| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.5 | Very low | 26.5 | Very low | 247 Ų | 247 | 155.8 Ų | 155.8 | 100% | 1.217 | 85% | 0.846 | S | S | * | * | 0 | 99.6 | 0 | -87.5 | 176.8 | 175.3 | 0 | 0 | 109 | |||||
| 2 | V | 26.5 | Very low | 26.6 | Very low | 146 Ų | 146 | 159.3 Ų | 159.3 | 89% | 0.885 | 85% | 0.848 | S | S | * | * | trans | -140.8 | 117.2 | 167.9 | 178.5 | 0 | 0 | 0 | 0 | 105.8 | K4 | V2-K4 PolarHBondContact O-N 3.46Š| ||
| 3 | R | 25.6 | Very low | 26.7 | Very low | 247 Ų | 247 | 152.5 Ų | 152.5 | 93% | 0.932 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 124.3 | -175.1 | -79.7 | 176.6 | 171.2 | 175.3 | -3.2 | 110 | ||
| 4 | K | 25.6 | Very low | 26.6 | Very low | 189 Ų | 189 | 146.9 Ų | 146.9 | 82% | 0.822 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 138 | 161.4 | -74 | 178 | 175.4 | 176.7 | 0 | 108.7 | V2 V6 | V2-K4 PolarHBondContact O-N 3.46Å; K4-V6 PolarHBondContact O-N 3.18Å |
| 5 | P | 24.4 | Very low | 26.8 | Very low | 120 Ų | 120 | 147.3 Ų | 147.3 | 78% | 0.779 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 117.3 | 164.7 | 28.2 | -26 | 0 | 0 | 0 | 107.7 | V7 | P5-V7 PolarHBondContact O-N 3.26Š|
| 6 | V | 26 | Very low | 27.2 | Very low | 135 Ų | 135 | 149 Ų | 149 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | trans | -71.3 | 104.6 | 170.4 | 175.8 | 0 | 0 | 0 | 0 | 106.5 | K4 S8 | K4-V6 PolarHBondContact O-N 3.18Å; V6-S8 PolarHBondContact O-N 2.91Å | ||
| 7 | V | 25.5 | Very low | 27.1 | Very low | 133 Ų | 133 | 152.3 Ų | 152.3 | 81% | 0.806 | 83% | 0.832 | S | S | * | * | trans | -69.7 | 108.9 | 162.1 | 177.3 | 0 | 0 | 0 | 0 | 105.5 | P5 T9 | P5-V7 PolarHBondContact O-N 3.26Å; V7-T9 PolarHBondContact O-N 3.32Å; V7-T9 VanDerWaalsContact O-N 3.16Å | ||
| 8 | S | 23.4 | Very low | 27.1 | Very low | 94 Ų | 94 | 147.5 Ų | 147.5 | 66% | 0.657 | 82% | 0.823 | S | S | * | * | trans | -53.3 | 119.2 | 172.4 | 49.7 | 0 | 0 | 0 | 0 | 108.7 | V6 I10 | V6-S8 PolarHBondContact O-N 2.91Å; S8-I10 PolarHBondContact O-N 3.41Å | ||
| 9 | T | 26.6 | Very low | 27.2 | Very low | 136 Ų | 136 | 148.1 Ų | 148.1 | 83% | 0.834 | 82% | 0.824 | S | S | * | * | trans | -39.7 | 123.9 | 160.5 | 22.7 | 0 | 0 | 0 | 0 | 109.2 | V7 S11 | V7-T9 PolarHBondContact O-N 3.32Å; V7-T9 VanDerWaalsContact O-N 3.16Å; T9-S11 PolarHBondContact O-N 3.43Å; T9-S11 VanDerWaalsContact O-N 3.15Å | ||
| 10 | I | 28.8 | Very low | 27.3 | Very low | 165 Ų | 165 | 147.1 Ų | 147.1 | 85% | 0.846 | 82% | 0.822 | S | S | * | * | trans | -42.3 | 120.2 | 174.9 | -69.3 | 166 | 0 | 0 | 0 | 108.3 | S8 K12 | S8-I10 PolarHBondContact O-N 3.41Å; I10-K12 PolarHBondContact O-N 3.35Å | ||
| 11 | S | 24.7 | Very low | 27.3 | Very low | 102 Ų | 102 | 147.8 Ų | 147.8 | 71% | 0.713 | 82% | 0.824 | S | S | * | * | trans | -45.3 | 126.5 | 170.6 | 176.6 | 0 | 0 | 0 | 0 | 108.8 | T9 G13 | T9-S11 PolarHBondContact O-N 3.43Å; T9-S11 VanDerWaalsContact O-N 3.15Å; S11-G13 PolarHBondContact O-N 3.23Å | ||
| 12 | K | 27.9 | Very low | 27 | Very low | 198 Ų | 198 | 146.6 Ų | 146.6 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | -41.9 | 127.2 | 160.7 | -72.4 | -178.2 | 174 | -176.1 | 0 | 107.9 | I10 G14 | I10-K12 PolarHBondContact O-N 3.35Å; K12-G14 PolarHBondContact O-N 3.34Å | ||
| 13 | G | 27.3 | Very low | 27.2 | Very low | 70 Ų | 70 | 151.9 Ų | 151.9 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | -54.1 | 114.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | S11 Y15 | S11-G13 PolarHBondContact O-N 3.23Å; G13-Y15 VanDerWaalsContact C-N 3.27Å; G13-Y15 PolarHBondContact O-N 3.32Å | ||
| 14 | G | 26 | Very low | 27.4 | Very low | 75 Ų | 75 | 147.7 Ų | 147.7 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -73.4 | 84.7 | 164.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | K12 | K12-G14 PolarHBondContact O-N 3.34Š| ||
| 15 | Y | 29.1 | Very low | 27.5 | Very low | 152 Ų | 152 | 143.8 Ų | 143.8 | 60% | 0.596 | 80% | 0.799 | S | S | * | * | trans | -132.7 | 121.2 | 157.8 | -83.4 | -90.2 | 0 | 0 | 0 | 107.7 | G13 R478 | G13-Y15 VanDerWaalsContact C-N 3.27Å; G13-Y15 PolarHBondContact O-N 3.32Å; Y15-R478 PolarHBondContact OH-NE 3.08Å; Y15-R478 PolarHBondContact OH-NH2 3.32Å | ||
| 16 | L | 33.4 | Very low | 28.2 | Very low | 175 Ų | 175 | 144 Ų | 144 | 92% | 0.916 | 80% | 0.803 | S | S | * | * | trans | 72.1 | 79.1 | 173.9 | -55.2 | 168.2 | 0 | 0 | 0 | 116.8 | ||||
| 17 | Q | 25.5 | Very low | 28.4 | Very low | 205 Ų | 205 | 145.4 Ų | 145.4 | 96% | 0.958 | 81% | 0.806 | S | S | * | * | trans | -118.5 | 79.9 | 149.3 | -120.1 | 170.7 | -0.9 | 0 | 0 | 108.7 | ||||
| 18 | G | 26.8 | Very low | 28.6 | Very low | 66 Ų | 66 | 142.4 Ų | 142.4 | 68% | 0.68 | 80% | 0.802 | S | S | * | * | trans | -76.9 | 124.8 | 164.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | V20 | G18-V20 PolarHBondContact O-N 2.88Å; G18-V20 VanDerWaalsContact O-N 3.16Å | ||
| 19 | N | 30 | Very low | 29.2 | Very low | 158 Ų | 158 | 146.2 Ų | 146.2 | 85% | 0.845 | 82% | 0.815 | S | S | * | * | trans | -51.2 | 112.4 | 172.7 | -104.8 | -20.3 | 0 | 0 | 0 | 111.5 | ||||
| 20 | V | 28.9 | Very low | 29.5 | Very low | 129 Ų | 129 | 149.2 Ų | 149.2 | 78% | 0.782 | 82% | 0.816 | S | S | * | * | trans | -132.9 | 75.4 | 160.7 | -172.4 | 0 | 0 | 0 | 0 | 108.7 | G18 R22 | G18-V20 PolarHBondContact O-N 2.88Å; G18-V20 VanDerWaalsContact O-N 3.16Å; V20-R22 PolarHBondContact O-N 3.2Å | ||
| 21 | N | 27.7 | Very low | 29.7 | Very low | 162 Ų | 162 | 150.1 Ų | 150.1 | 87% | 0.866 | 82% | 0.817 | S | S | * | * | trans | -83.6 | 86.3 | 160.5 | -98.3 | -19 | 0 | 0 | 0 | 108.4 | ||||
| 22 | R | 27.3 | Very low | 30.2 | Very low | 222 Ų | 222 | 150 Ų | 150 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | trans | -137.2 | 109.2 | 156.5 | -95.2 | -174 | 177 | 174.8 | -0.7 | 108.6 | V20 L24 | V20-R22 PolarHBondContact O-N 3.2Å; R22-L24 PolarHBondContact O-N 2.96Å | ||
| 23 | R | 31 | Very low | 30.5 | Very low | 257 Ų | 257 | 146.9 Ų | 146.9 | 97% | 0.97 | 81% | 0.814 | S | S | * | * | trans | -58.2 | 122.7 | 168.2 | -72.1 | 179.5 | -178.8 | -178.5 | -0.4 | 108.5 | ||||
| 24 | L | 29 | Very low | 31.2 | Very low | 159 Ų | 159 | 147.1 Ų | 147.1 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | -113.2 | 144.6 | 161.7 | -83.4 | 159.5 | 0 | 0 | 0 | 108.6 | R22 | R22-L24 PolarHBondContact O-N 2.96Š| ||
| 25 | P | 28.9 | Very low | 31.9 | Very low | 106 Ų | 106 | 151.1 Ų | 151.1 | 69% | 0.688 | 82% | 0.815 | S | S | * | * | trans | -69.5 | 146.4 | -170.5 | -11.9 | 27.4 | 0 | 0 | 0 | 112.2 | L27 | P25-L27 PolarHBondContact O-N 2.92Š| ||
| 26 | S | 38.2 | Very low | 32.6 | Very low | 124 Ų | 124 | 150.7 Ų | 150.7 | 87% | 0.867 | 82% | 0.818 | S | S | * | * | trans | -55.8 | 112.2 | 173.4 | 53.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 27 | L | 31.2 | Very low | 33.5 | Very low | 166 Ų | 166 | 149.6 Ų | 149.6 | 87% | 0.869 | 81% | 0.806 | S | S | * | * | trans | -116 | 113.5 | 166.9 | -90.2 | 153.1 | 0 | 0 | 0 | 108.6 | P25 | P25-L27 PolarHBondContact O-N 2.92Š| ||
| 28 | G | 28.9 | Very low | 34.8 | Very low | 70 Ų | 70 | 141.8 Ų | 141.8 | 72% | 0.722 | 77% | 0.772 | S | S | * | * | trans | 17.6 | 117.7 | 163.9 | 0 | 0 | 0 | 0 | 0 | 119.3 | K30 | G28-K30 PolarHBondContact O-N 3.11Š| ||
| 29 | N | 35.4 | Very low | 36.4 | Very low | 174 Ų | 174 | 142.7 Ų | 142.7 | 93% | 0.93 | 76% | 0.759 | S | S | * | * | trans | -49.6 | 98.9 | 158.4 | -79.6 | -12.9 | 0 | 0 | 0 | 111.1 | ||||
| 30 | K | 32.7 | Very low | 37.9 | Very low | 198 Ų | 198 | 137.9 Ų | 137.9 | 86% | 0.861 | 73% | 0.733 | S | S | * | * | trans | -127 | 103.2 | 148.5 | -79.2 | -173.4 | 176.1 | -180 | 0 | 106.2 | G28 | G28-K30 PolarHBondContact O-N 3.11Š| ||
| 31 | E | 33.8 | Very low | 39.7 | Very low | 184 Ų | 184 | 137.4 Ų | 137.4 | 86% | 0.86 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 127.6 | 165.9 | -70.1 | 179.8 | 159.9 | 0 | 0 | 108.1 | ||
| 32 | P | 34.4 | Very low | 41.8 | Very low | 100 Ų | 100 | 138.8 Ų | 138.8 | 65% | 0.649 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 135.5 | 173 | 24.7 | -30.2 | 0 | 0 | 0 | 109 | G34 | P32-G34 PolarHBondContact O-N 3.47Š|
| 33 | P | 35.7 | Very low | 44.2 | Very low | 133 Ų | 133 | 132.9 Ų | 132.9 | 86% | 0.864 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -68.9 | 118.4 | -178.8 | 27.2 | -32.2 | 0 | 0 | 0 | 110.3 | ||
| 34 | G | 42.3 | Very low | 46.5 | Very low | 75 Ų | 75 | 121 Ų | 121 | 77% | 0.773 | 65% | 0.65 | S | S | * | * | trans | 86.1 | 53 | 155.8 | 0 | 0 | 0 | 0 | 0 | 117.8 | P32 E36 | P32-G34 PolarHBondContact O-N 3.47Å; G34-E36 PolarHBondContact O-N 3.44Å | ||
| 35 | Q | 39.1 | Very low | 49.4 | Very low | 158 Ų | 158 | 115.8 Ų | 115.8 | 74% | 0.738 | 62% | 0.624 | S | S | * | * | trans | -78.8 | 93.6 | 149.4 | -91.9 | 175.3 | -38.3 | 0 | 0 | 108 | K37 | Q35-K37 PolarHBondContact O-N 3.31Š| ||
| 36 | E | 45 | Very low | 52.2 | Low | 144 Ų | 144 | 113.5 Ų | 113.5 | 67% | 0.673 | 61% | 0.606 | S | S | * | * | trans | -58.2 | 106.8 | 165.6 | -89.6 | -163.2 | 127.8 | 0 | 0 | 107.9 | G34 V38 K41 | G34-E36 PolarHBondContact O-N 3.44Å; E36-V38 PolarHBondContact O-N 3.21Å; E36-K41 IonicContact OE1-NZ 3.21Å; E36-K41 PolarHBondContact OE1-NZ 2.78Å | ||
| 37 | K | 51.2 | Low | 54.5 | Low | 151 Ų | 151 | 114 Ų | 114 | 66% | 0.657 | 60% | 0.598 | S | S | * | * | trans | -52.3 | 123.3 | 172.5 | -66.2 | -175.6 | 177.7 | -175.1 | 0 | 109.1 | Q35 Q39 | Q35-K37 PolarHBondContact O-N 3.31Å; K37-Q39 VanDerWaalsContact C-N 3.32Å; K37-Q39 HydrophobicContact CB-CG 4.3Å; K37-Q39 PolarHBondContact O-N 3.04Å | ||
| 38 | V | 53.4 | Low | 57 | Low | 41 Ų | 41 | 111.1 Ų | 111.1 | 25% | 0.248 | 58% | 0.576 | C | S | . | * | trans | -76.9 | 85.8 | -179.2 | -176 | 0 | 0 | 0 | 0 | 108.7 | E36 I358 | E36-V38 PolarHBondContact O-N 3.21Å; V38-I358 HydrophobicContact CG1-CD1 4.24Å | ||
| 39 | Q | 59.6 | Low | 59.8 | Low | 86 Ų | 86 | 107.8 Ų | 107.8 | 40% | 0.402 | 54% | 0.542 | S | S | . | . | trans | -123 | 153 | 178.7 | -66 | -176.4 | -1.1 | 0 | 0 | 111.8 | K37 K41 | K37-Q39 VanDerWaalsContact C-N 3.32Å; K37-Q39 HydrophobicContact CB-CG 4.3Å; K37-Q39 PolarHBondContact O-N 3.04Å; Q39-K41 PolarHBondContact O-N 3.18Å | ||
| 40 | L | 61.9 | Low | 62.3 | Low | 57 Ų | 57 | 100.7 Ų | 100.7 | 30% | 0.298 | 50% | 0.503 | S | S | . | . | trans | -66.5 | 114.2 | 172 | -69.8 | 169.3 | 0 | 0 | 0 | 110.1 | E258 Y343 | L40-E258 HydrophobicContact CB-CG 4.36Å; L40-Y343 HydrophobicContact CD1-CE1 4.13Å | ||
| 41 | K | 66.3 | Low | 64.8 | Low | 118 Ų | 118 | 91.8 Ų | 91.8 | 51% | 0.513 | 47% | 0.466 | S | S | . | . | trans | -75.1 | 133.1 | -178.3 | -64.2 | -175.2 | 177.8 | -176.8 | 0 | 110.4 | E36 Q39 K43 | E36-K41 IonicContact OE1-NZ 3.21Å; E36-K41 PolarHBondContact OE1-NZ 2.78Å; Q39-K41 PolarHBondContact O-N 3.18Å; K41-K43 HydrophobicContact CB-CD 4.04Å; K41-K43 HydrophobicContact CB-CG 4.03Å; K41-K43 PolarHBondContact O-N 2.65Å | ||
| 42 | R | 72.7 | Confident | 67.1 | Low | 191 Ų | 191 | 84.2 Ų | 84.2 | 72% | 0.721 | 43% | 0.431 | S | S | * | . | trans | -62.9 | 105.2 | 170.7 | -70.5 | -176.7 | -177.7 | 172.9 | 3.7 | 110.2 | E257 E258 | R42-E257 WeakPolarHBondContact CG-O 3.48Å; R42-E258 CarbonylContact C-O 3.3Å; R42-E258 WeakPolarHBondContact CA-O 3.28Å | ||
| 43 | K | 76.7 | Confident | 69.7 | Low | 98 Ų | 98 | 79.5 Ų | 79.5 | 43% | 0.426 | 40% | 0.4 | S | S | . | . | trans | -135.7 | -3.3 | -170.7 | -76.2 | -178.7 | 174.4 | 178.2 | 0 | 113.5 | K41 T45 R48 E258 | K41-K43 HydrophobicContact CB-CD 4.04Å; K41-K43 HydrophobicContact CB-CG 4.03Å; K41-K43 PolarHBondContact O-N 2.65Å; K43-T45 PolarHBondContact O-N 2.9Å; K43-R48 VanDerWaalsContact O-CD 3.26Å; K43-R48 WeakPolarHBondContact O-CD 3.42Å; K43-R48 PolarHBondContact O-NH1 3.32Å; K43-E258 PolarHBondContact N-O 3.01Å | ||
| 44 | V | 81.3 | Confident | 72.2 | Confident | 8 Ų | 8 | 73.4 Ų | 73.4 | 5% | 0.048 | 36% | 0.36 | C | S | . | . | B | Isolated β-bridge | trans | -93.7 | 95.9 | -178.3 | -176.3 | 0 | 0 | 0 | 0 | 109.1 | R48 I52 L252 E258 V259 E260 | V44-R48 HydrophobicContact CG1-CB 4.1Å; V44-I52 HydrophobicContact CG1-CD1 3.96Å; V44-I52 HydrophobicContact CG2-CD1 4.42Å; V44-L252 HydrophobicContact CG1-CD1 4.02Å; V44-E258 HydrophobicContact CG2-CB 4.03Å; V44-E258 PolarHBondContact N-O 2.94Å; V44-V259 HydrophobicContact CB-CG2 4.16Å; V44-V259 HydrophobicContact CG1-CG2 4.16Å; V44-E260 PolarHBondContact O-N 2.77Å |
| 45 | T | 88.9 | Confident | 74.1 | Confident | 49 Ų | 49 | 69.8 Ų | 69.8 | 30% | 0.301 | 32% | 0.324 | S | S | . | . | trans | -74.8 | 171 | 172.3 | 62.5 | 0 | 0 | 0 | 0 | 111.2 | K43 L47 R48 G49 | K43-T45 PolarHBondContact O-N 2.9Å; T45-L47 PolarHBondContact O-N 2.97Å; T45-R48 PolarHBondContact O-N 3.2Å; T45-R48 VanDerWaalsContact O-N 3.13Å; T45-R48 WeakPolarHBondContact OG1-CG 3.43Å; T45-G49 PolarHBondContact O-N 3.28Å | ||
| 46 | L | 88.8 | Confident | 76.2 | Confident | 58 Ų | 58 | 62.9 Ų | 62.9 | 30% | 0.304 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -53 | -49.2 | 177.3 | 178.5 | 66 | 0 | 0 | 0 | 113.6 | R48 G49 I50 T265 L268 A269 | L46-R48 VanDerWaalsContact C-N 3.3Å; L46-R48 PolarHBondContact O-N 3.16Å; L46-G49 PolarHBondContact O-N 3.15Å; L46-G49 VanDerWaalsContact O-N 3.13Å; L46-I50 HydrophobicContact CD1-CD1 4.15Å; L46-I50 HydrophobicContact CD1-CG1 4.38Å; L46-I50 HydrophobicContact CG-CD1 4Å; L46-I50 WeakPolarHBondContact O-CG1 3.18Å; L46-I50 PolarHBondContact O-N 3.22Å; L46-T265 HydrophobicContact CB-CG2 4.26Å; L46-T265 HydrophobicContact CD1-CG2 4.2Å; L46-L268 HydrophobicContact CD1-CB 4.04Å; L46-L268 HydrophobicContact CD1-CD2 3.91Å; L46-L268 HydrophobicContact CD1-CG 4.01Å; L46-L268 HydrophobicContact CD2-CD2 3.51Å; L46-L268 HydrophobicContact CD2-CG 4.34Å; L46-L268 HydrophobicContact CG-CD2 4.37Å; L46-A269 HydrophobicContact CD1-CB 4.04Å |
| 47 | L | 85.9 | Confident | 78.3 | Confident | 135 Ų | 135 | 56.2 Ų | 56.2 | 71% | 0.707 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -62.7 | -38.9 | 179.4 | -175.1 | 67 | 0 | 0 | 0 | 111.8 | T45 I50 S51 | T45-L47 PolarHBondContact O-N 2.97Å; L47-I50 PolarHBondContact O-N 2.93Å; L47-S51 WeakPolarHBondContact O-CB 3.45Å; L47-S51 PolarHBondContact O-N 3.14Å |
| 48 | R | 83.7 | Confident | 80 | Confident | 106 Ų | 106 | 49.2 Ų | 49.2 | 40% | 0.4 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.2 | -39.6 | 174.4 | -68.3 | -179.6 | -179.4 | -179.5 | 0.1 | 111.2 | K43 V44 T45 L46 S51 I52 I192 | K43-R48 VanDerWaalsContact O-CD 3.26Å; K43-R48 WeakPolarHBondContact O-CD 3.42Å; K43-R48 PolarHBondContact O-NH1 3.32Å; V44-R48 HydrophobicContact CG1-CB 4.1Å; T45-R48 PolarHBondContact O-N 3.2Å; T45-R48 VanDerWaalsContact O-N 3.13Å; T45-R48 WeakPolarHBondContact OG1-CG 3.43Å; L46-R48 VanDerWaalsContact C-N 3.3Å; L46-R48 PolarHBondContact O-N 3.16Å; R48-S51 PolarHBondContact O-N 3.5Å; R48-I52 WeakPolarHBondContact O-CB 3.48Å; R48-I52 VanDerWaalsContact O-CG1 3.23Å; R48-I52 WeakPolarHBondContact O-CG1 3.31Å; R48-I52 PolarHBondContact O-N 2.86Å; R48-I192 HydrophobicContact CG-CD1 4.34Å |
| 49 | G | 86.4 | Confident | 81.4 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61 | -48.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | T45 L46 S51 I52 I53 | T45-G49 PolarHBondContact O-N 3.28Å; L46-G49 PolarHBondContact O-N 3.15Å; L46-G49 VanDerWaalsContact O-N 3.13Å; G49-S51 VanDerWaalsContact C-N 3.32Å; G49-S51 PolarHBondContact O-N 2.62Å; G49-I52 PolarHBondContact O-N 2.87Å; G49-I53 WeakPolarHBondContact O-CG1 3.12Å; G49-I53 PolarHBondContact O-N 3.16Å |
| 50 | I | 88.8 | Confident | 82.3 | Confident | 25 Ų | 25 | 43.4 Ų | 43.4 | 13% | 0.128 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.9 | -44.9 | 174.9 | -68.1 | 167.6 | 0 | 0 | 0 | 110.5 | L46 L47 I53 I54 A269 I272 S273 | L46-I50 HydrophobicContact CD1-CD1 4.15Å; L46-I50 HydrophobicContact CD1-CG1 4.38Å; L46-I50 HydrophobicContact CG-CD1 4Å; L46-I50 WeakPolarHBondContact O-CG1 3.18Å; L46-I50 PolarHBondContact O-N 3.22Å; L47-I50 PolarHBondContact O-N 2.93Å; I50-I53 PolarHBondContact O-N 3.32Å; I50-I54 HydrophobicContact CG2-CD1 3.56Å; I50-I54 HydrophobicContact CG2-CG1 4.22Å; I50-I54 WeakPolarHBondContact O-CB 3.45Å; I50-I54 WeakPolarHBondContact O-CG1 3.38Å; I50-I54 PolarHBondContact O-N 3.17Å; I50-A269 HydrophobicContact CG1-CB 3.98Å; I50-I272 HydrophobicContact CD1-CB 4.39Å; I50-I272 HydrophobicContact CD1-CD1 4.06Å; I50-I272 HydrophobicContact CD1-CG2 4.11Å; I50-S273 PolarHBondContact O-OG 2.87Å |
| 51 | S | 84.5 | Confident | 83.5 | Confident | 11 Ų | 11 | 41 Ų | 41 | 8% | 0.077 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65 | -38.6 | 178.3 | 171.6 | 0 | 0 | 0 | 0 | 112.9 | L47 R48 G49 G55 T195 | L47-S51 WeakPolarHBondContact O-CB 3.45Å; L47-S51 PolarHBondContact O-N 3.14Å; R48-S51 PolarHBondContact O-N 3.5Å; G49-S51 VanDerWaalsContact C-N 3.32Å; G49-S51 PolarHBondContact O-N 2.62Å; S51-G55 VanDerWaalsContact O-CA 3.28Å; S51-G55 WeakPolarHBondContact O-CA 3.29Å; S51-G55 PolarHBondContact O-N 3.42Å; S51-T195 PolarHBondContact O-OG1 3.24Å; S51-T195 PolarHBondContact OG-OG1 3.19Å |
| 52 | I | 83.1 | Confident | 84.7 | Confident | 25 Ų | 25 | 35.3 Ų | 35.3 | 13% | 0.128 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.9 | -45.8 | 174.9 | -71.4 | 164.5 | 0 | 0 | 0 | 110 | V44 R48 G49 T56 | V44-I52 HydrophobicContact CG1-CD1 3.96Å; V44-I52 HydrophobicContact CG2-CD1 4.42Å; R48-I52 WeakPolarHBondContact O-CB 3.48Å; R48-I52 VanDerWaalsContact O-CG1 3.23Å; R48-I52 WeakPolarHBondContact O-CG1 3.31Å; R48-I52 PolarHBondContact O-N 2.86Å; G49-I52 PolarHBondContact O-N 2.87Å; I52-T56 WeakPolarHBondContact O-CB 3.34Å; I52-T56 VanDerWaalsContact O-CG2 3.23Å; I52-T56 WeakPolarHBondContact O-CG2 3.17Å; I52-T56 PolarHBondContact O-N 3.26Å; I52-T56 PolarHBondContact O-OG1 2.82Å |
| 53 | I | 88.1 | Confident | 85.3 | Confident | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.7 | -54.3 | -179.2 | -65 | 170.9 | 0 | 0 | 0 | 110.8 | G49 I50 G55 T56 I57 L252 A269 I270 | G49-I53 WeakPolarHBondContact O-CG1 3.12Å; G49-I53 PolarHBondContact O-N 3.16Å; I50-I53 PolarHBondContact O-N 3.32Å; I53-G55 VanDerWaalsContact C-N 3.31Å; I53-G55 PolarHBondContact O-N 2.92Å; I53-T56 PolarHBondContact O-N 3.44Å; I53-T56 VanDerWaalsContact O-N 3.17Å; I53-T56 PolarHBondContact O-OG1 2.71Å; I53-I57 HydrophobicContact CG2-CD1 3.47Å; I53-I57 VanDerWaalsContact CG2-CD1 3.47Å; I53-I57 HydrophobicContact CG2-CG1 4.26Å; I53-I57 WeakPolarHBondContact O-CG1 3.22Å; I53-I57 PolarHBondContact O-N 3.32Å; I53-L252 HydrophobicContact CD1-CB 4.04Å; I53-L252 HydrophobicContact CD1-CD2 3.84Å; I53-L252 HydrophobicContact CG1-CB 4.04Å; I53-A269 HydrophobicContact CD1-CB 3.92Å; I53-I270 HydrophobicContact CD1-CG1 3.72Å |
| 54 | I | 88.8 | Confident | 85.7 | Confident | 5 Ų | 5 | 23.5 Ų | 23.5 | 3% | 0.026 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60 | -45.6 | 178.7 | -67.8 | 178.6 | 0 | 0 | 0 | 110.2 | I50 T56 I57 I58 T195 L199 I276 | I50-I54 HydrophobicContact CG2-CD1 3.56Å; I50-I54 HydrophobicContact CG2-CG1 4.22Å; I50-I54 WeakPolarHBondContact O-CB 3.45Å; I50-I54 WeakPolarHBondContact O-CG1 3.38Å; I50-I54 PolarHBondContact O-N 3.17Å; I54-T56 PolarHBondContact O-N 3.4Å; I54-I57 PolarHBondContact O-N 3.1Å; I54-I58 HydrophobicContact CG2-CD1 3.58Å; I54-I58 HydrophobicContact CG2-CG1 4.09Å; I54-I58 VanDerWaalsContact O-CB 3.31Å; I54-I58 WeakPolarHBondContact O-CB 3.24Å; I54-I58 PolarHBondContact O-N 3.45Å; I54-T195 HydrophobicContact CB-CG2 4.23Å; I54-T195 HydrophobicContact CG2-CG2 3.92Å; I54-L199 HydrophobicContact CG2-CD2 3.96Å; I54-L199 HydrophobicContact CG2-CG 4.41Å; I54-I276 HydrophobicContact CD1-CB 4.45Å; I54-I276 HydrophobicContact CD1-CD1 3.99Å; I54-I276 HydrophobicContact CD1-CG2 4.19Å |
| 55 | G | 82.8 | Confident | 86.2 | Confident | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -69.6 | -10.8 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | S51 I53 Q191 K198 | S51-G55 VanDerWaalsContact O-CA 3.28Å; S51-G55 WeakPolarHBondContact O-CA 3.29Å; S51-G55 PolarHBondContact O-N 3.42Å; I53-G55 VanDerWaalsContact C-N 3.31Å; I53-G55 PolarHBondContact O-N 2.92Å; G55-Q191 PolarHBondContact O-NE2 2.97Å; G55-K198 PolarHBondContact O-NZ 3.06Å |
| 56 | T | 82.7 | Confident | 86.4 | Confident | 12 Ų | 12 | 20.9 Ų | 20.9 | 7% | 0.074 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -103.1 | -35.7 | 172.9 | 49.6 | 0 | 0 | 0 | 0 | 112.6 | I52 I53 I54 Y251 | I52-T56 WeakPolarHBondContact O-CB 3.34Å; I52-T56 VanDerWaalsContact O-CG2 3.23Å; I52-T56 WeakPolarHBondContact O-CG2 3.17Å; I52-T56 PolarHBondContact O-N 3.26Å; I52-T56 PolarHBondContact O-OG1 2.82Å; I53-T56 PolarHBondContact O-N 3.44Å; I53-T56 VanDerWaalsContact O-N 3.17Å; I53-T56 PolarHBondContact O-OG1 2.71Å; I54-T56 PolarHBondContact O-N 3.4Å; T56-Y251 HydrophobicContact CG2-CD2 3.66Å; T56-Y251 HydrophobicContact CG2-CE2 4.1Å; T56-Y251 HydrophobicContact CG2-CG 4.11Å; T56-Y251 WeakPolarHBondContact OG1-CD2 3.26Å |
| 57 | I | 89.3 | Confident | 86.5 | Confident | 5 Ų | 5 | 20.9 Ų | 20.9 | 3% | 0.026 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -72.5 | -52.3 | 176.1 | -60 | 168.1 | 0 | 0 | 0 | 110.9 | I53 I54 G59 W249 M274 V277 Y281 | I53-I57 HydrophobicContact CG2-CD1 3.47Å; I53-I57 VanDerWaalsContact CG2-CD1 3.47Å; I53-I57 HydrophobicContact CG2-CG1 4.26Å; I53-I57 WeakPolarHBondContact O-CG1 3.22Å; I53-I57 PolarHBondContact O-N 3.32Å; I54-I57 PolarHBondContact O-N 3.1Å; I57-G59 PolarHBondContact O-N 3.09Å; I57-W249 HydrophobicContact CD1-CB 3.85Å; I57-M274 HydrophobicContact CD1-SD 3.74Å; I57-V277 HydrophobicContact CB-CG2 4.29Å; I57-V277 HydrophobicContact CD1-CG2 4.29Å; I57-V277 HydrophobicContact CG2-CB 4.49Å; I57-V277 HydrophobicContact CG2-CG1 3.64Å; I57-V277 HydrophobicContact CG2-CG2 4.13Å; I57-Y281 HydrophobicContact CG2-CE2 4.49Å; I57-Y281 PolarHBondContact O-OH 3.43Å |
| 58 | I | 87.1 | Confident | 86.7 | Confident | 3 Ų | 3 | 14.7 Ų | 14.7 | 2% | 0.015 | 7% | 0.072 | C | C | . | . | S | Bend | trans | -74 | 101.4 | 179.4 | -56.1 | -173.2 | 0 | 0 | 0 | 107.9 | I54 K198 L199 I202 V277 Y281 S330 | I54-I58 HydrophobicContact CG2-CD1 3.58Å; I54-I58 HydrophobicContact CG2-CG1 4.09Å; I54-I58 VanDerWaalsContact O-CB 3.31Å; I54-I58 WeakPolarHBondContact O-CB 3.24Å; I54-I58 PolarHBondContact O-N 3.45Å; I58-K198 HydrophobicContact CG2-CB 4.14Å; I58-K198 WeakPolarHBondContact O-CD 3.42Å; I58-K198 PolarHBondContact O-NZ 3.33Å; I58-L199 HydrophobicContact CD1-CD2 4.08Å; I58-I202 HydrophobicContact CB-CD1 4.49Å; I58-I202 HydrophobicContact CD1-CD1 3.65Å; I58-I202 HydrophobicContact CG1-CD1 4.3Å; I58-I202 HydrophobicContact CG2-CD1 3.47Å; I58-I202 VanDerWaalsContact CG2-CD1 3.47Å; I58-I202 HydrophobicContact CG2-CG1 4.44Å; I58-V277 HydrophobicContact CD1-CG2 4.05Å; I58-V277 HydrophobicContact CG1-CG2 3.86Å; I58-Y281 WeakPolarHBondContact CA-OH 3.41Å; I58-Y281 HydrophobicContact CG1-CE1 4.1Å; I58-S330 PolarHBondContact O-OG 3.06Å |
| 59 | G | 81.7 | Confident | 87.1 | Confident | 3 Ų | 3 | 9.7 Ų | 9.7 | 3% | 0.031 | 5% | 0.053 | C | C | . | . | S | Bend | trans | -150.2 | -142.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | I57 G61 F63 S330 | I57-G59 PolarHBondContact O-N 3.09Å; G59-G61 PolarHBondContact O-N 3.02Å; G59-F63 WeakPolarHBondContact O-CD2 3.2Å; G59-F63 WeakPolarHBondContact O-CE2 3.45Å; G59-S330 WeakPolarHBondContact CA-OG 3.2Å |
| 60 | A | 78.5 | Confident | 87.5 | Confident | 2 Ų | 2 | 9.9 Ų | 9.9 | 2% | 0.017 | 5% | 0.054 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -28.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | I62 F63 I64 A145 | A60-I62 PolarHBondContact O-N 3.35Å; A60-F63 PolarHBondContact O-N 2.68Å; A60-I64 HydrophobicContact CB-CD1 3.88Å; A60-I64 WeakPolarHBondContact O-CG1 3.32Å; A60-I64 PolarHBondContact O-N 3.18Å; A60-I64 VanDerWaalsContact O-N 3.08Å; A60-A145 HydrophobicContact CB-CB 3.52Å |
| 61 | G | 87.2 | Confident | 87.6 | Confident | 6 Ų | 6 | 14 Ų | 14 | 6% | 0.062 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -56.6 | -46.7 | -173 | 0 | 0 | 0 | 0 | 0 | 114.9 | G59 F63 I64 S65 | G59-G61 PolarHBondContact O-N 3.02Å; G61-F63 PolarHBondContact O-N 2.79Å; G61-I64 PolarHBondContact O-N 2.82Å; G61-S65 WeakPolarHBondContact O-CB 3.46Å; G61-S65 PolarHBondContact O-N 3Å; G61-S65 PolarHBondContact O-OG 3.04Å; G61-S65 VanDerWaalsContact O-OG 3.08Å |
| 62 | I | 91.7 | Very high | 87.8 | Confident | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -67.6 | -18.8 | 179.5 | -170.6 | 53.9 | 0 | 0 | 0 | 113.5 | A60 P66 W83 Y281 T284 | A60-I62 PolarHBondContact O-N 3.35Å; I62-P66 WeakPolarHBondContact O-CD 3.42Å; I62-P66 WeakPolarHBondContact O-CG 3.44Å; I62-W83 HydrophobicContact CD1-CH2 3.5Å; I62-W83 HydrophobicContact CD1-CZ2 4.07Å; I62-W83 HydrophobicContact CD1-CZ3 3.77Å; I62-Y281 HydrophobicContact CB-CD1 3.96Å; I62-Y281 HydrophobicContact CB-CE1 3.57Å; I62-Y281 HydrophobicContact CD1-CD1 3.62Å; I62-Y281 HydrophobicContact CD1-CD2 4.21Å; I62-Y281 HydrophobicContact CD1-CE1 4.15Å; I62-Y281 HydrophobicContact CD1-CG 3.64Å; I62-Y281 HydrophobicContact CG1-CD1 3.61Å; I62-Y281 HydrophobicContact CG1-CE1 3.77Å; I62-Y281 HydrophobicContact CG1-CG 4.17Å; I62-Y281 HydrophobicContact CG2-CE1 4.04Å; I62-T284 HydrophobicContact CD1-CG2 4.28Å; I62-T284 HydrophobicContact CG1-CG2 4.04Å |
| 63 | F | 86.5 | Confident | 88.2 | Confident | 3 Ų | 3 | 13.7 Ų | 13.7 | 1% | 0.013 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -97.3 | -14.8 | -179.6 | -53.3 | -63.9 | 0 | 0 | 0 | 113.1 | G59 A60 G61 Y149 I205 A304 V323 | G59-F63 WeakPolarHBondContact O-CD2 3.2Å; G59-F63 WeakPolarHBondContact O-CE2 3.45Å; A60-F63 PolarHBondContact O-N 2.68Å; G61-F63 PolarHBondContact O-N 2.79Å; F63-Y149 HydrophobicContact CB-CE2 4.16Å; F63-Y149 WeakPolarHBondContact CB-OH 3.39Å; F63-Y149 PolarHBondContact O-OH 3.17Å; F63-I205 HydrophobicContact CE1-CD1 3.99Å; F63-A304 HydrophobicContact CD1-CB 3.83Å; F63-A304 HydrophobicContact CE1-CB 4.28Å; F63-V323 HydrophobicContact CB-CG1 4.27Å; F63-V323 HydrophobicContact CD1-CG1 4.29Å; F63-V323 HydrophobicContact CD1-CG2 3.93Å; F63-V323 HydrophobicContact CD2-CB 4.44Å; F63-V323 HydrophobicContact CD2-CG1 3.47Å; F63-V323 VanDerWaalsContact CD2-CG1 3.47Å; F63-V323 HydrophobicContact CD2-CG2 4.3Å; F63-V323 HydrophobicContact CE1-CG2 3.66Å; F63-V323 HydrophobicContact CE2-CB 4.32Å; F63-V323 HydrophobicContact CE2-CG1 3.78Å; F63-V323 HydrophobicContact CE2-CG2 4.05Å; F63-V323 HydrophobicContact CG-CG1 3.75Å; F63-V323 HydrophobicContact CG-CG2 4.24Å; F63-V323 HydrophobicContact CZ-CB 4.46Å; F63-V323 HydrophobicContact CZ-CG1 4.32Å; F63-V323 HydrophobicContact CZ-CG2 3.73Å |
| 64 | I | 84.4 | Confident | 88.2 | Confident | 38 Ų | 38 | 15.2 Ų | 15.2 | 20% | 0.195 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -105.6 | -47.4 | 179.1 | -63.6 | 171.5 | 0 | 0 | 0 | 110.8 | A60 G61 A145 L385 | A60-I64 HydrophobicContact CB-CD1 3.88Å; A60-I64 WeakPolarHBondContact O-CG1 3.32Å; A60-I64 PolarHBondContact O-N 3.18Å; A60-I64 VanDerWaalsContact O-N 3.08Å; G61-I64 PolarHBondContact O-N 2.82Å; I64-A145 HydrophobicContact CD1-CB 4.02Å; I64-L385 HydrophobicContact CD1-CD1 4.34Å |
| 65 | S | 91.3 | Very high | 88.3 | Confident | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -62.6 | -30.1 | -172 | -65.2 | 0 | 0 | 0 | 0 | 116.4 | G61 K67 G68 V69 Y241 | G61-S65 WeakPolarHBondContact O-CB 3.46Å; G61-S65 PolarHBondContact O-N 3Å; G61-S65 PolarHBondContact O-OG 3.04Å; G61-S65 VanDerWaalsContact O-OG 3.08Å; S65-K67 VanDerWaalsContact C-N 3.28Å; S65-K67 PolarHBondContact O-N 3.49Å; S65-G68 PolarHBondContact O-N 2.98Å; S65-G68 VanDerWaalsContact O-N 3.14Å; S65-V69 WeakPolarHBondContact O-CG2 3.43Å; S65-V69 PolarHBondContact O-N 3.31Å; S65-Y241 VanDerWaalsContact CB-O 3.29Å; S65-Y241 WeakPolarHBondContact CB-O 3.49Å; S65-Y241 PolarHBondContact OG-O 3.36Å |
| 66 | P | 93.6 | Very high | 88.8 | Confident | 2 Ų | 2 | 15.8 Ų | 15.8 | 1% | 0.013 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -53.6 | -42.9 | -178.6 | -29.2 | 35.6 | 0 | 0 | 0 | 113.7 | I62 V69 L70 W83 Y288 L297 | I62-P66 WeakPolarHBondContact O-CD 3.42Å; I62-P66 WeakPolarHBondContact O-CG 3.44Å; P66-V69 PolarHBondContact O-N 3.32Å; P66-L70 WeakPolarHBondContact O-CB 3.29Å; P66-L70 PolarHBondContact O-N 3.03Å; P66-W83 HydrophobicContact CG-CZ2 4.02Å; P66-Y288 HydrophobicContact CB-CD2 4.41Å; P66-Y288 HydrophobicContact CB-CE2 4.42Å; P66-Y288 HydrophobicContact CG-CD2 4.37Å; P66-Y288 HydrophobicContact CG-CE2 3.95Å; P66-L297 HydrophobicContact CB-CD2 4.49Å |
| 67 | K | 91.4 | Very high | 89.3 | Confident | 58 Ų | 58 | 15.5 Ų | 15.5 | 25% | 0.252 | 9% | 0.089 | S | C | . | . | H | α-helix | trans | -61.6 | -50.5 | 176.7 | 176.1 | 170.2 | 177.6 | 163.1 | 0 | 111.6 | S65 V69 L70 Q71 L297 L298 S300 | S65-K67 VanDerWaalsContact C-N 3.28Å; S65-K67 PolarHBondContact O-N 3.49Å; K67-V69 PolarHBondContact O-N 3.08Å; K67-L70 PolarHBondContact O-N 3.05Å; K67-Q71 VanDerWaalsContact O-CB 3.25Å; K67-Q71 WeakPolarHBondContact O-CB 3.38Å; K67-Q71 PolarHBondContact O-N 3.22Å; K67-L297 HydrophobicContact CB-CD2 4.22Å; K67-L298 WeakPolarHBondContact CE-O 3.29Å; K67-L298 HydrophobicContact CG-CD2 4.46Å; K67-L298 PolarHBondContact NZ-O 3.37Å; K67-S300 WeakPolarHBondContact CD-O 3.25Å; K67-S300 PolarHBondContact NZ-O 3.06Å |
| 68 | G | 89.1 | Confident | 89.5 | Confident | 5 Ų | 5 | 17.9 Ų | 17.9 | 5% | 0.052 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63 | -39.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | S65 N72 | S65-G68 PolarHBondContact O-N 2.98Å; S65-G68 VanDerWaalsContact O-N 3.14Å; G68-N72 WeakPolarHBondContact O-CB 3.23Å; G68-N72 PolarHBondContact O-N 2.65Å; G68-N72 PolarHBondContact O-ND2 2.97Å |
| 69 | V | 93.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -66.3 | -47.3 | 176.3 | 176.9 | 0 | 0 | 0 | 0 | 110.5 | S65 P66 K67 N72 T73 I82 W83 A238 | S65-V69 WeakPolarHBondContact O-CG2 3.43Å; S65-V69 PolarHBondContact O-N 3.31Å; P66-V69 PolarHBondContact O-N 3.32Å; K67-V69 PolarHBondContact O-N 3.08Å; V69-N72 PolarHBondContact O-N 3.46Å; V69-T73 HydrophobicContact CG1-CG2 4.37Å; V69-T73 WeakPolarHBondContact O-CB 3.38Å; V69-T73 WeakPolarHBondContact O-CG2 3.4Å; V69-T73 PolarHBondContact O-N 2.99Å; V69-T73 PolarHBondContact O-OG1 3.15Å; V69-I82 HydrophobicContact CG1-CB 4.3Å; V69-I82 HydrophobicContact CG1-CG2 4.18Å; V69-W83 HydrophobicContact CG2-CZ2 4.43Å; V69-A238 HydrophobicContact CG1-CB 4.46Å |
| 70 | L | 93 | Very high | 90.5 | Very high | 4 Ų | 4 | 19 Ų | 19 | 2% | 0.021 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -65.2 | -42.8 | -179.5 | -175.1 | 61.6 | 0 | 0 | 0 | 112 | P66 K67 N72 T73 G74 F289 A294 L297 L298 | P66-L70 WeakPolarHBondContact O-CB 3.29Å; P66-L70 PolarHBondContact O-N 3.03Å; K67-L70 PolarHBondContact O-N 3.05Å; L70-N72 PolarHBondContact O-N 3.33Å; L70-T73 WeakPolarHBondContact CA-OG1 3.3Å; L70-T73 PolarHBondContact O-N 3.28Å; L70-T73 PolarHBondContact O-OG1 3.4Å; L70-G74 PolarHBondContact O-N 3.34Å; L70-F289 HydrophobicContact CD1-CE1 4.22Å; L70-F289 HydrophobicContact CD1-CZ 4.08Å; L70-F289 HydrophobicContact CD2-CE1 3.82Å; L70-F289 HydrophobicContact CD2-CZ 4.18Å; L70-A294 HydrophobicContact CD2-CB 3.99Å; L70-L297 HydrophobicContact CB-CD2 4.34Å; L70-L297 HydrophobicContact CD2-CB 4.17Å; L70-L297 HydrophobicContact CD2-CD1 4.23Å; L70-L297 HydrophobicContact CD2-CD2 3.81Å; L70-L297 HydrophobicContact CD2-CG 4.28Å; L70-L298 HydrophobicContact CB-CD2 4.19Å; L70-L298 HydrophobicContact CD2-CD2 4.23Å; L70-L298 HydrophobicContact CD2-CG 4.15Å; L70-L298 HydrophobicContact CG-CD2 4.19Å; L70-L298 HydrophobicContact CG-CG 4.47Å |
| 71 | Q | 91.1 | Very high | 91.3 | Very high | 112 Ų | 112 | 21.7 Ų | 21.7 | 52% | 0.523 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -59.2 | -36.8 | 179.3 | -174.3 | 175.6 | -7.5 | 0 | 0 | 112.4 | K67 L298 | K67-Q71 VanDerWaalsContact O-CB 3.25Å; K67-Q71 WeakPolarHBondContact O-CB 3.38Å; K67-Q71 PolarHBondContact O-N 3.22Å; Q71-L298 HydrophobicContact CB-CD2 3.74Å; Q71-L298 HydrophobicContact CG-CD2 4.49Å |
| 72 | N | 89.2 | Confident | 91.7 | Very high | 24 Ų | 24 | 21.5 Ų | 21.5 | 13% | 0.128 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -90.6 | -18.9 | -177.2 | -73.1 | -68.4 | 0 | 0 | 0 | 113.7 | G68 V69 L70 R234 L237 A238 | G68-N72 WeakPolarHBondContact O-CB 3.23Å; G68-N72 PolarHBondContact O-N 2.65Å; G68-N72 PolarHBondContact O-ND2 2.97Å; V69-N72 PolarHBondContact O-N 3.46Å; L70-N72 PolarHBondContact O-N 3.33Å; N72-R234 WeakPolarHBondContact O-CB 3.49Å; N72-L237 HydrophobicContact CB-CB 4.2Å; N72-L237 WeakPolarHBondContact OD1-CB 3.44Å; N72-A238 HydrophobicContact CB-CB 3.79Å |
| 73 | T | 90.9 | Very high | 92 | Very high | 6 Ų | 6 | 21.5 Ų | 21.5 | 4% | 0.037 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -91.6 | -30.5 | 174.6 | 47.6 | 0 | 0 | 0 | 0 | 113.6 | V69 L70 S75 M78 S79 I82 A238 | V69-T73 HydrophobicContact CG1-CG2 4.37Å; V69-T73 WeakPolarHBondContact O-CB 3.38Å; V69-T73 WeakPolarHBondContact O-CG2 3.4Å; V69-T73 PolarHBondContact O-N 2.99Å; V69-T73 PolarHBondContact O-OG1 3.15Å; L70-T73 WeakPolarHBondContact CA-OG1 3.3Å; L70-T73 PolarHBondContact O-N 3.28Å; L70-T73 PolarHBondContact O-OG1 3.4Å; T73-S75 PolarHBondContact O-N 3.1Å; T73-S75 VanDerWaalsContact O-N 3.13Å; T73-S75 PolarHBondContact OG1-O 2.9Å; T73-M78 HydrophobicContact CG2-CB 4.34Å; T73-M78 HydrophobicContact CG2-CG 3.97Å; T73-S79 WeakPolarHBondContact OG1-CB 3.44Å; T73-I82 HydrophobicContact CG2-CD1 3.18Å; T73-I82 HydrophobicContact CG2-CG1 4.21Å; T73-A238 HydrophobicContact CG2-CB 3.71Å |
| 74 | G | 88.9 | Confident | 92.5 | Very high | 31 Ų | 31 | 24.4 Ų | 24.4 | 32% | 0.32 | 14% | 0.138 | S | C | . | . | trans | 70.6 | -1.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | L70 G227 | L70-G74 PolarHBondContact O-N 3.34Å; G74-G227 WeakPolarHBondContact O-CA 3.23Å | ||
| 75 | S | 91.3 | Very high | 93.1 | Very high | 4 Ų | 4 | 25.2 Ų | 25.2 | 3% | 0.028 | 15% | 0.145 | C | C | . | . | S | Bend | trans | -144.8 | 140.9 | -174.3 | 148.9 | 0 | 0 | 0 | 0 | 111 | T73 G77 M78 S79 A224 F225 | T73-S75 PolarHBondContact O-N 3.1Å; T73-S75 VanDerWaalsContact O-N 3.13Å; T73-S75 PolarHBondContact OG1-O 2.9Å; S75-G77 PolarHBondContact OG-N 3.05Å; S75-M78 PolarHBondContact OG-N 3.41Å; S75-S79 WeakPolarHBondContact O-CB 3.23Å; S75-S79 PolarHBondContact O-N 2.85Å; S75-A224 PolarHBondContact OG-O 3.42Å; S75-F225 WeakPolarHBondContact OG-CA 3.37Å |
| 76 | V | 92.6 | Very high | 93.3 | Very high | 13 Ų | 13 | 25.2 Ų | 25.2 | 8% | 0.079 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62.4 | -50.2 | 177.7 | 176 | 0 | 0 | 0 | 0 | 111.2 | M78 S79 L80 F221 A224 F289 A294 | V76-M78 PolarHBondContact O-N 3.44Å; V76-S79 WeakPolarHBondContact O-CB 3.42Å; V76-S79 PolarHBondContact O-N 2.75Å; V76-S79 PolarHBondContact O-OG 3.36Å; V76-L80 HydrophobicContact CG1-CD1 4.44Å; V76-L80 PolarHBondContact O-N 3.15Å; V76-L80 VanDerWaalsContact O-N 3.09Å; V76-F221 HydrophobicContact CG1-CD1 4.43Å; V76-F221 HydrophobicContact CG1-CE1 4.34Å; V76-A224 PolarHBondContact N-O 3.45Å; V76-F289 HydrophobicContact CB-CE1 4.49Å; V76-F289 HydrophobicContact CG1-CB 4.14Å; V76-F289 HydrophobicContact CG1-CD1 3.93Å; V76-F289 HydrophobicContact CG1-CD2 3.57Å; V76-F289 HydrophobicContact CG1-CE1 4.19Å; V76-F289 HydrophobicContact CG1-CE2 3.86Å; V76-F289 HydrophobicContact CG1-CG 3.61Å; V76-F289 HydrophobicContact CG1-CZ 4.16Å; V76-F289 HydrophobicContact CG2-CD1 3.9Å; V76-F289 HydrophobicContact CG2-CE1 3.85Å; V76-F289 HydrophobicContact CG2-CG 4.43Å; V76-F289 HydrophobicContact CG2-CZ 4.36Å; V76-A294 HydrophobicContact CG2-CB 4.38Å |
| 77 | G | 93.2 | Very high | 93.5 | Very high | 6 Ų | 6 | 25.1 Ų | 25.1 | 6% | 0.062 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.3 | -40.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | S75 L80 T81 A224 F225 | S75-G77 PolarHBondContact OG-N 3.05Å; G77-L80 PolarHBondContact O-N 2.86Å; G77-T81 PolarHBondContact O-N 3.24Å; G77-T81 VanDerWaalsContact O-N 3.09Å; G77-T81 PolarHBondContact O-OG1 3.46Å; G77-A224 PolarHBondContact N-O 2.96Å; G77-F225 VanDerWaalsContact C-CE1 3.48Å |
| 78 | M | 92.9 | Very high | 93.7 | Very high | 56 Ų | 56 | 25.4 Ų | 25.4 | 28% | 0.276 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -68.6 | -38.2 | 175.7 | -166.6 | 62.8 | -178.1 | 0 | 0 | 111.8 | T73 S75 V76 L80 T81 I82 L235 | T73-M78 HydrophobicContact CG2-CB 4.34Å; T73-M78 HydrophobicContact CG2-CG 3.97Å; S75-M78 PolarHBondContact OG-N 3.41Å; V76-M78 PolarHBondContact O-N 3.44Å; M78-L80 PolarHBondContact O-N 2.81Å; M78-T81 WeakPolarHBondContact O-CB 3.28Å; M78-T81 PolarHBondContact O-N 3.48Å; M78-I82 WeakPolarHBondContact O-CG1 3.28Å; M78-I82 PolarHBondContact O-N 2.8Å; M78-L235 HydrophobicContact CE-CD1 3.4Å; M78-L235 HydrophobicContact CE-CD2 4.01Å; M78-L235 HydrophobicContact CE-CG 4.37Å; M78-L235 HydrophobicContact CG-CD1 4.45Å |
| 79 | S | 94.6 | Very high | 94.1 | Very high | 2 Ų | 2 | 26.1 Ų | 26.1 | 1% | 0.014 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.9 | -45.2 | 175.5 | 81 | 0 | 0 | 0 | 0 | 112.2 | T73 S75 V76 I82 W83 F289 | T73-S79 WeakPolarHBondContact OG1-CB 3.44Å; S75-S79 WeakPolarHBondContact O-CB 3.23Å; S75-S79 PolarHBondContact O-N 2.85Å; V76-S79 WeakPolarHBondContact O-CB 3.42Å; V76-S79 PolarHBondContact O-N 2.75Å; V76-S79 PolarHBondContact O-OG 3.36Å; S79-I82 PolarHBondContact O-N 3.34Å; S79-W83 PolarHBondContact O-N 3.3Å; S79-W83 VanDerWaalsContact O-N 3.1Å; S79-F289 WeakPolarHBondContact OG-CE2 3.23Å |
| 80 | L | 95.9 | Very high | 94.2 | Very high | 26 Ų | 26 | 26.1 Ų | 26.1 | 14% | 0.136 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65.4 | -40 | 177.8 | -67.8 | 175.4 | 0 | 0 | 0 | 111.8 | V76 G77 M78 I82 W83 T84 F221 N285 V286 F289 | V76-L80 HydrophobicContact CG1-CD1 4.44Å; V76-L80 PolarHBondContact O-N 3.15Å; V76-L80 VanDerWaalsContact O-N 3.09Å; G77-L80 PolarHBondContact O-N 2.86Å; M78-L80 PolarHBondContact O-N 2.81Å; L80-I82 VanDerWaalsContact C-N 3.3Å; L80-I82 PolarHBondContact O-N 2.83Å; L80-W83 PolarHBondContact O-N 2.87Å; L80-T84 PolarHBondContact O-N 3.49Å; L80-T84 PolarHBondContact O-OG1 2.95Å; L80-F221 HydrophobicContact CD1-CE1 3.99Å; L80-N285 HydrophobicContact CD2-CB 3.61Å; L80-V286 HydrophobicContact CD1-CG2 4.11Å; L80-V286 HydrophobicContact CD2-CG2 4.01Å; L80-F289 HydrophobicContact CD2-CD2 4.28Å; L80-F289 HydrophobicContact CD2-CE2 4.22Å; L80-F289 HydrophobicContact CG-CD2 4.49Å; L80-F289 HydrophobicContact CG-CE2 4.38Å |
| 81 | T | 95.9 | Very high | 94.4 | Very high | 59 Ų | 59 | 28.5 Ų | 28.5 | 36% | 0.362 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -58 | -44.2 | 174.7 | -57.1 | 0 | 0 | 0 | 0 | 110.8 | G77 M78 W83 T84 V85 | G77-T81 PolarHBondContact O-N 3.24Å; G77-T81 VanDerWaalsContact O-N 3.09Å; G77-T81 PolarHBondContact O-OG1 3.46Å; M78-T81 WeakPolarHBondContact O-CB 3.28Å; M78-T81 PolarHBondContact O-N 3.48Å; T81-W83 PolarHBondContact O-N 3.28Å; T81-T84 PolarHBondContact O-N 3.21Å; T81-V85 HydrophobicContact CG2-CG2 4.3Å; T81-V85 VanDerWaalsContact O-CG2 3.3Å; T81-V85 WeakPolarHBondContact O-CG2 3.17Å; T81-V85 PolarHBondContact O-N 3.41Å |
| 82 | I | 95.5 | Very high | 94.7 | Very high | 2 Ų | 2 | 24.9 Ų | 24.9 | 1% | 0.01 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64.6 | -40.8 | 177.6 | -69.9 | -177.7 | 0 | 0 | 0 | 112.2 | V69 T73 M78 S79 L80 T84 V85 C86 L235 A238 F239 | V69-I82 HydrophobicContact CG1-CB 4.3Å; V69-I82 HydrophobicContact CG1-CG2 4.18Å; T73-I82 HydrophobicContact CG2-CD1 3.18Å; T73-I82 HydrophobicContact CG2-CG1 4.21Å; M78-I82 WeakPolarHBondContact O-CG1 3.28Å; M78-I82 PolarHBondContact O-N 2.8Å; S79-I82 PolarHBondContact O-N 3.34Å; L80-I82 VanDerWaalsContact C-N 3.3Å; L80-I82 PolarHBondContact O-N 2.83Å; I82-T84 VanDerWaalsContact C-N 3.31Å; I82-T84 PolarHBondContact O-N 3.1Å; I82-V85 PolarHBondContact O-N 2.82Å; I82-C86 VanDerWaalsContact O-CB 3.26Å; I82-C86 WeakPolarHBondContact O-CB 3.44Å; I82-C86 PolarHBondContact O-N 3.27Å; I82-C86 PolarHBondContact O-SG 3.48Å; I82-L235 HydrophobicContact CD1-CD1 3.35Å; I82-L235 HydrophobicContact CD1-CG 4.44Å; I82-L235 HydrophobicContact CG1-CD1 4.18Å; I82-A238 HydrophobicContact CD1-CB 3.35Å; I82-F239 HydrophobicContact CG1-CZ 4.49Å; I82-F239 HydrophobicContact CG2-CD1 4.41Å |
| 83 | W | 97.2 | Very high | 95 | Very high | 1 Ų | 1 | 23.7 Ų | 23.7 | 0% | 0.004 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -57.3 | -46.5 | 174.3 | -81.8 | 104.1 | 0 | 0 | 0 | 111.4 | I62 P66 V69 S79 L80 T81 G87 A245 Y246 Y281 V282 N285 | I62-W83 HydrophobicContact CD1-CH2 3.5Å; I62-W83 HydrophobicContact CD1-CZ2 4.07Å; I62-W83 HydrophobicContact CD1-CZ3 3.77Å; P66-W83 HydrophobicContact CG-CZ2 4.02Å; V69-W83 HydrophobicContact CG2-CZ2 4.43Å; S79-W83 PolarHBondContact O-N 3.3Å; S79-W83 VanDerWaalsContact O-N 3.1Å; L80-W83 PolarHBondContact O-N 2.87Å; T81-W83 PolarHBondContact O-N 3.28Å; W83-G87 PolarHBondContact O-N 3.47Å; W83-A245 HydrophobicContact CH2-CB 3.54Å; W83-A245 HydrophobicContact CZ3-CB 3.55Å; W83-Y246 HydrophobicContact CE3-CD2 4.48Å; W83-Y246 AromaticContact CE3-CE2 3.6Å; W83-Y246 HydrophobicContact CE3-CE2 3.6Å; W83-Y246 HydrophobicContact CZ3-CE2 4.01Å; W83-Y246 WeakPolarHBondContact O-CE2 3.41Å; W83-Y246 PolarHBondContact O-OH 3.35Å; W83-Y246 VanDerWaalsContact O-OH 3.13Å; W83-Y281 AromaticContact CE3-CD2 3.89Å; W83-Y281 HydrophobicContact CE3-CD2 3.89Å; W83-Y281 HydrophobicContact CE3-CG 4.29Å; W83-Y281 HydrophobicContact CH2-CD2 4.47Å; W83-Y281 AromaticContact CZ3-CD2 3.41Å; W83-Y281 HydrophobicContact CZ3-CD2 3.41Å; W83-Y281 VanDerWaalsContact CZ3-CD2 3.41Å; W83-Y281 HydrophobicContact CZ3-CE2 4.04Å; W83-Y281 AromaticContact CZ3-CG 3.96Å; W83-Y281 HydrophobicContact CZ3-CG 3.96Å; W83-V282 HydrophobicContact CB-CG2 4.19Å; W83-N285 VanDerWaalsContact NE1-CG 3.32Å; W83-N285 PolarHBondContact NE1-ND2 2.85Å; W83-N285 PolarHBondContact NE1-OD1 3.12Å; W83-N285 VanDerWaalsContact NE1-OD1 3.1Å |
| 84 | T | 97.4 | Very high | 95.2 | Very high | 64 Ų | 64 | 23.4 Ų | 23.4 | 39% | 0.393 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -62.6 | -48.5 | 177 | -54.1 | 0 | 0 | 0 | 0 | 112.2 | L80 T81 I82 C86 G87 V88 | L80-T84 PolarHBondContact O-N 3.49Å; L80-T84 PolarHBondContact O-OG1 2.95Å; T81-T84 PolarHBondContact O-N 3.21Å; I82-T84 VanDerWaalsContact C-N 3.31Å; I82-T84 PolarHBondContact O-N 3.1Å; T84-C86 PolarHBondContact O-N 3.23Å; T84-G87 PolarHBondContact O-N 3.5Å; T84-V88 WeakPolarHBondContact O-CG2 3.26Å; T84-V88 PolarHBondContact O-N 3.49Å |
| 85 | V | 96.8 | Very high | 95.6 | Very high | 54 Ų | 54 | 23 Ų | 23 | 33% | 0.327 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -63.9 | -42.8 | -179.4 | 178.4 | 0 | 0 | 0 | 0 | 110.9 | T81 I82 G87 V88 L89 F239 | T81-V85 HydrophobicContact CG2-CG2 4.3Å; T81-V85 VanDerWaalsContact O-CG2 3.3Å; T81-V85 WeakPolarHBondContact O-CG2 3.17Å; T81-V85 PolarHBondContact O-N 3.41Å; I82-V85 PolarHBondContact O-N 2.82Å; V85-G87 VanDerWaalsContact C-N 3.28Å; V85-G87 PolarHBondContact O-N 2.82Å; V85-V88 PolarHBondContact O-N 2.79Å; V85-L89 HydrophobicContact CG1-CD1 3.84Å; V85-L89 HydrophobicContact CG1-CG 4.14Å; V85-L89 WeakPolarHBondContact O-CB 3.37Å; V85-L89 VanDerWaalsContact O-CG 3.31Å; V85-L89 WeakPolarHBondContact O-CG 3.38Å; V85-L89 PolarHBondContact O-N 2.99Å; V85-F239 HydrophobicContact CB-CE1 4.07Å; V85-F239 HydrophobicContact CB-CZ 4.45Å; V85-F239 HydrophobicContact CG1-CE1 3.61Å; V85-F239 HydrophobicContact CG1-CZ 4Å |
| 86 | C | 96.4 | Very high | 95.9 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -59.2 | -38.9 | 174.9 | -72.5 | 0 | 0 | 0 | 0 | 112.2 | I82 T84 S90 M243 Y246 | I82-C86 VanDerWaalsContact O-CB 3.26Å; I82-C86 WeakPolarHBondContact O-CB 3.44Å; I82-C86 PolarHBondContact O-N 3.27Å; I82-C86 PolarHBondContact O-SG 3.48Å; T84-C86 PolarHBondContact O-N 3.23Å; C86-S90 WeakPolarHBondContact O-CB 3.27Å; C86-S90 PolarHBondContact O-N 2.97Å; C86-S90 PolarHBondContact O-OG 3.06Å; C86-M243 HydrophobicContact CB-CG 4.49Å; C86-M243 HydrophobicContact CB-SD 3.88Å; C86-Y246 HydrophobicContact CB-CD2 3.69Å; C86-Y246 HydrophobicContact CB-CE2 3.77Å |
| 87 | G | 96.8 | Very high | 96 | Very high | 1 Ų | 1 | 22.2 Ų | 22.2 | 1% | 0.01 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.7 | -45.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | W83 T84 V85 S90 L91 | W83-G87 PolarHBondContact O-N 3.47Å; T84-G87 PolarHBondContact O-N 3.5Å; V85-G87 VanDerWaalsContact C-N 3.28Å; V85-G87 PolarHBondContact O-N 2.82Å; G87-S90 PolarHBondContact O-N 3.33Å; G87-L91 PolarHBondContact O-N 3.18Å |
| 88 | V | 97 | Very high | 96.1 | Very high | 64 Ų | 64 | 21.9 Ų | 21.9 | 39% | 0.388 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -64.5 | -46.4 | 176.9 | 174 | 0 | 0 | 0 | 0 | 111.7 | T84 V85 S90 L91 F92 | T84-V88 WeakPolarHBondContact O-CG2 3.26Å; T84-V88 PolarHBondContact O-N 3.49Å; V85-V88 PolarHBondContact O-N 2.79Å; V88-S90 VanDerWaalsContact C-N 3.31Å; V88-S90 PolarHBondContact O-N 3.13Å; V88-L91 WeakPolarHBondContact O-CB 3.48Å; V88-L91 PolarHBondContact O-N 3.35Å; V88-F92 HydrophobicContact CG1-CE1 4.15Å; V88-F92 HydrophobicContact CG1-CE2 3.93Å; V88-F92 HydrophobicContact CG1-CZ 3.72Å; V88-F92 PolarHBondContact O-N 3.17Å |
| 89 | L | 96.4 | Very high | 96.2 | Very high | 20 Ų | 20 | 19.3 Ų | 19.3 | 11% | 0.105 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.3 | -40.5 | 177.2 | -67.7 | 175.4 | 0 | 0 | 0 | 111.2 | V85 L91 F92 G93 F239 M243 L430 F431 T434 | V85-L89 HydrophobicContact CG1-CD1 3.84Å; V85-L89 HydrophobicContact CG1-CG 4.14Å; V85-L89 WeakPolarHBondContact O-CB 3.37Å; V85-L89 VanDerWaalsContact O-CG 3.31Å; V85-L89 WeakPolarHBondContact O-CG 3.38Å; V85-L89 PolarHBondContact O-N 2.99Å; L89-L91 VanDerWaalsContact C-N 3.33Å; L89-L91 PolarHBondContact O-N 3.44Å; L89-F92 HydrophobicContact CD2-CD2 4.41Å; L89-F92 WeakPolarHBondContact O-CB 3.46Å; L89-F92 PolarHBondContact O-N 2.89Å; L89-G93 PolarHBondContact O-N 2.95Å; L89-G93 VanDerWaalsContact O-N 3.08Å; L89-F239 HydrophobicContact CD1-CE1 4.24Å; L89-M243 HydrophobicContact CB-CE 4.27Å; L89-M243 HydrophobicContact CB-SD 4.12Å; L89-L430 HydrophobicContact CD2-CG 4.38Å; L89-F431 WeakPolarHBondContact O-CD2 3.28Å; L89-T434 HydrophobicContact CB-CG2 4.49Å; L89-T434 HydrophobicContact CD1-CG2 3.86Å |
| 90 | S | 96 | Very high | 96.2 | Very high | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.5 | -36.4 | 175.3 | -63 | 0 | 0 | 0 | 0 | 112.3 | C86 G87 V88 F92 G93 A94 Y246 M274 | C86-S90 WeakPolarHBondContact O-CB 3.27Å; C86-S90 PolarHBondContact O-N 2.97Å; C86-S90 PolarHBondContact O-OG 3.06Å; G87-S90 PolarHBondContact O-N 3.33Å; V88-S90 VanDerWaalsContact C-N 3.31Å; V88-S90 PolarHBondContact O-N 3.13Å; S90-F92 VanDerWaalsContact C-N 3.33Å; S90-G93 PolarHBondContact O-N 3.02Å; S90-A94 WeakPolarHBondContact O-CB 3.42Å; S90-A94 PolarHBondContact O-N 3.34Å; S90-Y246 WeakPolarHBondContact OG-CB 3.49Å; S90-M274 VanDerWaalsContact CB-CE 3.49Å |
| 91 | L | 96.1 | Very high | 96 | Very high | 53 Ų | 53 | 18 Ų | 18 | 28% | 0.277 | 10% | 0.103 | S | C | . | . | H | α-helix | trans | -61.8 | -41.5 | 172 | 177 | 64 | 0 | 0 | 0 | 110.9 | G87 V88 L89 G93 A94 L95 M274 | G87-L91 PolarHBondContact O-N 3.18Å; V88-L91 WeakPolarHBondContact O-CB 3.48Å; V88-L91 PolarHBondContact O-N 3.35Å; L89-L91 VanDerWaalsContact C-N 3.33Å; L89-L91 PolarHBondContact O-N 3.44Å; L91-G93 PolarHBondContact O-N 3.35Å; L91-A94 PolarHBondContact O-N 2.92Å; L91-L95 HydrophobicContact CD1-CD1 4.09Å; L91-L95 HydrophobicContact CD1-CD2 4.36Å; L91-L95 HydrophobicContact CD1-CG 3.92Å; L91-L95 HydrophobicContact CG-CD1 3.88Å; L91-L95 HydrophobicContact CG-CG 4.18Å; L91-L95 WeakPolarHBondContact O-CB 3.41Å; L91-L95 WeakPolarHBondContact O-CG 3.41Å; L91-L95 PolarHBondContact O-N 3.46Å; L91-M274 HydrophobicContact CD1-CB 3.85Å; L91-M274 HydrophobicContact CD1-CG 4.17Å |
| 92 | F | 97.3 | Very high | 95.9 | Very high | 36 Ų | 36 | 15.2 Ų | 15.2 | 16% | 0.158 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -62 | -41.3 | 175.9 | -67.2 | -13.9 | 0 | 0 | 0 | 112.9 | V88 L89 S90 S96 F426 I427 L430 F431 | V88-F92 HydrophobicContact CG1-CE1 4.15Å; V88-F92 HydrophobicContact CG1-CE2 3.93Å; V88-F92 HydrophobicContact CG1-CZ 3.72Å; V88-F92 PolarHBondContact O-N 3.17Å; L89-F92 HydrophobicContact CD2-CD2 4.41Å; L89-F92 WeakPolarHBondContact O-CB 3.46Å; L89-F92 PolarHBondContact O-N 2.89Å; S90-F92 VanDerWaalsContact C-N 3.33Å; F92-S96 WeakPolarHBondContact O-CB 3.45Å; F92-S96 PolarHBondContact O-N 2.62Å; F92-S96 PolarHBondContact O-OG 3.33Å; F92-F426 HydrophobicContact CZ-CE2 4.43Å; F92-I427 HydrophobicContact CB-CG2 3.67Å; F92-I427 HydrophobicContact CD1-CD1 4.36Å; F92-I427 HydrophobicContact CD1-CG1 4.24Å; F92-I427 HydrophobicContact CD1-CG2 3.94Å; F92-I427 HydrophobicContact CE1-CD1 4.5Å; F92-I427 HydrophobicContact CE1-CG1 4.41Å; F92-I427 HydrophobicContact CG-CG2 3.95Å; F92-I427 WeakPolarHBondContact O-CG2 3.45Å; F92-L430 HydrophobicContact CD2-CD2 3.86Å; F92-L430 HydrophobicContact CD2-CG 4.4Å; F92-L430 HydrophobicContact CE2-CD2 3.55Å; F92-F431 HydrophobicContact CB-CB 4.09Å |
| 93 | G | 96.2 | Very high | 95.7 | Very high | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.3 | -46.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L89 S90 L91 L95 S96 Y97 W249 F431 | L89-G93 PolarHBondContact O-N 2.95Å; L89-G93 VanDerWaalsContact O-N 3.08Å; S90-G93 PolarHBondContact O-N 3.02Å; L91-G93 PolarHBondContact O-N 3.35Å; G93-L95 PolarHBondContact O-N 2.71Å; G93-S96 WeakPolarHBondContact O-CB 3.46Å; G93-S96 PolarHBondContact O-N 3.05Å; G93-Y97 WeakPolarHBondContact O-CD2 3.26Å; G93-Y97 PolarHBondContact O-N 3.43Å; G93-W249 VanDerWaalsContact C-CZ3 3.44Å; G93-W249 WeakPolarHBondContact O-CH2 3.35Å; G93-W249 WeakPolarHBondContact O-CZ3 3.45Å; G93-F431 VanDerWaalsContact CA-CD1 3.44Å; G93-F431 VanDerWaalsContact CA-CE1 3.48Å; G93-F431 VanDerWaalsContact CA-CG 3.46Å |
| 94 | A | 95.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -65 | -41.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | S90 L91 S96 Y97 A98 W249 I270 M274 | S90-A94 WeakPolarHBondContact O-CB 3.42Å; S90-A94 PolarHBondContact O-N 3.34Å; L91-A94 PolarHBondContact O-N 2.92Å; A94-S96 VanDerWaalsContact C-N 3.33Å; A94-S96 PolarHBondContact O-N 3.23Å; A94-Y97 CarbonylContact O-C 3.59Å; A94-Y97 PolarHBondContact O-N 3.38Å; A94-A98 PolarHBondContact O-N 3.06Å; A94-W249 HydrophobicContact CB-CB 3.83Å; A94-W249 HydrophobicContact CB-CD2 3.64Å; A94-W249 HydrophobicContact CB-CE3 3.57Å; A94-W249 HydrophobicContact CB-CG 3.77Å; A94-W249 HydrophobicContact CB-CZ3 4.34Å; A94-I270 HydrophobicContact CB-CG2 3.35Å; A94-M274 HydrophobicContact CB-CG 4.13Å |
| 95 | L | 96.5 | Very high | 94.9 | Very high | 22 Ų | 22 | 18.8 Ų | 18.8 | 12% | 0.115 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -64 | -38.6 | 174.2 | -70.1 | 174.4 | 0 | 0 | 0 | 111.8 | L91 G93 Y97 A98 E99 F421 V423 I427 | L91-L95 HydrophobicContact CD1-CD1 4.09Å; L91-L95 HydrophobicContact CD1-CD2 4.36Å; L91-L95 HydrophobicContact CD1-CG 3.92Å; L91-L95 HydrophobicContact CG-CD1 3.88Å; L91-L95 HydrophobicContact CG-CG 4.18Å; L91-L95 WeakPolarHBondContact O-CB 3.41Å; L91-L95 WeakPolarHBondContact O-CG 3.41Å; L91-L95 PolarHBondContact O-N 3.46Å; G93-L95 PolarHBondContact O-N 2.71Å; L95-Y97 VanDerWaalsContact C-N 3.34Å; L95-Y97 PolarHBondContact O-N 3.46Å; L95-A98 WeakPolarHBondContact O-CB 3.47Å; L95-A98 PolarHBondContact O-N 2.92Å; L95-E99 PolarHBondContact O-N 3.41Å; L95-E99 VanDerWaalsContact O-N 3.1Å; L95-F421 HydrophobicContact CD2-CE1 4.29Å; L95-F421 HydrophobicContact CD2-CZ 3.89Å; L95-V423 HydrophobicContact CB-CG1 3.91Å; L95-I427 HydrophobicContact CB-CG2 4.35Å; L95-I427 HydrophobicContact CD1-CD1 4.19Å |
| 96 | S | 96.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63.5 | -40.7 | 174.7 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | F92 G93 A94 E99 L100 P428 | F92-S96 WeakPolarHBondContact O-CB 3.45Å; F92-S96 PolarHBondContact O-N 2.62Å; F92-S96 PolarHBondContact O-OG 3.33Å; G93-S96 WeakPolarHBondContact O-CB 3.46Å; G93-S96 PolarHBondContact O-N 3.05Å; A94-S96 VanDerWaalsContact C-N 3.33Å; A94-S96 PolarHBondContact O-N 3.23Å; S96-E99 PolarHBondContact O-N 2.93Å; S96-L100 PolarHBondContact O-N 3.19Å; S96-L100 VanDerWaalsContact O-N 3.1Å; S96-P428 WeakPolarHBondContact OG-CA 3.44Å |
| 97 | Y | 95.1 | Very high | 93.7 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -71.5 | -30.5 | 173.6 | -90.4 | -118.7 | 0 | 0 | 0 | 113.2 | G93 A94 L95 E99 L100 G101 H110 Y113 W249 F250 N253 I400 A403 V404 | G93-Y97 WeakPolarHBondContact O-CD2 3.26Å; G93-Y97 PolarHBondContact O-N 3.43Å; A94-Y97 CarbonylContact O-C 3.59Å; A94-Y97 PolarHBondContact O-N 3.38Å; L95-Y97 VanDerWaalsContact C-N 3.34Å; L95-Y97 PolarHBondContact O-N 3.46Å; Y97-E99 VanDerWaalsContact C-N 3.3Å; Y97-E99 PolarHBondContact O-N 2.93Å; Y97-L100 PolarHBondContact O-N 2.91Å; Y97-G101 PolarHBondContact O-N 2.88Å; Y97-H110 HydrophobicContact CE1-CB 4.42Å; Y97-Y113 HydrophobicContact CD1-CD2 4.35Å; Y97-Y113 AromaticContact CD1-CE2 3.74Å; Y97-Y113 HydrophobicContact CD1-CE2 3.74Å; Y97-Y113 HydrophobicContact CE1-CD2 4.2Å; Y97-Y113 AromaticContact CE1-CE2 3.98Å; Y97-Y113 HydrophobicContact CE1-CE2 3.98Å; Y97-Y113 HydrophobicContact CG-CE2 4.48Å; Y97-W249 HydrophobicContact CD1-CZ3 4.04Å; Y97-W249 AromaticContact CD2-CH2 3.53Å; Y97-W249 HydrophobicContact CD2-CH2 3.53Å; Y97-W249 AromaticContact CD2-CZ3 3.36Å; Y97-W249 HydrophobicContact CD2-CZ3 3.36Å; Y97-W249 HydrophobicContact CE1-CZ3 4.49Å; Y97-W249 AromaticContact CE2-CH2 3.66Å; Y97-W249 HydrophobicContact CE2-CH2 3.66Å; Y97-W249 AromaticContact CE2-CZ3 3.87Å; Y97-W249 HydrophobicContact CE2-CZ3 3.87Å; Y97-W249 HydrophobicContact CG-CE3 4.48Å; Y97-W249 HydrophobicContact CG-CH2 4.1Å; Y97-W249 AromaticContact CG-CZ3 3.45Å; Y97-W249 HydrophobicContact CG-CZ3 3.45Å; Y97-W249 VanDerWaalsContact CG-CZ3 3.45Å; Y97-F250 HydrophobicContact CD1-CB 3.82Å; Y97-F250 HydrophobicContact CE1-CB 3.83Å; Y97-F250 HydrophobicContact CG-CB 4.5Å; Y97-N253 HydrophobicContact CD1-CB 4.31Å; Y97-N253 PolarHBondContact O-ND2 3.15Å; Y97-I400 HydrophobicContact CE2-CG2 4.22Å; Y97-A403 HydrophobicContact CE2-CB 4.49Å; Y97-V404 HydrophobicContact CD2-CG2 3.97Å; Y97-V404 HydrophobicContact CE2-CG2 3.66Å |
| 98 | A | 94.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 20.2 Ų | 20.2 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.6 | -42.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | A94 L95 G101 T102 I266 P267 I270 F421 | A94-A98 PolarHBondContact O-N 3.06Å; L95-A98 WeakPolarHBondContact O-CB 3.47Å; L95-A98 PolarHBondContact O-N 2.92Å; A98-G101 PolarHBondContact O-N 3.21Å; A98-T102 WeakPolarHBondContact O-CB 3.38Å; A98-T102 VanDerWaalsContact O-CG2 3.25Å; A98-T102 WeakPolarHBondContact O-CG2 3.33Å; A98-T102 PolarHBondContact O-N 3.48Å; A98-T102 PolarHBondContact O-OG1 3.09Å; A98-I266 HydrophobicContact CB-CG2 4.32Å; A98-P267 HydrophobicContact CB-CB 4.41Å; A98-P267 HydrophobicContact CB-CG 4.35Å; A98-I270 HydrophobicContact CB-CD1 3.89Å; A98-F421 HydrophobicContact CB-CD1 3.87Å; A98-F421 HydrophobicContact CB-CE1 3.77Å |
| 99 | E | 95.8 | Very high | 92.8 | Very high | 1 Ų | 1 | 17.2 Ų | 17.2 | 1% | 0.005 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -62.5 | -47.8 | 172.9 | 176 | 171.7 | 152.9 | 0 | 0 | 111.8 | L95 S96 Y97 G101 T102 S103 L407 R411 R419 F421 K422 V423 | L95-E99 PolarHBondContact O-N 3.41Å; L95-E99 VanDerWaalsContact O-N 3.1Å; S96-E99 PolarHBondContact O-N 2.93Å; Y97-E99 VanDerWaalsContact C-N 3.3Å; Y97-E99 PolarHBondContact O-N 2.93Å; E99-G101 PolarHBondContact O-N 2.96Å; E99-T102 PolarHBondContact O-N 2.85Å; E99-T102 PolarHBondContact O-OG1 3.31Å; E99-T102 VanDerWaalsContact O-OG1 3.09Å; E99-S103 VanDerWaalsContact O-CB 3.32Å; E99-S103 WeakPolarHBondContact O-CB 3.21Å; E99-S103 PolarHBondContact O-N 3.05Å; E99-S103 PolarHBondContact O-OG 2.83Å; E99-L407 HydrophobicContact CB-CD1 4.42Å; E99-L407 HydrophobicContact CB-CD2 4.28Å; E99-L407 HydrophobicContact CG-CD1 3.74Å; E99-L407 HydrophobicContact CG-CD2 4.3Å; E99-L407 VanDerWaalsContact OE1-CD1 3.29Å; E99-L407 WeakPolarHBondContact OE1-CD1 3.49Å; E99-R411 IonicContact OE1-CZ 2.97Å; E99-R411 IonicContact OE1-NE 2.77Å; E99-R411 PolarHBondContact OE1-NE 3.2Å; E99-R411 IonicContact OE1-NH2 2.65Å; E99-R411 PolarHBondContact OE1-NH2 2.94Å; E99-R411 IonicContact OE2-CZ 3.76Å; E99-R411 IonicContact OE2-NE 3.92Å; E99-R411 IonicContact OE2-NH2 2.78Å; E99-R411 PolarHBondContact OE2-NH2 3.44Å; E99-R419 IonicContact OE1-NE 3.77Å; E99-F421 HydrophobicContact CB-CD1 4.24Å; E99-F421 WeakPolarHBondContact CG-O 3.34Å; E99-K422 WeakPolarHBondContact OE2-CA 3.42Å; E99-V423 HydrophobicContact CB-CG2 4.48Å; E99-V423 VanDerWaalsContact OE2-CG2 3.24Å; E99-V423 WeakPolarHBondContact OE2-CG2 3.26Å; E99-V423 PolarHBondContact OE2-N 2.97Å |
| 100 | L | 94.9 | Very high | 92.6 | Very high | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.005 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -60.2 | -44.2 | 177.3 | -76.4 | 169.8 | 0 | 0 | 0 | 112.3 | S96 Y97 S103 I104 Y113 L407 L410 | S96-L100 PolarHBondContact O-N 3.19Å; S96-L100 VanDerWaalsContact O-N 3.1Å; Y97-L100 PolarHBondContact O-N 2.91Å; L100-S103 PolarHBondContact O-N 3.17Å; L100-I104 HydrophobicContact CD2-CD1 4.39Å; L100-I104 WeakPolarHBondContact O-CB 3.42Å; L100-I104 PolarHBondContact O-N 3.39Å; L100-Y113 HydrophobicContact CB-CD1 4.2Å; L100-Y113 HydrophobicContact CB-CD2 3.92Å; L100-Y113 HydrophobicContact CB-CE1 4.02Å; L100-Y113 HydrophobicContact CB-CE2 3.71Å; L100-Y113 HydrophobicContact CB-CG 4.18Å; L100-Y113 HydrophobicContact CD1-CD2 3.68Å; L100-Y113 HydrophobicContact CD1-CE2 4.16Å; L100-Y113 HydrophobicContact CD1-CG 4.1Å; L100-Y113 HydrophobicContact CD2-CG 4.43Å; L100-Y113 HydrophobicContact CG-CD2 4.33Å; L100-Y113 HydrophobicContact CG-CG 4.48Å; L100-L407 HydrophobicContact CD1-CB 4.13Å; L100-L407 HydrophobicContact CD2-CB 3.86Å; L100-L407 HydrophobicContact CD2-CD1 3.53Å; L100-L407 HydrophobicContact CD2-CG 4.26Å; L100-L407 HydrophobicContact CG-CB 3.97Å; L100-L407 HydrophobicContact CG-CD1 3.73Å; L100-L407 HydrophobicContact CG-CD2 4.42Å; L100-L407 HydrophobicContact CG-CG 4.24Å; L100-L410 HydrophobicContact CD2-CD1 4.24Å |
| 101 | G | 91.8 | Very high | 92.4 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -73 | -26.1 | -178 | 0 | 0 | 0 | 0 | 0 | 114.7 | Y97 A98 E99 Y113 | Y97-G101 PolarHBondContact O-N 2.88Å; A98-G101 PolarHBondContact O-N 3.21Å; E99-G101 PolarHBondContact O-N 2.96Å; G101-Y113 WeakPolarHBondContact CA-OH 3.48Å; G101-Y113 PolarHBondContact N-OH 3.38Å |
| 102 | T | 92.9 | Very high | 92.3 | Very high | 1 Ų | 1 | 13.9 Ų | 13.9 | 1% | 0.006 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -82.6 | -26.8 | 172.8 | 54.5 | 0 | 0 | 0 | 0 | 112.4 | A98 E99 K105 P267 F421 | A98-T102 WeakPolarHBondContact O-CB 3.38Å; A98-T102 VanDerWaalsContact O-CG2 3.25Å; A98-T102 WeakPolarHBondContact O-CG2 3.33Å; A98-T102 PolarHBondContact O-N 3.48Å; A98-T102 PolarHBondContact O-OG1 3.09Å; E99-T102 PolarHBondContact O-N 2.85Å; E99-T102 PolarHBondContact O-OG1 3.31Å; E99-T102 VanDerWaalsContact O-OG1 3.09Å; T102-K105 WeakPolarHBondContact O-CE 3.29Å; T102-P267 HydrophobicContact CG2-CG 3.98Å; T102-F421 HydrophobicContact CG2-CB 4.17Å |
| 103 | S | 92.6 | Very high | 92.2 | Very high | 23 Ų | 23 | 12.2 Ų | 12.2 | 16% | 0.161 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -83.3 | -43.4 | 176.9 | -52.1 | 0 | 0 | 0 | 0 | 112.6 | E99 L100 | E99-S103 VanDerWaalsContact O-CB 3.32Å; E99-S103 WeakPolarHBondContact O-CB 3.21Å; E99-S103 PolarHBondContact O-N 3.05Å; E99-S103 PolarHBondContact O-OG 2.83Å; L100-S103 PolarHBondContact O-N 3.17Å |
| 104 | I | 91.1 | Very high | 92.2 | Very high | 18 Ų | 18 | 12.2 Ų | 12.2 | 9% | 0.092 | 6% | 0.058 | C | C | . | . | S | Bend | trans | -110.8 | 90.5 | -179 | -55.5 | 171.2 | 0 | 0 | 0 | 108 | L100 K106 T112 Y113 E116 L410 | L100-I104 HydrophobicContact CD2-CD1 4.39Å; L100-I104 WeakPolarHBondContact O-CB 3.42Å; L100-I104 PolarHBondContact O-N 3.39Å; I104-K106 HydrophobicContact CG2-CB 4.34Å; I104-K106 PolarHBondContact O-N 2.94Å; I104-T112 HydrophobicContact CG2-CG2 4.06Å; I104-Y113 HydrophobicContact CB-CD1 4.14Å; I104-Y113 HydrophobicContact CB-CE1 4.01Å; I104-Y113 HydrophobicContact CD1-CD1 3.89Å; I104-Y113 HydrophobicContact CG2-CD1 4.27Å; I104-Y113 HydrophobicContact CG2-CE1 4.31Å; I104-E116 HydrophobicContact CD1-CB 4.19Å; I104-E116 HydrophobicContact CD1-CG 4.34Å; I104-E116 HydrophobicContact CG2-CG 4.09Å; I104-L410 HydrophobicContact CD1-CD1 4.19Å |
| 105 | K | 85.4 | Confident | 92.2 | Very high | 100 Ų | 100 | 13.5 Ų | 13.5 | 44% | 0.435 | 7% | 0.065 | S | C | . | . | trans | -80.6 | 32.4 | -173.6 | -59.1 | 177.1 | -176.8 | 171.5 | 0 | 114.1 | T102 E263 | T102-K105 WeakPolarHBondContact O-CE 3.29Å; K105-E263 WeakPolarHBondContact CE-OE1 3.34Å; K105-E263 IonicContact NZ-OE1 3.54Å; K105-E263 PolarHBondContact NZ-OE1 3.21Å | ||
| 106 | K | 84.8 | Confident | 92 | Very high | 83 Ų | 83 | 16.7 Ų | 16.7 | 36% | 0.361 | 8% | 0.079 | S | C | . | . | trans | -101.1 | 143.2 | 175.8 | -73.9 | -179.3 | -178.3 | -178.4 | 0 | 109 | I104 T112 E116 | I104-K106 HydrophobicContact CG2-CB 4.34Å; I104-K106 PolarHBondContact O-N 2.94Å; K106-T112 HydrophobicContact CB-CG2 3.49Å; K106-T112 VanDerWaalsContact CB-CG2 3.49Å; K106-T112 HydrophobicContact CD-CG2 4.09Å; K106-T112 HydrophobicContact CG-CG2 4.44Å; K106-E116 WeakPolarHBondContact CE-OE1 3.35Å; K106-E116 IonicContact NZ-OE1 2.95Å; K106-E116 PolarHBondContact NZ-OE1 3.32Å | ||
| 107 | S | 83.3 | Confident | 91.9 | Very high | 3 Ų | 3 | 17.5 Ų | 17.5 | 2% | 0.021 | 8% | 0.084 | C | C | . | . | S | Bend | trans | -68.9 | 165.7 | 173.7 | -76.5 | 0 | 0 | 0 | 0 | 110.8 | T112 F254 E257 | S107-T112 PolarHBondContact O-OG1 2.95Å; S107-F254 WeakPolarHBondContact CB-O 3.18Å; S107-E257 PolarHBondContact N-OE1 3.47Å; S107-E257 WeakPolarHBondContact OG-CB 3.35Å; S107-E257 VanDerWaalsContact OG-CG 3.22Å; S107-E257 WeakPolarHBondContact OG-CG 3.33Å; S107-E257 PolarHBondContact OG-N 2.98Å |
| 108 | G | 84.7 | Confident | 91.9 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 10% | 0.101 | C | C | . | . | S | Bend | trans | 104.6 | -3.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 116 | H110 Y111 T112 F254 L341 | G108-H110 PolarHBondContact O-N 3.44Å; G108-Y111 PolarHBondContact O-N 2.9Å; G108-T112 WeakPolarHBondContact CA-OG1 3.13Å; G108-F254 PolarHBondContact N-O 3.33Å; G108-F254 VanDerWaalsContact N-O 3.12Å; G108-F254 WeakPolarHBondContact O-CD1 3.22Å; G108-F254 WeakPolarHBondContact O-CE1 3.45Å; G108-L341 WeakPolarHBondContact O-CD1 3.46Å |
| 109 | G | 90.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 11% | 0.11 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 55.7 | -128.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y111 T112 Y113 N253 | G109-Y111 PolarHBondContact O-N 3.18Å; G109-Y111 VanDerWaalsContact O-N 3.13Å; G109-T112 PolarHBondContact O-N 3.18Å; G109-Y113 VanDerWaalsContact O-CD2 3.29Å; G109-Y113 WeakPolarHBondContact O-CD2 3.46Å; G109-Y113 VanDerWaalsContact O-CG 3.24Å; G109-Y113 PolarHBondContact O-N 2.89Å; G109-N253 PolarHBondContact N-O 3.06Å |
| 110 | H | 91.4 | Very high | 91.9 | Very high | 1 Ų | 1 | 25 Ų | 25 | 1% | 0.005 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -56.4 | -29.6 | -178 | 47 | -123.5 | 0 | 0 | 0 | 114.4 | Y97 G108 Y113 I114 R126 E130 F254 A403 | Y97-H110 HydrophobicContact CE1-CB 4.42Å; G108-H110 PolarHBondContact O-N 3.44Å; H110-Y113 PolarHBondContact O-N 3.44Å; H110-I114 WeakPolarHBondContact O-CB 3.17Å; H110-I114 WeakPolarHBondContact O-CD1 3.43Å; H110-I114 WeakPolarHBondContact O-CG1 3.38Å; H110-I114 PolarHBondContact O-N 3.43Å; H110-R126 PolarHBondContact CD2-NE 2.87Å; H110-R126 PolarHBondContact CD2-NH2 3.25Å; H110-R126 PolarHBondContact CE1-NH2 2.83Å; H110-R126 PolarHBondContact ND1-NH2 3.48Å; H110-R126 PolarHBondContact NE2-NE 2.73Å; H110-R126 PolarHBondContact NE2-NH2 3.49Å; H110-E130 IonicContact CE1-OE1 3.4Å; H110-E130 IonicContact NE2-OE1 2.72Å; H110-E130 PolarHBondContact NE2-OE1 3.46Å; H110-F254 AromaticContact CD2-CE1 3.94Å; H110-F254 AromaticContact CD2-CZ 3.92Å; H110-F254 AromaticContact CE1-CE1 3.61Å; H110-F254 AromaticContact CE1-CZ 3.11Å; H110-F254 WeakPolarHBondContact CE1-CZ 3.43Å; H110-F254 AromaticContact CG-CZ 3.82Å; H110-F254 AromaticContact ND1-CZ 3.37Å; H110-F254 WeakPolarHBondContact ND1-CZ 3.1Å; H110-F254 AromaticContact NE2-CE1 3.45Å; H110-F254 WeakPolarHBondContact NE2-CE1 3.41Å; H110-F254 AromaticContact NE2-CZ 3.46Å; H110-F254 WeakPolarHBondContact NE2-CZ 3.38Å; H110-A403 HydrophobicContact CB-CB 4.16Å |
| 111 | Y | 93.8 | Very high | 91.9 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.8 | -50.5 | -179.9 | 160 | -105.9 | 0 | 0 | 0 | 109.9 | G108 G109 Y113 I114 L115 A123 V127 L341 V344 A345 E348 H350 | G108-Y111 PolarHBondContact O-N 2.9Å; G109-Y111 PolarHBondContact O-N 3.18Å; G109-Y111 VanDerWaalsContact O-N 3.13Å; Y111-Y113 VanDerWaalsContact C-N 3.34Å; Y111-Y113 PolarHBondContact O-N 3.44Å; Y111-I114 PolarHBondContact O-N 2.84Å; Y111-L115 HydrophobicContact CE1-CD2 4.25Å; Y111-L115 WeakPolarHBondContact O-CB 3.46Å; Y111-L115 PolarHBondContact O-N 2.99Å; Y111-A123 HydrophobicContact CD2-CB 3.85Å; Y111-A123 VanDerWaalsContact CD2-O 3.26Å; Y111-A123 WeakPolarHBondContact CD2-O 3.46Å; Y111-A123 HydrophobicContact CE2-CB 3.64Å; Y111-A123 WeakPolarHBondContact CE2-O 3.5Å; Y111-V127 HydrophobicContact CD1-CG2 4.44Å; Y111-V127 HydrophobicContact CD2-CB 4.31Å; Y111-V127 HydrophobicContact CD2-CG2 3.14Å; Y111-V127 HydrophobicContact CE2-CG2 3.61Å; Y111-V127 HydrophobicContact CG-CG2 3.59Å; Y111-L341 VanDerWaalsContact CB-CD1 3.48Å; Y111-L341 HydrophobicContact CD1-CD1 4.25Å; Y111-L341 HydrophobicContact CG-CD1 4.04Å; Y111-V344 HydrophobicContact CD1-CG1 4.18Å; Y111-V344 HydrophobicContact CE1-CG1 4.02Å; Y111-A345 HydrophobicContact CE1-CB 4.1Å; Y111-A345 HydrophobicContact CE2-CB 4.36Å; Y111-E348 HydrophobicContact CE1-CB 4.49Å; Y111-E348 HydrophobicContact CE1-CG 4.1Å; Y111-E348 WeakPolarHBondContact OH-CB 3.4Å; Y111-H350 AromaticContact CE2-ND1 3.57Å; Y111-H350 AromaticContact CZ-ND1 3.61Å; Y111-H350 PolarHBondContact OH-ND1 2.91Å |
| 112 | T | 93.3 | Very high | 92.1 | Very high | 3 Ų | 3 | 29.3 Ų | 29.3 | 2% | 0.018 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.5 | -40.9 | 178.9 | -53 | 0 | 0 | 0 | 0 | 111.1 | I104 K106 S107 G108 G109 L115 E116 | I104-T112 HydrophobicContact CG2-CG2 4.06Å; K106-T112 HydrophobicContact CB-CG2 3.49Å; K106-T112 VanDerWaalsContact CB-CG2 3.49Å; K106-T112 HydrophobicContact CD-CG2 4.09Å; K106-T112 HydrophobicContact CG-CG2 4.44Å; S107-T112 PolarHBondContact O-OG1 2.95Å; G108-T112 WeakPolarHBondContact CA-OG1 3.13Å; G109-T112 PolarHBondContact O-N 3.18Å; T112-L115 PolarHBondContact O-N 3.17Å; T112-E116 VanDerWaalsContact O-CG 3.29Å; T112-E116 WeakPolarHBondContact O-CG 3.46Å; T112-E116 PolarHBondContact O-N 3.22Å |
| 113 | Y | 94.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 29.3 Ų | 29.3 | 0% | 0.004 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.3 | -42.6 | 176.6 | -54.2 | -27.4 | 0 | 0 | 0 | 112 | Y97 L100 G101 I104 G109 H110 Y111 L115 V117 N253 | Y97-Y113 HydrophobicContact CD1-CD2 4.35Å; Y97-Y113 AromaticContact CD1-CE2 3.74Å; Y97-Y113 HydrophobicContact CD1-CE2 3.74Å; Y97-Y113 HydrophobicContact CE1-CD2 4.2Å; Y97-Y113 AromaticContact CE1-CE2 3.98Å; Y97-Y113 HydrophobicContact CE1-CE2 3.98Å; Y97-Y113 HydrophobicContact CG-CE2 4.48Å; L100-Y113 HydrophobicContact CB-CD1 4.2Å; L100-Y113 HydrophobicContact CB-CD2 3.92Å; L100-Y113 HydrophobicContact CB-CE1 4.02Å; L100-Y113 HydrophobicContact CB-CE2 3.71Å; L100-Y113 HydrophobicContact CB-CG 4.18Å; L100-Y113 HydrophobicContact CD1-CD2 3.68Å; L100-Y113 HydrophobicContact CD1-CE2 4.16Å; L100-Y113 HydrophobicContact CD1-CG 4.1Å; L100-Y113 HydrophobicContact CD2-CG 4.43Å; L100-Y113 HydrophobicContact CG-CD2 4.33Å; L100-Y113 HydrophobicContact CG-CG 4.48Å; G101-Y113 WeakPolarHBondContact CA-OH 3.48Å; G101-Y113 PolarHBondContact N-OH 3.38Å; I104-Y113 HydrophobicContact CB-CD1 4.14Å; I104-Y113 HydrophobicContact CB-CE1 4.01Å; I104-Y113 HydrophobicContact CD1-CD1 3.89Å; I104-Y113 HydrophobicContact CG2-CD1 4.27Å; I104-Y113 HydrophobicContact CG2-CE1 4.31Å; G109-Y113 VanDerWaalsContact O-CD2 3.29Å; G109-Y113 WeakPolarHBondContact O-CD2 3.46Å; G109-Y113 VanDerWaalsContact O-CG 3.24Å; G109-Y113 PolarHBondContact O-N 2.89Å; H110-Y113 PolarHBondContact O-N 3.44Å; Y111-Y113 VanDerWaalsContact C-N 3.34Å; Y111-Y113 PolarHBondContact O-N 3.44Å; Y113-L115 VanDerWaalsContact C-N 3.34Å; Y113-V117 WeakPolarHBondContact O-CB 3.44Å; Y113-V117 VanDerWaalsContact O-CG2 3.22Å; Y113-V117 WeakPolarHBondContact O-CG2 3.38Å; Y113-V117 PolarHBondContact O-N 3.08Å; Y113-V117 VanDerWaalsContact O-N 3.17Å; Y113-N253 HydrophobicContact CE2-CB 4.43Å; Y113-N253 WeakPolarHBondContact OH-CB 3.22Å; Y113-N253 PolarHBondContact OH-ND2 3.35Å |
| 114 | I | 96 | Very high | 92.3 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -67 | -38.5 | 176.4 | -68 | 164.4 | 0 | 0 | 0 | 110.6 | H110 Y111 V117 F118 G119 P122 A123 R126 F399 L402 A403 | H110-I114 WeakPolarHBondContact O-CB 3.17Å; H110-I114 WeakPolarHBondContact O-CD1 3.43Å; H110-I114 WeakPolarHBondContact O-CG1 3.38Å; H110-I114 PolarHBondContact O-N 3.43Å; Y111-I114 PolarHBondContact O-N 2.84Å; I114-V117 PolarHBondContact O-N 3.32Å; I114-F118 HydrophobicContact CG2-CB 4.41Å; I114-F118 HydrophobicContact CG2-CD2 4.14Å; I114-F118 WeakPolarHBondContact O-CA 3.28Å; I114-F118 WeakPolarHBondContact O-CB 3.36Å; I114-F118 PolarHBondContact O-N 3.17Å; I114-G119 PolarHBondContact O-N 3.01Å; I114-P122 HydrophobicContact CG2-CB 3.72Å; I114-A123 HydrophobicContact CG2-CB 4.29Å; I114-R126 HydrophobicContact CD1-CB 4.17Å; I114-R126 HydrophobicContact CD1-CG 3.97Å; I114-F399 HydrophobicContact CD1-CB 4.49Å; I114-F399 HydrophobicContact CD1-CD1 3.91Å; I114-L402 HydrophobicContact CD1-CD2 4.2Å; I114-L402 HydrophobicContact CG1-CD2 4.27Å; I114-L402 HydrophobicContact CG1-CG 4.44Å; I114-L402 HydrophobicContact CG2-CD2 4.26Å; I114-A403 HydrophobicContact CG1-CB 4.37Å |
| 115 | L | 95.4 | Very high | 92.6 | Very high | 26 Ų | 26 | 28.2 Ų | 28.2 | 14% | 0.136 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -61.3 | -48.7 | 177.6 | -178.4 | 59.8 | 0 | 0 | 0 | 112 | Y111 T112 Y113 V117 G119 P120 A123 E348 | Y111-L115 HydrophobicContact CE1-CD2 4.25Å; Y111-L115 WeakPolarHBondContact O-CB 3.46Å; Y111-L115 PolarHBondContact O-N 2.99Å; T112-L115 PolarHBondContact O-N 3.17Å; Y113-L115 VanDerWaalsContact C-N 3.34Å; L115-V117 VanDerWaalsContact C-N 3.3Å; L115-V117 PolarHBondContact O-N 3.43Å; L115-G119 WeakPolarHBondContact O-CA 3.49Å; L115-G119 PolarHBondContact O-N 3.29Å; L115-P120 HydrophobicContact CD1-CB 4.42Å; L115-P120 HydrophobicContact CD1-CG 4.31Å; L115-A123 HydrophobicContact CB-CB 3.68Å; L115-A123 HydrophobicContact CD1-CB 3.83Å; L115-A123 HydrophobicContact CG-CB 4.34Å; L115-E348 HydrophobicContact CD2-CB 4.5Å; L115-E348 HydrophobicContact CD2-CG 4Å |
| 116 | E | 93.5 | Very high | 92.9 | Very high | 90 Ų | 90 | 23.6 Ų | 23.6 | 42% | 0.421 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -66.7 | -32 | -179.8 | -67.6 | -67.2 | 169.4 | 0 | 0 | 112.5 | I104 K106 T112 | I104-E116 HydrophobicContact CD1-CB 4.19Å; I104-E116 HydrophobicContact CD1-CG 4.34Å; I104-E116 HydrophobicContact CG2-CG 4.09Å; K106-E116 WeakPolarHBondContact CE-OE1 3.35Å; K106-E116 IonicContact NZ-OE1 2.95Å; K106-E116 PolarHBondContact NZ-OE1 3.32Å; T112-E116 VanDerWaalsContact O-CG 3.29Å; T112-E116 WeakPolarHBondContact O-CG 3.46Å; T112-E116 PolarHBondContact O-N 3.22Å |
| 117 | V | 94.8 | Very high | 93.4 | Very high | 17 Ų | 17 | 19.7 Ų | 19.7 | 10% | 0.103 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -92.3 | -49.8 | -174.4 | 179.1 | 0 | 0 | 0 | 0 | 113.3 | Y113 I114 L115 Y409 L410 | Y113-V117 WeakPolarHBondContact O-CB 3.44Å; Y113-V117 VanDerWaalsContact O-CG2 3.22Å; Y113-V117 WeakPolarHBondContact O-CG2 3.38Å; Y113-V117 PolarHBondContact O-N 3.08Å; Y113-V117 VanDerWaalsContact O-N 3.17Å; I114-V117 PolarHBondContact O-N 3.32Å; L115-V117 VanDerWaalsContact C-N 3.3Å; L115-V117 PolarHBondContact O-N 3.43Å; V117-Y409 HydrophobicContact CG1-CD1 3.62Å; V117-Y409 HydrophobicContact CG1-CE1 4.18Å; V117-Y409 HydrophobicContact CG1-CG 4.46Å; V117-L410 HydrophobicContact CG2-CD1 3.54Å; V117-L410 HydrophobicContact CG2-CD2 4Å; V117-L410 HydrophobicContact CG2-CG 3.63Å |
| 118 | F | 95.4 | Very high | 93.9 | Very high | 80 Ų | 80 | 21.9 Ų | 21.9 | 35% | 0.351 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -109.3 | -8.9 | -170.6 | -57.7 | -72.2 | 0 | 0 | 0 | 113.2 | I114 P122 L402 | I114-F118 HydrophobicContact CG2-CB 4.41Å; I114-F118 HydrophobicContact CG2-CD2 4.14Å; I114-F118 WeakPolarHBondContact O-CA 3.28Å; I114-F118 WeakPolarHBondContact O-CB 3.36Å; I114-F118 PolarHBondContact O-N 3.17Å; F118-P122 HydrophobicContact CB-CB 4.11Å; F118-P122 HydrophobicContact CB-CG 3.95Å; F118-L402 HydrophobicContact CD2-CD1 4.12Å; F118-L402 HydrophobicContact CD2-CD2 4.32Å; F118-L402 HydrophobicContact CD2-CG 4Å; F118-L402 HydrophobicContact CE1-CD1 4.18Å; F118-L402 HydrophobicContact CE2-CD1 3.56Å; F118-L402 HydrophobicContact CE2-CD2 4.41Å; F118-L402 HydrophobicContact CE2-CG 3.61Å; F118-L402 WeakPolarHBondContact CE2-O 3.13Å; F118-L402 HydrophobicContact CZ-CD1 3.59Å; F118-L402 HydrophobicContact CZ-CG 4.17Å |
| 119 | G | 94.3 | Very high | 94.2 | Very high | 19 Ų | 19 | 21.9 Ų | 21.9 | 20% | 0.196 | 12% | 0.117 | C | C | . | . | trans | 89.9 | -171.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | I114 L115 A123 | I114-G119 PolarHBondContact O-N 3.01Å; L115-G119 WeakPolarHBondContact O-CA 3.49Å; L115-G119 PolarHBondContact O-N 3.29Å; G119-A123 WeakPolarHBondContact O-CB 3.39Å; G119-A123 PolarHBondContact O-N 3.08Å | ||
| 120 | P | 94.8 | Very high | 94.3 | Very high | 60 Ų | 60 | 21.9 Ų | 21.9 | 39% | 0.39 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -64.8 | -43.4 | -166.6 | -29.4 | 38.9 | 0 | 0 | 0 | 115.9 | L115 A123 F124 H350 Y464 | L115-P120 HydrophobicContact CD1-CB 4.42Å; L115-P120 HydrophobicContact CD1-CG 4.31Å; P120-A123 PolarHBondContact O-N 3.11Å; P120-F124 PolarHBondContact O-N 2.95Å; P120-H350 PolarHBondContact O-CE1 3.32Å; P120-Y464 HydrophobicContact CB-CE2 4.36Å; P120-Y464 VanDerWaalsContact CB-OH 3.26Å; P120-Y464 WeakPolarHBondContact CB-OH 3.39Å |
| 121 | L | 95.5 | Very high | 94.2 | Very high | 51 Ų | 51 | 22.7 Ų | 22.7 | 27% | 0.267 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -62.2 | -54.8 | -175.4 | 166.7 | 70.4 | 0 | 0 | 0 | 112.2 | A123 F124 V125 V461 Y464 | L121-A123 PolarHBondContact O-N 3.46Å; L121-F124 PolarHBondContact O-N 3.05Å; L121-F124 VanDerWaalsContact O-N 3.17Å; L121-V125 HydrophobicContact CD1-CG2 4.18Å; L121-V125 WeakPolarHBondContact O-CG2 3.1Å; L121-V125 PolarHBondContact O-N 3.04Å; L121-V461 HydrophobicContact CD1-CG1 4.34Å; L121-Y464 HydrophobicContact CB-CD1 3.98Å; L121-Y464 HydrophobicContact CB-CE1 3.74Å; L121-Y464 HydrophobicContact CD1-CD1 3.33Å; L121-Y464 HydrophobicContact CD1-CE1 4.02Å; L121-Y464 HydrophobicContact CD1-CG 3.64Å; L121-Y464 HydrophobicContact CG-CD1 4.22Å; L121-Y464 HydrophobicContact CG-CE1 4.45Å |
| 122 | P | 95.7 | Very high | 94 | Very high | 40 Ų | 40 | 25.3 Ų | 25.3 | 26% | 0.26 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -60.5 | -33.9 | 177.3 | -26.3 | 37.3 | 0 | 0 | 0 | 113.3 | I114 F118 V125 R126 | I114-P122 HydrophobicContact CG2-CB 3.72Å; F118-P122 HydrophobicContact CB-CB 4.11Å; F118-P122 HydrophobicContact CB-CG 3.95Å; P122-V125 PolarHBondContact O-N 3.25Å; P122-R126 WeakPolarHBondContact O-CB 3.43Å; P122-R126 PolarHBondContact O-N 2.98Å |
| 123 | A | 95.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -67.9 | -40 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y111 I114 L115 G119 P120 L121 R126 V127 | Y111-A123 HydrophobicContact CD2-CB 3.85Å; Y111-A123 VanDerWaalsContact CD2-O 3.26Å; Y111-A123 WeakPolarHBondContact CD2-O 3.46Å; Y111-A123 HydrophobicContact CE2-CB 3.64Å; Y111-A123 WeakPolarHBondContact CE2-O 3.5Å; I114-A123 HydrophobicContact CG2-CB 4.29Å; L115-A123 HydrophobicContact CB-CB 3.68Å; L115-A123 HydrophobicContact CD1-CB 3.83Å; L115-A123 HydrophobicContact CG-CB 4.34Å; G119-A123 WeakPolarHBondContact O-CB 3.39Å; G119-A123 PolarHBondContact O-N 3.08Å; P120-A123 PolarHBondContact O-N 3.11Å; L121-A123 PolarHBondContact O-N 3.46Å; A123-R126 WeakPolarHBondContact O-CB 3.41Å; A123-R126 PolarHBondContact O-N 3.38Å; A123-V127 PolarHBondContact O-N 3.33Å; A123-V127 VanDerWaalsContact O-N 3.11Å |
| 124 | F | 95.5 | Very high | 93.3 | Very high | 4 Ų | 4 | 25.3 Ų | 25.3 | 2% | 0.018 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.3 | -48.8 | 172.8 | 178.1 | -86.5 | 0 | 0 | 0 | 111.2 | P120 L121 R126 V127 W128 H350 G460 A463 Y464 I468 | P120-F124 PolarHBondContact O-N 2.95Å; L121-F124 PolarHBondContact O-N 3.05Å; L121-F124 VanDerWaalsContact O-N 3.17Å; F124-R126 PolarHBondContact O-N 3.41Å; F124-V127 PolarHBondContact O-N 3.2Å; F124-W128 HydrophobicContact CD1-CB 4.37Å; F124-W128 HydrophobicContact CE1-CB 4.12Å; F124-W128 HydrophobicContact CE1-CD2 4.26Å; F124-W128 HydrophobicContact CE1-CE3 4.01Å; F124-W128 HydrophobicContact CE1-CG 4.34Å; F124-W128 HydrophobicContact CZ-CD2 4.49Å; F124-W128 AromaticContact CZ-CE3 3.8Å; F124-W128 HydrophobicContact CZ-CE3 3.8Å; F124-W128 HydrophobicContact CZ-CZ3 4.35Å; F124-W128 WeakPolarHBondContact O-CB 3.43Å; F124-W128 PolarHBondContact O-N 3.35Å; F124-H350 HydrophobicContact CD2-CB 3.93Å; F124-H350 WeakPolarHBondContact CD2-O 3.33Å; F124-H350 WeakPolarHBondContact CE2-O 3.15Å; F124-G460 WeakPolarHBondContact CD1-O 3.47Å; F124-G460 VanDerWaalsContact CE1-O 3.25Å; F124-G460 WeakPolarHBondContact CE1-O 3.13Å; F124-A463 HydrophobicContact CE1-CB 3.93Å; F124-A463 HydrophobicContact CZ-CB 4.2Å; F124-Y464 HydrophobicContact CB-CD2 3.39Å; F124-Y464 HydrophobicContact CB-CE2 3.93Å; F124-Y464 HydrophobicContact CB-CG 4.25Å; F124-Y464 AromaticContact CD1-CD2 3.86Å; F124-Y464 HydrophobicContact CD1-CD2 3.86Å; F124-Y464 HydrophobicContact CD1-CG 4.14Å; F124-Y464 AromaticContact CD2-CD2 3.83Å; F124-Y464 HydrophobicContact CD2-CD2 3.83Å; F124-Y464 AromaticContact CG-CD2 3.42Å; F124-Y464 HydrophobicContact CG-CD2 3.42Å; F124-Y464 VanDerWaalsContact CG-CD2 3.42Å; F124-Y464 HydrophobicContact CG-CE2 4.32Å; F124-Y464 HydrophobicContact CG-CG 4.16Å; F124-I468 HydrophobicContact CD2-CD1 4.2Å; F124-I468 HydrophobicContact CD2-CG1 3.78Å; F124-I468 HydrophobicContact CE2-CD1 3.98Å; F124-I468 HydrophobicContact CE2-CG1 3.76Å |
| 125 | V | 95.6 | Very high | 93 | Very high | 14 Ų | 14 | 25.6 Ų | 25.6 | 9% | 0.085 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -57.5 | -39.8 | 178.3 | -178.3 | 0 | 0 | 0 | 0 | 110.2 | L121 P122 V127 W128 V129 F399 T457 V461 | L121-V125 HydrophobicContact CD1-CG2 4.18Å; L121-V125 WeakPolarHBondContact O-CG2 3.1Å; L121-V125 PolarHBondContact O-N 3.04Å; P122-V125 PolarHBondContact O-N 3.25Å; V125-V127 PolarHBondContact O-N 2.9Å; V125-W128 PolarHBondContact O-N 3.49Å; V125-V129 HydrophobicContact CG1-CG2 4.42Å; V125-V129 WeakPolarHBondContact O-CG2 3.35Å; V125-V129 PolarHBondContact O-N 2.84Å; V125-F399 HydrophobicContact CG1-CZ 4Å; V125-T457 HydrophobicContact CG1-CG2 3.88Å; V125-T457 VanDerWaalsContact CG1-O 3.29Å; V125-T457 WeakPolarHBondContact CG1-O 3.36Å; V125-V461 HydrophobicContact CG2-CG2 4.02Å |
| 126 | R | 93.8 | Very high | 92.7 | Very high | 3 Ų | 3 | 24.4 Ų | 24.4 | 1% | 0.011 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -55.4 | -52 | 173.5 | 173.6 | 69.7 | -168.6 | 87.5 | -14.3 | 112.1 | H110 I114 P122 A123 F124 E130 F399 | H110-R126 PolarHBondContact CD2-NE 2.87Å; H110-R126 PolarHBondContact CD2-NH2 3.25Å; H110-R126 PolarHBondContact CE1-NH2 2.83Å; H110-R126 PolarHBondContact ND1-NH2 3.48Å; H110-R126 PolarHBondContact NE2-NE 2.73Å; H110-R126 PolarHBondContact NE2-NH2 3.49Å; I114-R126 HydrophobicContact CD1-CB 4.17Å; I114-R126 HydrophobicContact CD1-CG 3.97Å; P122-R126 WeakPolarHBondContact O-CB 3.43Å; P122-R126 PolarHBondContact O-N 2.98Å; A123-R126 WeakPolarHBondContact O-CB 3.41Å; A123-R126 PolarHBondContact O-N 3.38Å; F124-R126 PolarHBondContact O-N 3.41Å; R126-E130 IonicContact CZ-OE1 3.53Å; R126-E130 IonicContact CZ-OE2 3.93Å; R126-E130 VanDerWaalsContact NH1-CB 3.28Å; R126-E130 IonicContact NH1-OE1 2.69Å; R126-E130 IonicContact NH1-OE2 3.81Å; R126-E130 PolarHBondContact NH1-OE2 3.12Å; R126-E130 VanDerWaalsContact NH2-CD 3.31Å; R126-E130 IonicContact NH2-OE1 3.1Å; R126-E130 PolarHBondContact NH2-OE1 2.9Å; R126-E130 IonicContact NH2-OE2 3.38Å; R126-E130 PolarHBondContact NH2-OE2 2.81Å; R126-E130 WeakPolarHBondContact O-CB 3.26Å; R126-E130 PolarHBondContact O-N 3.32Å; R126-F399 HydrophobicContact CB-CD1 3.96Å; R126-F399 HydrophobicContact CB-CE1 3.84Å; R126-F399 HydrophobicContact CB-CG 4.48Å; R126-F399 HydrophobicContact CB-CZ 4.29Å; R126-F399 HydrophobicContact CG-CD1 4.25Å; R126-F399 HydrophobicContact CG-CG 4.39Å |
| 127 | V | 93.6 | Very high | 92.5 | Very high | 1 Ų | 1 | 20.1 Ų | 20.1 | 1% | 0.006 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -71.5 | -35 | -177.5 | 165.9 | 0 | 0 | 0 | 0 | 111.8 | Y111 A123 F124 V125 E130 L131 L341 A345 L351 | Y111-V127 HydrophobicContact CD1-CG2 4.44Å; Y111-V127 HydrophobicContact CD2-CB 4.31Å; Y111-V127 HydrophobicContact CD2-CG2 3.14Å; Y111-V127 HydrophobicContact CE2-CG2 3.61Å; Y111-V127 HydrophobicContact CG-CG2 3.59Å; A123-V127 PolarHBondContact O-N 3.33Å; A123-V127 VanDerWaalsContact O-N 3.11Å; F124-V127 PolarHBondContact O-N 3.2Å; V125-V127 PolarHBondContact O-N 2.9Å; V127-E130 VanDerWaalsContact O-CB 3.3Å; V127-E130 WeakPolarHBondContact O-CB 3.44Å; V127-E130 PolarHBondContact O-N 3.25Å; V127-L131 WeakPolarHBondContact O-CB 3.26Å; V127-L131 PolarHBondContact O-N 3.5Å; V127-L341 HydrophobicContact CG2-CD1 4.23Å; V127-A345 HydrophobicContact CB-CB 4.32Å; V127-A345 HydrophobicContact CG1-CB 3.76Å; V127-A345 HydrophobicContact CG2-CB 3.78Å; V127-L351 HydrophobicContact CG1-CD1 3.68Å; V127-L351 HydrophobicContact CG1-CD2 4.07Å; V127-L351 HydrophobicContact CG1-CG 3.86Å |
| 128 | W | 94 | Very high | 92.2 | Very high | 50 Ų | 50 | 19.7 Ų | 19.7 | 19% | 0.189 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -56.2 | -51.9 | 174.2 | -177.4 | -101.4 | 0 | 0 | 0 | 111.4 | F124 V125 E130 L131 L132 T459 A463 F467 | F124-W128 HydrophobicContact CD1-CB 4.37Å; F124-W128 HydrophobicContact CE1-CB 4.12Å; F124-W128 HydrophobicContact CE1-CD2 4.26Å; F124-W128 HydrophobicContact CE1-CE3 4.01Å; F124-W128 HydrophobicContact CE1-CG 4.34Å; F124-W128 HydrophobicContact CZ-CD2 4.49Å; F124-W128 AromaticContact CZ-CE3 3.8Å; F124-W128 HydrophobicContact CZ-CE3 3.8Å; F124-W128 HydrophobicContact CZ-CZ3 4.35Å; F124-W128 WeakPolarHBondContact O-CB 3.43Å; F124-W128 PolarHBondContact O-N 3.35Å; V125-W128 PolarHBondContact O-N 3.49Å; W128-E130 VanDerWaalsContact C-N 3.33Å; W128-E130 PolarHBondContact O-N 2.76Å; W128-L131 PolarHBondContact O-N 3.34Å; W128-L132 HydrophobicContact CD2-CD1 4.02Å; W128-L132 VanDerWaalsContact CE2-CD1 3.42Å; W128-L132 HydrophobicContact CG-CD1 4.42Å; W128-L132 HydrophobicContact CH2-CD1 4.32Å; W128-L132 HydrophobicContact CZ2-CD1 3.61Å; W128-L132 WeakPolarHBondContact O-CG 3.27Å; W128-L132 PolarHBondContact O-N 2.95Å; W128-L132 VanDerWaalsContact O-N 3.08Å; W128-T459 PolarHBondContact NE1-OG1 3.13Å; W128-A463 HydrophobicContact CD2-CB 4.1Å; W128-A463 HydrophobicContact CE3-CB 4.11Å; W128-A463 HydrophobicContact CH2-CB 3.78Å; W128-A463 HydrophobicContact CZ2-CB 3.74Å; W128-A463 HydrophobicContact CZ3-CB 3.96Å; W128-F467 HydrophobicContact CH2-CE2 4.12Å; W128-F467 HydrophobicContact CZ3-CD2 4.4Å; W128-F467 HydrophobicContact CZ3-CE2 4.21Å |
| 129 | V | 92.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -70.4 | -32.2 | 178.7 | 179.8 | 0 | 0 | 0 | 0 | 111.9 | V125 L131 I133 I134 A395 F399 T457 | V125-V129 HydrophobicContact CG1-CG2 4.42Å; V125-V129 WeakPolarHBondContact O-CG2 3.35Å; V125-V129 PolarHBondContact O-N 2.84Å; V129-L131 VanDerWaalsContact C-N 3.35Å; V129-I133 HydrophobicContact CG1-CB 4.3Å; V129-I133 HydrophobicContact CG1-CD1 4.14Å; V129-I133 WeakPolarHBondContact O-CB 3.47Å; V129-I133 PolarHBondContact O-N 3.05Å; V129-I134 HydrophobicContact CG1-CD1 3.91Å; V129-I134 HydrophobicContact CG1-CG1 4.05Å; V129-I134 PolarHBondContact O-N 3.06Å; V129-A395 HydrophobicContact CG1-CB 3.64Å; V129-F399 HydrophobicContact CB-CE2 4.09Å; V129-F399 HydrophobicContact CG1-CE2 4.3Å; V129-F399 HydrophobicContact CG2-CE2 4.25Å; V129-T457 VanDerWaalsContact CG2-CA 3.48Å; V129-T457 HydrophobicContact CG2-CG2 3.96Å |
| 130 | E | 91.2 | Very high | 91.8 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 8% | 0.084 | C | C | . | . | I | π-helix | trans | -58.6 | -48.9 | 173.1 | -165.3 | 77.6 | 143.4 | 0 | 0 | 112.1 | H110 R126 V127 W128 I134 R135 L341 F342 | H110-E130 IonicContact CE1-OE1 3.4Å; H110-E130 IonicContact NE2-OE1 2.72Å; H110-E130 PolarHBondContact NE2-OE1 3.46Å; R126-E130 IonicContact CZ-OE1 3.53Å; R126-E130 IonicContact CZ-OE2 3.93Å; R126-E130 VanDerWaalsContact NH1-CB 3.28Å; R126-E130 IonicContact NH1-OE1 2.69Å; R126-E130 IonicContact NH1-OE2 3.81Å; R126-E130 PolarHBondContact NH1-OE2 3.12Å; R126-E130 VanDerWaalsContact NH2-CD 3.31Å; R126-E130 IonicContact NH2-OE1 3.1Å; R126-E130 PolarHBondContact NH2-OE1 2.9Å; R126-E130 IonicContact NH2-OE2 3.38Å; R126-E130 PolarHBondContact NH2-OE2 2.81Å; R126-E130 WeakPolarHBondContact O-CB 3.26Å; R126-E130 PolarHBondContact O-N 3.32Å; V127-E130 VanDerWaalsContact O-CB 3.3Å; V127-E130 WeakPolarHBondContact O-CB 3.44Å; V127-E130 PolarHBondContact O-N 3.25Å; W128-E130 VanDerWaalsContact C-N 3.33Å; W128-E130 PolarHBondContact O-N 2.76Å; E130-I134 WeakPolarHBondContact OE2-CB 3.38Å; E130-I134 WeakPolarHBondContact OE2-CD1 3.42Å; E130-I134 WeakPolarHBondContact OE2-CG2 3.34Å; E130-R135 HydrophobicContact CG-CG 3.57Å; E130-R135 WeakPolarHBondContact O-CB 3.33Å; E130-R135 WeakPolarHBondContact O-CG 3.43Å; E130-R135 PolarHBondContact O-N 3.3Å; E130-R135 IonicContact OE1-CZ 3.06Å; E130-R135 IonicContact OE1-NE 2.84Å; E130-R135 PolarHBondContact OE1-NE 3.45Å; E130-R135 IonicContact OE1-NH2 3.31Å; E130-R135 PolarHBondContact OE1-NH2 3.28Å; E130-R135 IonicContact OE2-NE 3.25Å; E130-L341 HydrophobicContact CB-CD2 4.45Å; E130-L341 HydrophobicContact CG-CD2 3.52Å; E130-L341 VanDerWaalsContact OE1-CD2 3.28Å; E130-L341 WeakPolarHBondContact OE1-CD2 3.42Å; E130-F342 HydrophobicContact CG-CE1 4.42Å |
| 131 | L | 90.4 | Very high | 91.5 | Very high | 17 Ų | 17 | 12.5 Ų | 12.5 | 9% | 0.089 | 7% | 0.066 | C | C | . | . | I | π-helix | trans | -68.3 | -47.7 | -175.2 | 178 | 66.2 | 0 | 0 | 0 | 111.3 | V127 W128 V129 P136 F342 L351 V371 L375 | V127-L131 WeakPolarHBondContact O-CB 3.26Å; V127-L131 PolarHBondContact O-N 3.5Å; W128-L131 PolarHBondContact O-N 3.34Å; V129-L131 VanDerWaalsContact C-N 3.35Å; L131-P136 VanDerWaalsContact O-CD 3.28Å; L131-P136 WeakPolarHBondContact O-CD 3.49Å; L131-P136 WeakPolarHBondContact O-CG 3.42Å; L131-F342 HydrophobicContact CB-CE1 3.92Å; L131-F342 HydrophobicContact CB-CZ 4.01Å; L131-F342 HydrophobicContact CD1-CD1 4.47Å; L131-F342 HydrophobicContact CD1-CD2 4.21Å; L131-F342 HydrophobicContact CD1-CE1 3.81Å; L131-F342 HydrophobicContact CD1-CE2 3.49Å; L131-F342 VanDerWaalsContact CD1-CE2 3.49Å; L131-F342 HydrophobicContact CD1-CZ 3.28Å; L131-F342 HydrophobicContact CG-CE1 4.47Å; L131-F342 HydrophobicContact CG-CZ 4.26Å; L131-L351 HydrophobicContact CD2-CD2 4.23Å; L131-V371 HydrophobicContact CD1-CG1 3.99Å; L131-L375 HydrophobicContact CD1-CD1 4.17Å; L131-L375 HydrophobicContact CG-CD1 4.28Å; L131-L375 WeakPolarHBondContact O-CD1 3.46Å |
| 132 | L | 88.8 | Confident | 91.2 | Very high | 55 Ų | 55 | 11.4 Ų | 11.4 | 29% | 0.288 | 6% | 0.06 | S | C | . | . | I | π-helix | trans | -82.7 | -34 | -172.8 | -64 | -178.6 | 0 | 0 | 0 | 113.6 | W128 | W128-L132 HydrophobicContact CD2-CD1 4.02Å; W128-L132 VanDerWaalsContact CE2-CD1 3.42Å; W128-L132 HydrophobicContact CG-CD1 4.42Å; W128-L132 HydrophobicContact CH2-CD1 4.32Å; W128-L132 HydrophobicContact CZ2-CD1 3.61Å; W128-L132 WeakPolarHBondContact O-CG 3.27Å; W128-L132 PolarHBondContact O-N 2.95Å; W128-L132 VanDerWaalsContact O-N 3.08Å |
| 133 | I | 84.9 | Confident | 91 | Very high | 2 Ų | 2 | 9.5 Ų | 9.5 | 1% | 0.01 | 5% | 0.048 | C | C | . | . | I | π-helix | trans | -119.9 | -67.4 | -169.5 | -63.9 | 169.7 | 0 | 0 | 0 | 111.8 | V129 R135 P136 A137 F391 I456 | V129-I133 HydrophobicContact CG1-CB 4.3Å; V129-I133 HydrophobicContact CG1-CD1 4.14Å; V129-I133 WeakPolarHBondContact O-CB 3.47Å; V129-I133 PolarHBondContact O-N 3.05Å; I133-R135 VanDerWaalsContact C-N 3.32Å; I133-R135 PolarHBondContact O-N 3.09Å; I133-P136 WeakPolarHBondContact O-CD 3.3Å; I133-A137 WeakPolarHBondContact O-CB 3.34Å; I133-A137 PolarHBondContact O-N 3.24Å; I133-F391 HydrophobicContact CB-CE1 3.97Å; I133-F391 HydrophobicContact CB-CZ 4.32Å; I133-F391 HydrophobicContact CD1-CE1 4.22Å; I133-F391 HydrophobicContact CD1-CE2 4.39Å; I133-F391 HydrophobicContact CD1-CZ 3.69Å; I133-F391 HydrophobicContact CG1-CE1 3.77Å; I133-F391 HydrophobicContact CG1-CZ 3.66Å; I133-F391 HydrophobicContact CG2-CD1 3.61Å; I133-F391 HydrophobicContact CG2-CE1 3.18Å; I133-F391 HydrophobicContact CG2-CZ 3.76Å; I133-I456 HydrophobicContact CD1-CB 3.47Å; I133-I456 VanDerWaalsContact CD1-CB 3.47Å; I133-I456 HydrophobicContact CD1-CD1 3.81Å; I133-I456 HydrophobicContact CD1-CG1 4.24Å; I133-I456 HydrophobicContact CD1-CG2 3.24Å; I133-I456 HydrophobicContact CG1-CD1 4.3Å; I133-I456 HydrophobicContact CG1-CG2 3.93Å |
| 134 | I | 88.9 | Confident | 90.8 | Very high | 2 Ų | 2 | 10.5 Ų | 10.5 | 1% | 0.01 | 5% | 0.053 | C | C | . | . | I | π-helix | trans | -63.4 | -42.2 | -159.2 | -64.1 | 168.8 | 0 | 0 | 0 | 110.6 | V129 E130 A138 A395 | V129-I134 HydrophobicContact CG1-CD1 3.91Å; V129-I134 HydrophobicContact CG1-CG1 4.05Å; V129-I134 PolarHBondContact O-N 3.06Å; E130-I134 WeakPolarHBondContact OE2-CB 3.38Å; E130-I134 WeakPolarHBondContact OE2-CD1 3.42Å; E130-I134 WeakPolarHBondContact OE2-CG2 3.34Å; I134-A138 WeakPolarHBondContact O-CB 3.44Å; I134-A138 PolarHBondContact O-N 3.22Å; I134-A395 HydrophobicContact CD1-CB 3.92Å; I134-A395 HydrophobicContact CG1-CB 4.1Å |
| 135 | R | 88.5 | Confident | 90.5 | Very high | 7 Ų | 7 | 10.5 Ų | 10.5 | 3% | 0.026 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -79.8 | -46.9 | -176.2 | -59.4 | -57.6 | -173.9 | 173.7 | -5.8 | 113.7 | E130 I133 A137 A138 T139 Y251 V338 L372 | E130-R135 HydrophobicContact CG-CG 3.57Å; E130-R135 WeakPolarHBondContact O-CB 3.33Å; E130-R135 WeakPolarHBondContact O-CG 3.43Å; E130-R135 PolarHBondContact O-N 3.3Å; E130-R135 IonicContact OE1-CZ 3.06Å; E130-R135 IonicContact OE1-NE 2.84Å; E130-R135 PolarHBondContact OE1-NE 3.45Å; E130-R135 IonicContact OE1-NH2 3.31Å; E130-R135 PolarHBondContact OE1-NH2 3.28Å; E130-R135 IonicContact OE2-NE 3.25Å; I133-R135 VanDerWaalsContact C-N 3.32Å; I133-R135 PolarHBondContact O-N 3.09Å; R135-A137 VanDerWaalsContact C-N 3.35Å; R135-A137 PolarHBondContact O-N 3.12Å; R135-A138 PolarHBondContact O-N 2.98Å; R135-T139 VanDerWaalsContact O-CB 3.29Å; R135-T139 WeakPolarHBondContact O-CB 3.32Å; R135-T139 PolarHBondContact O-N 2.88Å; R135-T139 PolarHBondContact O-OG1 3.43Å; R135-Y251 VanDerWaalsContact NH1-CZ 3.32Å; R135-Y251 PolarHBondContact NH1-OH 3.44Å; R135-V338 HydrophobicContact CB-CG1 4.38Å; R135-V338 HydrophobicContact CB-CG2 4.15Å; R135-V338 HydrophobicContact CG-CG1 4.12Å; R135-V338 HydrophobicContact CG-CG2 3.58Å; R135-L372 HydrophobicContact CB-CD1 3.88Å |
| 136 | P | 90 | Very high | 90.3 | Very high | 0 Ų | 0 | 10.9 Ų | 10.9 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -54 | -50.2 | 171.4 | -30 | 38.5 | 0 | 0 | 0 | 112.4 | L131 I133 T139 A140 L372 L375 M379 | L131-P136 VanDerWaalsContact O-CD 3.28Å; L131-P136 WeakPolarHBondContact O-CD 3.49Å; L131-P136 WeakPolarHBondContact O-CG 3.42Å; I133-P136 WeakPolarHBondContact O-CD 3.3Å; P136-T139 PolarHBondContact O-N 3.38Å; P136-A140 VanDerWaalsContact O-CB 3.29Å; P136-A140 WeakPolarHBondContact O-CB 3.37Å; P136-A140 PolarHBondContact O-N 3.29Å; P136-L372 HydrophobicContact CG-CD1 4.08Å; P136-L375 HydrophobicContact CB-CB 4.15Å; P136-L375 HydrophobicContact CG-CB 3.67Å; P136-L375 HydrophobicContact CG-CD1 4.42Å; P136-M379 HydrophobicContact CB-CB 4.4Å; P136-M379 HydrophobicContact CB-CG 3.64Å |
| 137 | A | 88.9 | Confident | 90.3 | Very high | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -65.4 | -45.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | I133 R135 T139 A140 V141 L388 L392 | I133-A137 WeakPolarHBondContact O-CB 3.34Å; I133-A137 PolarHBondContact O-N 3.24Å; R135-A137 VanDerWaalsContact C-N 3.35Å; R135-A137 PolarHBondContact O-N 3.12Å; A137-T139 VanDerWaalsContact C-N 3.32Å; A137-T139 PolarHBondContact O-N 3.37Å; A137-A140 PolarHBondContact O-N 2.9Å; A137-V141 WeakPolarHBondContact O-CG2 3.17Å; A137-V141 PolarHBondContact O-N 2.91Å; A137-L388 HydrophobicContact CB-CD2 4.1Å; A137-L392 HydrophobicContact CB-CB 4.06Å; A137-L392 HydrophobicContact CB-CD2 4.04Å |
| 138 | A | 88.6 | Confident | 90.1 | Very high | 8 Ų | 8 | 14.6 Ų | 14.6 | 7% | 0.066 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -62.2 | -40.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | I134 R135 I142 L392 | I134-A138 WeakPolarHBondContact O-CB 3.44Å; I134-A138 PolarHBondContact O-N 3.22Å; R135-A138 PolarHBondContact O-N 2.98Å; A138-I142 VanDerWaalsContact O-CG1 3.3Å; A138-I142 WeakPolarHBondContact O-CG1 3.44Å; A138-I142 PolarHBondContact O-N 3.39Å; A138-L392 HydrophobicContact CB-CD2 4.19Å |
| 139 | T | 90.2 | Very high | 89.9 | Confident | 9 Ų | 9 | 12.5 Ų | 12.5 | 6% | 0.055 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -68.8 | -41.7 | 179.1 | -50.8 | 0 | 0 | 0 | 0 | 110.3 | R135 P136 A137 I142 S143 L173 T376 | R135-T139 VanDerWaalsContact O-CB 3.29Å; R135-T139 WeakPolarHBondContact O-CB 3.32Å; R135-T139 PolarHBondContact O-N 2.88Å; R135-T139 PolarHBondContact O-OG1 3.43Å; P136-T139 PolarHBondContact O-N 3.38Å; A137-T139 VanDerWaalsContact C-N 3.32Å; A137-T139 PolarHBondContact O-N 3.37Å; T139-I142 PolarHBondContact O-N 3.14Å; T139-S143 VanDerWaalsContact O-CB 3.26Å; T139-S143 WeakPolarHBondContact O-CB 3.25Å; T139-S143 PolarHBondContact O-N 2.94Å; T139-S143 PolarHBondContact O-OG 3.19Å; T139-S143 VanDerWaalsContact O-OG 3.12Å; T139-L173 HydrophobicContact CG2-CD1 3.62Å; T139-T376 HydrophobicContact CG2-CG2 3.83Å |
| 140 | A | 90.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 14.8 Ų | 14.8 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -60.6 | -45.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | P136 A137 I142 S143 L144 T376 M379 L388 | P136-A140 VanDerWaalsContact O-CB 3.29Å; P136-A140 WeakPolarHBondContact O-CB 3.37Å; P136-A140 PolarHBondContact O-N 3.29Å; A137-A140 PolarHBondContact O-N 2.9Å; A140-I142 PolarHBondContact O-N 2.97Å; A140-S143 VanDerWaalsContact CA-OG 3.31Å; A140-S143 WeakPolarHBondContact CA-OG 3.45Å; A140-S143 PolarHBondContact O-N 2.99Å; A140-S143 PolarHBondContact O-OG 3.41Å; A140-L144 WeakPolarHBondContact O-CB 3.33Å; A140-L144 WeakPolarHBondContact O-CG 3.35Å; A140-L144 PolarHBondContact O-N 3.44Å; A140-T376 HydrophobicContact CB-CG2 4.36Å; A140-M379 HydrophobicContact CB-CB 4.05Å; A140-L388 HydrophobicContact CB-CD1 4.26Å |
| 141 | V | 88.3 | Confident | 90 | Very high | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -61.3 | -47.6 | 177.7 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | A137 S143 L144 A145 Y244 L385 L388 L389 | A137-V141 WeakPolarHBondContact O-CG2 3.17Å; A137-V141 PolarHBondContact O-N 2.91Å; V141-S143 VanDerWaalsContact C-N 3.3Å; V141-S143 PolarHBondContact O-N 3.26Å; V141-L144 PolarHBondContact O-N 2.93Å; V141-A145 PolarHBondContact O-N 2.73Å; V141-A145 VanDerWaalsContact O-N 3.17Å; V141-Y244 VanDerWaalsContact CG1-OH 3.26Å; V141-Y244 WeakPolarHBondContact CG1-OH 3.43Å; V141-L385 HydrophobicContact CG1-CD1 4.41Å; V141-L385 HydrophobicContact CG1-CD2 4.28Å; V141-L385 HydrophobicContact CG1-CG 4.07Å; V141-L388 HydrophobicContact CG2-CB 3.65Å; V141-L388 HydrophobicContact CG2-CD1 4.2Å; V141-L389 HydrophobicContact CG1-CD2 3.9Å; V141-L389 HydrophobicContact CG1-CG 4.25Å; V141-L389 HydrophobicContact CG2-CD2 4.26Å; V141-L389 HydrophobicContact CG2-CG 4.29Å |
| 142 | I | 90 | Very high | 89.8 | Confident | 28 Ų | 28 | 16.7 Ų | 16.7 | 14% | 0.144 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -64.5 | -38.8 | 178.8 | -65.3 | 169 | 0 | 0 | 0 | 110.5 | A138 T139 A140 A145 F146 C327 M331 | A138-I142 VanDerWaalsContact O-CG1 3.3Å; A138-I142 WeakPolarHBondContact O-CG1 3.44Å; A138-I142 PolarHBondContact O-N 3.39Å; T139-I142 PolarHBondContact O-N 3.14Å; A140-I142 PolarHBondContact O-N 2.97Å; I142-A145 PolarHBondContact O-N 3.09Å; I142-F146 PolarHBondContact O-N 3.47Å; I142-F146 VanDerWaalsContact O-N 3.1Å; I142-C327 HydrophobicContact CG2-CB 4.35Å; I142-C327 WeakPolarHBondContact CG2-O 3.26Å; I142-M331 HydrophobicContact CB-CG 4.34Å; I142-M331 HydrophobicContact CG2-CG 3.65Å |
| 143 | S | 92.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -70.6 | -37.3 | -179.6 | 69.6 | 0 | 0 | 0 | 0 | 112.3 | T139 A140 V141 A145 F146 G147 T169 M331 | T139-S143 VanDerWaalsContact O-CB 3.26Å; T139-S143 WeakPolarHBondContact O-CB 3.25Å; T139-S143 PolarHBondContact O-N 2.94Å; T139-S143 PolarHBondContact O-OG 3.19Å; T139-S143 VanDerWaalsContact O-OG 3.12Å; A140-S143 VanDerWaalsContact CA-OG 3.31Å; A140-S143 WeakPolarHBondContact CA-OG 3.45Å; A140-S143 PolarHBondContact O-N 2.99Å; A140-S143 PolarHBondContact O-OG 3.41Å; V141-S143 VanDerWaalsContact C-N 3.3Å; V141-S143 PolarHBondContact O-N 3.26Å; S143-A145 VanDerWaalsContact C-N 3.32Å; S143-A145 PolarHBondContact O-N 3.11Å; S143-F146 WeakPolarHBondContact O-CA 3.36Å; S143-F146 VanDerWaalsContact O-CB 3.28Å; S143-F146 WeakPolarHBondContact O-CB 3.2Å; S143-F146 PolarHBondContact O-N 3.4Å; S143-F146 VanDerWaalsContact O-N 3.16Å; S143-G147 PolarHBondContact O-N 2.81Å; S143-T169 VanDerWaalsContact CB-CG2 3.4Å; S143-T169 WeakPolarHBondContact O-CG2 3.47Å; S143-T169 PolarHBondContact O-OG1 3.43Å; S143-T169 WeakPolarHBondContact OG-CG2 3.5Å; S143-M331 VanDerWaalsContact CA-SD 3.51Å; S143-M331 WeakPolarHBondContact CB-SD 3.36Å |
| 144 | L | 90.3 | Very high | 89.9 | Confident | 20 Ų | 20 | 23 Ų | 23 | 11% | 0.105 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -62.7 | -40.9 | 174.7 | -79.6 | 168 | 0 | 0 | 0 | 111.4 | A140 V141 F146 G147 R148 I165 K166 L380 | A140-L144 WeakPolarHBondContact O-CB 3.33Å; A140-L144 WeakPolarHBondContact O-CG 3.35Å; A140-L144 PolarHBondContact O-N 3.44Å; V141-L144 PolarHBondContact O-N 2.93Å; L144-F146 VanDerWaalsContact C-N 3.34Å; L144-F146 PolarHBondContact O-N 2.78Å; L144-G147 PolarHBondContact O-N 3.01Å; L144-R148 PolarHBondContact O-N 3.48Å; L144-I165 HydrophobicContact CD2-CG2 4.14Å; L144-K166 HydrophobicContact CD2-CG 4.28Å; L144-L380 HydrophobicContact CD1-CD1 4.26Å; L144-L380 HydrophobicContact CD2-CD1 3.42Å; L144-L380 VanDerWaalsContact CD2-CD1 3.42Å; L144-L380 HydrophobicContact CG-CD1 3.56Å |
| 145 | A | 88.9 | Confident | 89.9 | Confident | 4 Ų | 4 | 26.1 Ų | 26.1 | 3% | 0.033 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -59.6 | -45.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | A60 I64 V141 I142 S143 G147 R148 Y149 | A60-A145 HydrophobicContact CB-CB 3.52Å; I64-A145 HydrophobicContact CD1-CB 4.02Å; V141-A145 PolarHBondContact O-N 2.73Å; V141-A145 VanDerWaalsContact O-N 3.17Å; I142-A145 PolarHBondContact O-N 3.09Å; S143-A145 VanDerWaalsContact C-N 3.32Å; S143-A145 PolarHBondContact O-N 3.11Å; A145-G147 PolarHBondContact O-N 2.87Å; A145-R148 PolarHBondContact O-N 3.49Å; A145-Y149 VanDerWaalsContact O-CD2 3.25Å; A145-Y149 WeakPolarHBondContact O-CD2 3.46Å; A145-Y149 PolarHBondContact O-N 2.95Å |
| 146 | F | 92.9 | Very high | 89.3 | Confident | 22 Ų | 22 | 30.3 Ų | 30.3 | 10% | 0.096 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -54.2 | -50.8 | 173.1 | 161.8 | -95.8 | 0 | 0 | 0 | 112 | I142 S143 L144 R148 Y149 I150 I168 A324 C327 F328 M331 | I142-F146 PolarHBondContact O-N 3.47Å; I142-F146 VanDerWaalsContact O-N 3.1Å; S143-F146 WeakPolarHBondContact O-CA 3.36Å; S143-F146 VanDerWaalsContact O-CB 3.28Å; S143-F146 WeakPolarHBondContact O-CB 3.2Å; S143-F146 PolarHBondContact O-N 3.4Å; S143-F146 VanDerWaalsContact O-N 3.16Å; L144-F146 VanDerWaalsContact C-N 3.34Å; L144-F146 PolarHBondContact O-N 2.78Å; F146-R148 VanDerWaalsContact C-N 3.31Å; F146-R148 PolarHBondContact O-N 3.13Å; F146-Y149 PolarHBondContact O-N 2.91Å; F146-I150 HydrophobicContact CE1-CG2 4.42Å; F146-I150 HydrophobicContact CE2-CB 4.43Å; F146-I150 HydrophobicContact CZ-CB 4.5Å; F146-I150 HydrophobicContact CZ-CG2 4.38Å; F146-I150 WeakPolarHBondContact O-CB 3.48Å; F146-I150 WeakPolarHBondContact O-CG2 3.49Å; F146-I150 PolarHBondContact O-N 3.4Å; F146-I168 HydrophobicContact CE1-CG2 4.41Å; F146-A324 HydrophobicContact CD2-CB 3.97Å; F146-A324 WeakPolarHBondContact CD2-O 3.29Å; F146-A324 HydrophobicContact CE2-CB 4.24Å; F146-C327 HydrophobicContact CB-CB 3.64Å; F146-F328 HydrophobicContact CD2-CB 4.17Å; F146-F328 HydrophobicContact CE2-CB 4.33Å; F146-F328 HydrophobicContact CE2-CD2 4.15Å; F146-F328 HydrophobicContact CZ-CD2 4.44Å; F146-M331 HydrophobicContact CB-CE 3.82Å; F146-M331 HydrophobicContact CD1-CE 4.05Å; F146-M331 HydrophobicContact CD2-CE 4.28Å; F146-M331 HydrophobicContact CG-CE 3.77Å |
| 147 | G | 92.7 | Very high | 88.8 | Confident | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.3 | -35.1 | -178 | 0 | 0 | 0 | 0 | 0 | 113.6 | S143 L144 A145 I150 L151 T169 | S143-G147 PolarHBondContact O-N 2.81Å; L144-G147 PolarHBondContact O-N 3.01Å; A145-G147 PolarHBondContact O-N 2.87Å; G147-I150 WeakPolarHBondContact O-CG2 3.34Å; G147-L151 WeakPolarHBondContact O-CB 3.22Å; G147-L151 WeakPolarHBondContact O-CG 3.38Å; G147-L151 PolarHBondContact O-N 3.13Å; G147-T169 WeakPolarHBondContact CA-OG1 3.36Å |
| 148 | R | 89.8 | Confident | 88.7 | Confident | 82 Ų | 82 | 43.4 Ų | 43.4 | 31% | 0.309 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -68.3 | -53.9 | 175.1 | -171.2 | 174.7 | -171.3 | 136.5 | 12.9 | 111.2 | L144 A145 F146 I150 L151 E152 I160 I165 N301 | L144-R148 PolarHBondContact O-N 3.48Å; A145-R148 PolarHBondContact O-N 3.49Å; F146-R148 VanDerWaalsContact C-N 3.31Å; F146-R148 PolarHBondContact O-N 3.13Å; R148-I150 VanDerWaalsContact C-N 3.34Å; R148-I150 PolarHBondContact O-N 2.75Å; R148-L151 PolarHBondContact O-N 3.36Å; R148-L151 VanDerWaalsContact O-N 3.13Å; R148-E152 PolarHBondContact O-N 2.91Å; R148-I160 HydrophobicContact CG-CD1 4.34Å; R148-I165 HydrophobicContact CB-CD1 4.38Å; R148-I165 HydrophobicContact CB-CG2 4.48Å; R148-I165 HydrophobicContact CG-CD1 4.3Å; R148-N301 PolarHBondContact NH2-ND2 2.91Å |
| 149 | Y | 89.9 | Confident | 88.5 | Confident | 6 Ų | 6 | 51.2 Ų | 51.2 | 2% | 0.024 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66 | -31.7 | -176.1 | -82.6 | -76.3 | 0 | 0 | 0 | 113.6 | F63 A145 F146 L151 A302 V305 P320 V323 | F63-Y149 HydrophobicContact CB-CE2 4.16Å; F63-Y149 WeakPolarHBondContact CB-OH 3.39Å; F63-Y149 PolarHBondContact O-OH 3.17Å; A145-Y149 VanDerWaalsContact O-CD2 3.25Å; A145-Y149 WeakPolarHBondContact O-CD2 3.46Å; A145-Y149 PolarHBondContact O-N 2.95Å; F146-Y149 PolarHBondContact O-N 2.91Å; Y149-L151 VanDerWaalsContact C-N 3.3Å; Y149-A302 HydrophobicContact CE1-CB 3.83Å; Y149-V305 HydrophobicContact CD1-CG2 4.16Å; Y149-V305 HydrophobicContact CE1-CG2 3.97Å; Y149-P320 HydrophobicContact CD1-CB 4.36Å; Y149-P320 WeakPolarHBondContact O-CB 3.3Å; Y149-V323 HydrophobicContact CD1-CB 3.86Å; Y149-V323 HydrophobicContact CD1-CG1 3.55Å; Y149-V323 HydrophobicContact CD1-CG2 4.48Å; Y149-V323 HydrophobicContact CD2-CG1 3.49Å; Y149-V323 VanDerWaalsContact CD2-CG1 3.49Å; Y149-V323 HydrophobicContact CE1-CB 4.25Å; Y149-V323 HydrophobicContact CE1-CG1 3.73Å; Y149-V323 HydrophobicContact CE1-CG2 4.48Å; Y149-V323 HydrophobicContact CE2-CG1 3.72Å; Y149-V323 HydrophobicContact CG-CB 4.04Å; Y149-V323 HydrophobicContact CG-CG1 3.44Å; Y149-V323 VanDerWaalsContact CG-CG1 3.44Å |
| 150 | I | 92.7 | Very high | 88.5 | Confident | 49 Ų | 49 | 51.6 Ų | 51.6 | 25% | 0.251 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -72.6 | -26.4 | 176.7 | -162 | 66.6 | 0 | 0 | 0 | 112.3 | F146 G147 R148 F154 I168 A324 | F146-I150 HydrophobicContact CE1-CG2 4.42Å; F146-I150 HydrophobicContact CE2-CB 4.43Å; F146-I150 HydrophobicContact CZ-CB 4.5Å; F146-I150 HydrophobicContact CZ-CG2 4.38Å; F146-I150 WeakPolarHBondContact O-CB 3.48Å; F146-I150 WeakPolarHBondContact O-CG2 3.49Å; F146-I150 PolarHBondContact O-N 3.4Å; G147-I150 WeakPolarHBondContact O-CG2 3.34Å; R148-I150 VanDerWaalsContact C-N 3.34Å; R148-I150 PolarHBondContact O-N 2.75Å; I150-F154 WeakPolarHBondContact O-CE2 3.45Å; I150-I168 HydrophobicContact CG2-CG2 3.47Å; I150-I168 VanDerWaalsContact CG2-CG2 3.47Å; I150-A324 HydrophobicContact CB-CB 3.95Å; I150-A324 HydrophobicContact CD1-CB 3.9Å |
| 151 | L | 91.9 | Very high | 88.5 | Confident | 20 Ų | 20 | 54.9 Ų | 54.9 | 11% | 0.105 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -87.2 | -25.6 | 178.9 | -75.3 | 177.2 | 0 | 0 | 0 | 113.1 | G147 R148 Y149 P153 F154 F155 I160 A164 I165 I168 | G147-L151 WeakPolarHBondContact O-CB 3.22Å; G147-L151 WeakPolarHBondContact O-CG 3.38Å; G147-L151 PolarHBondContact O-N 3.13Å; R148-L151 PolarHBondContact O-N 3.36Å; R148-L151 VanDerWaalsContact O-N 3.13Å; Y149-L151 VanDerWaalsContact C-N 3.3Å; L151-P153 VanDerWaalsContact C-N 3.34Å; L151-P153 VanDerWaalsContact O-N 3.16Å; L151-F154 WeakPolarHBondContact O-CB 3.29Å; L151-F154 PolarHBondContact O-N 3.33Å; L151-F155 HydrophobicContact CB-CD2 4.41Å; L151-F155 HydrophobicContact CD2-CE2 4.31Å; L151-F155 WeakPolarHBondContact O-CD2 3.4Å; L151-I160 HydrophobicContact CB-CD1 4.02Å; L151-I160 HydrophobicContact CB-CG2 4.1Å; L151-I160 HydrophobicContact CD1-CG2 3.78Å; L151-A164 HydrophobicContact CD1-CB 4.13Å; L151-I165 HydrophobicContact CD1-CG1 4.2Å; L151-I168 HydrophobicContact CD1-CB 4.33Å; L151-I168 HydrophobicContact CD1-CG1 4.12Å; L151-I168 HydrophobicContact CD2-CG1 4.12Å; L151-I168 HydrophobicContact CG-CG1 4.32Å |
| 152 | E | 87.6 | Confident | 88.6 | Confident | 37 Ų | 37 | 60.8 Ų | 60.8 | 17% | 0.173 | 30% | 0.3 | C | S | . | . | G | 310 helix | trans | -46.3 | -46.2 | -177.3 | -152.9 | 81.5 | -176.6 | 0 | 0 | 114.5 | R148 F154 F155 I156 I160 V305 P320 | R148-E152 PolarHBondContact O-N 2.91Å; E152-F154 PolarHBondContact O-N 3.29Å; E152-F154 VanDerWaalsContact O-N 3.09Å; E152-F155 CarbonylContact O-C 3.55Å; E152-F155 PolarHBondContact O-N 2.86Å; E152-I156 PolarHBondContact O-N 2.93Å; E152-I160 WeakPolarHBondContact OE2-CD1 3.33Å; E152-V305 HydrophobicContact CG-CG1 4.16Å; E152-V305 HydrophobicContact CG-CG2 4.18Å; E152-P320 HydrophobicContact CB-CB 4.17Å |
| 153 | P | 86.8 | Confident | 88.7 | Confident | 29 Ų | 29 | 64.9 Ų | 64.9 | 19% | 0.188 | 32% | 0.321 | C | S | . | . | G | 310 helix | trans | -61.2 | -22.9 | 179.7 | -24.4 | 36.3 | 0 | 0 | 0 | 114.6 | L151 I156 L317 P320 | L151-P153 VanDerWaalsContact C-N 3.34Å; L151-P153 VanDerWaalsContact O-N 3.16Å; P153-I156 WeakPolarHBondContact O-CD1 3.4Å; P153-I156 WeakPolarHBondContact O-CG1 3.26Å; P153-L317 HydrophobicContact CB-CD2 4.35Å; P153-P320 HydrophobicContact CG-CB 4.08Å; P153-P320 HydrophobicContact CG-CG 3.65Å |
| 154 | F | 88.6 | Confident | 88.8 | Confident | 161 Ų | 161 | 66.3 Ų | 66.3 | 71% | 0.706 | 33% | 0.333 | S | S | * | . | G | 310 helix | trans | -90.4 | -11.6 | -178.9 | -56.9 | -79.7 | 0 | 0 | 0 | 112.7 | I150 L151 E152 | I150-F154 WeakPolarHBondContact O-CE2 3.45Å; L151-F154 WeakPolarHBondContact O-CB 3.29Å; L151-F154 PolarHBondContact O-N 3.33Å; E152-F154 PolarHBondContact O-N 3.29Å; E152-F154 VanDerWaalsContact O-N 3.09Å |
| 155 | F | 87.8 | Confident | 88.9 | Confident | 66 Ų | 66 | 66.3 Ų | 66.3 | 29% | 0.289 | 33% | 0.333 | S | S | . | . | trans | -130.5 | 33 | -173.1 | -70.8 | -92 | 0 | 0 | 0 | 112.1 | L151 E152 Q157 C158 I160 | L151-F155 HydrophobicContact CB-CD2 4.41Å; L151-F155 HydrophobicContact CD2-CE2 4.31Å; L151-F155 WeakPolarHBondContact O-CD2 3.4Å; E152-F155 CarbonylContact O-C 3.55Å; E152-F155 PolarHBondContact O-N 2.86Å; F155-Q157 PolarHBondContact O-N 3.27Å; F155-C158 HydrophobicContact CD1-CB 4.23Å; F155-C158 PolarHBondContact O-N 3.5Å; F155-I160 HydrophobicContact CB-CD1 4.45Å; F155-I160 HydrophobicContact CB-CG1 3.54Å; F155-I160 HydrophobicContact CD2-CG1 4.09Å; F155-I160 HydrophobicContact CD2-CG2 4.36Å; F155-I160 HydrophobicContact CG-CB 4.48Å; F155-I160 HydrophobicContact CG-CG1 3.82Å | ||
| 156 | I | 77.1 | Confident | 89.1 | Confident | 95 Ų | 95 | 67.6 Ų | 67.6 | 49% | 0.487 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -34.2 | -175 | -58.8 | 168 | 0 | 0 | 0 | 113.1 | E152 P153 L317 | E152-I156 PolarHBondContact O-N 2.93Å; P153-I156 WeakPolarHBondContact O-CD1 3.4Å; P153-I156 WeakPolarHBondContact O-CG1 3.26Å; I156-L317 HydrophobicContact CD1-CD2 3.65Å |
| 157 | Q | 79.9 | Confident | 89.3 | Confident | 189 Ų | 189 | 71 Ų | 71 | 88% | 0.883 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.7 | 2.5 | -177 | -63.5 | -178 | -13.5 | 0 | 0 | 113.8 | F155 | F155-Q157 PolarHBondContact O-N 3.27Š|
| 158 | C | 85.5 | Confident | 89.4 | Confident | 86 Ų | 86 | 74.1 Ų | 74.1 | 58% | 0.581 | 37% | 0.373 | S | S | * | . | S | Bend | trans | -135.4 | 150.8 | -170.8 | -65.7 | 0 | 0 | 0 | 0 | 111.1 | F155 I160 | F155-C158 HydrophobicContact CD1-CB 4.23Å; F155-C158 PolarHBondContact O-N 3.5Å; C158-I160 PolarHBondContact O-N 3.21Å |
| 159 | E | 85.8 | Confident | 89.7 | Confident | 172 Ų | 172 | 70.2 Ų | 70.2 | 80% | 0.804 | 36% | 0.358 | S | S | * | . | P | Polyproline II helix | trans | -70.5 | 133.3 | 170.8 | -166.7 | 169.2 | -167.4 | 0 | 0 | 110.3 | P161 | E159-P161 WeakPolarHBondContact O-CD 2.95Š|
| 160 | I | 88.9 | Confident | 90 | Very high | 18 Ų | 18 | 70.6 Ų | 70.6 | 9% | 0.092 | 36% | 0.362 | C | S | . | . | P | Polyproline II helix | trans | -74.3 | 125.1 | 179.2 | -54.6 | 165.8 | 0 | 0 | 0 | 108.6 | R148 L151 E152 F155 C158 E162 I165 | R148-I160 HydrophobicContact CG-CD1 4.34Å; L151-I160 HydrophobicContact CB-CD1 4.02Å; L151-I160 HydrophobicContact CB-CG2 4.1Å; L151-I160 HydrophobicContact CD1-CG2 3.78Å; E152-I160 WeakPolarHBondContact OE2-CD1 3.33Å; F155-I160 HydrophobicContact CB-CD1 4.45Å; F155-I160 HydrophobicContact CB-CG1 3.54Å; F155-I160 HydrophobicContact CD2-CG1 4.09Å; F155-I160 HydrophobicContact CD2-CG2 4.36Å; F155-I160 HydrophobicContact CG-CB 4.48Å; F155-I160 HydrophobicContact CG-CG1 3.82Å; C158-I160 PolarHBondContact O-N 3.21Å; I160-E162 PolarHBondContact O-N 3.14Å; I160-I165 HydrophobicContact CB-CD1 4.13Å; I160-I165 HydrophobicContact CB-CG1 4.26Å; I160-I165 HydrophobicContact CG2-CD1 3.96Å; I160-I165 HydrophobicContact CG2-CG1 3.52Å |
| 161 | P | 92.3 | Very high | 90.1 | Very high | 68 Ų | 68 | 72.6 Ų | 72.6 | 44% | 0.442 | 38% | 0.377 | S | S | . | . | P | Polyproline II helix | trans | -59.5 | 131.5 | 175.8 | -23.2 | 33.4 | 0 | 0 | 0 | 111.8 | E159 L163 A164 I165 | E159-P161 WeakPolarHBondContact O-CD 2.95Å; P161-L163 PolarHBondContact O-N 3.49Å; P161-A164 HydrophobicContact CB-CB 4.24Å; P161-A164 WeakPolarHBondContact O-CB 3.31Å; P161-A164 PolarHBondContact O-N 3.01Å; P161-I165 PolarHBondContact O-N 3.4Å |
| 162 | E | 89.7 | Confident | 90.3 | Very high | 125 Ų | 125 | 72 Ų | 72 | 58% | 0.584 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -56.9 | -38.9 | -177.4 | -167.9 | -167.9 | 156.6 | 0 | 0 | 112.4 | I160 A164 I165 K166 | I160-E162 PolarHBondContact O-N 3.14Å; E162-A164 VanDerWaalsContact C-N 3.31Å; E162-A164 PolarHBondContact O-N 3Å; E162-I165 WeakPolarHBondContact O-CB 3.46Å; E162-I165 PolarHBondContact O-N 2.96Å; E162-K166 PolarHBondContact O-N 3.47Å; E162-K166 WeakPolarHBondContact OE1-CE 3.48Å; E162-K166 IonicContact OE1-NZ 3.58Å; E162-K166 PolarHBondContact OE1-NZ 3.41Å |
| 163 | L | 92.3 | Very high | 90.6 | Very high | 114 Ų | 114 | 70.2 Ų | 70.2 | 60% | 0.597 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -62.2 | -38 | 176.9 | -174 | 64.2 | 0 | 0 | 0 | 112 | P161 K166 L167 | P161-L163 PolarHBondContact O-N 3.49Å; L163-K166 PolarHBondContact O-N 3.13Å; L163-L167 HydrophobicContact CD1-CD1 4.47Å; L163-L167 HydrophobicContact CD1-CG 4.36Å; L163-L167 HydrophobicContact CG-CD1 4.07Å; L163-L167 HydrophobicContact CG-CG 4.38Å; L163-L167 WeakPolarHBondContact O-CB 3.39Å; L163-L167 VanDerWaalsContact O-CG 3.26Å; L163-L167 WeakPolarHBondContact O-CG 3.12Å; L163-L167 PolarHBondContact O-N 2.92Å |
| 164 | A | 94.1 | Very high | 91 | Very high | 29 Ų | 29 | 71.3 Ų | 71.3 | 24% | 0.24 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -65.5 | -42.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | L151 P161 E162 L167 I168 | L151-A164 HydrophobicContact CD1-CB 4.13Å; P161-A164 HydrophobicContact CB-CB 4.24Å; P161-A164 WeakPolarHBondContact O-CB 3.31Å; P161-A164 PolarHBondContact O-N 3.01Å; E162-A164 VanDerWaalsContact C-N 3.31Å; E162-A164 PolarHBondContact O-N 3Å; A164-L167 PolarHBondContact O-N 3.14Å; A164-I168 WeakPolarHBondContact O-CB 3.36Å; A164-I168 WeakPolarHBondContact O-CG1 3.26Å; A164-I168 PolarHBondContact O-N 3.44Å |
| 165 | I | 92.3 | Very high | 91.2 | Very high | 21 Ų | 21 | 66.8 Ų | 66.8 | 11% | 0.108 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -58 | -51.2 | 173.5 | -61.4 | 174.9 | 0 | 0 | 0 | 109.8 | L144 R148 L151 I160 P161 E162 L167 T169 | L144-I165 HydrophobicContact CD2-CG2 4.14Å; R148-I165 HydrophobicContact CB-CD1 4.38Å; R148-I165 HydrophobicContact CB-CG2 4.48Å; R148-I165 HydrophobicContact CG-CD1 4.3Å; L151-I165 HydrophobicContact CD1-CG1 4.2Å; I160-I165 HydrophobicContact CB-CD1 4.13Å; I160-I165 HydrophobicContact CB-CG1 4.26Å; I160-I165 HydrophobicContact CG2-CD1 3.96Å; I160-I165 HydrophobicContact CG2-CG1 3.52Å; P161-I165 PolarHBondContact O-N 3.4Å; E162-I165 WeakPolarHBondContact O-CB 3.46Å; E162-I165 PolarHBondContact O-N 2.96Å; I165-L167 PolarHBondContact O-N 3.39Å; I165-T169 WeakPolarHBondContact O-CB 3.46Å; I165-T169 PolarHBondContact O-N 3.16Å; I165-T169 PolarHBondContact O-OG1 3.05Å |
| 166 | K | 93.4 | Very high | 91.4 | Very high | 30 Ų | 30 | 63.7 Ų | 63.7 | 13% | 0.13 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.6 | -42.2 | -178.6 | -74.4 | 179.8 | 174.3 | 171.4 | 0 | 112.4 | L144 E162 L163 T169 A170 F381 | L144-K166 HydrophobicContact CD2-CG 4.28Å; E162-K166 PolarHBondContact O-N 3.47Å; E162-K166 WeakPolarHBondContact OE1-CE 3.48Å; E162-K166 IonicContact OE1-NZ 3.58Å; E162-K166 PolarHBondContact OE1-NZ 3.41Å; L163-K166 PolarHBondContact O-N 3.13Å; K166-T169 WeakPolarHBondContact O-CB 3.48Å; K166-T169 PolarHBondContact O-N 2.95Å; K166-A170 WeakPolarHBondContact O-CB 3.32Å; K166-A170 PolarHBondContact O-N 2.87Å; K166-F381 HydrophobicContact CB-CD1 4.32Å; K166-F381 HydrophobicContact CB-CE1 3.92Å; K166-F381 HydrophobicContact CD-CD1 4.06Å; K166-F381 HydrophobicContact CD-CE1 4.48Å; K166-F381 PolarHBondContact NZ-O 3.33Å |
| 167 | L | 95.6 | Very high | 92 | Very high | 94 Ų | 94 | 59.5 Ų | 59.5 | 49% | 0.492 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -67.3 | -47.6 | 179.3 | -70.7 | 175 | 0 | 0 | 0 | 112.5 | L163 A164 I165 T169 A170 V171 | L163-L167 HydrophobicContact CD1-CD1 4.47Å; L163-L167 HydrophobicContact CD1-CG 4.36Å; L163-L167 HydrophobicContact CG-CD1 4.07Å; L163-L167 HydrophobicContact CG-CG 4.38Å; L163-L167 WeakPolarHBondContact O-CB 3.39Å; L163-L167 VanDerWaalsContact O-CG 3.26Å; L163-L167 WeakPolarHBondContact O-CG 3.12Å; L163-L167 PolarHBondContact O-N 2.92Å; A164-L167 PolarHBondContact O-N 3.14Å; I165-L167 PolarHBondContact O-N 3.39Å; L167-T169 VanDerWaalsContact C-N 3.29Å; L167-T169 PolarHBondContact O-N 3.38Å; L167-A170 WeakPolarHBondContact O-CB 3.25Å; L167-A170 PolarHBondContact O-N 2.78Å; L167-V171 WeakPolarHBondContact O-CG2 3.45Å; L167-V171 PolarHBondContact O-N 3.11Å |
| 168 | I | 95.9 | Very high | 92.4 | Very high | 66 Ų | 66 | 54 Ų | 54 | 34% | 0.338 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.9 | -37.7 | 176.5 | -69.4 | -64.5 | 0 | 0 | 0 | 111.2 | F146 I150 L151 A164 V171 G172 | F146-I168 HydrophobicContact CE1-CG2 4.41Å; I150-I168 HydrophobicContact CG2-CG2 3.47Å; I150-I168 VanDerWaalsContact CG2-CG2 3.47Å; L151-I168 HydrophobicContact CD1-CB 4.33Å; L151-I168 HydrophobicContact CD1-CG1 4.12Å; L151-I168 HydrophobicContact CD2-CG1 4.12Å; L151-I168 HydrophobicContact CG-CG1 4.32Å; A164-I168 WeakPolarHBondContact O-CB 3.36Å; A164-I168 WeakPolarHBondContact O-CG1 3.26Å; A164-I168 PolarHBondContact O-N 3.44Å; I168-V171 PolarHBondContact O-N 3.35Å; I168-G172 PolarHBondContact O-N 3.19Å |
| 169 | T | 95.2 | Very high | 92.5 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58.9 | -47 | 172.6 | -62.8 | 0 | 0 | 0 | 0 | 111.3 | S143 G147 I165 K166 L167 V171 G172 L173 L380 | S143-T169 VanDerWaalsContact CB-CG2 3.4Å; S143-T169 WeakPolarHBondContact O-CG2 3.47Å; S143-T169 PolarHBondContact O-OG1 3.43Å; S143-T169 WeakPolarHBondContact OG-CG2 3.5Å; G147-T169 WeakPolarHBondContact CA-OG1 3.36Å; I165-T169 WeakPolarHBondContact O-CB 3.46Å; I165-T169 PolarHBondContact O-N 3.16Å; I165-T169 PolarHBondContact O-OG1 3.05Å; K166-T169 WeakPolarHBondContact O-CB 3.48Å; K166-T169 PolarHBondContact O-N 2.95Å; L167-T169 VanDerWaalsContact C-N 3.29Å; L167-T169 PolarHBondContact O-N 3.38Å; T169-V171 VanDerWaalsContact C-N 3.33Å; T169-V171 PolarHBondContact O-N 3.43Å; T169-G172 PolarHBondContact O-N 3.49Å; T169-L173 VanDerWaalsContact O-CB 3.29Å; T169-L173 WeakPolarHBondContact O-CB 3.29Å; T169-L173 PolarHBondContact O-N 3.19Å; T169-L380 HydrophobicContact CG2-CD1 3.4Å; T169-L380 VanDerWaalsContact CG2-CD1 3.4Å; T169-L380 HydrophobicContact CG2-CD2 3.84Å; T169-L380 HydrophobicContact CG2-CG 4.28Å |
| 170 | A | 95.9 | Very high | 92.5 | Very high | 14 Ų | 14 | 44.4 Ų | 44.4 | 12% | 0.116 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -60 | -42.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | K166 L167 T174 M377 L380 F381 | K166-A170 WeakPolarHBondContact O-CB 3.32Å; K166-A170 PolarHBondContact O-N 2.87Å; L167-A170 WeakPolarHBondContact O-CB 3.25Å; L167-A170 PolarHBondContact O-N 2.78Å; A170-T174 WeakPolarHBondContact O-CB 3.47Å; A170-T174 PolarHBondContact O-N 2.9Å; A170-T174 PolarHBondContact O-OG1 3.36Å; A170-M377 HydrophobicContact CB-CE 3.75Å; A170-M377 HydrophobicContact CB-SD 3.88Å; A170-M377 WeakPolarHBondContact O-CE 3.13Å; A170-L380 HydrophobicContact CB-CD2 3.95Å; A170-F381 HydrophobicContact CB-CZ 4.42Å |
| 171 | V | 96.4 | Very high | 92.3 | Very high | 91 Ų | 91 | 44.3 Ų | 44.3 | 55% | 0.552 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -61.5 | -51.5 | 174.7 | 174.4 | 0 | 0 | 0 | 0 | 110.7 | L167 I168 T169 L173 T174 V175 | L167-V171 WeakPolarHBondContact O-CG2 3.45Å; L167-V171 PolarHBondContact O-N 3.11Å; I168-V171 PolarHBondContact O-N 3.35Å; T169-V171 VanDerWaalsContact C-N 3.33Å; T169-V171 PolarHBondContact O-N 3.43Å; V171-L173 PolarHBondContact O-N 3.19Å; V171-T174 WeakPolarHBondContact O-CB 3.41Å; V171-T174 PolarHBondContact O-N 3.01Å; V171-T174 VanDerWaalsContact O-N 3.17Å; V171-V175 WeakPolarHBondContact O-CG2 3.3Å; V171-V175 PolarHBondContact O-N 3.28Å |
| 172 | G | 94.9 | Very high | 92 | Very high | 6 Ų | 6 | 46 Ų | 46 | 6% | 0.062 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59.3 | -44.7 | 180 | 0 | 0 | 0 | 0 | 0 | 112.9 | I168 T169 T174 V175 V176 | I168-G172 PolarHBondContact O-N 3.19Å; T169-G172 PolarHBondContact O-N 3.49Å; G172-T174 PolarHBondContact O-N 3.39Å; G172-V175 PolarHBondContact O-N 3.48Å; G172-V176 WeakPolarHBondContact O-CG2 3.25Å; G172-V176 PolarHBondContact O-N 3.04Å |
| 173 | L | 94.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.6 | -45.3 | 174.9 | 178.2 | 63.3 | 0 | 0 | 0 | 111.6 | T139 T169 V171 V175 V176 M177 T376 M377 | T139-L173 HydrophobicContact CG2-CD1 3.62Å; T169-L173 VanDerWaalsContact O-CB 3.29Å; T169-L173 WeakPolarHBondContact O-CB 3.29Å; T169-L173 PolarHBondContact O-N 3.19Å; V171-L173 PolarHBondContact O-N 3.19Å; L173-V175 VanDerWaalsContact C-N 3.33Å; L173-V175 PolarHBondContact O-N 2.98Å; L173-V176 PolarHBondContact O-N 3Å; L173-M177 HydrophobicContact CD1-CE 3.81Å; L173-M177 VanDerWaalsContact O-CG 3.29Å; L173-M177 WeakPolarHBondContact O-CG 3.31Å; L173-M177 PolarHBondContact O-N 2.8Å; L173-T376 HydrophobicContact CD1-CG2 4.15Å; L173-T376 HydrophobicContact CD2-CG2 3.47Å; L173-T376 VanDerWaalsContact CD2-CG2 3.47Å; L173-T376 HydrophobicContact CG-CG2 4.45Å; L173-M377 HydrophobicContact CD2-CE 4.03Å; L173-M377 HydrophobicContact CD2-SD 4.28Å |
| 174 | T | 94.5 | Very high | 90.7 | Very high | 52 Ų | 52 | 37.4 Ų | 37.4 | 32% | 0.319 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -61.4 | -43.3 | 178.4 | -55.7 | 0 | 0 | 0 | 0 | 111 | A170 V171 G172 V176 M177 V178 H373 M377 | A170-T174 WeakPolarHBondContact O-CB 3.47Å; A170-T174 PolarHBondContact O-N 2.9Å; A170-T174 PolarHBondContact O-OG1 3.36Å; V171-T174 WeakPolarHBondContact O-CB 3.41Å; V171-T174 PolarHBondContact O-N 3.01Å; V171-T174 VanDerWaalsContact O-N 3.17Å; G172-T174 PolarHBondContact O-N 3.39Å; T174-V176 PolarHBondContact O-N 3.25Å; T174-M177 PolarHBondContact O-N 2.84Å; T174-V178 HydrophobicContact CG2-CG2 4.46Å; T174-V178 WeakPolarHBondContact O-CG2 3.25Å; T174-V178 PolarHBondContact O-N 3.38Å; T174-H373 PolarHBondContact OG1-CE1 2.81Å; T174-M377 WeakPolarHBondContact OG1-CE 3.41Å |
| 175 | V | 93.4 | Very high | 90 | Very high | 67 Ų | 67 | 38.4 Ų | 38.4 | 41% | 0.406 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -59.6 | -45.9 | 175.7 | 172.2 | 0 | 0 | 0 | 0 | 111 | V171 G172 L173 M177 V178 L179 F328 | V171-V175 WeakPolarHBondContact O-CG2 3.3Å; V171-V175 PolarHBondContact O-N 3.28Å; G172-V175 PolarHBondContact O-N 3.48Å; L173-V175 VanDerWaalsContact C-N 3.33Å; L173-V175 PolarHBondContact O-N 2.98Å; V175-M177 VanDerWaalsContact C-N 3.32Å; V175-M177 PolarHBondContact O-N 2.73Å; V175-V178 PolarHBondContact O-N 3.25Å; V175-L179 HydrophobicContact CG1-CD1 3.94Å; V175-L179 HydrophobicContact CG1-CG 4.32Å; V175-L179 WeakPolarHBondContact O-CB 3.31Å; V175-L179 VanDerWaalsContact O-CG 3.29Å; V175-L179 WeakPolarHBondContact O-CG 3.21Å; V175-L179 PolarHBondContact O-N 3.47Å; V175-F328 HydrophobicContact CG1-CE2 4.25Å; V175-F328 HydrophobicContact CG1-CZ 4.09Å |
| 176 | V | 91.5 | Very high | 89.5 | Confident | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -59.1 | -44.2 | 176.5 | 173.2 | 0 | 0 | 0 | 0 | 111.4 | G172 L173 T174 L179 N180 F328 M331 N332 V335 | G172-V176 WeakPolarHBondContact O-CG2 3.25Å; G172-V176 PolarHBondContact O-N 3.04Å; L173-V176 PolarHBondContact O-N 3Å; T174-V176 PolarHBondContact O-N 3.25Å; V176-L179 PolarHBondContact O-N 3.05Å; V176-N180 PolarHBondContact O-N 3.41Å; V176-N180 PolarHBondContact O-ND2 2.72Å; V176-F328 HydrophobicContact CG2-CD1 4.3Å; V176-F328 HydrophobicContact CG2-CD2 3.77Å; V176-F328 HydrophobicContact CG2-CE1 3.98Å; V176-F328 HydrophobicContact CG2-CE2 3.39Å; V176-F328 HydrophobicContact CG2-CG 4.22Å; V176-F328 HydrophobicContact CG2-CZ 3.51Å; V176-M331 HydrophobicContact CG1-CB 4.08Å; V176-M331 HydrophobicContact CG2-CB 4.11Å; V176-M331 HydrophobicContact CG2-CE 4.2Å; V176-N332 HydrophobicContact CG1-CB 4.18Å; V176-V335 HydrophobicContact CG1-CG2 4.22Å |
| 177 | M | 89.8 | Confident | 89 | Confident | 8 Ų | 8 | 43.6 Ų | 43.6 | 4% | 0.039 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.2 | -42.2 | 179.1 | -66.5 | -68.5 | -178.6 | 0 | 0 | 111.6 | L173 T174 V175 N180 S181 V335 V369 L372 H373 | L173-M177 HydrophobicContact CD1-CE 3.81Å; L173-M177 VanDerWaalsContact O-CG 3.29Å; L173-M177 WeakPolarHBondContact O-CG 3.31Å; L173-M177 PolarHBondContact O-N 2.8Å; T174-M177 PolarHBondContact O-N 2.84Å; V175-M177 VanDerWaalsContact C-N 3.32Å; V175-M177 PolarHBondContact O-N 2.73Å; M177-N180 PolarHBondContact O-N 2.9Å; M177-S181 VanDerWaalsContact O-CB 3.28Å; M177-S181 WeakPolarHBondContact O-CB 3.33Å; M177-S181 PolarHBondContact O-N 2.73Å; M177-S181 PolarHBondContact O-OG 2.69Å; M177-V335 HydrophobicContact CE-CG2 3.65Å; M177-V335 HydrophobicContact SD-CB 4.5Å; M177-V335 HydrophobicContact SD-CG1 3.83Å; M177-V335 HydrophobicContact SD-CG2 3.76Å; M177-V369 HydrophobicContact CB-CG1 4.17Å; M177-V369 HydrophobicContact SD-CG1 3.64Å; M177-L372 HydrophobicContact CE-CB 4.5Å; M177-L372 HydrophobicContact CE-CD2 4.02Å; M177-L372 HydrophobicContact CE-CG 4.1Å; M177-H373 HydrophobicContact CG-CB 4.34Å |
| 178 | V | 89.8 | Confident | 88.3 | Confident | 72 Ų | 72 | 40.7 Ų | 40.7 | 44% | 0.436 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63.6 | -45.2 | 176.2 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | T174 V175 N180 S181 M182 | T174-V178 HydrophobicContact CG2-CG2 4.46Å; T174-V178 WeakPolarHBondContact O-CG2 3.25Å; T174-V178 PolarHBondContact O-N 3.38Å; V175-V178 PolarHBondContact O-N 3.25Å; V178-N180 PolarHBondContact O-N 2.69Å; V178-S181 CarbonylContact O-C 3.6Å; V178-S181 WeakPolarHBondContact O-CA 3.5Å; V178-S181 WeakPolarHBondContact O-CB 3.28Å; V178-S181 PolarHBondContact O-N 2.84Å; V178-S181 VanDerWaalsContact O-N 3.1Å; V178-M182 HydrophobicContact CG1-CG 4.17Å; V178-M182 HydrophobicContact CG1-SD 3.73Å; V178-M182 VanDerWaalsContact O-CG 3.3Å; V178-M182 WeakPolarHBondContact O-CG 3.49Å; V178-M182 PolarHBondContact O-N 2.93Å |
| 179 | L | 87.8 | Confident | 87.8 | Confident | 47 Ų | 47 | 44.8 Ų | 44.8 | 25% | 0.246 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.8 | -44.4 | 178.3 | -72.4 | 172.2 | 0 | 0 | 0 | 112.1 | V175 V176 S181 M182 S183 I190 F328 | V175-L179 HydrophobicContact CG1-CD1 3.94Å; V175-L179 HydrophobicContact CG1-CG 4.32Å; V175-L179 WeakPolarHBondContact O-CB 3.31Å; V175-L179 VanDerWaalsContact O-CG 3.29Å; V175-L179 WeakPolarHBondContact O-CG 3.21Å; V175-L179 PolarHBondContact O-N 3.47Å; V176-L179 PolarHBondContact O-N 3.05Å; L179-S181 VanDerWaalsContact C-N 3.26Å; L179-S181 PolarHBondContact O-N 3.46Å; L179-M182 PolarHBondContact O-N 3.26Å; L179-S183 PolarHBondContact O-N 3.3Å; L179-I190 HydrophobicContact CD1-CD1 4.29Å; L179-I190 HydrophobicContact CD2-CD1 4.2Å; L179-F328 HydrophobicContact CD1-CE1 4.25Å; L179-F328 HydrophobicContact CD1-CZ 3.89Å |
| 180 | N | 85.6 | Confident | 87.3 | Confident | 10 Ų | 10 | 46.9 Ų | 46.9 | 5% | 0.053 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.8 | -28.2 | 176.8 | -79 | -76.6 | 0 | 0 | 0 | 112.9 | V176 M177 V178 S187 N332 V335 | V176-N180 PolarHBondContact O-N 3.41Å; V176-N180 PolarHBondContact O-ND2 2.72Å; M177-N180 PolarHBondContact O-N 2.9Å; V178-N180 PolarHBondContact O-N 2.69Å; N180-S187 PolarHBondContact OD1-OG 2.86Å; N180-N332 PolarHBondContact ND2-OD1 2.85Å; N180-V335 HydrophobicContact CB-CG1 3.86Å |
| 181 | S | 84.7 | Confident | 86.9 | Confident | 16 Ų | 16 | 46.6 Ų | 46.6 | 11% | 0.112 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -76 | -31.4 | 175.9 | -65.1 | 0 | 0 | 0 | 0 | 113.1 | M177 V178 L179 T364 L366 | M177-S181 VanDerWaalsContact O-CB 3.28Å; M177-S181 WeakPolarHBondContact O-CB 3.33Å; M177-S181 PolarHBondContact O-N 2.73Å; M177-S181 PolarHBondContact O-OG 2.69Å; V178-S181 CarbonylContact O-C 3.6Å; V178-S181 WeakPolarHBondContact O-CA 3.5Å; V178-S181 WeakPolarHBondContact O-CB 3.28Å; V178-S181 PolarHBondContact O-N 2.84Å; V178-S181 VanDerWaalsContact O-N 3.1Å; L179-S181 VanDerWaalsContact C-N 3.26Å; L179-S181 PolarHBondContact O-N 3.46Å; S181-T364 PolarHBondContact O-OG1 3.01Å; S181-L366 VanDerWaalsContact CB-CD1 3.45Å; S181-L366 WeakPolarHBondContact OG-CD1 3.28Å |
| 182 | M | 85 | Confident | 86.4 | Confident | 104 Ų | 104 | 45.7 Ų | 45.7 | 51% | 0.512 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -79.3 | -47 | -174.8 | -76.3 | 179.5 | 73.4 | 0 | 0 | 113.9 | V178 L179 K362 | V178-M182 HydrophobicContact CG1-CG 4.17Å; V178-M182 HydrophobicContact CG1-SD 3.73Å; V178-M182 VanDerWaalsContact O-CG 3.3Å; V178-M182 WeakPolarHBondContact O-CG 3.49Å; V178-M182 PolarHBondContact O-N 2.93Å; L179-M182 PolarHBondContact O-N 3.26Å; M182-K362 WeakPolarHBondContact O-CB 3.45Å; M182-K362 WeakPolarHBondContact O-CD 3.14Å; M182-K362 WeakPolarHBondContact O-CG 3.45Å |
| 183 | S | 80.3 | Confident | 86.1 | Confident | 27 Ų | 27 | 51.4 Ų | 51.4 | 19% | 0.189 | 26% | 0.262 | C | S | . | . | trans | -162.6 | 124.1 | 179.6 | -179 | 0 | 0 | 0 | 0 | 112.7 | L179 S185 W186 S187 | L179-S183 PolarHBondContact O-N 3.3Å; S183-S185 VanDerWaalsContact C-N 3.28Å; S183-S185 PolarHBondContact O-N 3.38Å; S183-S185 PolarHBondContact OG-N 3.01Å; S183-W186 PolarHBondContact O-N 3.16Å; S183-S187 PolarHBondContact O-N 2.9Å | ||
| 184 | V | 75 | Confident | 86 | Confident | 31 Ų | 31 | 51.7 Ų | 51.7 | 19% | 0.188 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -56.6 | -41.6 | 172.5 | 163.8 | 0 | 0 | 0 | 0 | 111.8 | S187 A188 F336 T364 | V184-S187 PolarHBondContact O-N 3.39Å; V184-A188 WeakPolarHBondContact O-CB 3.35Å; V184-A188 PolarHBondContact O-N 2.85Å; V184-F336 HydrophobicContact CG1-CE2 3.9Å; V184-F336 HydrophobicContact CG1-CZ 4.41Å; V184-T364 HydrophobicContact CG2-CG2 3.82Å |
| 185 | S | 79.4 | Confident | 85.6 | Confident | 50 Ų | 50 | 49.6 Ų | 49.6 | 35% | 0.35 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -68.4 | -39.8 | -176.5 | -59.1 | 0 | 0 | 0 | 0 | 112.1 | S183 R189 | S183-S185 VanDerWaalsContact C-N 3.28Å; S183-S185 PolarHBondContact O-N 3.38Å; S183-S185 PolarHBondContact OG-N 3.01Å; S185-R189 WeakPolarHBondContact O-CG 3.22Å; S185-R189 PolarHBondContact O-N 3.23Å; S185-R189 VanDerWaalsContact O-N 3.07Å |
| 186 | W | 82 | Confident | 85.4 | Confident | 158 Ų | 158 | 53.1 Ų | 53.1 | 60% | 0.598 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -69 | -44.6 | 175.4 | -78.4 | 106.4 | 0 | 0 | 0 | 111.7 | S183 A188 R189 I190 | S183-W186 PolarHBondContact O-N 3.16Å; W186-A188 VanDerWaalsContact C-N 3.27Å; W186-A188 PolarHBondContact O-N 2.99Å; W186-R189 PolarHBondContact O-N 3.02Å; W186-R189 VanDerWaalsContact O-N 3.15Å; W186-I190 WeakPolarHBondContact O-CB 3.38Å; W186-I190 WeakPolarHBondContact O-CG1 3.32Å; W186-I190 PolarHBondContact O-N 3.44Å |
| 187 | S | 82.6 | Confident | 85.3 | Confident | 2 Ų | 2 | 53.5 Ų | 53.5 | 1% | 0.014 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -55.2 | -43.2 | 174.2 | 174.1 | 0 | 0 | 0 | 0 | 111.6 | N180 S183 V184 I190 Q191 N332 | N180-S187 PolarHBondContact OD1-OG 2.86Å; S183-S187 PolarHBondContact O-N 2.9Å; V184-S187 PolarHBondContact O-N 3.39Å; S187-I190 PolarHBondContact O-N 3.48Å; S187-Q191 WeakPolarHBondContact O-CB 3.2Å; S187-Q191 PolarHBondContact O-N 2.94Å; S187-N332 PolarHBondContact O-ND2 3.43Å; S187-N332 PolarHBondContact OG-ND2 3.39Å; S187-N332 PolarHBondContact OG-OD1 3.4Å; S187-N332 VanDerWaalsContact OG-OD1 3.08Å |
| 188 | A | 79.9 | Confident | 85.2 | Confident | 33 Ų | 33 | 53.1 Ų | 53.1 | 27% | 0.273 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.9 | -40.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | V184 W186 Q191 I192 | V184-A188 WeakPolarHBondContact O-CB 3.35Å; V184-A188 PolarHBondContact O-N 2.85Å; W186-A188 VanDerWaalsContact C-N 3.27Å; W186-A188 PolarHBondContact O-N 2.99Å; A188-Q191 WeakPolarHBondContact O-CB 3.21Å; A188-Q191 PolarHBondContact O-N 3.49Å; A188-I192 WeakPolarHBondContact O-CG1 3.45Å; A188-I192 PolarHBondContact O-N 3.04Å; A188-I192 VanDerWaalsContact O-N 3.17Å |
| 189 | R | 85.1 | Confident | 85.2 | Confident | 152 Ų | 152 | 52.4 Ų | 52.4 | 57% | 0.574 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -65.6 | -44 | 176.1 | -72.7 | 174.5 | -175.2 | 176 | -0 | 111.7 | S185 W186 Q191 I192 F193 | S185-R189 WeakPolarHBondContact O-CG 3.22Å; S185-R189 PolarHBondContact O-N 3.23Å; S185-R189 VanDerWaalsContact O-N 3.07Å; W186-R189 PolarHBondContact O-N 3.02Å; W186-R189 VanDerWaalsContact O-N 3.15Å; R189-Q191 VanDerWaalsContact C-N 3.29Å; R189-Q191 PolarHBondContact O-N 3.33Å; R189-I192 PolarHBondContact O-N 3.25Å; R189-F193 PolarHBondContact O-N 2.97Å; R189-F193 VanDerWaalsContact O-N 3.15Å |
| 190 | I | 86.4 | Confident | 85.3 | Confident | 44 Ų | 44 | 51.9 Ų | 51.9 | 23% | 0.226 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.1 | -41.9 | 174.5 | -71.5 | 170.2 | 0 | 0 | 0 | 109.9 | L179 W186 S187 I192 F193 L194 | L179-I190 HydrophobicContact CD1-CD1 4.29Å; L179-I190 HydrophobicContact CD2-CD1 4.2Å; W186-I190 WeakPolarHBondContact O-CB 3.38Å; W186-I190 WeakPolarHBondContact O-CG1 3.32Å; W186-I190 PolarHBondContact O-N 3.44Å; S187-I190 PolarHBondContact O-N 3.48Å; I190-I192 VanDerWaalsContact C-N 3.32Å; I190-I192 PolarHBondContact O-N 3.23Å; I190-F193 PolarHBondContact O-N 3.44Å; I190-L194 HydrophobicContact CG2-CD1 3.48Å; I190-L194 VanDerWaalsContact CG2-CD1 3.48Å; I190-L194 HydrophobicContact CG2-CG 4.06Å; I190-L194 WeakPolarHBondContact O-CB 3.41Å; I190-L194 VanDerWaalsContact O-CG 3.23Å; I190-L194 WeakPolarHBondContact O-CG 3.35Å; I190-L194 PolarHBondContact O-N 3.4Å |
| 191 | Q | 86.3 | Confident | 85.4 | Confident | 8 Ų | 8 | 51.5 Ų | 51.5 | 4% | 0.037 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.2 | -42.5 | 176.4 | -169.5 | 65.2 | 20.6 | 0 | 0 | 112.7 | G55 S187 A188 R189 L194 T195 G329 N332 | G55-Q191 PolarHBondContact O-NE2 2.97Å; S187-Q191 WeakPolarHBondContact O-CB 3.2Å; S187-Q191 PolarHBondContact O-N 2.94Å; A188-Q191 WeakPolarHBondContact O-CB 3.21Å; A188-Q191 PolarHBondContact O-N 3.49Å; R189-Q191 VanDerWaalsContact C-N 3.29Å; R189-Q191 PolarHBondContact O-N 3.33Å; Q191-L194 PolarHBondContact O-N 2.99Å; Q191-T195 WeakPolarHBondContact O-CB 3.46Å; Q191-T195 PolarHBondContact O-N 3.47Å; Q191-T195 PolarHBondContact O-OG1 2.92Å; Q191-G329 PolarHBondContact NE2-O 3.05Å; Q191-G329 PolarHBondContact OE1-O 3.04Å; Q191-N332 PolarHBondContact OE1-ND2 2.82Å |
| 192 | I | 86 | Confident | 85.7 | Confident | 73 Ų | 73 | 51.2 Ų | 51.2 | 37% | 0.374 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63 | -48.4 | 177.8 | -66.4 | 165.3 | 0 | 0 | 0 | 110.3 | R48 A188 R189 I190 L194 T195 F196 | R48-I192 HydrophobicContact CG-CD1 4.34Å; A188-I192 WeakPolarHBondContact O-CG1 3.45Å; A188-I192 PolarHBondContact O-N 3.04Å; A188-I192 VanDerWaalsContact O-N 3.17Å; R189-I192 PolarHBondContact O-N 3.25Å; I190-I192 VanDerWaalsContact C-N 3.32Å; I190-I192 PolarHBondContact O-N 3.23Å; I192-L194 PolarHBondContact O-N 2.89Å; I192-T195 WeakPolarHBondContact O-CB 3.45Å; I192-T195 PolarHBondContact O-N 2.88Å; I192-T195 VanDerWaalsContact O-N 3.15Å; I192-F196 PolarHBondContact O-N 3.38Å |
| 193 | F | 89.8 | Confident | 86 | Confident | 126 Ų | 126 | 50.8 Ų | 50.8 | 55% | 0.553 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -57.9 | -48.2 | 176.5 | 171.3 | -102.4 | 0 | 0 | 0 | 111.8 | R189 I190 T195 F196 C197 | R189-F193 PolarHBondContact O-N 2.97Å; R189-F193 VanDerWaalsContact O-N 3.15Å; I190-F193 PolarHBondContact O-N 3.44Å; F193-T195 VanDerWaalsContact C-N 3.26Å; F193-T195 PolarHBondContact O-N 2.71Å; F193-F196 WeakPolarHBondContact O-CB 3.37Å; F193-F196 PolarHBondContact O-N 3.06Å; F193-F196 VanDerWaalsContact O-N 3.09Å; F193-C197 PolarHBondContact O-N 3.41Å; F193-C197 PolarHBondContact O-SG 2.98Å |
| 194 | L | 90.4 | Very high | 86.5 | Confident | 6 Ų | 6 | 50.8 Ų | 50.8 | 3% | 0.031 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64 | -32.4 | 177.6 | -66.7 | 169 | 0 | 0 | 0 | 112 | I190 Q191 I192 F196 C197 K198 L325 F328 | I190-L194 HydrophobicContact CG2-CD1 3.48Å; I190-L194 VanDerWaalsContact CG2-CD1 3.48Å; I190-L194 HydrophobicContact CG2-CG 4.06Å; I190-L194 WeakPolarHBondContact O-CB 3.41Å; I190-L194 VanDerWaalsContact O-CG 3.23Å; I190-L194 WeakPolarHBondContact O-CG 3.35Å; I190-L194 PolarHBondContact O-N 3.4Å; Q191-L194 PolarHBondContact O-N 2.99Å; I192-L194 PolarHBondContact O-N 2.89Å; L194-F196 VanDerWaalsContact C-N 3.33Å; L194-C197 WeakPolarHBondContact O-CB 3.28Å; L194-C197 PolarHBondContact O-N 2.91Å; L194-K198 WeakPolarHBondContact O-CG 3.32Å; L194-K198 PolarHBondContact O-N 2.69Å; L194-L325 HydrophobicContact CD2-CB 4.21Å; L194-L325 HydrophobicContact CD2-CD2 4.09Å; L194-F328 HydrophobicContact CD1-CD1 3.62Å; L194-F328 HydrophobicContact CD1-CE1 4.13Å; L194-F328 HydrophobicContact CD2-CD1 4.36Å |
| 195 | T | 86.9 | Confident | 87.4 | Confident | 8 Ų | 8 | 49.3 Ų | 49.3 | 5% | 0.049 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.8 | -40.9 | 173.4 | -54.7 | 0 | 0 | 0 | 0 | 111.3 | S51 I54 Q191 I192 F193 K198 L199 | S51-T195 PolarHBondContact O-OG1 3.24Å; S51-T195 PolarHBondContact OG-OG1 3.19Å; I54-T195 HydrophobicContact CB-CG2 4.23Å; I54-T195 HydrophobicContact CG2-CG2 3.92Å; Q191-T195 WeakPolarHBondContact O-CB 3.46Å; Q191-T195 PolarHBondContact O-N 3.47Å; Q191-T195 PolarHBondContact O-OG1 2.92Å; I192-T195 WeakPolarHBondContact O-CB 3.45Å; I192-T195 PolarHBondContact O-N 2.88Å; I192-T195 VanDerWaalsContact O-N 3.15Å; F193-T195 VanDerWaalsContact C-N 3.26Å; F193-T195 PolarHBondContact O-N 2.71Å; T195-K198 WeakPolarHBondContact O-CB 3.11Å; T195-K198 PolarHBondContact O-N 3.31Å; T195-L199 WeakPolarHBondContact O-CG 3.45Å; T195-L199 PolarHBondContact O-N 3.43Å; T195-L199 VanDerWaalsContact O-N 3.09Å |
| 196 | F | 88.8 | Confident | 88.1 | Confident | 141 Ų | 141 | 47.8 Ų | 47.8 | 62% | 0.618 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -62 | -46.8 | 172.6 | -178.3 | -97.2 | 0 | 0 | 0 | 111.2 | I192 F193 L194 K198 L199 T200 | I192-F196 PolarHBondContact O-N 3.38Å; F193-F196 WeakPolarHBondContact O-CB 3.37Å; F193-F196 PolarHBondContact O-N 3.06Å; F193-F196 VanDerWaalsContact O-N 3.09Å; L194-F196 VanDerWaalsContact C-N 3.33Å; F196-K198 VanDerWaalsContact C-N 3.27Å; F196-K198 PolarHBondContact O-N 3.17Å; F196-L199 PolarHBondContact O-N 3.03Å; F196-T200 PolarHBondContact O-N 3.01Å; F196-T200 PolarHBondContact O-OG1 3.45Å; F196-T200 VanDerWaalsContact O-OG1 3.07Å |
| 197 | C | 89.4 | Confident | 88.7 | Confident | 7 Ų | 7 | 44 Ų | 44 | 5% | 0.047 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -55.4 | -40.6 | 174.6 | -64.5 | 0 | 0 | 0 | 0 | 112.7 | F193 L194 T200 A201 F322 L325 | F193-C197 PolarHBondContact O-N 3.41Å; F193-C197 PolarHBondContact O-SG 2.98Å; L194-C197 WeakPolarHBondContact O-CB 3.28Å; L194-C197 PolarHBondContact O-N 2.91Å; C197-T200 PolarHBondContact O-N 3.22Å; C197-A201 WeakPolarHBondContact O-CB 3.3Å; C197-A201 PolarHBondContact O-N 2.86Å; C197-F322 HydrophobicContact CB-CD1 4.32Å; C197-L325 HydrophobicContact CB-CB 4.42Å; C197-L325 HydrophobicContact CB-CD1 4.45Å |
| 198 | K | 88 | Confident | 89.2 | Confident | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.2 | -47.4 | 177.1 | -72.3 | 168.6 | -174.3 | -121.8 | 0 | 112.7 | G55 I58 L194 T195 F196 T200 A201 I202 S326 S330 | G55-K198 PolarHBondContact O-NZ 3.06Å; I58-K198 HydrophobicContact CG2-CB 4.14Å; I58-K198 WeakPolarHBondContact O-CD 3.42Å; I58-K198 PolarHBondContact O-NZ 3.33Å; L194-K198 WeakPolarHBondContact O-CG 3.32Å; L194-K198 PolarHBondContact O-N 2.69Å; T195-K198 WeakPolarHBondContact O-CB 3.11Å; T195-K198 PolarHBondContact O-N 3.31Å; F196-K198 VanDerWaalsContact C-N 3.27Å; F196-K198 PolarHBondContact O-N 3.17Å; K198-T200 VanDerWaalsContact C-N 3.32Å; K198-A201 WeakPolarHBondContact O-CB 3.37Å; K198-A201 PolarHBondContact O-N 3.4Å; K198-I202 PolarHBondContact O-N 3.42Å; K198-I202 VanDerWaalsContact O-N 3.13Å; K198-S326 WeakPolarHBondContact CE-O 3.37Å; K198-S326 WeakPolarHBondContact CG-OG 3.5Å; K198-S326 PolarHBondContact NZ-O 3.31Å; K198-S330 VanDerWaalsContact NZ-N 3.16Å; K198-S330 PolarHBondContact NZ-OG 3.04Å |
| 199 | L | 89.2 | Confident | 89.8 | Confident | 57 Ų | 57 | 43.4 Ų | 43.4 | 30% | 0.298 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -64.5 | -41.5 | 178.8 | -68.6 | 176.7 | 0 | 0 | 0 | 110.4 | I54 I58 T195 F196 A201 I202 L203 I276 | I54-L199 HydrophobicContact CG2-CD2 3.96Å; I54-L199 HydrophobicContact CG2-CG 4.41Å; I58-L199 HydrophobicContact CD1-CD2 4.08Å; T195-L199 WeakPolarHBondContact O-CG 3.45Å; T195-L199 PolarHBondContact O-N 3.43Å; T195-L199 VanDerWaalsContact O-N 3.09Å; F196-L199 PolarHBondContact O-N 3.03Å; L199-A201 VanDerWaalsContact C-N 3.35Å; L199-A201 PolarHBondContact O-N 3.42Å; L199-I202 PolarHBondContact O-N 3.26Å; L199-L203 VanDerWaalsContact O-CG 3.3Å; L199-L203 WeakPolarHBondContact O-CG 3.25Å; L199-L203 PolarHBondContact O-N 3.03Å; L199-I276 HydrophobicContact CD2-CG2 4.43Å |
| 200 | T | 89.6 | Confident | 90.2 | Very high | 36 Ų | 36 | 39 Ų | 39 | 22% | 0.221 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.1 | -42.9 | 172.8 | -57.8 | 0 | 0 | 0 | 0 | 111.9 | F196 C197 K198 I202 L203 I204 F322 | F196-T200 PolarHBondContact O-N 3.01Å; F196-T200 PolarHBondContact O-OG1 3.45Å; F196-T200 VanDerWaalsContact O-OG1 3.07Å; C197-T200 PolarHBondContact O-N 3.22Å; K198-T200 VanDerWaalsContact C-N 3.32Å; T200-I202 VanDerWaalsContact C-N 3.31Å; T200-I202 PolarHBondContact O-N 3.12Å; T200-L203 PolarHBondContact O-N 3.12Å; T200-L203 VanDerWaalsContact O-N 3.16Å; T200-I204 HydrophobicContact CG2-CD1 3.92Å; T200-I204 HydrophobicContact CG2-CG1 4.39Å; T200-I204 VanDerWaalsContact O-CG1 3.3Å; T200-I204 WeakPolarHBondContact O-CG1 3.5Å; T200-I204 PolarHBondContact O-N 3.21Å; T200-F322 HydrophobicContact CG2-CZ 4.42Å |
| 201 | A | 88.8 | Confident | 90.5 | Very high | 3 Ų | 3 | 41.8 Ų | 41.8 | 3% | 0.025 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -56.3 | -45.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | C197 K198 L199 I204 I205 F322 | C197-A201 WeakPolarHBondContact O-CB 3.3Å; C197-A201 PolarHBondContact O-N 2.86Å; K198-A201 WeakPolarHBondContact O-CB 3.37Å; K198-A201 PolarHBondContact O-N 3.4Å; L199-A201 VanDerWaalsContact C-N 3.35Å; L199-A201 PolarHBondContact O-N 3.42Å; A201-I204 PolarHBondContact O-N 2.85Å; A201-I205 PolarHBondContact O-N 3.44Å; A201-F322 HydrophobicContact CB-CB 3.7Å |
| 202 | I | 90.8 | Very high | 90.9 | Very high | 9 Ų | 9 | 42.8 Ų | 42.8 | 5% | 0.046 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -66.8 | -42.4 | 177.4 | -75.6 | 174.2 | 0 | 0 | 0 | 111 | I58 K198 L199 T200 I204 I205 I206 | I58-I202 HydrophobicContact CB-CD1 4.49Å; I58-I202 HydrophobicContact CD1-CD1 3.65Å; I58-I202 HydrophobicContact CG1-CD1 4.3Å; I58-I202 HydrophobicContact CG2-CD1 3.47Å; I58-I202 VanDerWaalsContact CG2-CD1 3.47Å; I58-I202 HydrophobicContact CG2-CG1 4.44Å; K198-I202 PolarHBondContact O-N 3.42Å; K198-I202 VanDerWaalsContact O-N 3.13Å; L199-I202 PolarHBondContact O-N 3.26Å; T200-I202 VanDerWaalsContact C-N 3.31Å; T200-I202 PolarHBondContact O-N 3.12Å; I202-I204 VanDerWaalsContact C-N 3.31Å; I202-I204 PolarHBondContact O-N 3.2Å; I202-I205 PolarHBondContact O-N 2.77Å; I202-I206 HydrophobicContact CG2-CD1 3.33Å; I202-I206 HydrophobicContact CG2-CG1 3.96Å; I202-I206 WeakPolarHBondContact O-CG1 3.34Å; I202-I206 PolarHBondContact O-N 3.35Å |
| 203 | L | 91.9 | Very high | 91.2 | Very high | 96 Ų | 96 | 42.7 Ų | 42.7 | 50% | 0.503 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -64 | -35.6 | 178.5 | -71.2 | 173.2 | 0 | 0 | 0 | 112.5 | L199 T200 I205 I206 V207 | L199-L203 VanDerWaalsContact O-CG 3.3Å; L199-L203 WeakPolarHBondContact O-CG 3.25Å; L199-L203 PolarHBondContact O-N 3.03Å; T200-L203 PolarHBondContact O-N 3.12Å; T200-L203 VanDerWaalsContact O-N 3.16Å; L203-I205 PolarHBondContact O-N 3.46Å; L203-I206 PolarHBondContact O-N 3.34Å; L203-V207 WeakPolarHBondContact O-CB 3.47Å; L203-V207 WeakPolarHBondContact O-CG2 3.31Å; L203-V207 PolarHBondContact O-N 2.93Å |
| 204 | I | 91.2 | Very high | 91.3 | Very high | 26 Ų | 26 | 43.4 Ų | 43.4 | 13% | 0.133 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.1 | -24.2 | 173.7 | -70.2 | 165.2 | 0 | 0 | 0 | 111.7 | T200 A201 I202 P208 L312 F315 V319 F322 | T200-I204 HydrophobicContact CG2-CD1 3.92Å; T200-I204 HydrophobicContact CG2-CG1 4.39Å; T200-I204 VanDerWaalsContact O-CG1 3.3Å; T200-I204 WeakPolarHBondContact O-CG1 3.5Å; T200-I204 PolarHBondContact O-N 3.21Å; A201-I204 PolarHBondContact O-N 2.85Å; I202-I204 VanDerWaalsContact C-N 3.31Å; I202-I204 PolarHBondContact O-N 3.2Å; I204-P208 WeakPolarHBondContact O-CD 3.44Å; I204-P208 WeakPolarHBondContact O-CG 3.42Å; I204-L312 HydrophobicContact CG2-CD1 3.74Å; I204-F315 HydrophobicContact CD1-CE1 4.01Å; I204-F315 HydrophobicContact CD1-CZ 4.08Å; I204-F315 HydrophobicContact CG1-CE1 4.24Å; I204-F315 HydrophobicContact CG2-CE1 3.92Å; I204-V319 HydrophobicContact CG2-CG2 3.8Å; I204-F322 HydrophobicContact CD1-CD2 3.65Å; I204-F322 HydrophobicContact CD1-CE2 3.6Å; I204-F322 HydrophobicContact CD1-CZ 4.48Å |
| 205 | I | 92.1 | Very high | 91.5 | Very high | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.005 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -89.7 | -47.8 | 174.4 | -63.4 | 162.8 | 0 | 0 | 0 | 110.7 | F63 A201 I202 L203 G209 T284 A287 Y288 A304 F307 | F63-I205 HydrophobicContact CE1-CD1 3.99Å; A201-I205 PolarHBondContact O-N 3.44Å; I202-I205 PolarHBondContact O-N 2.77Å; L203-I205 PolarHBondContact O-N 3.46Å; I205-G209 PolarHBondContact O-N 3.34Å; I205-T284 HydrophobicContact CG2-CG2 4.01Å; I205-A287 HydrophobicContact CG2-CB 3.88Å; I205-A287 WeakPolarHBondContact O-CB 3.22Å; I205-Y288 HydrophobicContact CD1-CE1 4.23Å; I205-Y288 HydrophobicContact CG2-CD1 4.06Å; I205-Y288 HydrophobicContact CG2-CE1 3.65Å; I205-A304 HydrophobicContact CD1-CB 4.14Å; I205-F307 HydrophobicContact CB-CE1 4.27Å; I205-F307 HydrophobicContact CG1-CD1 4.32Å; I205-F307 HydrophobicContact CG1-CE1 4.4Å; I205-F307 HydrophobicContact CG2-CD1 4.16Å; I205-F307 HydrophobicContact CG2-CE1 3.96Å; I205-F307 HydrophobicContact CG2-CZ 4.18Å; I205-F307 WeakPolarHBondContact O-CZ 3.26Å |
| 206 | I | 94.4 | Very high | 91.7 | Very high | 17 Ų | 17 | 51.7 Ų | 51.7 | 9% | 0.087 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.1 | -50.6 | -175.3 | -67.9 | 176.6 | 0 | 0 | 0 | 111.6 | I202 L203 G209 V210 L283 | I202-I206 HydrophobicContact CG2-CD1 3.33Å; I202-I206 HydrophobicContact CG2-CG1 3.96Å; I202-I206 WeakPolarHBondContact O-CG1 3.34Å; I202-I206 PolarHBondContact O-N 3.35Å; L203-I206 PolarHBondContact O-N 3.34Å; I206-G209 PolarHBondContact O-N 2.86Å; I206-V210 HydrophobicContact CG2-CG2 4.07Å; I206-V210 WeakPolarHBondContact O-CG2 3.28Å; I206-V210 PolarHBondContact O-N 3.33Å; I206-L283 HydrophobicContact CD1-CB 3.7Å; I206-L283 HydrophobicContact CD1-CD1 4.34Å; I206-L283 HydrophobicContact CG1-CB 3.9Å; I206-L283 HydrophobicContact CG2-CB 4.1Å; I206-L283 HydrophobicContact CG2-CD1 4.2Å |
| 207 | V | 94.8 | Very high | 91.8 | Very high | 79 Ų | 79 | 49.2 Ų | 49.2 | 48% | 0.479 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.1 | -50 | -172.6 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | L203 G209 V210 M211 | L203-V207 WeakPolarHBondContact O-CB 3.47Å; L203-V207 WeakPolarHBondContact O-CG2 3.31Å; L203-V207 PolarHBondContact O-N 2.93Å; V207-G209 VanDerWaalsContact C-N 3.34Å; V207-G209 PolarHBondContact O-N 2.94Å; V207-V210 PolarHBondContact O-N 2.89Å; V207-M211 HydrophobicContact CG1-SD 4.35Å; V207-M211 WeakPolarHBondContact O-CG 3.31Å; V207-M211 PolarHBondContact O-N 2.82Å |
| 208 | P | 93.1 | Very high | 91.9 | Very high | 20 Ų | 20 | 51.3 Ų | 51.3 | 13% | 0.13 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.7 | -35 | 176.2 | -25.2 | 39.4 | 0 | 0 | 0 | 113.4 | I204 M211 Q212 F307 L311 L312 | I204-P208 WeakPolarHBondContact O-CD 3.44Å; I204-P208 WeakPolarHBondContact O-CG 3.42Å; P208-M211 WeakPolarHBondContact O-CB 3.06Å; P208-M211 PolarHBondContact O-N 3.37Å; P208-Q212 WeakPolarHBondContact O-CG 3.37Å; P208-Q212 PolarHBondContact O-N 3.5Å; P208-F307 HydrophobicContact CB-CZ 4.43Å; P208-L311 HydrophobicContact CB-CD2 3.25Å; P208-L311 HydrophobicContact CB-CG 4.26Å; P208-L312 HydrophobicContact CB-CD2 4.29Å; P208-L312 HydrophobicContact CG-CD2 3.97Å |
| 209 | G | 92.8 | Very high | 91.8 | Very high | 2 Ų | 2 | 57.6 Ų | 57.6 | 2% | 0.021 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -64.2 | -41.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | I205 I206 V207 M211 Q212 L213 T290 | I205-G209 PolarHBondContact O-N 3.34Å; I206-G209 PolarHBondContact O-N 2.86Å; V207-G209 VanDerWaalsContact C-N 3.34Å; V207-G209 PolarHBondContact O-N 2.94Å; G209-M211 VanDerWaalsContact C-N 3.32Å; G209-M211 PolarHBondContact O-N 3.29Å; G209-Q212 WeakPolarHBondContact O-CB 3.32Å; G209-Q212 PolarHBondContact O-N 3.07Å; G209-L213 PolarHBondContact O-N 3.47Å; G209-T290 WeakPolarHBondContact CA-OG1 3.5Å; G209-T290 PolarHBondContact O-OG1 3.4Å |
| 210 | V | 93.1 | Very high | 91.7 | Very high | 61 Ų | 61 | 57.1 Ų | 57.1 | 37% | 0.37 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.9 | -38.9 | 173.3 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | I206 V207 Q212 L213 I214 | I206-V210 HydrophobicContact CG2-CG2 4.07Å; I206-V210 WeakPolarHBondContact O-CG2 3.28Å; I206-V210 PolarHBondContact O-N 3.33Å; V207-V210 PolarHBondContact O-N 2.89Å; V210-Q212 VanDerWaalsContact C-N 3.32Å; V210-Q212 PolarHBondContact O-N 3.36Å; V210-L213 WeakPolarHBondContact O-CB 3.35Å; V210-L213 PolarHBondContact O-N 2.98Å; V210-I214 HydrophobicContact CG1-CD1 4.05Å; V210-I214 WeakPolarHBondContact O-CG1 3.23Å; V210-I214 PolarHBondContact O-N 3.3Å |
| 211 | M | 94.1 | Very high | 91.6 | Very high | 101 Ų | 101 | 57.9 Ų | 57.9 | 50% | 0.498 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -62 | -39 | 173.6 | -68.4 | 173.7 | 67.9 | 0 | 0 | 112.2 | V207 P208 G209 L213 I214 K215 | V207-M211 HydrophobicContact CG1-SD 4.35Å; V207-M211 WeakPolarHBondContact O-CG 3.31Å; V207-M211 PolarHBondContact O-N 2.82Å; P208-M211 WeakPolarHBondContact O-CB 3.06Å; P208-M211 PolarHBondContact O-N 3.37Å; G209-M211 VanDerWaalsContact C-N 3.32Å; G209-M211 PolarHBondContact O-N 3.29Å; M211-L213 VanDerWaalsContact C-N 3.34Å; M211-I214 PolarHBondContact O-N 2.86Å; M211-K215 WeakPolarHBondContact O-CG 3.34Å; M211-K215 PolarHBondContact O-N 3.49Å |
| 212 | Q | 93.6 | Very high | 91.5 | Very high | 29 Ų | 29 | 64.4 Ų | 64.4 | 14% | 0.136 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -65.3 | -38.6 | 174.2 | -70.8 | -74.5 | 71 | 0 | 0 | 111.9 | P208 G209 V210 K215 G216 Q217 L311 | P208-Q212 WeakPolarHBondContact O-CG 3.37Å; P208-Q212 PolarHBondContact O-N 3.5Å; G209-Q212 WeakPolarHBondContact O-CB 3.32Å; G209-Q212 PolarHBondContact O-N 3.07Å; V210-Q212 VanDerWaalsContact C-N 3.32Å; V210-Q212 PolarHBondContact O-N 3.36Å; Q212-K215 PolarHBondContact O-N 3.41Å; Q212-G216 PolarHBondContact O-N 3.43Å; Q212-Q217 HydrophobicContact CB-CB 4.26Å; Q212-Q217 HydrophobicContact CB-CG 4.42Å; Q212-Q217 WeakPolarHBondContact O-CB 3.04Å; Q212-Q217 PolarHBondContact O-N 3.2Å; Q212-L311 HydrophobicContact CG-CD1 3.87Å; Q212-L311 HydrophobicContact CG-CD2 4.05Å |
| 213 | L | 92.4 | Very high | 91.3 | Very high | 71 Ų | 71 | 69.6 Ų | 69.6 | 37% | 0.372 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 173.9 | -168.3 | 69.6 | 0 | 0 | 0 | 111.7 | G209 V210 M211 K215 G216 T218 F221 T290 | G209-L213 PolarHBondContact O-N 3.47Å; V210-L213 WeakPolarHBondContact O-CB 3.35Å; V210-L213 PolarHBondContact O-N 2.98Å; M211-L213 VanDerWaalsContact C-N 3.34Å; L213-K215 VanDerWaalsContact C-N 3.28Å; L213-K215 PolarHBondContact O-N 2.84Å; L213-G216 WeakPolarHBondContact O-CA 3.35Å; L213-G216 PolarHBondContact O-N 2.92Å; L213-T218 HydrophobicContact CD1-CG2 3.63Å; L213-F221 HydrophobicContact CD1-CE2 4.5Å; L213-T290 HydrophobicContact CB-CG2 4.09Å; L213-T290 HydrophobicContact CD1-CG2 4.01Å |
| 214 | I | 93.1 | Very high | 91.1 | Very high | 141 Ų | 141 | 65.7 Ų | 65.7 | 72% | 0.723 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -62.5 | -35.9 | 176.4 | -67.2 | 166 | 0 | 0 | 0 | 111.3 | V210 M211 G216 | V210-I214 HydrophobicContact CG1-CD1 4.05Å; V210-I214 WeakPolarHBondContact O-CG1 3.23Å; V210-I214 PolarHBondContact O-N 3.3Å; M211-I214 PolarHBondContact O-N 2.86Å; I214-G216 PolarHBondContact O-N 3.4Å |
| 215 | K | 93.4 | Very high | 90.9 | Very high | 144 Ų | 144 | 71.3 Ų | 71.3 | 63% | 0.626 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | -2.8 | 173.4 | -71.9 | 173.5 | 179.3 | -179.8 | 0 | 113.8 | M211 Q212 L213 | M211-K215 WeakPolarHBondContact O-CG 3.34Å; M211-K215 PolarHBondContact O-N 3.49Å; Q212-K215 PolarHBondContact O-N 3.41Å; L213-K215 VanDerWaalsContact C-N 3.28Å; L213-K215 PolarHBondContact O-N 2.84Å |
| 216 | G | 91.3 | Very high | 90.4 | Very high | 44 Ų | 44 | 75 Ų | 75 | 45% | 0.454 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.9 | 13.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q212 L213 I214 T218 | Q212-G216 PolarHBondContact O-N 3.43Å; L213-G216 WeakPolarHBondContact O-CA 3.35Å; L213-G216 PolarHBondContact O-N 2.92Å; I214-G216 PolarHBondContact O-N 3.4Å; G216-T218 PolarHBondContact O-N 2.95Å; G216-T218 PolarHBondContact O-OG1 3.47Å |
| 217 | Q | 91.3 | Very high | 89.4 | Confident | 90 Ų | 90 | 76.5 Ų | 76.5 | 42% | 0.421 | 41% | 0.413 | S | S | . | . | trans | -73 | 72.4 | 176 | -61.5 | -61.9 | -19.4 | 0 | 0 | 111.2 | Q212 | Q212-Q217 HydrophobicContact CB-CB 4.26Å; Q212-Q217 HydrophobicContact CB-CG 4.42Å; Q212-Q217 WeakPolarHBondContact O-CB 3.04Å; Q212-Q217 PolarHBondContact O-N 3.2Å | ||
| 218 | T | 90.1 | Very high | 88 | Confident | 50 Ų | 50 | 83.3 Ų | 83.3 | 31% | 0.307 | 43% | 0.43 | S | S | . | . | trans | -115 | 10.3 | -173.1 | 52.3 | 0 | 0 | 0 | 0 | 113.3 | L213 G216 N220 F221 K222 | L213-T218 HydrophobicContact CD1-CG2 3.63Å; G216-T218 PolarHBondContact O-N 2.95Å; G216-T218 PolarHBondContact O-OG1 3.47Å; T218-N220 VanDerWaalsContact C-N 3.3Å; T218-N220 PolarHBondContact O-N 2.99Å; T218-F221 WeakPolarHBondContact O-CA 3.29Å; T218-F221 WeakPolarHBondContact O-CB 3.46Å; T218-F221 PolarHBondContact O-N 3.06Å; T218-K222 PolarHBondContact O-N 3.2Å | ||
| 219 | Q | 87.8 | Confident | 86.5 | Confident | 132 Ų | 132 | 89.7 Ų | 89.7 | 62% | 0.617 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -51.8 | -47.5 | -174.2 | -63.9 | -84 | 21.1 | 0 | 0 | 112 | F221 K222 | Q219-F221 PolarHBondContact O-N 2.84Å; Q219-F221 VanDerWaalsContact O-N 3.14Å; Q219-K222 PolarHBondContact O-N 2.9Å |
| 220 | N | 85.9 | Confident | 84.9 | Confident | 47 Ų | 47 | 93.6 Ų | 93.6 | 25% | 0.251 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -68.1 | -10.9 | -180 | -65.2 | -36.8 | 0 | 0 | 0 | 114.2 | T218 F289 I292 | T218-N220 VanDerWaalsContact C-N 3.3Å; T218-N220 PolarHBondContact O-N 2.99Å; N220-F289 WeakPolarHBondContact CB-O 3.28Å; N220-F289 PolarHBondContact ND2-O 3.32Å; N220-I292 PolarHBondContact ND2-O 3.4Å; N220-I292 VanDerWaalsContact ND2-O 3.12Å |
| 221 | F | 88.4 | Confident | 83.6 | Confident | 52 Ų | 52 | 92.6 Ų | 92.6 | 23% | 0.228 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -101.2 | -12.9 | 179.4 | -58 | -79.5 | 0 | 0 | 0 | 113.8 | V76 L80 L213 T218 Q219 A224 V286 F289 T290 | V76-F221 HydrophobicContact CG1-CD1 4.43Å; V76-F221 HydrophobicContact CG1-CE1 4.34Å; L80-F221 HydrophobicContact CD1-CE1 3.99Å; L213-F221 HydrophobicContact CD1-CE2 4.5Å; T218-F221 WeakPolarHBondContact O-CA 3.29Å; T218-F221 WeakPolarHBondContact O-CB 3.46Å; T218-F221 PolarHBondContact O-N 3.06Å; Q219-F221 PolarHBondContact O-N 2.84Å; Q219-F221 VanDerWaalsContact O-N 3.14Å; F221-A224 PolarHBondContact O-N 3.4Å; F221-V286 HydrophobicContact CZ-CG1 3.98Å; F221-F289 HydrophobicContact CE1-CB 4.12Å; F221-F289 HydrophobicContact CE2-CB 4.28Å; F221-F289 HydrophobicContact CZ-CB 3.66Å; F221-T290 HydrophobicContact CE2-CG2 3.72Å; F221-T290 HydrophobicContact CZ-CG2 4.18Å |
| 222 | K | 86.8 | Confident | 82.6 | Confident | 141 Ų | 141 | 94.8 Ų | 94.8 | 61% | 0.613 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.9 | -45.9 | -177.7 | -74.5 | -178.4 | 177.9 | 174.3 | 0 | 112.1 | T218 Q219 | T218-K222 PolarHBondContact O-N 3.2Å; Q219-K222 PolarHBondContact O-N 2.9Å |
| 223 | D | 85.6 | Confident | 81.7 | Confident | 118 Ų | 118 | 97.8 Ų | 97.8 | 63% | 0.631 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.6 | 47 | 174 | -58.7 | -55.7 | 0 | 0 | 0 | 110.3 | F225 S226 | D223-F225 PolarHBondContact O-N 3.3Å; D223-S226 WeakPolarHBondContact CB-OG 3.49Å; D223-S226 WeakPolarHBondContact O-CB 3.32Å; D223-S226 PolarHBondContact O-N 2.89Å; D223-S226 PolarHBondContact O-OG 3.43Å |
| 224 | A | 87.2 | Confident | 81.2 | Confident | 14 Ų | 14 | 101 Ų | 101 | 12% | 0.116 | 53% | 0.526 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | -33.9 | -170.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | S75 V76 G77 F221 | S75-A224 PolarHBondContact OG-O 3.42Å; V76-A224 PolarHBondContact N-O 3.45Å; G77-A224 PolarHBondContact N-O 2.96Å; F221-A224 PolarHBondContact O-N 3.4Å |
| 225 | F | 88.8 | Confident | 80.8 | Confident | 143 Ų | 143 | 96.4 Ų | 96.4 | 63% | 0.627 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.2 | -8.9 | 180 | -66.2 | -80.8 | 0 | 0 | 0 | 113.8 | S75 G77 D223 | S75-F225 WeakPolarHBondContact OG-CA 3.37Å; G77-F225 VanDerWaalsContact C-CE1 3.48Å; D223-F225 PolarHBondContact O-N 3.3Å |
| 226 | S | 80.8 | Confident | 80.4 | Confident | 80 Ų | 80 | 90.6 Ų | 90.6 | 56% | 0.559 | 48% | 0.479 | S | S | * | . | trans | -74.4 | 134.2 | 170 | 79.1 | 0 | 0 | 0 | 0 | 109.2 | D223 | D223-S226 WeakPolarHBondContact CB-OG 3.49Å; D223-S226 WeakPolarHBondContact O-CB 3.32Å; D223-S226 PolarHBondContact O-N 2.89Å; D223-S226 PolarHBondContact O-OG 3.43Å | ||
| 227 | G | 72.4 | Confident | 80.1 | Confident | 48 Ų | 48 | 90.7 Ų | 90.7 | 50% | 0.495 | 47% | 0.469 | S | S | . | . | trans | -176.5 | 168.3 | -172.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | G74 | G74-G227 WeakPolarHBondContact O-CA 3.23Š| ||
| 228 | R | 66.6 | Low | 80 | Confident | 222 Ų | 222 | 86.4 Ų | 86.4 | 84% | 0.838 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -57.2 | 145.7 | 170.4 | -82.2 | -177.9 | -179.2 | 159 | 2.4 | 109.3 | S230 | R228-S230 PolarHBondContact O-N 3.34Š|
| 229 | D | 61.6 | Low | 80.1 | Confident | 154 Ų | 154 | 85.7 Ų | 85.7 | 82% | 0.824 | 44% | 0.442 | S | S | * | . | trans | -22.7 | 102.4 | 179.6 | -84.9 | -26.1 | 0 | 0 | 0 | 112.1 | S231 | D229-S231 PolarHBondContact O-N 3.21Š| ||
| 230 | S | 59.7 | Low | 80 | Confident | 83 Ų | 83 | 79.6 Ų | 79.6 | 58% | 0.58 | 41% | 0.413 | S | S | * | . | trans | -73.2 | 61.5 | 173.6 | 30.6 | 0 | 0 | 0 | 0 | 108.3 | R228 I232 | R228-S230 PolarHBondContact O-N 3.34Å; S230-I232 PolarHBondContact O-N 3.1Å; S230-I232 VanDerWaalsContact O-N 3.12Å | ||
| 231 | S | 64.1 | Low | 80.1 | Confident | 41 Ų | 41 | 79.1 Ų | 79.1 | 29% | 0.287 | 41% | 0.408 | S | S | . | . | trans | -57.5 | 119.7 | 176.5 | 60.4 | 0 | 0 | 0 | 0 | 107.9 | D229 T233 R234 | D229-S231 PolarHBondContact O-N 3.21Å; S231-T233 WeakPolarHBondContact CB-OG1 3.47Å; S231-T233 PolarHBondContact O-N 2.94Å; S231-T233 PolarHBondContact OG-OG1 3.05Å; S231-R234 PolarHBondContact O-N 3.27Å | ||
| 232 | I | 73.2 | Confident | 80.3 | Confident | 146 Ų | 146 | 76.7 Ų | 76.7 | 75% | 0.749 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.3 | -23.2 | 177.5 | -63.5 | 170.9 | 0 | 0 | 0 | 110.5 | S230 R234 L235 P236 | S230-I232 PolarHBondContact O-N 3.1Å; S230-I232 VanDerWaalsContact O-N 3.12Å; I232-R234 PolarHBondContact O-N 3.44Å; I232-L235 WeakPolarHBondContact O-CB 3.48Å; I232-L235 PolarHBondContact O-N 2.88Å; I232-P236 VanDerWaalsContact O-CD 3.29Å; I232-P236 WeakPolarHBondContact O-CD 3.31Å |
| 233 | T | 75.9 | Confident | 80.5 | Confident | 93 Ų | 93 | 70 Ų | 70 | 57% | 0.571 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | -28 | 177.2 | 56.6 | 0 | 0 | 0 | 0 | 114.6 | S231 P236 | S231-T233 WeakPolarHBondContact CB-OG1 3.47Å; S231-T233 PolarHBondContact O-N 2.94Å; S231-T233 PolarHBondContact OG-OG1 3.05Å; T233-P236 WeakPolarHBondContact O-CD 3.45Å |
| 234 | R | 81.8 | Confident | 80.6 | Confident | 139 Ų | 139 | 65.5 Ų | 65.5 | 53% | 0.525 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94 | -18.8 | 178.6 | -65.9 | -175.7 | -174.8 | 179.1 | 2.6 | 113.7 | N72 S231 I232 P236 L237 A238 | N72-R234 WeakPolarHBondContact O-CB 3.49Å; S231-R234 PolarHBondContact O-N 3.27Å; I232-R234 PolarHBondContact O-N 3.44Å; R234-P236 VanDerWaalsContact C-N 3.31Å; R234-L237 WeakPolarHBondContact O-CB 3.29Å; R234-L237 PolarHBondContact O-N 3.36Å; R234-A238 PolarHBondContact O-N 3.36Å |
| 235 | L | 84.6 | Confident | 80.9 | Confident | 43 Ų | 43 | 64.9 Ų | 64.9 | 23% | 0.225 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -52.4 | -40.3 | 179.1 | -170.4 | 68.9 | 0 | 0 | 0 | 114.3 | M78 I82 I232 L237 A238 F239 | M78-L235 HydrophobicContact CE-CD1 3.4Å; M78-L235 HydrophobicContact CE-CD2 4.01Å; M78-L235 HydrophobicContact CE-CG 4.37Å; M78-L235 HydrophobicContact CG-CD1 4.45Å; I82-L235 HydrophobicContact CD1-CD1 3.35Å; I82-L235 HydrophobicContact CD1-CG 4.44Å; I82-L235 HydrophobicContact CG1-CD1 4.18Å; I232-L235 WeakPolarHBondContact O-CB 3.48Å; I232-L235 PolarHBondContact O-N 2.88Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 2.92Å; L235-A238 WeakPolarHBondContact O-CB 3.27Å; L235-A238 PolarHBondContact O-N 3.08Å; L235-A238 VanDerWaalsContact O-N 3.09Å; L235-F239 HydrophobicContact CD1-CE2 4.4Å; L235-F239 HydrophobicContact CD2-CE2 4.14Å; L235-F239 HydrophobicContact CG-CD2 4.17Å; L235-F239 HydrophobicContact CG-CE2 3.92Å; L235-F239 WeakPolarHBondContact O-CD2 3.41Å; L235-F239 PolarHBondContact O-N 3.37Å; L235-F239 VanDerWaalsContact O-N 3.13Å |
| 236 | P | 85.5 | Confident | 81 | Confident | 23 Ų | 23 | 58.1 Ų | 58.1 | 15% | 0.149 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -56.8 | -43.6 | 176 | -25.9 | 35.7 | 0 | 0 | 0 | 112.6 | I232 T233 R234 A238 F239 Y240 F437 L441 | I232-P236 VanDerWaalsContact O-CD 3.29Å; I232-P236 WeakPolarHBondContact O-CD 3.31Å; T233-P236 WeakPolarHBondContact O-CD 3.45Å; R234-P236 VanDerWaalsContact C-N 3.31Å; P236-A238 PolarHBondContact O-N 3.49Å; P236-F239 WeakPolarHBondContact O-CA 3.46Å; P236-F239 WeakPolarHBondContact O-CB 3.43Å; P236-F239 PolarHBondContact O-N 2.79Å; P236-F239 VanDerWaalsContact O-N 3.08Å; P236-Y240 PolarHBondContact O-N 2.98Å; P236-F437 HydrophobicContact CB-CE1 4.25Å; P236-F437 HydrophobicContact CB-CZ 3.81Å; P236-F437 HydrophobicContact CG-CZ 3.86Å; P236-L441 HydrophobicContact CB-CB 4.44Å; P236-L441 HydrophobicContact CB-CD1 3.27Å; P236-L441 HydrophobicContact CB-CD2 3.49Å; P236-L441 VanDerWaalsContact CB-CD2 3.49Å; P236-L441 HydrophobicContact CB-CG 3.86Å; P236-L441 HydrophobicContact CG-CD1 4.31Å; P236-L441 WeakPolarHBondContact O-CD2 3.25Å |
| 237 | L | 84.3 | Confident | 81.3 | Confident | 45 Ų | 45 | 55.1 Ų | 55.1 | 24% | 0.236 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -62.3 | -31.6 | 177.7 | -78.2 | 168.7 | 0 | 0 | 0 | 112.2 | N72 R234 L235 Y240 Y241 S445 | N72-L237 HydrophobicContact CB-CB 4.2Å; N72-L237 WeakPolarHBondContact OD1-CB 3.44Å; R234-L237 WeakPolarHBondContact O-CB 3.29Å; R234-L237 PolarHBondContact O-N 3.36Å; L235-L237 VanDerWaalsContact C-N 3.32Å; L235-L237 PolarHBondContact O-N 2.92Å; L237-Y240 VanDerWaalsContact O-CB 3.29Å; L237-Y240 WeakPolarHBondContact O-CB 3.44Å; L237-Y240 PolarHBondContact O-N 2.61Å; L237-Y241 VanDerWaalsContact O-CD2 3.24Å; L237-Y241 WeakPolarHBondContact O-CD2 3.32Å; L237-Y241 PolarHBondContact O-N 3.35Å; L237-Y241 VanDerWaalsContact O-N 3.16Å; L237-S445 WeakPolarHBondContact CD2-OG 3.35Å |
| 238 | A | 89.8 | Confident | 82 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -68.7 | -41.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | V69 N72 T73 I82 R234 L235 P236 Y240 Y241 G242 | V69-A238 HydrophobicContact CG1-CB 4.46Å; N72-A238 HydrophobicContact CB-CB 3.79Å; T73-A238 HydrophobicContact CG2-CB 3.71Å; I82-A238 HydrophobicContact CD1-CB 3.35Å; R234-A238 PolarHBondContact O-N 3.36Å; L235-A238 WeakPolarHBondContact O-CB 3.27Å; L235-A238 PolarHBondContact O-N 3.08Å; L235-A238 VanDerWaalsContact O-N 3.09Å; P236-A238 PolarHBondContact O-N 3.49Å; A238-Y240 PolarHBondContact O-N 3.19Å; A238-Y241 PolarHBondContact O-N 2.89Å; A238-G242 PolarHBondContact O-N 3.07Å |
| 239 | F | 90.6 | Very high | 83.2 | Confident | 35 Ų | 35 | 42.3 Ų | 42.3 | 15% | 0.154 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.9 | -36.2 | 169.9 | -83.5 | -75 | 0 | 0 | 0 | 111.8 | I82 V85 L89 L235 P236 G242 M243 M438 | I82-F239 HydrophobicContact CG1-CZ 4.49Å; I82-F239 HydrophobicContact CG2-CD1 4.41Å; V85-F239 HydrophobicContact CB-CE1 4.07Å; V85-F239 HydrophobicContact CB-CZ 4.45Å; V85-F239 HydrophobicContact CG1-CE1 3.61Å; V85-F239 HydrophobicContact CG1-CZ 4Å; L89-F239 HydrophobicContact CD1-CE1 4.24Å; L235-F239 HydrophobicContact CD1-CE2 4.4Å; L235-F239 HydrophobicContact CD2-CE2 4.14Å; L235-F239 HydrophobicContact CG-CD2 4.17Å; L235-F239 HydrophobicContact CG-CE2 3.92Å; L235-F239 WeakPolarHBondContact O-CD2 3.41Å; L235-F239 PolarHBondContact O-N 3.37Å; L235-F239 VanDerWaalsContact O-N 3.13Å; P236-F239 WeakPolarHBondContact O-CA 3.46Å; P236-F239 WeakPolarHBondContact O-CB 3.43Å; P236-F239 PolarHBondContact O-N 2.79Å; P236-F239 VanDerWaalsContact O-N 3.08Å; F239-G242 PolarHBondContact O-N 3.43Å; F239-M243 VanDerWaalsContact O-CB 3.27Å; F239-M243 WeakPolarHBondContact O-CB 3.38Å; F239-M243 WeakPolarHBondContact O-CG 3.28Å; F239-M243 PolarHBondContact O-N 3.18Å; F239-M438 HydrophobicContact CB-SD 4.42Å |
| 240 | Y | 86.3 | Confident | 84.5 | Confident | 5 Ų | 5 | 35.4 Ų | 35.4 | 2% | 0.02 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60 | -52.6 | 176.6 | 176.7 | -86.6 | 0 | 0 | 0 | 113.4 | P236 L237 A238 G242 Y244 L389 N390 S393 M438 | P236-Y240 PolarHBondContact O-N 2.98Å; L237-Y240 VanDerWaalsContact O-CB 3.29Å; L237-Y240 WeakPolarHBondContact O-CB 3.44Å; L237-Y240 PolarHBondContact O-N 2.61Å; A238-Y240 PolarHBondContact O-N 3.19Å; Y240-G242 VanDerWaalsContact C-N 3.33Å; Y240-G242 PolarHBondContact O-N 3.49Å; Y240-Y244 PolarHBondContact O-N 3.14Å; Y240-Y244 VanDerWaalsContact O-N 3.09Å; Y240-L389 PolarHBondContact OH-O 2.86Å; Y240-N390 VanDerWaalsContact CZ-OD1 3.26Å; Y240-N390 WeakPolarHBondContact OH-CA 3.11Å; Y240-N390 PolarHBondContact OH-N 3.45Å; Y240-N390 PolarHBondContact OH-OD1 3.01Å; Y240-S393 WeakPolarHBondContact CE2-OG 3.36Å; Y240-S393 VanDerWaalsContact CZ-OG 3.24Å; Y240-S393 WeakPolarHBondContact OH-CB 3.35Å; Y240-S393 PolarHBondContact OH-OG 3.08Å; Y240-M438 VanDerWaalsContact CA-CE 3.45Å; Y240-M438 HydrophobicContact CD2-CE 3.66Å; Y240-M438 HydrophobicContact CG-CE 4.14Å |
| 241 | Y | 88.3 | Confident | 85.8 | Confident | 37 Ų | 37 | 32.7 Ų | 32.7 | 15% | 0.145 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.5 | -37.5 | 175.6 | -75.6 | -73.7 | 0 | 0 | 0 | 112.5 | S65 L237 A238 A245 | S65-Y241 VanDerWaalsContact CB-O 3.29Å; S65-Y241 WeakPolarHBondContact CB-O 3.49Å; S65-Y241 PolarHBondContact OG-O 3.36Å; L237-Y241 VanDerWaalsContact O-CD2 3.24Å; L237-Y241 WeakPolarHBondContact O-CD2 3.32Å; L237-Y241 PolarHBondContact O-N 3.35Å; L237-Y241 VanDerWaalsContact O-N 3.16Å; A238-Y241 PolarHBondContact O-N 2.89Å; Y241-A245 PolarHBondContact O-N 3.26Å |
| 242 | G | 92.6 | Very high | 86.8 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.9 | -51.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A238 F239 Y240 Y244 A245 Y246 | A238-G242 PolarHBondContact O-N 3.07Å; F239-G242 PolarHBondContact O-N 3.43Å; Y240-G242 VanDerWaalsContact C-N 3.33Å; Y240-G242 PolarHBondContact O-N 3.49Å; G242-Y244 VanDerWaalsContact C-N 3.26Å; G242-Y244 PolarHBondContact O-N 2.84Å; G242-A245 WeakPolarHBondContact O-CB 3.41Å; G242-A245 PolarHBondContact O-N 2.8Å; G242-Y246 WeakPolarHBondContact O-CD2 3.46Å; G242-Y246 PolarHBondContact O-N 2.99Å |
| 243 | M | 91.1 | Very high | 87.6 | Confident | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -64.8 | -29.5 | 179.9 | -66.8 | -64.8 | -66.9 | 0 | 0 | 112.3 | C86 L89 F239 Y246 A247 W397 F431 T434 M438 | C86-M243 HydrophobicContact CB-CG 4.49Å; C86-M243 HydrophobicContact CB-SD 3.88Å; L89-M243 HydrophobicContact CB-CE 4.27Å; L89-M243 HydrophobicContact CB-SD 4.12Å; F239-M243 VanDerWaalsContact O-CB 3.27Å; F239-M243 WeakPolarHBondContact O-CB 3.38Å; F239-M243 WeakPolarHBondContact O-CG 3.28Å; F239-M243 PolarHBondContact O-N 3.18Å; M243-Y246 PolarHBondContact O-N 3.03Å; M243-A247 PolarHBondContact O-N 3.49Å; M243-W397 HydrophobicContact CB-CH2 3.98Å; M243-W397 HydrophobicContact CB-CZ2 3.6Å; M243-W397 HydrophobicContact CE-CH2 3.45Å; M243-W397 VanDerWaalsContact CE-CH2 3.45Å; M243-W397 HydrophobicContact CE-CZ2 4.24Å; M243-W397 HydrophobicContact CE-CZ3 3.9Å; M243-F431 HydrophobicContact CE-CE2 4.29Å; M243-T434 HydrophobicContact CE-CG2 4.32Å; M243-M438 HydrophobicContact CB-CE 4.42Å; M243-M438 HydrophobicContact CG-SD 4.41Å |
| 244 | Y | 88.4 | Confident | 87.9 | Confident | 24 Ų | 24 | 19.4 Ų | 19.4 | 9% | 0.094 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -59.5 | -44.9 | 170.3 | 172.1 | -103.4 | 0 | 0 | 0 | 111.9 | V141 Y240 G242 Y246 A247 L389 | V141-Y244 VanDerWaalsContact CG1-OH 3.26Å; V141-Y244 WeakPolarHBondContact CG1-OH 3.43Å; Y240-Y244 PolarHBondContact O-N 3.14Å; Y240-Y244 VanDerWaalsContact O-N 3.09Å; G242-Y244 VanDerWaalsContact C-N 3.26Å; G242-Y244 PolarHBondContact O-N 2.84Å; Y244-Y246 VanDerWaalsContact C-N 3.28Å; Y244-Y246 PolarHBondContact O-N 3.08Å; Y244-A247 WeakPolarHBondContact O-CB 3.45Å; Y244-A247 PolarHBondContact O-N 3.13Å; Y244-L389 HydrophobicContact CD1-CD2 4.41Å; Y244-L389 HydrophobicContact CD2-CD2 3.57Å; Y244-L389 HydrophobicContact CE1-CD2 4.09Å; Y244-L389 HydrophobicContact CE2-CD2 3.19Å; Y244-L389 HydrophobicContact CG-CD2 4.18Å; Y244-L389 VanDerWaalsContact CZ-CD2 3.5Å |
| 245 | A | 91.8 | Very high | 88 | Confident | 2 Ų | 2 | 12.9 Ų | 12.9 | 2% | 0.017 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -66.5 | -28.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | W83 Y241 G242 Y281 | W83-A245 HydrophobicContact CH2-CB 3.54Å; W83-A245 HydrophobicContact CZ3-CB 3.55Å; Y241-A245 PolarHBondContact O-N 3.26Å; G242-A245 WeakPolarHBondContact O-CB 3.41Å; G242-A245 PolarHBondContact O-N 2.8Å; A245-Y281 HydrophobicContact CB-CE2 4.03Å; A245-Y281 VanDerWaalsContact O-CE2 3.25Å; A245-Y281 WeakPolarHBondContact O-CE2 3.43Å; A245-Y281 PolarHBondContact O-OH 3.17Å |
| 246 | Y | 92.4 | Very high | 88 | Confident | 0 Ų | 0 | 10.9 Ų | 10.9 | 0% | 0 | 5% | 0.054 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88 | 0.8 | 177 | -75.2 | -80.1 | 0 | 0 | 0 | 114.2 | W83 C86 S90 G242 M243 Y244 W249 M274 V277 Y281 | W83-Y246 HydrophobicContact CE3-CD2 4.48Å; W83-Y246 AromaticContact CE3-CE2 3.6Å; W83-Y246 HydrophobicContact CE3-CE2 3.6Å; W83-Y246 HydrophobicContact CZ3-CE2 4.01Å; W83-Y246 WeakPolarHBondContact O-CE2 3.41Å; W83-Y246 PolarHBondContact O-OH 3.35Å; W83-Y246 VanDerWaalsContact O-OH 3.13Å; C86-Y246 HydrophobicContact CB-CD2 3.69Å; C86-Y246 HydrophobicContact CB-CE2 3.77Å; S90-Y246 WeakPolarHBondContact OG-CB 3.49Å; G242-Y246 WeakPolarHBondContact O-CD2 3.46Å; G242-Y246 PolarHBondContact O-N 2.99Å; M243-Y246 PolarHBondContact O-N 3.03Å; Y244-Y246 VanDerWaalsContact C-N 3.28Å; Y244-Y246 PolarHBondContact O-N 3.08Å; Y246-W249 VanDerWaalsContact O-CD1 3.27Å; Y246-M274 HydrophobicContact CD1-CE 4.15Å; Y246-V277 HydrophobicContact CD1-CG1 3.8Å; Y246-V277 HydrophobicContact CE1-CG1 3.77Å; Y246-Y281 AromaticContact CD1-CD2 3.99Å; Y246-Y281 HydrophobicContact CD1-CD2 3.99Å; Y246-Y281 HydrophobicContact CD1-CE2 4.05Å; Y246-Y281 HydrophobicContact CD2-CD2 4.28Å; Y246-Y281 HydrophobicContact CD2-CE2 4.5Å; Y246-Y281 AromaticContact CE1-CD2 3.53Å; Y246-Y281 HydrophobicContact CE1-CD2 3.53Å; Y246-Y281 HydrophobicContact CE1-CE2 4.06Å; Y246-Y281 HydrophobicContact CE1-CG 4.36Å; Y246-Y281 AromaticContact CE2-CD2 3.86Å; Y246-Y281 HydrophobicContact CE2-CD2 3.86Å; Y246-Y281 HydrophobicContact CG-CD2 4.33Å; Y246-Y281 HydrophobicContact CG-CE2 4.27Å; Y246-Y281 AromaticContact CZ-CD2 3.45Å; Y246-Y281 VanDerWaalsContact CZ-CD2 3.45Å; Y246-Y281 WeakPolarHBondContact OH-CB 3.3Å |
| 247 | A | 86.9 | Confident | 87.8 | Confident | 18 Ų | 18 | 12 Ų | 12 | 15% | 0.149 | 6% | 0.057 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | 134.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | M243 Y244 | M243-A247 PolarHBondContact O-N 3.49Å; Y244-A247 WeakPolarHBondContact O-CB 3.45Å; Y244-A247 PolarHBondContact O-N 3.13Å |
| 248 | G | 87.4 | Confident | 87.7 | Confident | 0 Ų | 0 | 10.3 Ų | 10.3 | 0% | 0 | 5% | 0.048 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 135.7 | -11.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | F250 Y251 | G248-F250 PolarHBondContact O-N 3.38Å; G248-Y251 VanDerWaalsContact CA-CD2 3.49Å; G248-Y251 WeakPolarHBondContact O-CD2 3.44Å; G248-Y251 PolarHBondContact O-N 3.06Å |
| 249 | W | 91 | Very high | 87.5 | Confident | 1 Ų | 1 | 10.3 Ų | 10.3 | 0% | 0.004 | 5% | 0.048 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -22.9 | 179.3 | 50 | -104.5 | 0 | 0 | 0 | 114.6 | I57 G93 A94 Y97 Y246 M274 I400 F431 | I57-W249 HydrophobicContact CD1-CB 3.85Å; G93-W249 VanDerWaalsContact C-CZ3 3.44Å; G93-W249 WeakPolarHBondContact O-CH2 3.35Å; G93-W249 WeakPolarHBondContact O-CZ3 3.45Å; A94-W249 HydrophobicContact CB-CB 3.83Å; A94-W249 HydrophobicContact CB-CD2 3.64Å; A94-W249 HydrophobicContact CB-CE3 3.57Å; A94-W249 HydrophobicContact CB-CG 3.77Å; A94-W249 HydrophobicContact CB-CZ3 4.34Å; Y97-W249 HydrophobicContact CD1-CZ3 4.04Å; Y97-W249 AromaticContact CD2-CH2 3.53Å; Y97-W249 HydrophobicContact CD2-CH2 3.53Å; Y97-W249 AromaticContact CD2-CZ3 3.36Å; Y97-W249 HydrophobicContact CD2-CZ3 3.36Å; Y97-W249 HydrophobicContact CE1-CZ3 4.49Å; Y97-W249 AromaticContact CE2-CH2 3.66Å; Y97-W249 HydrophobicContact CE2-CH2 3.66Å; Y97-W249 AromaticContact CE2-CZ3 3.87Å; Y97-W249 HydrophobicContact CE2-CZ3 3.87Å; Y97-W249 HydrophobicContact CG-CE3 4.48Å; Y97-W249 HydrophobicContact CG-CH2 4.1Å; Y97-W249 AromaticContact CG-CZ3 3.45Å; Y97-W249 HydrophobicContact CG-CZ3 3.45Å; Y97-W249 VanDerWaalsContact CG-CZ3 3.45Å; Y246-W249 VanDerWaalsContact O-CD1 3.27Å; W249-M274 HydrophobicContact CB-CG 4.47Å; W249-M274 HydrophobicContact CB-SD 3.64Å; W249-M274 HydrophobicContact CG-SD 4.15Å; W249-I400 HydrophobicContact CH2-CG2 4.41Å; W249-F431 HydrophobicContact CH2-CE1 4.24Å; W249-F431 HydrophobicContact CH2-CZ 4.12Å; W249-F431 HydrophobicContact CZ2-CE1 4.21Å; W249-F431 HydrophobicContact CZ2-CE2 4.31Å; W249-F431 AromaticContact CZ2-CZ 3.63Å; W249-F431 HydrophobicContact CZ2-CZ 3.63Å |
| 250 | F | 89.3 | Confident | 87.4 | Confident | 9 Ų | 9 | 13.2 Ų | 13.2 | 4% | 0.039 | 6% | 0.062 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | -8.6 | 179.6 | 48.2 | -107 | 0 | 0 | 0 | 114.3 | Y97 G248 L252 N253 F254 I400 | Y97-F250 HydrophobicContact CD1-CB 3.82Å; Y97-F250 HydrophobicContact CE1-CB 3.83Å; Y97-F250 HydrophobicContact CG-CB 4.5Å; G248-F250 PolarHBondContact O-N 3.38Å; F250-L252 VanDerWaalsContact C-N 3.26Å; F250-L252 PolarHBondContact O-N 3.34Å; F250-N253 WeakPolarHBondContact O-CB 3.16Å; F250-N253 PolarHBondContact O-N 3.18Å; F250-N253 VanDerWaalsContact O-N 3.09Å; F250-F254 HydrophobicContact CB-CE2 4.34Å; F250-F254 HydrophobicContact CD2-CD2 4.44Å; F250-F254 AromaticContact CD2-CE2 3.64Å; F250-F254 HydrophobicContact CD2-CE2 3.64Å; F250-F254 HydrophobicContact CD2-CZ 4.44Å; F250-F254 HydrophobicContact CE2-CE2 4.46Å; F250-F254 HydrophobicContact CG-CE2 4.4Å; F250-F254 VanDerWaalsContact O-CD2 3.25Å; F250-F254 WeakPolarHBondContact O-CD2 3.48Å; F250-F254 VanDerWaalsContact O-CE2 3.32Å; F250-F254 WeakPolarHBondContact O-CE2 3.47Å; F250-I400 HydrophobicContact CD1-CD1 4.16Å; F250-I400 HydrophobicContact CE1-CD1 3.76Å; F250-I400 HydrophobicContact CZ-CD1 4.5Å |
| 251 | Y | 86.3 | Confident | 87.5 | Confident | 26 Ų | 26 | 18 Ų | 18 | 10% | 0.102 | 9% | 0.088 | C | C | . | . | G | 310 helix | trans | -63 | -31.2 | -171 | -81.6 | -65.4 | 0 | 0 | 0 | 113.8 | T56 R135 G248 N253 F254 A337 | T56-Y251 HydrophobicContact CG2-CD2 3.66Å; T56-Y251 HydrophobicContact CG2-CE2 4.1Å; T56-Y251 HydrophobicContact CG2-CG 4.11Å; T56-Y251 WeakPolarHBondContact OG1-CD2 3.26Å; R135-Y251 VanDerWaalsContact NH1-CZ 3.32Å; R135-Y251 PolarHBondContact NH1-OH 3.44Å; G248-Y251 VanDerWaalsContact CA-CD2 3.49Å; G248-Y251 WeakPolarHBondContact O-CD2 3.44Å; G248-Y251 PolarHBondContact O-N 3.06Å; Y251-N253 PolarHBondContact O-N 3.25Å; Y251-F254 HydrophobicContact CD1-CD2 4.4Å; Y251-F254 WeakPolarHBondContact O-CB 3.27Å; Y251-F254 PolarHBondContact O-N 2.95Å; Y251-F254 VanDerWaalsContact O-N 3.12Å; Y251-A337 HydrophobicContact CD1-CB 3.33Å; Y251-A337 HydrophobicContact CE1-CB 3.82Å; Y251-A337 HydrophobicContact CG-CB 4.32Å |
| 252 | L | 85.9 | Confident | 87.6 | Confident | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 9% | 0.088 | C | C | . | . | G | 310 helix | trans | -62.3 | -31.9 | 177.6 | -168.4 | 62.1 | 0 | 0 | 0 | 111.9 | V44 I53 F250 F254 V255 T256 V259 I266 A269 | V44-L252 HydrophobicContact CG1-CD1 4.02Å; I53-L252 HydrophobicContact CD1-CB 4.04Å; I53-L252 HydrophobicContact CD1-CD2 3.84Å; I53-L252 HydrophobicContact CG1-CB 4.04Å; F250-L252 VanDerWaalsContact C-N 3.26Å; F250-L252 PolarHBondContact O-N 3.34Å; L252-F254 PolarHBondContact O-N 3.43Å; L252-V255 HydrophobicContact CD1-CG2 4.21Å; L252-V255 WeakPolarHBondContact O-CG2 3.36Å; L252-V255 PolarHBondContact O-N 3.35Å; L252-T256 PolarHBondContact O-N 2.84Å; L252-V259 HydrophobicContact CD1-CG2 3.79Å; L252-V259 HydrophobicContact CG-CG2 4.22Å; L252-I266 HydrophobicContact CD2-CB 4.41Å; L252-I266 HydrophobicContact CD2-CG1 4.09Å; L252-I266 HydrophobicContact CG-CG1 4.39Å; L252-A269 HydrophobicContact CD2-CB 3.83Å |
| 253 | N | 88.5 | Confident | 87.5 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.105 | C | C | . | . | G | 310 helix | trans | -67.8 | -19.4 | 178 | -65.9 | 81.5 | 0 | 0 | 0 | 113.7 | Y97 G109 Y113 F250 Y251 V255 T256 | Y97-N253 HydrophobicContact CD1-CB 4.31Å; Y97-N253 PolarHBondContact O-ND2 3.15Å; G109-N253 PolarHBondContact N-O 3.06Å; Y113-N253 HydrophobicContact CE2-CB 4.43Å; Y113-N253 WeakPolarHBondContact OH-CB 3.22Å; Y113-N253 PolarHBondContact OH-ND2 3.35Å; F250-N253 WeakPolarHBondContact O-CB 3.16Å; F250-N253 PolarHBondContact O-N 3.18Å; F250-N253 VanDerWaalsContact O-N 3.09Å; Y251-N253 PolarHBondContact O-N 3.25Å; N253-V255 VanDerWaalsContact C-N 3.29Å; N253-T256 WeakPolarHBondContact CA-OG1 3.26Å; N253-T256 PolarHBondContact O-OG1 2.88Å |
| 254 | F | 84.1 | Confident | 87.5 | Confident | 1 Ų | 1 | 29 Ų | 29 | 0% | 0.004 | 14% | 0.14 | C | C | . | . | G | 310 helix | trans | -74.9 | -24.1 | 176 | -69.5 | -89.6 | 0 | 0 | 0 | 112.4 | S107 G108 H110 F250 Y251 L252 A337 L341 | S107-F254 WeakPolarHBondContact CB-O 3.18Å; G108-F254 PolarHBondContact N-O 3.33Å; G108-F254 VanDerWaalsContact N-O 3.12Å; G108-F254 WeakPolarHBondContact O-CD1 3.22Å; G108-F254 WeakPolarHBondContact O-CE1 3.45Å; H110-F254 AromaticContact CD2-CE1 3.94Å; H110-F254 AromaticContact CD2-CZ 3.92Å; H110-F254 AromaticContact CE1-CE1 3.61Å; H110-F254 AromaticContact CE1-CZ 3.11Å; H110-F254 WeakPolarHBondContact CE1-CZ 3.43Å; H110-F254 AromaticContact CG-CZ 3.82Å; H110-F254 AromaticContact ND1-CZ 3.37Å; H110-F254 WeakPolarHBondContact ND1-CZ 3.1Å; H110-F254 AromaticContact NE2-CE1 3.45Å; H110-F254 WeakPolarHBondContact NE2-CE1 3.41Å; H110-F254 AromaticContact NE2-CZ 3.46Å; H110-F254 WeakPolarHBondContact NE2-CZ 3.38Å; F250-F254 HydrophobicContact CB-CE2 4.34Å; F250-F254 HydrophobicContact CD2-CD2 4.44Å; F250-F254 AromaticContact CD2-CE2 3.64Å; F250-F254 HydrophobicContact CD2-CE2 3.64Å; F250-F254 HydrophobicContact CD2-CZ 4.44Å; F250-F254 HydrophobicContact CE2-CE2 4.46Å; F250-F254 HydrophobicContact CG-CE2 4.4Å; F250-F254 VanDerWaalsContact O-CD2 3.25Å; F250-F254 WeakPolarHBondContact O-CD2 3.48Å; F250-F254 VanDerWaalsContact O-CE2 3.32Å; F250-F254 WeakPolarHBondContact O-CE2 3.47Å; Y251-F254 HydrophobicContact CD1-CD2 4.4Å; Y251-F254 WeakPolarHBondContact O-CB 3.27Å; Y251-F254 PolarHBondContact O-N 2.95Å; Y251-F254 VanDerWaalsContact O-N 3.12Å; L252-F254 PolarHBondContact O-N 3.43Å; F254-A337 HydrophobicContact CB-CB 4.4Å; F254-L341 HydrophobicContact CD1-CB 4.07Å; F254-L341 HydrophobicContact CD1-CD1 4.36Å; F254-L341 HydrophobicContact CD1-CD2 4.28Å; F254-L341 HydrophobicContact CD1-CG 4.49Å; F254-L341 HydrophobicContact CE1-CD1 4.23Å; F254-L341 HydrophobicContact CE1-CD2 3.95Å; F254-L341 HydrophobicContact CE1-CG 4.49Å |
| 255 | V | 82.8 | Confident | 87.7 | Confident | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.006 | 14% | 0.139 | C | C | . | . | G | 310 helix | trans | -115.2 | 24.7 | -176.1 | -62.6 | 0 | 0 | 0 | 0 | 111.7 | L252 N253 E257 E258 V259 F336 R340 | L252-V255 HydrophobicContact CD1-CG2 4.21Å; L252-V255 WeakPolarHBondContact O-CG2 3.36Å; L252-V255 PolarHBondContact O-N 3.35Å; N253-V255 VanDerWaalsContact C-N 3.29Å; V255-E257 PolarHBondContact O-N 3.43Å; V255-E257 VanDerWaalsContact O-N 3.15Å; V255-E258 WeakPolarHBondContact O-CA 3.35Å; V255-E258 WeakPolarHBondContact O-CB 3.49Å; V255-E258 PolarHBondContact O-N 3.1Å; V255-V259 PolarHBondContact O-N 3.49Å; V255-F336 HydrophobicContact CG1-CE1 4.05Å; V255-R340 HydrophobicContact CG1-CB 4.43Å; V255-R340 HydrophobicContact CG1-CG 4.01Å |
| 256 | T | 84.1 | Confident | 87.7 | Confident | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.006 | 14% | 0.139 | C | C | . | . | G | 310 helix | trans | -52 | -38 | -176.6 | -58.5 | 0 | 0 | 0 | 0 | 113 | L252 N253 E258 V259 P262 I266 | L252-T256 PolarHBondContact O-N 2.84Å; N253-T256 WeakPolarHBondContact CA-OG1 3.26Å; N253-T256 PolarHBondContact O-OG1 2.88Å; T256-E258 PolarHBondContact O-N 2.94Å; T256-V259 PolarHBondContact O-N 2.98Å; T256-P262 HydrophobicContact CG2-CB 4.4Å; T256-I266 HydrophobicContact CG2-CD1 3.91Å |
| 257 | E | 81.5 | Confident | 87.8 | Confident | 46 Ų | 46 | 29 Ų | 29 | 22% | 0.215 | 14% | 0.142 | C | C | . | . | G | 310 helix | trans | -67.1 | -24.1 | 178.3 | -67.2 | 168 | -164.9 | 0 | 0 | 113.1 | R42 S107 V255 R347 | R42-E257 WeakPolarHBondContact CG-O 3.48Å; S107-E257 PolarHBondContact N-OE1 3.47Å; S107-E257 WeakPolarHBondContact OG-CB 3.35Å; S107-E257 VanDerWaalsContact OG-CG 3.22Å; S107-E257 WeakPolarHBondContact OG-CG 3.33Å; S107-E257 PolarHBondContact OG-N 2.98Å; V255-E257 PolarHBondContact O-N 3.43Å; V255-E257 VanDerWaalsContact O-N 3.15Å; E257-R347 IonicContact OE1-NH2 2.68Å; E257-R347 PolarHBondContact OE1-NH2 3.3Å; E257-R347 IonicContact OE2-NH1 3.95Å; E257-R347 IonicContact OE2-NH2 2.62Å |
| 258 | E | 81.9 | Confident | 88.2 | Confident | 10 Ų | 10 | 32.1 Ų | 32.1 | 5% | 0.047 | 16% | 0.156 | C | C | . | . | G | 310 helix | trans | -89.1 | -9.7 | 178.4 | -59.6 | -176.8 | -137.2 | 0 | 0 | 112.7 | L40 R42 K43 V44 V255 T256 R340 | L40-E258 HydrophobicContact CB-CG 4.36Å; R42-E258 CarbonylContact C-O 3.3Å; R42-E258 WeakPolarHBondContact CA-O 3.28Å; K43-E258 PolarHBondContact N-O 3.01Å; V44-E258 HydrophobicContact CG2-CB 4.03Å; V44-E258 PolarHBondContact N-O 2.94Å; V255-E258 WeakPolarHBondContact O-CA 3.35Å; V255-E258 WeakPolarHBondContact O-CB 3.49Å; V255-E258 PolarHBondContact O-N 3.1Å; T256-E258 PolarHBondContact O-N 2.94Å; E258-R340 IonicContact OE1-CZ 2.73Å; E258-R340 IonicContact OE1-NE 3.71Å; E258-R340 PolarHBondContact OE1-NE 3.43Å; E258-R340 IonicContact OE1-NH2 2.69Å; E258-R340 IonicContact OE2-NH2 3.17Å |
| 259 | V | 86.9 | Confident | 88.4 | Confident | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 16% | 0.156 | C | C | . | . | B | Isolated β-bridge | trans | -78.9 | 131.6 | -178.4 | 179.2 | 0 | 0 | 0 | 0 | 111.5 | V44 L252 V255 T256 P262 T265 I266 | V44-V259 HydrophobicContact CB-CG2 4.16Å; V44-V259 HydrophobicContact CG1-CG2 4.16Å; L252-V259 HydrophobicContact CD1-CG2 3.79Å; L252-V259 HydrophobicContact CG-CG2 4.22Å; V255-V259 PolarHBondContact O-N 3.49Å; T256-V259 PolarHBondContact O-N 2.98Å; V259-P262 HydrophobicContact CB-CG 4.3Å; V259-P262 HydrophobicContact CG1-CG 4.44Å; V259-T265 HydrophobicContact CG1-CG2 3.62Å; V259-I266 HydrophobicContact CG1-CG1 4.2Å |
| 260 | E | 87.6 | Confident | 88.5 | Confident | 96 Ų | 96 | 32 Ų | 32 | 45% | 0.449 | 16% | 0.156 | S | C | . | . | S | Bend | trans | -76.3 | 128.3 | 172.4 | -172.1 | 179.6 | -172 | 0 | 0 | 110.2 | V44 T265 | V44-E260 PolarHBondContact O-N 2.77Å; E260-T265 VanDerWaalsContact O-CB 3.23Å; E260-T265 WeakPolarHBondContact O-CB 3.19Å; E260-T265 PolarHBondContact O-OG1 2.76Å |
| 261 | N | 89.1 | Confident | 88.8 | Confident | 107 Ų | 107 | 34 Ų | 34 | 57% | 0.572 | 17% | 0.17 | S | C | * | . | S | Bend | trans | 46.2 | 64 | -177.2 | -62.6 | -39.1 | 0 | 0 | 0 | 113.8 | E263 K264 T265 | N261-E263 PolarHBondContact O-N 2.87Å; N261-K264 PolarHBondContact O-N 2.71Å; N261-K264 VanDerWaalsContact O-N 3.08Å; N261-T265 WeakPolarHBondContact O-CB 3.45Å; N261-T265 PolarHBondContact O-N 2.93Å; N261-T265 PolarHBondContact O-OG1 2.86Å |
| 262 | P | 89.4 | Confident | 89.2 | Confident | 22 Ų | 22 | 35.8 Ų | 35.8 | 14% | 0.143 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -52.3 | -34.5 | -171.9 | -27.8 | 34.9 | 0 | 0 | 0 | 114.7 | T256 V259 K264 I266 | T256-P262 HydrophobicContact CG2-CB 4.4Å; V259-P262 HydrophobicContact CB-CG 4.3Å; V259-P262 HydrophobicContact CG1-CG 4.44Å; P262-K264 VanDerWaalsContact C-N 3.29Å; P262-K264 PolarHBondContact O-N 3.38Å; P262-I266 HydrophobicContact CB-CD1 3.82Å; P262-I266 HydrophobicContact CB-CG1 4.36Å; P262-I266 VanDerWaalsContact O-CB 3.3Å; P262-I266 WeakPolarHBondContact O-CB 3.41Å; P262-I266 WeakPolarHBondContact O-CG1 3.34Å; P262-I266 PolarHBondContact O-N 3.27Å |
| 263 | E | 91.1 | Very high | 89.6 | Confident | 77 Ų | 77 | 35.8 Ų | 35.8 | 36% | 0.36 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -60.7 | -34.3 | -178.2 | -59.1 | -175.7 | 180 | 0 | 0 | 113.9 | K105 N261 P267 P420 | K105-E263 WeakPolarHBondContact CE-OE1 3.34Å; K105-E263 IonicContact NZ-OE1 3.54Å; K105-E263 PolarHBondContact NZ-OE1 3.21Å; N261-E263 PolarHBondContact O-N 2.87Å; E263-P267 WeakPolarHBondContact O-CD 3.27Å; E263-P267 WeakPolarHBondContact O-CG 3.25Å; E263-P420 HydrophobicContact CB-CB 3.96Å; E263-P420 HydrophobicContact CB-CG 4.43Å; E263-P420 HydrophobicContact CG-CB 3.83Å; E263-P420 HydrophobicContact CG-CG 3.74Å |
| 264 | K | 91.1 | Very high | 89.9 | Confident | 168 Ų | 168 | 35.9 Ų | 35.9 | 73% | 0.73 | 18% | 0.181 | S | C | * | . | H | α-helix | trans | -100.1 | -41.6 | 178.6 | -65.3 | -176.8 | 179.8 | 180 | 0 | 111.1 | N261 P262 L268 | N261-K264 PolarHBondContact O-N 2.71Å; N261-K264 VanDerWaalsContact O-N 3.08Å; P262-K264 VanDerWaalsContact C-N 3.29Å; P262-K264 PolarHBondContact O-N 3.38Å; K264-L268 VanDerWaalsContact O-CB 3.23Å; K264-L268 WeakPolarHBondContact O-CB 3.36Å; K264-L268 PolarHBondContact O-N 2.79Å |
| 265 | T | 92.6 | Very high | 90.4 | Very high | 14 Ų | 14 | 38.2 Ų | 38.2 | 9% | 0.086 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -69.6 | -42.5 | -172.6 | -61.3 | 0 | 0 | 0 | 0 | 112.5 | L46 V259 E260 N261 A269 | L46-T265 HydrophobicContact CB-CG2 4.26Å; L46-T265 HydrophobicContact CD1-CG2 4.2Å; V259-T265 HydrophobicContact CG1-CG2 3.62Å; E260-T265 VanDerWaalsContact O-CB 3.23Å; E260-T265 WeakPolarHBondContact O-CB 3.19Å; E260-T265 PolarHBondContact O-OG1 2.76Å; N261-T265 WeakPolarHBondContact O-CB 3.45Å; N261-T265 PolarHBondContact O-N 2.93Å; N261-T265 PolarHBondContact O-OG1 2.86Å; T265-A269 WeakPolarHBondContact O-CB 3.46Å; T265-A269 PolarHBondContact O-N 2.94Å |
| 266 | I | 92.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.5 | -53.6 | -176.9 | -64.9 | 174.4 | 0 | 0 | 0 | 111.3 | A98 L252 T256 V259 P262 L268 A269 I270 | A98-I266 HydrophobicContact CB-CG2 4.32Å; L252-I266 HydrophobicContact CD2-CB 4.41Å; L252-I266 HydrophobicContact CD2-CG1 4.09Å; L252-I266 HydrophobicContact CG-CG1 4.39Å; T256-I266 HydrophobicContact CG2-CD1 3.91Å; V259-I266 HydrophobicContact CG1-CG1 4.2Å; P262-I266 HydrophobicContact CB-CD1 3.82Å; P262-I266 HydrophobicContact CB-CG1 4.36Å; P262-I266 VanDerWaalsContact O-CB 3.3Å; P262-I266 WeakPolarHBondContact O-CB 3.41Å; P262-I266 WeakPolarHBondContact O-CG1 3.34Å; P262-I266 PolarHBondContact O-N 3.27Å; I266-L268 VanDerWaalsContact C-N 3.35Å; I266-L268 PolarHBondContact O-N 3.4Å; I266-A269 PolarHBondContact O-N 3.31Å; I266-I270 HydrophobicContact CG2-CD1 3.72Å; I266-I270 WeakPolarHBondContact O-CB 3.33Å; I266-I270 WeakPolarHBondContact O-CG1 3.48Å; I266-I270 PolarHBondContact O-N 3.25Å |
| 267 | P | 93.9 | Very high | 91.4 | Very high | 12 Ų | 12 | 41.6 Ų | 41.6 | 8% | 0.078 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62 | -41.9 | -179.4 | -22.6 | 34.4 | 0 | 0 | 0 | 112.6 | A98 T102 E263 I270 C271 F421 | A98-P267 HydrophobicContact CB-CB 4.41Å; A98-P267 HydrophobicContact CB-CG 4.35Å; T102-P267 HydrophobicContact CG2-CG 3.98Å; E263-P267 WeakPolarHBondContact O-CD 3.27Å; E263-P267 WeakPolarHBondContact O-CG 3.25Å; P267-I270 PolarHBondContact O-N 3.44Å; P267-C271 PolarHBondContact O-N 3.49Å; P267-C271 PolarHBondContact O-SG 3.39Å; P267-F421 HydrophobicContact CB-CD1 4.46Å; P267-F421 HydrophobicContact CB-CD2 3.76Å; P267-F421 HydrophobicContact CB-CE2 3.83Å; P267-F421 HydrophobicContact CB-CG 4.09Å; P267-F421 HydrophobicContact CB-CZ 4.21Å; P267-F421 HydrophobicContact CG-CB 3.96Å; P267-F421 HydrophobicContact CG-CD1 4.25Å; P267-F421 HydrophobicContact CG-CD2 3.8Å; P267-F421 HydrophobicContact CG-CE2 4.37Å; P267-F421 HydrophobicContact CG-CG 3.74Å |
| 268 | L | 94.4 | Very high | 92.1 | Very high | 83 Ų | 83 | 40.6 Ų | 40.6 | 44% | 0.435 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -67.5 | -44.5 | -178.4 | -172.3 | 64.6 | 0 | 0 | 0 | 111.8 | L46 K264 I266 I270 C271 I272 | L46-L268 HydrophobicContact CD1-CB 4.04Å; L46-L268 HydrophobicContact CD1-CD2 3.91Å; L46-L268 HydrophobicContact CD1-CG 4.01Å; L46-L268 HydrophobicContact CD2-CD2 3.51Å; L46-L268 HydrophobicContact CD2-CG 4.34Å; L46-L268 HydrophobicContact CG-CD2 4.37Å; K264-L268 VanDerWaalsContact O-CB 3.23Å; K264-L268 WeakPolarHBondContact O-CB 3.36Å; K264-L268 PolarHBondContact O-N 2.79Å; I266-L268 VanDerWaalsContact C-N 3.35Å; I266-L268 PolarHBondContact O-N 3.4Å; L268-I270 VanDerWaalsContact C-N 3.34Å; L268-I270 PolarHBondContact O-N 3Å; L268-C271 PolarHBondContact O-N 3.47Å; L268-I272 HydrophobicContact CD1-CD1 3.81Å; L268-I272 HydrophobicContact CD1-CG1 4.3Å; L268-I272 HydrophobicContact CG-CD1 3.77Å; L268-I272 WeakPolarHBondContact O-CB 3.38Å; L268-I272 VanDerWaalsContact O-CG1 3.3Å; L268-I272 WeakPolarHBondContact O-CG1 3.28Å; L268-I272 PolarHBondContact O-N 3.08Å; L268-I272 VanDerWaalsContact O-N 3.09Å |
| 269 | A | 92.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.9 | -46 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | L46 I50 I53 L252 T265 I266 S273 | L46-A269 HydrophobicContact CD1-CB 4.04Å; I50-A269 HydrophobicContact CG1-CB 3.98Å; I53-A269 HydrophobicContact CD1-CB 3.92Å; L252-A269 HydrophobicContact CD2-CB 3.83Å; T265-A269 WeakPolarHBondContact O-CB 3.46Å; T265-A269 PolarHBondContact O-N 2.94Å; I266-A269 PolarHBondContact O-N 3.31Å; A269-S273 WeakPolarHBondContact O-CB 3.2Å; A269-S273 PolarHBondContact O-N 3.26Å; A269-S273 PolarHBondContact O-OG 3.03Å |
| 270 | I | 93.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.9 | -50.2 | 179 | -76 | 170.8 | 0 | 0 | 0 | 111.7 | I53 A94 A98 I266 P267 L268 S273 M274 | I53-I270 HydrophobicContact CD1-CG1 3.72Å; A94-I270 HydrophobicContact CB-CG2 3.35Å; A98-I270 HydrophobicContact CB-CD1 3.89Å; I266-I270 HydrophobicContact CG2-CD1 3.72Å; I266-I270 WeakPolarHBondContact O-CB 3.33Å; I266-I270 WeakPolarHBondContact O-CG1 3.48Å; I266-I270 PolarHBondContact O-N 3.25Å; P267-I270 PolarHBondContact O-N 3.44Å; L268-I270 VanDerWaalsContact C-N 3.34Å; L268-I270 PolarHBondContact O-N 3Å; I270-S273 PolarHBondContact O-N 3.43Å; I270-M274 HydrophobicContact CG2-CG 4.37Å; I270-M274 WeakPolarHBondContact O-CB 3.25Å; I270-M274 VanDerWaalsContact O-CG 3.3Å; I270-M274 WeakPolarHBondContact O-CG 3.28Å; I270-M274 PolarHBondContact O-N 3.13Å |
| 271 | C | 93.9 | Very high | 93.5 | Very high | 51 Ų | 51 | 41.1 Ų | 41.1 | 35% | 0.345 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -63.4 | -46.8 | -176.4 | -65.8 | 0 | 0 | 0 | 0 | 111.8 | P267 L268 A275 | P267-C271 PolarHBondContact O-N 3.49Å; P267-C271 PolarHBondContact O-SG 3.39Å; L268-C271 PolarHBondContact O-N 3.47Å; C271-A275 WeakPolarHBondContact O-CB 3.31Å; C271-A275 PolarHBondContact O-N 3.3Å |
| 272 | I | 95.1 | Very high | 93.9 | Very high | 63 Ų | 63 | 37.6 Ų | 37.6 | 32% | 0.323 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -62.2 | -49.2 | 179.1 | -67 | 171.5 | 0 | 0 | 0 | 110.1 | I50 L268 M274 A275 I276 | I50-I272 HydrophobicContact CD1-CB 4.39Å; I50-I272 HydrophobicContact CD1-CD1 4.06Å; I50-I272 HydrophobicContact CD1-CG2 4.11Å; L268-I272 HydrophobicContact CD1-CD1 3.81Å; L268-I272 HydrophobicContact CD1-CG1 4.3Å; L268-I272 HydrophobicContact CG-CD1 3.77Å; L268-I272 WeakPolarHBondContact O-CB 3.38Å; L268-I272 VanDerWaalsContact O-CG1 3.3Å; L268-I272 WeakPolarHBondContact O-CG1 3.28Å; L268-I272 PolarHBondContact O-N 3.08Å; L268-I272 VanDerWaalsContact O-N 3.09Å; I272-M274 PolarHBondContact O-N 3.05Å; I272-A275 PolarHBondContact O-N 3.3Å; I272-I276 HydrophobicContact CG2-CD1 3.67Å; I272-I276 VanDerWaalsContact O-CG1 3.31Å; I272-I276 WeakPolarHBondContact O-CG1 3.49Å; I272-I276 PolarHBondContact O-N 3.15Å |
| 273 | S | 93.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.7 | -44.4 | -179.1 | -65.3 | 0 | 0 | 0 | 0 | 112.3 | I50 A269 I270 A275 I276 V277 | I50-S273 PolarHBondContact O-OG 2.87Å; A269-S273 WeakPolarHBondContact O-CB 3.2Å; A269-S273 PolarHBondContact O-N 3.26Å; A269-S273 PolarHBondContact O-OG 3.03Å; I270-S273 PolarHBondContact O-N 3.43Å; S273-A275 PolarHBondContact O-N 3.09Å; S273-I276 PolarHBondContact O-N 2.96Å; S273-V277 WeakPolarHBondContact O-CB 3.34Å; S273-V277 WeakPolarHBondContact O-CG2 3.38Å; S273-V277 PolarHBondContact O-N 3.01Å |
| 274 | M | 94.8 | Very high | 94.4 | Very high | 2 Ų | 2 | 36 Ų | 36 | 1% | 0.01 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.8 | -37.4 | 179.7 | -73.9 | -54.1 | -56.1 | 0 | 0 | 112.7 | I57 S90 L91 A94 Y246 W249 I270 I272 T278 | I57-M274 HydrophobicContact CD1-SD 3.74Å; S90-M274 VanDerWaalsContact CB-CE 3.49Å; L91-M274 HydrophobicContact CD1-CB 3.85Å; L91-M274 HydrophobicContact CD1-CG 4.17Å; A94-M274 HydrophobicContact CB-CG 4.13Å; Y246-M274 HydrophobicContact CD1-CE 4.15Å; W249-M274 HydrophobicContact CB-CG 4.47Å; W249-M274 HydrophobicContact CB-SD 3.64Å; W249-M274 HydrophobicContact CG-SD 4.15Å; I270-M274 HydrophobicContact CG2-CG 4.37Å; I270-M274 WeakPolarHBondContact O-CB 3.25Å; I270-M274 VanDerWaalsContact O-CG 3.3Å; I270-M274 WeakPolarHBondContact O-CG 3.28Å; I270-M274 PolarHBondContact O-N 3.13Å; I272-M274 PolarHBondContact O-N 3.05Å; M274-T278 VanDerWaalsContact O-CB 3.31Å; M274-T278 WeakPolarHBondContact O-CB 3.47Å; M274-T278 PolarHBondContact O-N 2.9Å; M274-T278 PolarHBondContact O-OG1 2.99Å |
| 275 | A | 95.2 | Very high | 94.6 | Very high | 50 Ų | 50 | 28.1 Ų | 28.1 | 41% | 0.413 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -63.4 | -49.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | C271 I272 S273 V277 T278 I279 | C271-A275 WeakPolarHBondContact O-CB 3.31Å; C271-A275 PolarHBondContact O-N 3.3Å; I272-A275 PolarHBondContact O-N 3.3Å; S273-A275 PolarHBondContact O-N 3.09Å; A275-V277 PolarHBondContact O-N 2.68Å; A275-T278 PolarHBondContact O-N 2.84Å; A275-I279 WeakPolarHBondContact O-CB 3.48Å; A275-I279 WeakPolarHBondContact O-CG1 3.4Å; A275-I279 PolarHBondContact O-N 3.33Å |
| 276 | I | 93.5 | Very high | 94.8 | Very high | 72 Ų | 72 | 28.8 Ų | 28.8 | 37% | 0.369 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -58.5 | -47.4 | 178.2 | -69 | 168.2 | 0 | 0 | 0 | 110.9 | I54 L199 I272 S273 G280 | I54-I276 HydrophobicContact CD1-CB 4.45Å; I54-I276 HydrophobicContact CD1-CD1 3.99Å; I54-I276 HydrophobicContact CD1-CG2 4.19Å; L199-I276 HydrophobicContact CD2-CG2 4.43Å; I272-I276 HydrophobicContact CG2-CD1 3.67Å; I272-I276 VanDerWaalsContact O-CG1 3.31Å; I272-I276 WeakPolarHBondContact O-CG1 3.49Å; I272-I276 PolarHBondContact O-N 3.15Å; S273-I276 PolarHBondContact O-N 2.96Å; I276-G280 PolarHBondContact O-N 2.84Å |
| 277 | V | 94.6 | Very high | 94.9 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.5 | -45.2 | -179.7 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | I57 I58 Y246 S273 A275 G280 Y281 | I57-V277 HydrophobicContact CB-CG2 4.29Å; I57-V277 HydrophobicContact CD1-CG2 4.29Å; I57-V277 HydrophobicContact CG2-CB 4.49Å; I57-V277 HydrophobicContact CG2-CG1 3.64Å; I57-V277 HydrophobicContact CG2-CG2 4.13Å; I58-V277 HydrophobicContact CD1-CG2 4.05Å; I58-V277 HydrophobicContact CG1-CG2 3.86Å; Y246-V277 HydrophobicContact CD1-CG1 3.8Å; Y246-V277 HydrophobicContact CE1-CG1 3.77Å; S273-V277 WeakPolarHBondContact O-CB 3.34Å; S273-V277 WeakPolarHBondContact O-CG2 3.38Å; S273-V277 PolarHBondContact O-N 3.01Å; A275-V277 PolarHBondContact O-N 2.68Å; V277-G280 PolarHBondContact O-N 2.89Å; V277-Y281 HydrophobicContact CG1-CD1 4.14Å; V277-Y281 HydrophobicContact CG1-CD2 3.8Å; V277-Y281 HydrophobicContact CG1-CE1 3.9Å; V277-Y281 HydrophobicContact CG1-CE2 3.54Å; V277-Y281 HydrophobicContact CG1-CG 4.11Å; V277-Y281 WeakPolarHBondContact O-CB 3.46Å; V277-Y281 VanDerWaalsContact O-CG 3.29Å; V277-Y281 PolarHBondContact O-N 2.85Å |
| 278 | T | 95.8 | Very high | 94.9 | Very high | 26 Ų | 26 | 28.3 Ų | 28.3 | 16% | 0.16 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.1 | -47.5 | -176.9 | -55.3 | 0 | 0 | 0 | 0 | 111.5 | M274 A275 Y281 V282 | M274-T278 VanDerWaalsContact O-CB 3.31Å; M274-T278 WeakPolarHBondContact O-CB 3.47Å; M274-T278 PolarHBondContact O-N 2.9Å; M274-T278 PolarHBondContact O-OG1 2.99Å; A275-T278 PolarHBondContact O-N 2.84Å; T278-Y281 PolarHBondContact O-N 3.22Å; T278-V282 WeakPolarHBondContact O-CG2 3.33Å; T278-V282 PolarHBondContact O-N 3.22Å; T278-V282 VanDerWaalsContact O-N 3.1Å |
| 279 | I | 95.8 | Very high | 94.9 | Very high | 107 Ų | 107 | 24.5 Ų | 24.5 | 55% | 0.549 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -62.1 | -47.6 | 176.1 | -66.5 | 168.1 | 0 | 0 | 0 | 110 | A275 Y281 V282 L283 | A275-I279 WeakPolarHBondContact O-CB 3.48Å; A275-I279 WeakPolarHBondContact O-CG1 3.4Å; A275-I279 PolarHBondContact O-N 3.33Å; I279-Y281 PolarHBondContact O-N 2.77Å; I279-V282 PolarHBondContact O-N 3.08Å; I279-L283 HydrophobicContact CG2-CD1 3.67Å; I279-L283 HydrophobicContact CG2-CG 4.24Å; I279-L283 WeakPolarHBondContact O-CB 3.42Å; I279-L283 VanDerWaalsContact O-CG 3.27Å; I279-L283 WeakPolarHBondContact O-CG 3.39Å; I279-L283 PolarHBondContact O-N 2.79Å |
| 280 | G | 95.1 | Very high | 94.9 | Very high | 10 Ų | 10 | 24.8 Ų | 24.8 | 10% | 0.103 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -56.8 | -48.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I276 V277 L283 T284 | I276-G280 PolarHBondContact O-N 2.84Å; V277-G280 PolarHBondContact O-N 2.89Å; G280-L283 PolarHBondContact O-N 3.37Å; G280-T284 WeakPolarHBondContact O-CB 3.43Å; G280-T284 PolarHBondContact O-N 3.47Å; G280-T284 PolarHBondContact O-OG1 3.36Å |
| 281 | Y | 96.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -66.5 | -42.8 | -178.3 | -74.2 | 3.9 | 0 | 0 | 0 | 113 | I57 I58 I62 W83 A245 Y246 V277 T278 I279 T284 N285 | I57-Y281 HydrophobicContact CG2-CE2 4.49Å; I57-Y281 PolarHBondContact O-OH 3.43Å; I58-Y281 WeakPolarHBondContact CA-OH 3.41Å; I58-Y281 HydrophobicContact CG1-CE1 4.1Å; I62-Y281 HydrophobicContact CB-CD1 3.96Å; I62-Y281 HydrophobicContact CB-CE1 3.57Å; I62-Y281 HydrophobicContact CD1-CD1 3.62Å; I62-Y281 HydrophobicContact CD1-CD2 4.21Å; I62-Y281 HydrophobicContact CD1-CE1 4.15Å; I62-Y281 HydrophobicContact CD1-CG 3.64Å; I62-Y281 HydrophobicContact CG1-CD1 3.61Å; I62-Y281 HydrophobicContact CG1-CE1 3.77Å; I62-Y281 HydrophobicContact CG1-CG 4.17Å; I62-Y281 HydrophobicContact CG2-CE1 4.04Å; W83-Y281 AromaticContact CE3-CD2 3.89Å; W83-Y281 HydrophobicContact CE3-CD2 3.89Å; W83-Y281 HydrophobicContact CE3-CG 4.29Å; W83-Y281 HydrophobicContact CH2-CD2 4.47Å; W83-Y281 AromaticContact CZ3-CD2 3.41Å; W83-Y281 HydrophobicContact CZ3-CD2 3.41Å; W83-Y281 VanDerWaalsContact CZ3-CD2 3.41Å; W83-Y281 HydrophobicContact CZ3-CE2 4.04Å; W83-Y281 AromaticContact CZ3-CG 3.96Å; W83-Y281 HydrophobicContact CZ3-CG 3.96Å; A245-Y281 HydrophobicContact CB-CE2 4.03Å; A245-Y281 VanDerWaalsContact O-CE2 3.25Å; A245-Y281 WeakPolarHBondContact O-CE2 3.43Å; A245-Y281 PolarHBondContact O-OH 3.17Å; Y246-Y281 AromaticContact CD1-CD2 3.99Å; Y246-Y281 HydrophobicContact CD1-CD2 3.99Å; Y246-Y281 HydrophobicContact CD1-CE2 4.05Å; Y246-Y281 HydrophobicContact CD2-CD2 4.28Å; Y246-Y281 HydrophobicContact CD2-CE2 4.5Å; Y246-Y281 AromaticContact CE1-CD2 3.53Å; Y246-Y281 HydrophobicContact CE1-CD2 3.53Å; Y246-Y281 HydrophobicContact CE1-CE2 4.06Å; Y246-Y281 HydrophobicContact CE1-CG 4.36Å; Y246-Y281 AromaticContact CE2-CD2 3.86Å; Y246-Y281 HydrophobicContact CE2-CD2 3.86Å; Y246-Y281 HydrophobicContact CG-CD2 4.33Å; Y246-Y281 HydrophobicContact CG-CE2 4.27Å; Y246-Y281 AromaticContact CZ-CD2 3.45Å; Y246-Y281 VanDerWaalsContact CZ-CD2 3.45Å; Y246-Y281 WeakPolarHBondContact OH-CB 3.3Å; V277-Y281 HydrophobicContact CG1-CD1 4.14Å; V277-Y281 HydrophobicContact CG1-CD2 3.8Å; V277-Y281 HydrophobicContact CG1-CE1 3.9Å; V277-Y281 HydrophobicContact CG1-CE2 3.54Å; V277-Y281 HydrophobicContact CG1-CG 4.11Å; V277-Y281 WeakPolarHBondContact O-CB 3.46Å; V277-Y281 VanDerWaalsContact O-CG 3.29Å; V277-Y281 PolarHBondContact O-N 2.85Å; T278-Y281 PolarHBondContact O-N 3.22Å; I279-Y281 PolarHBondContact O-N 2.77Å; Y281-T284 PolarHBondContact O-N 3.25Å; Y281-N285 PolarHBondContact O-N 3.42Å; Y281-N285 PolarHBondContact O-ND2 3.46Å |
| 282 | V | 96.5 | Very high | 94.5 | Very high | 33 Ų | 33 | 23.8 Ų | 23.8 | 20% | 0.2 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.7 | -47 | 176 | 173.4 | 0 | 0 | 0 | 0 | 109.9 | W83 T278 I279 T284 N285 V286 | W83-V282 HydrophobicContact CB-CG2 4.19Å; T278-V282 WeakPolarHBondContact O-CG2 3.33Å; T278-V282 PolarHBondContact O-N 3.22Å; T278-V282 VanDerWaalsContact O-N 3.1Å; I279-V282 PolarHBondContact O-N 3.08Å; V282-T284 VanDerWaalsContact C-N 3.35Å; V282-T284 PolarHBondContact O-N 3.15Å; V282-N285 PolarHBondContact O-N 3.46Å; V282-V286 HydrophobicContact CG1-CG2 4.48Å; V282-V286 WeakPolarHBondContact O-CG2 3.25Å; V282-V286 PolarHBondContact O-N 2.97Å |
| 283 | L | 96.2 | Very high | 94.3 | Very high | 66 Ų | 66 | 24.2 Ų | 24.2 | 35% | 0.346 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -64.1 | -36.5 | 178.1 | -71.4 | 178.9 | 0 | 0 | 0 | 112.9 | I206 I279 G280 V286 A287 | I206-L283 HydrophobicContact CD1-CB 3.7Å; I206-L283 HydrophobicContact CD1-CD1 4.34Å; I206-L283 HydrophobicContact CG1-CB 3.9Å; I206-L283 HydrophobicContact CG2-CB 4.1Å; I206-L283 HydrophobicContact CG2-CD1 4.2Å; I279-L283 HydrophobicContact CG2-CD1 3.67Å; I279-L283 HydrophobicContact CG2-CG 4.24Å; I279-L283 WeakPolarHBondContact O-CB 3.42Å; I279-L283 VanDerWaalsContact O-CG 3.27Å; I279-L283 WeakPolarHBondContact O-CG 3.39Å; I279-L283 PolarHBondContact O-N 2.79Å; G280-L283 PolarHBondContact O-N 3.37Å; L283-V286 PolarHBondContact O-N 3.05Å; L283-A287 WeakPolarHBondContact O-CB 3.35Å; L283-A287 PolarHBondContact O-N 3.09Å |
| 284 | T | 95.6 | Very high | 94 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.1 | -43.2 | 173.7 | -66 | 0 | 0 | 0 | 0 | 111.3 | I62 I205 G280 Y281 V282 A287 Y288 | I62-T284 HydrophobicContact CD1-CG2 4.28Å; I62-T284 HydrophobicContact CG1-CG2 4.04Å; I205-T284 HydrophobicContact CG2-CG2 4.01Å; G280-T284 WeakPolarHBondContact O-CB 3.43Å; G280-T284 PolarHBondContact O-N 3.47Å; G280-T284 PolarHBondContact O-OG1 3.36Å; Y281-T284 PolarHBondContact O-N 3.25Å; V282-T284 VanDerWaalsContact C-N 3.35Å; V282-T284 PolarHBondContact O-N 3.15Å; T284-A287 WeakPolarHBondContact O-CB 3.47Å; T284-A287 PolarHBondContact O-N 3.48Å; T284-Y288 HydrophobicContact CG2-CD2 4.3Å; T284-Y288 HydrophobicContact CG2-CE1 4.32Å; T284-Y288 HydrophobicContact CG2-CE2 3.62Å; T284-Y288 WeakPolarHBondContact O-CD2 3.23Å; T284-Y288 PolarHBondContact O-N 2.88Å |
| 285 | N | 95.6 | Very high | 93.6 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.005 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -68.9 | -39.9 | 176.9 | -76.3 | -87.3 | 0 | 0 | 0 | 111.8 | L80 W83 Y281 V282 A287 Y288 F289 | L80-N285 HydrophobicContact CD2-CB 3.61Å; W83-N285 VanDerWaalsContact NE1-CG 3.32Å; W83-N285 PolarHBondContact NE1-ND2 2.85Å; W83-N285 PolarHBondContact NE1-OD1 3.12Å; W83-N285 VanDerWaalsContact NE1-OD1 3.1Å; Y281-N285 PolarHBondContact O-N 3.42Å; Y281-N285 PolarHBondContact O-ND2 3.46Å; V282-N285 PolarHBondContact O-N 3.46Å; N285-A287 VanDerWaalsContact C-N 3.29Å; N285-A287 PolarHBondContact O-N 3.24Å; N285-Y288 PolarHBondContact O-N 3.17Å; N285-F289 HydrophobicContact CB-CE2 4.37Å; N285-F289 WeakPolarHBondContact O-CD2 3.36Å; N285-F289 PolarHBondContact O-N 3.44Å |
| 286 | V | 95.3 | Very high | 93.4 | Very high | 29 Ų | 29 | 31.8 Ų | 31.8 | 18% | 0.176 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -56.6 | -46.5 | 171.3 | 170.3 | 0 | 0 | 0 | 0 | 110.3 | L80 F221 V282 L283 Y288 F289 T290 | L80-V286 HydrophobicContact CD1-CG2 4.11Å; L80-V286 HydrophobicContact CD2-CG2 4.01Å; F221-V286 HydrophobicContact CZ-CG1 3.98Å; V282-V286 HydrophobicContact CG1-CG2 4.48Å; V282-V286 WeakPolarHBondContact O-CG2 3.25Å; V282-V286 PolarHBondContact O-N 2.97Å; L283-V286 PolarHBondContact O-N 3.05Å; V286-Y288 PolarHBondContact O-N 3.35Å; V286-F289 PolarHBondContact O-N 3.15Å; V286-T290 HydrophobicContact CG1-CG2 4.45Å; V286-T290 WeakPolarHBondContact O-CG2 3.44Å; V286-T290 PolarHBondContact O-N 2.89Å |
| 287 | A | 95.1 | Very high | 93.3 | Very high | 2 Ų | 2 | 28.4 Ų | 28.4 | 2% | 0.017 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -57.7 | -46.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I205 L283 T284 N285 F289 T290 T291 F307 | I205-A287 HydrophobicContact CG2-CB 3.88Å; I205-A287 WeakPolarHBondContact O-CB 3.22Å; L283-A287 WeakPolarHBondContact O-CB 3.35Å; L283-A287 PolarHBondContact O-N 3.09Å; T284-A287 WeakPolarHBondContact O-CB 3.47Å; T284-A287 PolarHBondContact O-N 3.48Å; N285-A287 VanDerWaalsContact C-N 3.29Å; N285-A287 PolarHBondContact O-N 3.24Å; A287-F289 VanDerWaalsContact C-N 3.33Å; A287-F289 PolarHBondContact O-N 3.07Å; A287-T290 PolarHBondContact O-N 3.01Å; A287-T290 VanDerWaalsContact O-N 3.11Å; A287-T290 PolarHBondContact O-OG1 3.32Å; A287-T291 PolarHBondContact O-N 2.91Å; A287-F307 HydrophobicContact CB-CE2 4.32Å; A287-F307 HydrophobicContact CB-CZ 4.43Å; A287-F307 VanDerWaalsContact O-CE2 3.31Å; A287-F307 WeakPolarHBondContact O-CE2 3.25Å |
| 288 | Y | 94.3 | Very high | 93 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -54.3 | -49.6 | 174.7 | -64.7 | -32.1 | 0 | 0 | 0 | 111.6 | P66 I205 T284 N285 V286 T290 T291 I292 V303 F307 | P66-Y288 HydrophobicContact CB-CD2 4.41Å; P66-Y288 HydrophobicContact CB-CE2 4.42Å; P66-Y288 HydrophobicContact CG-CD2 4.37Å; P66-Y288 HydrophobicContact CG-CE2 3.95Å; I205-Y288 HydrophobicContact CD1-CE1 4.23Å; I205-Y288 HydrophobicContact CG2-CD1 4.06Å; I205-Y288 HydrophobicContact CG2-CE1 3.65Å; T284-Y288 HydrophobicContact CG2-CD2 4.3Å; T284-Y288 HydrophobicContact CG2-CE1 4.32Å; T284-Y288 HydrophobicContact CG2-CE2 3.62Å; T284-Y288 WeakPolarHBondContact O-CD2 3.23Å; T284-Y288 PolarHBondContact O-N 2.88Å; N285-Y288 PolarHBondContact O-N 3.17Å; V286-Y288 PolarHBondContact O-N 3.35Å; Y288-T290 VanDerWaalsContact C-N 3.26Å; Y288-T290 PolarHBondContact O-N 3.36Å; Y288-T291 PolarHBondContact O-N 3.41Å; Y288-T291 VanDerWaalsContact O-N 3.15Å; Y288-I292 WeakPolarHBondContact O-CG1 3.36Å; Y288-I292 PolarHBondContact O-N 3.1Å; Y288-V303 HydrophobicContact CD1-CG1 4.04Å; Y288-V303 HydrophobicContact CD2-CG1 3.75Å; Y288-V303 HydrophobicContact CE1-CG1 4.09Å; Y288-V303 HydrophobicContact CE2-CG1 3.8Å; Y288-V303 HydrophobicContact CG-CG1 3.88Å; Y288-F307 HydrophobicContact CD1-CB 3.84Å; Y288-F307 AromaticContact CD1-CD2 3.84Å; Y288-F307 HydrophobicContact CD1-CD2 3.84Å; Y288-F307 AromaticContact CD1-CG 3.88Å; Y288-F307 HydrophobicContact CD1-CG 3.88Å; Y288-F307 HydrophobicContact CE1-CB 3.97Å; Y288-F307 HydrophobicContact CE1-CG 4.14Å |
| 289 | F | 93.8 | Very high | 92.7 | Very high | 2 Ų | 2 | 36.9 Ų | 36.9 | 1% | 0.009 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -70.5 | -13.3 | -179.7 | -63.3 | -56.9 | 0 | 0 | 0 | 115 | L70 V76 S79 L80 N220 F221 N285 V286 A287 L297 | L70-F289 HydrophobicContact CD1-CE1 4.22Å; L70-F289 HydrophobicContact CD1-CZ 4.08Å; L70-F289 HydrophobicContact CD2-CE1 3.82Å; L70-F289 HydrophobicContact CD2-CZ 4.18Å; V76-F289 HydrophobicContact CB-CE1 4.49Å; V76-F289 HydrophobicContact CG1-CB 4.14Å; V76-F289 HydrophobicContact CG1-CD1 3.93Å; V76-F289 HydrophobicContact CG1-CD2 3.57Å; V76-F289 HydrophobicContact CG1-CE1 4.19Å; V76-F289 HydrophobicContact CG1-CE2 3.86Å; V76-F289 HydrophobicContact CG1-CG 3.61Å; V76-F289 HydrophobicContact CG1-CZ 4.16Å; V76-F289 HydrophobicContact CG2-CD1 3.9Å; V76-F289 HydrophobicContact CG2-CE1 3.85Å; V76-F289 HydrophobicContact CG2-CG 4.43Å; V76-F289 HydrophobicContact CG2-CZ 4.36Å; S79-F289 WeakPolarHBondContact OG-CE2 3.23Å; L80-F289 HydrophobicContact CD2-CD2 4.28Å; L80-F289 HydrophobicContact CD2-CE2 4.22Å; L80-F289 HydrophobicContact CG-CD2 4.49Å; L80-F289 HydrophobicContact CG-CE2 4.38Å; N220-F289 WeakPolarHBondContact CB-O 3.28Å; N220-F289 PolarHBondContact ND2-O 3.32Å; F221-F289 HydrophobicContact CE1-CB 4.12Å; F221-F289 HydrophobicContact CE2-CB 4.28Å; F221-F289 HydrophobicContact CZ-CB 3.66Å; N285-F289 HydrophobicContact CB-CE2 4.37Å; N285-F289 WeakPolarHBondContact O-CD2 3.36Å; N285-F289 PolarHBondContact O-N 3.44Å; V286-F289 PolarHBondContact O-N 3.15Å; A287-F289 VanDerWaalsContact C-N 3.33Å; A287-F289 PolarHBondContact O-N 3.07Å; F289-L297 HydrophobicContact CD1-CD1 4.38Å; F289-L297 HydrophobicContact CE1-CD1 3.79Å; F289-L297 HydrophobicContact CZ-CD1 4.17Å |
| 290 | T | 93 | Very high | 92.1 | Very high | 7 Ų | 7 | 32.3 Ų | 32.3 | 4% | 0.043 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -79.7 | -21.4 | 171.4 | 59.3 | 0 | 0 | 0 | 0 | 113.6 | G209 L213 F221 V286 A287 Y288 | G209-T290 WeakPolarHBondContact CA-OG1 3.5Å; G209-T290 PolarHBondContact O-OG1 3.4Å; L213-T290 HydrophobicContact CB-CG2 4.09Å; L213-T290 HydrophobicContact CD1-CG2 4.01Å; F221-T290 HydrophobicContact CE2-CG2 3.72Å; F221-T290 HydrophobicContact CZ-CG2 4.18Å; V286-T290 HydrophobicContact CG1-CG2 4.45Å; V286-T290 WeakPolarHBondContact O-CG2 3.44Å; V286-T290 PolarHBondContact O-N 2.89Å; A287-T290 PolarHBondContact O-N 3.01Å; A287-T290 VanDerWaalsContact O-N 3.11Å; A287-T290 PolarHBondContact O-OG1 3.32Å; Y288-T290 VanDerWaalsContact C-N 3.26Å; Y288-T290 PolarHBondContact O-N 3.36Å |
| 291 | T | 89.6 | Confident | 91.3 | Very high | 29 Ų | 29 | 36.6 Ų | 36.6 | 18% | 0.178 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -115.4 | -42 | -171 | -58.4 | 0 | 0 | 0 | 0 | 112.6 | A287 Y288 F307 R310 L311 | A287-T291 PolarHBondContact O-N 2.91Å; Y288-T291 PolarHBondContact O-N 3.41Å; Y288-T291 VanDerWaalsContact O-N 3.15Å; T291-F307 HydrophobicContact CG2-CD2 4.07Å; T291-F307 HydrophobicContact CG2-CE2 4.16Å; T291-F307 WeakPolarHBondContact OG1-CE2 3.34Å; T291-R310 HydrophobicContact CG2-CB 3.71Å; T291-L311 HydrophobicContact CG2-CB 4.23Å |
| 292 | I | 90.9 | Very high | 90.7 | Very high | 1 Ų | 1 | 36.7 Ų | 36.7 | 1% | 0.005 | 20% | 0.198 | C | C | . | . | S | Bend | trans | -113 | 146.3 | 179.7 | 54.5 | 170.9 | 0 | 0 | 0 | 110.1 | N220 Y288 E296 L297 V303 T306 R310 | N220-I292 PolarHBondContact ND2-O 3.4Å; N220-I292 VanDerWaalsContact ND2-O 3.12Å; Y288-I292 WeakPolarHBondContact O-CG1 3.36Å; Y288-I292 PolarHBondContact O-N 3.1Å; I292-E296 HydrophobicContact CB-CG 4.46Å; I292-E296 HydrophobicContact CG2-CG 4.47Å; I292-L297 HydrophobicContact CD1-CB 4.02Å; I292-L297 HydrophobicContact CD1-CD1 4.24Å; I292-L297 HydrophobicContact CD1-CG 4.19Å; I292-V303 HydrophobicContact CD1-CG1 3.95Å; I292-T306 HydrophobicContact CG2-CG2 4.35Å; I292-R310 HydrophobicContact CG2-CG 3.95Å |
| 293 | N | 89.3 | Confident | 90.2 | Very high | 72 Ų | 72 | 35.2 Ų | 35.2 | 39% | 0.385 | 19% | 0.189 | S | C | . | . | trans | -80.7 | 166.7 | 176.4 | 71.7 | 25.3 | 0 | 0 | 0 | 111.4 | E295 E296 L297 | N293-E295 VanDerWaalsContact C-N 3.31Å; N293-E295 PolarHBondContact O-N 3.31Å; N293-E295 PolarHBondContact OD1-N 3.05Å; N293-E296 PolarHBondContact O-N 3.12Å; N293-E296 WeakPolarHBondContact OD1-CB 3.42Å; N293-E296 PolarHBondContact OD1-N 3.49Å; N293-L297 PolarHBondContact O-N 3.09Å; N293-L297 VanDerWaalsContact O-N 3.09Å | ||
| 294 | A | 87.4 | Confident | 89.8 | Confident | 30 Ų | 30 | 32.1 Ų | 32.1 | 25% | 0.248 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.9 | -37 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113 | L70 V76 L298 | L70-A294 HydrophobicContact CD2-CB 3.99Å; V76-A294 HydrophobicContact CG2-CB 4.38Å; A294-L298 WeakPolarHBondContact O-CG 3.34Å; A294-L298 PolarHBondContact O-N 3.47Å |
| 295 | E | 87.9 | Confident | 89.4 | Confident | 144 Ų | 144 | 32.5 Ų | 32.5 | 67% | 0.673 | 18% | 0.175 | S | C | * | . | H | α-helix | trans | -69.1 | -43.9 | -179.7 | -63.7 | -175.5 | 165.5 | 0 | 0 | 111.8 | N293 L297 L298 L299 | N293-E295 VanDerWaalsContact C-N 3.31Å; N293-E295 PolarHBondContact O-N 3.31Å; N293-E295 PolarHBondContact OD1-N 3.05Å; E295-L297 VanDerWaalsContact C-N 3.33Å; E295-L297 PolarHBondContact O-N 2.94Å; E295-L298 PolarHBondContact O-N 3.43Å; E295-L298 VanDerWaalsContact O-N 3.16Å; E295-L299 WeakPolarHBondContact O-CG 3.48Å; E295-L299 PolarHBondContact O-N 3.46Å |
| 296 | E | 90 | Very high | 89 | Confident | 37 Ų | 37 | 33.6 Ų | 33.6 | 17% | 0.173 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.3 | -40.2 | 176 | -177.5 | 174.2 | -164.8 | 0 | 0 | 111.5 | I292 N293 L298 L299 S300 T306 R310 | I292-E296 HydrophobicContact CB-CG 4.46Å; I292-E296 HydrophobicContact CG2-CG 4.47Å; N293-E296 PolarHBondContact O-N 3.12Å; N293-E296 WeakPolarHBondContact OD1-CB 3.42Å; N293-E296 PolarHBondContact OD1-N 3.49Å; E296-L298 VanDerWaalsContact C-N 3.29Å; E296-L298 PolarHBondContact O-N 3.05Å; E296-L299 PolarHBondContact O-N 2.96Å; E296-S300 WeakPolarHBondContact O-CB 3.26Å; E296-S300 PolarHBondContact O-N 3.12Å; E296-T306 HydrophobicContact CG-CG2 4.07Å; E296-R310 VanDerWaalsContact CD-NH2 3.31Å; E296-R310 IonicContact OE1-CZ 3.39Å; E296-R310 IonicContact OE1-NE 3.72Å; E296-R310 PolarHBondContact OE1-NE 3.01Å; E296-R310 IonicContact OE1-NH2 3.85Å; E296-R310 PolarHBondContact OE1-NH2 3.27Å; E296-R310 IonicContact OE2-CZ 2.81Å; E296-R310 IonicContact OE2-NE 2.7Å; E296-R310 IonicContact OE2-NH2 3.17Å; E296-R310 PolarHBondContact OE2-NH2 2.99Å |
| 297 | L | 90.8 | Very high | 88.8 | Confident | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.1 | -40.5 | 174.5 | -168.7 | 158.2 | 0 | 0 | 0 | 111.6 | P66 K67 L70 F289 I292 N293 E295 S300 V303 | P66-L297 HydrophobicContact CB-CD2 4.49Å; K67-L297 HydrophobicContact CB-CD2 4.22Å; L70-L297 HydrophobicContact CB-CD2 4.34Å; L70-L297 HydrophobicContact CD2-CB 4.17Å; L70-L297 HydrophobicContact CD2-CD1 4.23Å; L70-L297 HydrophobicContact CD2-CD2 3.81Å; L70-L297 HydrophobicContact CD2-CG 4.28Å; F289-L297 HydrophobicContact CD1-CD1 4.38Å; F289-L297 HydrophobicContact CE1-CD1 3.79Å; F289-L297 HydrophobicContact CZ-CD1 4.17Å; I292-L297 HydrophobicContact CD1-CB 4.02Å; I292-L297 HydrophobicContact CD1-CD1 4.24Å; I292-L297 HydrophobicContact CD1-CG 4.19Å; N293-L297 PolarHBondContact O-N 3.09Å; N293-L297 VanDerWaalsContact O-N 3.09Å; E295-L297 VanDerWaalsContact C-N 3.33Å; E295-L297 PolarHBondContact O-N 2.94Å; L297-S300 PolarHBondContact O-N 2.83Å; L297-V303 HydrophobicContact CD1-CG1 4.17Å; L297-V303 HydrophobicContact CD2-CG2 4.26Å; L297-V303 HydrophobicContact CG-CG1 3.95Å; L297-V303 HydrophobicContact CG-CG2 4.24Å |
| 298 | L | 89.8 | Confident | 88.5 | Confident | 61 Ų | 61 | 32.1 Ų | 32.1 | 32% | 0.319 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -70.7 | -31.8 | 178.1 | -67.7 | 175.1 | 0 | 0 | 0 | 113.1 | K67 L70 Q71 A294 E295 E296 | K67-L298 WeakPolarHBondContact CE-O 3.29Å; K67-L298 HydrophobicContact CG-CD2 4.46Å; K67-L298 PolarHBondContact NZ-O 3.37Å; L70-L298 HydrophobicContact CB-CD2 4.19Å; L70-L298 HydrophobicContact CD2-CD2 4.23Å; L70-L298 HydrophobicContact CD2-CG 4.15Å; L70-L298 HydrophobicContact CG-CD2 4.19Å; L70-L298 HydrophobicContact CG-CG 4.47Å; Q71-L298 HydrophobicContact CB-CD2 3.74Å; Q71-L298 HydrophobicContact CG-CD2 4.49Å; A294-L298 WeakPolarHBondContact O-CG 3.34Å; A294-L298 PolarHBondContact O-N 3.47Å; E295-L298 PolarHBondContact O-N 3.43Å; E295-L298 VanDerWaalsContact O-N 3.16Å; E296-L298 VanDerWaalsContact C-N 3.29Å; E296-L298 PolarHBondContact O-N 3.05Å |
| 299 | L | 87.9 | Confident | 88.2 | Confident | 144 Ų | 144 | 36.5 Ų | 36.5 | 75% | 0.754 | 19% | 0.193 | S | C | * | . | H | α-helix | trans | -78 | -27.1 | 176.3 | -68.8 | 172.3 | 0 | 0 | 0 | 112.5 | E295 E296 | E295-L299 WeakPolarHBondContact O-CG 3.48Å; E295-L299 PolarHBondContact O-N 3.46Å; E296-L299 PolarHBondContact O-N 2.96Å |
| 300 | S | 84.7 | Confident | 87.9 | Confident | 10 Ų | 10 | 44 Ų | 44 | 7% | 0.07 | 22% | 0.222 | C | C | . | . | trans | -64.4 | 140.3 | -179.7 | -177.7 | 0 | 0 | 0 | 0 | 112.3 | K67 E296 L297 A302 V303 T306 | K67-S300 WeakPolarHBondContact CD-O 3.25Å; K67-S300 PolarHBondContact NZ-O 3.06Å; E296-S300 WeakPolarHBondContact O-CB 3.26Å; E296-S300 PolarHBondContact O-N 3.12Å; L297-S300 PolarHBondContact O-N 2.83Å; S300-A302 PolarHBondContact OG-N 3.25Å; S300-A302 VanDerWaalsContact OG-N 3.14Å; S300-A302 PolarHBondContact OG-O 2.82Å; S300-V303 PolarHBondContact OG-N 3.18Å; S300-T306 WeakPolarHBondContact CB-OG1 3.5Å; S300-T306 PolarHBondContact OG-OG1 3.23Å | ||
| 301 | N | 77.4 | Confident | 87.7 | Confident | 100 Ų | 100 | 46.2 Ų | 46.2 | 54% | 0.535 | 23% | 0.232 | S | C | . | . | S | Bend | trans | -89.6 | -23.7 | 169.3 | -74.5 | -35.6 | 0 | 0 | 0 | 112.6 | R148 | R148-N301 PolarHBondContact NH2-ND2 2.91Š|
| 302 | A | 83.3 | Confident | 87.5 | Confident | 2 Ų | 2 | 46.6 Ų | 46.6 | 2% | 0.017 | 23% | 0.233 | C | C | . | . | S | Bend | trans | -140.4 | 84 | -176.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | Y149 S300 A304 V305 T306 | Y149-A302 HydrophobicContact CE1-CB 3.83Å; S300-A302 PolarHBondContact OG-N 3.25Å; S300-A302 VanDerWaalsContact OG-N 3.14Å; S300-A302 PolarHBondContact OG-O 2.82Å; A302-A304 PolarHBondContact O-N 2.86Å; A302-A304 VanDerWaalsContact O-N 3.14Å; A302-V305 HydrophobicContact CB-CB 4.05Å; A302-V305 HydrophobicContact CB-CG2 3.99Å; A302-V305 WeakPolarHBondContact O-CB 3.36Å; A302-V305 PolarHBondContact O-N 3.15Å; A302-T306 PolarHBondContact O-N 3.38Å; A302-T306 VanDerWaalsContact O-N 3.08Å; A302-T306 PolarHBondContact O-OG1 3.29Å |
| 303 | V | 86.3 | Confident | 87.3 | Confident | 3 Ų | 3 | 48.6 Ų | 48.6 | 2% | 0.018 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -55.3 | -39 | -170.2 | -177.8 | 0 | 0 | 0 | 0 | 112.5 | Y288 I292 L297 S300 V305 F307 | Y288-V303 HydrophobicContact CD1-CG1 4.04Å; Y288-V303 HydrophobicContact CD2-CG1 3.75Å; Y288-V303 HydrophobicContact CE1-CG1 4.09Å; Y288-V303 HydrophobicContact CE2-CG1 3.8Å; Y288-V303 HydrophobicContact CG-CG1 3.88Å; I292-V303 HydrophobicContact CD1-CG1 3.95Å; L297-V303 HydrophobicContact CD1-CG1 4.17Å; L297-V303 HydrophobicContact CD2-CG2 4.26Å; L297-V303 HydrophobicContact CG-CG1 3.95Å; L297-V303 HydrophobicContact CG-CG2 4.24Å; S300-V303 PolarHBondContact OG-N 3.18Å; V303-V305 VanDerWaalsContact C-N 3.31Å; V303-V305 PolarHBondContact O-N 2.84Å; V303-F307 WeakPolarHBondContact O-CB 3.29Å; V303-F307 PolarHBondContact O-N 3.16Å |
| 304 | A | 87.7 | Confident | 86.9 | Confident | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.8 | -34.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | F63 I205 A302 S308 V319 V323 | F63-A304 HydrophobicContact CD1-CB 3.83Å; F63-A304 HydrophobicContact CE1-CB 4.28Å; I205-A304 HydrophobicContact CD1-CB 4.14Å; A302-A304 PolarHBondContact O-N 2.86Å; A302-A304 VanDerWaalsContact O-N 3.14Å; A304-S308 WeakPolarHBondContact O-CB 3.48Å; A304-S308 PolarHBondContact O-N 3.47Å; A304-S308 VanDerWaalsContact O-N 3.1Å; A304-V319 HydrophobicContact CB-CG1 3.99Å; A304-V323 HydrophobicContact CB-CG2 4.21Å |
| 305 | V | 86.8 | Confident | 86.7 | Confident | 8 Ų | 8 | 56.4 Ų | 56.4 | 5% | 0.048 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -75.6 | -46.7 | 179.7 | 178 | 0 | 0 | 0 | 0 | 109.6 | Y149 E152 A302 V303 F307 S308 E309 P320 | Y149-V305 HydrophobicContact CD1-CG2 4.16Å; Y149-V305 HydrophobicContact CE1-CG2 3.97Å; E152-V305 HydrophobicContact CG-CG1 4.16Å; E152-V305 HydrophobicContact CG-CG2 4.18Å; A302-V305 HydrophobicContact CB-CB 4.05Å; A302-V305 HydrophobicContact CB-CG2 3.99Å; A302-V305 WeakPolarHBondContact O-CB 3.36Å; A302-V305 PolarHBondContact O-N 3.15Å; V303-V305 VanDerWaalsContact C-N 3.31Å; V303-V305 PolarHBondContact O-N 2.84Å; V305-F307 VanDerWaalsContact C-N 3.27Å; V305-F307 PolarHBondContact O-N 3.38Å; V305-S308 PolarHBondContact O-N 3.01Å; V305-S308 PolarHBondContact O-OG 3.35Å; V305-E309 HydrophobicContact CG1-CG 4.35Å; V305-E309 WeakPolarHBondContact O-CG 2.97Å; V305-E309 PolarHBondContact O-N 2.86Å; V305-P320 HydrophobicContact CG2-CB 3.91Å; V305-P320 HydrophobicContact CG2-CG 4.28Å |
| 306 | T | 88.3 | Confident | 86.5 | Confident | 25 Ų | 25 | 50.3 Ų | 50.3 | 15% | 0.153 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.3 | -41.3 | 175.3 | -52.4 | 0 | 0 | 0 | 0 | 111.7 | I292 E296 S300 A302 S308 R310 | I292-T306 HydrophobicContact CG2-CG2 4.35Å; E296-T306 HydrophobicContact CG-CG2 4.07Å; S300-T306 WeakPolarHBondContact CB-OG1 3.5Å; S300-T306 PolarHBondContact OG-OG1 3.23Å; A302-T306 PolarHBondContact O-N 3.38Å; A302-T306 VanDerWaalsContact O-N 3.08Å; A302-T306 PolarHBondContact O-OG1 3.29Å; T306-S308 PolarHBondContact O-N 3.03Å; T306-R310 VanDerWaalsContact O-CG 3.29Å; T306-R310 WeakPolarHBondContact O-CG 3.13Å; T306-R310 PolarHBondContact O-N 2.9Å |
| 307 | F | 90.3 | Very high | 86.3 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.1 | -44.3 | 172.8 | 172.6 | -89.4 | 0 | 0 | 0 | 112.4 | I205 P208 A287 Y288 T291 V303 V305 R310 L311 | I205-F307 HydrophobicContact CB-CE1 4.27Å; I205-F307 HydrophobicContact CG1-CD1 4.32Å; I205-F307 HydrophobicContact CG1-CE1 4.4Å; I205-F307 HydrophobicContact CG2-CD1 4.16Å; I205-F307 HydrophobicContact CG2-CE1 3.96Å; I205-F307 HydrophobicContact CG2-CZ 4.18Å; I205-F307 WeakPolarHBondContact O-CZ 3.26Å; P208-F307 HydrophobicContact CB-CZ 4.43Å; A287-F307 HydrophobicContact CB-CE2 4.32Å; A287-F307 HydrophobicContact CB-CZ 4.43Å; A287-F307 VanDerWaalsContact O-CE2 3.31Å; A287-F307 WeakPolarHBondContact O-CE2 3.25Å; Y288-F307 HydrophobicContact CD1-CB 3.84Å; Y288-F307 AromaticContact CD1-CD2 3.84Å; Y288-F307 HydrophobicContact CD1-CD2 3.84Å; Y288-F307 AromaticContact CD1-CG 3.88Å; Y288-F307 HydrophobicContact CD1-CG 3.88Å; Y288-F307 HydrophobicContact CE1-CB 3.97Å; Y288-F307 HydrophobicContact CE1-CG 4.14Å; T291-F307 HydrophobicContact CG2-CD2 4.07Å; T291-F307 HydrophobicContact CG2-CE2 4.16Å; T291-F307 WeakPolarHBondContact OG1-CE2 3.34Å; V303-F307 WeakPolarHBondContact O-CB 3.29Å; V303-F307 PolarHBondContact O-N 3.16Å; V305-F307 VanDerWaalsContact C-N 3.27Å; V305-F307 PolarHBondContact O-N 3.38Å; F307-R310 PolarHBondContact O-N 3.25Å; F307-L311 HydrophobicContact CE1-CD2 4.32Å; F307-L311 HydrophobicContact CE2-CD2 4.42Å; F307-L311 HydrophobicContact CZ-CD2 3.84Å |
| 308 | S | 89 | Confident | 86.1 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -70.4 | -37.8 | -175.8 | 76.6 | 0 | 0 | 0 | 0 | 112.3 | A304 V305 T306 R310 L311 L312 S316 V319 | A304-S308 WeakPolarHBondContact O-CB 3.48Å; A304-S308 PolarHBondContact O-N 3.47Å; A304-S308 VanDerWaalsContact O-N 3.1Å; V305-S308 PolarHBondContact O-N 3.01Å; V305-S308 PolarHBondContact O-OG 3.35Å; T306-S308 PolarHBondContact O-N 3.03Å; S308-R310 VanDerWaalsContact C-N 3.3Å; S308-R310 PolarHBondContact O-N 3.44Å; S308-L311 PolarHBondContact O-N 3.44Å; S308-L312 WeakPolarHBondContact O-CA 3.31Å; S308-L312 WeakPolarHBondContact O-CB 3.46Å; S308-L312 PolarHBondContact O-N 3.09Å; S308-S316 WeakPolarHBondContact OG-CA 3.45Å; S308-S316 WeakPolarHBondContact OG-CB 3.39Å; S308-S316 PolarHBondContact OG-O 3.5Å; S308-V319 VanDerWaalsContact CB-CG2 3.46Å |
| 309 | E | 88.4 | Confident | 86.1 | Confident | 92 Ų | 92 | 50.7 Ų | 50.7 | 43% | 0.43 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.9 | -37.2 | 175.6 | -72.2 | 175.4 | 162.5 | 0 | 0 | 112.3 | V305 L311 | V305-E309 HydrophobicContact CG1-CG 4.35Å; V305-E309 WeakPolarHBondContact O-CG 2.97Å; V305-E309 PolarHBondContact O-N 2.86Å; E309-L311 VanDerWaalsContact C-N 3.31Å; E309-L311 PolarHBondContact O-N 3.13Å |
| 310 | R | 87.8 | Confident | 86.2 | Confident | 160 Ų | 160 | 44 Ų | 44 | 60% | 0.604 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -68.9 | -26.4 | 179 | -71 | -68.8 | -169.3 | 168.8 | 0.6 | 114 | T291 I292 E296 T306 F307 S308 | T291-R310 HydrophobicContact CG2-CB 3.71Å; I292-R310 HydrophobicContact CG2-CG 3.95Å; E296-R310 VanDerWaalsContact CD-NH2 3.31Å; E296-R310 IonicContact OE1-CZ 3.39Å; E296-R310 IonicContact OE1-NE 3.72Å; E296-R310 PolarHBondContact OE1-NE 3.01Å; E296-R310 IonicContact OE1-NH2 3.85Å; E296-R310 PolarHBondContact OE1-NH2 3.27Å; E296-R310 IonicContact OE2-CZ 2.81Å; E296-R310 IonicContact OE2-NE 2.7Å; E296-R310 IonicContact OE2-NH2 3.17Å; E296-R310 PolarHBondContact OE2-NH2 2.99Å; T306-R310 VanDerWaalsContact O-CG 3.29Å; T306-R310 WeakPolarHBondContact O-CG 3.13Å; T306-R310 PolarHBondContact O-N 2.9Å; F307-R310 PolarHBondContact O-N 3.25Å; S308-R310 VanDerWaalsContact C-N 3.3Å; S308-R310 PolarHBondContact O-N 3.44Å |
| 311 | L | 88.6 | Confident | 86.5 | Confident | 52 Ų | 52 | 47.2 Ų | 47.2 | 27% | 0.272 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -126 | -31.7 | -165.1 | -164.6 | 65.5 | 0 | 0 | 0 | 115 | P208 Q212 T291 F307 S308 E309 | P208-L311 HydrophobicContact CB-CD2 3.25Å; P208-L311 HydrophobicContact CB-CG 4.26Å; Q212-L311 HydrophobicContact CG-CD1 3.87Å; Q212-L311 HydrophobicContact CG-CD2 4.05Å; T291-L311 HydrophobicContact CG2-CB 4.23Å; F307-L311 HydrophobicContact CE1-CD2 4.32Å; F307-L311 HydrophobicContact CE2-CD2 4.42Å; F307-L311 HydrophobicContact CZ-CD2 3.84Å; S308-L311 PolarHBondContact O-N 3.44Å; E309-L311 VanDerWaalsContact C-N 3.31Å; E309-L311 PolarHBondContact O-N 3.13Å |
| 312 | L | 85.9 | Confident | 87.2 | Confident | 37 Ų | 37 | 45 Ų | 45 | 19% | 0.194 | 23% | 0.233 | C | C | . | . | S | Bend | trans | -104.1 | -2.5 | -166.7 | -56.8 | -179.2 | 0 | 0 | 0 | 113.8 | I204 P208 S308 N314 F315 V319 | I204-L312 HydrophobicContact CG2-CD1 3.74Å; P208-L312 HydrophobicContact CB-CD2 4.29Å; P208-L312 HydrophobicContact CG-CD2 3.97Å; S308-L312 WeakPolarHBondContact O-CA 3.31Å; S308-L312 WeakPolarHBondContact O-CB 3.46Å; S308-L312 PolarHBondContact O-N 3.09Å; L312-N314 PolarHBondContact O-N 3.26Å; L312-F315 HydrophobicContact CB-CB 4.23Å; L312-F315 HydrophobicContact CB-CD1 4.42Å; L312-F315 HydrophobicContact CD1-CD1 4.07Å; L312-F315 WeakPolarHBondContact O-CB 3.41Å; L312-F315 PolarHBondContact O-N 2.93Å; L312-V319 HydrophobicContact CD1-CG2 4.01Å |
| 313 | G | 84.8 | Confident | 87.6 | Confident | 43 Ų | 43 | 44.9 Ų | 44.9 | 44% | 0.443 | 23% | 0.232 | S | C | . | . | G | 310 helix | trans | 53 | -127.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111 | F315 S316 | G313-F315 PolarHBondContact O-N 3.34Å; G313-F315 VanDerWaalsContact O-N 3.14Å; G313-S316 WeakPolarHBondContact O-CB 3.49Å; G313-S316 PolarHBondContact O-N 3.16Å; G313-S316 PolarHBondContact O-OG 3.08Å |
| 314 | N | 82.5 | Confident | 87.9 | Confident | 158 Ų | 158 | 44.7 Ų | 44.7 | 85% | 0.845 | 23% | 0.231 | S | C | * | . | G | 310 helix | trans | -61.7 | -22.8 | -179.7 | -65.8 | -5.1 | 0 | 0 | 0 | 114.4 | L312 S316 | L312-N314 PolarHBondContact O-N 3.26Å; N314-S316 PolarHBondContact O-N 3.3Å |
| 315 | F | 83.6 | Confident | 88.1 | Confident | 108 Ų | 108 | 47.2 Ų | 47.2 | 47% | 0.474 | 24% | 0.244 | S | C | . | . | G | 310 helix | trans | -76.8 | -5.7 | 176.7 | -169 | -105.5 | 0 | 0 | 0 | 112.4 | I204 L312 G313 L317 A318 | I204-F315 HydrophobicContact CD1-CE1 4.01Å; I204-F315 HydrophobicContact CD1-CZ 4.08Å; I204-F315 HydrophobicContact CG1-CE1 4.24Å; I204-F315 HydrophobicContact CG2-CE1 3.92Å; L312-F315 HydrophobicContact CB-CB 4.23Å; L312-F315 HydrophobicContact CB-CD1 4.42Å; L312-F315 HydrophobicContact CD1-CD1 4.07Å; L312-F315 WeakPolarHBondContact O-CB 3.41Å; L312-F315 PolarHBondContact O-N 2.93Å; G313-F315 PolarHBondContact O-N 3.34Å; G313-F315 VanDerWaalsContact O-N 3.14Å; F315-L317 PolarHBondContact O-N 3.04Å; F315-A318 HydrophobicContact CD1-CB 4.47Å; F315-A318 HydrophobicContact CD2-CB 3.99Å; F315-A318 HydrophobicContact CE1-CB 4.22Å; F315-A318 HydrophobicContact CE2-CB 3.7Å; F315-A318 HydrophobicContact CG-CB 4.37Å; F315-A318 HydrophobicContact CZ-CB 3.82Å; F315-A318 WeakPolarHBondContact O-CB 3.24Å; F315-A318 PolarHBondContact O-N 3.29Å; F315-A318 VanDerWaalsContact O-N 3.07Å |
| 316 | S | 83.3 | Confident | 88.4 | Confident | 17 Ų | 17 | 46.9 Ų | 46.9 | 12% | 0.119 | 24% | 0.242 | C | C | . | . | G | 310 helix | trans | -55.6 | -32.8 | 174.8 | 67.2 | 0 | 0 | 0 | 0 | 112.7 | S308 G313 N314 A318 V319 P320 | S308-S316 WeakPolarHBondContact OG-CA 3.45Å; S308-S316 WeakPolarHBondContact OG-CB 3.39Å; S308-S316 PolarHBondContact OG-O 3.5Å; G313-S316 WeakPolarHBondContact O-CB 3.49Å; G313-S316 PolarHBondContact O-N 3.16Å; G313-S316 PolarHBondContact O-OG 3.08Å; N314-S316 PolarHBondContact O-N 3.3Å; S316-A318 VanDerWaalsContact C-N 3.25Å; S316-A318 PolarHBondContact O-N 3.4Å; S316-V319 PolarHBondContact O-N 2.94Å; S316-P320 WeakPolarHBondContact O-CD 3.29Å |
| 317 | L | 85.4 | Confident | 88.6 | Confident | 81 Ų | 81 | 45.7 Ų | 45.7 | 42% | 0.424 | 23% | 0.234 | S | C | . | . | G | 310 helix | trans | -65.5 | -22.8 | 179 | -60 | 179 | 0 | 0 | 0 | 113.8 | P153 I156 F315 P320 | P153-L317 HydrophobicContact CB-CD2 4.35Å; I156-L317 HydrophobicContact CD1-CD2 3.65Å; F315-L317 PolarHBondContact O-N 3.04Å; L317-P320 WeakPolarHBondContact O-CD 3.33Å; L317-P320 WeakPolarHBondContact O-CG 3.37Å |
| 318 | A | 86.8 | Confident | 88.7 | Confident | 20 Ų | 20 | 47 Ų | 47 | 17% | 0.165 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -74.2 | -31.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F315 S316 I321 F322 | F315-A318 HydrophobicContact CD1-CB 4.47Å; F315-A318 HydrophobicContact CD2-CB 3.99Å; F315-A318 HydrophobicContact CE1-CB 4.22Å; F315-A318 HydrophobicContact CE2-CB 3.7Å; F315-A318 HydrophobicContact CG-CB 4.37Å; F315-A318 HydrophobicContact CZ-CB 3.82Å; F315-A318 WeakPolarHBondContact O-CB 3.24Å; F315-A318 PolarHBondContact O-N 3.29Å; F315-A318 VanDerWaalsContact O-N 3.07Å; S316-A318 VanDerWaalsContact C-N 3.25Å; S316-A318 PolarHBondContact O-N 3.4Å; A318-I321 PolarHBondContact O-N 3.48Å; A318-F322 HydrophobicContact CB-CD2 4.28Å; A318-F322 HydrophobicContact CB-CE2 4.15Å; A318-F322 WeakPolarHBondContact O-CD2 3.16Å; A318-F322 PolarHBondContact O-N 3.41Å |
| 319 | V | 89.4 | Confident | 88.8 | Confident | 4 Ų | 4 | 47 Ų | 47 | 2% | 0.024 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.3 | -54.3 | -177.2 | 178.2 | 0 | 0 | 0 | 0 | 113.1 | I204 A304 S308 L312 S316 I321 F322 V323 | I204-V319 HydrophobicContact CG2-CG2 3.8Å; A304-V319 HydrophobicContact CB-CG1 3.99Å; S308-V319 VanDerWaalsContact CB-CG2 3.46Å; L312-V319 HydrophobicContact CD1-CG2 4.01Å; S316-V319 PolarHBondContact O-N 2.94Å; V319-I321 PolarHBondContact O-N 3.22Å; V319-F322 PolarHBondContact O-N 3.25Å; V319-F322 VanDerWaalsContact O-N 3.13Å; V319-V323 HydrophobicContact CG1-CG2 4.24Å; V319-V323 VanDerWaalsContact O-CG2 3.3Å; V319-V323 WeakPolarHBondContact O-CG2 3.44Å; V319-V323 PolarHBondContact O-N 3.2Å |
| 320 | P | 89.8 | Confident | 88.9 | Confident | 3 Ų | 3 | 42.8 Ų | 42.8 | 2% | 0.019 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58 | -35 | 177.9 | 20.3 | -31.5 | 0 | 0 | 0 | 112.8 | Y149 E152 P153 V305 S316 L317 V323 A324 | Y149-P320 HydrophobicContact CD1-CB 4.36Å; Y149-P320 WeakPolarHBondContact O-CB 3.3Å; E152-P320 HydrophobicContact CB-CB 4.17Å; P153-P320 HydrophobicContact CG-CB 4.08Å; P153-P320 HydrophobicContact CG-CG 3.65Å; V305-P320 HydrophobicContact CG2-CB 3.91Å; V305-P320 HydrophobicContact CG2-CG 4.28Å; S316-P320 WeakPolarHBondContact O-CD 3.29Å; L317-P320 WeakPolarHBondContact O-CD 3.33Å; L317-P320 WeakPolarHBondContact O-CG 3.37Å; P320-V323 PolarHBondContact O-N 3.46Å; P320-A324 WeakPolarHBondContact O-CB 3.41Å; P320-A324 PolarHBondContact O-N 3.09Å |
| 321 | I | 91.1 | Very high | 89 | Confident | 79 Ų | 79 | 35.3 Ų | 35.3 | 41% | 0.405 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -65.1 | -47.4 | 175.9 | -60.6 | 171.9 | 0 | 0 | 0 | 110.8 | A318 V319 V323 A324 L325 | A318-I321 PolarHBondContact O-N 3.48Å; V319-I321 PolarHBondContact O-N 3.22Å; I321-V323 VanDerWaalsContact C-N 3.31Å; I321-V323 PolarHBondContact O-N 3.37Å; I321-A324 PolarHBondContact O-N 3.1Å; I321-L325 HydrophobicContact CG2-CD1 4.4Å; I321-L325 WeakPolarHBondContact O-CG 3.29Å; I321-L325 PolarHBondContact O-N 3.38Å |
| 322 | F | 91.9 | Very high | 89 | Confident | 52 Ų | 52 | 32.9 Ų | 32.9 | 23% | 0.228 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.6 | -35.9 | 176.8 | -77.9 | -59.5 | 0 | 0 | 0 | 112.6 | C197 T200 A201 I204 A318 V319 L325 S326 | C197-F322 HydrophobicContact CB-CD1 4.32Å; T200-F322 HydrophobicContact CG2-CZ 4.42Å; A201-F322 HydrophobicContact CB-CB 3.7Å; I204-F322 HydrophobicContact CD1-CD2 3.65Å; I204-F322 HydrophobicContact CD1-CE2 3.6Å; I204-F322 HydrophobicContact CD1-CZ 4.48Å; A318-F322 HydrophobicContact CB-CD2 4.28Å; A318-F322 HydrophobicContact CB-CE2 4.15Å; A318-F322 WeakPolarHBondContact O-CD2 3.16Å; A318-F322 PolarHBondContact O-N 3.41Å; V319-F322 PolarHBondContact O-N 3.25Å; V319-F322 VanDerWaalsContact O-N 3.13Å; F322-L325 HydrophobicContact CD1-CD1 4.39Å; F322-L325 PolarHBondContact O-N 3.21Å; F322-S326 WeakPolarHBondContact O-CB 3.18Å; F322-S326 PolarHBondContact O-N 3.09Å |
| 323 | V | 90.9 | Very high | 89 | Confident | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.3 | -41.1 | 173.6 | 176.1 | 0 | 0 | 0 | 0 | 111.3 | F63 Y149 A304 V319 P320 I321 S326 C327 | F63-V323 HydrophobicContact CB-CG1 4.27Å; F63-V323 HydrophobicContact CD1-CG1 4.29Å; F63-V323 HydrophobicContact CD1-CG2 3.93Å; F63-V323 HydrophobicContact CD2-CB 4.44Å; F63-V323 HydrophobicContact CD2-CG1 3.47Å; F63-V323 VanDerWaalsContact CD2-CG1 3.47Å; F63-V323 HydrophobicContact CD2-CG2 4.3Å; F63-V323 HydrophobicContact CE1-CG2 3.66Å; F63-V323 HydrophobicContact CE2-CB 4.32Å; F63-V323 HydrophobicContact CE2-CG1 3.78Å; F63-V323 HydrophobicContact CE2-CG2 4.05Å; F63-V323 HydrophobicContact CG-CG1 3.75Å; F63-V323 HydrophobicContact CG-CG2 4.24Å; F63-V323 HydrophobicContact CZ-CB 4.46Å; F63-V323 HydrophobicContact CZ-CG1 4.32Å; F63-V323 HydrophobicContact CZ-CG2 3.73Å; Y149-V323 HydrophobicContact CD1-CB 3.86Å; Y149-V323 HydrophobicContact CD1-CG1 3.55Å; Y149-V323 HydrophobicContact CD1-CG2 4.48Å; Y149-V323 HydrophobicContact CD2-CG1 3.49Å; Y149-V323 VanDerWaalsContact CD2-CG1 3.49Å; Y149-V323 HydrophobicContact CE1-CB 4.25Å; Y149-V323 HydrophobicContact CE1-CG1 3.73Å; Y149-V323 HydrophobicContact CE1-CG2 4.48Å; Y149-V323 HydrophobicContact CE2-CG1 3.72Å; Y149-V323 HydrophobicContact CG-CB 4.04Å; Y149-V323 HydrophobicContact CG-CG1 3.44Å; Y149-V323 VanDerWaalsContact CG-CG1 3.44Å; A304-V323 HydrophobicContact CB-CG2 4.21Å; V319-V323 HydrophobicContact CG1-CG2 4.24Å; V319-V323 VanDerWaalsContact O-CG2 3.3Å; V319-V323 WeakPolarHBondContact O-CG2 3.44Å; V319-V323 PolarHBondContact O-N 3.2Å; P320-V323 PolarHBondContact O-N 3.46Å; I321-V323 VanDerWaalsContact C-N 3.31Å; I321-V323 PolarHBondContact O-N 3.37Å; V323-S326 WeakPolarHBondContact O-CA 3.4Å; V323-S326 VanDerWaalsContact O-CB 3.24Å; V323-S326 WeakPolarHBondContact O-CB 3.47Å; V323-S326 PolarHBondContact O-N 2.97Å; V323-C327 PolarHBondContact O-N 3.1Å; V323-C327 PolarHBondContact O-SG 3.02Å; V323-C327 VanDerWaalsContact O-SG 3.32Å |
| 324 | A | 92.8 | Very high | 89 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.1 | -47.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111 | F146 I150 P320 I321 S326 C327 F328 | F146-A324 HydrophobicContact CD2-CB 3.97Å; F146-A324 WeakPolarHBondContact CD2-O 3.29Å; F146-A324 HydrophobicContact CE2-CB 4.24Å; I150-A324 HydrophobicContact CB-CB 3.95Å; I150-A324 HydrophobicContact CD1-CB 3.9Å; P320-A324 WeakPolarHBondContact O-CB 3.41Å; P320-A324 PolarHBondContact O-N 3.09Å; I321-A324 PolarHBondContact O-N 3.1Å; A324-S326 PolarHBondContact O-N 3.09Å; A324-C327 PolarHBondContact O-N 2.78Å; A324-C327 VanDerWaalsContact O-N 3.09Å; A324-F328 PolarHBondContact O-N 2.71Å |
| 325 | L | 93.4 | Very high | 89.2 | Confident | 53 Ų | 53 | 22.2 Ų | 22.2 | 28% | 0.277 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -58.7 | -35.3 | 173.7 | -68.9 | 175.3 | 0 | 0 | 0 | 112.1 | L194 C197 I321 F322 F328 G329 | L194-L325 HydrophobicContact CD2-CB 4.21Å; L194-L325 HydrophobicContact CD2-CD2 4.09Å; C197-L325 HydrophobicContact CB-CB 4.42Å; C197-L325 HydrophobicContact CB-CD1 4.45Å; I321-L325 HydrophobicContact CG2-CD1 4.4Å; I321-L325 WeakPolarHBondContact O-CG 3.29Å; I321-L325 PolarHBondContact O-N 3.38Å; F322-L325 HydrophobicContact CD1-CD1 4.39Å; F322-L325 PolarHBondContact O-N 3.21Å; L325-F328 PolarHBondContact O-N 3.38Å; L325-G329 PolarHBondContact O-N 3.1Å |
| 326 | S | 92.7 | Very high | 89.1 | Confident | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -60.4 | -51 | 172.3 | 176.2 | 0 | 0 | 0 | 0 | 111.8 | K198 F322 V323 A324 F328 G329 S330 | K198-S326 WeakPolarHBondContact CE-O 3.37Å; K198-S326 WeakPolarHBondContact CG-OG 3.5Å; K198-S326 PolarHBondContact NZ-O 3.31Å; F322-S326 WeakPolarHBondContact O-CB 3.18Å; F322-S326 PolarHBondContact O-N 3.09Å; V323-S326 WeakPolarHBondContact O-CA 3.4Å; V323-S326 VanDerWaalsContact O-CB 3.24Å; V323-S326 WeakPolarHBondContact O-CB 3.47Å; V323-S326 PolarHBondContact O-N 2.97Å; A324-S326 PolarHBondContact O-N 3.09Å; S326-F328 VanDerWaalsContact C-N 3.3Å; S326-F328 PolarHBondContact O-N 2.94Å; S326-G329 PolarHBondContact O-N 2.83Å; S326-S330 PolarHBondContact O-N 3.28Å; S326-S330 VanDerWaalsContact O-N 3.08Å; S326-S330 PolarHBondContact O-OG 3.49Å; S326-S330 VanDerWaalsContact O-OG 3.14Å |
| 327 | C | 92.3 | Very high | 88.8 | Confident | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.3 | -40.5 | 177.5 | -62.5 | 0 | 0 | 0 | 0 | 111.5 | I142 F146 V323 A324 G329 S330 M331 | I142-C327 HydrophobicContact CG2-CB 4.35Å; I142-C327 WeakPolarHBondContact CG2-O 3.26Å; F146-C327 HydrophobicContact CB-CB 3.64Å; V323-C327 PolarHBondContact O-N 3.1Å; V323-C327 PolarHBondContact O-SG 3.02Å; V323-C327 VanDerWaalsContact O-SG 3.32Å; A324-C327 PolarHBondContact O-N 2.78Å; A324-C327 VanDerWaalsContact O-N 3.09Å; C327-G329 PolarHBondContact O-N 3.32Å; C327-S330 WeakPolarHBondContact O-CB 3.08Å; C327-S330 PolarHBondContact O-N 2.8Å; C327-S330 VanDerWaalsContact O-N 3.11Å; C327-M331 WeakPolarHBondContact O-CG 3.46Å; C327-M331 PolarHBondContact O-N 3.47Å |
| 328 | F | 92.6 | Very high | 88.6 | Confident | 27 Ų | 27 | 13.5 Ų | 13.5 | 12% | 0.118 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -58.9 | -44.9 | 175.2 | -169.4 | -83.1 | 0 | 0 | 0 | 112.8 | F146 V175 V176 L179 L194 A324 L325 S326 S330 M331 N332 | F146-F328 HydrophobicContact CD2-CB 4.17Å; F146-F328 HydrophobicContact CE2-CB 4.33Å; F146-F328 HydrophobicContact CE2-CD2 4.15Å; F146-F328 HydrophobicContact CZ-CD2 4.44Å; V175-F328 HydrophobicContact CG1-CE2 4.25Å; V175-F328 HydrophobicContact CG1-CZ 4.09Å; V176-F328 HydrophobicContact CG2-CD1 4.3Å; V176-F328 HydrophobicContact CG2-CD2 3.77Å; V176-F328 HydrophobicContact CG2-CE1 3.98Å; V176-F328 HydrophobicContact CG2-CE2 3.39Å; V176-F328 HydrophobicContact CG2-CG 4.22Å; V176-F328 HydrophobicContact CG2-CZ 3.51Å; L179-F328 HydrophobicContact CD1-CE1 4.25Å; L179-F328 HydrophobicContact CD1-CZ 3.89Å; L194-F328 HydrophobicContact CD1-CD1 3.62Å; L194-F328 HydrophobicContact CD1-CE1 4.13Å; L194-F328 HydrophobicContact CD2-CD1 4.36Å; A324-F328 PolarHBondContact O-N 2.71Å; L325-F328 PolarHBondContact O-N 3.38Å; S326-F328 VanDerWaalsContact C-N 3.3Å; S326-F328 PolarHBondContact O-N 2.94Å; F328-S330 VanDerWaalsContact C-N 3.29Å; F328-S330 PolarHBondContact O-N 3.1Å; F328-M331 HydrophobicContact CB-CE 4.21Å; F328-M331 HydrophobicContact CD2-CE 4.06Å; F328-M331 HydrophobicContact CG-CE 4.4Å; F328-M331 PolarHBondContact O-N 2.97Å; F328-N332 PolarHBondContact O-N 2.92Å |
| 329 | G | 90.7 | Very high | 88.4 | Confident | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -65.4 | -30.3 | 175 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q191 L325 S326 C327 G333 | Q191-G329 PolarHBondContact NE2-O 3.05Å; Q191-G329 PolarHBondContact OE1-O 3.04Å; L325-G329 PolarHBondContact O-N 3.1Å; S326-G329 PolarHBondContact O-N 2.83Å; C327-G329 PolarHBondContact O-N 3.32Å; G329-G333 PolarHBondContact O-N 3.38Å |
| 330 | S | 90 | Very high | 87.9 | Confident | 5 Ų | 5 | 13.1 Ų | 13.1 | 4% | 0.035 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -71.4 | -40.9 | 176.2 | -56.8 | 0 | 0 | 0 | 0 | 111.4 | I58 G59 K198 S326 C327 F328 N332 G334 | I58-S330 PolarHBondContact O-OG 3.06Å; G59-S330 WeakPolarHBondContact CA-OG 3.2Å; K198-S330 VanDerWaalsContact NZ-N 3.16Å; K198-S330 PolarHBondContact NZ-OG 3.04Å; S326-S330 PolarHBondContact O-N 3.28Å; S326-S330 VanDerWaalsContact O-N 3.08Å; S326-S330 PolarHBondContact O-OG 3.49Å; S326-S330 VanDerWaalsContact O-OG 3.14Å; C327-S330 WeakPolarHBondContact O-CB 3.08Å; C327-S330 PolarHBondContact O-N 2.8Å; C327-S330 VanDerWaalsContact O-N 3.11Å; F328-S330 VanDerWaalsContact C-N 3.29Å; F328-S330 PolarHBondContact O-N 3.1Å; S330-N332 VanDerWaalsContact C-N 3.35Å; S330-G334 PolarHBondContact O-N 2.91Å |
| 331 | M | 90.6 | Very high | 87.7 | Confident | 2 Ų | 2 | 13 Ų | 13 | 1% | 0.01 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -59.5 | -47.7 | 172.5 | -65.4 | -172.1 | -79.4 | 0 | 0 | 110.6 | I142 S143 F146 V176 C327 F328 G334 V335 | I142-M331 HydrophobicContact CB-CG 4.34Å; I142-M331 HydrophobicContact CG2-CG 3.65Å; S143-M331 VanDerWaalsContact CA-SD 3.51Å; S143-M331 WeakPolarHBondContact CB-SD 3.36Å; F146-M331 HydrophobicContact CB-CE 3.82Å; F146-M331 HydrophobicContact CD1-CE 4.05Å; F146-M331 HydrophobicContact CD2-CE 4.28Å; F146-M331 HydrophobicContact CG-CE 3.77Å; V176-M331 HydrophobicContact CG1-CB 4.08Å; V176-M331 HydrophobicContact CG2-CB 4.11Å; V176-M331 HydrophobicContact CG2-CE 4.2Å; C327-M331 WeakPolarHBondContact O-CG 3.46Å; C327-M331 PolarHBondContact O-N 3.47Å; F328-M331 HydrophobicContact CB-CE 4.21Å; F328-M331 HydrophobicContact CD2-CE 4.06Å; F328-M331 HydrophobicContact CG-CE 4.4Å; F328-M331 PolarHBondContact O-N 2.97Å; M331-G334 PolarHBondContact O-N 3.05Å; M331-V335 WeakPolarHBondContact O-CG2 3.45Å; M331-V335 PolarHBondContact O-N 3.25Å |
| 332 | N | 89 | Confident | 87.5 | Confident | 1 Ų | 1 | 9.2 Ų | 9.2 | 1% | 0.005 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -60.5 | -49.1 | -179.5 | -173.8 | 66.3 | 0 | 0 | 0 | 112.4 | V176 N180 S187 Q191 F328 S330 G334 F336 | V176-N332 HydrophobicContact CG1-CB 4.18Å; N180-N332 PolarHBondContact ND2-OD1 2.85Å; S187-N332 PolarHBondContact O-ND2 3.43Å; S187-N332 PolarHBondContact OG-ND2 3.39Å; S187-N332 PolarHBondContact OG-OD1 3.4Å; S187-N332 VanDerWaalsContact OG-OD1 3.08Å; Q191-N332 PolarHBondContact OE1-ND2 2.82Å; F328-N332 PolarHBondContact O-N 2.92Å; S330-N332 VanDerWaalsContact C-N 3.35Å; N332-G334 VanDerWaalsContact C-N 3.33Å; N332-G334 PolarHBondContact O-N 3.37Å; N332-F336 WeakPolarHBondContact O-CB 3.37Å; N332-F336 PolarHBondContact O-N 3.23Å |
| 333 | G | 84.6 | Confident | 87.1 | Confident | 6 Ų | 6 | 7 Ų | 7 | 6% | 0.062 | 4% | 0.038 | C | C | . | . | H | α-helix | trans | -62.7 | -37.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | G329 F336 A337 | G329-G333 PolarHBondContact O-N 3.38Å; G333-F336 WeakPolarHBondContact O-CB 3.37Å; G333-F336 PolarHBondContact O-N 3.21Å; G333-A337 PolarHBondContact O-N 2.9Å; G333-A337 VanDerWaalsContact O-N 3.12Å |
| 334 | G | 85.8 | Confident | 86.7 | Confident | 8 Ų | 8 | 7.2 Ų | 7.2 | 8% | 0.082 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -63.4 | -51.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | S330 M331 N332 F336 A337 V338 | S330-G334 PolarHBondContact O-N 2.91Å; M331-G334 PolarHBondContact O-N 3.05Å; N332-G334 VanDerWaalsContact C-N 3.33Å; N332-G334 PolarHBondContact O-N 3.37Å; G334-F336 VanDerWaalsContact C-N 3.28Å; G334-F336 PolarHBondContact O-N 2.71Å; G334-A337 PolarHBondContact O-N 2.74Å; G334-V338 VanDerWaalsContact O-CG2 3.25Å; G334-V338 WeakPolarHBondContact O-CG2 3.17Å; G334-V338 PolarHBondContact O-N 3.49Å |
| 335 | V | 86.3 | Confident | 86.5 | Confident | 1 Ų | 1 | 7.2 Ų | 7.2 | 1% | 0.006 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -61 | -40.5 | 177.3 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | V176 M177 N180 M331 A337 V338 S339 V369 L372 | V176-V335 HydrophobicContact CG1-CG2 4.22Å; M177-V335 HydrophobicContact CE-CG2 3.65Å; M177-V335 HydrophobicContact SD-CB 4.5Å; M177-V335 HydrophobicContact SD-CG1 3.83Å; M177-V335 HydrophobicContact SD-CG2 3.76Å; N180-V335 HydrophobicContact CB-CG1 3.86Å; M331-V335 WeakPolarHBondContact O-CG2 3.45Å; M331-V335 PolarHBondContact O-N 3.25Å; V335-A337 PolarHBondContact O-N 2.98Å; V335-V338 PolarHBondContact O-N 2.87Å; V335-S339 PolarHBondContact O-N 3.43Å; V335-S339 VanDerWaalsContact O-N 3.12Å; V335-S339 PolarHBondContact O-OG 2.77Å; V335-V369 HydrophobicContact CG1-CG1 4.03Å; V335-V369 HydrophobicContact CG1-CG2 4.27Å; V335-L372 HydrophobicContact CG2-CD2 4.42Å |
| 336 | F | 81.3 | Confident | 86.2 | Confident | 18 Ų | 18 | 5 Ų | 5 | 8% | 0.079 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -55.6 | -49.5 | 176 | -175.1 | -96.4 | 0 | 0 | 0 | 112.1 | V184 V255 N332 G333 G334 S339 R340 | V184-F336 HydrophobicContact CG1-CE2 3.9Å; V184-F336 HydrophobicContact CG1-CZ 4.41Å; V255-F336 HydrophobicContact CG1-CE1 4.05Å; N332-F336 WeakPolarHBondContact O-CB 3.37Å; N332-F336 PolarHBondContact O-N 3.23Å; G333-F336 WeakPolarHBondContact O-CB 3.37Å; G333-F336 PolarHBondContact O-N 3.21Å; G334-F336 VanDerWaalsContact C-N 3.28Å; G334-F336 PolarHBondContact O-N 2.71Å; F336-S339 PolarHBondContact O-OG 3.39Å; F336-R340 VanDerWaalsContact CZ-CZ 3.41Å; F336-R340 WeakPolarHBondContact O-CD 3.29Å; F336-R340 PolarHBondContact O-NH1 2.96Å |
| 337 | A | 78.3 | Confident | 85.8 | Confident | 4 Ų | 4 | 8.9 Ų | 8.9 | 3% | 0.033 | 4% | 0.043 | C | C | . | . | H | α-helix | trans | -71.8 | -39.3 | -179 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y251 F254 G333 G334 V335 S339 R340 L341 | Y251-A337 HydrophobicContact CD1-CB 3.33Å; Y251-A337 HydrophobicContact CE1-CB 3.82Å; Y251-A337 HydrophobicContact CG-CB 4.32Å; F254-A337 HydrophobicContact CB-CB 4.4Å; G333-A337 PolarHBondContact O-N 2.9Å; G333-A337 VanDerWaalsContact O-N 3.12Å; G334-A337 PolarHBondContact O-N 2.74Å; V335-A337 PolarHBondContact O-N 2.98Å; A337-S339 VanDerWaalsContact C-N 3.34Å; A337-S339 PolarHBondContact O-N 3.4Å; A337-R340 PolarHBondContact O-N 3.26Å; A337-L341 PolarHBondContact O-N 3.08Å |
| 338 | V | 81 | Confident | 85.6 | Confident | 1 Ų | 1 | 12.5 Ų | 12.5 | 1% | 0.006 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -64.8 | -39.1 | -177.7 | 172.2 | 0 | 0 | 0 | 0 | 111.9 | R135 G334 V335 R340 L341 F342 L372 | R135-V338 HydrophobicContact CB-CG1 4.38Å; R135-V338 HydrophobicContact CB-CG2 4.15Å; R135-V338 HydrophobicContact CG-CG1 4.12Å; R135-V338 HydrophobicContact CG-CG2 3.58Å; G334-V338 VanDerWaalsContact O-CG2 3.25Å; G334-V338 WeakPolarHBondContact O-CG2 3.17Å; G334-V338 PolarHBondContact O-N 3.49Å; V335-V338 PolarHBondContact O-N 2.87Å; V338-R340 PolarHBondContact O-N 3.05Å; V338-L341 WeakPolarHBondContact O-CB 3.29Å; V338-L341 PolarHBondContact O-N 3.39Å; V338-F342 HydrophobicContact CG1-CD2 3.87Å; V338-F342 HydrophobicContact CG1-CE1 4.08Å; V338-F342 HydrophobicContact CG1-CE2 3.31Å; V338-F342 HydrophobicContact CG1-CG 4.45Å; V338-F342 HydrophobicContact CG1-CZ 3.4Å; V338-F342 VanDerWaalsContact CG1-CZ 3.4Å; V338-F342 PolarHBondContact O-N 2.74Å; V338-L372 HydrophobicContact CB-CD2 4.36Å; V338-L372 HydrophobicContact CG1-CD2 3.94Å |
| 339 | S | 82.3 | Confident | 85.3 | Confident | 4 Ų | 4 | 13.4 Ų | 13.4 | 3% | 0.028 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -56.9 | -36.4 | 176.7 | 62 | 0 | 0 | 0 | 0 | 112.7 | V335 F336 A337 Y343 | V335-S339 PolarHBondContact O-N 3.43Å; V335-S339 VanDerWaalsContact O-N 3.12Å; V335-S339 PolarHBondContact O-OG 2.77Å; F336-S339 PolarHBondContact O-OG 3.39Å; A337-S339 VanDerWaalsContact C-N 3.34Å; A337-S339 PolarHBondContact O-N 3.4Å; S339-Y343 VanDerWaalsContact O-CB 3.26Å; S339-Y343 WeakPolarHBondContact O-CB 3.42Å; S339-Y343 PolarHBondContact O-N 3.14Å |
| 340 | R | 79.7 | Confident | 85.3 | Confident | 11 Ų | 11 | 14 Ų | 14 | 4% | 0.042 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -72.1 | -36 | 175.2 | -78 | 85.7 | 178.8 | 135.7 | 5 | 112.7 | V255 E258 F336 A337 V338 Y343 V344 | V255-R340 HydrophobicContact CG1-CB 4.43Å; V255-R340 HydrophobicContact CG1-CG 4.01Å; E258-R340 IonicContact OE1-CZ 2.73Å; E258-R340 IonicContact OE1-NE 3.71Å; E258-R340 PolarHBondContact OE1-NE 3.43Å; E258-R340 IonicContact OE1-NH2 2.69Å; E258-R340 IonicContact OE2-NH2 3.17Å; F336-R340 VanDerWaalsContact CZ-CZ 3.41Å; F336-R340 WeakPolarHBondContact O-CD 3.29Å; F336-R340 PolarHBondContact O-NH1 2.96Å; A337-R340 PolarHBondContact O-N 3.26Å; V338-R340 PolarHBondContact O-N 3.05Å; R340-Y343 WeakPolarHBondContact O-CB 3.3Å; R340-Y343 PolarHBondContact O-N 3.38Å; R340-V344 WeakPolarHBondContact O-CB 3.39Å; R340-V344 VanDerWaalsContact O-CG2 3.29Å; R340-V344 WeakPolarHBondContact O-CG2 3.15Å; R340-V344 PolarHBondContact O-N 3.24Å |
| 341 | L | 84.9 | Confident | 85.2 | Confident | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -62.6 | -46.8 | 176.4 | 175.7 | 56.8 | 0 | 0 | 0 | 111.2 | G108 Y111 V127 E130 F254 A337 V338 Y343 V344 A345 | G108-L341 WeakPolarHBondContact O-CD1 3.46Å; Y111-L341 VanDerWaalsContact CB-CD1 3.48Å; Y111-L341 HydrophobicContact CD1-CD1 4.25Å; Y111-L341 HydrophobicContact CG-CD1 4.04Å; V127-L341 HydrophobicContact CG2-CD1 4.23Å; E130-L341 HydrophobicContact CB-CD2 4.45Å; E130-L341 HydrophobicContact CG-CD2 3.52Å; E130-L341 VanDerWaalsContact OE1-CD2 3.28Å; E130-L341 WeakPolarHBondContact OE1-CD2 3.42Å; F254-L341 HydrophobicContact CD1-CB 4.07Å; F254-L341 HydrophobicContact CD1-CD1 4.36Å; F254-L341 HydrophobicContact CD1-CD2 4.28Å; F254-L341 HydrophobicContact CD1-CG 4.49Å; F254-L341 HydrophobicContact CE1-CD1 4.23Å; F254-L341 HydrophobicContact CE1-CD2 3.95Å; F254-L341 HydrophobicContact CE1-CG 4.49Å; A337-L341 PolarHBondContact O-N 3.08Å; V338-L341 WeakPolarHBondContact O-CB 3.29Å; V338-L341 PolarHBondContact O-N 3.39Å; L341-Y343 VanDerWaalsContact C-N 3.33Å; L341-V344 PolarHBondContact O-N 3.39Å; L341-A345 WeakPolarHBondContact O-CB 3.44Å; L341-A345 PolarHBondContact O-N 3.11Å |
| 342 | F | 86.8 | Confident | 85.1 | Confident | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -67.1 | -37.7 | 177.2 | -62.2 | -22.2 | 0 | 0 | 0 | 112.1 | E130 L131 V338 A345 S346 L351 A368 L372 | E130-F342 HydrophobicContact CG-CE1 4.42Å; L131-F342 HydrophobicContact CB-CE1 3.92Å; L131-F342 HydrophobicContact CB-CZ 4.01Å; L131-F342 HydrophobicContact CD1-CD1 4.47Å; L131-F342 HydrophobicContact CD1-CD2 4.21Å; L131-F342 HydrophobicContact CD1-CE1 3.81Å; L131-F342 HydrophobicContact CD1-CE2 3.49Å; L131-F342 VanDerWaalsContact CD1-CE2 3.49Å; L131-F342 HydrophobicContact CD1-CZ 3.28Å; L131-F342 HydrophobicContact CG-CE1 4.47Å; L131-F342 HydrophobicContact CG-CZ 4.26Å; V338-F342 HydrophobicContact CG1-CD2 3.87Å; V338-F342 HydrophobicContact CG1-CE1 4.08Å; V338-F342 HydrophobicContact CG1-CE2 3.31Å; V338-F342 HydrophobicContact CG1-CG 4.45Å; V338-F342 HydrophobicContact CG1-CZ 3.4Å; V338-F342 VanDerWaalsContact CG1-CZ 3.4Å; V338-F342 PolarHBondContact O-N 2.74Å; F342-A345 PolarHBondContact O-N 2.72Å; F342-S346 WeakPolarHBondContact O-CB 3.44Å; F342-S346 PolarHBondContact O-N 3.01Å; F342-L351 HydrophobicContact CB-CD1 4.02Å; F342-L351 HydrophobicContact CD1-CD1 3.96Å; F342-L351 HydrophobicContact CG-CD1 4.25Å; F342-A368 HydrophobicContact CB-CB 4.04Å; F342-A368 HydrophobicContact CD2-CB 4.3Å; F342-L372 HydrophobicContact CE2-CD1 4.49Å |
| 343 | Y | 82.6 | Confident | 84.9 | Confident | 6 Ų | 6 | 23.9 Ų | 23.9 | 2% | 0.024 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -56.4 | -51 | 172.1 | -179.8 | -89.8 | 0 | 0 | 0 | 112 | L40 S339 R340 L341 S346 R347 S356 I358 E497 | L40-Y343 HydrophobicContact CD1-CE1 4.13Å; S339-Y343 VanDerWaalsContact O-CB 3.26Å; S339-Y343 WeakPolarHBondContact O-CB 3.42Å; S339-Y343 PolarHBondContact O-N 3.14Å; R340-Y343 WeakPolarHBondContact O-CB 3.3Å; R340-Y343 PolarHBondContact O-N 3.38Å; L341-Y343 VanDerWaalsContact C-N 3.33Å; Y343-S346 PolarHBondContact O-N 3.34Å; Y343-R347 PolarHBondContact O-N 3.16Å; Y343-S356 WeakPolarHBondContact CD2-O 3.36Å; Y343-S356 WeakPolarHBondContact CE2-O 3.48Å; Y343-I358 HydrophobicContact CE2-CD1 3.98Å; Y343-I358 HydrophobicContact CE2-CG1 3.85Å; Y343-E497 WeakPolarHBondContact OH-CG 3.43Å; Y343-E497 PolarHBondContact OH-OE1 3.04Å; Y343-E497 PolarHBondContact OH-OE2 3.02Å |
| 344 | V | 83.9 | Confident | 84.9 | Confident | 4 Ų | 4 | 24.3 Ų | 24.3 | 2% | 0.024 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -65.9 | -43.5 | 179.2 | 172.6 | 0 | 0 | 0 | 0 | 111.5 | Y111 R340 L341 S346 R347 E348 | Y111-V344 HydrophobicContact CD1-CG1 4.18Å; Y111-V344 HydrophobicContact CE1-CG1 4.02Å; R340-V344 WeakPolarHBondContact O-CB 3.39Å; R340-V344 VanDerWaalsContact O-CG2 3.29Å; R340-V344 WeakPolarHBondContact O-CG2 3.15Å; R340-V344 PolarHBondContact O-N 3.24Å; L341-V344 PolarHBondContact O-N 3.39Å; V344-S346 VanDerWaalsContact C-N 3.28Å; V344-S346 PolarHBondContact O-N 3.45Å; V344-R347 WeakPolarHBondContact O-CB 3.45Å; V344-R347 PolarHBondContact O-N 2.94Å; V344-E348 WeakPolarHBondContact O-CG 3.38Å; V344-E348 PolarHBondContact O-N 3.13Å |
| 345 | A | 87.8 | Confident | 84.9 | Confident | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -65.3 | -33.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y111 V127 L341 F342 G349 H350 L351 | Y111-A345 HydrophobicContact CE1-CB 4.1Å; Y111-A345 HydrophobicContact CE2-CB 4.36Å; V127-A345 HydrophobicContact CB-CB 4.32Å; V127-A345 HydrophobicContact CG1-CB 3.76Å; V127-A345 HydrophobicContact CG2-CB 3.78Å; L341-A345 WeakPolarHBondContact O-CB 3.44Å; L341-A345 PolarHBondContact O-N 3.11Å; F342-A345 PolarHBondContact O-N 2.72Å; A345-G349 PolarHBondContact O-N 3.43Å; A345-H350 WeakPolarHBondContact O-CB 2.96Å; A345-H350 PolarHBondContact O-N 3.25Å; A345-L351 HydrophobicContact CB-CD1 3.84Å; A345-L351 HydrophobicContact CB-CG 4.09Å; A345-L351 PolarHBondContact O-N 3.28Å |
| 346 | S | 87.4 | Confident | 84.8 | Confident | 6 Ų | 6 | 25 Ų | 25 | 4% | 0.042 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -68.2 | -42.2 | 172.4 | -177.7 | 0 | 0 | 0 | 0 | 111.8 | F342 Y343 V344 E348 G349 P352 E353 S356 | F342-S346 WeakPolarHBondContact O-CB 3.44Å; F342-S346 PolarHBondContact O-N 3.01Å; Y343-S346 PolarHBondContact O-N 3.34Å; V344-S346 VanDerWaalsContact C-N 3.28Å; V344-S346 PolarHBondContact O-N 3.45Å; S346-E348 VanDerWaalsContact C-N 3.28Å; S346-E348 PolarHBondContact O-N 3.37Å; S346-G349 WeakPolarHBondContact O-CA 3.29Å; S346-G349 PolarHBondContact O-N 3.47Å; S346-P352 PolarHBondContact OG-O 3.34Å; S346-E353 WeakPolarHBondContact OG-CA 3.4Å; S346-S356 WeakPolarHBondContact CB-OG 3.03Å; S346-S356 WeakPolarHBondContact OG-CB 3.46Å; S346-S356 PolarHBondContact OG-N 3.38Å; S346-S356 VanDerWaalsContact OG-N 3.14Å; S346-S356 PolarHBondContact OG-OG 3.43Å |
| 347 | R | 84.6 | Confident | 85 | Confident | 82 Ų | 82 | 24.1 Ų | 24.1 | 31% | 0.309 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -60.7 | -35.7 | 175 | -171.6 | 177.9 | 69.7 | -168.3 | 0.6 | 112.9 | E257 Y343 V344 G349 | E257-R347 IonicContact OE1-NH2 2.68Å; E257-R347 PolarHBondContact OE1-NH2 3.3Å; E257-R347 IonicContact OE2-NH1 3.95Å; E257-R347 IonicContact OE2-NH2 2.62Å; Y343-R347 PolarHBondContact O-N 3.16Å; V344-R347 WeakPolarHBondContact O-CB 3.45Å; V344-R347 PolarHBondContact O-N 2.94Å; R347-G349 PolarHBondContact O-N 3.2Å |
| 348 | E | 87.8 | Confident | 85.3 | Confident | 76 Ų | 76 | 24.4 Ų | 24.4 | 36% | 0.355 | 13% | 0.133 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.3 | 5.4 | 174.2 | -63.3 | -67.4 | 157.7 | 0 | 0 | 113.1 | Y111 L115 V344 S346 H350 | Y111-E348 HydrophobicContact CE1-CB 4.49Å; Y111-E348 HydrophobicContact CE1-CG 4.1Å; Y111-E348 WeakPolarHBondContact OH-CB 3.4Å; L115-E348 HydrophobicContact CD2-CB 4.5Å; L115-E348 HydrophobicContact CD2-CG 4Å; V344-E348 WeakPolarHBondContact O-CG 3.38Å; V344-E348 PolarHBondContact O-N 3.13Å; S346-E348 VanDerWaalsContact C-N 3.28Å; S346-E348 PolarHBondContact O-N 3.37Å; E348-H350 VanDerWaalsContact C-N 3.29Å; E348-H350 PolarHBondContact O-N 2.95Å |
| 349 | G | 86.8 | Confident | 85.5 | Confident | 46 Ų | 46 | 25 Ų | 25 | 47% | 0.474 | 14% | 0.136 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 76.1 | 7.8 | 177 | 0 | 0 | 0 | 0 | 0 | 115.2 | A345 S346 R347 I468 | A345-G349 PolarHBondContact O-N 3.43Å; S346-G349 WeakPolarHBondContact O-CA 3.29Å; S346-G349 PolarHBondContact O-N 3.47Å; R347-G349 PolarHBondContact O-N 3.2Å; G349-I468 VanDerWaalsContact O-CD1 3.27Å; G349-I468 WeakPolarHBondContact O-CD1 3.12Å |
| 350 | H | 89.4 | Confident | 85.5 | Confident | 14 Ų | 14 | 27.9 Ų | 27.9 | 7% | 0.065 | 15% | 0.153 | C | C | . | . | S | Bend | trans | -86.7 | -14 | 179.4 | -73.5 | 165.2 | 0 | 0 | 0 | 113.9 | Y111 P120 F124 A345 E348 | Y111-H350 AromaticContact CE2-ND1 3.57Å; Y111-H350 AromaticContact CZ-ND1 3.61Å; Y111-H350 PolarHBondContact OH-ND1 2.91Å; P120-H350 PolarHBondContact O-CE1 3.32Å; F124-H350 HydrophobicContact CD2-CB 3.93Å; F124-H350 WeakPolarHBondContact CD2-O 3.33Å; F124-H350 WeakPolarHBondContact CE2-O 3.15Å; A345-H350 WeakPolarHBondContact O-CB 2.96Å; A345-H350 PolarHBondContact O-N 3.25Å; E348-H350 VanDerWaalsContact C-N 3.29Å; E348-H350 PolarHBondContact O-N 2.95Å |
| 351 | L | 89.3 | Confident | 85.6 | Confident | 19 Ų | 19 | 36.3 Ų | 36.3 | 10% | 0.099 | 19% | 0.185 | C | C | . | . | S | Bend | trans | -127.8 | 161.7 | 173 | -73.8 | -179.6 | 0 | 0 | 0 | 110.4 | V127 L131 F342 A345 E353 L355 | V127-L351 HydrophobicContact CG1-CD1 3.68Å; V127-L351 HydrophobicContact CG1-CD2 4.07Å; V127-L351 HydrophobicContact CG1-CG 3.86Å; L131-L351 HydrophobicContact CD2-CD2 4.23Å; F342-L351 HydrophobicContact CB-CD1 4.02Å; F342-L351 HydrophobicContact CD1-CD1 3.96Å; F342-L351 HydrophobicContact CG-CD1 4.25Å; A345-L351 HydrophobicContact CB-CD1 3.84Å; A345-L351 HydrophobicContact CB-CG 4.09Å; A345-L351 PolarHBondContact O-N 3.28Å; L351-E353 PolarHBondContact O-N 2.97Å; L351-L355 HydrophobicContact CB-CD1 4.19Å; L351-L355 HydrophobicContact CD1-CD1 4.04Å |
| 352 | P | 87 | Confident | 85.3 | Confident | 79 Ų | 79 | 40.5 Ų | 40.5 | 51% | 0.513 | 20% | 0.203 | S | C | . | . | trans | -58.7 | 134 | 176.8 | -24.6 | 35.1 | 0 | 0 | 0 | 112.2 | S346 I354 L355 | S346-P352 PolarHBondContact OG-O 3.34Å; P352-I354 HydrophobicContact CB-CG2 4.12Å; P352-I354 PolarHBondContact O-N 2.88Å; P352-L355 WeakPolarHBondContact O-CB 3.44Å; P352-L355 PolarHBondContact O-N 3.29Å | ||
| 353 | E | 84.5 | Confident | 84.9 | Confident | 117 Ų | 117 | 45.3 Ų | 45.3 | 55% | 0.547 | 23% | 0.226 | S | C | . | . | G | 310 helix | trans | -52.2 | -30.1 | -173 | -166.2 | -174.1 | 158.6 | 0 | 0 | 114.3 | S346 L351 L355 S356 M357 | S346-E353 WeakPolarHBondContact OG-CA 3.4Å; L351-E353 PolarHBondContact O-N 2.97Å; E353-L355 PolarHBondContact O-N 3.01Å; E353-L355 VanDerWaalsContact O-N 3.11Å; E353-S356 PolarHBondContact O-N 3.4Å; E353-S356 PolarHBondContact O-OG 3.29Å; E353-M357 HydrophobicContact CB-CE 4.27Å; E353-M357 HydrophobicContact CG-CE 3.91Å |
| 354 | I | 86.1 | Confident | 84.7 | Confident | 14 Ų | 14 | 45.1 Ų | 45.1 | 7% | 0.072 | 23% | 0.225 | C | C | . | . | G | 310 helix | trans | -54 | -30.4 | 175.1 | -167.2 | 61.3 | 0 | 0 | 0 | 112.5 | P352 S356 M357 P367 T485 L488 Q489 V494 | P352-I354 HydrophobicContact CB-CG2 4.12Å; P352-I354 PolarHBondContact O-N 2.88Å; I354-S356 VanDerWaalsContact C-N 3.32Å; I354-S356 PolarHBondContact O-N 2.91Å; I354-M357 HydrophobicContact CD1-CE 4.42Å; I354-M357 HydrophobicContact CD1-CG 4.5Å; I354-M357 HydrophobicContact CD1-SD 3.55Å; I354-M357 VanDerWaalsContact CD1-SD 3.55Å; I354-M357 WeakPolarHBondContact O-CB 3.3Å; I354-M357 PolarHBondContact O-N 3.07Å; I354-P367 HydrophobicContact CD1-CG 4.49Å; I354-P367 HydrophobicContact CG1-CB 4.15Å; I354-P367 HydrophobicContact CG1-CG 4.32Å; I354-P367 VanDerWaalsContact O-CB 3.28Å; I354-P367 WeakPolarHBondContact O-CB 3.34Å; I354-P367 VanDerWaalsContact O-CG 3.29Å; I354-P367 WeakPolarHBondContact O-CG 3.2Å; I354-T485 HydrophobicContact CB-CG2 4.3Å; I354-T485 HydrophobicContact CD1-CG2 4.4Å; I354-L488 HydrophobicContact CD1-CB 3.99Å; I354-L488 HydrophobicContact CG1-CB 4.15Å; I354-L488 HydrophobicContact CG1-CD1 4.29Å; I354-Q489 HydrophobicContact CD1-CG 3.91Å; I354-V494 HydrophobicContact CD1-CG2 3.86Å |
| 355 | L | 85.9 | Confident | 84.6 | Confident | 8 Ų | 8 | 45.5 Ų | 45.5 | 4% | 0.042 | 23% | 0.227 | C | C | . | . | G | 310 helix | trans | -76.4 | -17.6 | -179.2 | -58.4 | -174.5 | 0 | 0 | 0 | 113.4 | L351 P352 E353 P367 V371 | L351-L355 HydrophobicContact CB-CD1 4.19Å; L351-L355 HydrophobicContact CD1-CD1 4.04Å; P352-L355 WeakPolarHBondContact O-CB 3.44Å; P352-L355 PolarHBondContact O-N 3.29Å; E353-L355 PolarHBondContact O-N 3.01Å; E353-L355 VanDerWaalsContact O-N 3.11Å; L355-P367 HydrophobicContact CD2-CB 4.16Å; L355-V371 HydrophobicContact CD2-CB 4.37Å; L355-V371 HydrophobicContact CD2-CG2 3.7Å |
| 356 | S | 83.1 | Confident | 84.4 | Confident | 15 Ų | 15 | 46.5 Ų | 46.5 | 11% | 0.105 | 23% | 0.233 | C | C | . | . | G | 310 helix | trans | -90.9 | 2.9 | 169.1 | 40.1 | 0 | 0 | 0 | 0 | 113.5 | Y343 S346 E353 I354 | Y343-S356 WeakPolarHBondContact CD2-O 3.36Å; Y343-S356 WeakPolarHBondContact CE2-O 3.48Å; S346-S356 WeakPolarHBondContact CB-OG 3.03Å; S346-S356 WeakPolarHBondContact OG-CB 3.46Å; S346-S356 PolarHBondContact OG-N 3.38Å; S346-S356 VanDerWaalsContact OG-N 3.14Å; S346-S356 PolarHBondContact OG-OG 3.43Å; E353-S356 PolarHBondContact O-N 3.4Å; E353-S356 PolarHBondContact O-OG 3.29Å; I354-S356 VanDerWaalsContact C-N 3.32Å; I354-S356 PolarHBondContact O-N 2.91Å |
| 357 | M | 86.4 | Confident | 84.3 | Confident | 1 Ų | 1 | 46.4 Ų | 46.4 | 1% | 0.005 | 23% | 0.232 | C | C | . | . | trans | -84.7 | 149.8 | -179.4 | -60.8 | -176.9 | -170.9 | 0 | 0 | 112.3 | E353 I354 T485 Q489 V494 V495 | E353-M357 HydrophobicContact CB-CE 4.27Å; E353-M357 HydrophobicContact CG-CE 3.91Å; I354-M357 HydrophobicContact CD1-CE 4.42Å; I354-M357 HydrophobicContact CD1-CG 4.5Å; I354-M357 HydrophobicContact CD1-SD 3.55Å; I354-M357 VanDerWaalsContact CD1-SD 3.55Å; I354-M357 WeakPolarHBondContact O-CB 3.3Å; I354-M357 PolarHBondContact O-N 3.07Å; M357-T485 HydrophobicContact CE-CG2 4.07Å; M357-Q489 HydrophobicContact CE-CG 4.25Å; M357-Q489 HydrophobicContact SD-CG 3.45Å; M357-Q489 WeakPolarHBondContact SD-CG 3.32Å; M357-Q489 PolarHBondContact SD-NE2 3.18Å; M357-V494 HydrophobicContact CB-CB 3.84Å; M357-V494 HydrophobicContact CB-CG2 3.81Å; M357-V494 HydrophobicContact SD-CG2 4.14Å; M357-V495 CarbonylContact C-O 3.6Å; M357-V495 VanDerWaalsContact CA-O 3.31Å; M357-V495 WeakPolarHBondContact CA-O 3.5Å; M357-V495 WeakPolarHBondContact CB-O 3.46Å | ||
| 358 | I | 83.6 | Confident | 84.2 | Confident | 9 Ų | 9 | 42.5 Ų | 42.5 | 5% | 0.046 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 138 | -175.7 | -56.4 | 175.5 | 0 | 0 | 0 | 109.1 | V38 Y343 V360 H363 V494 V495 | V38-I358 HydrophobicContact CG1-CD1 4.24Å; Y343-I358 HydrophobicContact CE2-CD1 3.98Å; Y343-I358 HydrophobicContact CE2-CG1 3.85Å; I358-V360 PolarHBondContact O-N 2.73Å; I358-H363 VanDerWaalsContact CG2-C 3.5Å; I358-H363 HydrophobicContact CG2-CB 4.38Å; I358-V494 CarbonylContact O-C 3.58Å; I358-V494 VanDerWaalsContact O-CA 3.27Å; I358-V494 WeakPolarHBondContact O-CA 3.49Å; I358-V495 PolarHBondContact N-O 3.38Å; I358-V495 PolarHBondContact O-N 3.2Å |
| 359 | H | 85.8 | Confident | 84 | Confident | 14 Ų | 14 | 39.2 Ų | 39.2 | 7% | 0.065 | 20% | 0.202 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -66.7 | 129.6 | 174.9 | -172.9 | -46.6 | 0 | 0 | 0 | 111.1 | R361 K362 H363 T364 L366 L492 E493 V494 | H359-R361 PolarHBondContact ND1-N 3.22Å; H359-R361 PolarHBondContact O-N 3.46Å; H359-K362 HydrophobicContact CB-CB 4.27Å; H359-K362 PolarHBondContact O-N 3.01Å; H359-H363 VanDerWaalsContact O-CA 3.32Å; H359-H363 WeakPolarHBondContact O-CA 3.44Å; H359-H363 PolarHBondContact O-N 3Å; H359-T364 PolarHBondContact N-O 3.46Å; H359-L366 HydrophobicContact CB-CB 4.45Å; H359-L492 PolarHBondContact CD2-O 3.07Å; H359-E493 WeakPolarHBondContact CA-O 3.46Å; H359-E493 IonicContact CE1-OE2 3.39Å; H359-E493 PolarHBondContact CE1-OE2 3.47Å; H359-E493 VanDerWaalsContact CE1-OE2 3.31Å; H359-V494 HydrophobicContact CB-CG1 4.24Å |
| 360 | V | 82.9 | Confident | 84.1 | Confident | 65 Ų | 65 | 40.6 Ų | 40.6 | 39% | 0.394 | 20% | 0.198 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -52.1 | -172.5 | 177.3 | 0 | 0 | 0 | 0 | 112.6 | I358 H363 E493 V495 | I358-V360 PolarHBondContact O-N 2.73Å; V360-H363 PolarHBondContact O-CE1 3.41Å; V360-H363 VanDerWaalsContact O-CE1 3.29Å; V360-E493 HydrophobicContact CB-CG 4.32Å; V360-E493 HydrophobicContact CG2-CG 4.36Å; V360-E493 WeakPolarHBondContact CG2-O 3.36Å; V360-E493 PolarHBondContact N-O 3.44Å; V360-V495 HydrophobicContact CG2-CB 4.37Å; V360-V495 HydrophobicContact CG2-CG1 3.61Å; V360-V495 HydrophobicContact CG2-CG2 3.92Å |
| 361 | R | 81.3 | Confident | 83.9 | Confident | 188 Ų | 188 | 42.4 Ų | 42.4 | 71% | 0.709 | 21% | 0.21 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -78 | -34.3 | -177 | -55.5 | -177.2 | -166.5 | -157.9 | -0.2 | 114.6 | H359 E493 | H359-R361 PolarHBondContact ND1-N 3.22Å; H359-R361 PolarHBondContact O-N 3.46Å; R361-E493 IonicContact CZ-OE1 3.8Å; R361-E493 IonicContact CZ-OE2 3.74Å; R361-E493 IonicContact NE-OE1 3.05Å; R361-E493 PolarHBondContact NE-OE1 2.7Å; R361-E493 IonicContact NE-OE2 2.68Å; R361-E493 PolarHBondContact NE-OE2 3.36Å; R361-E493 IonicContact NH2-OE1 3.97Å; R361-E493 PolarHBondContact NH2-OE1 2.81Å; R361-E493 IonicContact NH2-OE2 3.83Å |
| 362 | K | 77.3 | Confident | 83.8 | Confident | 88 Ų | 88 | 41.6 Ų | 41.6 | 38% | 0.383 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -99.3 | -17 | -168.7 | -68.2 | 172.8 | 174.9 | 169.3 | 0 | 113.3 | M182 H359 T364 | M182-K362 WeakPolarHBondContact O-CB 3.45Å; M182-K362 WeakPolarHBondContact O-CD 3.14Å; M182-K362 WeakPolarHBondContact O-CG 3.45Å; H359-K362 HydrophobicContact CB-CB 4.27Å; H359-K362 PolarHBondContact O-N 3.01Å; K362-T364 HydrophobicContact CB-CG2 4.19Å; K362-T364 PolarHBondContact O-N 3.07Å |
| 363 | H | 78.6 | Confident | 84 | Confident | 101 Ų | 101 | 40.3 Ų | 40.3 | 47% | 0.468 | 19% | 0.193 | S | C | . | . | trans | 51.6 | 40.7 | -174.1 | -53.6 | -73.4 | 0 | 0 | 0 | 112.7 | I358 H359 V360 | I358-H363 VanDerWaalsContact CG2-C 3.5Å; I358-H363 HydrophobicContact CG2-CB 4.38Å; H359-H363 VanDerWaalsContact O-CA 3.32Å; H359-H363 WeakPolarHBondContact O-CA 3.44Å; H359-H363 PolarHBondContact O-N 3Å; V360-H363 PolarHBondContact O-CE1 3.41Å; V360-H363 VanDerWaalsContact O-CE1 3.29Å | ||
| 364 | T | 80.1 | Confident | 84.4 | Confident | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.006 | 19% | 0.188 | C | C | . | . | trans | -114.5 | 144.9 | -179.2 | 51 | 0 | 0 | 0 | 0 | 110.8 | S181 V184 H359 K362 L366 | S181-T364 PolarHBondContact O-OG1 3.01Å; V184-T364 HydrophobicContact CG2-CG2 3.82Å; H359-T364 PolarHBondContact N-O 3.46Å; K362-T364 HydrophobicContact CB-CG2 4.19Å; K362-T364 PolarHBondContact O-N 3.07Å; T364-L366 PolarHBondContact O-N 2.91Å | ||
| 365 | P | 80.1 | Confident | 84.6 | Confident | 12 Ų | 12 | 39.3 Ų | 39.3 | 8% | 0.078 | 20% | 0.195 | C | C | . | . | trans | -77.2 | 64.5 | 174.5 | 33.2 | -36.7 | 0 | 0 | 0 | 111 | A368 V369 | P365-A368 HydrophobicContact CB-CB 4.5Å; P365-A368 PolarHBondContact O-N 2.73Å; P365-V369 PolarHBondContact O-N 2.97Å | ||
| 366 | L | 84 | Confident | 84.8 | Confident | 21 Ų | 21 | 39 Ų | 39 | 11% | 0.11 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -56.2 | -47.2 | -172.5 | 177.7 | 62.8 | 0 | 0 | 0 | 113.9 | S181 H359 T364 A368 V369 I370 L492 V494 | S181-L366 VanDerWaalsContact CB-CD1 3.45Å; S181-L366 WeakPolarHBondContact OG-CD1 3.28Å; H359-L366 HydrophobicContact CB-CB 4.45Å; T364-L366 PolarHBondContact O-N 2.91Å; L366-A368 VanDerWaalsContact C-N 3.3Å; L366-A368 PolarHBondContact O-N 3.23Å; L366-V369 PolarHBondContact O-N 2.95Å; L366-V369 VanDerWaalsContact O-N 3.13Å; L366-I370 HydrophobicContact CD1-CD1 3.75Å; L366-I370 HydrophobicContact CD1-CG1 3.93Å; L366-I370 HydrophobicContact CD2-CD1 4.19Å; L366-I370 HydrophobicContact CG-CD1 3.64Å; L366-I370 HydrophobicContact CG-CG1 4.24Å; L366-I370 WeakPolarHBondContact O-CG1 3.43Å; L366-I370 PolarHBondContact O-N 3.27Å; L366-L492 HydrophobicContact CD2-CB 4.2Å; L366-L492 HydrophobicContact CD2-CD2 4Å; L366-V494 HydrophobicContact CB-CG1 4.49Å |
| 367 | P | 86.5 | Confident | 85.3 | Confident | 5 Ų | 5 | 39.8 Ų | 39.8 | 3% | 0.032 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.4 | -37 | -176.2 | -23.6 | 36.4 | 0 | 0 | 0 | 112.8 | I354 L355 V369 I370 V371 L492 V494 | I354-P367 HydrophobicContact CD1-CG 4.49Å; I354-P367 HydrophobicContact CG1-CB 4.15Å; I354-P367 HydrophobicContact CG1-CG 4.32Å; I354-P367 VanDerWaalsContact O-CB 3.28Å; I354-P367 WeakPolarHBondContact O-CB 3.34Å; I354-P367 VanDerWaalsContact O-CG 3.29Å; I354-P367 WeakPolarHBondContact O-CG 3.2Å; L355-P367 HydrophobicContact CD2-CB 4.16Å; P367-V369 VanDerWaalsContact C-N 3.32Å; P367-V369 PolarHBondContact O-N 3.41Å; P367-I370 PolarHBondContact O-N 3.03Å; P367-V371 WeakPolarHBondContact O-CG2 3.29Å; P367-V371 PolarHBondContact O-N 3.41Å; P367-V371 VanDerWaalsContact O-N 3.08Å; P367-L492 HydrophobicContact CB-CD1 4.28Å; P367-L492 HydrophobicContact CG-CD1 3.95Å; P367-V494 HydrophobicContact CG-CB 4.47Å; P367-V494 HydrophobicContact CG-CG1 3.95Å; P367-V494 HydrophobicContact CG-CG2 4.15Å |
| 368 | A | 82.4 | Confident | 85.5 | Confident | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.8 | -37.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | F342 P365 L366 | F342-A368 HydrophobicContact CB-CB 4.04Å; F342-A368 HydrophobicContact CD2-CB 4.3Å; P365-A368 HydrophobicContact CB-CB 4.5Å; P365-A368 PolarHBondContact O-N 2.73Å; L366-A368 VanDerWaalsContact C-N 3.3Å; L366-A368 PolarHBondContact O-N 3.23Å |
| 369 | V | 83.7 | Confident | 85.8 | Confident | 6 Ų | 6 | 46 Ų | 46 | 4% | 0.036 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -71.6 | -42.4 | 176.5 | -179.2 | 0 | 0 | 0 | 0 | 110.7 | M177 V335 P365 L366 P367 V371 L372 H373 | M177-V369 HydrophobicContact CB-CG1 4.17Å; M177-V369 HydrophobicContact SD-CG1 3.64Å; V335-V369 HydrophobicContact CG1-CG1 4.03Å; V335-V369 HydrophobicContact CG1-CG2 4.27Å; P365-V369 PolarHBondContact O-N 2.97Å; L366-V369 PolarHBondContact O-N 2.95Å; L366-V369 VanDerWaalsContact O-N 3.13Å; P367-V369 VanDerWaalsContact C-N 3.32Å; P367-V369 PolarHBondContact O-N 3.41Å; V369-V371 PolarHBondContact O-N 3.33Å; V369-L372 PolarHBondContact O-N 2.87Å; V369-H373 PolarHBondContact O-N 2.71Å |
| 370 | I | 87 | Confident | 86 | Confident | 75 Ų | 75 | 45.3 Ų | 45.3 | 39% | 0.385 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -62 | -41.4 | -179.2 | -70.1 | 174.8 | 0 | 0 | 0 | 111.7 | L366 P367 L372 H373 P374 L492 | L366-I370 HydrophobicContact CD1-CD1 3.75Å; L366-I370 HydrophobicContact CD1-CG1 3.93Å; L366-I370 HydrophobicContact CD2-CD1 4.19Å; L366-I370 HydrophobicContact CG-CD1 3.64Å; L366-I370 HydrophobicContact CG-CG1 4.24Å; L366-I370 WeakPolarHBondContact O-CG1 3.43Å; L366-I370 PolarHBondContact O-N 3.27Å; P367-I370 PolarHBondContact O-N 3.03Å; I370-L372 VanDerWaalsContact C-N 3.29Å; I370-L372 PolarHBondContact O-N 3.05Å; I370-H373 PolarHBondContact O-N 2.65Å; I370-P374 WeakPolarHBondContact O-CD 3.44Å; I370-L492 HydrophobicContact CD1-CD1 4.19Å; I370-L492 HydrophobicContact CD1-CD2 3.52Å |
| 371 | V | 87.3 | Confident | 86.3 | Confident | 53 Ų | 53 | 46.8 Ų | 46.8 | 32% | 0.321 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -65.8 | -33 | 179.9 | 170.9 | 0 | 0 | 0 | 0 | 112.4 | L131 L355 P367 V369 H373 P374 L375 | L131-V371 HydrophobicContact CD1-CG1 3.99Å; L355-V371 HydrophobicContact CD2-CB 4.37Å; L355-V371 HydrophobicContact CD2-CG2 3.7Å; P367-V371 WeakPolarHBondContact O-CG2 3.29Å; P367-V371 PolarHBondContact O-N 3.41Å; P367-V371 VanDerWaalsContact O-N 3.08Å; V369-V371 PolarHBondContact O-N 3.33Å; V371-H373 VanDerWaalsContact C-N 3.33Å; V371-H373 PolarHBondContact O-N 3.37Å; V371-P374 WeakPolarHBondContact O-CD 3.5Å; V371-L375 HydrophobicContact CG1-CD1 4.46Å |
| 372 | L | 86.6 | Confident | 86.4 | Confident | 2 Ų | 2 | 41.8 Ų | 41.8 | 1% | 0.01 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -70.4 | -31.5 | 179.9 | -174 | 62.5 | 0 | 0 | 0 | 112.6 | R135 P136 M177 V335 V338 F342 V369 I370 T376 | R135-L372 HydrophobicContact CB-CD1 3.88Å; P136-L372 HydrophobicContact CG-CD1 4.08Å; M177-L372 HydrophobicContact CE-CB 4.5Å; M177-L372 HydrophobicContact CE-CD2 4.02Å; M177-L372 HydrophobicContact CE-CG 4.1Å; V335-L372 HydrophobicContact CG2-CD2 4.42Å; V338-L372 HydrophobicContact CB-CD2 4.36Å; V338-L372 HydrophobicContact CG1-CD2 3.94Å; F342-L372 HydrophobicContact CE2-CD1 4.49Å; V369-L372 PolarHBondContact O-N 2.87Å; I370-L372 VanDerWaalsContact C-N 3.29Å; I370-L372 PolarHBondContact O-N 3.05Å; L372-T376 WeakPolarHBondContact O-CB 3.3Å; L372-T376 PolarHBondContact O-N 3.43Å; L372-T376 PolarHBondContact O-OG1 3.13Å |
| 373 | H | 90.8 | Very high | 85.9 | Confident | 51 Ų | 51 | 38.3 Ų | 38.3 | 24% | 0.236 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.8 | -54.9 | -174.1 | -174.8 | 54.9 | 0 | 0 | 0 | 114.7 | T174 M177 V369 I370 V371 L375 T376 M377 | T174-H373 PolarHBondContact OG1-CE1 2.81Å; M177-H373 HydrophobicContact CG-CB 4.34Å; V369-H373 PolarHBondContact O-N 2.71Å; I370-H373 PolarHBondContact O-N 2.65Å; V371-H373 VanDerWaalsContact C-N 3.33Å; V371-H373 PolarHBondContact O-N 3.37Å; H373-L375 VanDerWaalsContact C-N 3.32Å; H373-L375 PolarHBondContact O-N 3.21Å; H373-T376 PolarHBondContact O-N 3.43Å; H373-M377 WeakPolarHBondContact CE1-CE 3.49Å; H373-M377 WeakPolarHBondContact O-CG 3.35Å; H373-M377 PolarHBondContact O-N 2.88Å |
| 374 | P | 91.9 | Very high | 85.6 | Confident | 67 Ų | 67 | 38.1 Ų | 38.1 | 44% | 0.435 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64.1 | -37.4 | 179.9 | 25.7 | -33.8 | 0 | 0 | 0 | 112 | I370 V371 T376 M377 I378 | I370-P374 WeakPolarHBondContact O-CD 3.44Å; V371-P374 WeakPolarHBondContact O-CD 3.5Å; P374-T376 VanDerWaalsContact C-N 3.32Å; P374-T376 PolarHBondContact O-N 2.98Å; P374-M377 PolarHBondContact O-N 3.26Å; P374-I378 WeakPolarHBondContact O-CG1 3.35Å; P374-I378 PolarHBondContact O-N 2.72Å |
| 375 | L | 90.6 | Very high | 85.2 | Confident | 44 Ų | 44 | 40 Ų | 40 | 23% | 0.23 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.9 | -42 | 176.2 | -65.2 | 175 | 0 | 0 | 0 | 111.5 | L131 P136 V371 H373 I378 M379 | L131-L375 HydrophobicContact CD1-CD1 4.17Å; L131-L375 HydrophobicContact CG-CD1 4.28Å; L131-L375 WeakPolarHBondContact O-CD1 3.46Å; P136-L375 HydrophobicContact CB-CB 4.15Å; P136-L375 HydrophobicContact CG-CB 3.67Å; P136-L375 HydrophobicContact CG-CD1 4.42Å; V371-L375 HydrophobicContact CG1-CD1 4.46Å; H373-L375 VanDerWaalsContact C-N 3.32Å; H373-L375 PolarHBondContact O-N 3.21Å; L375-I378 PolarHBondContact O-N 3.38Å; L375-M379 WeakPolarHBondContact O-CG 3.34Å; L375-M379 PolarHBondContact O-N 3Å; L375-M379 VanDerWaalsContact O-N 3.14Å |
| 376 | T | 91.5 | Very high | 84.7 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -68.3 | -37.8 | 177.1 | -50.5 | 0 | 0 | 0 | 0 | 111.5 | T139 A140 L173 L372 H373 P374 M379 L380 | T139-T376 HydrophobicContact CG2-CG2 3.83Å; A140-T376 HydrophobicContact CB-CG2 4.36Å; L173-T376 HydrophobicContact CD1-CG2 4.15Å; L173-T376 HydrophobicContact CD2-CG2 3.47Å; L173-T376 VanDerWaalsContact CD2-CG2 3.47Å; L173-T376 HydrophobicContact CG-CG2 4.45Å; L372-T376 WeakPolarHBondContact O-CB 3.3Å; L372-T376 PolarHBondContact O-N 3.43Å; L372-T376 PolarHBondContact O-OG1 3.13Å; H373-T376 PolarHBondContact O-N 3.43Å; P374-T376 VanDerWaalsContact C-N 3.32Å; P374-T376 PolarHBondContact O-N 2.98Å; T376-M379 PolarHBondContact O-N 3.3Å; T376-L380 WeakPolarHBondContact O-CB 3.34Å; T376-L380 PolarHBondContact O-N 3.28Å |
| 377 | M | 92.8 | Very high | 84.2 | Confident | 32 Ų | 32 | 44.5 Ų | 44.5 | 16% | 0.158 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.2 | -42.6 | 174.8 | -75.3 | -66.3 | -179 | 0 | 0 | 112.1 | A170 L173 T174 H373 P374 M379 L380 F381 | A170-M377 HydrophobicContact CB-CE 3.75Å; A170-M377 HydrophobicContact CB-SD 3.88Å; A170-M377 WeakPolarHBondContact O-CE 3.13Å; L173-M377 HydrophobicContact CD2-CE 4.03Å; L173-M377 HydrophobicContact CD2-SD 4.28Å; T174-M377 WeakPolarHBondContact OG1-CE 3.41Å; H373-M377 WeakPolarHBondContact CE1-CE 3.49Å; H373-M377 WeakPolarHBondContact O-CG 3.35Å; H373-M377 PolarHBondContact O-N 2.88Å; P374-M377 PolarHBondContact O-N 3.26Å; M377-M379 VanDerWaalsContact C-N 3.33Å; M377-M379 PolarHBondContact O-N 3.39Å; M377-L380 WeakPolarHBondContact O-CB 3.4Å; M377-L380 PolarHBondContact O-N 3.28Å; M377-L380 HydrophobicContact SD-CD2 3.99Å; M377-F381 VanDerWaalsContact O-CD2 3.25Å; M377-F381 WeakPolarHBondContact O-CD2 3.5Å; M377-F381 PolarHBondContact O-N 2.62Å; M377-F381 VanDerWaalsContact O-N 3.1Å; M377-F381 HydrophobicContact SD-CE2 4.2Å |
| 378 | I | 91.4 | Very high | 83.6 | Confident | 108 Ų | 108 | 44.6 Ų | 44.6 | 55% | 0.554 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -59.5 | -46.8 | 175.4 | -68.1 | 164 | 0 | 0 | 0 | 110.1 | P374 L375 L380 F381 S382 | P374-I378 WeakPolarHBondContact O-CG1 3.35Å; P374-I378 PolarHBondContact O-N 2.72Å; L375-I378 PolarHBondContact O-N 3.38Å; I378-L380 VanDerWaalsContact C-N 3.34Å; I378-L380 PolarHBondContact O-N 2.77Å; I378-F381 PolarHBondContact O-N 2.97Å; I378-S382 VanDerWaalsContact O-CB 3.26Å; I378-S382 WeakPolarHBondContact O-CB 3.42Å; I378-S382 PolarHBondContact O-N 3.43Å; I378-S382 PolarHBondContact O-OG 3.29Å |
| 379 | M | 89.1 | Confident | 83.2 | Confident | 33 Ų | 33 | 44.7 Ų | 44.7 | 16% | 0.163 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.8 | -38.1 | 177.5 | -69.3 | -66.1 | 179.7 | 0 | 0 | 112.6 | P136 A140 L375 T376 M377 F381 G383 L388 F391 | P136-M379 HydrophobicContact CB-CB 4.4Å; P136-M379 HydrophobicContact CB-CG 3.64Å; A140-M379 HydrophobicContact CB-CB 4.05Å; L375-M379 WeakPolarHBondContact O-CG 3.34Å; L375-M379 PolarHBondContact O-N 3Å; L375-M379 VanDerWaalsContact O-N 3.14Å; T376-M379 PolarHBondContact O-N 3.3Å; M377-M379 VanDerWaalsContact C-N 3.33Å; M377-M379 PolarHBondContact O-N 3.39Å; M379-F381 PolarHBondContact O-N 2.95Å; M379-G383 PolarHBondContact O-N 3.37Å; M379-L388 HydrophobicContact CB-CD2 4.43Å; M379-L388 HydrophobicContact SD-CD2 4.07Å; M379-F391 HydrophobicContact CE-CE1 4.31Å |
| 380 | L | 90.9 | Very high | 82.8 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.9 | -42.1 | 177.8 | 173.8 | 64 | 0 | 0 | 0 | 112.5 | L144 T169 A170 T376 M377 I378 | L144-L380 HydrophobicContact CD1-CD1 4.26Å; L144-L380 HydrophobicContact CD2-CD1 3.42Å; L144-L380 VanDerWaalsContact CD2-CD1 3.42Å; L144-L380 HydrophobicContact CG-CD1 3.56Å; T169-L380 HydrophobicContact CG2-CD1 3.4Å; T169-L380 VanDerWaalsContact CG2-CD1 3.4Å; T169-L380 HydrophobicContact CG2-CD2 3.84Å; T169-L380 HydrophobicContact CG2-CG 4.28Å; A170-L380 HydrophobicContact CB-CD2 3.95Å; T376-L380 WeakPolarHBondContact O-CB 3.34Å; T376-L380 PolarHBondContact O-N 3.28Å; M377-L380 WeakPolarHBondContact O-CB 3.4Å; M377-L380 PolarHBondContact O-N 3.28Å; M377-L380 HydrophobicContact SD-CD2 3.99Å; I378-L380 VanDerWaalsContact C-N 3.34Å; I378-L380 PolarHBondContact O-N 2.77Å |
| 381 | F | 89.4 | Confident | 82.1 | Confident | 95 Ų | 95 | 43.4 Ų | 43.4 | 42% | 0.417 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -86 | -27.1 | -178.2 | -73.8 | -72.1 | 0 | 0 | 0 | 113.5 | K166 A170 M377 I378 M379 | K166-F381 HydrophobicContact CB-CD1 4.32Å; K166-F381 HydrophobicContact CB-CE1 3.92Å; K166-F381 HydrophobicContact CD-CD1 4.06Å; K166-F381 HydrophobicContact CD-CE1 4.48Å; K166-F381 PolarHBondContact NZ-O 3.33Å; A170-F381 HydrophobicContact CB-CZ 4.42Å; M377-F381 VanDerWaalsContact O-CD2 3.25Å; M377-F381 WeakPolarHBondContact O-CD2 3.5Å; M377-F381 PolarHBondContact O-N 2.62Å; M377-F381 VanDerWaalsContact O-N 3.1Å; M377-F381 HydrophobicContact SD-CE2 4.2Å; I378-F381 PolarHBondContact O-N 2.97Å; M379-F381 PolarHBondContact O-N 2.95Å |
| 382 | S | 82.1 | Confident | 81.8 | Confident | 84 Ų | 84 | 40.9 Ų | 40.9 | 59% | 0.587 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -90.6 | -28.8 | -176.4 | 59.7 | 0 | 0 | 0 | 0 | 115 | I378 | I378-S382 VanDerWaalsContact O-CB 3.26Å; I378-S382 WeakPolarHBondContact O-CB 3.42Å; I378-S382 PolarHBondContact O-N 3.43Å; I378-S382 PolarHBondContact O-OG 3.29Å |
| 383 | G | 67.8 | Low | 81.5 | Confident | 14 Ų | 14 | 40.9 Ų | 40.9 | 14% | 0.144 | 23% | 0.226 | C | C | . | . | trans | -102.3 | 141.8 | -168.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | M379 | M379-G383 PolarHBondContact O-N 3.37Š| ||
| 384 | D | 72.3 | Confident | 81.3 | Confident | 98 Ų | 98 | 38.8 Ų | 38.8 | 52% | 0.524 | 22% | 0.216 | S | C | . | . | trans | -82.1 | 151.2 | 159.1 | 174.3 | 49.6 | 0 | 0 | 0 | 110.6 | D386 S387 L388 | D384-D386 PolarHBondContact O-N 2.88Å; D384-S387 PolarHBondContact O-N 2.66Å; D384-L388 WeakPolarHBondContact O-CB 3.43Å; D384-L388 VanDerWaalsContact O-CG 3.27Å; D384-L388 WeakPolarHBondContact O-CG 3.36Å; D384-L388 PolarHBondContact O-N 2.94Å | ||
| 385 | L | 70.2 | Confident | 81.1 | Confident | 40 Ų | 40 | 35.6 Ų | 35.6 | 21% | 0.209 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.6 | -46.1 | -170 | -168.7 | 151.4 | 0 | 0 | 0 | 112.3 | I64 V141 L388 L389 | I64-L385 HydrophobicContact CD1-CD1 4.34Å; V141-L385 HydrophobicContact CG1-CD1 4.41Å; V141-L385 HydrophobicContact CG1-CD2 4.28Å; V141-L385 HydrophobicContact CG1-CG 4.07Å; L385-L388 PolarHBondContact O-N 3.14Å; L385-L389 HydrophobicContact CD2-CD1 3.58Å; L385-L389 HydrophobicContact CD2-CG 4.16Å; L385-L389 WeakPolarHBondContact O-CG 3.06Å; L385-L389 PolarHBondContact O-N 3.37Å |
| 386 | D | 69.8 | Low | 81 | Confident | 74 Ų | 74 | 34.4 Ų | 34.4 | 40% | 0.396 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -69.5 | -40.3 | -177.8 | -74.3 | -41.7 | 0 | 0 | 0 | 111.5 | D384 L389 N390 | D384-D386 PolarHBondContact O-N 2.88Å; D386-L389 WeakPolarHBondContact O-CB 3.49Å; D386-L389 PolarHBondContact O-N 3.48Å; D386-N390 PolarHBondContact O-N 3.24Å |
| 387 | S | 73.7 | Confident | 81 | Confident | 53 Ų | 53 | 34.8 Ų | 34.8 | 37% | 0.371 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -61.7 | -45.2 | 174.9 | -62.5 | 0 | 0 | 0 | 0 | 111.3 | D384 L389 N390 F391 | D384-S387 PolarHBondContact O-N 2.66Å; S387-L389 VanDerWaalsContact C-N 3.32Å; S387-L389 PolarHBondContact O-N 3.47Å; S387-N390 PolarHBondContact O-N 2.98Å; S387-F391 WeakPolarHBondContact O-CB 3.49Å; S387-F391 PolarHBondContact O-N 3.43Å |
| 388 | L | 74.4 | Confident | 81 | Confident | 8 Ų | 8 | 35.9 Ų | 35.9 | 4% | 0.042 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.3 | -39 | 176.7 | -74.5 | 172.8 | 0 | 0 | 0 | 112.1 | A137 A140 V141 M379 D384 L385 L392 | A137-L388 HydrophobicContact CB-CD2 4.1Å; A140-L388 HydrophobicContact CB-CD1 4.26Å; V141-L388 HydrophobicContact CG2-CB 3.65Å; V141-L388 HydrophobicContact CG2-CD1 4.2Å; M379-L388 HydrophobicContact CB-CD2 4.43Å; M379-L388 HydrophobicContact SD-CD2 4.07Å; D384-L388 WeakPolarHBondContact O-CB 3.43Å; D384-L388 VanDerWaalsContact O-CG 3.27Å; D384-L388 WeakPolarHBondContact O-CG 3.36Å; D384-L388 PolarHBondContact O-N 2.94Å; L385-L388 PolarHBondContact O-N 3.14Å; L388-L392 WeakPolarHBondContact O-CB 3.49Å; L388-L392 WeakPolarHBondContact O-CD2 3.48Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 2.93Å; L388-L392 VanDerWaalsContact O-N 3.1Å |
| 389 | L | 74.1 | Confident | 81.1 | Confident | 1 Ų | 1 | 31.2 Ų | 31.2 | 1% | 0.005 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.9 | -52.7 | 174.9 | -76.9 | 178 | 0 | 0 | 0 | 111.2 | V141 Y240 Y244 L385 D386 S387 F391 L392 S393 | V141-L389 HydrophobicContact CG1-CD2 3.9Å; V141-L389 HydrophobicContact CG1-CG 4.25Å; V141-L389 HydrophobicContact CG2-CD2 4.26Å; V141-L389 HydrophobicContact CG2-CG 4.29Å; Y240-L389 PolarHBondContact OH-O 2.86Å; Y244-L389 HydrophobicContact CD1-CD2 4.41Å; Y244-L389 HydrophobicContact CD2-CD2 3.57Å; Y244-L389 HydrophobicContact CE1-CD2 4.09Å; Y244-L389 HydrophobicContact CE2-CD2 3.19Å; Y244-L389 HydrophobicContact CG-CD2 4.18Å; Y244-L389 VanDerWaalsContact CZ-CD2 3.5Å; L385-L389 HydrophobicContact CD2-CD1 3.58Å; L385-L389 HydrophobicContact CD2-CG 4.16Å; L385-L389 WeakPolarHBondContact O-CG 3.06Å; L385-L389 PolarHBondContact O-N 3.37Å; D386-L389 WeakPolarHBondContact O-CB 3.49Å; D386-L389 PolarHBondContact O-N 3.48Å; S387-L389 VanDerWaalsContact C-N 3.32Å; S387-L389 PolarHBondContact O-N 3.47Å; L389-F391 VanDerWaalsContact C-N 3.32Å; L389-F391 PolarHBondContact O-N 3.42Å; L389-L392 HydrophobicContact CD2-CD2 4.5Å; L389-L392 VanDerWaalsContact O-CG 3.29Å; L389-L392 WeakPolarHBondContact O-CG 3.35Å; L389-L392 PolarHBondContact O-N 3.14Å; L389-S393 WeakPolarHBondContact O-CB 3.47Å; L389-S393 PolarHBondContact O-N 3.23Å; L389-S393 VanDerWaalsContact O-N 3.1Å; L389-S393 PolarHBondContact O-OG 2.85Å |
| 390 | N | 74.3 | Confident | 81.4 | Confident | 29 Ų | 29 | 29.8 Ų | 29.8 | 16% | 0.155 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -60.8 | -45.5 | -178.1 | -71.3 | -18.8 | 0 | 0 | 0 | 111.3 | Y240 D386 S387 L392 S393 D446 | Y240-N390 VanDerWaalsContact CZ-OD1 3.26Å; Y240-N390 WeakPolarHBondContact OH-CA 3.11Å; Y240-N390 PolarHBondContact OH-N 3.45Å; Y240-N390 PolarHBondContact OH-OD1 3.01Å; D386-N390 PolarHBondContact O-N 3.24Å; S387-N390 PolarHBondContact O-N 2.98Å; N390-L392 PolarHBondContact O-N 3.36Å; N390-S393 PolarHBondContact O-N 3.27Å; N390-D446 HydrophobicContact CB-CB 4.28Å |
| 391 | F | 73.5 | Confident | 81.6 | Confident | 25 Ų | 25 | 30 Ų | 30 | 11% | 0.11 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -57.9 | -43.8 | 178 | -179.1 | -115.8 | 0 | 0 | 0 | 113.3 | I133 M379 S387 L389 S449 I452 I456 | I133-F391 HydrophobicContact CB-CE1 3.97Å; I133-F391 HydrophobicContact CB-CZ 4.32Å; I133-F391 HydrophobicContact CD1-CE1 4.22Å; I133-F391 HydrophobicContact CD1-CE2 4.39Å; I133-F391 HydrophobicContact CD1-CZ 3.69Å; I133-F391 HydrophobicContact CG1-CE1 3.77Å; I133-F391 HydrophobicContact CG1-CZ 3.66Å; I133-F391 HydrophobicContact CG2-CD1 3.61Å; I133-F391 HydrophobicContact CG2-CE1 3.18Å; I133-F391 HydrophobicContact CG2-CZ 3.76Å; M379-F391 HydrophobicContact CE-CE1 4.31Å; S387-F391 WeakPolarHBondContact O-CB 3.49Å; S387-F391 PolarHBondContact O-N 3.43Å; L389-F391 VanDerWaalsContact C-N 3.32Å; L389-F391 PolarHBondContact O-N 3.42Å; F391-S449 WeakPolarHBondContact CD2-O 3.09Å; F391-I452 HydrophobicContact CE2-CB 4.27Å; F391-I452 HydrophobicContact CE2-CG2 3.9Å; F391-I456 HydrophobicContact CE2-CD1 4.1Å; F391-I456 HydrophobicContact CZ-CD1 3.72Å |
| 392 | L | 80 | Confident | 81.9 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -77.6 | -25.9 | -178.7 | 69.3 | 72.2 | 0 | 0 | 0 | 113.6 | A137 A138 L388 L389 N390 R396 | A137-L392 HydrophobicContact CB-CB 4.06Å; A137-L392 HydrophobicContact CB-CD2 4.04Å; A138-L392 HydrophobicContact CB-CD2 4.19Å; L388-L392 WeakPolarHBondContact O-CB 3.49Å; L388-L392 WeakPolarHBondContact O-CD2 3.48Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 2.93Å; L388-L392 VanDerWaalsContact O-N 3.1Å; L389-L392 HydrophobicContact CD2-CD2 4.5Å; L389-L392 VanDerWaalsContact O-CG 3.29Å; L389-L392 WeakPolarHBondContact O-CG 3.35Å; L389-L392 PolarHBondContact O-N 3.14Å; N390-L392 PolarHBondContact O-N 3.36Å; L392-R396 VanDerWaalsContact CD1-NH1 3.3Å; L392-R396 VanDerWaalsContact O-CB 3.22Å; L392-R396 WeakPolarHBondContact O-CB 3.14Å; L392-R396 PolarHBondContact O-N 3.2Å; L392-R396 VanDerWaalsContact O-N 3.17Å |
| 393 | S | 81.6 | Confident | 82.5 | Confident | 2 Ų | 2 | 24.2 Ų | 24.2 | 1% | 0.014 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -71.5 | -42.7 | -168.3 | -77.1 | 0 | 0 | 0 | 0 | 112.2 | Y240 L389 N390 A395 R396 W397 | Y240-S393 WeakPolarHBondContact CE2-OG 3.36Å; Y240-S393 VanDerWaalsContact CZ-OG 3.24Å; Y240-S393 WeakPolarHBondContact OH-CB 3.35Å; Y240-S393 PolarHBondContact OH-OG 3.08Å; L389-S393 WeakPolarHBondContact O-CB 3.47Å; L389-S393 PolarHBondContact O-N 3.23Å; L389-S393 VanDerWaalsContact O-N 3.1Å; L389-S393 PolarHBondContact O-OG 2.85Å; N390-S393 PolarHBondContact O-N 3.27Å; S393-A395 PolarHBondContact O-N 3.24Å; S393-R396 PolarHBondContact O-N 3.07Å; S393-W397 PolarHBondContact O-N 3.42Å |
| 394 | F | 85.4 | Confident | 83.9 | Confident | 7 Ų | 7 | 23.5 Ų | 23.5 | 3% | 0.031 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -53.2 | -59.4 | 177.9 | 168.7 | -95.2 | 0 | 0 | 0 | 111.8 | R396 W397 L398 V439 L443 T450 F454 | F394-R396 VanDerWaalsContact C-N 3.3Å; F394-R396 PolarHBondContact O-N 3.28Å; F394-W397 PolarHBondContact O-N 3.08Å; F394-L398 HydrophobicContact CE1-CD2 4.1Å; F394-L398 HydrophobicContact CZ-CD2 4.11Å; F394-L398 VanDerWaalsContact O-CB 3.3Å; F394-L398 WeakPolarHBondContact O-CB 3.42Å; F394-L398 PolarHBondContact O-N 3.4Å; F394-V439 HydrophobicContact CD2-CG1 3.8Å; F394-V439 HydrophobicContact CE2-CG1 3.55Å; F394-L443 HydrophobicContact CD2-CG 4.32Å; F394-L443 HydrophobicContact CE2-CD1 4.23Å; F394-L443 HydrophobicContact CE2-CD2 4.44Å; F394-L443 HydrophobicContact CE2-CG 4.22Å; F394-T450 HydrophobicContact CB-CG2 3.65Å; F394-T450 HydrophobicContact CD1-CG2 4.3Å; F394-T450 HydrophobicContact CD2-CG2 3.38Å; F394-T450 HydrophobicContact CE2-CG2 4.1Å; F394-T450 HydrophobicContact CG-CG2 3.51Å; F394-F454 HydrophobicContact CE1-CB 3.93Å; F394-F454 AromaticContact CE1-CD2 3.92Å; F394-F454 HydrophobicContact CE1-CD2 3.92Å; F394-F454 HydrophobicContact CE1-CG 4.43Å; F394-F454 HydrophobicContact CZ-CB 4.13Å; F394-F454 AromaticContact CZ-CD2 3.67Å; F394-F454 HydrophobicContact CZ-CD2 3.67Å; F394-F454 HydrophobicContact CZ-CG 4.32Å |
| 395 | A | 87.6 | Confident | 85.1 | Confident | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -64.6 | -38.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | V129 I134 S393 F399 | V129-A395 HydrophobicContact CG1-CB 3.64Å; I134-A395 HydrophobicContact CD1-CB 3.92Å; I134-A395 HydrophobicContact CG1-CB 4.1Å; S393-A395 PolarHBondContact O-N 3.24Å; A395-F399 WeakPolarHBondContact O-CD2 3.42Å; A395-F399 PolarHBondContact O-N 2.99Å; A395-F399 VanDerWaalsContact O-N 3.13Å |
| 396 | R | 89.9 | Confident | 86.3 | Confident | 20 Ų | 20 | 18.6 Ų | 18.6 | 8% | 0.075 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60 | -54.1 | 176.8 | -179 | -173.9 | -64.5 | 163.8 | 0.3 | 111.6 | L392 S393 F394 L398 F399 I400 | L392-R396 VanDerWaalsContact CD1-NH1 3.3Å; L392-R396 VanDerWaalsContact O-CB 3.22Å; L392-R396 WeakPolarHBondContact O-CB 3.14Å; L392-R396 PolarHBondContact O-N 3.2Å; L392-R396 VanDerWaalsContact O-N 3.17Å; S393-R396 PolarHBondContact O-N 3.07Å; F394-R396 VanDerWaalsContact C-N 3.3Å; F394-R396 PolarHBondContact O-N 3.28Å; R396-L398 VanDerWaalsContact C-N 3.35Å; R396-F399 PolarHBondContact O-N 3.14Å; R396-I400 HydrophobicContact CG-CD1 3.73Å; R396-I400 WeakPolarHBondContact O-CB 3.48Å; R396-I400 VanDerWaalsContact O-CG1 3.28Å; R396-I400 WeakPolarHBondContact O-CG1 3.01Å; R396-I400 PolarHBondContact O-N 3.45Å |
| 397 | W | 91.6 | Very high | 87.5 | Confident | 7 Ų | 7 | 15.1 Ų | 15.1 | 3% | 0.027 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -67.2 | -36.5 | -177.6 | -70.9 | 117.4 | 0 | 0 | 0 | 112.2 | M243 S393 F394 F399 G401 F431 M438 V439 | M243-W397 HydrophobicContact CB-CH2 3.98Å; M243-W397 HydrophobicContact CB-CZ2 3.6Å; M243-W397 HydrophobicContact CE-CH2 3.45Å; M243-W397 VanDerWaalsContact CE-CH2 3.45Å; M243-W397 HydrophobicContact CE-CZ2 4.24Å; M243-W397 HydrophobicContact CE-CZ3 3.9Å; S393-W397 PolarHBondContact O-N 3.42Å; F394-W397 PolarHBondContact O-N 3.08Å; W397-F399 PolarHBondContact O-N 3.31Å; W397-G401 PolarHBondContact O-N 3.33Å; W397-F431 HydrophobicContact CZ3-CE2 4.32Å; W397-F431 HydrophobicContact CZ3-CZ 4.03Å; W397-M438 HydrophobicContact CB-CB 4.06Å; W397-M438 HydrophobicContact CD2-CB 4.06Å; W397-M438 HydrophobicContact CD2-CG 4.19Å; W397-M438 HydrophobicContact CG-CB 3.7Å; W397-M438 HydrophobicContact CG-CG 4.34Å; W397-V439 HydrophobicContact CB-CG2 3.89Å |
| 398 | L | 92.1 | Very high | 88.6 | Confident | 56 Ų | 56 | 14.3 Ų | 14.3 | 29% | 0.293 | 8% | 0.078 | S | C | . | . | H | α-helix | trans | -56.8 | -51 | 174.8 | 178.9 | 64.9 | 0 | 0 | 0 | 111.4 | F394 R396 G401 L402 V439 | F394-L398 HydrophobicContact CE1-CD2 4.1Å; F394-L398 HydrophobicContact CZ-CD2 4.11Å; F394-L398 VanDerWaalsContact O-CB 3.3Å; F394-L398 WeakPolarHBondContact O-CB 3.42Å; F394-L398 PolarHBondContact O-N 3.4Å; R396-L398 VanDerWaalsContact C-N 3.35Å; L398-G401 PolarHBondContact O-N 3.44Å; L398-L402 WeakPolarHBondContact O-CB 3.19Å; L398-L402 PolarHBondContact O-N 3.4Å; L398-V439 HydrophobicContact CB-CG2 3.97Å |
| 399 | F | 93.9 | Very high | 89.6 | Confident | 9 Ų | 9 | 18.7 Ų | 18.7 | 4% | 0.039 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -75.9 | -32.7 | -176.7 | -78.4 | -60.9 | 0 | 0 | 0 | 114.2 | I114 V125 R126 V129 A395 R396 W397 G401 L402 A403 T457 | I114-F399 HydrophobicContact CD1-CB 4.49Å; I114-F399 HydrophobicContact CD1-CD1 3.91Å; V125-F399 HydrophobicContact CG1-CZ 4Å; R126-F399 HydrophobicContact CB-CD1 3.96Å; R126-F399 HydrophobicContact CB-CE1 3.84Å; R126-F399 HydrophobicContact CB-CG 4.48Å; R126-F399 HydrophobicContact CB-CZ 4.29Å; R126-F399 HydrophobicContact CG-CD1 4.25Å; R126-F399 HydrophobicContact CG-CG 4.39Å; V129-F399 HydrophobicContact CB-CE2 4.09Å; V129-F399 HydrophobicContact CG1-CE2 4.3Å; V129-F399 HydrophobicContact CG2-CE2 4.25Å; A395-F399 WeakPolarHBondContact O-CD2 3.42Å; A395-F399 PolarHBondContact O-N 2.99Å; A395-F399 VanDerWaalsContact O-N 3.13Å; R396-F399 PolarHBondContact O-N 3.14Å; W397-F399 PolarHBondContact O-N 3.31Å; F399-G401 VanDerWaalsContact C-N 3.35Å; F399-L402 HydrophobicContact CD1-CD2 4.28Å; F399-L402 PolarHBondContact O-N 3.31Å; F399-A403 PolarHBondContact O-N 3Å; F399-T457 HydrophobicContact CE2-CG2 4.27Å; F399-T457 HydrophobicContact CZ-CG2 4.13Å |
| 400 | I | 94.3 | Very high | 90.6 | Very high | 3 Ų | 3 | 19.3 Ų | 19.3 | 2% | 0.015 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.4 | -44.9 | 171 | -70.7 | 173.9 | 0 | 0 | 0 | 109.6 | Y97 W249 F250 R396 L402 A403 V404 F431 | Y97-I400 HydrophobicContact CE2-CG2 4.22Å; W249-I400 HydrophobicContact CH2-CG2 4.41Å; F250-I400 HydrophobicContact CD1-CD1 4.16Å; F250-I400 HydrophobicContact CE1-CD1 3.76Å; F250-I400 HydrophobicContact CZ-CD1 4.5Å; R396-I400 HydrophobicContact CG-CD1 3.73Å; R396-I400 WeakPolarHBondContact O-CB 3.48Å; R396-I400 VanDerWaalsContact O-CG1 3.28Å; R396-I400 WeakPolarHBondContact O-CG1 3.01Å; R396-I400 PolarHBondContact O-N 3.45Å; I400-L402 VanDerWaalsContact C-N 3.33Å; I400-L402 PolarHBondContact O-N 3.02Å; I400-A403 PolarHBondContact O-N 3.05Å; I400-V404 WeakPolarHBondContact O-CG2 3.4Å; I400-V404 PolarHBondContact O-N 3.44Å; I400-F431 HydrophobicContact CG2-CE1 3.57Å; I400-F431 HydrophobicContact CG2-CZ 3.82Å |
| 401 | G | 95.5 | Very high | 91.6 | Very high | 6 Ų | 6 | 19.3 Ų | 19.3 | 6% | 0.062 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -58.9 | -43 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | W397 L398 F399 V404 A405 | W397-G401 PolarHBondContact O-N 3.33Å; L398-G401 PolarHBondContact O-N 3.44Å; F399-G401 VanDerWaalsContact C-N 3.35Å; G401-V404 PolarHBondContact O-N 2.96Å; G401-A405 VanDerWaalsContact O-CB 3.26Å; G401-A405 WeakPolarHBondContact O-CB 3.39Å; G401-A405 PolarHBondContact O-N 3.46Å |
| 402 | L | 95.5 | Very high | 92.5 | Very high | 54 Ų | 54 | 26.2 Ų | 26.2 | 28% | 0.283 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -62.7 | -43.6 | 175.9 | -173.4 | 65.5 | 0 | 0 | 0 | 112 | I114 F118 L398 F399 I400 V404 A405 G406 | I114-L402 HydrophobicContact CD1-CD2 4.2Å; I114-L402 HydrophobicContact CG1-CD2 4.27Å; I114-L402 HydrophobicContact CG1-CG 4.44Å; I114-L402 HydrophobicContact CG2-CD2 4.26Å; F118-L402 HydrophobicContact CD2-CD1 4.12Å; F118-L402 HydrophobicContact CD2-CD2 4.32Å; F118-L402 HydrophobicContact CD2-CG 4Å; F118-L402 HydrophobicContact CE1-CD1 4.18Å; F118-L402 HydrophobicContact CE2-CD1 3.56Å; F118-L402 HydrophobicContact CE2-CD2 4.41Å; F118-L402 HydrophobicContact CE2-CG 3.61Å; F118-L402 WeakPolarHBondContact CE2-O 3.13Å; F118-L402 HydrophobicContact CZ-CD1 3.59Å; F118-L402 HydrophobicContact CZ-CG 4.17Å; L398-L402 WeakPolarHBondContact O-CB 3.19Å; L398-L402 PolarHBondContact O-N 3.4Å; F399-L402 HydrophobicContact CD1-CD2 4.28Å; F399-L402 PolarHBondContact O-N 3.31Å; I400-L402 VanDerWaalsContact C-N 3.33Å; I400-L402 PolarHBondContact O-N 3.02Å; L402-V404 PolarHBondContact O-N 3.43Å; L402-A405 PolarHBondContact O-N 3.1Å; L402-G406 PolarHBondContact O-N 3.4Å |
| 403 | A | 95.9 | Very high | 93.2 | Very high | 2 Ų | 2 | 32.4 Ų | 32.4 | 2% | 0.017 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61.6 | -43.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y97 H110 I114 F399 I400 G406 L407 | Y97-A403 HydrophobicContact CE2-CB 4.49Å; H110-A403 HydrophobicContact CB-CB 4.16Å; I114-A403 HydrophobicContact CG1-CB 4.37Å; F399-A403 PolarHBondContact O-N 3Å; I400-A403 PolarHBondContact O-N 3.05Å; A403-G406 WeakPolarHBondContact O-CA 3.43Å; A403-G406 PolarHBondContact O-N 3.17Å; A403-L407 PolarHBondContact O-N 3.42Å; A403-L407 VanDerWaalsContact O-N 3.15Å |
| 404 | V | 96.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -73.3 | -36.8 | 178.6 | 179.1 | 0 | 0 | 0 | 0 | 112.2 | Y97 I400 G401 L402 G406 L407 I408 P428 F431 | Y97-V404 HydrophobicContact CD2-CG2 3.97Å; Y97-V404 HydrophobicContact CE2-CG2 3.66Å; I400-V404 WeakPolarHBondContact O-CG2 3.4Å; I400-V404 PolarHBondContact O-N 3.44Å; G401-V404 PolarHBondContact O-N 2.96Å; L402-V404 PolarHBondContact O-N 3.43Å; V404-G406 PolarHBondContact O-N 3.27Å; V404-L407 VanDerWaalsContact O-CB 3.27Å; V404-L407 WeakPolarHBondContact O-CB 3.15Å; V404-L407 PolarHBondContact O-N 2.87Å; V404-I408 PolarHBondContact O-N 2.89Å; V404-P428 HydrophobicContact CG1-CB 3.49Å; V404-P428 VanDerWaalsContact CG1-CB 3.49Å; V404-P428 WeakPolarHBondContact CG1-O 3.49Å; V404-F431 HydrophobicContact CB-CD1 4.26Å; V404-F431 HydrophobicContact CG1-CD1 4.16Å; V404-F431 HydrophobicContact CG2-CD1 3.8Å; V404-F431 HydrophobicContact CG2-CE1 3.89Å |
| 405 | A | 96.3 | Very high | 94 | Very high | 33 Ų | 33 | 38 Ų | 38 | 27% | 0.273 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -60.3 | -36.3 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111 | G401 L402 L407 I408 Y409 | G401-A405 VanDerWaalsContact O-CB 3.26Å; G401-A405 WeakPolarHBondContact O-CB 3.39Å; G401-A405 PolarHBondContact O-N 3.46Å; L402-A405 PolarHBondContact O-N 3.1Å; A405-L407 VanDerWaalsContact C-N 3.3Å; A405-L407 PolarHBondContact O-N 3.5Å; A405-I408 WeakPolarHBondContact O-CB 3.39Å; A405-I408 PolarHBondContact O-N 3.12Å; A405-Y409 PolarHBondContact O-N 3.25Å |
| 406 | G | 95.6 | Very high | 94.2 | Very high | 1 Ų | 1 | 45.5 Ų | 45.5 | 1% | 0.01 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.2 | -36.1 | 172 | 0 | 0 | 0 | 0 | 0 | 113.3 | L402 A403 V404 Y409 L410 | L402-G406 PolarHBondContact O-N 3.4Å; A403-G406 WeakPolarHBondContact O-CA 3.43Å; A403-G406 PolarHBondContact O-N 3.17Å; V404-G406 PolarHBondContact O-N 3.27Å; G406-Y409 PolarHBondContact O-N 2.94Å; G406-L410 WeakPolarHBondContact O-CG 3.32Å; G406-L410 PolarHBondContact O-N 2.94Å |
| 407 | L | 96.3 | Very high | 94.3 | Very high | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.005 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61.6 | -46.7 | 172.4 | -179.1 | 67.2 | 0 | 0 | 0 | 111.8 | E99 L100 A403 V404 A405 Y409 L410 R411 P428 | E99-L407 HydrophobicContact CB-CD1 4.42Å; E99-L407 HydrophobicContact CB-CD2 4.28Å; E99-L407 HydrophobicContact CG-CD1 3.74Å; E99-L407 HydrophobicContact CG-CD2 4.3Å; E99-L407 VanDerWaalsContact OE1-CD1 3.29Å; E99-L407 WeakPolarHBondContact OE1-CD1 3.49Å; L100-L407 HydrophobicContact CD1-CB 4.13Å; L100-L407 HydrophobicContact CD2-CB 3.86Å; L100-L407 HydrophobicContact CD2-CD1 3.53Å; L100-L407 HydrophobicContact CD2-CG 4.26Å; L100-L407 HydrophobicContact CG-CB 3.97Å; L100-L407 HydrophobicContact CG-CD1 3.73Å; L100-L407 HydrophobicContact CG-CD2 4.42Å; L100-L407 HydrophobicContact CG-CG 4.24Å; A403-L407 PolarHBondContact O-N 3.42Å; A403-L407 VanDerWaalsContact O-N 3.15Å; V404-L407 VanDerWaalsContact O-CB 3.27Å; V404-L407 WeakPolarHBondContact O-CB 3.15Å; V404-L407 PolarHBondContact O-N 2.87Å; A405-L407 VanDerWaalsContact C-N 3.3Å; A405-L407 PolarHBondContact O-N 3.5Å; L407-Y409 VanDerWaalsContact C-N 3.29Å; L407-Y409 PolarHBondContact O-N 3.44Å; L407-L410 PolarHBondContact O-N 3.4Å; L407-R411 WeakPolarHBondContact O-CG 3.43Å; L407-R411 PolarHBondContact O-N 3.03Å; L407-P428 HydrophobicContact CD2-CB 4.12Å; L407-P428 HydrophobicContact CD2-CG 4.34Å |
| 408 | I | 96.4 | Very high | 94.3 | Very high | 37 Ų | 37 | 53.2 Ų | 53.2 | 19% | 0.19 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.5 | -43.3 | 177 | -59.3 | 171.7 | 0 | 0 | 0 | 109.6 | V404 A405 L410 R411 Y412 P428 A429 | V404-I408 PolarHBondContact O-N 2.89Å; A405-I408 WeakPolarHBondContact O-CB 3.39Å; A405-I408 PolarHBondContact O-N 3.12Å; I408-L410 PolarHBondContact O-N 2.85Å; I408-R411 VanDerWaalsContact O-CB 3.31Å; I408-R411 WeakPolarHBondContact O-CB 3.4Å; I408-R411 PolarHBondContact O-N 3.38Å; I408-Y412 HydrophobicContact CG2-CD2 4.19Å; I408-Y412 HydrophobicContact CG2-CE2 3.67Å; I408-Y412 WeakPolarHBondContact O-CD2 3.49Å; I408-Y412 PolarHBondContact O-N 3.19Å; I408-P428 HydrophobicContact CD1-CB 4.21Å; I408-P428 HydrophobicContact CG1-CB 3.9Å; I408-P428 HydrophobicContact CG1-CG 4.08Å; I408-A429 HydrophobicContact CD1-CB 4.28Å |
| 409 | Y | 95.9 | Very high | 94.4 | Very high | 99 Ų | 99 | 52.2 Ų | 52.2 | 39% | 0.388 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.3 | -43.4 | 176.1 | 178.2 | -101.5 | 0 | 0 | 0 | 112.9 | V117 A405 G406 L407 R411 Y412 K413 | V117-Y409 HydrophobicContact CG1-CD1 3.62Å; V117-Y409 HydrophobicContact CG1-CE1 4.18Å; V117-Y409 HydrophobicContact CG1-CG 4.46Å; A405-Y409 PolarHBondContact O-N 3.25Å; G406-Y409 PolarHBondContact O-N 2.94Å; L407-Y409 VanDerWaalsContact C-N 3.29Å; L407-Y409 PolarHBondContact O-N 3.44Å; Y409-R411 PolarHBondContact O-N 2.94Å; Y409-Y412 PolarHBondContact O-N 2.96Å; Y409-Y412 VanDerWaalsContact O-N 3.11Å; Y409-K413 HydrophobicContact CD1-CD 4.39Å; Y409-K413 HydrophobicContact CE1-CB 4.25Å; Y409-K413 HydrophobicContact CE1-CD 3.41Å; Y409-K413 VanDerWaalsContact CE1-CD 3.41Å; Y409-K413 HydrophobicContact CE1-CG 4.5Å; Y409-K413 HydrophobicContact CE2-CD 4.34Å; Y409-K413 PolarHBondContact O-N 3Å; Y409-K413 WeakPolarHBondContact OH-CD 3.38Å; Y409-K413 PolarHBondContact OH-NZ 3.21Å |
| 410 | L | 94.8 | Very high | 94.3 | Very high | 15 Ų | 15 | 54.1 Ų | 54.1 | 8% | 0.079 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.4 | -31.9 | 175.7 | -75.9 | 174 | 0 | 0 | 0 | 112.3 | L100 I104 V117 G406 L407 I408 Y412 C414 M417 R419 | L100-L410 HydrophobicContact CD2-CD1 4.24Å; I104-L410 HydrophobicContact CD1-CD1 4.19Å; V117-L410 HydrophobicContact CG2-CD1 3.54Å; V117-L410 HydrophobicContact CG2-CD2 4Å; V117-L410 HydrophobicContact CG2-CG 3.63Å; G406-L410 WeakPolarHBondContact O-CG 3.32Å; G406-L410 PolarHBondContact O-N 2.94Å; L407-L410 PolarHBondContact O-N 3.4Å; I408-L410 PolarHBondContact O-N 2.85Å; L410-Y412 VanDerWaalsContact C-N 3.29Å; L410-Y412 PolarHBondContact O-N 3.47Å; L410-C414 CarbonylContact O-C 3.58Å; L410-C414 VanDerWaalsContact O-C 3.3Å; L410-C414 WeakPolarHBondContact O-CA 3.47Å; L410-C414 PolarHBondContact O-N 3.28Å; L410-C414 VanDerWaalsContact O-O 3.12Å; L410-M417 HydrophobicContact CD1-CE 4.36Å; L410-R419 PolarHBondContact O-NH2 3.49Å |
| 411 | R | 93.9 | Very high | 94.3 | Very high | 29 Ų | 29 | 56.4 Ų | 56.4 | 11% | 0.109 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.7 | -37.8 | 174.6 | -73.5 | -81.2 | -176.2 | -172.7 | 8.4 | 112.5 | E99 L407 I408 Y409 K422 L425 | E99-R411 IonicContact OE1-CZ 2.97Å; E99-R411 IonicContact OE1-NE 2.77Å; E99-R411 PolarHBondContact OE1-NE 3.2Å; E99-R411 IonicContact OE1-NH2 2.65Å; E99-R411 PolarHBondContact OE1-NH2 2.94Å; E99-R411 IonicContact OE2-CZ 3.76Å; E99-R411 IonicContact OE2-NE 3.92Å; E99-R411 IonicContact OE2-NH2 2.78Å; E99-R411 PolarHBondContact OE2-NH2 3.44Å; L407-R411 WeakPolarHBondContact O-CG 3.43Å; L407-R411 PolarHBondContact O-N 3.03Å; I408-R411 VanDerWaalsContact O-CB 3.31Å; I408-R411 WeakPolarHBondContact O-CB 3.4Å; I408-R411 PolarHBondContact O-N 3.38Å; Y409-R411 PolarHBondContact O-N 2.94Å; R411-K422 VanDerWaalsContact NH2-CB 3.33Å; R411-K422 VanDerWaalsContact NH2-CD 3.34Å; R411-L425 HydrophobicContact CB-CD2 4.04Å; R411-L425 HydrophobicContact CG-CD2 3.83Å |
| 412 | Y | 93.6 | Very high | 94.3 | Very high | 169 Ų | 169 | 63.1 Ų | 63.1 | 66% | 0.663 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -83.1 | -43.9 | 178.4 | -67.3 | -68.8 | 0 | 0 | 0 | 113.1 | I408 Y409 L410 | I408-Y412 HydrophobicContact CG2-CD2 4.19Å; I408-Y412 HydrophobicContact CG2-CE2 3.67Å; I408-Y412 WeakPolarHBondContact O-CD2 3.49Å; I408-Y412 PolarHBondContact O-N 3.19Å; Y409-Y412 PolarHBondContact O-N 2.96Å; Y409-Y412 VanDerWaalsContact O-N 3.11Å; L410-Y412 VanDerWaalsContact C-N 3.29Å; L410-Y412 PolarHBondContact O-N 3.47Å |
| 413 | K | 94.2 | Very high | 94.3 | Very high | 130 Ų | 130 | 60.9 Ų | 60.9 | 57% | 0.565 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -82.1 | -34.9 | -173.3 | -174.4 | 171.7 | -179.1 | -175.6 | 0 | 114.1 | Y409 P415 | Y409-K413 HydrophobicContact CD1-CD 4.39Å; Y409-K413 HydrophobicContact CE1-CB 4.25Å; Y409-K413 HydrophobicContact CE1-CD 3.41Å; Y409-K413 VanDerWaalsContact CE1-CD 3.41Å; Y409-K413 HydrophobicContact CE1-CG 4.5Å; Y409-K413 HydrophobicContact CE2-CD 4.34Å; Y409-K413 PolarHBondContact O-N 3Å; Y409-K413 WeakPolarHBondContact OH-CD 3.38Å; Y409-K413 PolarHBondContact OH-NZ 3.21Å; K413-P415 VanDerWaalsContact C-CD 3.47Å; K413-P415 WeakPolarHBondContact O-CD 3.31Å |
| 414 | C | 92.8 | Very high | 94.4 | Very high | 54 Ų | 54 | 64.2 Ų | 64.2 | 37% | 0.365 | 32% | 0.318 | S | S | . | . | trans | -126 | 69 | -177.8 | -61.1 | 0 | 0 | 0 | 0 | 109.6 | L410 D416 M417 R419 | L410-C414 CarbonylContact O-C 3.58Å; L410-C414 VanDerWaalsContact O-C 3.3Å; L410-C414 WeakPolarHBondContact O-CA 3.47Å; L410-C414 PolarHBondContact O-N 3.28Å; L410-C414 VanDerWaalsContact O-O 3.12Å; C414-D416 VanDerWaalsContact C-N 3.3Å; C414-D416 PolarHBondContact O-N 3.21Å; C414-M417 HydrophobicContact CB-CB 4.31Å; C414-M417 PolarHBondContact O-N 3.42Å; C414-R419 PolarHBondContact O-NH2 3.32Å | ||
| 415 | P | 90.8 | Very high | 94.3 | Very high | 73 Ų | 73 | 67.8 Ų | 67.8 | 47% | 0.474 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -37.9 | -176.9 | 25.2 | -33.3 | 0 | 0 | 0 | 111.9 | K413 M417 R419 | K413-P415 VanDerWaalsContact C-CD 3.47Å; K413-P415 WeakPolarHBondContact O-CD 3.31Å; P415-M417 VanDerWaalsContact C-N 3.28Å; P415-M417 PolarHBondContact O-N 2.85Å; P415-R419 PolarHBondContact O-NH1 3.3Å |
| 416 | D | 91.8 | Very high | 94.3 | Very high | 157 Ų | 157 | 72.1 Ų | 72.1 | 84% | 0.84 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | 1 | -174.6 | -53 | -44.3 | 0 | 0 | 0 | 114.5 | C414 H418 | C414-D416 VanDerWaalsContact C-N 3.3Å; C414-D416 PolarHBondContact O-N 3.21Å; D416-H418 PolarHBondContact O-N 3.36Å |
| 417 | M | 91.9 | Very high | 94.4 | Very high | 52 Ų | 52 | 72.8 Ų | 72.8 | 26% | 0.256 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -58.5 | 132.1 | 175 | -174.3 | 177.4 | 69.2 | 0 | 0 | 110 | L410 C414 P415 R419 | L410-M417 HydrophobicContact CD1-CE 4.36Å; C414-M417 HydrophobicContact CB-CB 4.31Å; C414-M417 PolarHBondContact O-N 3.42Å; P415-M417 VanDerWaalsContact C-N 3.28Å; P415-M417 PolarHBondContact O-N 2.85Å; M417-R419 HydrophobicContact CE-CG 4.09Å; M417-R419 WeakPolarHBondContact O-CG 3.18Å; M417-R419 PolarHBondContact O-N 3.18Å |
| 418 | H | 92.2 | Very high | 94.4 | Very high | 137 Ų | 137 | 72.8 Ų | 72.8 | 63% | 0.634 | 35% | 0.353 | S | S | * | . | trans | -63.9 | 119.6 | 177.4 | -175.7 | 70.6 | 0 | 0 | 0 | 110.6 | D416 | D416-H418 PolarHBondContact O-N 3.36Š| ||
| 419 | R | 93.4 | Very high | 94.4 | Very high | 35 Ų | 35 | 73.3 Ų | 73.3 | 13% | 0.132 | 36% | 0.362 | C | S | . | . | trans | -126.7 | 91.2 | -177.4 | -66.8 | 178.5 | -176 | 108 | 1.3 | 109.7 | E99 L410 C414 P415 M417 F421 | E99-R419 IonicContact OE1-NE 3.77Å; L410-R419 PolarHBondContact O-NH2 3.49Å; C414-R419 PolarHBondContact O-NH2 3.32Å; P415-R419 PolarHBondContact O-NH1 3.3Å; M417-R419 HydrophobicContact CE-CG 4.09Å; M417-R419 WeakPolarHBondContact O-CG 3.18Å; M417-R419 PolarHBondContact O-N 3.18Å; R419-F421 PolarHBondContact O-N 3.25Å | ||
| 420 | P | 92.8 | Very high | 94.4 | Very high | 49 Ų | 49 | 72 Ų | 72 | 32% | 0.318 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -59 | -35.5 | 179.4 | -23.1 | 31.9 | 0 | 0 | 0 | 112.9 | E263 | E263-P420 HydrophobicContact CB-CB 3.96Å; E263-P420 HydrophobicContact CB-CG 4.43Å; E263-P420 HydrophobicContact CG-CB 3.83Å; E263-P420 HydrophobicContact CG-CG 3.74Å |
| 421 | F | 94 | Very high | 94.5 | Very high | 52 Ų | 52 | 71.3 Ų | 71.3 | 23% | 0.228 | 36% | 0.358 | C | S | . | . | S | Bend | trans | -119.4 | 129.6 | 174.5 | -176.8 | -101.1 | 0 | 0 | 0 | 109.1 | L95 A98 E99 T102 P267 R419 V423 | L95-F421 HydrophobicContact CD2-CE1 4.29Å; L95-F421 HydrophobicContact CD2-CZ 3.89Å; A98-F421 HydrophobicContact CB-CD1 3.87Å; A98-F421 HydrophobicContact CB-CE1 3.77Å; E99-F421 HydrophobicContact CB-CD1 4.24Å; E99-F421 WeakPolarHBondContact CG-O 3.34Å; T102-F421 HydrophobicContact CG2-CB 4.17Å; P267-F421 HydrophobicContact CB-CD1 4.46Å; P267-F421 HydrophobicContact CB-CD2 3.76Å; P267-F421 HydrophobicContact CB-CE2 3.83Å; P267-F421 HydrophobicContact CB-CG 4.09Å; P267-F421 HydrophobicContact CB-CZ 4.21Å; P267-F421 HydrophobicContact CG-CB 3.96Å; P267-F421 HydrophobicContact CG-CD1 4.25Å; P267-F421 HydrophobicContact CG-CD2 3.8Å; P267-F421 HydrophobicContact CG-CE2 4.37Å; P267-F421 HydrophobicContact CG-CG 3.74Å; R419-F421 PolarHBondContact O-N 3.25Å; F421-V423 HydrophobicContact CD1-CG1 4.31Å; F421-V423 HydrophobicContact CE1-CG1 3.49Å; F421-V423 VanDerWaalsContact CE1-CG1 3.49Å; F421-V423 HydrophobicContact CZ-CG1 3.99Å |
| 422 | K | 95.1 | Very high | 94.6 | Very high | 147 Ų | 147 | 70.7 Ų | 70.7 | 64% | 0.639 | 36% | 0.358 | S | S | * | . | trans | -135.4 | 121 | -172.9 | 157 | 156.9 | -162.6 | -175.4 | 0 | 110 | E99 R411 | E99-K422 WeakPolarHBondContact OE2-CA 3.42Å; R411-K422 VanDerWaalsContact NH2-CB 3.33Å; R411-K422 VanDerWaalsContact NH2-CD 3.34Å | ||
| 423 | V | 96.1 | Very high | 94.6 | Very high | 7 Ų | 7 | 68.9 Ų | 68.9 | 4% | 0.042 | 35% | 0.354 | C | S | . | . | trans | -96.8 | 150.9 | 174.6 | -62.4 | 0 | 0 | 0 | 0 | 111.3 | L95 E99 F421 I427 | L95-V423 HydrophobicContact CB-CG1 3.91Å; E99-V423 HydrophobicContact CB-CG2 4.48Å; E99-V423 VanDerWaalsContact OE2-CG2 3.24Å; E99-V423 WeakPolarHBondContact OE2-CG2 3.26Å; E99-V423 PolarHBondContact OE2-N 2.97Å; F421-V423 HydrophobicContact CD1-CG1 4.31Å; F421-V423 HydrophobicContact CE1-CG1 3.49Å; F421-V423 VanDerWaalsContact CE1-CG1 3.49Å; F421-V423 HydrophobicContact CZ-CG1 3.99Å; V423-I427 HydrophobicContact CB-CD1 4.3Å | ||
| 424 | P | 96.8 | Very high | 94.6 | Very high | 71 Ų | 71 | 63.2 Ų | 63.2 | 46% | 0.461 | 33% | 0.33 | S | S | . | . | trans | -59.5 | 143.4 | 169 | -23.8 | 34.4 | 0 | 0 | 0 | 111.7 | F426 I427 P428 | P424-F426 HydrophobicContact CB-CD1 3.51Å; P424-F426 HydrophobicContact CB-CE1 3.45Å; P424-F426 VanDerWaalsContact CB-CE1 3.45Å; P424-F426 HydrophobicContact CG-CD1 4.44Å; P424-F426 HydrophobicContact CG-CE1 3.9Å; P424-F426 PolarHBondContact O-N 3.09Å; P424-F426 VanDerWaalsContact O-N 3.14Å; P424-I427 WeakPolarHBondContact O-CB 3.34Å; P424-I427 PolarHBondContact O-N 3.34Å; P424-I427 VanDerWaalsContact O-N 3.1Å; P424-P428 WeakPolarHBondContact O-CD 3.46Å | ||
| 425 | L | 95.4 | Very high | 94.7 | Very high | 75 Ų | 75 | 60.7 Ų | 60.7 | 39% | 0.393 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -24.2 | -175 | -78 | 171.9 | 0 | 0 | 0 | 114.8 | R411 I427 P428 A429 | R411-L425 HydrophobicContact CB-CD2 4.04Å; R411-L425 HydrophobicContact CG-CD2 3.83Å; L425-I427 PolarHBondContact O-N 2.91Å; L425-P428 VanDerWaalsContact O-CD 3.28Å; L425-P428 WeakPolarHBondContact O-CD 3.35Å; L425-P428 WeakPolarHBondContact O-CG 3.34Å; L425-A429 VanDerWaalsContact O-CB 3.28Å; L425-A429 WeakPolarHBondContact O-CB 3.49Å; L425-A429 PolarHBondContact O-N 2.9Å; L425-A429 VanDerWaalsContact O-N 3.15Å |
| 426 | F | 96.8 | Very high | 94.7 | Very high | 125 Ų | 125 | 62.1 Ų | 62.1 | 55% | 0.548 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.8 | -29.4 | 177.6 | 79.8 | -96.2 | 0 | 0 | 0 | 112.1 | F92 P424 L430 | F92-F426 HydrophobicContact CZ-CE2 4.43Å; P424-F426 HydrophobicContact CB-CD1 3.51Å; P424-F426 HydrophobicContact CB-CE1 3.45Å; P424-F426 VanDerWaalsContact CB-CE1 3.45Å; P424-F426 HydrophobicContact CG-CD1 4.44Å; P424-F426 HydrophobicContact CG-CE1 3.9Å; P424-F426 PolarHBondContact O-N 3.09Å; P424-F426 VanDerWaalsContact O-N 3.14Å; F426-L430 VanDerWaalsContact O-CB 3.23Å; F426-L430 WeakPolarHBondContact O-CB 3.46Å; F426-L430 PolarHBondContact O-N 3.17Å |
| 427 | I | 97.1 | Very high | 94.6 | Very high | 14 Ų | 14 | 58.5 Ų | 58.5 | 7% | 0.072 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.2 | -59.6 | 179.4 | -66 | -171.4 | 0 | 0 | 0 | 111.1 | F92 L95 V423 P424 L425 A429 F431 | F92-I427 HydrophobicContact CB-CG2 3.67Å; F92-I427 HydrophobicContact CD1-CD1 4.36Å; F92-I427 HydrophobicContact CD1-CG1 4.24Å; F92-I427 HydrophobicContact CD1-CG2 3.94Å; F92-I427 HydrophobicContact CE1-CD1 4.5Å; F92-I427 HydrophobicContact CE1-CG1 4.41Å; F92-I427 HydrophobicContact CG-CG2 3.95Å; F92-I427 WeakPolarHBondContact O-CG2 3.45Å; L95-I427 HydrophobicContact CB-CG2 4.35Å; L95-I427 HydrophobicContact CD1-CD1 4.19Å; V423-I427 HydrophobicContact CB-CD1 4.3Å; P424-I427 WeakPolarHBondContact O-CB 3.34Å; P424-I427 PolarHBondContact O-N 3.34Å; P424-I427 VanDerWaalsContact O-N 3.1Å; L425-I427 PolarHBondContact O-N 2.91Å; I427-A429 VanDerWaalsContact C-N 3.29Å; I427-A429 PolarHBondContact O-N 3.44Å; I427-F431 WeakPolarHBondContact O-CB 3.39Å; I427-F431 PolarHBondContact O-N 3.41Å; I427-F431 VanDerWaalsContact O-N 3.09Å |
| 428 | P | 96.9 | Very high | 94.5 | Very high | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.006 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.9 | -31.3 | 177.2 | 25.5 | -33.7 | 0 | 0 | 0 | 112.4 | S96 V404 L407 I408 P424 L425 S432 | S96-P428 WeakPolarHBondContact OG-CA 3.44Å; V404-P428 HydrophobicContact CG1-CB 3.49Å; V404-P428 VanDerWaalsContact CG1-CB 3.49Å; V404-P428 WeakPolarHBondContact CG1-O 3.49Å; L407-P428 HydrophobicContact CD2-CB 4.12Å; L407-P428 HydrophobicContact CD2-CG 4.34Å; I408-P428 HydrophobicContact CD1-CB 4.21Å; I408-P428 HydrophobicContact CG1-CB 3.9Å; I408-P428 HydrophobicContact CG1-CG 4.08Å; P424-P428 WeakPolarHBondContact O-CD 3.46Å; L425-P428 VanDerWaalsContact O-CD 3.28Å; L425-P428 WeakPolarHBondContact O-CD 3.35Å; L425-P428 WeakPolarHBondContact O-CG 3.34Å; P428-S432 WeakPolarHBondContact O-CB 3.24Å; P428-S432 PolarHBondContact O-N 3.47Å |
| 429 | A | 96.5 | Very high | 94.4 | Very high | 48 Ų | 48 | 50.3 Ų | 50.3 | 40% | 0.397 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64.6 | -49.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I408 L425 I427 F431 S432 F433 | I408-A429 HydrophobicContact CD1-CB 4.28Å; L425-A429 VanDerWaalsContact O-CB 3.28Å; L425-A429 WeakPolarHBondContact O-CB 3.49Å; L425-A429 PolarHBondContact O-N 2.9Å; L425-A429 VanDerWaalsContact O-N 3.15Å; I427-A429 VanDerWaalsContact C-N 3.29Å; I427-A429 PolarHBondContact O-N 3.44Å; A429-F431 VanDerWaalsContact C-N 3.35Å; A429-F431 PolarHBondContact O-N 2.9Å; A429-S432 PolarHBondContact O-N 3.37Å; A429-F433 PolarHBondContact O-N 2.9Å |
| 430 | L | 96.6 | Very high | 94.1 | Very high | 73 Ų | 73 | 51.3 Ų | 51.3 | 38% | 0.382 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -65.3 | -38.9 | 178.9 | -178.8 | 59.4 | 0 | 0 | 0 | 111.9 | L89 F92 F426 F433 T434 | L89-L430 HydrophobicContact CD2-CG 4.38Å; F92-L430 HydrophobicContact CD2-CD2 3.86Å; F92-L430 HydrophobicContact CD2-CG 4.4Å; F92-L430 HydrophobicContact CE2-CD2 3.55Å; F426-L430 VanDerWaalsContact O-CB 3.23Å; F426-L430 WeakPolarHBondContact O-CB 3.46Å; F426-L430 PolarHBondContact O-N 3.17Å; L430-F433 PolarHBondContact O-N 2.89Å; L430-T434 PolarHBondContact O-N 3.45Å; L430-T434 PolarHBondContact O-OG1 3.27Å |
| 431 | F | 96.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -70 | -37.9 | 176 | -176.5 | -103.5 | 0 | 0 | 0 | 112.6 | L89 F92 G93 M243 W249 W397 I400 V404 I427 A429 F433 T434 C435 | L89-F431 WeakPolarHBondContact O-CD2 3.28Å; F92-F431 HydrophobicContact CB-CB 4.09Å; G93-F431 VanDerWaalsContact CA-CD1 3.44Å; G93-F431 VanDerWaalsContact CA-CE1 3.48Å; G93-F431 VanDerWaalsContact CA-CG 3.46Å; M243-F431 HydrophobicContact CE-CE2 4.29Å; W249-F431 HydrophobicContact CH2-CE1 4.24Å; W249-F431 HydrophobicContact CH2-CZ 4.12Å; W249-F431 HydrophobicContact CZ2-CE1 4.21Å; W249-F431 HydrophobicContact CZ2-CE2 4.31Å; W249-F431 AromaticContact CZ2-CZ 3.63Å; W249-F431 HydrophobicContact CZ2-CZ 3.63Å; W397-F431 HydrophobicContact CZ3-CE2 4.32Å; W397-F431 HydrophobicContact CZ3-CZ 4.03Å; I400-F431 HydrophobicContact CG2-CE1 3.57Å; I400-F431 HydrophobicContact CG2-CZ 3.82Å; V404-F431 HydrophobicContact CB-CD1 4.26Å; V404-F431 HydrophobicContact CG1-CD1 4.16Å; V404-F431 HydrophobicContact CG2-CD1 3.8Å; V404-F431 HydrophobicContact CG2-CE1 3.89Å; I427-F431 WeakPolarHBondContact O-CB 3.39Å; I427-F431 PolarHBondContact O-N 3.41Å; I427-F431 VanDerWaalsContact O-N 3.09Å; A429-F431 VanDerWaalsContact C-N 3.35Å; A429-F431 PolarHBondContact O-N 2.9Å; F431-F433 VanDerWaalsContact C-N 3.35Å; F431-T434 WeakPolarHBondContact O-CB 3.28Å; F431-T434 PolarHBondContact O-N 2.87Å; F431-C435 WeakPolarHBondContact CE1-SG 3.4Å; F431-C435 PolarHBondContact O-N 3.03Å; F431-C435 PolarHBondContact O-SG 3.46Å |
| 432 | S | 95.6 | Very high | 93.1 | Very high | 15 Ų | 15 | 47.1 Ų | 47.1 | 11% | 0.105 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.6 | -42.7 | 173.7 | -172 | 0 | 0 | 0 | 0 | 111.1 | P428 A429 T434 C435 L436 | P428-S432 WeakPolarHBondContact O-CB 3.24Å; P428-S432 PolarHBondContact O-N 3.47Å; A429-S432 PolarHBondContact O-N 3.37Å; S432-T434 VanDerWaalsContact C-N 3.33Å; S432-T434 PolarHBondContact O-N 3.25Å; S432-C435 WeakPolarHBondContact O-CB 3.29Å; S432-C435 PolarHBondContact O-N 3.41Å; S432-L436 WeakPolarHBondContact O-CG 3.3Å; S432-L436 PolarHBondContact O-N 3.48Å |
| 433 | F | 94.4 | Very high | 92.6 | Very high | 131 Ų | 131 | 43.9 Ų | 43.9 | 58% | 0.575 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -57.8 | -44.6 | 170.8 | 175.3 | -97.8 | 0 | 0 | 0 | 112 | A429 L430 F431 C435 L436 F437 | A429-F433 PolarHBondContact O-N 2.9Å; L430-F433 PolarHBondContact O-N 2.89Å; F431-F433 VanDerWaalsContact C-N 3.35Å; F433-C435 VanDerWaalsContact C-N 3.32Å; F433-C435 PolarHBondContact O-N 3.31Å; F433-L436 PolarHBondContact O-N 3.46Å; F433-F437 WeakPolarHBondContact O-CB 3.37Å; F433-F437 PolarHBondContact O-N 3.44Å |
| 434 | T | 93.3 | Very high | 91.9 | Very high | 11 Ų | 11 | 51.6 Ų | 51.6 | 7% | 0.067 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.9 | -43.4 | 175.9 | -55.6 | 0 | 0 | 0 | 0 | 111.2 | L89 M243 L430 F431 S432 L436 F437 M438 | L89-T434 HydrophobicContact CB-CG2 4.49Å; L89-T434 HydrophobicContact CD1-CG2 3.86Å; M243-T434 HydrophobicContact CE-CG2 4.32Å; L430-T434 PolarHBondContact O-N 3.45Å; L430-T434 PolarHBondContact O-OG1 3.27Å; F431-T434 WeakPolarHBondContact O-CB 3.28Å; F431-T434 PolarHBondContact O-N 2.87Å; S432-T434 VanDerWaalsContact C-N 3.33Å; S432-T434 PolarHBondContact O-N 3.25Å; T434-L436 PolarHBondContact O-N 2.95Å; T434-F437 WeakPolarHBondContact O-CB 3.33Å; T434-F437 PolarHBondContact O-N 2.78Å; T434-M438 HydrophobicContact CG2-CG 4.49Å; T434-M438 WeakPolarHBondContact O-CB 3.21Å; T434-M438 VanDerWaalsContact O-CG 3.25Å; T434-M438 WeakPolarHBondContact O-CG 3.36Å; T434-M438 PolarHBondContact O-N 3.12Å |
| 435 | C | 93.9 | Very high | 91 | Very high | 1 Ų | 1 | 50.2 Ų | 50.2 | 1% | 0.007 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 177 | -65.3 | 0 | 0 | 0 | 0 | 112.1 | F431 S432 F433 M438 V439 | F431-C435 WeakPolarHBondContact CE1-SG 3.4Å; F431-C435 PolarHBondContact O-N 3.03Å; F431-C435 PolarHBondContact O-SG 3.46Å; S432-C435 WeakPolarHBondContact O-CB 3.29Å; S432-C435 PolarHBondContact O-N 3.41Å; F433-C435 VanDerWaalsContact C-N 3.32Å; F433-C435 PolarHBondContact O-N 3.31Å; C435-M438 WeakPolarHBondContact O-CB 3.04Å; C435-M438 PolarHBondContact O-N 2.76Å; C435-V439 VanDerWaalsContact O-CG2 3.32Å; C435-V439 WeakPolarHBondContact O-CG2 3.14Å; C435-V439 PolarHBondContact O-N 3.18Å |
| 436 | L | 91.9 | Very high | 90.2 | Very high | 104 Ų | 104 | 48.2 Ų | 48.2 | 55% | 0.545 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -64.5 | -41.1 | 176.5 | -68.6 | 175.2 | 0 | 0 | 0 | 111.9 | S432 F433 T434 M438 V439 A440 | S432-L436 WeakPolarHBondContact O-CG 3.3Å; S432-L436 PolarHBondContact O-N 3.48Å; F433-L436 PolarHBondContact O-N 3.46Å; T434-L436 PolarHBondContact O-N 2.95Å; L436-M438 VanDerWaalsContact C-N 3.34Å; L436-M438 PolarHBondContact O-N 3.17Å; L436-V439 PolarHBondContact O-N 2.9Å; L436-A440 PolarHBondContact O-N 3.39Å |
| 437 | F | 90.2 | Very high | 89.7 | Confident | 80 Ų | 80 | 46.3 Ų | 46.3 | 35% | 0.351 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -59.8 | -44.9 | 173.7 | 176 | -104.9 | 0 | 0 | 0 | 111.5 | P236 F433 T434 V439 A440 L441 | P236-F437 HydrophobicContact CB-CE1 4.25Å; P236-F437 HydrophobicContact CB-CZ 3.81Å; P236-F437 HydrophobicContact CG-CZ 3.86Å; F433-F437 WeakPolarHBondContact O-CB 3.37Å; F433-F437 PolarHBondContact O-N 3.44Å; T434-F437 WeakPolarHBondContact O-CB 3.33Å; T434-F437 PolarHBondContact O-N 2.78Å; F437-V439 VanDerWaalsContact C-N 3.34Å; F437-V439 PolarHBondContact O-N 3.02Å; F437-A440 PolarHBondContact O-N 3.24Å; F437-L441 WeakPolarHBondContact O-CB 3.49Å; F437-L441 PolarHBondContact O-N 3.4Å |
| 438 | M | 89.8 | Confident | 89.2 | Confident | 1 Ų | 1 | 53.2 Ų | 53.2 | 1% | 0.005 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.8 | -39.8 | 175.6 | -73.5 | -53.7 | -64.4 | 0 | 0 | 112.8 | F239 Y240 M243 W397 T434 C435 L436 L441 S442 | F239-M438 HydrophobicContact CB-SD 4.42Å; Y240-M438 VanDerWaalsContact CA-CE 3.45Å; Y240-M438 HydrophobicContact CD2-CE 3.66Å; Y240-M438 HydrophobicContact CG-CE 4.14Å; M243-M438 HydrophobicContact CB-CE 4.42Å; M243-M438 HydrophobicContact CG-SD 4.41Å; W397-M438 HydrophobicContact CB-CB 4.06Å; W397-M438 HydrophobicContact CD2-CB 4.06Å; W397-M438 HydrophobicContact CD2-CG 4.19Å; W397-M438 HydrophobicContact CG-CB 3.7Å; W397-M438 HydrophobicContact CG-CG 4.34Å; T434-M438 HydrophobicContact CG2-CG 4.49Å; T434-M438 WeakPolarHBondContact O-CB 3.21Å; T434-M438 VanDerWaalsContact O-CG 3.25Å; T434-M438 WeakPolarHBondContact O-CG 3.36Å; T434-M438 PolarHBondContact O-N 3.12Å; C435-M438 WeakPolarHBondContact O-CB 3.04Å; C435-M438 PolarHBondContact O-N 2.76Å; L436-M438 VanDerWaalsContact C-N 3.34Å; L436-M438 PolarHBondContact O-N 3.17Å; M438-L441 PolarHBondContact O-N 3.1Å; M438-S442 PolarHBondContact O-N 3.21Å; M438-S442 PolarHBondContact O-OG 3.36Å; M438-S442 VanDerWaalsContact O-OG 3.08Å |
| 439 | V | 89.8 | Confident | 88.5 | Confident | 16 Ų | 16 | 54 Ų | 54 | 10% | 0.097 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.9 | -48.1 | 175.5 | 167 | 0 | 0 | 0 | 0 | 111.2 | F394 W397 L398 C435 L436 F437 L441 S442 L443 | F394-V439 HydrophobicContact CD2-CG1 3.8Å; F394-V439 HydrophobicContact CE2-CG1 3.55Å; W397-V439 HydrophobicContact CB-CG2 3.89Å; L398-V439 HydrophobicContact CB-CG2 3.97Å; C435-V439 VanDerWaalsContact O-CG2 3.32Å; C435-V439 WeakPolarHBondContact O-CG2 3.14Å; C435-V439 PolarHBondContact O-N 3.18Å; L436-V439 PolarHBondContact O-N 2.9Å; F437-V439 VanDerWaalsContact C-N 3.34Å; F437-V439 PolarHBondContact O-N 3.02Å; V439-L441 VanDerWaalsContact C-N 3.26Å; V439-L441 PolarHBondContact O-N 3.46Å; V439-S442 PolarHBondContact O-N 2.65Å; V439-L443 PolarHBondContact O-N 2.98Å |
| 440 | A | 87.4 | Confident | 87.9 | Confident | 57 Ų | 57 | 51.7 Ų | 51.7 | 47% | 0.471 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61 | -38.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L436 F437 L443 Y444 | L436-A440 PolarHBondContact O-N 3.39Å; F437-A440 PolarHBondContact O-N 3.24Å; A440-L443 WeakPolarHBondContact O-CB 3.37Å; A440-L443 PolarHBondContact O-N 3.48Å; A440-Y444 PolarHBondContact O-N 3.25Å; A440-Y444 VanDerWaalsContact O-N 3.09Å |
| 441 | L | 82.9 | Confident | 87.4 | Confident | 9 Ų | 9 | 49.3 Ų | 49.3 | 5% | 0.047 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.5 | -46.8 | 175.4 | 175.9 | 61.5 | 0 | 0 | 0 | 112.4 | P236 F437 M438 V439 L443 Y444 S445 | P236-L441 HydrophobicContact CB-CB 4.44Å; P236-L441 HydrophobicContact CB-CD1 3.27Å; P236-L441 HydrophobicContact CB-CD2 3.49Å; P236-L441 VanDerWaalsContact CB-CD2 3.49Å; P236-L441 HydrophobicContact CB-CG 3.86Å; P236-L441 HydrophobicContact CG-CD1 4.31Å; P236-L441 WeakPolarHBondContact O-CD2 3.25Å; F437-L441 WeakPolarHBondContact O-CB 3.49Å; F437-L441 PolarHBondContact O-N 3.4Å; M438-L441 PolarHBondContact O-N 3.1Å; V439-L441 VanDerWaalsContact C-N 3.26Å; V439-L441 PolarHBondContact O-N 3.46Å; L441-L443 PolarHBondContact O-N 3.24Å; L441-Y444 HydrophobicContact CD1-CD1 4.37Å; L441-Y444 PolarHBondContact O-N 2.93Å; L441-S445 VanDerWaalsContact CD1-OG 3.29Å; L441-S445 WeakPolarHBondContact CD1-OG 3.12Å; L441-S445 WeakPolarHBondContact O-CB 3.15Å; L441-S445 PolarHBondContact O-N 2.86Å; L441-S445 PolarHBondContact O-OG 3.03Å; L441-S445 VanDerWaalsContact O-OG 3.12Å |
| 442 | S | 82.7 | Confident | 86.9 | Confident | 3 Ų | 3 | 52.5 Ų | 52.5 | 2% | 0.021 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -55.9 | -40.8 | 178.4 | -60.8 | 0 | 0 | 0 | 0 | 111.2 | M438 V439 Y444 D446 T450 | M438-S442 PolarHBondContact O-N 3.21Å; M438-S442 PolarHBondContact O-OG 3.36Å; M438-S442 VanDerWaalsContact O-OG 3.08Å; V439-S442 PolarHBondContact O-N 2.65Å; S442-Y444 PolarHBondContact O-N 3.15Å; S442-D446 PolarHBondContact O-N 3.32Å; S442-D446 VanDerWaalsContact O-N 3.15Å; S442-T450 PolarHBondContact O-OG1 2.97Å |
| 443 | L | 83.6 | Confident | 86.4 | Confident | 80 Ų | 80 | 51.8 Ų | 51.8 | 42% | 0.419 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.9 | -38.7 | 174.5 | -75.2 | 164.7 | 0 | 0 | 0 | 113.2 | F394 V439 A440 L441 P447 T450 | F394-L443 HydrophobicContact CD2-CG 4.32Å; F394-L443 HydrophobicContact CE2-CD1 4.23Å; F394-L443 HydrophobicContact CE2-CD2 4.44Å; F394-L443 HydrophobicContact CE2-CG 4.22Å; V439-L443 PolarHBondContact O-N 2.98Å; A440-L443 WeakPolarHBondContact O-CB 3.37Å; A440-L443 PolarHBondContact O-N 3.48Å; L441-L443 PolarHBondContact O-N 3.24Å; L443-P447 WeakPolarHBondContact O-CA 3.27Å; L443-P447 WeakPolarHBondContact O-CB 3.45Å; L443-P447 VanDerWaalsContact O-CG 3.26Å; L443-P447 WeakPolarHBondContact O-CG 3.26Å; L443-T450 HydrophobicContact CB-CG2 4.49Å; L443-T450 HydrophobicContact CD2-CG2 3.48Å; L443-T450 VanDerWaalsContact CD2-CG2 3.48Å; L443-T450 HydrophobicContact CG-CG2 3.78Å |
| 444 | Y | 82.3 | Confident | 86.1 | Confident | 169 Ų | 169 | 49.9 Ų | 49.9 | 66% | 0.663 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -73.2 | -42.2 | 178.2 | 174.8 | -100.2 | 0 | 0 | 0 | 112.6 | A440 L441 S442 | A440-Y444 PolarHBondContact O-N 3.25Å; A440-Y444 VanDerWaalsContact O-N 3.09Å; L441-Y444 HydrophobicContact CD1-CD1 4.37Å; L441-Y444 PolarHBondContact O-N 2.93Å; S442-Y444 PolarHBondContact O-N 3.15Å |
| 445 | S | 77.5 | Confident | 85.9 | Confident | 42 Ų | 42 | 54.4 Ų | 54.4 | 29% | 0.294 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -73.1 | -43.3 | -173.1 | -63.3 | 0 | 0 | 0 | 0 | 113.3 | L237 L441 | L237-S445 WeakPolarHBondContact CD2-OG 3.35Å; L441-S445 VanDerWaalsContact CD1-OG 3.29Å; L441-S445 WeakPolarHBondContact CD1-OG 3.12Å; L441-S445 WeakPolarHBondContact O-CB 3.15Å; L441-S445 PolarHBondContact O-N 2.86Å; L441-S445 PolarHBondContact O-OG 3.03Å; L441-S445 VanDerWaalsContact O-OG 3.12Å |
| 446 | D | 79.4 | Confident | 85.7 | Confident | 32 Ų | 32 | 56.4 Ų | 56.4 | 17% | 0.171 | 30% | 0.295 | C | S | . | . | trans | -143.4 | 82.7 | 177.1 | -174.7 | -7.9 | 0 | 0 | 0 | 109.4 | N390 S442 F448 S449 T450 | N390-D446 HydrophobicContact CB-CB 4.28Å; S442-D446 PolarHBondContact O-N 3.32Å; S442-D446 VanDerWaalsContact O-N 3.15Å; D446-F448 PolarHBondContact O-N 3.49Å; D446-F448 PolarHBondContact OD1-N 3.24Å; D446-S449 VanDerWaalsContact CG-CB 3.49Å; D446-S449 VanDerWaalsContact CG-OG 3.29Å; D446-S449 PolarHBondContact OD1-N 3.11Å; D446-S449 PolarHBondContact OD1-OG 2.67Å; D446-S449 WeakPolarHBondContact OD2-CB 3.16Å; D446-S449 PolarHBondContact OD2-OG 3.31Å; D446-T450 WeakPolarHBondContact O-CB 3.31Å; D446-T450 PolarHBondContact O-N 3.43Å; D446-T450 PolarHBondContact O-OG1 3.25Å | ||
| 447 | P | 85.9 | Confident | 85.7 | Confident | 85 Ų | 85 | 52 Ų | 52 | 55% | 0.552 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -61.2 | -30.3 | -178.3 | -18.3 | 26.6 | 0 | 0 | 0 | 112.8 | L443 G451 | L443-P447 WeakPolarHBondContact O-CA 3.27Å; L443-P447 WeakPolarHBondContact O-CB 3.45Å; L443-P447 VanDerWaalsContact O-CG 3.26Å; L443-P447 WeakPolarHBondContact O-CG 3.26Å; P447-G451 WeakPolarHBondContact O-CA 3.39Å; P447-G451 PolarHBondContact O-N 3.48Å |
| 448 | F | 86.1 | Confident | 85.8 | Confident | 159 Ų | 159 | 52.4 Ų | 52.4 | 70% | 0.697 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -73.9 | -57.2 | -176.1 | -177.2 | -100 | 0 | 0 | 0 | 110.9 | D446 T450 G451 I452 | D446-F448 PolarHBondContact O-N 3.49Å; D446-F448 PolarHBondContact OD1-N 3.24Å; F448-T450 VanDerWaalsContact C-N 3.29Å; F448-T450 PolarHBondContact O-N 2.98Å; F448-G451 PolarHBondContact O-N 3.1Å; F448-I452 HydrophobicContact CD1-CD1 3.92Å; F448-I452 HydrophobicContact CE1-CD1 3.48Å; F448-I452 VanDerWaalsContact CE1-CD1 3.48Å; F448-I452 HydrophobicContact CZ-CD1 3.83Å; F448-I452 WeakPolarHBondContact O-CG1 3.47Å; F448-I452 PolarHBondContact O-N 2.97Å |
| 449 | S | 82.3 | Confident | 86.1 | Confident | 18 Ų | 18 | 55 Ų | 55 | 13% | 0.126 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.1 | -40.9 | 178.4 | -56.2 | 0 | 0 | 0 | 0 | 110.9 | F391 D446 I452 G453 | F391-S449 WeakPolarHBondContact CD2-O 3.09Å; D446-S449 VanDerWaalsContact CG-CB 3.49Å; D446-S449 VanDerWaalsContact CG-OG 3.29Å; D446-S449 PolarHBondContact OD1-N 3.11Å; D446-S449 PolarHBondContact OD1-OG 2.67Å; D446-S449 WeakPolarHBondContact OD2-CB 3.16Å; D446-S449 PolarHBondContact OD2-OG 3.31Å; S449-I452 PolarHBondContact O-N 3Å; S449-G453 PolarHBondContact O-N 3.14Å |
| 450 | T | 83.2 | Confident | 86.3 | Confident | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.2 | -40.3 | 176.7 | -59.1 | 0 | 0 | 0 | 0 | 112 | F394 S442 L443 D446 F448 I452 G453 F454 | F394-T450 HydrophobicContact CB-CG2 3.65Å; F394-T450 HydrophobicContact CD1-CG2 4.3Å; F394-T450 HydrophobicContact CD2-CG2 3.38Å; F394-T450 HydrophobicContact CE2-CG2 4.1Å; F394-T450 HydrophobicContact CG-CG2 3.51Å; S442-T450 PolarHBondContact O-OG1 2.97Å; L443-T450 HydrophobicContact CB-CG2 4.49Å; L443-T450 HydrophobicContact CD2-CG2 3.48Å; L443-T450 VanDerWaalsContact CD2-CG2 3.48Å; L443-T450 HydrophobicContact CG-CG2 3.78Å; D446-T450 WeakPolarHBondContact O-CB 3.31Å; D446-T450 PolarHBondContact O-N 3.43Å; D446-T450 PolarHBondContact O-OG1 3.25Å; F448-T450 VanDerWaalsContact C-N 3.29Å; F448-T450 PolarHBondContact O-N 2.98Å; T450-I452 VanDerWaalsContact C-N 3.34Å; T450-I452 PolarHBondContact O-N 3.38Å; T450-G453 PolarHBondContact O-N 3.33Å; T450-G453 VanDerWaalsContact O-N 3.16Å; T450-F454 PolarHBondContact O-N 3.48Å |
| 451 | G | 86.3 | Confident | 86.6 | Confident | 23 Ų | 23 | 54 Ų | 54 | 24% | 0.237 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.6 | -43 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | P447 F448 G453 F454 I455 | P447-G451 WeakPolarHBondContact O-CA 3.39Å; P447-G451 PolarHBondContact O-N 3.48Å; F448-G451 PolarHBondContact O-N 3.1Å; G451-G453 PolarHBondContact O-N 3.35Å; G451-F454 PolarHBondContact O-N 3.33Å; G451-I455 VanDerWaalsContact O-CG1 3.31Å; G451-I455 WeakPolarHBondContact O-CG1 3.25Å; G451-I455 PolarHBondContact O-N 3.27Å |
| 452 | I | 85.7 | Confident | 87.3 | Confident | 66 Ų | 66 | 57.3 Ų | 57.3 | 34% | 0.338 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.4 | -45.3 | 173.6 | -62.7 | 168.3 | 0 | 0 | 0 | 110.4 | F391 F448 S449 T450 F454 I455 I456 | F391-I452 HydrophobicContact CE2-CB 4.27Å; F391-I452 HydrophobicContact CE2-CG2 3.9Å; F448-I452 HydrophobicContact CD1-CD1 3.92Å; F448-I452 HydrophobicContact CE1-CD1 3.48Å; F448-I452 VanDerWaalsContact CE1-CD1 3.48Å; F448-I452 HydrophobicContact CZ-CD1 3.83Å; F448-I452 WeakPolarHBondContact O-CG1 3.47Å; F448-I452 PolarHBondContact O-N 2.97Å; S449-I452 PolarHBondContact O-N 3Å; T450-I452 VanDerWaalsContact C-N 3.34Å; T450-I452 PolarHBondContact O-N 3.38Å; I452-F454 VanDerWaalsContact C-N 3.3Å; I452-F454 PolarHBondContact O-N 3.43Å; I452-I455 PolarHBondContact O-N 3.21Å; I452-I456 HydrophobicContact CG2-CD1 3.8Å; I452-I456 HydrophobicContact CG2-CG1 4.46Å; I452-I456 WeakPolarHBondContact O-CG1 3.45Å; I452-I456 PolarHBondContact O-N 3.4Å |
| 453 | G | 85 | Confident | 87.8 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -60.3 | -38.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | S449 T450 G451 T457 | S449-G453 PolarHBondContact O-N 3.14Å; T450-G453 PolarHBondContact O-N 3.33Å; T450-G453 VanDerWaalsContact O-N 3.16Å; G451-G453 PolarHBondContact O-N 3.35Å; G453-T457 WeakPolarHBondContact O-CB 3.4Å; G453-T457 PolarHBondContact O-N 2.85Å; G453-T457 PolarHBondContact O-OG1 3.47Å |
| 454 | F | 88.3 | Confident | 88.3 | Confident | 92 Ų | 92 | 55 Ų | 55 | 40% | 0.404 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -66.5 | -45.3 | 173.9 | -179.6 | -109.1 | 0 | 0 | 0 | 112.3 | F394 T450 G451 I452 I456 T457 L458 | F394-F454 HydrophobicContact CE1-CB 3.93Å; F394-F454 AromaticContact CE1-CD2 3.92Å; F394-F454 HydrophobicContact CE1-CD2 3.92Å; F394-F454 HydrophobicContact CE1-CG 4.43Å; F394-F454 HydrophobicContact CZ-CB 4.13Å; F394-F454 AromaticContact CZ-CD2 3.67Å; F394-F454 HydrophobicContact CZ-CD2 3.67Å; F394-F454 HydrophobicContact CZ-CG 4.32Å; T450-F454 PolarHBondContact O-N 3.48Å; G451-F454 PolarHBondContact O-N 3.33Å; I452-F454 VanDerWaalsContact C-N 3.3Å; I452-F454 PolarHBondContact O-N 3.43Å; F454-I456 VanDerWaalsContact C-N 3.35Å; F454-I456 PolarHBondContact O-N 2.93Å; F454-T457 CarbonylContact O-C 3.54Å; F454-T457 WeakPolarHBondContact O-CA 3.43Å; F454-T457 VanDerWaalsContact O-CB 3.28Å; F454-T457 WeakPolarHBondContact O-CB 3.3Å; F454-T457 PolarHBondContact O-N 3.39Å; F454-T457 VanDerWaalsContact O-N 3.1Å; F454-L458 HydrophobicContact CD1-CD1 4.01Å; F454-L458 HydrophobicContact CD1-CG 4.44Å; F454-L458 HydrophobicContact CE1-CD1 3.44Å; F454-L458 VanDerWaalsContact CE1-CD1 3.44Å; F454-L458 HydrophobicContact CE1-CG 4.06Å; F454-L458 HydrophobicContact CE2-CD2 4.46Å; F454-L458 HydrophobicContact CE2-CG 4.41Å; F454-L458 HydrophobicContact CZ-CD1 3.8Å; F454-L458 HydrophobicContact CZ-CD2 4.15Å; F454-L458 HydrophobicContact CZ-CG 4.05Å; F454-L458 PolarHBondContact O-N 3.16Å |
| 455 | I | 90.5 | Very high | 88.8 | Confident | 105 Ų | 105 | 52.9 Ų | 52.9 | 54% | 0.538 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.1 | -47 | 176.8 | -70.5 | 165.4 | 0 | 0 | 0 | 110.5 | G451 I452 T457 L458 T459 | G451-I455 VanDerWaalsContact O-CG1 3.31Å; G451-I455 WeakPolarHBondContact O-CG1 3.25Å; G451-I455 PolarHBondContact O-N 3.27Å; I452-I455 PolarHBondContact O-N 3.21Å; I455-T457 VanDerWaalsContact C-N 3.26Å; I455-T457 PolarHBondContact O-N 2.88Å; I455-L458 CarbonylContact O-C 3.6Å; I455-L458 WeakPolarHBondContact O-CA 3.35Å; I455-L458 WeakPolarHBondContact O-CB 3.45Å; I455-L458 PolarHBondContact O-N 2.63Å; I455-T459 WeakPolarHBondContact O-CG2 3.25Å; I455-T459 PolarHBondContact O-N 3.27Å |
| 456 | I | 88.6 | Confident | 89.4 | Confident | 44 Ų | 44 | 55 Ų | 55 | 23% | 0.226 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.3 | -35.5 | 177.8 | -62.9 | 164 | 0 | 0 | 0 | 110.5 | I133 F391 I452 F454 L458 T459 | I133-I456 HydrophobicContact CD1-CB 3.47Å; I133-I456 VanDerWaalsContact CD1-CB 3.47Å; I133-I456 HydrophobicContact CD1-CD1 3.81Å; I133-I456 HydrophobicContact CD1-CG1 4.24Å; I133-I456 HydrophobicContact CD1-CG2 3.24Å; I133-I456 HydrophobicContact CG1-CD1 4.3Å; I133-I456 HydrophobicContact CG1-CG2 3.93Å; F391-I456 HydrophobicContact CE2-CD1 4.1Å; F391-I456 HydrophobicContact CZ-CD1 3.72Å; I452-I456 HydrophobicContact CG2-CD1 3.8Å; I452-I456 HydrophobicContact CG2-CG1 4.46Å; I452-I456 WeakPolarHBondContact O-CG1 3.45Å; I452-I456 PolarHBondContact O-N 3.4Å; F454-I456 VanDerWaalsContact C-N 3.35Å; F454-I456 PolarHBondContact O-N 2.93Å; I456-L458 VanDerWaalsContact C-N 3.32Å; I456-L458 PolarHBondContact O-N 2.86Å; I456-T459 PolarHBondContact O-N 3.28Å; I456-T459 VanDerWaalsContact O-N 3.14Å; I456-T459 PolarHBondContact O-OG1 3.02Å |
| 457 | T | 91.8 | Very high | 89.8 | Confident | 10 Ų | 10 | 57.4 Ų | 57.4 | 6% | 0.061 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.8 | -44.8 | 171.2 | -58.8 | 0 | 0 | 0 | 0 | 111.5 | V125 V129 F399 G453 F454 I455 T459 G460 | V125-T457 HydrophobicContact CG1-CG2 3.88Å; V125-T457 VanDerWaalsContact CG1-O 3.29Å; V125-T457 WeakPolarHBondContact CG1-O 3.36Å; V129-T457 VanDerWaalsContact CG2-CA 3.48Å; V129-T457 HydrophobicContact CG2-CG2 3.96Å; F399-T457 HydrophobicContact CE2-CG2 4.27Å; F399-T457 HydrophobicContact CZ-CG2 4.13Å; G453-T457 WeakPolarHBondContact O-CB 3.4Å; G453-T457 PolarHBondContact O-N 2.85Å; G453-T457 PolarHBondContact O-OG1 3.47Å; F454-T457 CarbonylContact O-C 3.54Å; F454-T457 WeakPolarHBondContact O-CA 3.43Å; F454-T457 VanDerWaalsContact O-CB 3.28Å; F454-T457 WeakPolarHBondContact O-CB 3.3Å; F454-T457 PolarHBondContact O-N 3.39Å; F454-T457 VanDerWaalsContact O-N 3.1Å; I455-T457 VanDerWaalsContact C-N 3.26Å; I455-T457 PolarHBondContact O-N 2.88Å; T457-T459 VanDerWaalsContact C-N 3.3Å; T457-T459 PolarHBondContact O-N 3.43Å; T457-G460 PolarHBondContact O-N 3.44Å; T457-G460 VanDerWaalsContact O-N 3.14Å |
| 458 | L | 93 | Very high | 90 | Very high | 89 Ų | 89 | 55.7 Ų | 55.7 | 47% | 0.466 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.5 | -31.5 | 175.4 | -68.4 | 179.6 | 0 | 0 | 0 | 113 | F454 I455 I456 G460 V461 P462 | F454-L458 HydrophobicContact CD1-CD1 4.01Å; F454-L458 HydrophobicContact CD1-CG 4.44Å; F454-L458 HydrophobicContact CE1-CD1 3.44Å; F454-L458 VanDerWaalsContact CE1-CD1 3.44Å; F454-L458 HydrophobicContact CE1-CG 4.06Å; F454-L458 HydrophobicContact CE2-CD2 4.46Å; F454-L458 HydrophobicContact CE2-CG 4.41Å; F454-L458 HydrophobicContact CZ-CD1 3.8Å; F454-L458 HydrophobicContact CZ-CD2 4.15Å; F454-L458 HydrophobicContact CZ-CG 4.05Å; F454-L458 PolarHBondContact O-N 3.16Å; I455-L458 CarbonylContact O-C 3.6Å; I455-L458 WeakPolarHBondContact O-CA 3.35Å; I455-L458 WeakPolarHBondContact O-CB 3.45Å; I455-L458 PolarHBondContact O-N 2.63Å; I456-L458 VanDerWaalsContact C-N 3.32Å; I456-L458 PolarHBondContact O-N 2.86Å; L458-G460 PolarHBondContact O-N 2.68Å; L458-G460 VanDerWaalsContact O-N 3.14Å; L458-V461 WeakPolarHBondContact O-CB 3.38Å; L458-V461 PolarHBondContact O-N 2.96Å; L458-P462 WeakPolarHBondContact O-CD 3.5Å |
| 459 | T | 95.2 | Very high | 90.1 | Very high | 56 Ų | 56 | 51.8 Ų | 51.8 | 34% | 0.344 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.8 | -18.7 | 175.2 | 70.1 | 0 | 0 | 0 | 0 | 113.6 | W128 I455 I456 T457 V461 P462 A463 | W128-T459 PolarHBondContact NE1-OG1 3.13Å; I455-T459 WeakPolarHBondContact O-CG2 3.25Å; I455-T459 PolarHBondContact O-N 3.27Å; I456-T459 PolarHBondContact O-N 3.28Å; I456-T459 VanDerWaalsContact O-N 3.14Å; I456-T459 PolarHBondContact O-OG1 3.02Å; T457-T459 VanDerWaalsContact C-N 3.3Å; T457-T459 PolarHBondContact O-N 3.43Å; T459-V461 PolarHBondContact O-N 3.24Å; T459-P462 VanDerWaalsContact O-CD 3.25Å; T459-P462 WeakPolarHBondContact O-CD 3.36Å; T459-P462 WeakPolarHBondContact O-CG 3.39Å; T459-A463 VanDerWaalsContact O-CB 3.26Å; T459-A463 WeakPolarHBondContact O-CB 3.19Å; T459-A463 PolarHBondContact O-N 3.33Å; T459-A463 VanDerWaalsContact O-N 3.16Å |
| 460 | G | 94.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.3 | -27.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | F124 T457 L458 Y464 | F124-G460 WeakPolarHBondContact CD1-O 3.47Å; F124-G460 VanDerWaalsContact CE1-O 3.25Å; F124-G460 WeakPolarHBondContact CE1-O 3.13Å; T457-G460 PolarHBondContact O-N 3.44Å; T457-G460 VanDerWaalsContact O-N 3.14Å; L458-G460 PolarHBondContact O-N 2.68Å; L458-G460 VanDerWaalsContact O-N 3.14Å; G460-Y464 WeakPolarHBondContact O-CB 3.36Å; G460-Y464 PolarHBondContact O-N 3.26Å |
| 461 | V | 95.3 | Very high | 90.1 | Very high | 52 Ų | 52 | 63.6 Ų | 63.6 | 32% | 0.315 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -69.3 | -57.4 | 179 | -178.6 | 0 | 0 | 0 | 0 | 112 | L121 V125 L458 T459 A463 Y464 Y465 | L121-V461 HydrophobicContact CD1-CG1 4.34Å; V125-V461 HydrophobicContact CG2-CG2 4.02Å; L458-V461 WeakPolarHBondContact O-CB 3.38Å; L458-V461 PolarHBondContact O-N 2.96Å; T459-V461 PolarHBondContact O-N 3.24Å; V461-A463 VanDerWaalsContact C-N 3.25Å; V461-A463 PolarHBondContact O-N 2.83Å; V461-Y464 WeakPolarHBondContact O-CB 3.37Å; V461-Y464 PolarHBondContact O-N 3.33Å; V461-Y464 VanDerWaalsContact O-N 3.11Å; V461-Y465 HydrophobicContact CG1-CD2 4.15Å; V461-Y465 HydrophobicContact CG1-CE2 3.9Å; V461-Y465 VanDerWaalsContact O-CD2 3.28Å; V461-Y465 WeakPolarHBondContact O-CD2 3.38Å; V461-Y465 PolarHBondContact O-N 3.01Å |
| 462 | P | 95.6 | Very high | 89.9 | Confident | 79 Ų | 79 | 71.1 Ų | 71.1 | 51% | 0.513 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.3 | -34.8 | 175.9 | 24.9 | -33 | 0 | 0 | 0 | 111.8 | L458 T459 Y464 Y465 L466 | L458-P462 WeakPolarHBondContact O-CD 3.5Å; T459-P462 VanDerWaalsContact O-CD 3.25Å; T459-P462 WeakPolarHBondContact O-CD 3.36Å; T459-P462 WeakPolarHBondContact O-CG 3.39Å; P462-Y464 VanDerWaalsContact C-N 3.32Å; P462-Y464 PolarHBondContact O-N 3.42Å; P462-Y465 PolarHBondContact O-N 3.16Å; P462-L466 VanDerWaalsContact O-CB 3.31Å; P462-L466 WeakPolarHBondContact O-CB 3.44Å; P462-L466 PolarHBondContact O-N 3.34Å |
| 463 | A | 94.1 | Very high | 89.8 | Confident | 10 Ų | 10 | 71 Ų | 71 | 8% | 0.083 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.4 | -40.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F124 W128 T459 V461 L466 F467 | F124-A463 HydrophobicContact CE1-CB 3.93Å; F124-A463 HydrophobicContact CZ-CB 4.2Å; W128-A463 HydrophobicContact CD2-CB 4.1Å; W128-A463 HydrophobicContact CE3-CB 4.11Å; W128-A463 HydrophobicContact CH2-CB 3.78Å; W128-A463 HydrophobicContact CZ2-CB 3.74Å; W128-A463 HydrophobicContact CZ3-CB 3.96Å; T459-A463 VanDerWaalsContact O-CB 3.26Å; T459-A463 WeakPolarHBondContact O-CB 3.19Å; T459-A463 PolarHBondContact O-N 3.33Å; T459-A463 VanDerWaalsContact O-N 3.16Å; V461-A463 VanDerWaalsContact C-N 3.25Å; V461-A463 PolarHBondContact O-N 2.83Å; A463-L466 PolarHBondContact O-N 3.2Å; A463-F467 HydrophobicContact CB-CD2 4.07Å; A463-F467 HydrophobicContact CB-CE2 4.27Å; A463-F467 WeakPolarHBondContact O-CB 3.44Å; A463-F467 VanDerWaalsContact O-CD2 3.22Å; A463-F467 WeakPolarHBondContact O-CD2 3.36Å; A463-F467 PolarHBondContact O-N 2.93Å |
| 464 | Y | 93.8 | Very high | 90 | Very high | 25 Ų | 25 | 73 Ų | 73 | 10% | 0.098 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61.1 | -47.9 | 175.5 | 180 | -109.4 | 0 | 0 | 0 | 112.1 | P120 L121 F124 G460 V461 P462 L466 I468 I469 | P120-Y464 HydrophobicContact CB-CE2 4.36Å; P120-Y464 VanDerWaalsContact CB-OH 3.26Å; P120-Y464 WeakPolarHBondContact CB-OH 3.39Å; L121-Y464 HydrophobicContact CB-CD1 3.98Å; L121-Y464 HydrophobicContact CB-CE1 3.74Å; L121-Y464 HydrophobicContact CD1-CD1 3.33Å; L121-Y464 HydrophobicContact CD1-CE1 4.02Å; L121-Y464 HydrophobicContact CD1-CG 3.64Å; L121-Y464 HydrophobicContact CG-CD1 4.22Å; L121-Y464 HydrophobicContact CG-CE1 4.45Å; F124-Y464 HydrophobicContact CB-CD2 3.39Å; F124-Y464 HydrophobicContact CB-CE2 3.93Å; F124-Y464 HydrophobicContact CB-CG 4.25Å; F124-Y464 AromaticContact CD1-CD2 3.86Å; F124-Y464 HydrophobicContact CD1-CD2 3.86Å; F124-Y464 HydrophobicContact CD1-CG 4.14Å; F124-Y464 AromaticContact CD2-CD2 3.83Å; F124-Y464 HydrophobicContact CD2-CD2 3.83Å; F124-Y464 AromaticContact CG-CD2 3.42Å; F124-Y464 HydrophobicContact CG-CD2 3.42Å; F124-Y464 VanDerWaalsContact CG-CD2 3.42Å; F124-Y464 HydrophobicContact CG-CE2 4.32Å; F124-Y464 HydrophobicContact CG-CG 4.16Å; G460-Y464 WeakPolarHBondContact O-CB 3.36Å; G460-Y464 PolarHBondContact O-N 3.26Å; V461-Y464 WeakPolarHBondContact O-CB 3.37Å; V461-Y464 PolarHBondContact O-N 3.33Å; V461-Y464 VanDerWaalsContact O-N 3.11Å; P462-Y464 VanDerWaalsContact C-N 3.32Å; P462-Y464 PolarHBondContact O-N 3.42Å; Y464-L466 VanDerWaalsContact C-N 3.32Å; Y464-L466 PolarHBondContact O-N 3.25Å; Y464-I468 HydrophobicContact CD2-CB 3.8Å; Y464-I468 HydrophobicContact CD2-CG1 3.6Å; Y464-I468 HydrophobicContact CD2-CG2 4.29Å; Y464-I468 HydrophobicContact CE2-CB 3.72Å; Y464-I468 HydrophobicContact CE2-CG1 3.84Å; Y464-I468 HydrophobicContact CE2-CG2 3.69Å; Y464-I468 WeakPolarHBondContact O-CA 3.16Å; Y464-I468 VanDerWaalsContact O-CB 3.26Å; Y464-I468 WeakPolarHBondContact O-CB 2.98Å; Y464-I468 PolarHBondContact O-N 2.81Å; Y464-I469 HydrophobicContact CD1-CD1 3.78Å; Y464-I469 HydrophobicContact CD1-CG1 4.34Å; Y464-I469 HydrophobicContact CE1-CD1 3.32Å; Y464-I469 HydrophobicContact CE1-CG1 3.84Å; Y464-I469 PolarHBondContact O-N 3.46Å |
| 465 | Y | 93.3 | Very high | 90 | Very high | 123 Ų | 123 | 77 Ų | 77 | 48% | 0.482 | 38% | 0.377 | S | S | . | . | I | π-helix | trans | -64.3 | -38.5 | 178.9 | -76.5 | -78.5 | 0 | 0 | 0 | 112.2 | V461 P462 I469 W470 | V461-Y465 HydrophobicContact CG1-CD2 4.15Å; V461-Y465 HydrophobicContact CG1-CE2 3.9Å; V461-Y465 VanDerWaalsContact O-CD2 3.28Å; V461-Y465 WeakPolarHBondContact O-CD2 3.38Å; V461-Y465 PolarHBondContact O-N 3.01Å; P462-Y465 PolarHBondContact O-N 3.16Å; Y465-I469 HydrophobicContact CD1-CB 4.21Å; Y465-I469 HydrophobicContact CD1-CD1 3.37Å; Y465-I469 HydrophobicContact CD1-CG1 4.33Å; Y465-I469 HydrophobicContact CD1-CG2 4.3Å; Y465-I469 HydrophobicContact CE1-CD1 3.36Å; Y465-I469 HydrophobicContact CG-CD1 4.25Å; Y465-W470 PolarHBondContact O-N 3.37Å; Y465-W470 VanDerWaalsContact O-N 3.08Å |
| 466 | L | 90.9 | Very high | 90 | Very high | 86 Ų | 86 | 79.9 Ų | 79.9 | 45% | 0.45 | 38% | 0.382 | S | S | . | . | I | π-helix | trans | -74.1 | -42.6 | -178.9 | -174.7 | 139 | 0 | 0 | 0 | 113 | P462 A463 Y464 W470 | P462-L466 VanDerWaalsContact O-CB 3.31Å; P462-L466 WeakPolarHBondContact O-CB 3.44Å; P462-L466 PolarHBondContact O-N 3.34Å; A463-L466 PolarHBondContact O-N 3.2Å; Y464-L466 VanDerWaalsContact C-N 3.32Å; Y464-L466 PolarHBondContact O-N 3.25Å; L466-W470 HydrophobicContact CG-CE3 4.34Å; L466-W470 WeakPolarHBondContact O-CB 3.49Å |
| 467 | F | 87.9 | Confident | 90 | Very high | 84 Ų | 84 | 80.6 Ų | 80.6 | 37% | 0.368 | 38% | 0.383 | S | S | . | . | I | π-helix | trans | -91.7 | -31 | -174.9 | -68.1 | -60.7 | 0 | 0 | 0 | 113.8 | W128 A463 K473 | W128-F467 HydrophobicContact CH2-CE2 4.12Å; W128-F467 HydrophobicContact CZ3-CD2 4.4Å; W128-F467 HydrophobicContact CZ3-CE2 4.21Å; A463-F467 HydrophobicContact CB-CD2 4.07Å; A463-F467 HydrophobicContact CB-CE2 4.27Å; A463-F467 WeakPolarHBondContact O-CB 3.44Å; A463-F467 VanDerWaalsContact O-CD2 3.22Å; A463-F467 WeakPolarHBondContact O-CD2 3.36Å; A463-F467 PolarHBondContact O-N 2.93Å; F467-K473 WeakPolarHBondContact O-CE 3.33Å; F467-K473 PolarHBondContact O-NZ 3.01Å |
| 468 | I | 88.4 | Confident | 89.7 | Confident | 49 Ų | 49 | 85.1 Ų | 85.1 | 25% | 0.251 | 40% | 0.399 | S | S | . | . | I | π-helix | trans | -106.3 | -53.7 | -172.1 | -50.4 | -54.4 | 0 | 0 | 0 | 112 | F124 G349 Y464 | F124-I468 HydrophobicContact CD2-CD1 4.2Å; F124-I468 HydrophobicContact CD2-CG1 3.78Å; F124-I468 HydrophobicContact CE2-CD1 3.98Å; F124-I468 HydrophobicContact CE2-CG1 3.76Å; G349-I468 VanDerWaalsContact O-CD1 3.27Å; G349-I468 WeakPolarHBondContact O-CD1 3.12Å; Y464-I468 HydrophobicContact CD2-CB 3.8Å; Y464-I468 HydrophobicContact CD2-CG1 3.6Å; Y464-I468 HydrophobicContact CD2-CG2 4.29Å; Y464-I468 HydrophobicContact CE2-CB 3.72Å; Y464-I468 HydrophobicContact CE2-CG1 3.84Å; Y464-I468 HydrophobicContact CE2-CG2 3.69Å; Y464-I468 WeakPolarHBondContact O-CA 3.16Å; Y464-I468 VanDerWaalsContact O-CB 3.26Å; Y464-I468 WeakPolarHBondContact O-CB 2.98Å; Y464-I468 PolarHBondContact O-N 2.81Å |
| 469 | I | 89.8 | Confident | 89.5 | Confident | 77 Ų | 77 | 86.1 Ų | 86.1 | 40% | 0.395 | 40% | 0.404 | S | S | . | . | I | π-helix | trans | -78.3 | -26.7 | -174.1 | -69.3 | 172.7 | 0 | 0 | 0 | 112.7 | Y464 Y465 D471 | Y464-I469 HydrophobicContact CD1-CD1 3.78Å; Y464-I469 HydrophobicContact CD1-CG1 4.34Å; Y464-I469 HydrophobicContact CE1-CD1 3.32Å; Y464-I469 HydrophobicContact CE1-CG1 3.84Å; Y464-I469 PolarHBondContact O-N 3.46Å; Y465-I469 HydrophobicContact CD1-CB 4.21Å; Y465-I469 HydrophobicContact CD1-CD1 3.37Å; Y465-I469 HydrophobicContact CD1-CG1 4.33Å; Y465-I469 HydrophobicContact CD1-CG2 4.3Å; Y465-I469 HydrophobicContact CE1-CD1 3.36Å; Y465-I469 HydrophobicContact CG-CD1 4.25Å; I469-D471 PolarHBondContact O-N 3.4Å |
| 470 | W | 87.6 | Confident | 89.2 | Confident | 118 Ų | 118 | 87.2 Ų | 87.2 | 45% | 0.447 | 41% | 0.406 | S | S | . | . | trans | -69.9 | 96 | -175.3 | -171.1 | 21.4 | 0 | 0 | 0 | 112.1 | Y465 L466 K472 K473 P474 | Y465-W470 PolarHBondContact O-N 3.37Å; Y465-W470 VanDerWaalsContact O-N 3.08Å; L466-W470 HydrophobicContact CG-CE3 4.34Å; L466-W470 WeakPolarHBondContact O-CB 3.49Å; W470-K472 PolarHBondContact NE1-O 2.92Å; W470-K473 HydrophobicContact CD2-CG 4.4Å; W470-K473 HydrophobicContact CE3-CG 4.4Å; W470-K473 WeakPolarHBondContact O-CE 3.45Å; W470-K473 WeakPolarHBondContact O-CG 3.1Å; W470-P474 HydrophobicContact CH2-CG 4.11Å; W470-P474 HydrophobicContact CZ2-CG 4.37Å | ||
| 471 | D | 76.1 | Confident | 88.9 | Confident | 147 Ų | 147 | 89.7 Ų | 89.7 | 79% | 0.786 | 42% | 0.423 | S | S | * | . | trans | -71.1 | -34 | 179.9 | -67.7 | -39 | 0 | 0 | 0 | 113.1 | I469 K473 | I469-D471 PolarHBondContact O-N 3.4Å; D471-K473 VanDerWaalsContact C-N 3.26Å; D471-K473 PolarHBondContact O-N 3.09Å; D471-K473 VanDerWaalsContact O-N 3.12Å | ||
| 472 | K | 82.4 | Confident | 88.5 | Confident | 181 Ų | 181 | 93.3 Ų | 93.3 | 79% | 0.787 | 44% | 0.437 | S | S | * | . | trans | -89 | 46.8 | -175.7 | -65.2 | -174.6 | -179.4 | 177.6 | 0 | 112.6 | W470 | W470-K472 PolarHBondContact NE1-O 2.92Š| ||
| 473 | K | 85.2 | Confident | 88.3 | Confident | 64 Ų | 64 | 97.8 Ų | 97.8 | 28% | 0.278 | 44% | 0.443 | S | S | . | . | trans | -58.7 | 134.1 | 174.8 | -65.9 | 179.4 | -174.8 | 171.7 | 0 | 109.9 | F467 W470 D471 K475 F477 R478 | F467-K473 WeakPolarHBondContact O-CE 3.33Å; F467-K473 PolarHBondContact O-NZ 3.01Å; W470-K473 HydrophobicContact CD2-CG 4.4Å; W470-K473 HydrophobicContact CE3-CG 4.4Å; W470-K473 WeakPolarHBondContact O-CE 3.45Å; W470-K473 WeakPolarHBondContact O-CG 3.1Å; D471-K473 VanDerWaalsContact C-N 3.26Å; D471-K473 PolarHBondContact O-N 3.09Å; D471-K473 VanDerWaalsContact O-N 3.12Å; K473-K475 PolarHBondContact O-N 3.39Å; K473-F477 HydrophobicContact CB-CD1 4.41Å; K473-F477 HydrophobicContact CD-CD1 4.28Å; K473-F477 HydrophobicContact CD-CE1 4.26Å; K473-R478 HydrophobicContact CB-CG 4.05Å | ||
| 474 | P | 89.1 | Confident | 88.2 | Confident | 42 Ų | 42 | 101.5 Ų | 101.5 | 27% | 0.273 | 46% | 0.461 | S | S | . | . | trans | -53.1 | 140.4 | 177.7 | -26.6 | 34.1 | 0 | 0 | 0 | 111.9 | W470 W476 F477 R478 | W470-P474 HydrophobicContact CH2-CG 4.11Å; W470-P474 HydrophobicContact CZ2-CG 4.37Å; P474-W476 HydrophobicContact CB-CG 4.21Å; P474-W476 PolarHBondContact O-N 3.47Å; P474-F477 HydrophobicContact CB-CB 4.37Å; P474-F477 WeakPolarHBondContact O-CB 3.42Å; P474-F477 PolarHBondContact O-N 3.45Å; P474-R478 PolarHBondContact O-N 3.44Å; P474-R478 VanDerWaalsContact O-N 3.16Å | ||
| 475 | K | 87.6 | Confident | 87.9 | Confident | 175 Ų | 175 | 101.6 Ų | 101.6 | 76% | 0.761 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -55.3 | -40.9 | -179 | -69.8 | -175.7 | 179.8 | 179.8 | 0 | 112.1 | K473 F477 R478 I479 | K473-K475 PolarHBondContact O-N 3.39Å; K475-F477 VanDerWaalsContact C-N 3.29Å; K475-F477 PolarHBondContact O-N 3.29Å; K475-R478 PolarHBondContact O-N 2.68Å; K475-I479 WeakPolarHBondContact O-CD1 3.48Å; K475-I479 VanDerWaalsContact O-CG1 3.26Å; K475-I479 WeakPolarHBondContact O-CG1 3.29Å; K475-I479 PolarHBondContact O-N 2.94Å |
| 476 | W | 90.8 | Very high | 87.8 | Confident | 166 Ų | 166 | 102.8 Ų | 102.8 | 63% | 0.629 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -60 | -39.2 | 177.9 | 71.2 | -99.3 | 0 | 0 | 0 | 112.2 | P474 M480 | P474-W476 HydrophobicContact CB-CG 4.21Å; P474-W476 PolarHBondContact O-N 3.47Å; W476-M480 HydrophobicContact CZ3-CE 3.92Å; W476-M480 HydrophobicContact CZ3-SD 4.13Å; W476-M480 VanDerWaalsContact O-CB 3.25Å; W476-M480 WeakPolarHBondContact O-CB 3.49Å; W476-M480 PolarHBondContact O-N 2.68Å |
| 477 | F | 88.1 | Confident | 87.8 | Confident | 60 Ų | 60 | 101.7 Ų | 101.7 | 26% | 0.263 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -69.1 | -42 | 179.6 | -179 | -94.8 | 0 | 0 | 0 | 111.3 | K473 P474 K475 M480 S481 | K473-F477 HydrophobicContact CB-CD1 4.41Å; K473-F477 HydrophobicContact CD-CD1 4.28Å; K473-F477 HydrophobicContact CD-CE1 4.26Å; P474-F477 HydrophobicContact CB-CB 4.37Å; P474-F477 WeakPolarHBondContact O-CB 3.42Å; P474-F477 PolarHBondContact O-N 3.45Å; K475-F477 VanDerWaalsContact C-N 3.29Å; K475-F477 PolarHBondContact O-N 3.29Å; F477-M480 HydrophobicContact CD2-CE 3.73Å; F477-M480 HydrophobicContact CE2-CE 3.97Å; F477-M480 PolarHBondContact O-N 3.32Å; F477-S481 WeakPolarHBondContact O-CB 3.48Å; F477-S481 PolarHBondContact O-N 3.49Å |
| 478 | R | 85 | Confident | 88 | Confident | 105 Ų | 105 | 100.8 Ų | 100.8 | 40% | 0.396 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.3 | -48.5 | 174.9 | -72.3 | 174.4 | 63.2 | 179.6 | -5.7 | 111.5 | Y15 K473 P474 K475 M480 S481 E482 | Y15-R478 PolarHBondContact OH-NE 3.08Å; Y15-R478 PolarHBondContact OH-NH2 3.32Å; K473-R478 HydrophobicContact CB-CG 4.05Å; P474-R478 PolarHBondContact O-N 3.44Å; P474-R478 VanDerWaalsContact O-N 3.16Å; K475-R478 PolarHBondContact O-N 2.68Å; R478-M480 VanDerWaalsContact C-N 3.32Å; R478-M480 PolarHBondContact O-N 3.14Å; R478-S481 PolarHBondContact O-N 3.4Å; R478-E482 WeakPolarHBondContact O-CB 3.39Å; R478-E482 PolarHBondContact O-N 3.43Å |
| 479 | I | 89 | Confident | 88.1 | Confident | 110 Ų | 110 | 101 Ų | 101 | 56% | 0.564 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -60.8 | -42.8 | 177.8 | -66.3 | 164.9 | 0 | 0 | 0 | 110.9 | K475 R483 | K475-I479 WeakPolarHBondContact O-CD1 3.48Å; K475-I479 VanDerWaalsContact O-CG1 3.26Å; K475-I479 WeakPolarHBondContact O-CG1 3.29Å; K475-I479 PolarHBondContact O-N 2.94Å; I479-R483 VanDerWaalsContact O-CB 3.28Å; I479-R483 WeakPolarHBondContact O-CB 3.34Å; I479-R483 PolarHBondContact O-N 2.92Å |
| 480 | M | 89.8 | Confident | 88.1 | Confident | 79 Ų | 79 | 103.4 Ų | 103.4 | 39% | 0.389 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.8 | -48.6 | 177 | -177.8 | -175 | 71.1 | 0 | 0 | 111.5 | W476 F477 R478 E482 R483 I484 | W476-M480 HydrophobicContact CZ3-CE 3.92Å; W476-M480 HydrophobicContact CZ3-SD 4.13Å; W476-M480 VanDerWaalsContact O-CB 3.25Å; W476-M480 WeakPolarHBondContact O-CB 3.49Å; W476-M480 PolarHBondContact O-N 2.68Å; F477-M480 HydrophobicContact CD2-CE 3.73Å; F477-M480 HydrophobicContact CE2-CE 3.97Å; F477-M480 PolarHBondContact O-N 3.32Å; R478-M480 VanDerWaalsContact C-N 3.32Å; R478-M480 PolarHBondContact O-N 3.14Å; M480-E482 VanDerWaalsContact C-N 3.33Å; M480-E482 PolarHBondContact O-N 3.42Å; M480-R483 PolarHBondContact O-N 2.96Å; M480-I484 HydrophobicContact CG-CD1 3.83Å; M480-I484 HydrophobicContact CG-CG1 4.48Å; M480-I484 WeakPolarHBondContact O-CB 3.34Å; M480-I484 VanDerWaalsContact O-CG1 3.28Å; M480-I484 WeakPolarHBondContact O-CG1 3.45Å; M480-I484 PolarHBondContact O-N 3.35Å |
| 481 | S | 87.4 | Confident | 88.3 | Confident | 52 Ų | 52 | 103.6 Ų | 103.6 | 36% | 0.364 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 178.4 | -173.8 | 0 | 0 | 0 | 0 | 111.8 | F477 R478 I484 T485 | F477-S481 WeakPolarHBondContact O-CB 3.48Å; F477-S481 PolarHBondContact O-N 3.49Å; R478-S481 PolarHBondContact O-N 3.4Å; S481-I484 PolarHBondContact O-N 3.25Å; S481-T485 WeakPolarHBondContact O-CB 3.36Å; S481-T485 PolarHBondContact O-N 3.42Å; S481-T485 PolarHBondContact O-OG1 3.29Å |
| 482 | E | 87.8 | Confident | 89 | Confident | 128 Ų | 128 | 97.9 Ų | 97.9 | 60% | 0.598 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -66.4 | -42.3 | 177.4 | -169.8 | 177.9 | 177.5 | 0 | 0 | 111.3 | R478 M480 T485 R486 | R478-E482 WeakPolarHBondContact O-CB 3.39Å; R478-E482 PolarHBondContact O-N 3.43Å; M480-E482 VanDerWaalsContact C-N 3.33Å; M480-E482 PolarHBondContact O-N 3.42Å; E482-T485 PolarHBondContact O-N 3.02Å; E482-R486 VanDerWaalsContact O-CB 3.32Å; E482-R486 WeakPolarHBondContact O-CB 3.48Å; E482-R486 PolarHBondContact O-N 3Å |
| 483 | R | 91.3 | Very high | 89.4 | Confident | 172 Ų | 172 | 92.6 Ų | 92.6 | 65% | 0.649 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -62.2 | -45.5 | 175.1 | -170.8 | 176.3 | -175.9 | 174.1 | 1.6 | 111.7 | I479 M480 R486 T487 | I479-R483 VanDerWaalsContact O-CB 3.28Å; I479-R483 WeakPolarHBondContact O-CB 3.34Å; I479-R483 PolarHBondContact O-N 2.92Å; M480-R483 PolarHBondContact O-N 2.96Å; R483-R486 PolarHBondContact O-N 3.03Å; R483-T487 WeakPolarHBondContact O-CB 3.42Å; R483-T487 PolarHBondContact O-N 2.91Å; R483-T487 PolarHBondContact O-OG1 2.99Å; R483-T487 VanDerWaalsContact O-OG1 3.05Å |
| 484 | I | 90.4 | Very high | 89.6 | Confident | 88 Ų | 88 | 89.9 Ų | 89.9 | 45% | 0.451 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -60.6 | -48.8 | 175.9 | -70.3 | 167.5 | 0 | 0 | 0 | 110 | M480 S481 R486 T487 L488 | M480-I484 HydrophobicContact CG-CD1 3.83Å; M480-I484 HydrophobicContact CG-CG1 4.48Å; M480-I484 WeakPolarHBondContact O-CB 3.34Å; M480-I484 VanDerWaalsContact O-CG1 3.28Å; M480-I484 WeakPolarHBondContact O-CG1 3.45Å; M480-I484 PolarHBondContact O-N 3.35Å; S481-I484 PolarHBondContact O-N 3.25Å; I484-R486 PolarHBondContact O-N 3.45Å; I484-T487 PolarHBondContact O-N 2.9Å; I484-L488 HydrophobicContact CG2-CD1 3.84Å; I484-L488 HydrophobicContact CG2-CG 4.35Å; I484-L488 WeakPolarHBondContact O-CB 3.45Å; I484-L488 WeakPolarHBondContact O-CG 3.26Å; I484-L488 PolarHBondContact O-N 3.19Å |
| 485 | T | 89.3 | Confident | 89.5 | Confident | 27 Ų | 27 | 90.5 Ų | 90.5 | 17% | 0.166 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -59.5 | -46.9 | -179.9 | -57.3 | 0 | 0 | 0 | 0 | 110.9 | I354 M357 S481 E482 T487 L488 Q489 | I354-T485 HydrophobicContact CB-CG2 4.3Å; I354-T485 HydrophobicContact CD1-CG2 4.4Å; M357-T485 HydrophobicContact CE-CG2 4.07Å; S481-T485 WeakPolarHBondContact O-CB 3.36Å; S481-T485 PolarHBondContact O-N 3.42Å; S481-T485 PolarHBondContact O-OG1 3.29Å; E482-T485 PolarHBondContact O-N 3.02Å; T485-T487 PolarHBondContact O-N 3.13Å; T485-L488 PolarHBondContact O-N 3.48Å; T485-Q489 WeakPolarHBondContact O-CB 3.14Å; T485-Q489 VanDerWaalsContact O-CG 3.31Å; T485-Q489 WeakPolarHBondContact O-CG 3.49Å; T485-Q489 PolarHBondContact O-N 3.27Å |
| 486 | R | 89.4 | Confident | 89.2 | Confident | 148 Ų | 148 | 85.2 Ų | 85.2 | 56% | 0.558 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -63.5 | -42.1 | 177.3 | -169.9 | -179.9 | 71.8 | -171.3 | 4.3 | 112.5 | E482 R483 I484 Q489 I490 | E482-R486 VanDerWaalsContact O-CB 3.32Å; E482-R486 WeakPolarHBondContact O-CB 3.48Å; E482-R486 PolarHBondContact O-N 3Å; R483-R486 PolarHBondContact O-N 3.03Å; I484-R486 PolarHBondContact O-N 3.45Å; R486-Q489 WeakPolarHBondContact O-CB 3.49Å; R486-Q489 PolarHBondContact O-N 3.03Å; R486-I490 HydrophobicContact CG-CD1 4.18Å; R486-I490 VanDerWaalsContact O-CG1 3.29Å; R486-I490 WeakPolarHBondContact O-CG1 3.47Å; R486-I490 PolarHBondContact O-N 3.42Å |
| 487 | T | 92.1 | Very high | 88.1 | Confident | 64 Ų | 64 | 79.5 Ų | 79.5 | 39% | 0.393 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.7 | -44.3 | 175.8 | -67 | 0 | 0 | 0 | 0 | 110.9 | R483 I484 T485 I490 I491 | R483-T487 WeakPolarHBondContact O-CB 3.42Å; R483-T487 PolarHBondContact O-N 2.91Å; R483-T487 PolarHBondContact O-OG1 2.99Å; R483-T487 VanDerWaalsContact O-OG1 3.05Å; I484-T487 PolarHBondContact O-N 2.9Å; T485-T487 PolarHBondContact O-N 3.13Å; T487-I490 PolarHBondContact O-N 2.92Å; T487-I491 HydrophobicContact CG2-CD1 3.64Å; T487-I491 HydrophobicContact CG2-CG1 4.38Å; T487-I491 WeakPolarHBondContact O-CB 3.08Å; T487-I491 VanDerWaalsContact O-CG1 3.25Å; T487-I491 WeakPolarHBondContact O-CG1 3.49Å; T487-I491 PolarHBondContact O-N 2.98Å |
| 488 | L | 91.1 | Very high | 86.9 | Confident | 65 Ų | 65 | 80.6 Ų | 80.6 | 34% | 0.34 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65.1 | -39.2 | 176 | -70.5 | 174.4 | 0 | 0 | 0 | 112.3 | I354 I484 T485 I490 I491 L492 | I354-L488 HydrophobicContact CD1-CB 3.99Å; I354-L488 HydrophobicContact CG1-CB 4.15Å; I354-L488 HydrophobicContact CG1-CD1 4.29Å; I484-L488 HydrophobicContact CG2-CD1 3.84Å; I484-L488 HydrophobicContact CG2-CG 4.35Å; I484-L488 WeakPolarHBondContact O-CB 3.45Å; I484-L488 WeakPolarHBondContact O-CG 3.26Å; I484-L488 PolarHBondContact O-N 3.19Å; T485-L488 PolarHBondContact O-N 3.48Å; L488-I490 VanDerWaalsContact C-N 3.34Å; L488-I490 PolarHBondContact O-N 3.36Å; L488-I491 PolarHBondContact O-N 3.14Å; L488-L492 HydrophobicContact CB-CD1 4.5Å; L488-L492 WeakPolarHBondContact O-CB 3.42Å; L488-L492 VanDerWaalsContact O-CG 3.25Å; L488-L492 WeakPolarHBondContact O-CG 3.49Å; L488-L492 PolarHBondContact O-N 2.9Å |
| 489 | Q | 90.3 | Very high | 85.1 | Confident | 53 Ų | 53 | 82.6 Ų | 82.6 | 25% | 0.248 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -56.9 | -47.5 | 174.1 | -80.5 | 173.6 | -28.7 | 0 | 0 | 112 | I354 M357 T485 R486 E493 V494 | I354-Q489 HydrophobicContact CD1-CG 3.91Å; M357-Q489 HydrophobicContact CE-CG 4.25Å; M357-Q489 HydrophobicContact SD-CG 3.45Å; M357-Q489 WeakPolarHBondContact SD-CG 3.32Å; M357-Q489 PolarHBondContact SD-NE2 3.18Å; T485-Q489 WeakPolarHBondContact O-CB 3.14Å; T485-Q489 VanDerWaalsContact O-CG 3.31Å; T485-Q489 WeakPolarHBondContact O-CG 3.49Å; T485-Q489 PolarHBondContact O-N 3.27Å; R486-Q489 WeakPolarHBondContact O-CB 3.49Å; R486-Q489 PolarHBondContact O-N 3.03Å; Q489-E493 WeakPolarHBondContact O-CA 3.42Å; Q489-E493 PolarHBondContact O-N 2.82Å; Q489-V494 HydrophobicContact CB-CG2 4.49Å; Q489-V494 HydrophobicContact CG-CG2 4.24Å; Q489-V494 PolarHBondContact O-N 2.95Å |
| 490 | I | 90.7 | Very high | 82.7 | Confident | 127 Ų | 127 | 84.8 Ų | 84.8 | 65% | 0.651 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -67.1 | -46.8 | -180 | -65.2 | 165.1 | 0 | 0 | 0 | 110.7 | R486 T487 L488 L492 | R486-I490 HydrophobicContact CG-CD1 4.18Å; R486-I490 VanDerWaalsContact O-CG1 3.29Å; R486-I490 WeakPolarHBondContact O-CG1 3.47Å; R486-I490 PolarHBondContact O-N 3.42Å; T487-I490 PolarHBondContact O-N 2.92Å; L488-I490 VanDerWaalsContact C-N 3.34Å; L488-I490 PolarHBondContact O-N 3.36Å; I490-L492 PolarHBondContact O-N 3.3Å |
| 491 | I | 92.2 | Very high | 79.7 | Confident | 122 Ų | 122 | 92.2 Ų | 92.2 | 63% | 0.626 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -63.8 | -41.4 | -178.7 | -69.8 | 171.2 | 0 | 0 | 0 | 111.4 | T487 L488 | T487-I491 HydrophobicContact CG2-CD1 3.64Å; T487-I491 HydrophobicContact CG2-CG1 4.38Å; T487-I491 WeakPolarHBondContact O-CB 3.08Å; T487-I491 VanDerWaalsContact O-CG1 3.25Å; T487-I491 WeakPolarHBondContact O-CG1 3.49Å; T487-I491 PolarHBondContact O-N 2.98Å; L488-I491 PolarHBondContact O-N 3.14Å |
| 492 | L | 89.6 | Confident | 79.4 | Confident | 28 Ų | 28 | 94.3 Ų | 94.3 | 15% | 0.147 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -91.5 | -5.5 | -173.7 | -59.2 | 177.1 | 0 | 0 | 0 | 113.3 | H359 L366 P367 I370 L488 I490 V494 | H359-L492 PolarHBondContact CD2-O 3.07Å; L366-L492 HydrophobicContact CD2-CB 4.2Å; L366-L492 HydrophobicContact CD2-CD2 4Å; P367-L492 HydrophobicContact CB-CD1 4.28Å; P367-L492 HydrophobicContact CG-CD1 3.95Å; I370-L492 HydrophobicContact CD1-CD1 4.19Å; I370-L492 HydrophobicContact CD1-CD2 3.52Å; L488-L492 HydrophobicContact CB-CD1 4.5Å; L488-L492 WeakPolarHBondContact O-CB 3.42Å; L488-L492 VanDerWaalsContact O-CG 3.25Å; L488-L492 WeakPolarHBondContact O-CG 3.49Å; L488-L492 PolarHBondContact O-N 2.9Å; I490-L492 PolarHBondContact O-N 3.3Å; L492-V494 VanDerWaalsContact C-N 3.3Å; L492-V494 HydrophobicContact CB-CG1 3.76Å; L492-V494 HydrophobicContact CB-CG2 4.14Å; L492-V494 WeakPolarHBondContact O-CG1 3.5Å; L492-V494 PolarHBondContact O-N 3.21Å |
| 493 | E | 91.2 | Very high | 78.9 | Confident | 70 Ų | 70 | 92.5 Ų | 92.5 | 33% | 0.327 | 46% | 0.455 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.9 | 49.5 | -174.2 | -160.5 | -174.5 | -163.9 | 0 | 0 | 111.3 | H359 V360 R361 Q489 | H359-E493 WeakPolarHBondContact CA-O 3.46Å; H359-E493 IonicContact CE1-OE2 3.39Å; H359-E493 PolarHBondContact CE1-OE2 3.47Å; H359-E493 VanDerWaalsContact CE1-OE2 3.31Å; V360-E493 HydrophobicContact CB-CG 4.32Å; V360-E493 HydrophobicContact CG2-CG 4.36Å; V360-E493 WeakPolarHBondContact CG2-O 3.36Å; V360-E493 PolarHBondContact N-O 3.44Å; R361-E493 IonicContact CZ-OE1 3.8Å; R361-E493 IonicContact CZ-OE2 3.74Å; R361-E493 IonicContact NE-OE1 3.05Å; R361-E493 PolarHBondContact NE-OE1 2.7Å; R361-E493 IonicContact NE-OE2 2.68Å; R361-E493 PolarHBondContact NE-OE2 3.36Å; R361-E493 IonicContact NH2-OE1 3.97Å; R361-E493 PolarHBondContact NH2-OE1 2.81Å; R361-E493 IonicContact NH2-OE2 3.83Å; Q489-E493 WeakPolarHBondContact O-CA 3.42Å; Q489-E493 PolarHBondContact O-N 2.82Å |
| 494 | V | 89.4 | Confident | 78.2 | Confident | 7 Ų | 7 | 88.1 Ų | 88.1 | 4% | 0.042 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 146.1 | -177.5 | -60.7 | 0 | 0 | 0 | 0 | 112.3 | I354 M357 I358 H359 L366 P367 Q489 L492 | I354-V494 HydrophobicContact CD1-CG2 3.86Å; M357-V494 HydrophobicContact CB-CB 3.84Å; M357-V494 HydrophobicContact CB-CG2 3.81Å; M357-V494 HydrophobicContact SD-CG2 4.14Å; I358-V494 CarbonylContact O-C 3.58Å; I358-V494 VanDerWaalsContact O-CA 3.27Å; I358-V494 WeakPolarHBondContact O-CA 3.49Å; H359-V494 HydrophobicContact CB-CG1 4.24Å; L366-V494 HydrophobicContact CB-CG1 4.49Å; P367-V494 HydrophobicContact CG-CB 4.47Å; P367-V494 HydrophobicContact CG-CG1 3.95Å; P367-V494 HydrophobicContact CG-CG2 4.15Å; Q489-V494 HydrophobicContact CB-CG2 4.49Å; Q489-V494 HydrophobicContact CG-CG2 4.24Å; Q489-V494 PolarHBondContact O-N 2.95Å; L492-V494 VanDerWaalsContact C-N 3.3Å; L492-V494 HydrophobicContact CB-CG1 3.76Å; L492-V494 HydrophobicContact CB-CG2 4.14Å; L492-V494 WeakPolarHBondContact O-CG1 3.5Å; L492-V494 PolarHBondContact O-N 3.21Å |
| 495 | V | 86.6 | Confident | 77.5 | Confident | 55 Ų | 55 | 88.1 Ų | 88.1 | 33% | 0.333 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126 | 149.1 | 179.7 | -68.9 | 0 | 0 | 0 | 0 | 111.1 | M357 I358 V360 | M357-V495 CarbonylContact C-O 3.6Å; M357-V495 VanDerWaalsContact CA-O 3.31Å; M357-V495 WeakPolarHBondContact CA-O 3.5Å; M357-V495 WeakPolarHBondContact CB-O 3.46Å; I358-V495 PolarHBondContact N-O 3.38Å; I358-V495 PolarHBondContact O-N 3.2Å; V360-V495 HydrophobicContact CG2-CB 4.37Å; V360-V495 HydrophobicContact CG2-CG1 3.61Å; V360-V495 HydrophobicContact CG2-CG2 3.92Å |
| 496 | P | 81.4 | Confident | 76.8 | Confident | 64 Ų | 64 | 91.9 Ų | 91.9 | 42% | 0.416 | 46% | 0.461 | S | S | . | . | P | Polyproline II helix | trans | -63.5 | 156.4 | 170.4 | 28 | -33.5 | 0 | 0 | 0 | 111.2 | ||
| 497 | E | 68.8 | Low | 75.9 | Confident | 46 Ų | 46 | 88.1 Ų | 88.1 | 22% | 0.215 | 46% | 0.455 | C | S | . | . | P | Polyproline II helix | trans | -65.9 | 140.4 | 174 | -168.1 | -178.8 | -161.8 | 0 | 0 | 109.6 | Y343 D499 | Y343-E497 WeakPolarHBondContact OH-CG 3.43Å; Y343-E497 PolarHBondContact OH-OE1 3.04Å; Y343-E497 PolarHBondContact OH-OE2 3.02Å; E497-D499 PolarHBondContact O-N 3.06Å |
| 498 | E | 62.1 | Low | 74.8 | Confident | 82 Ų | 82 | 89.9 Ų | 89.9 | 38% | 0.383 | 46% | 0.459 | S | S | . | . | P | Polyproline II helix | trans | -69.9 | 120.1 | 170.4 | -75.1 | -178 | 162.7 | 0 | 0 | 109.3 | K500 | E498-K500 PolarHBondContact O-N 3.09Š|
| 499 | D | 46.5 | Very low | 73.5 | Confident | 148 Ų | 148 | 91.8 Ų | 91.8 | 79% | 0.791 | 47% | 0.468 | S | S | * | . | P | Polyproline II helix | trans | -52.5 | 138.1 | 179.6 | -82.2 | -35.2 | 0 | 0 | 0 | 111.7 | E497 L501 | E497-D499 PolarHBondContact O-N 3.06Å; D499-L501 VanDerWaalsContact C-N 3.26Å; D499-L501 PolarHBondContact O-N 2.91Å |
| 500 | K | 38.8 | Very low | 72.1 | Confident | 155 Ų | 155 | 95 Ų | 95 | 67% | 0.674 | 49% | 0.487 | S | S | * | . | trans | -67.1 | 88.9 | 165 | -70.4 | 177.9 | -177.7 | 170.9 | 0 | 107.9 | E498 | E498-K500 PolarHBondContact O-N 3.09Š| ||
| 501 | L | 28.5 | Very low | 70.5 | Confident | 236 Ų | 236 | 92.1 Ų | 92.1 | 100% | 1.236 | 47% | 0.472 | S | S | * | . | trans | -59.3 | 0 | 166.8 | -84.4 | 163.5 | 0 | 0 | 0 | 111.3 | D499 | D499-L501 VanDerWaalsContact C-N 3.26Å; D499-L501 PolarHBondContact O-N 2.91Å |
Retrieved 501 of 501 residues in 1465.4 ms
(Link to these results)