| 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 | S | 28.2 | Very low | 27.7 | Very low | 173 Ų | 173 | 135.1 Ų | 135.1 | 100% | 1.21 | 83% | 0.83 | S | S | * | * | 0 | 149 | 0 | -65.1 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 2 | P | 45 | Very low | 27.5 | Very low | 108 Ų | 108 | 129.2 Ų | 129.2 | 70% | 0.701 | 82% | 0.816 | S | S | * | * | cis | -127.3 | 169.3 | -12 | 30.6 | -8.4 | 0 | 0 | 0 | 109.4 | ||||
| 3 | K | 26.8 | Very low | 27.5 | Very low | 179 Ų | 179 | 127.7 Ų | 127.7 | 78% | 0.778 | 81% | 0.812 | S | S | * | * | -168.8 | 122.9 | 60 | -84.5 | -177.8 | 176 | 175.6 | 0 | 107.4 | |||||
| 4 | T | 27.6 | Very low | 27.5 | Very low | 113 Ų | 113 | 128.3 Ų | 128.3 | 69% | 0.693 | 81% | 0.806 | S | S | * | * | 60 | 127.4 | 92.7 | 25.5 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 5 | N | 26 | Very low | 27.6 | Very low | 127 Ų | 127 | 130.9 Ų | 130.9 | 68% | 0.679 | 80% | 0.801 | S | S | * | * | -171.3 | 134.1 | 53.6 | -104.3 | -11 | 0 | 0 | 0 | 109.2 | |||||
| 6 | I | 26.6 | Very low | 27.7 | Very low | 140 Ų | 140 | 131.4 Ų | 131.4 | 72% | 0.718 | 80% | 0.796 | S | S | * | * | 92.6 | 120.3 | 93.4 | -66.9 | 176.2 | 0 | 0 | 0 | 114.3 | |||||
| 7 | M | 25.7 | Very low | 27.7 | Very low | 177 Ų | 177 | 132.6 Ų | 132.6 | 87% | 0.872 | 80% | 0.797 | S | S | * | * | trans | -8 | 141.8 | 150.6 | -61.9 | 171.4 | -179 | 0 | 0 | 118.7 | ||||
| 8 | A | 25.4 | Very low | 27.6 | Very low | 103 Ų | 103 | 129.2 Ų | 129.2 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | 176 | 140.3 | 102.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 9 | G | 23.6 | Very low | 27.8 | Very low | 85 Ų | 85 | 129.1 Ų | 129.1 | 88% | 0.876 | 80% | 0.799 | S | S | * | * | trans | 107 | 126.9 | 141.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 10 | G | 25 | Very low | 27.8 | Very low | 77 Ų | 77 | 127.2 Ų | 127.2 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | 122.9 | 89.8 | 141.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 11 | E | 25.1 | Very low | 27.8 | Very low | 204 Ų | 204 | 126 Ų | 126 | 95% | 0.953 | 79% | 0.793 | S | S | * | * | trans | -0.7 | 149.7 | 141.2 | -64.7 | 173.8 | 150.4 | 0 | 0 | 121.2 | ||||
| 12 | G | 25.4 | Very low | 27.9 | Very low | 64 Ų | 64 | 127.6 Ų | 127.6 | 66% | 0.66 | 78% | 0.781 | S | S | * | * | trans | 103.1 | 96.5 | 147.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 13 | S | 26.9 | Very low | 27.1 | Very low | 110 Ų | 110 | 127.3 Ų | 127.3 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | 58.4 | 102.4 | 103 | 67.5 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 14 | D | 28.2 | Very low | 27.3 | Very low | 136 Ų | 136 | 124.1 Ų | 124.1 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | 164.2 | 133.6 | 107.6 | -100.4 | -31.7 | 0 | 0 | 0 | 112.5 | |||||
| 15 | K | 28.4 | Very low | 27.3 | Very low | 167 Ų | 167 | 123.4 Ų | 123.4 | 73% | 0.726 | 78% | 0.781 | S | S | * | * | trans | 50.8 | 120.7 | 137.9 | -69 | -179.1 | -179.2 | 171.7 | 0 | 122.2 | ||||
| 16 | L | 29.3 | Very low | 27.5 | Very low | 139 Ų | 139 | 126 Ų | 126 | 73% | 0.728 | 79% | 0.789 | S | S | * | * | 69.1 | 127.8 | 124.3 | -77.1 | 147.7 | 0 | 0 | 0 | 120.5 | |||||
| 17 | D | 27.3 | Very low | 27.6 | Very low | 153 Ų | 153 | 126.8 Ų | 126.8 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | 73.8 | 119.7 | 150.3 | -63.5 | -18.5 | 0 | 0 | 0 | 119.8 | ||||
| 18 | G | 26.7 | Very low | 27.8 | Very low | 71 Ų | 71 | 125.6 Ų | 125.6 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | 139.2 | 99 | 144.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 19 | S | 30.7 | Very low | 28.1 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | 79.1 | 105.3 | 150.5 | 110.6 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 20 | A | 27.9 | Very low | 28.6 | Very low | 91 Ų | 91 | 128.7 Ų | 128.7 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | trans | -131.8 | 99.8 | 151.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 21 | S | 28.2 | Very low | 28.9 | Very low | 103 Ų | 103 | 132.9 Ų | 132.9 | 72% | 0.72 | 77% | 0.767 | S | S | * | * | trans | 28.6 | 105.2 | 141.6 | 44.5 | 0 | 0 | 0 | 0 | 117.4 | S23 | S21-S23 PolarHBondContact O-N 2.97Š| ||
| 22 | Q | 30.7 | Very low | 29.4 | Very low | 205 Ų | 205 | 132 Ų | 132 | 96% | 0.958 | 76% | 0.763 | S | S | * | * | trans | -52.8 | 102.6 | 152.6 | -78.7 | 174.7 | -20.4 | 0 | 0 | 109.3 | ||||
| 23 | S | 27.8 | Very low | 29.8 | Very low | 102 Ų | 102 | 135 Ų | 135 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | trans | -102.6 | 106.1 | 155.3 | 53.8 | 0 | 0 | 0 | 0 | 106.7 | S21 S25 | S21-S23 PolarHBondContact O-N 2.97Å; S23-S25 PolarHBondContact O-N 2.88Å | ||
| 24 | S | 31.3 | Very low | 30.1 | Very low | 112 Ų | 112 | 139.1 Ų | 139.1 | 78% | 0.783 | 77% | 0.769 | S | S | * | * | trans | -58.6 | 93.9 | 173.1 | 50.3 | 0 | 0 | 0 | 0 | 110 | H26 | S24-H26 PolarHBondContact O-N 3.1Š| ||
| 25 | S | 27.2 | Very low | 30.9 | Very low | 98 Ų | 98 | 141.3 Ų | 141.3 | 69% | 0.685 | 77% | 0.772 | S | S | * | * | trans | -86.2 | 94.7 | 158.9 | 46 | 0 | 0 | 0 | 0 | 107.2 | S23 Q27 | S23-S25 PolarHBondContact O-N 2.88Å; S25-Q27 PolarHBondContact O-N 3.3Å | ||
| 26 | H | 29.1 | Very low | 32.3 | Very low | 183 Ų | 183 | 137.5 Ų | 137.5 | 85% | 0.847 | 76% | 0.759 | S | S | * | * | trans | -58.4 | 95.6 | 155.9 | -90 | -72 | 0 | 0 | 0 | 106.6 | S24 D28 | S24-H26 PolarHBondContact O-N 3.1Å; H26-D28 PolarHBondContact O-N 3.49Å | ||
| 27 | Q | 29.6 | Very low | 34.1 | Very low | 156 Ų | 156 | 138.3 Ų | 138.3 | 73% | 0.729 | 76% | 0.757 | S | S | * | * | trans | -65.6 | 96.5 | 160.5 | -82.6 | -178.6 | -17.8 | 0 | 0 | 106 | S25 H29 | S25-Q27 PolarHBondContact O-N 3.3Å; Q27-H29 PolarHBondContact O-N 3.37Å | ||
| 28 | D | 29.2 | Very low | 36.4 | Very low | 151 Ų | 151 | 137.1 Ų | 137.1 | 81% | 0.807 | 74% | 0.744 | S | S | * | * | trans | -61.8 | 94.3 | 164.5 | -151.2 | 8.1 | 0 | 0 | 0 | 105.8 | H26 S30 | H26-D28 PolarHBondContact O-N 3.49Å; D28-S30 PolarHBondContact O-N 3.07Å | ||
| 29 | H | 32.7 | Very low | 38.9 | Very low | 161 Ų | 161 | 139.6 Ų | 139.6 | 75% | 0.745 | 74% | 0.737 | S | S | * | * | trans | -65.2 | 81.8 | 165.8 | -88.5 | -66 | 0 | 0 | 0 | 106.4 | Q27 K31 | Q27-H29 PolarHBondContact O-N 3.37Å; H29-K31 PolarHBondContact O-N 3.23Å | ||
| 30 | S | 34.1 | Very low | 41.3 | Very low | 93 Ų | 93 | 134.6 Ų | 134.6 | 65% | 0.65 | 70% | 0.7 | S | S | * | * | trans | -52.2 | 109.1 | 159.2 | 47.4 | 0 | 0 | 0 | 0 | 105.7 | D28 E32 | D28-S30 PolarHBondContact O-N 3.07Å; S30-E32 VanDerWaalsContact C-N 3.26Å; S30-E32 PolarHBondContact O-N 3.41Å | ||
| 31 | K | 32.2 | Very low | 44.1 | Very low | 164 Ų | 164 | 132 Ų | 132 | 71% | 0.713 | 68% | 0.676 | S | S | * | * | trans | -55.7 | 98.4 | 169.2 | -76.6 | 178 | 176.1 | 179 | 0 | 106 | H29 H33 | H29-K31 PolarHBondContact O-N 3.23Å; K31-H33 PolarHBondContact O-CD2 3.04Å; K31-H33 VanDerWaalsContact O-CD2 3.23Å; K31-H33 PolarHBondContact O-N 3.31Å | ||
| 32 | E | 33.7 | Very low | 46.9 | Very low | 187 Ų | 187 | 129.3 Ų | 129.3 | 87% | 0.874 | 65% | 0.654 | S | S | * | * | trans | -64.4 | 91.1 | 168.2 | -82.1 | -166 | 154.8 | 0 | 0 | 106.6 | S30 M34 | S30-E32 VanDerWaalsContact C-N 3.26Å; S30-E32 PolarHBondContact O-N 3.41Å; E32-M34 PolarHBondContact O-N 2.81Å; E32-M34 VanDerWaalsContact O-N 3.16Å | ||
| 33 | H | 33.8 | Very low | 49.5 | Very low | 127 Ų | 127 | 126.1 Ų | 126.1 | 59% | 0.588 | 64% | 0.642 | S | S | * | * | trans | -63.7 | 117.4 | 171.3 | -73.4 | -79 | 0 | 0 | 0 | 107.5 | K31 K35 | K31-H33 PolarHBondContact O-CD2 3.04Å; K31-H33 VanDerWaalsContact O-CD2 3.23Å; K31-H33 PolarHBondContact O-N 3.31Å; H33-K35 VanDerWaalsContact C-N 3.35Å; H33-K35 PolarHBondContact O-N 2.81Å | ||
| 34 | M | 35.1 | Very low | 52 | Low | 196 Ų | 196 | 125.5 Ų | 125.5 | 97% | 0.966 | 63% | 0.631 | S | S | * | * | trans | -63.6 | 95.3 | 174.4 | -157.5 | -173.2 | -50.8 | 0 | 0 | 108.2 | E32 | E32-M34 PolarHBondContact O-N 2.81Å; E32-M34 VanDerWaalsContact O-N 3.16Å | ||
| 35 | K | 44.9 | Very low | 54.5 | Low | 181 Ų | 181 | 120.2 Ų | 120.2 | 79% | 0.787 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -89.9 | 140 | 176.6 | -71.1 | -179.1 | -178.8 | 177.6 | 0 | 109.5 | H33 K37 | H33-K35 VanDerWaalsContact C-N 3.35Å; H33-K35 PolarHBondContact O-N 2.81Å; K35-K37 PolarHBondContact O-N 2.93Å |
| 36 | L | 57 | Low | 57.4 | Low | 88 Ų | 88 | 116.5 Ų | 116.5 | 46% | 0.461 | 57% | 0.567 | S | S | . | * | P | Polyproline II helix | trans | -56.3 | 137.1 | 171 | -68.4 | 172.6 | 0 | 0 | 0 | 109.9 | K38 E253 E254 | L36-K38 PolarHBondContact O-N 2.92Å; L36-E253 HydrophobicContact CD1-CB 4.18Å; L36-E254 HydrophobicContact CB-CG 4.15Å; L36-E254 HydrophobicContact CD1-CG 4.23Å |
| 37 | K | 66.7 | Low | 59.9 | Low | 156 Ų | 156 | 110.2 Ų | 110.2 | 68% | 0.678 | 54% | 0.544 | S | S | * | . | P | Polyproline II helix | trans | -71.9 | 129.5 | -179.3 | -70.7 | -174 | 177.8 | -180 | 0 | 109.8 | K35 E39 | K35-K37 PolarHBondContact O-N 2.93Å; K37-E39 HydrophobicContact CB-CG 3.86Å; K37-E39 WeakPolarHBondContact CD-OE1 3.48Å; K37-E39 PolarHBondContact O-N 3.46Å |
| 38 | K | 75.8 | Confident | 62.3 | Low | 128 Ų | 128 | 105.1 Ų | 105.1 | 56% | 0.557 | 52% | 0.521 | S | S | * | . | trans | -78 | 84.5 | 175.9 | -67.1 | -176.9 | 179.4 | -176.3 | 0 | 110.8 | L36 E253 E254 K256 | L36-K38 PolarHBondContact O-N 2.92Å; K38-E253 WeakPolarHBondContact CG-O 3.44Å; K38-E254 CarbonylContact C-O 3.5Å; K38-E254 VanDerWaalsContact CA-O 3.29Å; K38-E254 WeakPolarHBondContact CA-O 3.46Å; K38-K256 HydrophobicContact CB-CG 4.34Å; K38-K256 WeakPolarHBondContact O-CE 2.95Å; K38-K256 VanDerWaalsContact O-CG 3.24Å; K38-K256 WeakPolarHBondContact O-CG 3.46Å | ||
| 39 | E | 79.7 | Confident | 65 | Low | 123 Ų | 123 | 97.9 Ų | 97.9 | 58% | 0.575 | 48% | 0.483 | S | S | * | . | trans | -106.2 | -21.7 | -174.5 | -65.2 | -172.6 | 171.3 | 0 | 0 | 113.6 | K37 S41 E254 | K37-E39 HydrophobicContact CB-CG 3.86Å; K37-E39 WeakPolarHBondContact CD-OE1 3.48Å; K37-E39 PolarHBondContact O-N 3.46Å; E39-S41 PolarHBondContact O-N 3.38Å; E39-E254 PolarHBondContact N-O 3.12Å | ||
| 40 | I | 80 | Confident | 67.5 | Low | 22 Ų | 22 | 91.2 Ų | 91.2 | 11% | 0.113 | 45% | 0.453 | C | S | . | . | B | Isolated β-bridge | trans | -76.4 | 112.9 | -173.8 | -55.5 | 177.5 | 0 | 0 | 0 | 110.3 | N44 V251 E254 I255 K256 | I40-N44 HydrophobicContact CG2-CB 3.97Å; I40-V251 HydrophobicContact CD1-CB 3.97Å; I40-V251 HydrophobicContact CD1-CG2 3.79Å; I40-E254 HydrophobicContact CD1-CB 3.79Å; I40-E254 HydrophobicContact CG1-CB 4.14Å; I40-E254 PolarHBondContact N-O 3.21Å; I40-I255 HydrophobicContact CB-CG1 4.21Å; I40-I255 HydrophobicContact CG2-CG1 4.21Å; I40-K256 WeakPolarHBondContact O-CB 3.13Å; I40-K256 PolarHBondContact O-N 2.98Å |
| 41 | S | 88.2 | Confident | 69.7 | Low | 35 Ų | 35 | 86.9 Ų | 86.9 | 25% | 0.245 | 42% | 0.424 | C | S | . | . | trans | -80.9 | 170.9 | 175 | 79.9 | 0 | 0 | 0 | 0 | 112.2 | E39 L43 N44 G45 | E39-S41 PolarHBondContact O-N 3.38Å; S41-L43 PolarHBondContact O-N 3.34Å; S41-N44 PolarHBondContact O-N 3.23Å; S41-N44 PolarHBondContact OG-N 3.06Å; S41-N44 PolarHBondContact OG-OD1 3.09Å; S41-N44 VanDerWaalsContact OG-OD1 3.13Å; S41-G45 PolarHBondContact O-N 3.32Å | ||
| 42 | L | 86.6 | Confident | 72 | Confident | 48 Ų | 48 | 81.4 Ų | 81.4 | 25% | 0.251 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -57.4 | -46.3 | 175 | 177.6 | 65.4 | 0 | 0 | 0 | 112.4 | N44 G45 V46 N261 L264 S265 | L42-N44 VanDerWaalsContact C-N 3.33Å; L42-N44 PolarHBondContact O-N 3.43Å; L42-G45 PolarHBondContact O-N 3.15Å; L42-G45 VanDerWaalsContact O-N 3.16Å; L42-V46 WeakPolarHBondContact O-CG2 3.16Å; L42-V46 PolarHBondContact O-N 3.44Å; L42-N261 HydrophobicContact CD1-CB 4.3Å; L42-L264 HydrophobicContact CD1-CB 3.62Å; L42-L264 HydrophobicContact CD2-CD1 4.5Å; L42-S265 WeakPolarHBondContact CD1-OG 3.34Å |
| 43 | L | 84.1 | Confident | 74.5 | Confident | 137 Ų | 137 | 72.7 Ų | 72.7 | 72% | 0.717 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -66.3 | -38.3 | 179.5 | -70.1 | 174.6 | 0 | 0 | 0 | 111.5 | S41 G45 V46 S47 | S41-L43 PolarHBondContact O-N 3.34Å; L43-G45 VanDerWaalsContact C-N 3.28Å; L43-G45 PolarHBondContact O-N 3.29Å; L43-V46 PolarHBondContact O-N 3.34Å; L43-S47 WeakPolarHBondContact O-CB 3.1Å; L43-S47 PolarHBondContact O-N 3.28Å |
| 44 | N | 82.1 | Confident | 76.9 | Confident | 89 Ų | 89 | 66.6 Ų | 66.6 | 48% | 0.476 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.9 | -39.9 | 173.6 | -61.8 | 3.7 | 0 | 0 | 0 | 110.2 | I40 S41 L42 S47 L48 | I40-N44 HydrophobicContact CG2-CB 3.97Å; S41-N44 PolarHBondContact O-N 3.23Å; S41-N44 PolarHBondContact OG-N 3.06Å; S41-N44 PolarHBondContact OG-OD1 3.09Å; S41-N44 VanDerWaalsContact OG-OD1 3.13Å; L42-N44 VanDerWaalsContact C-N 3.33Å; L42-N44 PolarHBondContact O-N 3.43Å; N44-S47 PolarHBondContact O-N 3.44Å; N44-L48 VanDerWaalsContact O-CB 3.24Å; N44-L48 WeakPolarHBondContact O-CB 3.42Å; N44-L48 PolarHBondContact O-N 3.28Å |
| 45 | G | 83.3 | Confident | 79 | Confident | 1 Ų | 1 | 57.8 Ų | 57.8 | 1% | 0.01 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.2 | -47.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113.1 | S41 L42 L43 L48 I49 | S41-G45 PolarHBondContact O-N 3.32Å; L42-G45 PolarHBondContact O-N 3.15Å; L42-G45 VanDerWaalsContact O-N 3.16Å; L43-G45 VanDerWaalsContact C-N 3.28Å; L43-G45 PolarHBondContact O-N 3.29Å; G45-L48 PolarHBondContact O-N 2.84Å; G45-I49 PolarHBondContact O-N 2.98Å |
| 46 | V | 87.2 | Confident | 80.7 | Confident | 21 Ų | 21 | 49.5 Ų | 49.5 | 13% | 0.127 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.3 | -48.5 | 174.9 | 174.1 | 0 | 0 | 0 | 0 | 110.8 | L42 L43 L48 I49 V50 I268 | L42-V46 WeakPolarHBondContact O-CG2 3.16Å; L42-V46 PolarHBondContact O-N 3.44Å; L43-V46 PolarHBondContact O-N 3.34Å; V46-L48 VanDerWaalsContact C-N 3.28Å; V46-L48 PolarHBondContact O-N 3.29Å; V46-I49 PolarHBondContact O-N 2.94Å; V46-V50 HydrophobicContact CG1-CG2 4.19Å; V46-V50 WeakPolarHBondContact O-CB 3.41Å; V46-V50 VanDerWaalsContact O-CG2 3.31Å; V46-V50 WeakPolarHBondContact O-CG2 3.26Å; V46-V50 PolarHBondContact O-N 3.17Å; V46-I268 HydrophobicContact CG1-CG2 4.05Å; V46-I268 HydrophobicContact CG2-CB 4.11Å; V46-I268 HydrophobicContact CG2-CD1 4.35Å; V46-I268 HydrophobicContact CG2-CG2 4.12Å |
| 47 | S | 82.6 | Confident | 82.2 | Confident | 51 Ų | 51 | 45.5 Ų | 45.5 | 36% | 0.357 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -60.2 | -39.1 | 178.8 | -171.9 | 0 | 0 | 0 | 0 | 111.9 | L43 N44 G51 | L43-S47 WeakPolarHBondContact O-CB 3.1Å; L43-S47 PolarHBondContact O-N 3.28Å; N44-S47 PolarHBondContact O-N 3.44Å; S47-G51 WeakPolarHBondContact O-CA 3.42Å; S47-G51 PolarHBondContact O-N 2.88Å |
| 48 | L | 80.5 | Confident | 83.4 | Confident | 48 Ų | 48 | 38.1 Ų | 38.1 | 25% | 0.251 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -66.6 | -45.3 | 177.7 | -168.6 | 160.5 | 0 | 0 | 0 | 111.6 | N44 G45 V46 N52 T247 L248 | N44-L48 VanDerWaalsContact O-CB 3.24Å; N44-L48 WeakPolarHBondContact O-CB 3.42Å; N44-L48 PolarHBondContact O-N 3.28Å; G45-L48 PolarHBondContact O-N 2.84Å; V46-L48 VanDerWaalsContact C-N 3.28Å; V46-L48 PolarHBondContact O-N 3.29Å; L48-N52 WeakPolarHBondContact CD2-ND2 3.48Å; L48-N52 WeakPolarHBondContact O-CB 3.37Å; L48-N52 VanDerWaalsContact O-CG 3.31Å; L48-N52 PolarHBondContact O-N 3.36Å; L48-T247 HydrophobicContact CD2-CG2 3.86Å; L48-L248 HydrophobicContact CB-CD2 4.21Å; L48-L248 HydrophobicContact CD1-CD2 4Å; L48-L248 HydrophobicContact CD2-CD2 3.83Å; L48-L248 HydrophobicContact CD2-CG 4.32Å; L48-L248 HydrophobicContact CG-CD2 4.24Å |
| 49 | I | 85.1 | Confident | 84.1 | Confident | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.9 | -53.1 | 176.4 | -66.1 | 172.1 | 0 | 0 | 0 | 110.6 | G45 V46 G51 N52 M53 W245 L248 I266 S269 | G45-I49 PolarHBondContact O-N 2.98Å; V46-I49 PolarHBondContact O-N 2.94Å; I49-G51 VanDerWaalsContact C-N 3.27Å; I49-G51 PolarHBondContact O-N 2.84Å; I49-N52 PolarHBondContact O-N 3.3Å; I49-N52 VanDerWaalsContact O-N 3.15Å; I49-M53 HydrophobicContact CG2-CG 4.03Å; I49-M53 HydrophobicContact CG2-SD 3.44Å; I49-M53 WeakPolarHBondContact CG2-SD 3.24Å; I49-M53 WeakPolarHBondContact O-CB 3.29Å; I49-M53 WeakPolarHBondContact O-CG 3.48Å; I49-M53 PolarHBondContact O-N 3.44Å; I49-W245 HydrophobicContact CG2-CB 4.43Å; I49-L248 HydrophobicContact CD1-CD1 3.36Å; I49-L248 HydrophobicContact CD1-CG 3.95Å; I49-L248 HydrophobicContact CG1-CD1 3.61Å; I49-L248 HydrophobicContact CG1-CG 3.69Å; I49-I266 HydrophobicContact CD1-CB 4.48Å; I49-I266 HydrophobicContact CD1-CG1 3.66Å; I49-S269 WeakPolarHBondContact CD1-OG 3.21Å; I49-S269 VanDerWaalsContact CG2-OG 3.23Å; I49-S269 WeakPolarHBondContact CG2-OG 3.35Å |
| 50 | V | 85.6 | Confident | 84.6 | Confident | 20 Ų | 20 | 27.1 Ų | 27.1 | 12% | 0.121 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.6 | -43.4 | -178.6 | 174.1 | 0 | 0 | 0 | 0 | 110 | V46 I54 V273 | V46-V50 HydrophobicContact CG1-CG2 4.19Å; V46-V50 WeakPolarHBondContact O-CB 3.41Å; V46-V50 VanDerWaalsContact O-CG2 3.31Å; V46-V50 WeakPolarHBondContact O-CG2 3.26Å; V46-V50 PolarHBondContact O-N 3.17Å; V50-I54 HydrophobicContact CG1-CD1 3.55Å; V50-I54 HydrophobicContact CG1-CG1 4.2Å; V50-I54 WeakPolarHBondContact O-CB 3.28Å; V50-I54 VanDerWaalsContact O-CG1 3.28Å; V50-I54 WeakPolarHBondContact O-CG1 3.35Å; V50-I54 PolarHBondContact O-N 3.21Å; V50-V273 HydrophobicContact CG1-CG2 4.44Å; V50-V273 HydrophobicContact CG2-CG2 4.21Å |
| 51 | G | 80 | Confident | 85.3 | Confident | 3 Ų | 3 | 26 Ų | 26 | 3% | 0.031 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -65.6 | -34.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | S47 I49 K194 | S47-G51 WeakPolarHBondContact O-CA 3.42Å; S47-G51 PolarHBondContact O-N 2.88Å; I49-G51 VanDerWaalsContact C-N 3.27Å; I49-G51 PolarHBondContact O-N 2.84Å; G51-K194 WeakPolarHBondContact O-CE 3.42Å; G51-K194 PolarHBondContact O-NZ 2.92Å |
| 52 | N | 79.5 | Confident | 85.7 | Confident | 48 Ų | 48 | 24.4 Ų | 24.4 | 26% | 0.257 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -82.5 | -38.8 | 178.5 | -74.2 | -7.1 | 0 | 0 | 0 | 112.5 | L48 I49 T247 | L48-N52 WeakPolarHBondContact CD2-ND2 3.48Å; L48-N52 WeakPolarHBondContact O-CB 3.37Å; L48-N52 VanDerWaalsContact O-CG 3.31Å; L48-N52 PolarHBondContact O-N 3.36Å; I49-N52 PolarHBondContact O-N 3.3Å; I49-N52 VanDerWaalsContact O-N 3.15Å; N52-T247 WeakPolarHBondContact ND2-CB 3.37Å; N52-T247 VanDerWaalsContact ND2-CG2 3.26Å; N52-T247 WeakPolarHBondContact ND2-CG2 3.49Å; N52-T247 PolarHBondContact ND2-OG1 3.47Å; N52-T247 VanDerWaalsContact ND2-OG1 3.15Å |
| 53 | M | 85.9 | Confident | 86.1 | Confident | 4 Ų | 4 | 23.4 Ų | 23.4 | 2% | 0.02 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -67.8 | -50.1 | 178 | -70 | 178.9 | 77.1 | 0 | 0 | 111.6 | I49 G55 Y242 S243 W245 M270 V273 Y277 | I49-M53 HydrophobicContact CG2-CG 4.03Å; I49-M53 HydrophobicContact CG2-SD 3.44Å; I49-M53 WeakPolarHBondContact CG2-SD 3.24Å; I49-M53 WeakPolarHBondContact O-CB 3.29Å; I49-M53 WeakPolarHBondContact O-CG 3.48Å; I49-M53 PolarHBondContact O-N 3.44Å; M53-G55 VanDerWaalsContact C-N 3.26Å; M53-G55 PolarHBondContact O-N 2.93Å; M53-Y242 HydrophobicContact CE-CD1 3.73Å; M53-Y242 HydrophobicContact CE-CG 4.46Å; M53-Y242 VanDerWaalsContact CE-O 3.28Å; M53-Y242 WeakPolarHBondContact CE-O 3.26Å; M53-S243 WeakPolarHBondContact CA-O 3.32Å; M53-W245 HydrophobicContact CE-CB 4.43Å; M53-W245 HydrophobicContact CG-CB 4.41Å; M53-W245 HydrophobicContact SD-CB 3.87Å; M53-M270 HydrophobicContact CE-CE 3.6Å; M53-M270 HydrophobicContact CE-SD 3.6Å; M53-M270 HydrophobicContact SD-CE 4.36Å; M53-M270 HydrophobicContact SD-SD 3.54Å; M53-V273 HydrophobicContact CB-CG1 4.22Å; M53-V273 HydrophobicContact CB-CG2 4.27Å; M53-V273 HydrophobicContact CE-CB 4.26Å; M53-V273 HydrophobicContact CE-CG1 3.88Å; M53-V273 HydrophobicContact SD-CB 4.47Å; M53-V273 HydrophobicContact SD-CG1 4.46Å; M53-V273 HydrophobicContact SD-CG2 4.11Å; M53-Y277 VanDerWaalsContact C-OH 3.27Å; M53-Y277 PolarHBondContact O-OH 3.44Å |
| 54 | I | 85.5 | Confident | 86.5 | Confident | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 10% | 0.1 | C | C | . | . | S | Bend | trans | -70.7 | 87 | 177.2 | -59.6 | -176.5 | 0 | 0 | 0 | 108 | V50 K194 V195 L198 V273 I276 Y277 | V50-I54 HydrophobicContact CG1-CD1 3.55Å; V50-I54 HydrophobicContact CG1-CG1 4.2Å; V50-I54 WeakPolarHBondContact O-CB 3.28Å; V50-I54 VanDerWaalsContact O-CG1 3.28Å; V50-I54 WeakPolarHBondContact O-CG1 3.35Å; V50-I54 PolarHBondContact O-N 3.21Å; I54-K194 HydrophobicContact CG2-CD 4.35Å; I54-K194 HydrophobicContact CG2-CG 4.41Å; I54-K194 WeakPolarHBondContact O-CD 3.36Å; I54-K194 WeakPolarHBondContact O-CE 3.48Å; I54-K194 PolarHBondContact O-NZ 2.8Å; I54-V195 HydrophobicContact CD1-CG2 4.42Å; I54-L198 HydrophobicContact CD1-CD1 4.49Å; I54-L198 HydrophobicContact CG2-CD1 3.35Å; I54-V273 HydrophobicContact CD1-CG2 4.35Å; I54-V273 HydrophobicContact CG1-CG1 4.3Å; I54-V273 HydrophobicContact CG1-CG2 4.1Å; I54-I276 HydrophobicContact CD1-CD1 3.89Å; I54-I276 HydrophobicContact CD1-CG2 4.46Å; I54-Y277 WeakPolarHBondContact CA-OH 3.41Å; I54-Y277 HydrophobicContact CG1-CE1 4.13Å |
| 55 | G | 79.6 | Confident | 87.2 | Confident | 10 Ų | 10 | 12.7 Ų | 12.7 | 10% | 0.103 | 8% | 0.077 | C | C | . | . | S | Bend | trans | -125.2 | -146.2 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | M53 G57 F59 | M53-G55 VanDerWaalsContact C-N 3.26Å; M53-G55 PolarHBondContact O-N 2.93Å; G55-G57 VanDerWaalsContact C-N 3.25Å; G55-G57 PolarHBondContact O-N 3.27Å; G55-F59 WeakPolarHBondContact O-CD2 3.41Å; G55-F59 WeakPolarHBondContact O-CE2 3.42Å |
| 56 | S | 79.8 | Confident | 87.8 | Confident | 8 Ų | 8 | 13 Ų | 13 | 6% | 0.056 | 8% | 0.078 | C | C | . | . | S | Bend | trans | -69 | -24 | 173.2 | 57.4 | 0 | 0 | 0 | 0 | 112.9 | I58 F59 V60 I138 C323 | S56-I58 PolarHBondContact O-N 2.72Å; S56-F59 WeakPolarHBondContact O-CB 3.39Å; S56-F59 PolarHBondContact O-N 3.47Å; S56-V60 PolarHBondContact O-N 3.02Å; S56-I138 VanDerWaalsContact OG-CG1 3.27Å; S56-I138 WeakPolarHBondContact OG-CG1 3.21Å; S56-C323 VanDerWaalsContact CB-SG 3.53Å |
| 57 | G | 87.9 | Confident | 88.1 | Confident | 4 Ų | 4 | 15.4 Ų | 15.4 | 4% | 0.041 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -54.7 | -50.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | G55 F59 V60 S61 S241 | G55-G57 VanDerWaalsContact C-N 3.25Å; G55-G57 PolarHBondContact O-N 3.27Å; G57-F59 PolarHBondContact O-N 3.05Å; G57-V60 PolarHBondContact O-N 3.47Å; G57-S61 VanDerWaalsContact O-CB 3.27Å; G57-S61 WeakPolarHBondContact O-CB 3.34Å; G57-S61 PolarHBondContact O-N 2.94Å; G57-S61 PolarHBondContact O-OG 3.38Å; G57-S61 VanDerWaalsContact O-OG 3.09Å; G57-S241 WeakPolarHBondContact CA-OG 3.4Å; G57-S241 PolarHBondContact O-OG 2.63Å |
| 58 | I | 91.9 | Very high | 88.7 | Confident | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -61.8 | -17.4 | -177.4 | -169.3 | 54.8 | 0 | 0 | 0 | 113.3 | S56 P62 W79 L198 S241 Y277 T280 | S56-I58 PolarHBondContact O-N 2.72Å; I58-P62 WeakPolarHBondContact O-CD 3.41Å; I58-P62 WeakPolarHBondContact O-CG 3.21Å; I58-W79 HydrophobicContact CD1-CH2 3.51Å; I58-W79 HydrophobicContact CD1-CZ2 4.07Å; I58-W79 HydrophobicContact CD1-CZ3 3.93Å; I58-L198 HydrophobicContact CG1-CD2 4.49Å; I58-L198 HydrophobicContact CG2-CD1 4.41Å; I58-L198 HydrophobicContact CG2-CD2 4.18Å; I58-S241 PolarHBondContact N-OG 2.69Å; I58-S241 VanDerWaalsContact N-OG 3.14Å; I58-Y277 HydrophobicContact CB-CD1 4.1Å; I58-Y277 HydrophobicContact CB-CE1 3.74Å; I58-Y277 HydrophobicContact CD1-CD1 3.61Å; I58-Y277 HydrophobicContact CD1-CD2 4.44Å; I58-Y277 HydrophobicContact CD1-CE1 4.14Å; I58-Y277 HydrophobicContact CD1-CG 3.77Å; I58-Y277 HydrophobicContact CG1-CD1 3.69Å; I58-Y277 HydrophobicContact CG1-CE1 3.86Å; I58-Y277 HydrophobicContact CG1-CG 4.37Å; I58-Y277 HydrophobicContact CG2-CE1 4.28Å; I58-T280 HydrophobicContact CD1-CG2 4.42Å; I58-T280 HydrophobicContact CG1-CG2 4.11Å |
| 59 | F | 90.4 | Very high | 89.4 | Confident | 2 Ų | 2 | 12.9 Ų | 12.9 | 1% | 0.009 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -92.4 | -14.7 | 179.4 | -61.8 | -58.4 | 0 | 0 | 0 | 113.1 | G55 S56 G57 T141 Y145 L198 I201 A300 V319 | G55-F59 WeakPolarHBondContact O-CD2 3.41Å; G55-F59 WeakPolarHBondContact O-CE2 3.42Å; S56-F59 WeakPolarHBondContact O-CB 3.39Å; S56-F59 PolarHBondContact O-N 3.47Å; G57-F59 PolarHBondContact O-N 3.05Å; F59-T141 HydrophobicContact CB-CG2 4.39Å; F59-Y145 HydrophobicContact CB-CE1 4.5Å; F59-Y145 HydrophobicContact CB-CE2 3.87Å; F59-Y145 WeakPolarHBondContact CB-OH 3.5Å; F59-Y145 PolarHBondContact O-OH 3.07Å; F59-L198 HydrophobicContact CE1-CD2 3.75Å; F59-L198 HydrophobicContact CZ-CD2 3.71Å; F59-L198 HydrophobicContact CZ-CG 4.17Å; F59-I201 HydrophobicContact CE1-CD1 4.41Å; F59-A300 HydrophobicContact CD1-CB 3.89Å; F59-A300 HydrophobicContact CE1-CB 4.23Å; F59-V319 HydrophobicContact CB-CG1 4.06Å; F59-V319 HydrophobicContact CD1-CG1 4.19Å; F59-V319 HydrophobicContact CD1-CG2 3.74Å; F59-V319 HydrophobicContact CD2-CB 4.41Å; F59-V319 HydrophobicContact CD2-CG1 3.53Å; F59-V319 HydrophobicContact CD2-CG2 4.13Å; F59-V319 HydrophobicContact CE1-CG2 3.51Å; F59-V319 HydrophobicContact CE2-CB 4.43Å; F59-V319 HydrophobicContact CE2-CG1 3.99Å; F59-V319 HydrophobicContact CE2-CG2 3.92Å; F59-V319 HydrophobicContact CG-CG1 3.64Å; F59-V319 HydrophobicContact CG-CG2 4.05Å; F59-V319 HydrophobicContact CZ-CG2 3.61Å |
| 60 | V | 91.6 | Very high | 89.8 | Confident | 18 Ų | 18 | 15.6 Ų | 15.6 | 11% | 0.109 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -110.9 | -45.3 | 178 | 178.8 | 0 | 0 | 0 | 0 | 112 | S56 G57 K63 T141 V381 F382 I385 | S56-V60 PolarHBondContact O-N 3.02Å; G57-V60 PolarHBondContact O-N 3.47Å; V60-K63 PolarHBondContact O-N 3.44Å; V60-T141 HydrophobicContact CG2-CG2 3.5Å; V60-T141 WeakPolarHBondContact CG2-OG1 3.35Å; V60-V381 HydrophobicContact CG1-CG1 4.2Å; V60-F382 HydrophobicContact CG1-CE1 4.13Å; V60-F382 HydrophobicContact CG1-CZ 4.36Å; V60-I385 HydrophobicContact CG1-CD1 4.03Å |
| 61 | S | 94.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -58.5 | -32.7 | -173.1 | -65.4 | 0 | 0 | 0 | 0 | 115.5 | G57 K63 G64 V65 S237 S241 | G57-S61 VanDerWaalsContact O-CB 3.27Å; G57-S61 WeakPolarHBondContact O-CB 3.34Å; G57-S61 PolarHBondContact O-N 2.94Å; G57-S61 PolarHBondContact O-OG 3.38Å; G57-S61 VanDerWaalsContact O-OG 3.09Å; S61-K63 VanDerWaalsContact C-N 3.27Å; S61-K63 PolarHBondContact O-N 3.19Å; S61-G64 PolarHBondContact O-N 3.21Å; S61-G64 VanDerWaalsContact O-N 3.11Å; S61-V65 WeakPolarHBondContact O-CG2 3.24Å; S61-V65 PolarHBondContact O-N 3.49Å; S61-S237 WeakPolarHBondContact CB-O 3.44Å; S61-S237 PolarHBondContact OG-O 2.89Å; S61-S241 WeakPolarHBondContact CB-OG 3.48Å; S61-S241 PolarHBondContact OG-OG 2.95Å |
| 62 | P | 95.3 | Very high | 90.9 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -55.3 | -39.7 | 178.7 | -29.3 | 36.7 | 0 | 0 | 0 | 113.8 | I58 L66 W79 N281 Y284 | I58-P62 WeakPolarHBondContact O-CD 3.41Å; I58-P62 WeakPolarHBondContact O-CG 3.21Å; P62-L66 VanDerWaalsContact O-CB 3.27Å; P62-L66 WeakPolarHBondContact O-CB 3.42Å; P62-L66 PolarHBondContact O-N 2.82Å; P62-W79 HydrophobicContact CG-CZ2 4.22Å; P62-N281 WeakPolarHBondContact CB-OD1 3.29Å; P62-Y284 HydrophobicContact CB-CD2 4.25Å; P62-Y284 HydrophobicContact CB-CE2 4.49Å; P62-Y284 HydrophobicContact CG-CD2 4.16Å; P62-Y284 HydrophobicContact CG-CE2 3.97Å |
| 63 | K | 94.9 | Very high | 91.6 | Very high | 28 Ų | 28 | 14.3 Ų | 14.3 | 12% | 0.122 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.9 | -49.4 | 174.7 | 172.1 | 168.3 | 170.1 | 171.4 | 0 | 110.7 | V60 S61 V65 L66 I67 L294 S296 D297 V299 F382 | V60-K63 PolarHBondContact O-N 3.44Å; S61-K63 VanDerWaalsContact C-N 3.27Å; S61-K63 PolarHBondContact O-N 3.19Å; K63-V65 PolarHBondContact O-N 3.04Å; K63-L66 PolarHBondContact O-N 3.14Å; K63-I67 HydrophobicContact CG-CD1 3.91Å; K63-I67 HydrophobicContact CG-CG1 4.46Å; K63-I67 VanDerWaalsContact O-CG1 3.27Å; K63-I67 WeakPolarHBondContact O-CG1 3.4Å; K63-I67 PolarHBondContact O-N 3.08Å; K63-L294 WeakPolarHBondContact CE-O 3.48Å; K63-L294 PolarHBondContact NZ-O 3.03Å; K63-L294 VanDerWaalsContact NZ-O 3.1Å; K63-S296 WeakPolarHBondContact CD-O 3.31Å; K63-S296 PolarHBondContact NZ-O 3.4Å; K63-D297 IonicContact NZ-OD1 2.69Å; K63-D297 PolarHBondContact NZ-OD1 3.45Å; K63-V299 HydrophobicContact CB-CG2 4.3Å; K63-F382 HydrophobicContact CB-CZ 4.1Å; K63-F382 HydrophobicContact CD-CE2 4.36Å; K63-F382 HydrophobicContact CD-CZ 4.28Å; K63-F382 HydrophobicContact CG-CE2 4.2Å; K63-F382 HydrophobicContact CG-CZ 3.85Å |
| 64 | G | 93.7 | Very high | 92.1 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -59.6 | -46.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | S61 L66 I67 Y68 | S61-G64 PolarHBondContact O-N 3.21Å; S61-G64 VanDerWaalsContact O-N 3.11Å; G64-L66 VanDerWaalsContact C-N 3.31Å; G64-L66 PolarHBondContact O-N 2.86Å; G64-I67 PolarHBondContact O-N 3.37Å; G64-Y68 WeakPolarHBondContact O-CD2 3.15Å; G64-Y68 PolarHBondContact O-N 2.7Å |
| 65 | V | 96.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -62.4 | -41.1 | 176.9 | -179.4 | 0 | 0 | 0 | 0 | 110.5 | S61 K63 S69 S75 I78 W79 A234 A238 | S61-V65 WeakPolarHBondContact O-CG2 3.24Å; S61-V65 PolarHBondContact O-N 3.49Å; K63-V65 PolarHBondContact O-N 3.04Å; V65-S69 WeakPolarHBondContact O-CB 3.48Å; V65-S69 PolarHBondContact O-N 2.69Å; V65-S69 PolarHBondContact O-OG 2.98Å; V65-S75 VanDerWaalsContact CG1-OG 3.25Å; V65-S75 WeakPolarHBondContact CG1-OG 3.29Å; V65-I78 HydrophobicContact CG1-CB 4.21Å; V65-I78 HydrophobicContact CG1-CG2 3.97Å; V65-W79 HydrophobicContact CG2-CZ2 4.24Å; V65-A234 HydrophobicContact CG1-CB 4.48Å; V65-A238 HydrophobicContact CG2-CB 3.93Å |
| 66 | L | 95.6 | Very high | 93.4 | Very high | 7 Ų | 7 | 16.6 Ų | 16.6 | 4% | 0.037 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -69.8 | -36.8 | -179.5 | -170.1 | 62.4 | 0 | 0 | 0 | 112.9 | P62 K63 G64 Y68 S69 A70 Y72 Y285 I293 L294 | P62-L66 VanDerWaalsContact O-CB 3.27Å; P62-L66 WeakPolarHBondContact O-CB 3.42Å; P62-L66 PolarHBondContact O-N 2.82Å; K63-L66 PolarHBondContact O-N 3.14Å; G64-L66 VanDerWaalsContact C-N 3.31Å; G64-L66 PolarHBondContact O-N 2.86Å; L66-Y68 VanDerWaalsContact C-N 3.33Å; L66-Y68 PolarHBondContact O-N 2.69Å; L66-S69 WeakPolarHBondContact CA-OG 3.39Å; L66-A70 WeakPolarHBondContact O-CA 3.31Å; L66-A70 PolarHBondContact O-N 3.39Å; L66-Y72 HydrophobicContact CD1-CD1 3.69Å; L66-Y72 HydrophobicContact CD1-CE1 4.06Å; L66-Y72 HydrophobicContact CD2-CD1 4.4Å; L66-Y72 HydrophobicContact CD2-CE1 4.05Å; L66-Y285 HydrophobicContact CD2-CE1 4.37Å; L66-I293 HydrophobicContact CD2-CB 3.92Å; L66-I293 HydrophobicContact CD2-CD1 4.13Å; L66-I293 HydrophobicContact CD2-CG2 3.78Å; L66-L294 HydrophobicContact CB-CD2 4.38Å; L66-L294 HydrophobicContact CD2-CD2 4.42Å; L66-L294 HydrophobicContact CD2-CG 4.37Å; L66-L294 HydrophobicContact CG-CD2 4.34Å |
| 67 | I | 94.5 | Very high | 94.2 | Very high | 73 Ų | 73 | 19.1 Ų | 19.1 | 37% | 0.374 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -53 | -52.2 | 175.1 | -73.7 | 165.1 | 0 | 0 | 0 | 110.3 | K63 G64 L294 F382 | K63-I67 HydrophobicContact CG-CD1 3.91Å; K63-I67 HydrophobicContact CG-CG1 4.46Å; K63-I67 VanDerWaalsContact O-CG1 3.27Å; K63-I67 WeakPolarHBondContact O-CG1 3.4Å; K63-I67 PolarHBondContact O-N 3.08Å; G64-I67 PolarHBondContact O-N 3.37Å; I67-L294 HydrophobicContact CB-CD2 4.31Å; I67-L294 HydrophobicContact CD1-CD2 4.46Å; I67-L294 HydrophobicContact CG1-CD2 3.38Å; I67-F382 HydrophobicContact CD1-CD2 4.48Å; I67-F382 HydrophobicContact CD1-CE2 4.08Å; I67-F382 HydrophobicContact CD1-CZ 4.44Å |
| 68 | Y | 94.4 | Very high | 94.7 | Very high | 45 Ų | 45 | 19 Ų | 19 | 18% | 0.176 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -86.4 | -30.6 | -173.5 | -62.6 | -66.8 | 0 | 0 | 0 | 113.5 | G64 L66 S225 D230 L233 | G64-Y68 WeakPolarHBondContact O-CD2 3.15Å; G64-Y68 PolarHBondContact O-N 2.7Å; L66-Y68 VanDerWaalsContact C-N 3.33Å; L66-Y68 PolarHBondContact O-N 2.69Å; Y68-S225 VanDerWaalsContact O-CB 3.25Å; Y68-S225 WeakPolarHBondContact O-CB 3.18Å; Y68-D230 VanDerWaalsContact CB-O 3.31Å; Y68-D230 WeakPolarHBondContact CB-O 3.44Å; Y68-D230 WeakPolarHBondContact O-CB 3.38Å; Y68-L233 HydrophobicContact CD1-CB 3.91Å; Y68-L233 HydrophobicContact CD1-CD1 4.07Å; Y68-L233 HydrophobicContact CD2-CB 3.77Å; Y68-L233 HydrophobicContact CE1-CB 3.91Å; Y68-L233 HydrophobicContact CE1-CD1 3.54Å; Y68-L233 HydrophobicContact CE1-CG 4.38Å; Y68-L233 HydrophobicContact CE2-CB 3.79Å; Y68-L233 HydrophobicContact CG-CB 3.86Å |
| 69 | S | 94.7 | Very high | 94.9 | Very high | 1 Ų | 1 | 19 Ų | 19 | 1% | 0.007 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -76.1 | -25.6 | 176.7 | 62.5 | 0 | 0 | 0 | 0 | 113.2 | V65 L66 S71 S75 S224 S225 | V65-S69 WeakPolarHBondContact O-CB 3.48Å; V65-S69 PolarHBondContact O-N 2.69Å; V65-S69 PolarHBondContact O-OG 2.98Å; L66-S69 WeakPolarHBondContact CA-OG 3.39Å; S69-S71 PolarHBondContact O-N 2.96Å; S69-S71 PolarHBondContact OG-O 2.93Å; S69-S75 WeakPolarHBondContact OG-CB 3.41Å; S69-S224 WeakPolarHBondContact O-CA 3.09Å; S69-S225 PolarHBondContact O-N 3.02Å |
| 70 | A | 93.5 | Very high | 95.3 | Very high | 57 Ų | 57 | 20.9 Ų | 20.9 | 47% | 0.471 | 12% | 0.122 | S | C | . | . | trans | 56.5 | 4.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | L66 G223 | L66-A70 WeakPolarHBondContact O-CA 3.31Å; L66-A70 PolarHBondContact O-N 3.39Å; A70-G223 VanDerWaalsContact CB-O 3.24Å; A70-G223 WeakPolarHBondContact CB-O 3.11Å | ||
| 71 | S | 94.2 | Very high | 95.5 | Very high | 6 Ų | 6 | 24.1 Ų | 24.1 | 4% | 0.042 | 14% | 0.138 | C | C | . | . | S | Bend | trans | -150.1 | 146.9 | 178.8 | 85.2 | 0 | 0 | 0 | 0 | 111.4 | S69 G73 L74 S75 S220 S224 | S69-S71 PolarHBondContact O-N 2.96Å; S69-S71 PolarHBondContact OG-O 2.93Å; S71-G73 VanDerWaalsContact C-N 3.33Å; S71-G73 PolarHBondContact O-N 3.28Å; S71-L74 WeakPolarHBondContact OG-CB 3.43Å; S71-L74 PolarHBondContact OG-N 2.95Å; S71-L74 VanDerWaalsContact OG-N 3.12Å; S71-S75 WeakPolarHBondContact O-CB 3.32Å; S71-S75 PolarHBondContact O-N 3.25Å; S71-S220 VanDerWaalsContact CB-O 3.29Å; S71-S220 WeakPolarHBondContact CB-O 3.33Å; S71-S220 PolarHBondContact OG-O 3.09Å; S71-S224 WeakPolarHBondContact CB-OG 3.27Å; S71-S224 PolarHBondContact OG-OG 3.33Å |
| 72 | Y | 94.3 | Very high | 95.5 | Very high | 33 Ų | 33 | 24.1 Ų | 24.1 | 13% | 0.129 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -66.3 | -37.7 | 179.7 | -52.6 | -46.2 | 0 | 0 | 0 | 112.2 | L66 S75 L76 N216 S220 Y285 G290 | L66-Y72 HydrophobicContact CD1-CD1 3.69Å; L66-Y72 HydrophobicContact CD1-CE1 4.06Å; L66-Y72 HydrophobicContact CD2-CD1 4.4Å; L66-Y72 HydrophobicContact CD2-CE1 4.05Å; Y72-S75 WeakPolarHBondContact O-CB 3.34Å; Y72-S75 PolarHBondContact O-N 3.04Å; Y72-L76 WeakPolarHBondContact O-CG 3.3Å; Y72-L76 PolarHBondContact O-N 2.83Å; Y72-N216 HydrophobicContact CD2-CB 4.22Å; Y72-N216 VanDerWaalsContact CD2-O 3.24Å; Y72-N216 WeakPolarHBondContact CD2-O 3.14Å; Y72-N216 HydrophobicContact CE2-CB 3.68Å; Y72-S220 PolarHBondContact N-O 3.25Å; Y72-Y285 AromaticContact CD1-CD1 3.67Å; Y72-Y285 HydrophobicContact CD1-CD1 3.67Å; Y72-Y285 HydrophobicContact CD1-CD2 4.15Å; Y72-Y285 AromaticContact CD1-CE1 3.92Å; Y72-Y285 HydrophobicContact CD1-CE1 3.92Å; Y72-Y285 HydrophobicContact CD1-CE2 4.35Å; Y72-Y285 AromaticContact CD1-CG 3.82Å; Y72-Y285 HydrophobicContact CD1-CG 3.82Å; Y72-Y285 AromaticContact CE1-CD1 4Å; Y72-Y285 HydrophobicContact CE1-CD1 4Å; Y72-Y285 HydrophobicContact CE1-CE1 4.38Å; Y72-Y285 HydrophobicContact CE1-CG 4.43Å; Y72-Y285 HydrophobicContact CG-CD1 4.4Å; Y72-Y285 HydrophobicContact CG-CD2 4.2Å; Y72-Y285 HydrophobicContact CG-CG 4.08Å; Y72-G290 VanDerWaalsContact OH-CA 3.31Å; Y72-G290 WeakPolarHBondContact OH-CA 3.28Å; Y72-G290 PolarHBondContact OH-N 3.16Å |
| 73 | G | 94.6 | Very high | 95.5 | Very high | 5 Ų | 5 | 24.2 Ų | 24.2 | 5% | 0.052 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -64.6 | -47.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S71 L76 V77 S220 | S71-G73 VanDerWaalsContact C-N 3.33Å; S71-G73 PolarHBondContact O-N 3.28Å; G73-L76 PolarHBondContact O-N 3.43Å; G73-V77 WeakPolarHBondContact O-CG2 3.5Å; G73-V77 PolarHBondContact O-N 3.45Å; G73-V77 VanDerWaalsContact O-N 3.16Å; G73-S220 WeakPolarHBondContact CA-O 3.36Å; G73-S220 PolarHBondContact N-O 3.38Å |
| 74 | L | 95.9 | Very high | 95.5 | Very high | 28 Ų | 28 | 28.3 Ų | 28.3 | 15% | 0.147 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -67.4 | -38.8 | 176.5 | -177.6 | 59.4 | 0 | 0 | 0 | 111.3 | S71 L76 V77 I78 S225 | S71-L74 WeakPolarHBondContact OG-CB 3.43Å; S71-L74 PolarHBondContact OG-N 2.95Å; S71-L74 VanDerWaalsContact OG-N 3.12Å; L74-L76 PolarHBondContact O-N 3.14Å; L74-V77 WeakPolarHBondContact O-CB 3.39Å; L74-V77 PolarHBondContact O-N 3.47Å; L74-I78 HydrophobicContact CD1-CD1 4.18Å; L74-I78 HydrophobicContact CD1-CG1 4.34Å; L74-I78 HydrophobicContact CD2-CD1 4.4Å; L74-I78 HydrophobicContact CG-CD1 3.77Å; L74-I78 HydrophobicContact CG-CG1 4.41Å; L74-I78 WeakPolarHBondContact O-CD1 3.28Å; L74-I78 WeakPolarHBondContact O-CG1 3.27Å; L74-I78 PolarHBondContact O-N 3.34Å; L74-S225 WeakPolarHBondContact CD2-O 3.3Å |
| 75 | S | 96.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -54.1 | -50.9 | 173.5 | 176.5 | 0 | 0 | 0 | 0 | 112.1 | V65 S69 S71 Y72 V77 I78 W79 Y285 | V65-S75 VanDerWaalsContact CG1-OG 3.25Å; V65-S75 WeakPolarHBondContact CG1-OG 3.29Å; S69-S75 WeakPolarHBondContact OG-CB 3.41Å; S71-S75 WeakPolarHBondContact O-CB 3.32Å; S71-S75 PolarHBondContact O-N 3.25Å; Y72-S75 WeakPolarHBondContact O-CB 3.34Å; Y72-S75 PolarHBondContact O-N 3.04Å; S75-V77 VanDerWaalsContact C-N 3.3Å; S75-V77 PolarHBondContact O-N 3.2Å; S75-I78 WeakPolarHBondContact O-CB 3.24Å; S75-I78 PolarHBondContact O-N 2.94Å; S75-I78 VanDerWaalsContact O-N 3.1Å; S75-W79 PolarHBondContact O-N 3.41Å; S75-Y285 WeakPolarHBondContact CB-OH 3.23Å; S75-Y285 PolarHBondContact OG-OH 2.62Å |
| 76 | L | 96.8 | Very high | 95.3 | Very high | 34 Ų | 34 | 29.2 Ų | 29.2 | 18% | 0.178 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.5 | -36.9 | 179.1 | -68.6 | 175.1 | 0 | 0 | 0 | 112.5 | Y72 G73 L74 W79 A80 F217 N281 V282 Y285 | Y72-L76 WeakPolarHBondContact O-CG 3.3Å; Y72-L76 PolarHBondContact O-N 2.83Å; G73-L76 PolarHBondContact O-N 3.43Å; L74-L76 PolarHBondContact O-N 3.14Å; L76-W79 PolarHBondContact O-N 3.22Å; L76-A80 PolarHBondContact O-N 3.28Å; L76-F217 HydrophobicContact CD1-CE1 4.48Å; L76-N281 HydrophobicContact CD2-CB 3.75Å; L76-V282 HydrophobicContact CD1-CG2 3.94Å; L76-V282 HydrophobicContact CD2-CG2 3.86Å; L76-Y285 HydrophobicContact CD1-CD2 4.46Å; L76-Y285 HydrophobicContact CD2-CD2 4.23Å; L76-Y285 HydrophobicContact CD2-CE2 3.97Å; L76-Y285 HydrophobicContact CG-CD2 4.25Å; L76-Y285 HydrophobicContact CG-CE2 4.03Å |
| 77 | V | 96.9 | Very high | 95.2 | Very high | 60 Ų | 60 | 30.7 Ų | 30.7 | 36% | 0.364 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -63.3 | -42.7 | 173.5 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | G73 L74 S75 W79 A80 I81 F221 | G73-V77 WeakPolarHBondContact O-CG2 3.5Å; G73-V77 PolarHBondContact O-N 3.45Å; G73-V77 VanDerWaalsContact O-N 3.16Å; L74-V77 WeakPolarHBondContact O-CB 3.39Å; L74-V77 PolarHBondContact O-N 3.47Å; S75-V77 VanDerWaalsContact C-N 3.3Å; S75-V77 PolarHBondContact O-N 3.2Å; V77-W79 PolarHBondContact O-N 2.83Å; V77-A80 PolarHBondContact O-N 2.8Å; V77-I81 HydrophobicContact CG1-CD1 3.63Å; V77-I81 HydrophobicContact CG1-CG1 4.24Å; V77-I81 WeakPolarHBondContact O-CB 3.36Å; V77-I81 VanDerWaalsContact O-CG1 3.3Å; V77-I81 WeakPolarHBondContact O-CG1 3.41Å; V77-I81 PolarHBondContact O-N 2.94Å; V77-F221 HydrophobicContact CG2-CE1 4.27Å; V77-F221 HydrophobicContact CG2-CZ 4.5Å |
| 78 | I | 97.2 | Very high | 95.2 | Very high | 3 Ų | 3 | 28.1 Ų | 28.1 | 2% | 0.015 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.5 | -41.6 | 177.6 | -71.9 | 159.2 | 0 | 0 | 0 | 111.2 | V65 L74 S75 A80 I81 G82 A234 L235 A238 | V65-I78 HydrophobicContact CG1-CB 4.21Å; V65-I78 HydrophobicContact CG1-CG2 3.97Å; L74-I78 HydrophobicContact CD1-CD1 4.18Å; L74-I78 HydrophobicContact CD1-CG1 4.34Å; L74-I78 HydrophobicContact CD2-CD1 4.4Å; L74-I78 HydrophobicContact CG-CD1 3.77Å; L74-I78 HydrophobicContact CG-CG1 4.41Å; L74-I78 WeakPolarHBondContact O-CD1 3.28Å; L74-I78 WeakPolarHBondContact O-CG1 3.27Å; L74-I78 PolarHBondContact O-N 3.34Å; S75-I78 WeakPolarHBondContact O-CB 3.24Å; S75-I78 PolarHBondContact O-N 2.94Å; S75-I78 VanDerWaalsContact O-N 3.1Å; I78-A80 PolarHBondContact O-N 3.49Å; I78-I81 PolarHBondContact O-N 2.88Å; I78-G82 PolarHBondContact O-N 3.06Å; I78-A234 HydrophobicContact CD1-CB 3.65Å; I78-A234 HydrophobicContact CG2-CB 4.14Å; I78-L235 HydrophobicContact CG2-CD2 3.95Å; I78-L235 HydrophobicContact CG2-CG 4.12Å; I78-A238 HydrophobicContact CG2-CB 4.08Å |
| 79 | W | 97.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.4 | -45.5 | 172.4 | -80.9 | 102.5 | 0 | 0 | 0 | 112 | I58 P62 V65 S75 L76 V77 G82 G83 A238 S241 Y242 Y277 I278 N281 | I58-W79 HydrophobicContact CD1-CH2 3.51Å; I58-W79 HydrophobicContact CD1-CZ2 4.07Å; I58-W79 HydrophobicContact CD1-CZ3 3.93Å; P62-W79 HydrophobicContact CG-CZ2 4.22Å; V65-W79 HydrophobicContact CG2-CZ2 4.24Å; S75-W79 PolarHBondContact O-N 3.41Å; L76-W79 PolarHBondContact O-N 3.22Å; V77-W79 PolarHBondContact O-N 2.83Å; W79-G82 PolarHBondContact O-N 2.77Å; W79-G83 PolarHBondContact O-N 3.48Å; W79-A238 HydrophobicContact CD2-CB 4.33Å; W79-A238 HydrophobicContact CE3-CB 4.34Å; W79-S241 WeakPolarHBondContact CH2-OG 3.21Å; W79-Y242 AromaticContact CE3-CE2 3.64Å; W79-Y242 HydrophobicContact CE3-CE2 3.64Å; W79-Y242 HydrophobicContact CZ3-CE2 4.05Å; W79-Y242 WeakPolarHBondContact O-CE2 3.14Å; W79-Y242 PolarHBondContact O-OH 3.14Å; W79-Y277 AromaticContact CE3-CD2 3.96Å; W79-Y277 HydrophobicContact CE3-CD2 3.96Å; W79-Y277 HydrophobicContact CE3-CG 4.31Å; W79-Y277 HydrophobicContact CH2-CD2 4.49Å; W79-Y277 AromaticContact CZ3-CD2 3.45Å; W79-Y277 HydrophobicContact CZ3-CD2 3.45Å; W79-Y277 VanDerWaalsContact CZ3-CD2 3.45Å; W79-Y277 HydrophobicContact CZ3-CE2 4.13Å; W79-Y277 AromaticContact CZ3-CG 3.92Å; W79-Y277 HydrophobicContact CZ3-CG 3.92Å; W79-I278 HydrophobicContact CB-CG1 4.33Å; W79-N281 WeakPolarHBondContact CZ2-ND2 3.26Å; W79-N281 PolarHBondContact NE1-ND2 3.02Å; W79-N281 PolarHBondContact NE1-OD1 3.19Å |
| 80 | A | 96.9 | Very high | 95 | Very high | 41 Ų | 41 | 26 Ų | 26 | 34% | 0.339 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -64 | -44 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | L76 V77 I78 G83 L84 I278 | L76-A80 PolarHBondContact O-N 3.28Å; V77-A80 PolarHBondContact O-N 2.8Å; I78-A80 PolarHBondContact O-N 3.49Å; A80-G83 PolarHBondContact O-N 3.47Å; A80-L84 PolarHBondContact O-N 3.39Å; A80-I278 HydrophobicContact CB-CD1 3.97Å |
| 81 | I | 96.1 | Very high | 94.9 | Very high | 86 Ų | 86 | 24.9 Ų | 24.9 | 44% | 0.441 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -63.6 | -42.6 | 175.8 | -69.2 | 171.5 | 0 | 0 | 0 | 110.4 | V77 I78 G83 L84 F85 L235 | V77-I81 HydrophobicContact CG1-CD1 3.63Å; V77-I81 HydrophobicContact CG1-CG1 4.24Å; V77-I81 WeakPolarHBondContact O-CB 3.36Å; V77-I81 VanDerWaalsContact O-CG1 3.3Å; V77-I81 WeakPolarHBondContact O-CG1 3.41Å; V77-I81 PolarHBondContact O-N 2.94Å; I78-I81 PolarHBondContact O-N 2.88Å; I81-G83 PolarHBondContact O-N 2.79Å; I81-L84 PolarHBondContact O-N 2.82Å; I81-F85 WeakPolarHBondContact O-CB 3.41Å; I81-F85 PolarHBondContact O-N 3.41Å; I81-L235 HydrophobicContact CG2-CD2 4.06Å |
| 82 | G | 95.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61 | -42.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I78 W79 S86 L239 | I78-G82 PolarHBondContact O-N 3.06Å; W79-G82 PolarHBondContact O-N 2.77Å; G82-S86 WeakPolarHBondContact O-CB 3.39Å; G82-S86 PolarHBondContact O-N 3.43Å; G82-S86 PolarHBondContact O-OG 3.2Å; G82-L239 WeakPolarHBondContact O-CD2 3.24Å |
| 83 | G | 94.6 | Very high | 94.8 | Very high | 1 Ų | 1 | 23 Ų | 23 | 1% | 0.01 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63.4 | -46.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | W79 A80 I81 S86 V87 | W79-G83 PolarHBondContact O-N 3.48Å; A80-G83 PolarHBondContact O-N 3.47Å; I81-G83 PolarHBondContact O-N 2.79Å; G83-S86 PolarHBondContact O-N 2.96Å; G83-V87 WeakPolarHBondContact O-CG2 3.45Å; G83-V87 PolarHBondContact O-N 3.36Å |
| 84 | L | 94.6 | Very high | 94.6 | Very high | 115 Ų | 115 | 22.8 Ų | 22.8 | 60% | 0.602 | 13% | 0.129 | S | C | * | . | H | α-helix | trans | -62 | -46.2 | 177.6 | -179.9 | 62.4 | 0 | 0 | 0 | 112 | A80 I81 S86 V87 V88 | A80-L84 PolarHBondContact O-N 3.39Å; I81-L84 PolarHBondContact O-N 2.82Å; L84-S86 VanDerWaalsContact C-N 3.29Å; L84-S86 PolarHBondContact O-N 3.06Å; L84-V87 WeakPolarHBondContact O-CB 3.42Å; L84-V87 PolarHBondContact O-N 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.43Å; L84-V88 PolarHBondContact O-N 2.96Å; L84-V88 VanDerWaalsContact O-N 3.11Å |
| 85 | F | 94.4 | Very high | 94.4 | Very high | 18 Ų | 18 | 21.5 Ų | 21.5 | 8% | 0.079 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -59.2 | -41.8 | 175.9 | 172.9 | -110.6 | 0 | 0 | 0 | 111.6 | I81 V87 V88 G89 L239 W393 F427 C430 L434 | I81-F85 WeakPolarHBondContact O-CB 3.41Å; I81-F85 PolarHBondContact O-N 3.41Å; F85-V87 PolarHBondContact O-N 3.21Å; F85-V88 PolarHBondContact O-N 3.24Å; F85-G89 PolarHBondContact O-N 3.49Å; F85-L239 HydrophobicContact CD1-CD1 3.85Å; F85-L239 HydrophobicContact CD1-CD2 3.62Å; F85-L239 HydrophobicContact CD1-CG 4.41Å; F85-L239 HydrophobicContact CE1-CD1 3.88Å; F85-L239 HydrophobicContact CE1-CD2 4.26Å; F85-W393 HydrophobicContact CD1-CH2 4.39Å; F85-W393 HydrophobicContact CD1-CZ3 4.35Å; F85-W393 HydrophobicContact CE1-CD2 4.2Å; F85-W393 AromaticContact CE1-CE3 3.64Å; F85-W393 HydrophobicContact CE1-CE3 3.64Å; F85-W393 AromaticContact CE1-CH2 3.77Å; F85-W393 HydrophobicContact CE1-CH2 3.77Å; F85-W393 HydrophobicContact CE1-CZ2 4.33Å; F85-W393 AromaticContact CE1-CZ3 3.38Å; F85-W393 HydrophobicContact CE1-CZ3 3.38Å; F85-W393 AromaticContact CZ-CE3 3.94Å; F85-W393 HydrophobicContact CZ-CE3 3.94Å; F85-W393 AromaticContact CZ-CZ3 3.91Å; F85-W393 HydrophobicContact CZ-CZ3 3.91Å; F85-F427 HydrophobicContact CD2-CD2 4.02Å; F85-F427 HydrophobicContact CD2-CE2 4.29Å; F85-F427 AromaticContact CE1-CE2 3.99Å; F85-F427 HydrophobicContact CE1-CE2 3.99Å; F85-F427 AromaticContact CE2-CD2 3.34Å; F85-F427 HydrophobicContact CE2-CD2 3.34Å; F85-F427 AromaticContact CE2-CE2 3.49Å; F85-F427 HydrophobicContact CE2-CE2 3.49Å; F85-F427 VanDerWaalsContact CE2-CE2 3.49Å; F85-F427 HydrophobicContact CE2-CG 4.14Å; F85-F427 HydrophobicContact CE2-CZ 4.4Å; F85-F427 AromaticContact CZ-CD2 3.73Å; F85-F427 HydrophobicContact CZ-CD2 3.73Å; F85-F427 AromaticContact CZ-CE2 3.34Å; F85-F427 HydrophobicContact CZ-CE2 3.34Å; F85-F427 AromaticContact CZ-CZ 3.96Å; F85-F427 HydrophobicContact CZ-CZ 3.96Å; F85-C430 HydrophobicContact CD2-CB 3.55Å; F85-C430 HydrophobicContact CE2-CB 3.25Å; F85-C430 HydrophobicContact CZ-CB 4.16Å; F85-L434 HydrophobicContact CD1-CD1 4.42Å; F85-L434 HydrophobicContact CE1-CD1 3.62Å; F85-L434 HydrophobicContact CZ-CD1 3.81Å |
| 86 | S | 93.4 | Very high | 94.2 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -65.6 | -36.5 | 177.1 | -57.4 | 0 | 0 | 0 | 0 | 112.4 | G82 G83 L84 G89 A90 Y242 | G82-S86 WeakPolarHBondContact O-CB 3.39Å; G82-S86 PolarHBondContact O-N 3.43Å; G82-S86 PolarHBondContact O-OG 3.2Å; G83-S86 PolarHBondContact O-N 2.96Å; L84-S86 VanDerWaalsContact C-N 3.29Å; L84-S86 PolarHBondContact O-N 3.06Å; S86-G89 PolarHBondContact O-N 3.32Å; S86-A90 VanDerWaalsContact O-CB 3.27Å; S86-A90 WeakPolarHBondContact O-CB 3.17Å; S86-A90 PolarHBondContact O-N 3.43Å; S86-Y242 WeakPolarHBondContact OG-CB 3.44Å |
| 87 | V | 92.8 | Very high | 93.7 | Very high | 39 Ų | 39 | 20 Ų | 20 | 24% | 0.236 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -60.2 | -47.3 | 173.1 | 171.1 | 0 | 0 | 0 | 0 | 110.4 | G83 L84 F85 G89 A90 L91 M270 | G83-V87 WeakPolarHBondContact O-CG2 3.45Å; G83-V87 PolarHBondContact O-N 3.36Å; L84-V87 WeakPolarHBondContact O-CB 3.42Å; L84-V87 PolarHBondContact O-N 3.29Å; F85-V87 PolarHBondContact O-N 3.21Å; V87-G89 VanDerWaalsContact C-N 3.33Å; V87-G89 PolarHBondContact O-N 3.34Å; V87-A90 PolarHBondContact O-N 3.42Å; V87-L91 HydrophobicContact CG1-CD1 4.01Å; V87-L91 HydrophobicContact CG1-CG 4.45Å; V87-L91 WeakPolarHBondContact O-CB 3.44Å; V87-L91 VanDerWaalsContact O-CG 3.3Å; V87-L91 WeakPolarHBondContact O-CG 3.38Å; V87-L91 PolarHBondContact O-N 3.43Å; V87-M270 HydrophobicContact CG2-CB 3.56Å; V87-M270 HydrophobicContact CG2-CE 4.31Å; V87-M270 HydrophobicContact CG2-CG 4.27Å |
| 88 | V | 93.6 | Very high | 93.4 | Very high | 19 Ų | 19 | 17.6 Ų | 17.6 | 12% | 0.115 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -60.5 | -45.2 | 178.9 | 176.9 | 0 | 0 | 0 | 0 | 110.5 | L84 F85 L91 C92 Y423 F427 | L84-V88 WeakPolarHBondContact O-CG2 3.43Å; L84-V88 PolarHBondContact O-N 2.96Å; L84-V88 VanDerWaalsContact O-N 3.11Å; F85-V88 PolarHBondContact O-N 3.24Å; V88-L91 PolarHBondContact O-N 3.31Å; V88-C92 PolarHBondContact O-N 2.87Å; V88-C92 VanDerWaalsContact O-N 3.13Å; V88-C92 PolarHBondContact O-SG 2.81Å; V88-Y423 HydrophobicContact CG1-CD1 4.2Å; V88-Y423 WeakPolarHBondContact CG1-O 3.02Å; V88-Y423 HydrophobicContact CG2-CD1 4.43Å; V88-F427 HydrophobicContact CG1-CB 4.04Å |
| 89 | G | 93 | Very high | 93 | Very high | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -61.1 | -48.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | F85 S86 V87 L91 C92 Y93 W245 | F85-G89 PolarHBondContact O-N 3.49Å; S86-G89 PolarHBondContact O-N 3.32Å; V87-G89 VanDerWaalsContact C-N 3.33Å; V87-G89 PolarHBondContact O-N 3.34Å; G89-L91 VanDerWaalsContact C-N 3.33Å; G89-L91 PolarHBondContact O-N 2.81Å; G89-C92 WeakPolarHBondContact O-CB 3.49Å; G89-C92 PolarHBondContact O-N 2.92Å; G89-C92 VanDerWaalsContact O-N 3.15Å; G89-Y93 PolarHBondContact O-N 2.93Å; G89-W245 VanDerWaalsContact C-CH2 3.5Å |
| 90 | A | 92.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.2 | -39.1 | 180 | 0 | 0 | 0 | 0 | 0 | 112.1 | S86 V87 Y93 A94 W245 I266 M270 | S86-A90 VanDerWaalsContact O-CB 3.27Å; S86-A90 WeakPolarHBondContact O-CB 3.17Å; S86-A90 PolarHBondContact O-N 3.43Å; V87-A90 PolarHBondContact O-N 3.42Å; A90-Y93 CarbonylContact O-C 3.6Å; A90-Y93 PolarHBondContact O-N 2.84Å; A90-A94 WeakPolarHBondContact O-CB 3.15Å; A90-A94 PolarHBondContact O-N 3.44Å; A90-W245 VanDerWaalsContact CA-CE3 3.44Å; A90-W245 HydrophobicContact CB-CB 4.28Å; A90-W245 HydrophobicContact CB-CD2 3.8Å; A90-W245 HydrophobicContact CB-CE3 3.59Å; A90-W245 HydrophobicContact CB-CG 4.11Å; A90-W245 HydrophobicContact CB-CZ3 4.2Å; A90-I266 HydrophobicContact CB-CD1 4.34Å; A90-I266 HydrophobicContact CB-CG1 4.43Å; A90-I266 HydrophobicContact CB-CG2 3.41Å; A90-I266 VanDerWaalsContact CB-CG2 3.41Å; A90-M270 HydrophobicContact CB-CG 4.34Å; A90-M270 HydrophobicContact CB-SD 4.37Å |
| 91 | L | 91.9 | Very high | 91.7 | Very high | 35 Ų | 35 | 20.2 Ų | 20.2 | 18% | 0.183 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -62.8 | -44.8 | 173.4 | -72 | 173.4 | 0 | 0 | 0 | 111.9 | V87 V88 G89 Y93 A94 E95 L419 Y423 | V87-L91 HydrophobicContact CG1-CD1 4.01Å; V87-L91 HydrophobicContact CG1-CG 4.45Å; V87-L91 WeakPolarHBondContact O-CB 3.44Å; V87-L91 VanDerWaalsContact O-CG 3.3Å; V87-L91 WeakPolarHBondContact O-CG 3.38Å; V87-L91 PolarHBondContact O-N 3.43Å; V88-L91 PolarHBondContact O-N 3.31Å; G89-L91 VanDerWaalsContact C-N 3.33Å; G89-L91 PolarHBondContact O-N 2.81Å; L91-Y93 VanDerWaalsContact C-N 3.29Å; L91-Y93 PolarHBondContact O-N 2.95Å; L91-A94 WeakPolarHBondContact O-CB 3.44Å; L91-A94 PolarHBondContact O-N 2.9Å; L91-A94 VanDerWaalsContact O-N 3.11Å; L91-E95 PolarHBondContact O-N 3.38Å; L91-L419 VanDerWaalsContact C-CD1 3.41Å; L91-L419 HydrophobicContact CB-CD1 3.77Å; L91-L419 WeakPolarHBondContact O-CD1 3.33Å; L91-Y423 HydrophobicContact CD1-CD1 4.42Å; L91-Y423 HydrophobicContact CD1-CE1 4.21Å |
| 92 | C | 93.7 | Very high | 90.8 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -60.2 | -41.7 | 176.1 | -63.1 | 0 | 0 | 0 | 0 | 111.5 | V88 G89 E95 L96 V400 Q403 | V88-C92 PolarHBondContact O-N 2.87Å; V88-C92 VanDerWaalsContact O-N 3.13Å; V88-C92 PolarHBondContact O-SG 2.81Å; G89-C92 WeakPolarHBondContact O-CB 3.49Å; G89-C92 PolarHBondContact O-N 2.92Å; G89-C92 VanDerWaalsContact O-N 3.15Å; C92-E95 WeakPolarHBondContact O-CB 3.42Å; C92-E95 PolarHBondContact O-N 2.79Å; C92-L96 PolarHBondContact O-N 2.92Å; C92-V400 HydrophobicContact CB-CG1 4.06Å; C92-V400 HydrophobicContact CB-CG2 3.93Å; C92-Q403 PolarHBondContact O-OE1 3.34Å |
| 93 | Y | 92.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -67.6 | -32.3 | 174.2 | -93.7 | -113.3 | 0 | 0 | 0 | 113.4 | G89 A90 L91 E95 L96 G97 S106 Y109 W245 D246 N249 M396 S399 V400 | G89-Y93 PolarHBondContact O-N 2.93Å; A90-Y93 CarbonylContact O-C 3.6Å; A90-Y93 PolarHBondContact O-N 2.84Å; L91-Y93 VanDerWaalsContact C-N 3.29Å; L91-Y93 PolarHBondContact O-N 2.95Å; Y93-E95 VanDerWaalsContact C-N 3.26Å; Y93-E95 PolarHBondContact O-N 3.28Å; Y93-L96 PolarHBondContact O-N 3.47Å; Y93-G97 PolarHBondContact O-N 3.39Å; Y93-S106 WeakPolarHBondContact CE1-OG 3.5Å; Y93-S106 PolarHBondContact OH-OG 3.43Å; Y93-Y109 HydrophobicContact CD1-CD2 4.37Å; Y93-Y109 AromaticContact CD1-CE2 3.83Å; Y93-Y109 HydrophobicContact CD1-CE2 3.83Å; Y93-Y109 HydrophobicContact CE1-CD2 4.07Å; Y93-Y109 AromaticContact CE1-CE2 3.91Å; Y93-Y109 HydrophobicContact CE1-CE2 3.91Å; Y93-W245 AromaticContact CD1-CZ3 3.94Å; Y93-W245 HydrophobicContact CD1-CZ3 3.94Å; Y93-W245 AromaticContact CD2-CH2 3.61Å; Y93-W245 HydrophobicContact CD2-CH2 3.61Å; Y93-W245 AromaticContact CD2-CZ3 3.64Å; Y93-W245 HydrophobicContact CD2-CZ3 3.64Å; Y93-W245 AromaticContact CE2-CH2 3.98Å; Y93-W245 HydrophobicContact CE2-CH2 3.98Å; Y93-W245 HydrophobicContact CE2-CZ3 4.31Å; Y93-W245 AromaticContact CG-CH2 3.94Å; Y93-W245 HydrophobicContact CG-CH2 3.94Å; Y93-W245 AromaticContact CG-CZ3 3.44Å; Y93-W245 HydrophobicContact CG-CZ3 3.44Å; Y93-W245 VanDerWaalsContact CG-CZ3 3.44Å; Y93-D246 HydrophobicContact CD1-CB 4.17Å; Y93-D246 HydrophobicContact CE1-CB 4.32Å; Y93-N249 PolarHBondContact O-ND2 3.41Å; Y93-M396 HydrophobicContact CD1-CE 4.39Å; Y93-M396 HydrophobicContact CD2-CE 4.24Å; Y93-M396 HydrophobicContact CE1-CE 3.73Å; Y93-M396 HydrophobicContact CE1-SD 4.24Å; Y93-M396 HydrophobicContact CE2-CE 3.56Å; Y93-M396 HydrophobicContact CE2-SD 4.3Å; Y93-M396 WeakPolarHBondContact OH-CE 3.39Å; Y93-M396 PolarHBondContact OH-SD 3.44Å; Y93-S399 WeakPolarHBondContact OH-CB 3.42Å; Y93-S399 PolarHBondContact OH-OG 3.43Å; Y93-V400 HydrophobicContact CD2-CG2 4.03Å; Y93-V400 HydrophobicContact CE2-CG2 3.78Å |
| 94 | A | 90.9 | Very high | 88.5 | Confident | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -61.6 | -38.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | A90 L91 T98 L262 P263 I266 L417 | A90-A94 WeakPolarHBondContact O-CB 3.15Å; A90-A94 PolarHBondContact O-N 3.44Å; L91-A94 WeakPolarHBondContact O-CB 3.44Å; L91-A94 PolarHBondContact O-N 2.9Å; L91-A94 VanDerWaalsContact O-N 3.11Å; A94-T98 WeakPolarHBondContact O-CB 3.46Å; A94-T98 VanDerWaalsContact O-CG2 3.28Å; A94-T98 WeakPolarHBondContact O-CG2 3.39Å; A94-T98 PolarHBondContact O-N 3.48Å; A94-T98 PolarHBondContact O-OG1 3.42Å; A94-L262 HydrophobicContact CB-CG 4.48Å; A94-P263 HydrophobicContact CB-CB 4.47Å; A94-P263 HydrophobicContact CB-CG 4.3Å; A94-I266 HydrophobicContact CB-CD1 3.81Å; A94-L417 HydrophobicContact CB-CD2 3.74Å |
| 95 | E | 91.9 | Very high | 87.9 | Confident | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.005 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66.9 | -45.7 | 173.3 | 170.4 | 170.3 | 154.1 | 0 | 0 | 111.6 | L91 C92 Y93 G97 T98 T99 Q403 R407 L417 L419 | L91-E95 PolarHBondContact O-N 3.38Å; C92-E95 WeakPolarHBondContact O-CB 3.42Å; C92-E95 PolarHBondContact O-N 2.79Å; Y93-E95 VanDerWaalsContact C-N 3.26Å; Y93-E95 PolarHBondContact O-N 3.28Å; E95-G97 PolarHBondContact O-N 3.41Å; E95-T98 WeakPolarHBondContact CA-OG1 3.34Å; E95-T98 PolarHBondContact O-N 2.97Å; E95-T98 PolarHBondContact O-OG1 3.34Å; E95-T99 VanDerWaalsContact O-CB 3.31Å; E95-T99 WeakPolarHBondContact O-CB 3.35Å; E95-T99 PolarHBondContact O-N 3.29Å; E95-T99 PolarHBondContact O-OG1 3.23Å; E95-Q403 PolarHBondContact OE1-NE2 3.48Å; E95-Q403 PolarHBondContact OE2-NE2 3.4Å; E95-R407 IonicContact OE1-CZ 3.48Å; E95-R407 VanDerWaalsContact OE1-CZ 3.24Å; E95-R407 IonicContact OE1-NE 3.83Å; E95-R407 PolarHBondContact OE1-NE 3.36Å; E95-R407 IonicContact OE1-NH2 2.86Å; E95-R407 PolarHBondContact OE1-NH2 3.17Å; E95-R407 IonicContact OE2-CZ 2.82Å; E95-R407 IonicContact OE2-NH2 3.14Å; E95-R407 PolarHBondContact OE2-NH2 3.36Å; E95-L417 HydrophobicContact CB-CD2 4.21Å; E95-L417 WeakPolarHBondContact CG-O 3.44Å; E95-L419 HydrophobicContact CB-CD1 4.49Å; E95-L419 WeakPolarHBondContact OE2-CB 3.47Å; E95-L419 PolarHBondContact OE2-N 3.47Å |
| 96 | L | 91.6 | Very high | 87.6 | Confident | 3 Ų | 3 | 17 Ų | 17 | 2% | 0.016 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -60.6 | -44.3 | 176.6 | -77.4 | 171.1 | 0 | 0 | 0 | 112 | C92 Y93 T98 T99 I100 Y109 Q403 | C92-L96 PolarHBondContact O-N 2.92Å; Y93-L96 PolarHBondContact O-N 3.47Å; L96-T98 PolarHBondContact O-N 2.96Å; L96-T99 PolarHBondContact O-N 3.1Å; L96-I100 HydrophobicContact CD2-CD1 4.36Å; L96-I100 PolarHBondContact O-N 3.49Å; L96-Y109 HydrophobicContact CB-CD1 4.37Å; L96-Y109 HydrophobicContact CB-CD2 3.88Å; L96-Y109 HydrophobicContact CB-CE1 4.32Å; L96-Y109 HydrophobicContact CB-CE2 3.8Å; L96-Y109 HydrophobicContact CB-CG 4.18Å; L96-Y109 HydrophobicContact CD1-CD2 3.89Å; L96-Y109 HydrophobicContact CD1-CE2 4.47Å; L96-Y109 HydrophobicContact CD1-CG 4.33Å; L96-Y109 HydrophobicContact CG-CD2 4.42Å; L96-Q403 HydrophobicContact CD1-CB 4.22Å; L96-Q403 HydrophobicContact CD2-CB 3.7Å; L96-Q403 HydrophobicContact CD2-CG 3.91Å; L96-Q403 HydrophobicContact CG-CB 3.99Å; L96-Q403 HydrophobicContact CG-CG 4.05Å |
| 97 | G | 87.9 | Confident | 87.4 | Confident | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -68.9 | -30.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y93 E95 Y109 | Y93-G97 PolarHBondContact O-N 3.39Å; E95-G97 PolarHBondContact O-N 3.41Å; G97-Y109 WeakPolarHBondContact CA-OH 3.3Å; G97-Y109 PolarHBondContact N-OH 3.18Å |
| 98 | T | 89.2 | Confident | 87.1 | Confident | 8 Ų | 8 | 15.7 Ų | 15.7 | 5% | 0.049 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -79.4 | -22.6 | 172.7 | 52.2 | 0 | 0 | 0 | 0 | 113 | A94 E95 L96 L262 L417 | A94-T98 WeakPolarHBondContact O-CB 3.46Å; A94-T98 VanDerWaalsContact O-CG2 3.28Å; A94-T98 WeakPolarHBondContact O-CG2 3.39Å; A94-T98 PolarHBondContact O-N 3.48Å; A94-T98 PolarHBondContact O-OG1 3.42Å; E95-T98 WeakPolarHBondContact CA-OG1 3.34Å; E95-T98 PolarHBondContact O-N 2.97Å; E95-T98 PolarHBondContact O-OG1 3.34Å; L96-T98 PolarHBondContact O-N 2.96Å; T98-L262 HydrophobicContact CG2-CD2 4.29Å; T98-L417 HydrophobicContact CG2-CB 4.48Å; T98-L417 WeakPolarHBondContact OG1-CB 3.21Å |
| 99 | T | 89.6 | Confident | 87 | Confident | 19 Ų | 19 | 14.8 Ų | 14.8 | 12% | 0.117 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -91.1 | -36.3 | 179 | -55.2 | 0 | 0 | 0 | 0 | 112.9 | E95 L96 R413 R415 | E95-T99 VanDerWaalsContact O-CB 3.31Å; E95-T99 WeakPolarHBondContact O-CB 3.35Å; E95-T99 PolarHBondContact O-N 3.29Å; E95-T99 PolarHBondContact O-OG1 3.23Å; L96-T99 PolarHBondContact O-N 3.1Å; T99-R413 HydrophobicContact CG2-CG 4.19Å; T99-R415 HydrophobicContact CG2-CG 4.04Å |
| 100 | I | 87.3 | Confident | 87.1 | Confident | 3 Ų | 3 | 14.8 Ų | 14.8 | 2% | 0.015 | 8% | 0.083 | C | C | . | . | trans | -121.5 | 89.8 | -179.6 | -53.2 | 170.4 | 0 | 0 | 0 | 106.7 | L96 K102 Y109 E112 L406 | L96-I100 HydrophobicContact CD2-CD1 4.36Å; L96-I100 PolarHBondContact O-N 3.49Å; I100-K102 HydrophobicContact CG2-CB 4.25Å; I100-K102 HydrophobicContact CG2-CG 4.43Å; I100-K102 PolarHBondContact O-N 3.16Å; I100-Y109 HydrophobicContact CB-CD1 3.85Å; I100-Y109 HydrophobicContact CB-CE1 3.91Å; I100-Y109 HydrophobicContact CD1-CD1 3.9Å; I100-Y109 HydrophobicContact CG1-CD1 4.45Å; I100-Y109 HydrophobicContact CG2-CD1 4Å; I100-Y109 HydrophobicContact CG2-CE1 4.22Å; I100-Y109 WeakPolarHBondContact O-CE1 3.43Å; I100-E112 HydrophobicContact CD1-CB 4.03Å; I100-E112 HydrophobicContact CD1-CG 4Å; I100-E112 HydrophobicContact CG1-CG 4.43Å; I100-L406 HydrophobicContact CD1-CD1 3.9Å | ||
| 101 | T | 79.1 | Confident | 87 | Confident | 78 Ų | 78 | 16.6 Ų | 16.6 | 48% | 0.479 | 9% | 0.092 | S | C | . | . | trans | -82 | 14.1 | -176.7 | 61.9 | 0 | 0 | 0 | 0 | 113.3 | E253 | T101-E253 WeakPolarHBondContact O-CG 3.17Š| ||
| 102 | K | 77.2 | Confident | 87 | Confident | 107 Ų | 107 | 17.8 Ų | 17.8 | 47% | 0.465 | 10% | 0.097 | S | C | . | . | trans | -74.1 | 136.7 | 176.3 | -67.5 | 178.5 | 179.8 | 169.3 | 0 | 109.5 | I100 A108 E112 | I100-K102 HydrophobicContact CG2-CB 4.25Å; I100-K102 HydrophobicContact CG2-CG 4.43Å; I100-K102 PolarHBondContact O-N 3.16Å; K102-A108 HydrophobicContact CB-CB 4.25Å; K102-E112 IonicContact NZ-OE2 3.74Å; K102-E112 PolarHBondContact NZ-OE2 3.25Å | ||
| 103 | S | 69.9 | Low | 86.9 | Confident | 40 Ų | 40 | 18.1 Ų | 18.1 | 28% | 0.28 | 10% | 0.099 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | 141.9 | 172.6 | -61.6 | 0 | 0 | 0 | 0 | 112.2 | E253 | S103-E253 PolarHBondContact N-OE1 3.17Å; S103-E253 PolarHBondContact OG-OE1 3.34Å |
| 104 | G | 71.9 | Confident | 87 | Confident | 6 Ų | 6 | 21.8 Ų | 21.8 | 6% | 0.062 | 12% | 0.115 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 121.2 | -1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | S106 Y107 | G104-S106 PolarHBondContact O-N 3.05Å; G104-Y107 WeakPolarHBondContact O-CB 3.49Å; G104-Y107 PolarHBondContact O-N 2.93Å; G104-Y107 VanDerWaalsContact O-N 3.11Å |
| 105 | A | 82.8 | Confident | 87 | Confident | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 13% | 0.13 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 44.4 | -120.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y107 A108 Y109 N249 F250 | A105-Y107 PolarHBondContact O-N 3.47Å; A105-Y107 VanDerWaalsContact O-N 3.14Å; A105-A108 PolarHBondContact O-N 3.43Å; A105-Y109 HydrophobicContact CB-CE2 4.43Å; A105-Y109 WeakPolarHBondContact O-CD1 3.41Å; A105-Y109 VanDerWaalsContact O-CD2 3.31Å; A105-Y109 WeakPolarHBondContact O-CD2 3.33Å; A105-Y109 PolarHBondContact O-N 2.91Å; A105-N249 HydrophobicContact CB-CB 3.81Å; A105-F250 HydrophobicContact CB-CD1 3.71Å; A105-F250 HydrophobicContact CB-CD2 3.61Å; A105-F250 HydrophobicContact CB-CE1 3.63Å; A105-F250 HydrophobicContact CB-CE2 3.54Å; A105-F250 HydrophobicContact CB-CG 3.72Å; A105-F250 HydrophobicContact CB-CZ 3.56Å |
| 106 | S | 86.8 | Confident | 86.9 | Confident | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -52.3 | -37.4 | -177.4 | -56.7 | 0 | 0 | 0 | 0 | 113.6 | Y93 G104 I110 | Y93-S106 WeakPolarHBondContact CE1-OG 3.5Å; Y93-S106 PolarHBondContact OH-OG 3.43Å; G104-S106 PolarHBondContact O-N 3.05Å; S106-I110 WeakPolarHBondContact O-CB 3.26Å; S106-I110 WeakPolarHBondContact O-CD1 3.29Å; S106-I110 VanDerWaalsContact O-CG1 3.26Å; S106-I110 WeakPolarHBondContact O-CG1 3.38Å; S106-I110 PolarHBondContact O-N 3.04Å |
| 107 | Y | 89.2 | Confident | 87 | Confident | 4 Ų | 4 | 27.2 Ų | 27.2 | 2% | 0.016 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.7 | -48.4 | 176.4 | 168.4 | -101.1 | 0 | 0 | 0 | 111.5 | G104 A105 Y109 I110 L111 A119 L123 V340 E344 H346 | G104-Y107 WeakPolarHBondContact O-CB 3.49Å; G104-Y107 PolarHBondContact O-N 2.93Å; G104-Y107 VanDerWaalsContact O-N 3.11Å; A105-Y107 PolarHBondContact O-N 3.47Å; A105-Y107 VanDerWaalsContact O-N 3.14Å; Y107-Y109 VanDerWaalsContact C-N 3.35Å; Y107-Y109 PolarHBondContact O-N 3.32Å; Y107-I110 PolarHBondContact O-N 2.84Å; Y107-L111 HydrophobicContact CE1-CD2 4.23Å; Y107-L111 VanDerWaalsContact O-CB 3.29Å; Y107-L111 WeakPolarHBondContact O-CB 3.48Å; Y107-L111 PolarHBondContact O-N 3.26Å; Y107-A119 HydrophobicContact CD2-CB 4.05Å; Y107-A119 WeakPolarHBondContact CD2-O 3.32Å; Y107-A119 HydrophobicContact CE2-CB 3.74Å; Y107-A119 WeakPolarHBondContact CE2-O 3.31Å; Y107-L123 HydrophobicContact CD2-CB 3.94Å; Y107-L123 HydrophobicContact CE2-CB 4.01Å; Y107-L123 HydrophobicContact CE2-CD2 4.09Å; Y107-V340 HydrophobicContact CE1-CG1 4.4Å; Y107-E344 HydrophobicContact CE1-CG 4.12Å; Y107-E344 VanDerWaalsContact OH-CB 3.3Å; Y107-E344 WeakPolarHBondContact OH-CB 3.44Å; Y107-H346 AromaticContact CE2-ND1 3.78Å; Y107-H346 AromaticContact CZ-ND1 3.72Å; Y107-H346 PolarHBondContact OH-CE1 3.4Å; Y107-H346 PolarHBondContact OH-ND1 3.43Å |
| 108 | A | 87.8 | Confident | 87.3 | Confident | 6 Ų | 6 | 29.6 Ų | 29.6 | 5% | 0.05 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -65.4 | -37.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | K102 A105 L111 E112 | K102-A108 HydrophobicContact CB-CB 4.25Å; A105-A108 PolarHBondContact O-N 3.43Å; A108-L111 PolarHBondContact O-N 3.47Å; A108-E112 WeakPolarHBondContact O-CB 3.41Å; A108-E112 PolarHBondContact O-N 3.03Å |
| 109 | Y | 91.3 | Very high | 87.4 | Confident | 1 Ų | 1 | 29.2 Ų | 29.2 | 0% | 0.004 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -67 | -43.1 | 178.6 | -55.5 | -23.5 | 0 | 0 | 0 | 111.9 | Y93 L96 G97 I100 A105 Y107 S113 N249 | Y93-Y109 HydrophobicContact CD1-CD2 4.37Å; Y93-Y109 AromaticContact CD1-CE2 3.83Å; Y93-Y109 HydrophobicContact CD1-CE2 3.83Å; Y93-Y109 HydrophobicContact CE1-CD2 4.07Å; Y93-Y109 AromaticContact CE1-CE2 3.91Å; Y93-Y109 HydrophobicContact CE1-CE2 3.91Å; L96-Y109 HydrophobicContact CB-CD1 4.37Å; L96-Y109 HydrophobicContact CB-CD2 3.88Å; L96-Y109 HydrophobicContact CB-CE1 4.32Å; L96-Y109 HydrophobicContact CB-CE2 3.8Å; L96-Y109 HydrophobicContact CB-CG 4.18Å; L96-Y109 HydrophobicContact CD1-CD2 3.89Å; L96-Y109 HydrophobicContact CD1-CE2 4.47Å; L96-Y109 HydrophobicContact CD1-CG 4.33Å; L96-Y109 HydrophobicContact CG-CD2 4.42Å; G97-Y109 WeakPolarHBondContact CA-OH 3.3Å; G97-Y109 PolarHBondContact N-OH 3.18Å; I100-Y109 HydrophobicContact CB-CD1 3.85Å; I100-Y109 HydrophobicContact CB-CE1 3.91Å; I100-Y109 HydrophobicContact CD1-CD1 3.9Å; I100-Y109 HydrophobicContact CG1-CD1 4.45Å; I100-Y109 HydrophobicContact CG2-CD1 4Å; I100-Y109 HydrophobicContact CG2-CE1 4.22Å; I100-Y109 WeakPolarHBondContact O-CE1 3.43Å; A105-Y109 HydrophobicContact CB-CE2 4.43Å; A105-Y109 WeakPolarHBondContact O-CD1 3.41Å; A105-Y109 VanDerWaalsContact O-CD2 3.31Å; A105-Y109 WeakPolarHBondContact O-CD2 3.33Å; A105-Y109 PolarHBondContact O-N 2.91Å; Y107-Y109 VanDerWaalsContact C-N 3.35Å; Y107-Y109 PolarHBondContact O-N 3.32Å; Y109-S113 VanDerWaalsContact O-CB 3.29Å; Y109-S113 WeakPolarHBondContact O-CB 3.39Å; Y109-S113 PolarHBondContact O-N 3.41Å; Y109-S113 PolarHBondContact O-OG 2.77Å; Y109-N249 HydrophobicContact CE2-CB 4.46Å; Y109-N249 WeakPolarHBondContact OH-CB 3.09Å; Y109-N249 PolarHBondContact OH-ND2 2.77Å |
| 110 | I | 93.6 | Very high | 87.6 | Confident | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.5 | -40.7 | 175.9 | -71.1 | 170.1 | 0 | 0 | 0 | 110.7 | S106 Y107 E112 S113 F114 G115 I118 A119 R122 F395 L398 S399 | S106-I110 WeakPolarHBondContact O-CB 3.26Å; S106-I110 WeakPolarHBondContact O-CD1 3.29Å; S106-I110 VanDerWaalsContact O-CG1 3.26Å; S106-I110 WeakPolarHBondContact O-CG1 3.38Å; S106-I110 PolarHBondContact O-N 3.04Å; Y107-I110 PolarHBondContact O-N 2.84Å; I110-E112 PolarHBondContact O-N 2.76Å; I110-S113 PolarHBondContact O-N 3.17Å; I110-F114 HydrophobicContact CG2-CD2 4.31Å; I110-F114 PolarHBondContact O-N 3.21Å; I110-G115 PolarHBondContact O-N 3.07Å; I110-I118 HydrophobicContact CG2-CB 3.94Å; I110-I118 HydrophobicContact CG2-CG2 3.52Å; I110-A119 HydrophobicContact CG2-CB 4.22Å; I110-R122 HydrophobicContact CD1-CB 3.99Å; I110-R122 HydrophobicContact CD1-CG 3.86Å; I110-F395 HydrophobicContact CD1-CD1 4.1Å; I110-L398 HydrophobicContact CD1-CD2 4.29Å; I110-L398 HydrophobicContact CD1-CG 4.45Å; I110-S399 WeakPolarHBondContact CD1-OG 3.41Å |
| 111 | L | 91.5 | Very high | 87.9 | Confident | 38 Ų | 38 | 29.2 Ų | 29.2 | 20% | 0.199 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59 | -47 | 177.4 | -178.7 | 60.6 | 0 | 0 | 0 | 111.9 | Y107 A108 G115 A119 | Y107-L111 HydrophobicContact CE1-CD2 4.23Å; Y107-L111 VanDerWaalsContact O-CB 3.29Å; Y107-L111 WeakPolarHBondContact O-CB 3.48Å; Y107-L111 PolarHBondContact O-N 3.26Å; A108-L111 PolarHBondContact O-N 3.47Å; L111-G115 VanDerWaalsContact O-CA 3.24Å; L111-G115 WeakPolarHBondContact O-CA 3.22Å; L111-G115 PolarHBondContact O-N 3.48Å; L111-G115 VanDerWaalsContact O-N 3.07Å; L111-A119 HydrophobicContact CB-CB 3.72Å; L111-A119 HydrophobicContact CD1-CB 3.78Å; L111-A119 HydrophobicContact CG-CB 4.34Å |
| 112 | E | 91 | Very high | 88.6 | Confident | 60 Ų | 60 | 25.9 Ų | 25.9 | 28% | 0.28 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -69.1 | -32.8 | 179.1 | -170.1 | 80.7 | -178.6 | 0 | 0 | 112.5 | I100 K102 A108 I110 R413 | I100-E112 HydrophobicContact CD1-CB 4.03Å; I100-E112 HydrophobicContact CD1-CG 4Å; I100-E112 HydrophobicContact CG1-CG 4.43Å; K102-E112 IonicContact NZ-OE2 3.74Å; K102-E112 PolarHBondContact NZ-OE2 3.25Å; A108-E112 WeakPolarHBondContact O-CB 3.41Å; A108-E112 PolarHBondContact O-N 3.03Å; I110-E112 PolarHBondContact O-N 2.76Å; E112-R413 IonicContact OE1-CZ 2.74Å; E112-R413 IonicContact OE1-NH1 2.74Å; E112-R413 PolarHBondContact OE1-NH1 3.38Å; E112-R413 IonicContact OE1-NH2 3.82Å; E112-R413 PolarHBondContact OE1-NH2 3Å; E112-R413 VanDerWaalsContact OE1-NH2 3.14Å |
| 113 | S | 92.7 | Very high | 89.3 | Confident | 7 Ų | 7 | 20.8 Ų | 20.8 | 5% | 0.049 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -85.7 | -49.8 | -175.8 | -54.5 | 0 | 0 | 0 | 0 | 113.1 | Y109 I110 Y405 L406 | Y109-S113 VanDerWaalsContact O-CB 3.29Å; Y109-S113 WeakPolarHBondContact O-CB 3.39Å; Y109-S113 PolarHBondContact O-N 3.41Å; Y109-S113 PolarHBondContact O-OG 2.77Å; I110-S113 PolarHBondContact O-N 3.17Å; S113-Y405 WeakPolarHBondContact O-CE1 3.33Å; S113-L406 WeakPolarHBondContact OG-CD1 3.47Å |
| 114 | F | 93.6 | Very high | 90.4 | Very high | 77 Ų | 77 | 21 Ų | 21 | 34% | 0.338 | 11% | 0.113 | S | C | . | . | H | α-helix | trans | -115.3 | -6.5 | -169.4 | -58.9 | -69.1 | 0 | 0 | 0 | 113.9 | I110 I118 L398 | I110-F114 HydrophobicContact CG2-CD2 4.31Å; I110-F114 PolarHBondContact O-N 3.21Å; F114-I118 HydrophobicContact CB-CB 3.97Å; F114-I118 HydrophobicContact CB-CG1 3.96Å; F114-I118 HydrophobicContact CB-CG2 4.3Å; F114-L398 HydrophobicContact CD2-CD1 4.29Å; F114-L398 HydrophobicContact CD2-CG 4.32Å; F114-L398 HydrophobicContact CE2-CD1 3.75Å; F114-L398 HydrophobicContact CE2-CG 3.98Å; F114-L398 WeakPolarHBondContact CE2-O 3.41Å; F114-L398 HydrophobicContact CZ-CD1 4Å |
| 115 | G | 91.2 | Very high | 91.5 | Very high | 29 Ų | 29 | 20.8 Ų | 20.8 | 30% | 0.299 | 11% | 0.11 | S | C | . | . | trans | 88.5 | -177.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | I110 L111 F117 A119 | I110-G115 PolarHBondContact O-N 3.07Å; L111-G115 VanDerWaalsContact O-CA 3.24Å; L111-G115 WeakPolarHBondContact O-CA 3.22Å; L111-G115 PolarHBondContact O-N 3.48Å; L111-G115 VanDerWaalsContact O-N 3.07Å; G115-F117 PolarHBondContact O-N 2.89Å; G115-A119 WeakPolarHBondContact O-CB 3.45Å; G115-A119 PolarHBondContact O-N 2.77Å | ||
| 116 | G | 90 | Very high | 91.9 | Very high | 20 Ų | 20 | 20.8 Ų | 20.8 | 21% | 0.206 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.5 | -34.3 | -168 | 0 | 0 | 0 | 0 | 0 | 115.4 | A119 F120 H346 | G116-A119 PolarHBondContact O-N 3.41Å; G116-F120 WeakPolarHBondContact O-CB 3.48Å; G116-F120 PolarHBondContact O-N 2.93Å; G116-H346 PolarHBondContact O-CE1 2.91Å |
| 117 | F | 92.8 | Very high | 92.1 | Very high | 68 Ų | 68 | 21 Ų | 21 | 30% | 0.298 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -63.1 | -53.6 | -178.2 | 174.5 | -115 | 0 | 0 | 0 | 112.5 | G115 A119 F120 I121 V457 Y460 F461 | G115-F117 PolarHBondContact O-N 2.89Å; F117-A119 VanDerWaalsContact C-N 3.29Å; F117-A119 PolarHBondContact O-N 2.97Å; F117-F120 WeakPolarHBondContact O-CB 3.36Å; F117-F120 PolarHBondContact O-N 2.86Å; F117-I121 HydrophobicContact CE2-CD1 4.3Å; F117-I121 HydrophobicContact CE2-CG1 4.19Å; F117-I121 HydrophobicContact CZ-CG1 4.24Å; F117-I121 WeakPolarHBondContact O-CG1 3.35Å; F117-I121 PolarHBondContact O-N 3.44Å; F117-V457 HydrophobicContact CE2-CG1 4.32Å; F117-V457 HydrophobicContact CE2-CG2 4.27Å; F117-V457 HydrophobicContact CZ-CG1 4.34Å; F117-V457 HydrophobicContact CZ-CG2 3.96Å; F117-Y460 HydrophobicContact CB-CE1 3.96Å; F117-Y460 AromaticContact CD2-CD1 3.42Å; F117-Y460 HydrophobicContact CD2-CD1 3.42Å; F117-Y460 VanDerWaalsContact CD2-CD1 3.42Å; F117-Y460 HydrophobicContact CD2-CD2 4.44Å; F117-Y460 AromaticContact CD2-CE1 3.65Å; F117-Y460 HydrophobicContact CD2-CE1 3.65Å; F117-Y460 AromaticContact CD2-CG 3.83Å; F117-Y460 HydrophobicContact CD2-CG 3.83Å; F117-Y460 HydrophobicContact CE2-CD1 4.06Å; F117-Y460 HydrophobicContact CE2-CG 4.38Å; F117-Y460 HydrophobicContact CG-CD1 4.45Å; F117-Y460 HydrophobicContact CG-CE1 4.26Å; F117-Y460 PolarHBondContact N-OH 3.15Å; F117-F461 HydrophobicContact CE2-CE2 4.38Å |
| 118 | I | 94.1 | Very high | 92.3 | Very high | 50 Ų | 50 | 22.1 Ų | 22.1 | 26% | 0.256 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -67.9 | -35.2 | -178.9 | -54.9 | -60.4 | 0 | 0 | 0 | 110.6 | I110 F114 I121 R122 L398 | I110-I118 HydrophobicContact CG2-CB 3.94Å; I110-I118 HydrophobicContact CG2-CG2 3.52Å; F114-I118 HydrophobicContact CB-CB 3.97Å; F114-I118 HydrophobicContact CB-CG1 3.96Å; F114-I118 HydrophobicContact CB-CG2 4.3Å; I118-I121 PolarHBondContact O-N 3.18Å; I118-R122 PolarHBondContact O-N 3.26Å; I118-L398 HydrophobicContact CG2-CD2 3.47Å; I118-L398 VanDerWaalsContact CG2-CD2 3.47Å |
| 119 | A | 92.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63 | -40.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y107 I110 L111 G115 G116 F117 R122 L123 | Y107-A119 HydrophobicContact CD2-CB 4.05Å; Y107-A119 WeakPolarHBondContact CD2-O 3.32Å; Y107-A119 HydrophobicContact CE2-CB 3.74Å; Y107-A119 WeakPolarHBondContact CE2-O 3.31Å; I110-A119 HydrophobicContact CG2-CB 4.22Å; L111-A119 HydrophobicContact CB-CB 3.72Å; L111-A119 HydrophobicContact CD1-CB 3.78Å; L111-A119 HydrophobicContact CG-CB 4.34Å; G115-A119 WeakPolarHBondContact O-CB 3.45Å; G115-A119 PolarHBondContact O-N 2.77Å; G116-A119 PolarHBondContact O-N 3.41Å; F117-A119 VanDerWaalsContact C-N 3.29Å; F117-A119 PolarHBondContact O-N 2.97Å; A119-R122 WeakPolarHBondContact O-CB 3.5Å; A119-R122 PolarHBondContact O-N 3.26Å; A119-L123 WeakPolarHBondContact O-CB 3.5Å; A119-L123 PolarHBondContact O-N 2.92Å |
| 120 | F | 93.1 | Very high | 92.6 | Very high | 3 Ų | 3 | 22 Ų | 22 | 1% | 0.013 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.8 | -46.3 | 172.9 | 172.9 | -84.8 | 0 | 0 | 0 | 111.2 | G116 F117 R122 L123 W124 H346 G456 V459 Y460 V464 | G116-F120 WeakPolarHBondContact O-CB 3.48Å; G116-F120 PolarHBondContact O-N 2.93Å; F117-F120 WeakPolarHBondContact O-CB 3.36Å; F117-F120 PolarHBondContact O-N 2.86Å; F120-R122 VanDerWaalsContact C-N 3.28Å; F120-R122 PolarHBondContact O-N 3.39Å; F120-L123 WeakPolarHBondContact O-CB 3.48Å; F120-L123 PolarHBondContact O-N 3.14Å; F120-L123 VanDerWaalsContact O-N 3.07Å; F120-W124 HydrophobicContact CD1-CB 4.39Å; F120-W124 HydrophobicContact CE1-CB 3.98Å; F120-W124 HydrophobicContact CE1-CD2 4.32Å; F120-W124 HydrophobicContact CE1-CE3 4.35Å; F120-W124 HydrophobicContact CE1-CG 4.19Å; F120-W124 HydrophobicContact CZ-CB 4.36Å; F120-W124 HydrophobicContact CZ-CD2 4.19Å; F120-W124 AromaticContact CZ-CE3 3.77Å; F120-W124 HydrophobicContact CZ-CE3 3.77Å; F120-W124 HydrophobicContact CZ-CG 4.47Å; F120-W124 HydrophobicContact CZ-CZ3 4.45Å; F120-W124 VanDerWaalsContact O-CB 3.28Å; F120-W124 WeakPolarHBondContact O-CB 3.36Å; F120-W124 PolarHBondContact O-N 2.92Å; F120-H346 HydrophobicContact CD2-CB 4.01Å; F120-H346 WeakPolarHBondContact CD2-O 3.23Å; F120-H346 WeakPolarHBondContact CE2-O 3.27Å; F120-G456 WeakPolarHBondContact CE1-O 3.23Å; F120-V459 HydrophobicContact CZ-CB 4.19Å; F120-V459 HydrophobicContact CZ-CG1 3.93Å; F120-Y460 HydrophobicContact CB-CD2 3.47Å; F120-Y460 VanDerWaalsContact CB-CD2 3.47Å; F120-Y460 HydrophobicContact CB-CE2 3.79Å; F120-Y460 HydrophobicContact CB-CG 4.49Å; F120-Y460 AromaticContact CD1-CD2 3.76Å; F120-Y460 HydrophobicContact CD1-CD2 3.76Å; F120-Y460 HydrophobicContact CD1-CG 4.12Å; F120-Y460 AromaticContact CD2-CD2 3.84Å; F120-Y460 HydrophobicContact CD2-CD2 3.84Å; F120-Y460 AromaticContact CG-CD2 3.4Å; F120-Y460 HydrophobicContact CG-CD2 3.4Å; F120-Y460 HydrophobicContact CG-CE2 4.2Å; F120-Y460 HydrophobicContact CG-CG 4.22Å; F120-V464 HydrophobicContact CD2-CG2 4.02Å; F120-V464 HydrophobicContact CE2-CG2 4.09Å |
| 121 | I | 94.4 | Very high | 92.5 | Very high | 20 Ų | 20 | 23.5 Ų | 23.5 | 10% | 0.103 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.5 | -38.1 | 179.6 | -61.5 | -64.9 | 0 | 0 | 0 | 111.1 | F117 I118 T125 F395 A453 V457 | F117-I121 HydrophobicContact CE2-CD1 4.3Å; F117-I121 HydrophobicContact CE2-CG1 4.19Å; F117-I121 HydrophobicContact CZ-CG1 4.24Å; F117-I121 WeakPolarHBondContact O-CG1 3.35Å; F117-I121 PolarHBondContact O-N 3.44Å; I118-I121 PolarHBondContact O-N 3.18Å; I121-T125 WeakPolarHBondContact O-CB 3.31Å; I121-T125 PolarHBondContact O-N 3.47Å; I121-T125 PolarHBondContact O-OG1 3.02Å; I121-F395 HydrophobicContact CG2-CE1 4.44Å; I121-F395 HydrophobicContact CG2-CZ 4.03Å; I121-A453 HydrophobicContact CG2-CB 4.42Å; I121-V457 HydrophobicContact CD1-CG2 3.93Å |
| 122 | R | 93.3 | Very high | 92.7 | Very high | 7 Ų | 7 | 21.7 Ų | 21.7 | 3% | 0.026 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -58.9 | -47.1 | 170.8 | 169.7 | 65.3 | -174.6 | 72.4 | -5.5 | 112.1 | I110 I118 A119 F120 S126 F395 | I110-R122 HydrophobicContact CD1-CB 3.99Å; I110-R122 HydrophobicContact CD1-CG 3.86Å; I118-R122 PolarHBondContact O-N 3.26Å; A119-R122 WeakPolarHBondContact O-CB 3.5Å; A119-R122 PolarHBondContact O-N 3.26Å; F120-R122 VanDerWaalsContact C-N 3.28Å; F120-R122 PolarHBondContact O-N 3.39Å; R122-S126 PolarHBondContact NH1-OG 2.95Å; R122-S126 PolarHBondContact NH2-OG 2.93Å; R122-S126 PolarHBondContact O-N 3.33Å; R122-F395 VanDerWaalsContact CA-CE1 3.5Å; R122-F395 HydrophobicContact CB-CD1 3.79Å; R122-F395 HydrophobicContact CB-CE1 3.78Å; R122-F395 HydrophobicContact CB-CG 4.42Å; R122-F395 HydrophobicContact CB-CZ 4.44Å; R122-F395 HydrophobicContact CG-CD1 4.17Å; R122-F395 HydrophobicContact CG-CG 4.39Å |
| 123 | L | 92.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -66.6 | -46.2 | -178.9 | 179.7 | 65.1 | 0 | 0 | 0 | 111.3 | Y107 A119 F120 T125 S126 L127 L337 G341 H346 L347 | Y107-L123 HydrophobicContact CD2-CB 3.94Å; Y107-L123 HydrophobicContact CE2-CB 4.01Å; Y107-L123 HydrophobicContact CE2-CD2 4.09Å; A119-L123 WeakPolarHBondContact O-CB 3.5Å; A119-L123 PolarHBondContact O-N 2.92Å; F120-L123 WeakPolarHBondContact O-CB 3.48Å; F120-L123 PolarHBondContact O-N 3.14Å; F120-L123 VanDerWaalsContact O-N 3.07Å; L123-T125 VanDerWaalsContact C-N 3.34Å; L123-T125 PolarHBondContact O-N 3.41Å; L123-S126 WeakPolarHBondContact O-CB 3.4Å; L123-S126 PolarHBondContact O-N 3.46Å; L123-L127 WeakPolarHBondContact O-CB 3.47Å; L123-L127 PolarHBondContact O-N 3.43Å; L123-L337 HydrophobicContact CD1-CD1 3.99Å; L123-L337 HydrophobicContact CD1-CD2 4.38Å; L123-L337 HydrophobicContact CD1-CG 3.83Å; L123-G341 VanDerWaalsContact CD2-CA 3.48Å; L123-H346 HydrophobicContact CD2-CB 3.95Å; L123-L347 HydrophobicContact CD1-CD1 4.27Å; L123-L347 HydrophobicContact CD2-CD1 3.75Å; L123-L347 HydrophobicContact CD2-CD2 4.41Å; L123-L347 HydrophobicContact CD2-CG 3.73Å; L123-L347 HydrophobicContact CG-CD1 4.05Å; L123-L347 HydrophobicContact CG-CG 4.35Å |
| 124 | W | 93.7 | Very high | 92.9 | Very high | 46 Ų | 46 | 19.2 Ų | 19.2 | 17% | 0.174 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -56 | -47.1 | 175.9 | -174.3 | -104.5 | 0 | 0 | 0 | 111.6 | F120 L127 L128 I452 S455 G456 V459 | F120-W124 HydrophobicContact CD1-CB 4.39Å; F120-W124 HydrophobicContact CE1-CB 3.98Å; F120-W124 HydrophobicContact CE1-CD2 4.32Å; F120-W124 HydrophobicContact CE1-CE3 4.35Å; F120-W124 HydrophobicContact CE1-CG 4.19Å; F120-W124 HydrophobicContact CZ-CB 4.36Å; F120-W124 HydrophobicContact CZ-CD2 4.19Å; F120-W124 AromaticContact CZ-CE3 3.77Å; F120-W124 HydrophobicContact CZ-CE3 3.77Å; F120-W124 HydrophobicContact CZ-CG 4.47Å; F120-W124 HydrophobicContact CZ-CZ3 4.45Å; F120-W124 VanDerWaalsContact O-CB 3.28Å; F120-W124 WeakPolarHBondContact O-CB 3.36Å; F120-W124 PolarHBondContact O-N 2.92Å; W124-L127 PolarHBondContact O-N 3.22Å; W124-L128 HydrophobicContact CD2-CD1 4.07Å; W124-L128 HydrophobicContact CG-CD1 4.46Å; W124-L128 HydrophobicContact CH2-CD1 4.33Å; W124-L128 HydrophobicContact CZ2-CD1 3.53Å; W124-L128 PolarHBondContact O-N 2.83Å; W124-I452 PolarHBondContact NE1-O 3.27Å; W124-S455 PolarHBondContact NE1-OG 3.46Å; W124-S455 VanDerWaalsContact NE1-OG 3.13Å; W124-G456 VanDerWaalsContact CD1-CA 3.44Å; W124-V459 HydrophobicContact CH2-CB 4.35Å; W124-V459 HydrophobicContact CH2-CG1 4.02Å; W124-V459 HydrophobicContact CH2-CG2 3.93Å; W124-V459 HydrophobicContact CZ2-CG2 3.97Å; W124-V459 HydrophobicContact CZ3-CG1 3.91Å |
| 125 | T | 93.7 | Very high | 92.9 | Very high | 1 Ų | 1 | 15.5 Ų | 15.5 | 1% | 0.006 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -69.7 | -34 | 178.9 | -48.2 | 0 | 0 | 0 | 0 | 112.1 | I121 L123 L127 I129 I130 F395 | I121-T125 WeakPolarHBondContact O-CB 3.31Å; I121-T125 PolarHBondContact O-N 3.47Å; I121-T125 PolarHBondContact O-OG1 3.02Å; L123-T125 VanDerWaalsContact C-N 3.34Å; L123-T125 PolarHBondContact O-N 3.41Å; T125-L127 VanDerWaalsContact C-N 3.33Å; T125-I129 HydrophobicContact CG2-CB 4.25Å; T125-I129 HydrophobicContact CG2-CD1 3.77Å; T125-I129 HydrophobicContact CG2-CG1 4.15Å; T125-I129 WeakPolarHBondContact O-CA 3.43Å; T125-I129 WeakPolarHBondContact O-CB 3.2Å; T125-I129 PolarHBondContact O-N 3.26Å; T125-I130 PolarHBondContact O-N 3.36Å; T125-I130 VanDerWaalsContact O-N 3.16Å; T125-F395 VanDerWaalsContact CB-CE2 3.46Å; T125-F395 HydrophobicContact CG2-CD2 4.48Å; T125-F395 HydrophobicContact CG2-CE2 3.69Å; T125-F395 WeakPolarHBondContact OG1-CE2 3.31Å |
| 126 | S | 91.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 7% | 0.072 | C | C | . | . | I | π-helix | trans | -60.6 | -48.1 | 171.9 | -118.2 | 0 | 0 | 0 | 0 | 111.3 | R122 L123 L128 I130 E131 | R122-S126 PolarHBondContact NH1-OG 2.95Å; R122-S126 PolarHBondContact NH2-OG 2.93Å; R122-S126 PolarHBondContact O-N 3.33Å; L123-S126 WeakPolarHBondContact O-CB 3.4Å; L123-S126 PolarHBondContact O-N 3.46Å; S126-L128 PolarHBondContact O-N 3.08Å; S126-I130 PolarHBondContact O-N 2.59Å; S126-E131 WeakPolarHBondContact O-CG 3.35Å; S126-E131 PolarHBondContact O-N 3.11Å; S126-E131 PolarHBondContact OG-OE1 3.46Å; S126-E131 VanDerWaalsContact OG-OE1 3.1Å |
| 127 | L | 91.2 | Very high | 93.4 | Very high | 4 Ų | 4 | 13.2 Ų | 13.2 | 2% | 0.021 | 6% | 0.063 | C | C | . | . | I | π-helix | trans | -66.7 | -36.3 | -174.5 | 179.4 | 149.7 | 0 | 0 | 0 | 112.5 | L123 W124 T125 P132 F338 L347 L351 F367 | L123-L127 WeakPolarHBondContact O-CB 3.47Å; L123-L127 PolarHBondContact O-N 3.43Å; W124-L127 PolarHBondContact O-N 3.22Å; T125-L127 VanDerWaalsContact C-N 3.33Å; L127-P132 VanDerWaalsContact O-CG 3.29Å; L127-P132 WeakPolarHBondContact O-CG 3.48Å; L127-F338 HydrophobicContact CB-CD1 4.24Å; L127-F338 HydrophobicContact CB-CE1 3.59Å; L127-F338 HydrophobicContact CB-CZ 3.98Å; L127-F338 HydrophobicContact CD1-CD1 3.87Å; L127-F338 HydrophobicContact CD1-CD2 4.43Å; L127-F338 HydrophobicContact CD1-CE1 3.96Å; L127-F338 HydrophobicContact CD1-CE2 4.47Å; L127-F338 HydrophobicContact CD1-CG 4.15Å; L127-F338 HydrophobicContact CD1-CZ 4.27Å; L127-F338 HydrophobicContact CG-CD1 4.27Å; L127-F338 HydrophobicContact CG-CE1 3.83Å; L127-F338 HydrophobicContact CG-CE2 4.36Å; L127-F338 HydrophobicContact CG-CZ 3.88Å; L127-L347 HydrophobicContact CD1-CD1 3.92Å; L127-L347 HydrophobicContact CD1-CD2 3.96Å; L127-L351 HydrophobicContact CD1-CD1 4.23Å; L127-F367 HydrophobicContact CD1-CE1 4.12Å; L127-F367 HydrophobicContact CD2-CD1 4.27Å; L127-F367 HydrophobicContact CD2-CE1 3.18Å; L127-F367 HydrophobicContact CD2-CE2 4.48Å; L127-F367 HydrophobicContact CD2-CZ 3.32Å; L127-F367 HydrophobicContact CG-CD1 4.22Å; L127-F367 HydrophobicContact CG-CE1 3.48Å; L127-F367 VanDerWaalsContact CG-CE1 3.48Å; L127-F367 HydrophobicContact CG-CZ 4.14Å |
| 128 | L | 93 | Very high | 93.5 | Very high | 28 Ų | 28 | 10.6 Ų | 10.6 | 15% | 0.147 | 5% | 0.052 | C | C | . | . | I | π-helix | trans | -96.3 | -24.4 | -177.8 | -67.5 | -176.9 | 0 | 0 | 0 | 115.2 | W124 S126 F367 M371 Y375 I452 | W124-L128 HydrophobicContact CD2-CD1 4.07Å; W124-L128 HydrophobicContact CG-CD1 4.46Å; W124-L128 HydrophobicContact CH2-CD1 4.33Å; W124-L128 HydrophobicContact CZ2-CD1 3.53Å; W124-L128 PolarHBondContact O-N 2.83Å; S126-L128 PolarHBondContact O-N 3.08Å; L128-F367 HydrophobicContact CD2-CZ 4.16Å; L128-M371 HydrophobicContact CD2-CE 3.75Å; L128-M371 HydrophobicContact CD2-SD 4.16Å; L128-Y375 WeakPolarHBondContact O-CE2 3.14Å; L128-Y375 PolarHBondContact O-OH 3.35Å; L128-I452 HydrophobicContact CB-CG2 3.89Å; L128-I452 HydrophobicContact CD1-CG2 3.9Å |
| 129 | I | 93 | Very high | 93.6 | Very high | 2 Ų | 2 | 8.2 Ų | 8.2 | 1% | 0.01 | 4% | 0.04 | C | C | . | . | I | π-helix | trans | -123.9 | -64.8 | -174.3 | -49.5 | -177.3 | 0 | 0 | 0 | 110.6 | T125 E131 P132 T133 I452 | T125-I129 HydrophobicContact CG2-CB 4.25Å; T125-I129 HydrophobicContact CG2-CD1 3.77Å; T125-I129 HydrophobicContact CG2-CG1 4.15Å; T125-I129 WeakPolarHBondContact O-CA 3.43Å; T125-I129 WeakPolarHBondContact O-CB 3.2Å; T125-I129 PolarHBondContact O-N 3.26Å; I129-E131 PolarHBondContact O-N 3.44Å; I129-P132 WeakPolarHBondContact O-CD 3.33Å; I129-T133 WeakPolarHBondContact O-CB 3.39Å; I129-T133 PolarHBondContact O-N 3.27Å; I129-T133 PolarHBondContact O-OG1 3.45Å; I129-I452 HydrophobicContact CD1-CB 3.76Å; I129-I452 HydrophobicContact CD1-CD1 4.08Å; I129-I452 HydrophobicContact CD1-CG2 3.65Å; I129-I452 HydrophobicContact CG1-CB 4.29Å; I129-I452 HydrophobicContact CG1-CD1 4.23Å; I129-I452 HydrophobicContact CG1-CG2 3.68Å |
| 130 | I | 92.5 | Very high | 93.7 | Very high | 3 Ų | 3 | 8.4 Ų | 8.4 | 2% | 0.015 | 4% | 0.04 | C | C | . | . | I | π-helix | trans | -62.5 | -53.9 | -163.1 | -55.4 | 175.8 | 0 | 0 | 0 | 111.5 | T125 S126 S134 Y388 Y392 F395 | T125-I130 PolarHBondContact O-N 3.36Å; T125-I130 VanDerWaalsContact O-N 3.16Å; S126-I130 PolarHBondContact O-N 2.59Å; I130-S134 VanDerWaalsContact O-CB 3.32Å; I130-S134 WeakPolarHBondContact O-CB 3.41Å; I130-S134 PolarHBondContact O-N 3.37Å; I130-S134 VanDerWaalsContact O-N 3.16Å; I130-Y388 HydrophobicContact CB-CD2 4.44Å; I130-Y388 HydrophobicContact CG2-CD2 3.7Å; I130-Y388 HydrophobicContact CG2-CE2 3.42Å; I130-Y388 VanDerWaalsContact CG2-CE2 3.42Å; I130-Y388 WeakPolarHBondContact O-CD2 3.35Å; I130-Y392 HydrophobicContact CG2-CD2 4.1Å; I130-F395 HydrophobicContact CD1-CD2 4.41Å |
| 131 | E | 92.1 | Very high | 93.7 | Very high | 30 Ų | 30 | 8.3 Ų | 8.3 | 14% | 0.14 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -68.2 | -50.9 | -175.9 | -49 | -56.5 | 150.1 | 0 | 0 | 112.1 | S126 I129 T133 S134 Q135 A334 F338 | S126-E131 WeakPolarHBondContact O-CG 3.35Å; S126-E131 PolarHBondContact O-N 3.11Å; S126-E131 PolarHBondContact OG-OE1 3.46Å; S126-E131 VanDerWaalsContact OG-OE1 3.1Å; I129-E131 PolarHBondContact O-N 3.44Å; E131-T133 PolarHBondContact O-N 2.87Å; E131-S134 PolarHBondContact O-N 2.93Å; E131-Q135 VanDerWaalsContact O-CG 3.26Å; E131-Q135 WeakPolarHBondContact O-CG 3.31Å; E131-Q135 PolarHBondContact O-N 3.13Å; E131-Q135 PolarHBondContact O-NE2 3.39Å; E131-A334 HydrophobicContact CB-CB 3.87Å; E131-A334 HydrophobicContact CG-CB 3.86Å; E131-F338 HydrophobicContact CG-CE1 4.39Å; E131-F338 HydrophobicContact CG-CZ 4.34Å |
| 132 | P | 94.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 8.7 Ų | 8.7 | 0% | 0 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -66.4 | -36.8 | -176.5 | -23.4 | 36.7 | 0 | 0 | 0 | 113.3 | L127 I129 Q135 A136 M371 Y375 | L127-P132 VanDerWaalsContact O-CG 3.29Å; L127-P132 WeakPolarHBondContact O-CG 3.48Å; I129-P132 WeakPolarHBondContact O-CD 3.33Å; P132-Q135 PolarHBondContact O-N 2.84Å; P132-A136 WeakPolarHBondContact O-CB 3.42Å; P132-A136 PolarHBondContact O-N 2.91Å; P132-M371 HydrophobicContact CB-CB 3.71Å; P132-M371 HydrophobicContact CG-CB 3.55Å; P132-M371 HydrophobicContact CG-CG 4.39Å; P132-Y375 HydrophobicContact CB-CD2 3.63Å; P132-Y375 HydrophobicContact CB-CE2 3.88Å |
| 133 | T | 94.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 8.3 Ų | 8.3 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -67.5 | -44.5 | 179.2 | -57.3 | 0 | 0 | 0 | 0 | 110.9 | I129 E131 Q135 A136 V137 Y375 L384 | I129-T133 WeakPolarHBondContact O-CB 3.39Å; I129-T133 PolarHBondContact O-N 3.27Å; I129-T133 PolarHBondContact O-OG1 3.45Å; E131-T133 PolarHBondContact O-N 2.87Å; T133-Q135 VanDerWaalsContact C-N 3.34Å; T133-Q135 PolarHBondContact O-N 2.9Å; T133-A136 PolarHBondContact O-N 3.22Å; T133-V137 WeakPolarHBondContact O-CG2 3.39Å; T133-V137 PolarHBondContact O-N 2.99Å; T133-Y375 WeakPolarHBondContact OG1-CE1 3.47Å; T133-L384 HydrophobicContact CG2-CB 3.67Å; T133-L384 HydrophobicContact CG2-CD2 3.94Å; T133-L384 HydrophobicContact CG2-CG 4.4Å; T133-L384 WeakPolarHBondContact CG2-O 3.45Å |
| 134 | S | 93.3 | Very high | 93.7 | Very high | 15 Ų | 15 | 9.3 Ų | 9.3 | 11% | 0.105 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -59.9 | -44.9 | 175.6 | -177.8 | 0 | 0 | 0 | 0 | 111.5 | I130 E131 A136 V137 I138 | I130-S134 VanDerWaalsContact O-CB 3.32Å; I130-S134 WeakPolarHBondContact O-CB 3.41Å; I130-S134 PolarHBondContact O-N 3.37Å; I130-S134 VanDerWaalsContact O-N 3.16Å; E131-S134 PolarHBondContact O-N 2.93Å; S134-A136 PolarHBondContact O-N 3.15Å; S134-V137 PolarHBondContact O-N 2.99Å; S134-I138 WeakPolarHBondContact O-CD1 3.03Å; S134-I138 VanDerWaalsContact O-CG1 3.24Å; S134-I138 WeakPolarHBondContact O-CG1 3.16Å; S134-I138 PolarHBondContact O-N 2.91Å |
| 135 | Q | 94.9 | Very high | 93.6 | Very high | 0 Ų | 0 | 7.1 Ų | 7.1 | 0% | 0 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -63.1 | -41.2 | 177.3 | -70.3 | 167.9 | 41.4 | 0 | 0 | 112.4 | E131 P132 T133 I138 A139 L327 S330 I331 N368 S372 | E131-Q135 VanDerWaalsContact O-CG 3.26Å; E131-Q135 WeakPolarHBondContact O-CG 3.31Å; E131-Q135 PolarHBondContact O-N 3.13Å; E131-Q135 PolarHBondContact O-NE2 3.39Å; P132-Q135 PolarHBondContact O-N 2.84Å; T133-Q135 VanDerWaalsContact C-N 3.34Å; T133-Q135 PolarHBondContact O-N 2.9Å; Q135-I138 PolarHBondContact O-N 3Å; Q135-A139 VanDerWaalsContact O-CB 3.28Å; Q135-A139 WeakPolarHBondContact O-CB 3.33Å; Q135-A139 PolarHBondContact O-N 3.01Å; Q135-L327 HydrophobicContact CB-CD1 3.66Å; Q135-L327 HydrophobicContact CG-CD1 3.88Å; Q135-S330 WeakPolarHBondContact CG-OG 3.24Å; Q135-S330 PolarHBondContact NE2-OG 3.09Å; Q135-I331 HydrophobicContact CG-CG1 4.48Å; Q135-N368 PolarHBondContact NE2-ND2 3.34Å; Q135-N368 PolarHBondContact NE2-OD1 3.26Å; Q135-N368 VanDerWaalsContact NE2-OD1 3.13Å; Q135-N368 PolarHBondContact OE1-ND2 3.24Å; Q135-N368 PolarHBondContact OE1-OD1 2.71Å; Q135-S372 PolarHBondContact OE1-OG 2.73Å; Q135-S372 VanDerWaalsContact OE1-OG 3.05Å |
| 136 | A | 96.2 | Very high | 93.5 | Very high | 0 Ų | 0 | 11 Ų | 11 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -60.9 | -47.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | P132 T133 S134 I138 A139 I140 L376 L384 | P132-A136 WeakPolarHBondContact O-CB 3.42Å; P132-A136 PolarHBondContact O-N 2.91Å; T133-A136 PolarHBondContact O-N 3.22Å; S134-A136 PolarHBondContact O-N 3.15Å; A136-I138 PolarHBondContact O-N 3.24Å; A136-A139 PolarHBondContact O-N 2.53Å; A136-I140 VanDerWaalsContact O-CD1 3.29Å; A136-I140 WeakPolarHBondContact O-CD1 3.3Å; A136-I140 WeakPolarHBondContact O-CG1 3.25Å; A136-I140 PolarHBondContact O-N 3.44Å; A136-L376 HydrophobicContact CB-CD2 4.06Å; A136-L384 HydrophobicContact CB-CD1 4.11Å |
| 137 | V | 95.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 11.4 Ų | 11.4 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -59.2 | -46.8 | 177 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | T133 S134 A139 I140 T141 F240 V381 L384 I385 | T133-V137 WeakPolarHBondContact O-CG2 3.39Å; T133-V137 PolarHBondContact O-N 2.99Å; S134-V137 PolarHBondContact O-N 2.99Å; V137-A139 VanDerWaalsContact C-N 3.34Å; V137-A139 PolarHBondContact O-N 3.34Å; V137-I140 PolarHBondContact O-N 3.46Å; V137-T141 PolarHBondContact O-N 3.5Å; V137-T141 PolarHBondContact O-OG1 2.96Å; V137-F240 HydrophobicContact CB-CZ 3.93Å; V137-F240 HydrophobicContact CG1-CE1 3.6Å; V137-F240 HydrophobicContact CG1-CE2 4.43Å; V137-F240 HydrophobicContact CG1-CZ 3.47Å; V137-F240 VanDerWaalsContact CG1-CZ 3.47Å; V137-V381 HydrophobicContact CB-CG1 4.39Å; V137-V381 HydrophobicContact CG1-CG1 3.84Å; V137-V381 HydrophobicContact CG2-CG1 4.12Å; V137-L384 HydrophobicContact CG2-CB 3.52Å; V137-L384 HydrophobicContact CG2-CD1 4.13Å; V137-L384 HydrophobicContact CG2-CG 4.49Å; V137-I385 HydrophobicContact CG1-CD1 4.35Å; V137-I385 HydrophobicContact CG1-CG1 4.14Å; V137-I385 HydrophobicContact CG2-CG1 4.08Å |
| 138 | I | 93.9 | Very high | 93.3 | Very high | 14 Ų | 14 | 12.5 Ų | 12.5 | 7% | 0.072 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -61.6 | -42.9 | 177.7 | -61.3 | 157.9 | 0 | 0 | 0 | 110.9 | S56 S134 Q135 A136 T141 F142 C323 L327 | S56-I138 VanDerWaalsContact OG-CG1 3.27Å; S56-I138 WeakPolarHBondContact OG-CG1 3.21Å; S134-I138 WeakPolarHBondContact O-CD1 3.03Å; S134-I138 VanDerWaalsContact O-CG1 3.24Å; S134-I138 WeakPolarHBondContact O-CG1 3.16Å; S134-I138 PolarHBondContact O-N 2.91Å; Q135-I138 PolarHBondContact O-N 3Å; A136-I138 PolarHBondContact O-N 3.24Å; I138-T141 WeakPolarHBondContact O-CB 3.35Å; I138-T141 PolarHBondContact O-N 3.14Å; I138-F142 PolarHBondContact O-N 3.44Å; I138-C323 HydrophobicContact CG2-CB 4.04Å; I138-C323 WeakPolarHBondContact CG2-O 3.24Å; I138-L327 HydrophobicContact CG2-CB 3.78Å |
| 139 | A | 95.8 | Very high | 93 | Very high | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -67.9 | -38.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q135 A136 V137 T141 F142 A143 A165 I169 L327 | Q135-A139 VanDerWaalsContact O-CB 3.28Å; Q135-A139 WeakPolarHBondContact O-CB 3.33Å; Q135-A139 PolarHBondContact O-N 3.01Å; A136-A139 PolarHBondContact O-N 2.53Å; V137-A139 VanDerWaalsContact C-N 3.34Å; V137-A139 PolarHBondContact O-N 3.34Å; A139-T141 VanDerWaalsContact C-N 3.34Å; A139-F142 WeakPolarHBondContact O-CB 3.4Å; A139-F142 PolarHBondContact O-N 2.77Å; A139-A143 PolarHBondContact O-N 3.5Å; A139-A165 HydrophobicContact CB-CB 3.98Å; A139-A165 WeakPolarHBondContact O-CB 3.31Å; A139-I169 HydrophobicContact CB-CD1 3.43Å; A139-I169 VanDerWaalsContact CB-CD1 3.43Å; A139-I169 HydrophobicContact CB-CG1 3.7Å; A139-L327 HydrophobicContact CB-CD2 3.91Å |
| 140 | I | 95.1 | Very high | 92.8 | Very high | 3 Ų | 3 | 20.1 Ų | 20.1 | 2% | 0.015 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -65.7 | -42.3 | 174.3 | -63.6 | 155.6 | 0 | 0 | 0 | 109.8 | A136 V137 F142 A143 N144 L376 V381 L384 | A136-I140 VanDerWaalsContact O-CD1 3.29Å; A136-I140 WeakPolarHBondContact O-CD1 3.3Å; A136-I140 WeakPolarHBondContact O-CG1 3.25Å; A136-I140 PolarHBondContact O-N 3.44Å; V137-I140 PolarHBondContact O-N 3.46Å; I140-F142 PolarHBondContact O-N 3.07Å; I140-A143 PolarHBondContact O-N 3.39Å; I140-N144 WeakPolarHBondContact O-CB 3.4Å; I140-N144 PolarHBondContact O-N 3.38Å; I140-L376 HydrophobicContact CD1-CD2 4.02Å; I140-L376 HydrophobicContact CG1-CD2 3.67Å; I140-V381 HydrophobicContact CB-CG2 4.27Å; I140-V381 HydrophobicContact CD1-CG2 4.05Å; I140-V381 HydrophobicContact CG2-CG2 3.54Å; I140-L384 HydrophobicContact CD1-CD1 3.73Å |
| 141 | T | 93.3 | Very high | 92.5 | Very high | 2 Ų | 2 | 23 Ų | 23 | 1% | 0.012 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -58.8 | -48.3 | 174.6 | -47 | 0 | 0 | 0 | 0 | 110.8 | F59 V60 V137 I138 A139 A143 N144 Y145 | F59-T141 HydrophobicContact CB-CG2 4.39Å; V60-T141 HydrophobicContact CG2-CG2 3.5Å; V60-T141 WeakPolarHBondContact CG2-OG1 3.35Å; V137-T141 PolarHBondContact O-N 3.5Å; V137-T141 PolarHBondContact O-OG1 2.96Å; I138-T141 WeakPolarHBondContact O-CB 3.35Å; I138-T141 PolarHBondContact O-N 3.14Å; A139-T141 VanDerWaalsContact C-N 3.34Å; T141-A143 VanDerWaalsContact C-N 3.29Å; T141-A143 PolarHBondContact O-N 3.28Å; T141-N144 PolarHBondContact O-N 2.9Å; T141-Y145 HydrophobicContact CG2-CD2 3.74Å; T141-Y145 HydrophobicContact CG2-CE2 3.85Å; T141-Y145 WeakPolarHBondContact O-CB 3.39Å; T141-Y145 VanDerWaalsContact O-CD2 3.26Å; T141-Y145 WeakPolarHBondContact O-CD2 3.47Å; T141-Y145 PolarHBondContact O-N 2.75Å |
| 142 | F | 93.7 | Very high | 91.7 | Very high | 27 Ų | 27 | 26.1 Ų | 26.1 | 12% | 0.118 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -52.2 | -49.2 | 175.1 | 167.1 | -97.2 | 0 | 0 | 0 | 111.7 | I138 A139 I140 L146 V164 C168 A320 C323 Y324 | I138-F142 PolarHBondContact O-N 3.44Å; A139-F142 WeakPolarHBondContact O-CB 3.4Å; A139-F142 PolarHBondContact O-N 2.77Å; I140-F142 PolarHBondContact O-N 3.07Å; F142-L146 HydrophobicContact CE1-CD2 4.07Å; F142-L146 HydrophobicContact CZ-CD2 3.86Å; F142-L146 WeakPolarHBondContact O-CB 3.14Å; F142-L146 PolarHBondContact O-N 3.33Å; F142-V164 HydrophobicContact CD1-CG1 4.35Å; F142-V164 HydrophobicContact CE1-CG1 3.95Å; F142-C168 HydrophobicContact CD1-CB 3.76Å; F142-C168 HydrophobicContact CE1-CB 3.68Å; F142-A320 HydrophobicContact CD2-CB 3.97Å; F142-A320 VanDerWaalsContact CD2-O 3.28Å; F142-A320 WeakPolarHBondContact CD2-O 3.36Å; F142-A320 HydrophobicContact CE2-CB 4Å; F142-C323 HydrophobicContact CB-CB 3.66Å; F142-C323 HydrophobicContact CD2-CB 4.42Å; F142-Y324 HydrophobicContact CE2-CD2 4.42Å |
| 143 | A | 94.8 | Very high | 91 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.8 | -46.5 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A139 I140 T141 Y145 L146 V147 S161 V164 A165 | A139-A143 PolarHBondContact O-N 3.5Å; I140-A143 PolarHBondContact O-N 3.39Å; T141-A143 VanDerWaalsContact C-N 3.29Å; T141-A143 PolarHBondContact O-N 3.28Å; A143-Y145 VanDerWaalsContact C-N 3.3Å; A143-Y145 PolarHBondContact O-N 2.9Å; A143-L146 PolarHBondContact O-N 3.14Å; A143-L146 VanDerWaalsContact O-N 3.15Å; A143-V147 WeakPolarHBondContact O-CB 3.28Å; A143-V147 WeakPolarHBondContact O-CG2 3.46Å; A143-V147 PolarHBondContact O-N 3.12Å; A143-S161 WeakPolarHBondContact CB-O 3.47Å; A143-V164 HydrophobicContact CB-CB 3.95Å; A143-V164 HydrophobicContact CB-CG1 3.82Å; A143-A165 HydrophobicContact CB-CB 3.97Å |
| 144 | N | 92 | Very high | 90.5 | Very high | 20 Ų | 20 | 36 Ų | 36 | 11% | 0.107 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -58.7 | -44 | 178.7 | -72.8 | -4 | 0 | 0 | 0 | 111 | I140 T141 L146 V147 Q148 S161 | I140-N144 WeakPolarHBondContact O-CB 3.4Å; I140-N144 PolarHBondContact O-N 3.38Å; T141-N144 PolarHBondContact O-N 2.9Å; N144-L146 VanDerWaalsContact C-N 3.34Å; N144-L146 PolarHBondContact O-N 2.71Å; N144-V147 PolarHBondContact O-N 3Å; N144-Q148 WeakPolarHBondContact O-CB 3.13Å; N144-Q148 PolarHBondContact O-N 3.34Å; N144-S161 WeakPolarHBondContact OD1-CB 3.49Å; N144-S161 PolarHBondContact OD1-OG 3.35Å |
| 145 | Y | 91.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -69.9 | -28.1 | 178.9 | -85.9 | -96.1 | 0 | 0 | 0 | 114 | F59 T141 A143 P149 A298 V299 A300 V301 P316 V319 | F59-Y145 HydrophobicContact CB-CE1 4.5Å; F59-Y145 HydrophobicContact CB-CE2 3.87Å; F59-Y145 WeakPolarHBondContact CB-OH 3.5Å; F59-Y145 PolarHBondContact O-OH 3.07Å; T141-Y145 HydrophobicContact CG2-CD2 3.74Å; T141-Y145 HydrophobicContact CG2-CE2 3.85Å; T141-Y145 WeakPolarHBondContact O-CB 3.39Å; T141-Y145 VanDerWaalsContact O-CD2 3.26Å; T141-Y145 WeakPolarHBondContact O-CD2 3.47Å; T141-Y145 PolarHBondContact O-N 2.75Å; A143-Y145 VanDerWaalsContact C-N 3.3Å; A143-Y145 PolarHBondContact O-N 2.9Å; Y145-P149 WeakPolarHBondContact O-CD 3.33Å; Y145-A298 HydrophobicContact CD1-CB 4.18Å; Y145-A298 HydrophobicContact CD2-CB 3.95Å; Y145-A298 HydrophobicContact CE1-CB 3.99Å; Y145-A298 HydrophobicContact CE2-CB 3.76Å; Y145-A298 HydrophobicContact CG-CB 4.18Å; Y145-V299 PolarHBondContact OH-N 3.32Å; Y145-A300 HydrophobicContact CE1-CB 3.86Å; Y145-A300 PolarHBondContact OH-N 2.85Å; Y145-V301 HydrophobicContact CD1-CG2 3.56Å; Y145-V301 HydrophobicContact CE1-CG2 3.75Å; Y145-V301 HydrophobicContact CG-CG2 4.48Å; Y145-P316 WeakPolarHBondContact O-CB 3.39Å; Y145-V319 HydrophobicContact CD1-CB 3.49Å; Y145-V319 VanDerWaalsContact CD1-CB 3.49Å; Y145-V319 HydrophobicContact CD1-CG1 3.34Å; Y145-V319 HydrophobicContact CD1-CG2 3.96Å; Y145-V319 HydrophobicContact CD2-CG1 3.9Å; Y145-V319 HydrophobicContact CE1-CB 3.89Å; Y145-V319 HydrophobicContact CE1-CG1 3.6Å; Y145-V319 HydrophobicContact CE1-CG2 3.88Å; Y145-V319 HydrophobicContact CE2-CG1 4.13Å; Y145-V319 HydrophobicContact CG-CB 4.02Å; Y145-V319 HydrophobicContact CG-CG1 3.49Å; Y145-V319 VanDerWaalsContact CG-CG1 3.49Å |
| 146 | L | 91.6 | Very high | 89.4 | Confident | 82 Ų | 82 | 42.8 Ų | 42.8 | 43% | 0.429 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -80.1 | -36 | 176.1 | -173.4 | 63.3 | 0 | 0 | 0 | 112.4 | F142 A143 N144 V164 | F142-L146 HydrophobicContact CE1-CD2 4.07Å; F142-L146 HydrophobicContact CZ-CD2 3.86Å; F142-L146 WeakPolarHBondContact O-CB 3.14Å; F142-L146 PolarHBondContact O-N 3.33Å; A143-L146 PolarHBondContact O-N 3.14Å; A143-L146 VanDerWaalsContact O-N 3.15Å; N144-L146 VanDerWaalsContact C-N 3.34Å; N144-L146 PolarHBondContact O-N 2.71Å; L146-V164 HydrophobicContact CD2-CG1 4.09Å |
| 147 | V | 91.3 | Very high | 89.1 | Confident | 10 Ų | 10 | 45.9 Ų | 45.9 | 6% | 0.061 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -88.9 | -34.9 | -174.1 | -178.2 | 0 | 0 | 0 | 0 | 111.7 | A143 N144 P149 L150 F151 P156 V164 | A143-V147 WeakPolarHBondContact O-CB 3.28Å; A143-V147 WeakPolarHBondContact O-CG2 3.46Å; A143-V147 PolarHBondContact O-N 3.12Å; N144-V147 PolarHBondContact O-N 3Å; V147-P149 VanDerWaalsContact C-CD 3.44Å; V147-L150 WeakPolarHBondContact O-CB 3.48Å; V147-L150 PolarHBondContact O-N 3.36Å; V147-F151 HydrophobicContact CG1-CD2 3.74Å; V147-F151 HydrophobicContact CG1-CE2 3.66Å; V147-P156 HydrophobicContact CB-CB 4.41Å; V147-P156 HydrophobicContact CG1-CB 3.58Å; V147-V164 HydrophobicContact CG2-CG2 4.16Å |
| 148 | Q | 87.5 | Confident | 88.8 | Confident | 27 Ų | 27 | 50.7 Ų | 50.7 | 13% | 0.126 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -50.4 | -44.4 | -178.2 | -173.7 | 68 | 31.3 | 0 | 0 | 114 | N144 L150 F151 A298 V301 | N144-Q148 WeakPolarHBondContact O-CB 3.13Å; N144-Q148 PolarHBondContact O-N 3.34Å; Q148-L150 PolarHBondContact O-N 2.94Å; Q148-L150 VanDerWaalsContact O-N 3.14Å; Q148-F151 CarbonylContact O-C 3.23Å; Q148-F151 VanDerWaalsContact O-C 3.23Å; Q148-F151 PolarHBondContact O-N 3.35Å; Q148-A298 HydrophobicContact CB-CB 4.17Å; Q148-A298 HydrophobicContact CG-CB 4.16Å; Q148-V301 HydrophobicContact CG-CB 4.4Å; Q148-V301 HydrophobicContact CG-CG1 4.09Å |
| 149 | P | 86.4 | Confident | 88.7 | Confident | 57 Ų | 57 | 54.4 Ų | 54.4 | 37% | 0.37 | 30% | 0.299 | S | S | . | . | G | 310 helix | trans | -63.9 | -20.3 | -179.9 | -22.4 | 35.2 | 0 | 0 | 0 | 114.3 | Y145 V147 F151 V301 P316 | Y145-P149 WeakPolarHBondContact O-CD 3.33Å; V147-P149 VanDerWaalsContact C-CD 3.44Å; P149-F151 VanDerWaalsContact C-N 3.31Å; P149-V301 HydrophobicContact CG-CG1 4.39Å; P149-P316 HydrophobicContact CG-CB 3.51Å; P149-P316 HydrophobicContact CG-CG 3.64Å |
| 150 | L | 88.1 | Confident | 88.4 | Confident | 132 Ų | 132 | 56.1 Ų | 56.1 | 69% | 0.691 | 31% | 0.314 | S | S | * | . | G | 310 helix | trans | -80.1 | -17 | 175.7 | -55.6 | 175.9 | 0 | 0 | 0 | 112.2 | V147 Q148 P152 | V147-L150 WeakPolarHBondContact O-CB 3.48Å; V147-L150 PolarHBondContact O-N 3.36Å; Q148-L150 PolarHBondContact O-N 2.94Å; Q148-L150 VanDerWaalsContact O-N 3.14Å; L150-P152 VanDerWaalsContact C-CD 3.42Å; L150-P152 WeakPolarHBondContact O-CD 3.25Å |
| 151 | F | 86.8 | Confident | 88.3 | Confident | 64 Ų | 64 | 56.2 Ų | 56.2 | 28% | 0.281 | 32% | 0.315 | S | S | . | . | trans | -125.6 | 65.5 | 179.6 | -61.7 | -91.1 | 0 | 0 | 0 | 109.9 | V147 Q148 P149 T153 C154 P156 P157 | V147-F151 HydrophobicContact CG1-CD2 3.74Å; V147-F151 HydrophobicContact CG1-CE2 3.66Å; Q148-F151 CarbonylContact O-C 3.23Å; Q148-F151 VanDerWaalsContact O-C 3.23Å; Q148-F151 PolarHBondContact O-N 3.35Å; P149-F151 VanDerWaalsContact C-N 3.31Å; F151-T153 VanDerWaalsContact C-N 3.27Å; F151-T153 PolarHBondContact O-N 3.05Å; F151-C154 WeakPolarHBondContact CB-O 3.4Å; F151-P156 HydrophobicContact CB-CB 4.41Å; F151-P156 HydrophobicContact CD2-CB 3.9Å; F151-P156 HydrophobicContact CE2-CB 4.49Å; F151-P156 HydrophobicContact CG-CB 4.25Å; F151-P157 HydrophobicContact CE1-CG 4.26Å; F151-P157 HydrophobicContact CZ-CG 4.19Å | ||
| 152 | P | 76.2 | Confident | 88.3 | Confident | 95 Ų | 95 | 57.3 Ų | 57.3 | 62% | 0.617 | 32% | 0.318 | S | S | * | . | S | Bend | trans | -69.3 | -22.6 | -174.2 | 27.4 | -35.2 | 0 | 0 | 0 | 113.7 | L150 | L150-P152 VanDerWaalsContact C-CD 3.42Å; L150-P152 WeakPolarHBondContact O-CD 3.25Å |
| 153 | T | 79.3 | Confident | 88.4 | Confident | 138 Ų | 138 | 61.6 Ų | 61.6 | 85% | 0.847 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -111.9 | -3.7 | -174.5 | 52.7 | 0 | 0 | 0 | 0 | 114.1 | F151 | F151-T153 VanDerWaalsContact C-N 3.27Å; F151-T153 PolarHBondContact O-N 3.05Å |
| 154 | C | 83.3 | Confident | 88.4 | Confident | 71 Ų | 71 | 63.7 Ų | 63.7 | 48% | 0.48 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -146.1 | 163.8 | -178.8 | 55.7 | 0 | 0 | 0 | 0 | 110.9 | F151 | F151-C154 WeakPolarHBondContact CB-O 3.4Š|
| 155 | E | 80.2 | Confident | 88.6 | Confident | 144 Ų | 144 | 62.8 Ų | 62.8 | 67% | 0.673 | 35% | 0.35 | S | S | * | . | P | Polyproline II helix | trans | -72.2 | 135 | 176.3 | -69.5 | -179.8 | 178.3 | 0 | 0 | 110.6 | ||
| 156 | P | 85.3 | Confident | 88.9 | Confident | 13 Ų | 13 | 63.8 Ų | 63.8 | 8% | 0.084 | 36% | 0.358 | C | S | . | . | P | Polyproline II helix | trans | -64 | 141.3 | 177.5 | 27 | -33.9 | 0 | 0 | 0 | 110.3 | V147 F151 Y158 | V147-P156 HydrophobicContact CB-CB 4.41Å; V147-P156 HydrophobicContact CG1-CB 3.58Å; F151-P156 HydrophobicContact CB-CB 4.41Å; F151-P156 HydrophobicContact CD2-CB 3.9Å; F151-P156 HydrophobicContact CE2-CB 4.49Å; F151-P156 HydrophobicContact CG-CB 4.25Å; P156-Y158 PolarHBondContact O-N 3.14Å |
| 157 | P | 90 | Very high | 89.2 | Confident | 64 Ų | 64 | 62.8 Ų | 62.8 | 42% | 0.416 | 36% | 0.362 | S | S | . | . | P | Polyproline II helix | trans | -59.1 | 127 | 179.9 | -23.3 | 32.2 | 0 | 0 | 0 | 111.6 | F151 T159 A160 S161 | F151-P157 HydrophobicContact CE1-CG 4.26Å; F151-P157 HydrophobicContact CZ-CG 4.19Å; P157-T159 VanDerWaalsContact C-N 3.26Å; P157-T159 PolarHBondContact O-N 3.25Å; P157-T159 VanDerWaalsContact O-N 3.16Å; P157-A160 HydrophobicContact CB-CB 4.21Å; P157-A160 WeakPolarHBondContact O-CB 3.33Å; P157-A160 PolarHBondContact O-N 3.31Å; P157-S161 PolarHBondContact O-N 3.06Å |
| 158 | Y | 89.2 | Confident | 89.4 | Confident | 101 Ų | 101 | 62.6 Ų | 62.6 | 40% | 0.396 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -46.9 | -48.7 | 179.8 | 174.1 | -99.1 | 0 | 0 | 0 | 112.8 | P156 A160 S161 R162 E379 | P156-Y158 PolarHBondContact O-N 3.14Å; Y158-A160 VanDerWaalsContact C-N 3.28Å; Y158-A160 PolarHBondContact O-N 2.76Å; Y158-S161 PolarHBondContact O-N 3.11Å; Y158-R162 HydrophobicContact CD1-CG 4.18Å; Y158-R162 HydrophobicContact CD2-CG 4.22Å; Y158-R162 HydrophobicContact CE1-CG 3.76Å; Y158-R162 HydrophobicContact CE2-CG 3.81Å; Y158-R162 HydrophobicContact CG-CG 4.39Å; Y158-R162 WeakPolarHBondContact O-CG 3.4Å; Y158-R162 PolarHBondContact O-N 3.14Å; Y158-R162 PolarHBondContact OH-NE 3.37Å; Y158-E379 HydrophobicContact CE2-CB 4.37Å; Y158-E379 HydrophobicContact CE2-CG 4.43Å; Y158-E379 WeakPolarHBondContact OH-CA 3.29Å |
| 159 | T | 90.7 | Very high | 89.8 | Confident | 92 Ų | 92 | 61.3 Ų | 61.3 | 56% | 0.564 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -60.6 | -36.1 | -179.7 | -48.2 | 0 | 0 | 0 | 0 | 112.6 | P157 L163 | P157-T159 VanDerWaalsContact C-N 3.26Å; P157-T159 PolarHBondContact O-N 3.25Å; P157-T159 VanDerWaalsContact O-N 3.16Å; T159-L163 HydrophobicContact CG2-CD1 4.02Å; T159-L163 HydrophobicContact CG2-CG 4.35Å; T159-L163 WeakPolarHBondContact O-CB 3.42Å; T159-L163 VanDerWaalsContact O-CG 3.25Å; T159-L163 WeakPolarHBondContact O-CG 3.33Å; T159-L163 PolarHBondContact O-N 3Å |
| 160 | A | 91.1 | Very high | 90.2 | Very high | 36 Ų | 36 | 61.3 Ų | 61.3 | 30% | 0.298 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -67 | -49.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | P157 Y158 R162 L163 V164 | P157-A160 HydrophobicContact CB-CB 4.21Å; P157-A160 WeakPolarHBondContact O-CB 3.33Å; P157-A160 PolarHBondContact O-N 3.31Å; Y158-A160 VanDerWaalsContact C-N 3.28Å; Y158-A160 PolarHBondContact O-N 2.76Å; A160-R162 VanDerWaalsContact C-N 3.32Å; A160-R162 PolarHBondContact O-N 3.02Å; A160-L163 PolarHBondContact O-N 3.46Å; A160-V164 VanDerWaalsContact O-CG2 3.3Å; A160-V164 WeakPolarHBondContact O-CG2 3.48Å; A160-V164 PolarHBondContact O-N 3.13Å |
| 161 | S | 91.3 | Very high | 90.5 | Very high | 5 Ų | 5 | 59.3 Ų | 59.3 | 4% | 0.035 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.5 | -42.2 | 176.5 | -61.8 | 0 | 0 | 0 | 0 | 111.7 | A143 N144 P157 Y158 V164 A165 | A143-S161 WeakPolarHBondContact CB-O 3.47Å; N144-S161 WeakPolarHBondContact OD1-CB 3.49Å; N144-S161 PolarHBondContact OD1-OG 3.35Å; P157-S161 PolarHBondContact O-N 3.06Å; Y158-S161 PolarHBondContact O-N 3.11Å; S161-V164 PolarHBondContact O-N 3.15Å; S161-A165 WeakPolarHBondContact O-CB 3.3Å; S161-A165 PolarHBondContact O-N 3.47Å |
| 162 | R | 94 | Very high | 90.7 | Very high | 25 Ų | 25 | 56.3 Ų | 56.3 | 9% | 0.094 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -67.2 | -40.1 | 179 | -65.2 | -61.9 | 175.1 | 148.1 | -6.6 | 113.5 | Y158 A160 A165 A166 L376 V378 E379 | Y158-R162 HydrophobicContact CD1-CG 4.18Å; Y158-R162 HydrophobicContact CD2-CG 4.22Å; Y158-R162 HydrophobicContact CE1-CG 3.76Å; Y158-R162 HydrophobicContact CE2-CG 3.81Å; Y158-R162 HydrophobicContact CG-CG 4.39Å; Y158-R162 WeakPolarHBondContact O-CG 3.4Å; Y158-R162 PolarHBondContact O-N 3.14Å; Y158-R162 PolarHBondContact OH-NE 3.37Å; A160-R162 VanDerWaalsContact C-N 3.32Å; A160-R162 PolarHBondContact O-N 3.02Å; R162-A165 PolarHBondContact O-N 3.25Å; R162-A166 WeakPolarHBondContact O-CB 3.39Å; R162-A166 PolarHBondContact O-N 2.98Å; R162-L376 PolarHBondContact NH1-O 3.34Å; R162-V378 PolarHBondContact NH1-O 2.76Å; R162-V378 PolarHBondContact NH2-O 3.49Å; R162-E379 PolarHBondContact NH2-O 3.47Å |
| 163 | L | 95.6 | Very high | 91.4 | Very high | 118 Ų | 118 | 52.2 Ų | 52.2 | 62% | 0.618 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -67.3 | -38.4 | 175.7 | -72.3 | 175 | 0 | 0 | 0 | 112 | T159 A160 A166 A167 | T159-L163 HydrophobicContact CG2-CD1 4.02Å; T159-L163 HydrophobicContact CG2-CG 4.35Å; T159-L163 WeakPolarHBondContact O-CB 3.42Å; T159-L163 VanDerWaalsContact O-CG 3.25Å; T159-L163 WeakPolarHBondContact O-CG 3.33Å; T159-L163 PolarHBondContact O-N 3Å; A160-L163 PolarHBondContact O-N 3.46Å; L163-A166 PolarHBondContact O-N 3.11Å; L163-A167 VanDerWaalsContact O-CB 3.31Å; L163-A167 WeakPolarHBondContact O-CB 3.13Å; L163-A167 PolarHBondContact O-N 2.85Å |
| 164 | V | 95.9 | Very high | 92 | Very high | 44 Ų | 44 | 52.5 Ų | 52.5 | 27% | 0.267 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 174.3 | 171.2 | 0 | 0 | 0 | 0 | 111 | F142 A143 L146 V147 A160 S161 A167 C168 | F142-V164 HydrophobicContact CD1-CG1 4.35Å; F142-V164 HydrophobicContact CE1-CG1 3.95Å; A143-V164 HydrophobicContact CB-CB 3.95Å; A143-V164 HydrophobicContact CB-CG1 3.82Å; L146-V164 HydrophobicContact CD2-CG1 4.09Å; V147-V164 HydrophobicContact CG2-CG2 4.16Å; A160-V164 VanDerWaalsContact O-CG2 3.3Å; A160-V164 WeakPolarHBondContact O-CG2 3.48Å; A160-V164 PolarHBondContact O-N 3.13Å; S161-V164 PolarHBondContact O-N 3.15Å; V164-A167 PolarHBondContact O-N 3.37Å; V164-C168 WeakPolarHBondContact O-CB 3.35Å; V164-C168 PolarHBondContact O-N 3.15Å |
| 165 | A | 96.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.9 | -46.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | A139 A143 S161 R162 C168 I169 L376 | A139-A165 HydrophobicContact CB-CB 3.98Å; A139-A165 WeakPolarHBondContact O-CB 3.31Å; A143-A165 HydrophobicContact CB-CB 3.97Å; S161-A165 WeakPolarHBondContact O-CB 3.3Å; S161-A165 PolarHBondContact O-N 3.47Å; R162-A165 PolarHBondContact O-N 3.25Å; A165-C168 WeakPolarHBondContact O-CB 3.49Å; A165-C168 PolarHBondContact O-N 3.4Å; A165-I169 PolarHBondContact O-N 2.88Å; A165-L376 HydrophobicContact CB-CD1 4.34Å; A165-L376 HydrophobicContact CB-CD2 4Å |
| 166 | A | 97.2 | Very high | 92.6 | Very high | 22 Ų | 22 | 44.2 Ų | 44.2 | 18% | 0.182 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | R162 L163 C168 I169 C170 L373 L376 | R162-A166 WeakPolarHBondContact O-CB 3.39Å; R162-A166 PolarHBondContact O-N 2.98Å; L163-A166 PolarHBondContact O-N 3.11Å; A166-C168 VanDerWaalsContact C-N 3.3Å; A166-C168 PolarHBondContact O-N 3.47Å; A166-I169 PolarHBondContact O-N 2.93Å; A166-C170 WeakPolarHBondContact O-CB 3.49Å; A166-C170 PolarHBondContact O-N 3.4Å; A166-C170 PolarHBondContact O-SG 3.34Å; A166-C170 VanDerWaalsContact O-SG 3.33Å; A166-L373 HydrophobicContact CB-CD2 3.7Å; A166-L376 HydrophobicContact CB-CD1 3.75Å |
| 167 | A | 97.1 | Very high | 92.6 | Very high | 61 Ų | 61 | 44.4 Ų | 44.4 | 50% | 0.504 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.1 | -40.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L163 V164 C170 L171 | L163-A167 VanDerWaalsContact O-CB 3.31Å; L163-A167 WeakPolarHBondContact O-CB 3.13Å; L163-A167 PolarHBondContact O-N 2.85Å; V164-A167 PolarHBondContact O-N 3.37Å; A167-C170 PolarHBondContact O-N 2.97Å; A167-L171 WeakPolarHBondContact O-CB 3.08Å; A167-L171 PolarHBondContact O-N 2.79Å |
| 168 | C | 95.2 | Very high | 92.3 | Very high | 6 Ų | 6 | 42.4 Ų | 42.4 | 4% | 0.041 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.9 | -47.7 | 176.8 | -170.5 | 0 | 0 | 0 | 0 | 112.2 | F142 V164 A165 A166 L171 L172 | F142-C168 HydrophobicContact CD1-CB 3.76Å; F142-C168 HydrophobicContact CE1-CB 3.68Å; V164-C168 WeakPolarHBondContact O-CB 3.35Å; V164-C168 PolarHBondContact O-N 3.15Å; A165-C168 WeakPolarHBondContact O-CB 3.49Å; A165-C168 PolarHBondContact O-N 3.4Å; A166-C168 VanDerWaalsContact C-N 3.3Å; A166-C168 PolarHBondContact O-N 3.47Å; C168-L171 PolarHBondContact O-N 2.92Å; C168-L172 WeakPolarHBondContact O-CB 3.28Å; C168-L172 PolarHBondContact O-N 3.47Å |
| 169 | I | 95.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.7 | -47.2 | 176.6 | -72.1 | 163.1 | 0 | 0 | 0 | 111 | A139 A165 A166 L171 L172 T173 L327 C369 L376 | A139-I169 HydrophobicContact CB-CD1 3.43Å; A139-I169 VanDerWaalsContact CB-CD1 3.43Å; A139-I169 HydrophobicContact CB-CG1 3.7Å; A165-I169 PolarHBondContact O-N 2.88Å; A166-I169 PolarHBondContact O-N 2.93Å; I169-L171 PolarHBondContact O-N 2.74Å; I169-L172 PolarHBondContact O-N 2.81Å; I169-T173 VanDerWaalsContact O-CB 3.29Å; I169-T173 WeakPolarHBondContact O-CB 3.37Å; I169-T173 PolarHBondContact O-N 3.19Å; I169-T173 PolarHBondContact O-OG1 3.16Å; I169-L327 HydrophobicContact CG1-CD1 4.33Å; I169-L327 HydrophobicContact CG1-CD2 3.86Å; I169-C369 HydrophobicContact CG2-CB 4.48Å; I169-L376 HydrophobicContact CD1-CD1 3.87Å; I169-L376 HydrophobicContact CD1-CD2 4.31Å; I169-L376 HydrophobicContact CD1-CG 4.21Å |
| 170 | C | 96.3 | Very high | 90.5 | Very high | 57 Ų | 57 | 40.8 Ų | 40.8 | 39% | 0.385 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -62.1 | -43.8 | 178.6 | -72.6 | 0 | 0 | 0 | 0 | 111.9 | A166 A167 T173 F174 | A166-C170 WeakPolarHBondContact O-CB 3.49Å; A166-C170 PolarHBondContact O-N 3.4Å; A166-C170 PolarHBondContact O-SG 3.34Å; A166-C170 VanDerWaalsContact O-SG 3.33Å; A167-C170 PolarHBondContact O-N 2.97Å; C170-T173 PolarHBondContact O-N 3.11Å; C170-F174 WeakPolarHBondContact O-CB 3.46Å; C170-F174 PolarHBondContact O-N 2.82Å |
| 171 | L | 93.3 | Very high | 89.3 | Confident | 90 Ų | 90 | 45.3 Ų | 45.3 | 47% | 0.471 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.9 | -48.1 | 178.6 | 178.5 | 62.9 | 0 | 0 | 0 | 111.4 | A167 C168 I169 T173 F174 I175 | A167-L171 WeakPolarHBondContact O-CB 3.08Å; A167-L171 PolarHBondContact O-N 2.79Å; C168-L171 PolarHBondContact O-N 2.92Å; I169-L171 PolarHBondContact O-N 2.74Å; L171-T173 VanDerWaalsContact C-N 3.35Å; L171-T173 PolarHBondContact O-N 2.99Å; L171-F174 WeakPolarHBondContact O-CB 3.15Å; L171-F174 PolarHBondContact O-N 2.79Å; L171-I175 HydrophobicContact CD1-CD1 4.11Å; L171-I175 HydrophobicContact CD1-CG1 4.44Å; L171-I175 HydrophobicContact CG-CD1 3.96Å; L171-I175 VanDerWaalsContact O-CG1 3.31Å; L171-I175 WeakPolarHBondContact O-CG1 3.5Å; L171-I175 PolarHBondContact O-N 2.84Å |
| 172 | L | 91.4 | Very high | 88 | Confident | 1 Ų | 1 | 53.6 Ų | 53.6 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -65.1 | -39.5 | 178 | -79.1 | 174.7 | 0 | 0 | 0 | 112.1 | C168 I169 F174 I175 N176 Y324 L327 N328 I331 | C168-L172 WeakPolarHBondContact O-CB 3.28Å; C168-L172 PolarHBondContact O-N 3.47Å; I169-L172 PolarHBondContact O-N 2.81Å; L172-F174 VanDerWaalsContact C-N 3.31Å; L172-F174 PolarHBondContact O-N 3.04Å; L172-I175 PolarHBondContact O-N 3.18Å; L172-N176 WeakPolarHBondContact O-CB 3.48Å; L172-N176 PolarHBondContact O-N 2.73Å; L172-N176 PolarHBondContact O-ND2 2.77Å; L172-Y324 HydrophobicContact CD1-CD2 4.16Å; L172-Y324 HydrophobicContact CD1-CE2 4.14Å; L172-Y324 HydrophobicContact CD2-CD1 4.29Å; L172-Y324 HydrophobicContact CD2-CD2 4.37Å; L172-Y324 HydrophobicContact CD2-CE1 3.61Å; L172-Y324 HydrophobicContact CD2-CE2 3.7Å; L172-Y324 WeakPolarHBondContact CD2-OH 3.3Å; L172-Y324 HydrophobicContact CG-CD2 4.34Å; L172-Y324 HydrophobicContact CG-CE2 3.81Å; L172-L327 HydrophobicContact CD1-CB 3.82Å; L172-L327 HydrophobicContact CD1-CD2 3.62Å; L172-L327 HydrophobicContact CD1-CG 3.58Å; L172-N328 HydrophobicContact CD1-CB 4.32Å; L172-N328 HydrophobicContact CD2-CB 3.86Å; L172-I331 HydrophobicContact CB-CD1 3.8Å; L172-I331 HydrophobicContact CD1-CD1 4.45Å |
| 173 | T | 92 | Very high | 86.2 | Confident | 8 Ų | 8 | 52.6 Ų | 52.6 | 5% | 0.049 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.1 | -43 | 174.2 | -58.6 | 0 | 0 | 0 | 0 | 110.8 | I169 C170 L171 S177 L365 C369 | I169-T173 VanDerWaalsContact O-CB 3.29Å; I169-T173 WeakPolarHBondContact O-CB 3.37Å; I169-T173 PolarHBondContact O-N 3.19Å; I169-T173 PolarHBondContact O-OG1 3.16Å; C170-T173 PolarHBondContact O-N 3.11Å; L171-T173 VanDerWaalsContact C-N 3.35Å; L171-T173 PolarHBondContact O-N 2.99Å; T173-S177 VanDerWaalsContact O-CB 3.28Å; T173-S177 WeakPolarHBondContact O-CB 3.39Å; T173-S177 PolarHBondContact O-N 3.21Å; T173-S177 PolarHBondContact O-OG 2.85Å; T173-L365 HydrophobicContact CG2-CB 4.12Å; T173-C369 HydrophobicContact CG2-CB 3.7Å; T173-C369 WeakPolarHBondContact OG1-CB 3.42Å |
| 174 | F | 91.6 | Very high | 84.4 | Confident | 144 Ų | 144 | 49.9 Ų | 49.9 | 63% | 0.632 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -62.3 | -47.9 | 175.8 | 175 | -99.2 | 0 | 0 | 0 | 112 | C170 L171 L172 N176 S177 A178 | C170-F174 WeakPolarHBondContact O-CB 3.46Å; C170-F174 PolarHBondContact O-N 2.82Å; L171-F174 WeakPolarHBondContact O-CB 3.15Å; L171-F174 PolarHBondContact O-N 2.79Å; L172-F174 VanDerWaalsContact C-N 3.31Å; L172-F174 PolarHBondContact O-N 3.04Å; F174-N176 PolarHBondContact O-N 3.16Å; F174-S177 PolarHBondContact O-N 2.81Å; F174-A178 VanDerWaalsContact O-CB 3.28Å; F174-A178 WeakPolarHBondContact O-CB 3.41Å; F174-A178 PolarHBondContact O-N 3.23Å |
| 175 | I | 88.2 | Confident | 82.8 | Confident | 39 Ų | 39 | 57 Ų | 57 | 20% | 0.2 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.4 | -47.4 | 178.3 | -68.8 | 166.1 | 0 | 0 | 0 | 110.7 | L171 L172 S177 A178 Y179 W182 Y324 | L171-I175 HydrophobicContact CD1-CD1 4.11Å; L171-I175 HydrophobicContact CD1-CG1 4.44Å; L171-I175 HydrophobicContact CG-CD1 3.96Å; L171-I175 VanDerWaalsContact O-CG1 3.31Å; L171-I175 WeakPolarHBondContact O-CG1 3.5Å; L171-I175 PolarHBondContact O-N 2.84Å; L172-I175 PolarHBondContact O-N 3.18Å; I175-S177 VanDerWaalsContact C-N 3.32Å; I175-S177 PolarHBondContact O-N 2.8Å; I175-A178 PolarHBondContact O-N 3.47Å; I175-A178 VanDerWaalsContact O-N 3.15Å; I175-Y179 PolarHBondContact O-N 2.79Å; I175-W182 HydrophobicContact CG2-CB 4.47Å; I175-Y324 WeakPolarHBondContact CD1-OH 3.39Å |
| 176 | N | 86.4 | Confident | 81.1 | Confident | 3 Ų | 3 | 59.6 Ų | 59.6 | 2% | 0.016 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -68.1 | -31.3 | 179.5 | -76.3 | -62.4 | 0 | 0 | 0 | 113 | L172 F174 A178 N328 I332 L365 | L172-N176 WeakPolarHBondContact O-CB 3.48Å; L172-N176 PolarHBondContact O-N 2.73Å; L172-N176 PolarHBondContact O-ND2 2.77Å; F174-N176 PolarHBondContact O-N 3.16Å; N176-A178 VanDerWaalsContact C-N 3.34Å; N176-N328 PolarHBondContact ND2-OD1 3.11Å; N176-N328 PolarHBondContact OD1-OD1 2.78Å; N176-I332 WeakPolarHBondContact OD1-CD1 3.48Å; N176-I332 WeakPolarHBondContact OD1-CG1 3.44Å; N176-L365 HydrophobicContact CB-CD1 4.09Å; N176-L365 HydrophobicContact CB-CD2 4.24Å |
| 177 | S | 85.7 | Confident | 79.3 | Confident | 16 Ų | 16 | 60.4 Ų | 60.4 | 11% | 0.112 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -70.1 | -35 | 172.5 | -60.2 | 0 | 0 | 0 | 0 | 111.3 | T173 F174 I175 T360 | T173-S177 VanDerWaalsContact O-CB 3.28Å; T173-S177 WeakPolarHBondContact O-CB 3.39Å; T173-S177 PolarHBondContact O-N 3.21Å; T173-S177 PolarHBondContact O-OG 2.85Å; F174-S177 PolarHBondContact O-N 2.81Å; I175-S177 VanDerWaalsContact C-N 3.32Å; I175-S177 PolarHBondContact O-N 2.8Å; S177-T360 PolarHBondContact O-OG1 2.92Å |
| 178 | A | 84.1 | Confident | 77.6 | Confident | 23 Ų | 23 | 62.6 Ų | 62.6 | 19% | 0.19 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -78.5 | -51.8 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | F174 I175 N176 R358 | F174-A178 VanDerWaalsContact O-CB 3.28Å; F174-A178 WeakPolarHBondContact O-CB 3.41Å; F174-A178 PolarHBondContact O-N 3.23Å; I175-A178 PolarHBondContact O-N 3.47Å; I175-A178 VanDerWaalsContact O-N 3.15Å; N176-A178 VanDerWaalsContact C-N 3.34Å; A178-R358 WeakPolarHBondContact O-CD 3.21Å; A178-R358 PolarHBondContact O-NH1 3.38Å |
| 179 | Y | 76.4 | Confident | 76.3 | Confident | 110 Ų | 110 | 68 Ų | 68 | 43% | 0.431 | 33% | 0.327 | S | S | . | . | trans | -160.9 | 104.6 | 179.7 | -162.2 | -102.3 | 0 | 0 | 0 | 112.8 | I175 K181 W182 | I175-Y179 PolarHBondContact O-N 2.79Å; Y179-K181 VanDerWaalsContact C-N 3.29Å; Y179-K181 HydrophobicContact CD1-CB 3.96Å; Y179-K181 HydrophobicContact CE1-CB 3.55Å; Y179-K181 HydrophobicContact CE1-CD 4.02Å; Y179-K181 HydrophobicContact CE1-CG 3.97Å; Y179-K181 PolarHBondContact O-N 3.01Å; Y179-K181 VanDerWaalsContact O-N 3.15Å; Y179-W182 AromaticContact CD1-CD1 3.27Å; Y179-W182 HydrophobicContact CD1-CG 4.06Å; Y179-W182 AromaticContact CD1-NE1 3.66Å; Y179-W182 AromaticContact CE1-CD1 3.79Å; Y179-W182 PolarHBondContact O-N 2.82Å; Y179-W182 VanDerWaalsContact O-N 3.16Å | ||
| 180 | V | 65.3 | Low | 75.1 | Confident | 48 Ų | 48 | 69.6 Ų | 69.6 | 29% | 0.291 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -57.7 | -34.4 | -173 | -173.2 | 0 | 0 | 0 | 0 | 113.8 | W182 G183 T184 T360 | V180-W182 PolarHBondContact O-N 2.8Å; V180-G183 PolarHBondContact O-N 3.3Å; V180-G183 VanDerWaalsContact O-N 3.09Å; V180-T184 PolarHBondContact O-N 3.44Å; V180-T360 HydrophobicContact CG2-CG2 3.36Å |
| 181 | K | 66.6 | Low | 73.9 | Confident | 132 Ų | 132 | 67.9 Ų | 67.9 | 57% | 0.574 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -69.7 | -15.1 | -175.8 | -53.6 | -177.8 | 179.5 | 174.8 | 0 | 113.6 | Y179 T184 | Y179-K181 VanDerWaalsContact C-N 3.29Å; Y179-K181 HydrophobicContact CD1-CB 3.96Å; Y179-K181 HydrophobicContact CE1-CB 3.55Å; Y179-K181 HydrophobicContact CE1-CD 4.02Å; Y179-K181 HydrophobicContact CE1-CG 3.97Å; Y179-K181 PolarHBondContact O-N 3.01Å; Y179-K181 VanDerWaalsContact O-N 3.15Å; K181-T184 PolarHBondContact O-OG1 3.28Å |
| 182 | W | 63.1 | Low | 73 | Confident | 179 Ų | 179 | 71.5 Ų | 71.5 | 68% | 0.678 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -74.9 | -37.6 | 172.2 | -75.3 | 25.2 | 0 | 0 | 0 | 110.7 | I175 Y179 V180 T184 V186 | I175-W182 HydrophobicContact CG2-CB 4.47Å; Y179-W182 AromaticContact CD1-CD1 3.27Å; Y179-W182 HydrophobicContact CD1-CG 4.06Å; Y179-W182 AromaticContact CD1-NE1 3.66Å; Y179-W182 AromaticContact CE1-CD1 3.79Å; Y179-W182 PolarHBondContact O-N 2.82Å; Y179-W182 VanDerWaalsContact O-N 3.16Å; V180-W182 PolarHBondContact O-N 2.8Å; W182-T184 PolarHBondContact O-N 3.2Å; W182-V186 VanDerWaalsContact O-CG2 3.29Å; W182-V186 WeakPolarHBondContact O-CG2 3.39Å |
| 183 | G | 56.6 | Low | 72.3 | Confident | 3 Ų | 3 | 73.2 Ų | 73.2 | 3% | 0.031 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.7 | -40.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | V180 Q187 N328 | V180-G183 PolarHBondContact O-N 3.3Å; V180-G183 VanDerWaalsContact O-N 3.09Å; G183-Q187 PolarHBondContact O-N 2.65Å; G183-N328 PolarHBondContact O-ND2 2.99Å; G183-N328 VanDerWaalsContact O-ND2 3.15Å |
| 184 | T | 58.4 | Low | 71.6 | Confident | 62 Ų | 62 | 73.3 Ų | 73.3 | 38% | 0.38 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -73.2 | -38 | -176.3 | 55.4 | 0 | 0 | 0 | 0 | 113.8 | V180 K181 W182 V186 Q187 | V180-T184 PolarHBondContact O-N 3.44Å; K181-T184 PolarHBondContact O-OG1 3.28Å; W182-T184 PolarHBondContact O-N 3.2Å; T184-V186 VanDerWaalsContact C-N 3.32Å; T184-V186 PolarHBondContact O-N 2.87Å; T184-Q187 PolarHBondContact O-N 3.48Å |
| 185 | R | 62.3 | Low | 71.1 | Confident | 192 Ų | 192 | 68.4 Ų | 68.4 | 73% | 0.725 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -68.1 | -31.7 | 178.4 | -74.6 | -176.2 | 177 | 165.3 | -1.3 | 113.4 | ||
| 186 | V | 61.1 | Low | 71 | Confident | 55 Ų | 55 | 69 Ų | 69 | 33% | 0.333 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -73.2 | -31.3 | -179.4 | 170.6 | 0 | 0 | 0 | 0 | 111 | W182 T184 F190 Y324 | W182-V186 VanDerWaalsContact O-CG2 3.29Å; W182-V186 WeakPolarHBondContact O-CG2 3.39Å; T184-V186 VanDerWaalsContact C-N 3.32Å; T184-V186 PolarHBondContact O-N 2.87Å; V186-F190 HydrophobicContact CB-CE2 4.45Å; V186-F190 HydrophobicContact CG1-CD2 3.86Å; V186-F190 HydrophobicContact CG1-CE2 3.09Å; V186-F190 HydrophobicContact CG1-CZ 3.56Å; V186-F190 WeakPolarHBondContact O-CD2 3.29Å; V186-F190 WeakPolarHBondContact O-CG 3.35Å; V186-Y324 HydrophobicContact CG1-CE1 4.16Å |
| 187 | Q | 59 | Low | 70.9 | Confident | 39 Ų | 39 | 69 Ų | 69 | 18% | 0.182 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -69.1 | -39.8 | -178.7 | -176.8 | 177.3 | -18.3 | 0 | 0 | 114.1 | G183 T184 I189 F190 T191 | G183-Q187 PolarHBondContact O-N 2.65Å; T184-Q187 PolarHBondContact O-N 3.48Å; Q187-I189 VanDerWaalsContact C-N 3.34Å; Q187-I189 PolarHBondContact O-N 3.14Å; Q187-F190 PolarHBondContact O-N 3.36Å; Q187-T191 PolarHBondContact O-N 3.37Å; Q187-T191 PolarHBondContact O-OG1 3.27Å; Q187-T191 VanDerWaalsContact O-OG1 3.08Å |
| 188 | D | 62 | Low | 71.1 | Confident | 107 Ų | 107 | 68.4 Ų | 68.4 | 57% | 0.572 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -63.5 | -40.2 | -176.3 | -73 | -16.7 | 0 | 0 | 0 | 111.9 | F190 T191 Y192 | D188-F190 PolarHBondContact O-N 2.99Å; D188-T191 PolarHBondContact O-N 2.98Å; D188-Y192 VanDerWaalsContact O-CD2 3.23Å; D188-Y192 WeakPolarHBondContact O-CD2 3.4Å |
| 189 | I | 67.6 | Low | 71.5 | Confident | 119 Ų | 119 | 71.3 Ų | 71.3 | 61% | 0.61 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -65.3 | -40.3 | 178.8 | -63.3 | 172.7 | 0 | 0 | 0 | 110.8 | Q187 T191 Y192 A193 | Q187-I189 VanDerWaalsContact C-N 3.34Å; Q187-I189 PolarHBondContact O-N 3.14Å; I189-T191 VanDerWaalsContact C-N 3.28Å; I189-T191 PolarHBondContact O-N 2.98Å; I189-Y192 PolarHBondContact O-N 2.91Å; I189-A193 PolarHBondContact O-N 2.91Å |
| 190 | F | 70.9 | Confident | 72.2 | Confident | 34 Ų | 34 | 68.8 Ų | 68.8 | 15% | 0.149 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -73 | -21.5 | -177.7 | -60.6 | -25.2 | 0 | 0 | 0 | 113.6 | V186 Q187 D188 A193 K194 L321 Y324 | V186-F190 HydrophobicContact CB-CE2 4.45Å; V186-F190 HydrophobicContact CG1-CD2 3.86Å; V186-F190 HydrophobicContact CG1-CE2 3.09Å; V186-F190 HydrophobicContact CG1-CZ 3.56Å; V186-F190 WeakPolarHBondContact O-CD2 3.29Å; V186-F190 WeakPolarHBondContact O-CG 3.35Å; Q187-F190 PolarHBondContact O-N 3.36Å; D188-F190 PolarHBondContact O-N 2.99Å; F190-A193 PolarHBondContact O-N 3.11Å; F190-K194 PolarHBondContact O-N 3.43Å; F190-K194 VanDerWaalsContact O-N 3.16Å; F190-L321 HydrophobicContact CD1-CB 4.02Å; F190-L321 HydrophobicContact CD1-CD1 4.31Å; F190-L321 HydrophobicContact CD1-CD2 4.41Å; F190-L321 HydrophobicContact CD1-CG 4.48Å; F190-L321 HydrophobicContact CE1-CB 4.25Å; F190-L321 HydrophobicContact CE1-CD1 4.09Å; F190-L321 HydrophobicContact CE1-CD2 3.78Å; F190-L321 HydrophobicContact CE1-CG 4.26Å; F190-L321 HydrophobicContact CE2-CD2 4.29Å; F190-L321 HydrophobicContact CG-CB 4.23Å; F190-L321 HydrophobicContact CZ-CD2 3.72Å; F190-Y324 HydrophobicContact CD2-CD1 4.44Å; F190-Y324 AromaticContact CE2-CD1 3.84Å; F190-Y324 HydrophobicContact CE2-CD1 3.84Å; F190-Y324 HydrophobicContact CE2-CE1 4.37Å |
| 191 | T | 70.1 | Confident | 73.5 | Confident | 21 Ų | 21 | 66.5 Ų | 66.5 | 13% | 0.129 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -67 | -38.6 | 176.9 | -59.1 | 0 | 0 | 0 | 0 | 112.1 | Q187 D188 I189 K194 V195 | Q187-T191 PolarHBondContact O-N 3.37Å; Q187-T191 PolarHBondContact O-OG1 3.27Å; Q187-T191 VanDerWaalsContact O-OG1 3.08Å; D188-T191 PolarHBondContact O-N 2.98Å; I189-T191 VanDerWaalsContact C-N 3.28Å; I189-T191 PolarHBondContact O-N 2.98Å; T191-K194 VanDerWaalsContact O-CG 3.3Å; T191-K194 WeakPolarHBondContact O-CG 3.19Å; T191-V195 WeakPolarHBondContact O-CG2 3.45Å |
| 192 | Y | 75 | Confident | 74.9 | Confident | 167 Ų | 167 | 61.1 Ų | 61.1 | 66% | 0.655 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -72.5 | -39.6 | 175.3 | -63.2 | -75 | 0 | 0 | 0 | 112 | D188 I189 K194 V195 A196 | D188-Y192 VanDerWaalsContact O-CD2 3.23Å; D188-Y192 WeakPolarHBondContact O-CD2 3.4Å; I189-Y192 PolarHBondContact O-N 2.91Å; Y192-K194 PolarHBondContact O-N 2.91Å; Y192-V195 PolarHBondContact O-N 3.18Å; Y192-A196 PolarHBondContact O-N 2.84Å; Y192-A196 VanDerWaalsContact O-N 3.08Å |
| 193 | A | 75.9 | Confident | 76.4 | Confident | 36 Ų | 36 | 57.3 Ų | 57.3 | 30% | 0.298 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.9 | -41.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | I189 F190 A196 A197 | I189-A193 PolarHBondContact O-N 2.91Å; F190-A193 PolarHBondContact O-N 3.11Å; A193-A196 PolarHBondContact O-N 2.86Å; A193-A197 PolarHBondContact O-N 3.27Å |
| 194 | K | 77.3 | Confident | 78.1 | Confident | 11 Ų | 11 | 58.4 Ų | 58.4 | 5% | 0.048 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -71 | -36.1 | 179.8 | 69.4 | -174.5 | 177.9 | -171.2 | 0 | 113.7 | G51 I54 F190 T191 Y192 A196 A197 L198 S322 | G51-K194 WeakPolarHBondContact O-CE 3.42Å; G51-K194 PolarHBondContact O-NZ 2.92Å; I54-K194 HydrophobicContact CG2-CD 4.35Å; I54-K194 HydrophobicContact CG2-CG 4.41Å; I54-K194 WeakPolarHBondContact O-CD 3.36Å; I54-K194 WeakPolarHBondContact O-CE 3.48Å; I54-K194 PolarHBondContact O-NZ 2.8Å; F190-K194 PolarHBondContact O-N 3.43Å; F190-K194 VanDerWaalsContact O-N 3.16Å; T191-K194 VanDerWaalsContact O-CG 3.3Å; T191-K194 WeakPolarHBondContact O-CG 3.19Å; Y192-K194 PolarHBondContact O-N 2.91Å; K194-A196 VanDerWaalsContact C-N 3.32Å; K194-A197 PolarHBondContact O-N 3.35Å; K194-L198 PolarHBondContact O-N 2.95Å; K194-L198 VanDerWaalsContact O-N 3.09Å; K194-S322 WeakPolarHBondContact CD-OG 3.43Å |
| 195 | V | 81.5 | Confident | 79.8 | Confident | 40 Ų | 40 | 55.5 Ų | 55.5 | 24% | 0.242 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -65.7 | -41.1 | 175.5 | 175.5 | 0 | 0 | 0 | 0 | 109.5 | I54 T191 Y192 A197 L198 I199 | I54-V195 HydrophobicContact CD1-CG2 4.42Å; T191-V195 WeakPolarHBondContact O-CG2 3.45Å; Y192-V195 PolarHBondContact O-N 3.18Å; V195-A197 VanDerWaalsContact C-N 3.35Å; V195-A197 PolarHBondContact O-N 2.88Å; V195-L198 PolarHBondContact O-N 2.9Å; V195-I199 HydrophobicContact CG1-CD1 3.92Å; V195-I199 HydrophobicContact CG1-CG1 4.48Å; V195-I199 VanDerWaalsContact O-CG1 3.29Å; V195-I199 WeakPolarHBondContact O-CG1 3.34Å; V195-I199 PolarHBondContact O-N 2.84Å |
| 196 | A | 85.1 | Confident | 81.4 | Confident | 51 Ų | 51 | 50.3 Ų | 50.3 | 42% | 0.421 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.9 | -42.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y192 A193 K194 L198 I199 V200 | Y192-A196 PolarHBondContact O-N 2.84Å; Y192-A196 VanDerWaalsContact O-N 3.08Å; A193-A196 PolarHBondContact O-N 2.86Å; K194-A196 VanDerWaalsContact C-N 3.32Å; A196-L198 PolarHBondContact O-N 3.41Å; A196-I199 PolarHBondContact O-N 3.18Å; A196-V200 WeakPolarHBondContact O-CG2 3.2Å; A196-V200 PolarHBondContact O-N 3.42Å |
| 197 | A | 85.8 | Confident | 82.9 | Confident | 5 Ų | 5 | 51 Ų | 51 | 4% | 0.041 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -61.3 | -41.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | A193 K194 V195 V200 I201 I315 A318 | A193-A197 PolarHBondContact O-N 3.27Å; K194-A197 PolarHBondContact O-N 3.35Å; V195-A197 VanDerWaalsContact C-N 3.35Å; V195-A197 PolarHBondContact O-N 2.88Å; A197-V200 PolarHBondContact O-N 3.28Å; A197-I201 WeakPolarHBondContact O-CG1 3.36Å; A197-I201 PolarHBondContact O-N 3.47Å; A197-I201 VanDerWaalsContact O-N 3.12Å; A197-I315 HydrophobicContact CB-CD1 4.42Å; A197-A318 HydrophobicContact CB-CB 3.64Å |
| 198 | L | 90.1 | Very high | 84.6 | Confident | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.01 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.5 | -38.9 | 175 | -70.3 | 176.7 | 0 | 0 | 0 | 112.3 | I54 I58 F59 K194 V195 A196 V200 I201 I202 I276 T280 | I54-L198 HydrophobicContact CD1-CD1 4.49Å; I54-L198 HydrophobicContact CG2-CD1 3.35Å; I58-L198 HydrophobicContact CG1-CD2 4.49Å; I58-L198 HydrophobicContact CG2-CD1 4.41Å; I58-L198 HydrophobicContact CG2-CD2 4.18Å; F59-L198 HydrophobicContact CE1-CD2 3.75Å; F59-L198 HydrophobicContact CZ-CD2 3.71Å; F59-L198 HydrophobicContact CZ-CG 4.17Å; K194-L198 PolarHBondContact O-N 2.95Å; K194-L198 VanDerWaalsContact O-N 3.09Å; V195-L198 PolarHBondContact O-N 2.9Å; A196-L198 PolarHBondContact O-N 3.41Å; L198-V200 VanDerWaalsContact C-N 3.31Å; L198-V200 PolarHBondContact O-N 3.25Å; L198-I201 HydrophobicContact CD2-CD1 4.46Å; L198-I201 PolarHBondContact O-N 2.85Å; L198-I202 VanDerWaalsContact O-CG1 3.26Å; L198-I202 WeakPolarHBondContact O-CG1 3.41Å; L198-I202 PolarHBondContact O-N 3.29Å; L198-I276 HydrophobicContact CB-CG2 4.32Å; L198-I276 HydrophobicContact CD1-CG2 3.8Å; L198-T280 HydrophobicContact CD2-CG2 4.06Å |
| 199 | I | 91.2 | Very high | 86 | Confident | 85 Ų | 85 | 48.3 Ų | 48.3 | 44% | 0.436 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.5 | -42.8 | 175 | -70.4 | 166.9 | 0 | 0 | 0 | 110.5 | V195 A196 I201 I202 I203 | V195-I199 HydrophobicContact CG1-CD1 3.92Å; V195-I199 HydrophobicContact CG1-CG1 4.48Å; V195-I199 VanDerWaalsContact O-CG1 3.29Å; V195-I199 WeakPolarHBondContact O-CG1 3.34Å; V195-I199 PolarHBondContact O-N 2.84Å; A196-I199 PolarHBondContact O-N 3.18Å; I199-I201 PolarHBondContact O-N 3.16Å; I199-I202 PolarHBondContact O-N 2.96Å; I199-I203 HydrophobicContact CG2-CD1 3.54Å; I199-I203 HydrophobicContact CG2-CG1 4.19Å; I199-I203 WeakPolarHBondContact O-CB 3.43Å; I199-I203 VanDerWaalsContact O-CG1 3.29Å; I199-I203 WeakPolarHBondContact O-CG1 3.48Å; I199-I203 PolarHBondContact O-N 2.96Å |
| 200 | V | 91.4 | Very high | 87.2 | Confident | 57 Ų | 57 | 47.9 Ų | 47.9 | 35% | 0.345 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -58.4 | -49.3 | 175.4 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | A196 A197 L198 I202 I203 T204 L308 I315 | A196-V200 WeakPolarHBondContact O-CG2 3.2Å; A196-V200 PolarHBondContact O-N 3.42Å; A197-V200 PolarHBondContact O-N 3.28Å; L198-V200 VanDerWaalsContact C-N 3.31Å; L198-V200 PolarHBondContact O-N 3.25Å; V200-I202 VanDerWaalsContact C-N 3.34Å; V200-I202 PolarHBondContact O-N 2.97Å; V200-I203 PolarHBondContact O-N 3.31Å; V200-T204 WeakPolarHBondContact O-CB 3.39Å; V200-T204 PolarHBondContact O-N 3.17Å; V200-T204 PolarHBondContact O-OG1 3.02Å; V200-L308 HydrophobicContact CG1-CD1 4.16Å; V200-L308 HydrophobicContact CG1-CD2 4.27Å; V200-I315 HydrophobicContact CG1-CD1 4.47Å |
| 201 | I | 92.9 | Very high | 88.2 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -57.6 | -46.8 | 178 | -67.7 | 166.3 | 0 | 0 | 0 | 111.2 | F59 A197 L198 I199 T204 G205 T280 A283 Y284 A300 F303 I315 | F59-I201 HydrophobicContact CE1-CD1 4.41Å; A197-I201 WeakPolarHBondContact O-CG1 3.36Å; A197-I201 PolarHBondContact O-N 3.47Å; A197-I201 VanDerWaalsContact O-N 3.12Å; L198-I201 HydrophobicContact CD2-CD1 4.46Å; L198-I201 PolarHBondContact O-N 2.85Å; I199-I201 PolarHBondContact O-N 3.16Å; I201-T204 PolarHBondContact O-N 3.48Å; I201-G205 PolarHBondContact O-N 2.98Å; I201-T280 HydrophobicContact CG2-CG2 4.22Å; I201-A283 HydrophobicContact CG2-CB 3.95Å; I201-A283 WeakPolarHBondContact O-CB 3.47Å; I201-Y284 HydrophobicContact CD1-CE1 4.3Å; I201-Y284 HydrophobicContact CG2-CD1 4.21Å; I201-Y284 HydrophobicContact CG2-CE1 3.71Å; I201-A300 HydrophobicContact CD1-CB 4.08Å; I201-F303 HydrophobicContact CB-CE1 4.24Å; I201-F303 HydrophobicContact CG1-CD1 4.21Å; I201-F303 HydrophobicContact CG1-CE1 4.19Å; I201-F303 HydrophobicContact CG2-CD1 4.24Å; I201-F303 HydrophobicContact CG2-CE1 3.96Å; I201-F303 HydrophobicContact CG2-CZ 4.16Å; I201-I315 HydrophobicContact CD1-CD1 4.29Å; I201-I315 HydrophobicContact CG1-CD1 4.06Å |
| 202 | I | 95.2 | Very high | 89.1 | Confident | 19 Ų | 19 | 52.9 Ų | 52.9 | 10% | 0.097 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.2 | -48.7 | -179 | -69.1 | 166.2 | 0 | 0 | 0 | 111.1 | L198 I199 V200 T204 G205 I206 I276 L279 | L198-I202 VanDerWaalsContact O-CG1 3.26Å; L198-I202 WeakPolarHBondContact O-CG1 3.41Å; L198-I202 PolarHBondContact O-N 3.29Å; I199-I202 PolarHBondContact O-N 2.96Å; V200-I202 VanDerWaalsContact C-N 3.34Å; V200-I202 PolarHBondContact O-N 2.97Å; I202-T204 PolarHBondContact O-N 3.03Å; I202-G205 PolarHBondContact O-N 3.18Å; I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.48Å; I202-I206 WeakPolarHBondContact O-CG1 3.25Å; I202-I206 PolarHBondContact O-N 3.46Å; I202-I276 HydrophobicContact CD1-CG2 4.16Å; I202-L279 HydrophobicContact CD1-CB 3.96Å; I202-L279 HydrophobicContact CG1-CB 3.92Å; I202-L279 HydrophobicContact CG2-CB 4.01Å; I202-L279 HydrophobicContact CG2-CD1 4.15Å |
| 203 | I | 94.9 | Very high | 89.8 | Confident | 99 Ų | 99 | 50.8 Ų | 50.8 | 51% | 0.508 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.8 | -46.8 | -179.6 | -68.9 | 172.2 | 0 | 0 | 0 | 110.2 | I199 V200 G205 I206 V207 | I199-I203 HydrophobicContact CG2-CD1 3.54Å; I199-I203 HydrophobicContact CG2-CG1 4.19Å; I199-I203 WeakPolarHBondContact O-CB 3.43Å; I199-I203 VanDerWaalsContact O-CG1 3.29Å; I199-I203 WeakPolarHBondContact O-CG1 3.48Å; I199-I203 PolarHBondContact O-N 2.96Å; V200-I203 PolarHBondContact O-N 3.31Å; I203-G205 VanDerWaalsContact C-N 3.32Å; I203-G205 PolarHBondContact O-N 3.45Å; I203-I206 PolarHBondContact O-N 3.27Å; I203-V207 HydrophobicContact CG2-CG2 4.46Å; I203-V207 WeakPolarHBondContact O-CG2 3.32Å; I203-V207 PolarHBondContact O-N 2.77Å |
| 204 | T | 93.3 | Very high | 90.4 | Very high | 26 Ų | 26 | 51.7 Ų | 51.7 | 16% | 0.16 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60 | -42.6 | 177.5 | -59.7 | 0 | 0 | 0 | 0 | 111.5 | V200 I201 I202 V207 K208 F303 T307 L308 | V200-T204 WeakPolarHBondContact O-CB 3.39Å; V200-T204 PolarHBondContact O-N 3.17Å; V200-T204 PolarHBondContact O-OG1 3.02Å; I201-T204 PolarHBondContact O-N 3.48Å; I202-T204 PolarHBondContact O-N 3.03Å; T204-V207 PolarHBondContact O-N 3.35Å; T204-K208 WeakPolarHBondContact O-CG 3.31Å; T204-K208 PolarHBondContact O-N 3.1Å; T204-F303 HydrophobicContact CG2-CE1 4.06Å; T204-F303 HydrophobicContact CG2-CZ 3.87Å; T204-T307 HydrophobicContact CG2-CG2 4Å; T204-L308 HydrophobicContact CG2-CD2 4.31Å |
| 205 | G | 93.9 | Very high | 90.8 | Very high | 1 Ų | 1 | 56.2 Ų | 56.2 | 1% | 0.01 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -61.1 | -45.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113 | I201 I202 I203 V207 K208 L209 | I201-G205 PolarHBondContact O-N 2.98Å; I202-G205 PolarHBondContact O-N 3.18Å; I203-G205 VanDerWaalsContact C-N 3.32Å; I203-G205 PolarHBondContact O-N 3.45Å; G205-V207 PolarHBondContact O-N 2.99Å; G205-K208 PolarHBondContact O-N 3.11Å; G205-L209 WeakPolarHBondContact O-CG 3.37Å; G205-L209 PolarHBondContact O-N 3.04Å |
| 206 | I | 94.4 | Very high | 91 | Very high | 83 Ų | 83 | 56.1 Ų | 56.1 | 43% | 0.426 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 176.5 | -67.7 | 167.8 | 0 | 0 | 0 | 110.8 | I202 I203 K208 L209 C210 | I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.48Å; I202-I206 WeakPolarHBondContact O-CG1 3.25Å; I202-I206 PolarHBondContact O-N 3.46Å; I203-I206 PolarHBondContact O-N 3.27Å; I206-K208 VanDerWaalsContact C-N 3.31Å; I206-K208 PolarHBondContact O-N 3.42Å; I206-L209 WeakPolarHBondContact O-CB 3.46Å; I206-L209 PolarHBondContact O-N 3.34Å; I206-C210 PolarHBondContact O-N 3.02Å; I206-C210 PolarHBondContact O-SG 3.4Å; I206-C210 VanDerWaalsContact O-SG 3.36Å |
| 207 | V | 94.4 | Very high | 91.1 | Very high | 70 Ų | 70 | 56.1 Ų | 56.1 | 42% | 0.424 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.1 | -42.4 | 176.5 | 170.6 | 0 | 0 | 0 | 0 | 111 | I203 T204 G205 C210 Q211 | I203-V207 HydrophobicContact CG2-CG2 4.46Å; I203-V207 WeakPolarHBondContact O-CG2 3.32Å; I203-V207 PolarHBondContact O-N 2.77Å; T204-V207 PolarHBondContact O-N 3.35Å; G205-V207 PolarHBondContact O-N 2.99Å; V207-C210 PolarHBondContact O-N 3.48Å; V207-Q211 WeakPolarHBondContact O-CG 3.41Å; V207-Q211 PolarHBondContact O-N 2.75Å |
| 208 | K | 92.8 | Very high | 91.1 | Very high | 43 Ų | 43 | 63 Ų | 63 | 19% | 0.187 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.8 | -40.5 | 176.7 | -72.7 | -74.4 | -179.7 | -177.8 | 0 | 112.4 | T204 G205 I206 C210 Q211 G212 Y213 V287 | T204-K208 WeakPolarHBondContact O-CG 3.31Å; T204-K208 PolarHBondContact O-N 3.1Å; G205-K208 PolarHBondContact O-N 3.11Å; I206-K208 VanDerWaalsContact C-N 3.31Å; I206-K208 PolarHBondContact O-N 3.42Å; K208-C210 VanDerWaalsContact C-N 3.35Å; K208-C210 PolarHBondContact O-N 2.9Å; K208-Q211 WeakPolarHBondContact O-CB 3.41Å; K208-Q211 PolarHBondContact O-N 2.84Å; K208-Q211 VanDerWaalsContact O-N 3.13Å; K208-G212 PolarHBondContact O-N 3.41Å; K208-Y213 HydrophobicContact CB-CD2 4.46Å; K208-Y213 HydrophobicContact CD-CD2 4.07Å; K208-Y213 HydrophobicContact CD-CE2 4.07Å; K208-Y213 WeakPolarHBondContact O-CB 3.42Å; K208-Y213 WeakPolarHBondContact O-CD2 3.4Å; K208-Y213 PolarHBondContact O-N 3.36Å; K208-V287 HydrophobicContact CB-CG2 4.06Å; K208-V287 HydrophobicContact CG-CG2 3.85Å |
| 209 | L | 92.9 | Very high | 90.8 | Very high | 46 Ų | 46 | 66.3 Ų | 66.3 | 24% | 0.241 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59.7 | -45 | 171.9 | -73.1 | 171.3 | 0 | 0 | 0 | 111.7 | G205 I206 Q211 G212 T214 F217 V282 A286 | G205-L209 WeakPolarHBondContact O-CG 3.37Å; G205-L209 PolarHBondContact O-N 3.04Å; I206-L209 WeakPolarHBondContact O-CB 3.46Å; I206-L209 PolarHBondContact O-N 3.34Å; L209-Q211 PolarHBondContact O-N 3.49Å; L209-G212 PolarHBondContact O-N 3.46Å; L209-T214 HydrophobicContact CD2-CG2 4.17Å; L209-F217 HydrophobicContact CD2-CD2 4.09Å; L209-F217 HydrophobicContact CD2-CE2 3.66Å; L209-V282 HydrophobicContact CD1-CG1 3.79Å; L209-A286 HydrophobicContact CD1-CB 4.48Å; L209-A286 HydrophobicContact CD2-CB 3.71Å; L209-A286 HydrophobicContact CG-CB 3.79Å |
| 210 | C | 92.7 | Very high | 90.7 | Very high | 109 Ų | 109 | 63.3 Ų | 63.3 | 74% | 0.736 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -64.1 | -25.4 | 176 | -69.6 | 0 | 0 | 0 | 0 | 113.4 | I206 V207 K208 G212 | I206-C210 PolarHBondContact O-N 3.02Å; I206-C210 PolarHBondContact O-SG 3.4Å; I206-C210 VanDerWaalsContact O-SG 3.36Å; V207-C210 PolarHBondContact O-N 3.48Å; K208-C210 VanDerWaalsContact C-N 3.35Å; K208-C210 PolarHBondContact O-N 2.9Å; C210-G212 PolarHBondContact O-N 2.98Å |
| 211 | Q | 92.3 | Very high | 90.7 | Very high | 117 Ų | 117 | 66.8 Ų | 66.8 | 55% | 0.547 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -3.2 | 173 | -71.5 | 172.4 | 1.2 | 0 | 0 | 113.4 | V207 K208 L209 Y213 | V207-Q211 WeakPolarHBondContact O-CG 3.41Å; V207-Q211 PolarHBondContact O-N 2.75Å; K208-Q211 WeakPolarHBondContact O-CB 3.41Å; K208-Q211 PolarHBondContact O-N 2.84Å; K208-Q211 VanDerWaalsContact O-N 3.13Å; L209-Q211 PolarHBondContact O-N 3.49Å; Q211-Y213 HydrophobicContact CB-CD2 3.94Å; Q211-Y213 HydrophobicContact CB-CE2 4.06Å |
| 212 | G | 89.2 | Confident | 90.6 | Very high | 43 Ų | 43 | 74 Ų | 74 | 44% | 0.443 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 99.5 | 4.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | K208 L209 C210 T214 | K208-G212 PolarHBondContact O-N 3.41Å; L209-G212 PolarHBondContact O-N 3.46Å; C210-G212 PolarHBondContact O-N 2.98Å; G212-T214 PolarHBondContact O-N 2.75Å; G212-T214 PolarHBondContact O-OG1 2.83Å |
| 213 | Y | 88.3 | Confident | 90.2 | Very high | 123 Ų | 123 | 75.9 Ų | 75.9 | 48% | 0.482 | 41% | 0.414 | S | S | . | . | trans | -71.7 | 76 | 176.7 | -70.1 | -100.6 | 0 | 0 | 0 | 111.1 | K208 Q211 | K208-Y213 HydrophobicContact CB-CD2 4.46Å; K208-Y213 HydrophobicContact CD-CD2 4.07Å; K208-Y213 HydrophobicContact CD-CE2 4.07Å; K208-Y213 WeakPolarHBondContact O-CB 3.42Å; K208-Y213 WeakPolarHBondContact O-CD2 3.4Å; K208-Y213 PolarHBondContact O-N 3.36Å; Q211-Y213 HydrophobicContact CB-CD2 3.94Å; Q211-Y213 HydrophobicContact CB-CE2 4.06Å | ||
| 214 | T | 88.5 | Confident | 90.2 | Very high | 56 Ų | 56 | 72.8 Ų | 72.8 | 34% | 0.344 | 40% | 0.401 | S | S | . | . | trans | -122.8 | 2.4 | -173.8 | 55.4 | 0 | 0 | 0 | 0 | 113.2 | L209 G212 N216 F217 K218 | L209-T214 HydrophobicContact CD2-CG2 4.17Å; G212-T214 PolarHBondContact O-N 2.75Å; G212-T214 PolarHBondContact O-OG1 2.83Å; T214-N216 VanDerWaalsContact C-N 3.3Å; T214-N216 PolarHBondContact O-N 2.91Å; T214-F217 PolarHBondContact O-N 2.82Å; T214-K218 PolarHBondContact O-N 3.19Å | ||
| 215 | D | 85.7 | Confident | 90.1 | Very high | 106 Ų | 106 | 72.5 Ų | 72.5 | 57% | 0.567 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -59.5 | -41.2 | -174.3 | -68.5 | -41 | 0 | 0 | 0 | 112.3 | F217 K218 | D215-F217 PolarHBondContact O-N 3.29Å; D215-F217 VanDerWaalsContact O-N 3.13Å; D215-K218 PolarHBondContact O-N 3.47Å; D215-K218 WeakPolarHBondContact OD1-CE 3.41Å; D215-K218 IonicContact OD1-NZ 2.98Å; D215-K218 PolarHBondContact OD1-NZ 3.41Å |
| 216 | N | 85.8 | Confident | 90 | Very high | 37 Ų | 37 | 78.7 Ų | 78.7 | 20% | 0.198 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -60 | -23.8 | 175.6 | -74.5 | -19.9 | 0 | 0 | 0 | 113.2 | Y72 T214 Y285 L288 D289 | Y72-N216 HydrophobicContact CD2-CB 4.22Å; Y72-N216 VanDerWaalsContact CD2-O 3.24Å; Y72-N216 WeakPolarHBondContact CD2-O 3.14Å; Y72-N216 HydrophobicContact CE2-CB 3.68Å; T214-N216 VanDerWaalsContact C-N 3.3Å; T214-N216 PolarHBondContact O-N 2.91Å; N216-Y285 VanDerWaalsContact CB-O 3.28Å; N216-Y285 WeakPolarHBondContact CB-O 3.16Å; N216-Y285 PolarHBondContact ND2-O 3.18Å; N216-L288 PolarHBondContact ND2-O 2.97Å; N216-D289 PolarHBondContact ND2-OD1 2.93Å; N216-D289 PolarHBondContact OD1-OD1 3.41Å |
| 217 | F | 87.8 | Confident | 89.9 | Confident | 51 Ų | 51 | 78.3 Ų | 78.3 | 22% | 0.224 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -90.7 | -14 | -179.2 | -63.3 | -77.7 | 0 | 0 | 0 | 114.6 | L76 L209 T214 D215 S219 S220 V282 A286 | L76-F217 HydrophobicContact CD1-CE1 4.48Å; L209-F217 HydrophobicContact CD2-CD2 4.09Å; L209-F217 HydrophobicContact CD2-CE2 3.66Å; T214-F217 PolarHBondContact O-N 2.82Å; D215-F217 PolarHBondContact O-N 3.29Å; D215-F217 VanDerWaalsContact O-N 3.13Å; F217-S219 VanDerWaalsContact C-N 3.33Å; F217-S219 PolarHBondContact O-N 2.97Å; F217-S220 VanDerWaalsContact C-OG 3.27Å; F217-S220 WeakPolarHBondContact CA-OG 3.44Å; F217-S220 PolarHBondContact O-N 2.96Å; F217-S220 PolarHBondContact O-OG 3.33Å; F217-V282 HydrophobicContact CZ-CG1 4.16Å; F217-A286 HydrophobicContact CE2-CB 3.94Å; F217-A286 HydrophobicContact CZ-CB 4.42Å |
| 218 | K | 85.5 | Confident | 89.8 | Confident | 149 Ų | 149 | 77.7 Ų | 77.7 | 65% | 0.648 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -63.7 | -35.4 | -174.3 | -71.2 | 176 | 179.5 | 165.5 | 0 | 113.4 | T214 D215 | T214-K218 PolarHBondContact O-N 3.19Å; D215-K218 PolarHBondContact O-N 3.47Å; D215-K218 WeakPolarHBondContact OD1-CE 3.41Å; D215-K218 IonicContact OD1-NZ 2.98Å; D215-K218 PolarHBondContact OD1-NZ 3.41Å |
| 219 | S | 84.8 | Confident | 89.8 | Confident | 73 Ų | 73 | 75.7 Ų | 75.7 | 51% | 0.51 | 43% | 0.426 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -121.6 | 42.8 | 177.1 | -63.5 | 0 | 0 | 0 | 0 | 111.8 | F217 F221 Q222 | F217-S219 VanDerWaalsContact C-N 3.33Å; F217-S219 PolarHBondContact O-N 2.97Å; S219-F221 PolarHBondContact O-N 3.1Å; S219-Q222 WeakPolarHBondContact O-CB 3.33Å; S219-Q222 PolarHBondContact O-N 3.28Å |
| 220 | S | 88.2 | Confident | 89.8 | Confident | 22 Ų | 22 | 76.1 Ų | 76.1 | 15% | 0.154 | 43% | 0.428 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -29.7 | -169.6 | -66.8 | 0 | 0 | 0 | 0 | 115.4 | S71 Y72 G73 F217 | S71-S220 VanDerWaalsContact CB-O 3.29Å; S71-S220 WeakPolarHBondContact CB-O 3.33Å; S71-S220 PolarHBondContact OG-O 3.09Å; Y72-S220 PolarHBondContact N-O 3.25Å; G73-S220 WeakPolarHBondContact CA-O 3.36Å; G73-S220 PolarHBondContact N-O 3.38Å; F217-S220 VanDerWaalsContact C-OG 3.27Å; F217-S220 WeakPolarHBondContact CA-OG 3.44Å; F217-S220 PolarHBondContact O-N 2.96Å; F217-S220 PolarHBondContact O-OG 3.33Å |
| 221 | F | 92 | Very high | 89.9 | Confident | 129 Ų | 129 | 73.3 Ų | 73.3 | 57% | 0.566 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.5 | 0.2 | -177 | -67.3 | -82.8 | 0 | 0 | 0 | 113.9 | V77 S219 G223 S224 | V77-F221 HydrophobicContact CG2-CE1 4.27Å; V77-F221 HydrophobicContact CG2-CZ 4.5Å; S219-F221 PolarHBondContact O-N 3.1Å; F221-G223 PolarHBondContact O-N 3.37Å; F221-S224 WeakPolarHBondContact O-CB 3.36Å; F221-S224 PolarHBondContact O-N 3.38Å; F221-S224 PolarHBondContact O-OG 3.36Å |
| 222 | Q | 89.8 | Confident | 89.9 | Confident | 151 Ų | 151 | 67.8 Ų | 67.8 | 71% | 0.706 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | 131.7 | -179.9 | -171.9 | 172.5 | 10.1 | 0 | 0 | 110.1 | S219 S224 | S219-Q222 WeakPolarHBondContact O-CB 3.33Å; S219-Q222 PolarHBondContact O-N 3.28Å; Q222-S224 VanDerWaalsContact C-N 3.3Å; Q222-S224 PolarHBondContact O-N 3.28Å |
| 223 | G | 87.8 | Confident | 90.1 | Very high | 59 Ų | 59 | 66.3 Ų | 66.3 | 61% | 0.608 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.4 | 8.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | A70 F221 S225 | A70-G223 VanDerWaalsContact CB-O 3.24Å; A70-G223 WeakPolarHBondContact CB-O 3.11Å; F221-G223 PolarHBondContact O-N 3.37Å; G223-S225 PolarHBondContact O-N 3.01Å |
| 224 | S | 93.3 | Very high | 90.5 | Very high | 34 Ų | 34 | 60.5 Ų | 60.5 | 24% | 0.238 | 34% | 0.339 | C | S | . | . | trans | -53.9 | 131.9 | 178.7 | -59.2 | 0 | 0 | 0 | 0 | 111.8 | S69 S71 F221 Q222 | S69-S224 WeakPolarHBondContact O-CA 3.09Å; S71-S224 WeakPolarHBondContact CB-OG 3.27Å; S71-S224 PolarHBondContact OG-OG 3.33Å; F221-S224 WeakPolarHBondContact O-CB 3.36Å; F221-S224 PolarHBondContact O-N 3.38Å; F221-S224 PolarHBondContact O-OG 3.36Å; Q222-S224 VanDerWaalsContact C-N 3.3Å; Q222-S224 PolarHBondContact O-N 3.28Å | ||
| 225 | S | 92.3 | Very high | 90.8 | Very high | 21 Ų | 21 | 58.7 Ų | 58.7 | 15% | 0.147 | 33% | 0.327 | C | S | . | . | trans | -64.3 | 141.2 | 172.9 | -172.1 | 0 | 0 | 0 | 0 | 110.7 | Y68 S69 L74 G223 D227 D230 | Y68-S225 VanDerWaalsContact O-CB 3.25Å; Y68-S225 WeakPolarHBondContact O-CB 3.18Å; S69-S225 PolarHBondContact O-N 3.02Å; L74-S225 WeakPolarHBondContact CD2-O 3.3Å; G223-S225 PolarHBondContact O-N 3.01Å; S225-D227 PolarHBondContact OG-N 2.94Å; S225-D230 WeakPolarHBondContact OG-CB 3.48Å; S225-D230 PolarHBondContact OG-OD2 3.22Å | ||
| 226 | T | 91.9 | Very high | 91.3 | Very high | 131 Ų | 131 | 53.7 Ų | 53.7 | 80% | 0.804 | 30% | 0.3 | S | S | * | . | trans | -111.9 | -3.3 | 174.3 | 54.7 | 0 | 0 | 0 | 0 | 111.9 | P228 | T226-P228 WeakPolarHBondContact O-CD 3.48Š| ||
| 227 | D | 93 | Very high | 91.7 | Very high | 74 Ų | 74 | 52 Ų | 52 | 40% | 0.396 | 29% | 0.291 | S | S | . | . | trans | -73.3 | 126.1 | 179 | -176.3 | 63 | 0 | 0 | 0 | 110 | S225 G229 D230 I231 | S225-D227 PolarHBondContact OG-N 2.94Å; D227-G229 PolarHBondContact O-N 3.19Å; D227-G229 WeakPolarHBondContact OD2-CA 3.33Å; D227-G229 PolarHBondContact OD2-N 3.46Å; D227-D230 HydrophobicContact CB-CB 4.27Å; D227-D230 PolarHBondContact O-N 3.36Å; D227-D230 PolarHBondContact OD2-N 3.42Å; D227-D230 VanDerWaalsContact OD2-N 3.14Å; D227-I231 WeakPolarHBondContact O-CG1 3.25Å; D227-I231 PolarHBondContact O-N 3.28Å | ||
| 228 | P | 91.6 | Very high | 92.1 | Very high | 58 Ų | 58 | 49.5 Ų | 49.5 | 38% | 0.377 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.2 | -29.6 | 177.9 | -24.5 | 34.7 | 0 | 0 | 0 | 113.3 | T226 I231 A232 V437 | T226-P228 WeakPolarHBondContact O-CD 3.48Å; P228-I231 PolarHBondContact O-N 3.16Å; P228-A232 PolarHBondContact O-N 3.25Å; P228-V437 WeakPolarHBondContact O-CG1 3.36Å |
| 229 | G | 91.7 | Very high | 92.5 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.01 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -64.2 | -51.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | D227 I231 A232 L233 S441 | D227-G229 PolarHBondContact O-N 3.19Å; D227-G229 WeakPolarHBondContact OD2-CA 3.33Å; D227-G229 PolarHBondContact OD2-N 3.46Å; G229-I231 VanDerWaalsContact C-N 3.29Å; G229-I231 PolarHBondContact O-N 2.96Å; G229-A232 PolarHBondContact O-N 2.88Å; G229-A232 VanDerWaalsContact O-N 3.11Å; G229-L233 WeakPolarHBondContact O-CG 3.42Å; G229-L233 PolarHBondContact O-N 3.36Å; G229-S441 WeakPolarHBondContact CA-OG 3.43Å |
| 230 | D | 93.4 | Very high | 92.9 | Very high | 54 Ų | 54 | 39.3 Ų | 39.3 | 29% | 0.289 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -55.9 | -44.9 | 173.6 | -73.5 | -19.4 | 0 | 0 | 0 | 111.5 | Y68 S225 D227 A232 L233 A234 | Y68-D230 VanDerWaalsContact CB-O 3.31Å; Y68-D230 WeakPolarHBondContact CB-O 3.44Å; Y68-D230 WeakPolarHBondContact O-CB 3.38Å; S225-D230 WeakPolarHBondContact OG-CB 3.48Å; S225-D230 PolarHBondContact OG-OD2 3.22Å; D227-D230 HydrophobicContact CB-CB 4.27Å; D227-D230 PolarHBondContact O-N 3.36Å; D227-D230 PolarHBondContact OD2-N 3.42Å; D227-D230 VanDerWaalsContact OD2-N 3.14Å; D230-A232 VanDerWaalsContact C-N 3.3Å; D230-A232 PolarHBondContact O-N 3.22Å; D230-L233 PolarHBondContact O-N 3.3Å; D230-A234 WeakPolarHBondContact O-CB 3.37Å; D230-A234 PolarHBondContact O-N 2.94Å |
| 231 | I | 94.5 | Very high | 93.2 | Very high | 51 Ų | 51 | 38.3 Ų | 38.3 | 26% | 0.262 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -61.5 | -39.7 | 178.5 | -64.7 | 167.8 | 0 | 0 | 0 | 111.2 | D227 P228 G229 L235 | D227-I231 WeakPolarHBondContact O-CG1 3.25Å; D227-I231 PolarHBondContact O-N 3.28Å; P228-I231 PolarHBondContact O-N 3.16Å; G229-I231 VanDerWaalsContact C-N 3.29Å; G229-I231 PolarHBondContact O-N 2.96Å; I231-L235 HydrophobicContact CG2-CD1 4.22Å; I231-L235 WeakPolarHBondContact O-CB 3.27Å; I231-L235 WeakPolarHBondContact O-CG 3.37Å; I231-L235 PolarHBondContact O-N 3.42Å |
| 232 | A | 93.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -67.3 | -41.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | P228 G229 D230 L235 Y236 F433 V437 P438 | P228-A232 PolarHBondContact O-N 3.25Å; G229-A232 PolarHBondContact O-N 2.88Å; G229-A232 VanDerWaalsContact O-N 3.11Å; D230-A232 VanDerWaalsContact C-N 3.3Å; D230-A232 PolarHBondContact O-N 3.22Å; A232-L235 WeakPolarHBondContact O-CB 3.44Å; A232-L235 PolarHBondContact O-N 2.65Å; A232-Y236 WeakPolarHBondContact O-CD1 3.24Å; A232-Y236 PolarHBondContact O-N 3.44Å; A232-F433 HydrophobicContact CB-CE1 4.09Å; A232-F433 HydrophobicContact CB-CZ 4.31Å; A232-V437 HydrophobicContact CB-CB 4.01Å; A232-V437 HydrophobicContact CB-CG1 3.49Å; A232-V437 VanDerWaalsContact CB-CG1 3.49Å; A232-P438 HydrophobicContact CB-CG 4.19Å |
| 233 | L | 93.3 | Very high | 93.1 | Very high | 13 Ų | 13 | 26 Ų | 26 | 7% | 0.068 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -70.3 | -34.4 | 177.1 | -64.8 | 178.3 | 0 | 0 | 0 | 112.4 | Y68 G229 D230 Y236 S237 D442 | Y68-L233 HydrophobicContact CD1-CB 3.91Å; Y68-L233 HydrophobicContact CD1-CD1 4.07Å; Y68-L233 HydrophobicContact CD2-CB 3.77Å; Y68-L233 HydrophobicContact CE1-CB 3.91Å; Y68-L233 HydrophobicContact CE1-CD1 3.54Å; Y68-L233 HydrophobicContact CE1-CG 4.38Å; Y68-L233 HydrophobicContact CE2-CB 3.79Å; Y68-L233 HydrophobicContact CG-CB 3.86Å; G229-L233 WeakPolarHBondContact O-CG 3.42Å; G229-L233 PolarHBondContact O-N 3.36Å; D230-L233 PolarHBondContact O-N 3.3Å; L233-Y236 HydrophobicContact CD2-CD2 4.19Å; L233-Y236 WeakPolarHBondContact O-CB 3.34Å; L233-Y236 PolarHBondContact O-N 3.27Å; L233-S237 PolarHBondContact O-N 3.31Å; L233-S237 VanDerWaalsContact O-N 3.12Å; L233-S237 PolarHBondContact O-OG 2.82Å; L233-D442 HydrophobicContact CD2-CB 4.31Å |
| 234 | A | 95.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.4 | -44.4 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111 | V65 I78 D230 Y236 S237 A238 | V65-A234 HydrophobicContact CG1-CB 4.48Å; I78-A234 HydrophobicContact CD1-CB 3.65Å; I78-A234 HydrophobicContact CG2-CB 4.14Å; D230-A234 WeakPolarHBondContact O-CB 3.37Å; D230-A234 PolarHBondContact O-N 2.94Å; A234-Y236 VanDerWaalsContact C-N 3.33Å; A234-Y236 PolarHBondContact O-N 2.87Å; A234-S237 WeakPolarHBondContact O-CB 3.47Å; A234-S237 PolarHBondContact O-N 2.89Å; A234-A238 PolarHBondContact O-N 2.96Å |
| 235 | L | 95.8 | Very high | 92.5 | Very high | 19 Ų | 19 | 22.2 Ų | 22.2 | 10% | 0.099 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.8 | -39.5 | 174.5 | -81.7 | 167.5 | 0 | 0 | 0 | 111.6 | I78 I81 I231 A232 S237 A238 L239 F433 L434 | I78-L235 HydrophobicContact CG2-CD2 3.95Å; I78-L235 HydrophobicContact CG2-CG 4.12Å; I81-L235 HydrophobicContact CG2-CD2 4.06Å; I231-L235 HydrophobicContact CG2-CD1 4.22Å; I231-L235 WeakPolarHBondContact O-CB 3.27Å; I231-L235 WeakPolarHBondContact O-CG 3.37Å; I231-L235 PolarHBondContact O-N 3.42Å; A232-L235 WeakPolarHBondContact O-CB 3.44Å; A232-L235 PolarHBondContact O-N 2.65Å; L235-S237 VanDerWaalsContact C-N 3.31Å; L235-S237 PolarHBondContact O-N 2.7Å; L235-A238 PolarHBondContact O-N 3.46Å; L235-L239 HydrophobicContact CB-CD1 4.4Å; L235-L239 WeakPolarHBondContact O-CB 3.32Å; L235-L239 WeakPolarHBondContact O-CG 3.46Å; L235-L239 PolarHBondContact O-N 3.46Å; L235-F433 HydrophobicContact CD1-CE1 4.09Å; L235-L434 HydrophobicContact CB-CD2 3.98Å; L235-L434 HydrophobicContact CD1-CD2 4.31Å |
| 236 | Y | 94.5 | Very high | 92.2 | Very high | 1 Ų | 1 | 21.7 Ų | 21.7 | 0% | 0.004 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -55.7 | -47.6 | 173.1 | -81.6 | 12 | 0 | 0 | 0 | 111.7 | A232 L233 A234 A238 L239 F240 N386 S389 F390 L434 P438 | A232-Y236 WeakPolarHBondContact O-CD1 3.24Å; A232-Y236 PolarHBondContact O-N 3.44Å; L233-Y236 HydrophobicContact CD2-CD2 4.19Å; L233-Y236 WeakPolarHBondContact O-CB 3.34Å; L233-Y236 PolarHBondContact O-N 3.27Å; A234-Y236 VanDerWaalsContact C-N 3.33Å; A234-Y236 PolarHBondContact O-N 2.87Å; Y236-A238 PolarHBondContact O-N 2.87Å; Y236-L239 PolarHBondContact O-N 3.31Å; Y236-F240 WeakPolarHBondContact O-CB 3.34Å; Y236-F240 PolarHBondContact O-N 3.18Å; Y236-N386 HydrophobicContact CD2-CB 4.37Å; Y236-S389 VanDerWaalsContact CD2-CB 3.45Å; Y236-S389 VanDerWaalsContact CG-CB 3.45Å; Y236-F390 HydrophobicContact CE2-CB 4.29Å; Y236-F390 VanDerWaalsContact OH-CA 3.3Å; Y236-F390 WeakPolarHBondContact OH-CA 3.27Å; Y236-L434 HydrophobicContact CD1-CD2 4.01Å; Y236-L434 HydrophobicContact CE1-CB 4.05Å; Y236-L434 HydrophobicContact CE1-CD2 3.94Å; Y236-L434 VanDerWaalsContact CE1-O 3.25Å; Y236-L434 WeakPolarHBondContact CE1-O 3.44Å; Y236-L434 VanDerWaalsContact CZ-O 3.22Å; Y236-L434 PolarHBondContact OH-O 2.79Å; Y236-P438 HydrophobicContact CE1-CG 4.15Å; Y236-P438 HydrophobicContact CE2-CB 4.24Å; Y236-P438 HydrophobicContact CE2-CG 3.95Å; Y236-P438 WeakPolarHBondContact OH-CG 3.18Å |
| 237 | S | 94.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -60.3 | -47.4 | 177.3 | -64.4 | 0 | 0 | 0 | 0 | 111.7 | S61 L233 A234 L235 | S61-S237 WeakPolarHBondContact CB-O 3.44Å; S61-S237 PolarHBondContact OG-O 2.89Å; L233-S237 PolarHBondContact O-N 3.31Å; L233-S237 VanDerWaalsContact O-N 3.12Å; L233-S237 PolarHBondContact O-OG 2.82Å; A234-S237 WeakPolarHBondContact O-CB 3.47Å; A234-S237 PolarHBondContact O-N 2.89Å; L235-S237 VanDerWaalsContact C-N 3.31Å; L235-S237 PolarHBondContact O-N 2.7Å |
| 238 | A | 95.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 13.7 Ų | 13.7 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -64.7 | -44.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | V65 I78 W79 A234 L235 Y236 F240 S241 Y242 | V65-A238 HydrophobicContact CG2-CB 3.93Å; I78-A238 HydrophobicContact CG2-CB 4.08Å; W79-A238 HydrophobicContact CD2-CB 4.33Å; W79-A238 HydrophobicContact CE3-CB 4.34Å; A234-A238 PolarHBondContact O-N 2.96Å; L235-A238 PolarHBondContact O-N 3.46Å; Y236-A238 PolarHBondContact O-N 2.87Å; A238-F240 VanDerWaalsContact C-N 3.32Å; A238-F240 PolarHBondContact O-N 2.87Å; A238-S241 VanDerWaalsContact O-CB 3.28Å; A238-S241 WeakPolarHBondContact O-CB 3.2Å; A238-S241 PolarHBondContact O-N 3.23Å; A238-Y242 VanDerWaalsContact O-CD2 3.25Å; A238-Y242 WeakPolarHBondContact O-CD2 3.43Å; A238-Y242 PolarHBondContact O-N 3.44Å |
| 239 | L | 94.6 | Very high | 90.5 | Very high | 1 Ų | 1 | 11 Ų | 11 | 1% | 0.005 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -70.2 | -27.3 | -176.8 | -73.6 | 178.3 | 0 | 0 | 0 | 113.4 | G82 F85 L235 Y236 S241 Y242 S243 W393 L434 | G82-L239 WeakPolarHBondContact O-CD2 3.24Å; F85-L239 HydrophobicContact CD1-CD1 3.85Å; F85-L239 HydrophobicContact CD1-CD2 3.62Å; F85-L239 HydrophobicContact CD1-CG 4.41Å; F85-L239 HydrophobicContact CE1-CD1 3.88Å; F85-L239 HydrophobicContact CE1-CD2 4.26Å; L235-L239 HydrophobicContact CB-CD1 4.4Å; L235-L239 WeakPolarHBondContact O-CB 3.32Å; L235-L239 WeakPolarHBondContact O-CG 3.46Å; L235-L239 PolarHBondContact O-N 3.46Å; Y236-L239 PolarHBondContact O-N 3.31Å; L239-S241 VanDerWaalsContact C-N 3.27Å; L239-S241 PolarHBondContact O-N 3.42Å; L239-Y242 CarbonylContact O-C 3.54Å; L239-Y242 PolarHBondContact O-N 2.84Å; L239-S243 PolarHBondContact O-N 3.44Å; L239-W393 HydrophobicContact CB-CZ2 3.62Å; L239-W393 HydrophobicContact CD1-CZ2 3.97Å; L239-W393 HydrophobicContact CD2-CH2 4.38Å; L239-W393 HydrophobicContact CD2-CZ2 4.07Å; L239-W393 HydrophobicContact CG-CZ2 4.09Å; L239-L434 HydrophobicContact CD1-CD1 3.51Å; L239-L434 HydrophobicContact CD1-CD2 4.14Å; L239-L434 HydrophobicContact CD1-CG 4.5Å |
| 240 | F | 94.1 | Very high | 89.7 | Confident | 7 Ų | 7 | 14 Ų | 14 | 3% | 0.031 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -57.6 | -42.5 | 167 | -178.9 | -102.2 | 0 | 0 | 0 | 111.3 | V137 Y236 A238 Y242 S243 I385 Y388 | V137-F240 HydrophobicContact CB-CZ 3.93Å; V137-F240 HydrophobicContact CG1-CE1 3.6Å; V137-F240 HydrophobicContact CG1-CE2 4.43Å; V137-F240 HydrophobicContact CG1-CZ 3.47Å; V137-F240 VanDerWaalsContact CG1-CZ 3.47Å; Y236-F240 WeakPolarHBondContact O-CB 3.34Å; Y236-F240 PolarHBondContact O-N 3.18Å; A238-F240 VanDerWaalsContact C-N 3.32Å; A238-F240 PolarHBondContact O-N 2.87Å; F240-Y242 VanDerWaalsContact C-N 3.32Å; F240-Y242 PolarHBondContact O-N 3.45Å; F240-S243 WeakPolarHBondContact O-CB 3.47Å; F240-S243 PolarHBondContact O-N 3.25Å; F240-S243 PolarHBondContact O-OG 3.31Å; F240-I385 HydrophobicContact CB-CG2 3.9Å; F240-I385 HydrophobicContact CD1-CD1 4.22Å; F240-I385 HydrophobicContact CD1-CG1 4.23Å; F240-I385 HydrophobicContact CD2-CG1 4.35Å; F240-I385 HydrophobicContact CD2-CG2 4.43Å; F240-I385 HydrophobicContact CE1-CG1 4.45Å; F240-I385 HydrophobicContact CG-CG1 4.19Å; F240-I385 HydrophobicContact CG-CG2 4.15Å; F240-Y388 AromaticContact CD2-CD1 3.58Å; F240-Y388 HydrophobicContact CD2-CD1 3.58Å; F240-Y388 AromaticContact CD2-CE1 3.7Å; F240-Y388 HydrophobicContact CD2-CE1 3.7Å; F240-Y388 HydrophobicContact CD2-CG 4.3Å; F240-Y388 HydrophobicContact CE2-CD1 4.05Å; F240-Y388 HydrophobicContact CE2-CE1 4.22Å; F240-Y388 HydrophobicContact CE2-CG 4.35Å |
| 241 | S | 93.6 | Very high | 88.8 | Confident | 1 Ų | 1 | 12.2 Ų | 12.2 | 1% | 0.007 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -68.7 | -29.2 | 175.3 | -70 | 0 | 0 | 0 | 0 | 113.8 | G57 I58 S61 W79 A238 L239 S243 Y277 | G57-S241 WeakPolarHBondContact CA-OG 3.4Å; G57-S241 PolarHBondContact O-OG 2.63Å; I58-S241 PolarHBondContact N-OG 2.69Å; I58-S241 VanDerWaalsContact N-OG 3.14Å; S61-S241 WeakPolarHBondContact CB-OG 3.48Å; S61-S241 PolarHBondContact OG-OG 2.95Å; W79-S241 WeakPolarHBondContact CH2-OG 3.21Å; A238-S241 VanDerWaalsContact O-CB 3.28Å; A238-S241 WeakPolarHBondContact O-CB 3.2Å; A238-S241 PolarHBondContact O-N 3.23Å; L239-S241 VanDerWaalsContact C-N 3.27Å; L239-S241 PolarHBondContact O-N 3.42Å; S241-S243 VanDerWaalsContact C-N 3.32Å; S241-Y277 VanDerWaalsContact O-CE2 3.25Å; S241-Y277 WeakPolarHBondContact O-CE2 3.28Å; S241-Y277 PolarHBondContact O-OH 3.21Å |
| 242 | Y | 92.2 | Very high | 87.9 | Confident | 0 Ų | 0 | 10.1 Ų | 10.1 | 0% | 0 | 6% | 0.057 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | -1.6 | 175.3 | -72.6 | -72.6 | 0 | 0 | 0 | 113.3 | M53 W79 S86 A238 L239 F240 V273 Y277 | M53-Y242 HydrophobicContact CE-CD1 3.73Å; M53-Y242 HydrophobicContact CE-CG 4.46Å; M53-Y242 VanDerWaalsContact CE-O 3.28Å; M53-Y242 WeakPolarHBondContact CE-O 3.26Å; W79-Y242 AromaticContact CE3-CE2 3.64Å; W79-Y242 HydrophobicContact CE3-CE2 3.64Å; W79-Y242 HydrophobicContact CZ3-CE2 4.05Å; W79-Y242 WeakPolarHBondContact O-CE2 3.14Å; W79-Y242 PolarHBondContact O-OH 3.14Å; S86-Y242 WeakPolarHBondContact OG-CB 3.44Å; A238-Y242 VanDerWaalsContact O-CD2 3.25Å; A238-Y242 WeakPolarHBondContact O-CD2 3.43Å; A238-Y242 PolarHBondContact O-N 3.44Å; L239-Y242 CarbonylContact O-C 3.54Å; L239-Y242 PolarHBondContact O-N 2.84Å; F240-Y242 VanDerWaalsContact C-N 3.32Å; F240-Y242 PolarHBondContact O-N 3.45Å; Y242-V273 HydrophobicContact CD1-CG1 4.24Å; Y242-V273 HydrophobicContact CE1-CG1 4.18Å; Y242-Y277 AromaticContact CD1-CD2 3.92Å; Y242-Y277 HydrophobicContact CD1-CD2 3.92Å; Y242-Y277 AromaticContact CD1-CE2 3.87Å; Y242-Y277 HydrophobicContact CD1-CE2 3.87Å; Y242-Y277 HydrophobicContact CD2-CD2 4.44Å; Y242-Y277 AromaticContact CE1-CD2 3.44Å; Y242-Y277 HydrophobicContact CE1-CD2 3.44Å; Y242-Y277 VanDerWaalsContact CE1-CD2 3.44Å; Y242-Y277 AromaticContact CE1-CE2 3.88Å; Y242-Y277 HydrophobicContact CE1-CE2 3.88Å; Y242-Y277 HydrophobicContact CE1-CG 4.43Å; Y242-Y277 HydrophobicContact CE2-CD2 4.02Å; Y242-Y277 HydrophobicContact CG-CD2 4.39Å; Y242-Y277 HydrophobicContact CG-CE2 4.24Å; Y242-Y277 AromaticContact CZ-CD2 3.49Å; Y242-Y277 VanDerWaalsContact CZ-CD2 3.49Å |
| 243 | S | 86.9 | Confident | 87.1 | Confident | 21 Ų | 21 | 13.4 Ų | 13.4 | 15% | 0.147 | 7% | 0.073 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.2 | 153.3 | 178.1 | 68.5 | 0 | 0 | 0 | 0 | 112.1 | M53 L239 F240 S241 Y388 | M53-S243 WeakPolarHBondContact CA-O 3.32Å; L239-S243 PolarHBondContact O-N 3.44Å; F240-S243 WeakPolarHBondContact O-CB 3.47Å; F240-S243 PolarHBondContact O-N 3.25Å; F240-S243 PolarHBondContact O-OG 3.31Å; S241-S243 VanDerWaalsContact C-N 3.32Å; S243-Y388 WeakPolarHBondContact CB-OH 3.24Å |
| 244 | G | 83.1 | Confident | 86.6 | Confident | 13 Ų | 13 | 15.5 Ų | 15.5 | 13% | 0.134 | 8% | 0.082 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 103.9 | -4.3 | 175 | 0 | 0 | 0 | 0 | 0 | 116 | D246 T247 | G244-D246 WeakPolarHBondContact CA-OD1 3.47Å; G244-D246 PolarHBondContact O-N 2.93Å; G244-T247 WeakPolarHBondContact O-CB 3.26Å; G244-T247 PolarHBondContact O-N 2.98Å; G244-T247 VanDerWaalsContact O-N 3.1Å; G244-T247 PolarHBondContact O-OG1 3.3Å |
| 245 | W | 87 | Confident | 86 | Confident | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.083 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | -24.2 | 171.4 | 52.6 | -106.3 | 0 | 0 | 0 | 113.1 | I49 M53 G89 A90 Y93 T247 M270 W393 M396 | I49-W245 HydrophobicContact CG2-CB 4.43Å; M53-W245 HydrophobicContact CE-CB 4.43Å; M53-W245 HydrophobicContact CG-CB 4.41Å; M53-W245 HydrophobicContact SD-CB 3.87Å; G89-W245 VanDerWaalsContact C-CH2 3.5Å; A90-W245 VanDerWaalsContact CA-CE3 3.44Å; A90-W245 HydrophobicContact CB-CB 4.28Å; A90-W245 HydrophobicContact CB-CD2 3.8Å; A90-W245 HydrophobicContact CB-CE3 3.59Å; A90-W245 HydrophobicContact CB-CG 4.11Å; A90-W245 HydrophobicContact CB-CZ3 4.2Å; Y93-W245 AromaticContact CD1-CZ3 3.94Å; Y93-W245 HydrophobicContact CD1-CZ3 3.94Å; Y93-W245 AromaticContact CD2-CH2 3.61Å; Y93-W245 HydrophobicContact CD2-CH2 3.61Å; Y93-W245 AromaticContact CD2-CZ3 3.64Å; Y93-W245 HydrophobicContact CD2-CZ3 3.64Å; Y93-W245 AromaticContact CE2-CH2 3.98Å; Y93-W245 HydrophobicContact CE2-CH2 3.98Å; Y93-W245 HydrophobicContact CE2-CZ3 4.31Å; Y93-W245 AromaticContact CG-CH2 3.94Å; Y93-W245 HydrophobicContact CG-CH2 3.94Å; Y93-W245 AromaticContact CG-CZ3 3.44Å; Y93-W245 HydrophobicContact CG-CZ3 3.44Å; Y93-W245 VanDerWaalsContact CG-CZ3 3.44Å; W245-T247 PolarHBondContact O-N 3.41Å; W245-M270 HydrophobicContact CB-SD 3.63Å; W245-M270 HydrophobicContact CG-CE 4.5Å; W245-M270 HydrophobicContact CG-SD 4.19Å; W245-W393 HydrophobicContact CZ2-CH2 4.46Å; W245-W393 HydrophobicContact CZ2-CZ3 4.4Å; W245-M396 HydrophobicContact CH2-CE 3.16Å; W245-M396 HydrophobicContact CZ2-CE 3.58Å; W245-M396 HydrophobicContact CZ3-CE 3.81Å |
| 246 | D | 86 | Confident | 85.5 | Confident | 11 Ų | 11 | 19.4 Ų | 19.4 | 6% | 0.059 | 10% | 0.098 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -3.2 | 175.7 | 58.5 | -28.4 | 0 | 0 | 0 | 113 | Y93 G244 L248 N249 F250 Y392 M396 | Y93-D246 HydrophobicContact CD1-CB 4.17Å; Y93-D246 HydrophobicContact CE1-CB 4.32Å; G244-D246 WeakPolarHBondContact CA-OD1 3.47Å; G244-D246 PolarHBondContact O-N 2.93Å; D246-L248 VanDerWaalsContact C-N 3.33Å; D246-L248 PolarHBondContact O-N 3.23Å; D246-N249 VanDerWaalsContact O-CB 3.25Å; D246-N249 WeakPolarHBondContact O-CB 3.44Å; D246-N249 PolarHBondContact O-N 3.42Å; D246-N249 VanDerWaalsContact O-N 3.1Å; D246-F250 WeakPolarHBondContact O-CD2 3.24Å; D246-Y392 PolarHBondContact OD1-OH 2.69Å; D246-Y392 PolarHBondContact OD2-OH 2.57Å; D246-M396 HydrophobicContact CB-CE 4.05Å |
| 247 | T | 79.1 | Confident | 85.1 | Confident | 36 Ų | 36 | 24.8 Ų | 24.8 | 22% | 0.221 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -63.2 | -37.3 | -177.5 | -46 | 0 | 0 | 0 | 0 | 112.8 | L48 N52 G244 W245 N249 F250 | L48-T247 HydrophobicContact CD2-CG2 3.86Å; N52-T247 WeakPolarHBondContact ND2-CB 3.37Å; N52-T247 VanDerWaalsContact ND2-CG2 3.26Å; N52-T247 WeakPolarHBondContact ND2-CG2 3.49Å; N52-T247 PolarHBondContact ND2-OG1 3.47Å; N52-T247 VanDerWaalsContact ND2-OG1 3.15Å; G244-T247 WeakPolarHBondContact O-CB 3.26Å; G244-T247 PolarHBondContact O-N 2.98Å; G244-T247 VanDerWaalsContact O-N 3.1Å; G244-T247 PolarHBondContact O-OG1 3.3Å; W245-T247 PolarHBondContact O-N 3.41Å; T247-N249 PolarHBondContact O-N 3.21Å; T247-F250 WeakPolarHBondContact O-CB 3.47Å; T247-F250 PolarHBondContact O-N 3.06Å |
| 248 | L | 78.1 | Confident | 84.6 | Confident | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.4 | -24.6 | 178.3 | -75.3 | -172 | 0 | 0 | 0 | 112.8 | L48 I49 D246 F250 V251 T252 I255 L262 | L48-L248 HydrophobicContact CB-CD2 4.21Å; L48-L248 HydrophobicContact CD1-CD2 4Å; L48-L248 HydrophobicContact CD2-CD2 3.83Å; L48-L248 HydrophobicContact CD2-CG 4.32Å; L48-L248 HydrophobicContact CG-CD2 4.24Å; I49-L248 HydrophobicContact CD1-CD1 3.36Å; I49-L248 HydrophobicContact CD1-CG 3.95Å; I49-L248 HydrophobicContact CG1-CD1 3.61Å; I49-L248 HydrophobicContact CG1-CG 3.69Å; D246-L248 VanDerWaalsContact C-N 3.33Å; D246-L248 PolarHBondContact O-N 3.23Å; L248-F250 PolarHBondContact O-N 2.97Å; L248-V251 HydrophobicContact CD2-CG2 4.14Å; L248-V251 CarbonylContact O-C 3.1Å; L248-V251 PolarHBondContact O-N 2.91Å; L248-T252 PolarHBondContact O-N 2.89Å; L248-T252 VanDerWaalsContact O-N 3.16Å; L248-T252 PolarHBondContact O-OG1 3.42Å; L248-I255 HydrophobicContact CB-CD1 4.23Å; L248-I255 HydrophobicContact CD2-CD1 4.25Å; L248-L262 HydrophobicContact CB-CD1 3.48Å; L248-L262 VanDerWaalsContact CB-CD1 3.48Å; L248-L262 HydrophobicContact CD1-CD1 4.04Å; L248-L262 HydrophobicContact CG-CD1 4.43Å |
| 249 | N | 83.1 | Confident | 84.1 | Confident | 1 Ų | 1 | 31.6 Ų | 31.6 | 1% | 0.005 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -67.2 | -24.6 | 175.2 | -70.8 | 81.7 | 0 | 0 | 0 | 112.6 | Y93 A105 Y109 D246 T247 T252 | Y93-N249 PolarHBondContact O-ND2 3.41Å; A105-N249 HydrophobicContact CB-CB 3.81Å; Y109-N249 HydrophobicContact CE2-CB 4.46Å; Y109-N249 WeakPolarHBondContact OH-CB 3.09Å; Y109-N249 PolarHBondContact OH-ND2 2.77Å; D246-N249 VanDerWaalsContact O-CB 3.25Å; D246-N249 WeakPolarHBondContact O-CB 3.44Å; D246-N249 PolarHBondContact O-N 3.42Å; D246-N249 VanDerWaalsContact O-N 3.1Å; T247-N249 PolarHBondContact O-N 3.21Å; N249-T252 VanDerWaalsContact CA-OG1 3.32Å; N249-T252 WeakPolarHBondContact CA-OG1 3.46Å; N249-T252 PolarHBondContact O-OG1 3.37Å |
| 250 | F | 74.7 | Confident | 83.8 | Confident | 65 Ų | 65 | 39.8 Ų | 39.8 | 29% | 0.285 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -76.8 | -26.9 | 175.2 | -69.5 | -89.4 | 0 | 0 | 0 | 113.1 | A105 D246 T247 L248 | A105-F250 HydrophobicContact CB-CD1 3.71Å; A105-F250 HydrophobicContact CB-CD2 3.61Å; A105-F250 HydrophobicContact CB-CE1 3.63Å; A105-F250 HydrophobicContact CB-CE2 3.54Å; A105-F250 HydrophobicContact CB-CG 3.72Å; A105-F250 HydrophobicContact CB-CZ 3.56Å; D246-F250 WeakPolarHBondContact O-CD2 3.24Å; T247-F250 WeakPolarHBondContact O-CB 3.47Å; T247-F250 PolarHBondContact O-N 3.06Å; L248-F250 PolarHBondContact O-N 2.97Å |
| 251 | V | 73.8 | Confident | 83.6 | Confident | 17 Ų | 17 | 40.3 Ų | 40.3 | 10% | 0.103 | 20% | 0.195 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -112.4 | 22.8 | -176.8 | -65.3 | 0 | 0 | 0 | 0 | 112.3 | I40 L248 E253 E254 I255 | I40-V251 HydrophobicContact CD1-CB 3.97Å; I40-V251 HydrophobicContact CD1-CG2 3.79Å; L248-V251 HydrophobicContact CD2-CG2 4.14Å; L248-V251 CarbonylContact O-C 3.1Å; L248-V251 PolarHBondContact O-N 2.91Å; V251-E253 PolarHBondContact O-N 3.41Å; V251-E254 WeakPolarHBondContact O-CB 3.24Å; V251-E254 PolarHBondContact O-N 2.65Å; V251-I255 PolarHBondContact O-N 3.33Å |
| 252 | T | 76.8 | Confident | 83.4 | Confident | 6 Ų | 6 | 40.3 Ų | 40.3 | 4% | 0.037 | 20% | 0.195 | C | C | . | . | G | 310 helix | trans | -60.8 | -30.9 | -175.4 | -60.8 | 0 | 0 | 0 | 0 | 112.8 | L248 N249 E254 I255 P258 L262 | L248-T252 PolarHBondContact O-N 2.89Å; L248-T252 VanDerWaalsContact O-N 3.16Å; L248-T252 PolarHBondContact O-OG1 3.42Å; N249-T252 VanDerWaalsContact CA-OG1 3.32Å; N249-T252 WeakPolarHBondContact CA-OG1 3.46Å; N249-T252 PolarHBondContact O-OG1 3.37Å; T252-E254 PolarHBondContact O-N 3.34Å; T252-I255 PolarHBondContact O-N 3.42Å; T252-P258 HydrophobicContact CG2-CB 3.92Å; T252-L262 HydrophobicContact CG2-CD2 4.49Å |
| 253 | E | 76.6 | Confident | 83.2 | Confident | 70 Ų | 70 | 41.2 Ų | 41.2 | 33% | 0.327 | 20% | 0.201 | S | C | . | . | G | 310 helix | trans | -63.6 | -26.7 | 175.1 | -66.4 | -177.6 | -148.4 | 0 | 0 | 113.1 | L36 K38 T101 S103 V251 | L36-E253 HydrophobicContact CD1-CB 4.18Å; K38-E253 WeakPolarHBondContact CG-O 3.44Å; T101-E253 WeakPolarHBondContact O-CG 3.17Å; S103-E253 PolarHBondContact N-OE1 3.17Å; S103-E253 PolarHBondContact OG-OE1 3.34Å; V251-E253 PolarHBondContact O-N 3.41Å |
| 254 | E | 81.3 | Confident | 83.4 | Confident | 57 Ų | 57 | 43.3 Ų | 43.3 | 27% | 0.266 | 21% | 0.21 | S | C | . | . | G | 310 helix | trans | -91.7 | -7.2 | -178.2 | -60.2 | 175.2 | -135.7 | 0 | 0 | 112.6 | L36 K38 E39 I40 V251 T252 | L36-E254 HydrophobicContact CB-CG 4.15Å; L36-E254 HydrophobicContact CD1-CG 4.23Å; K38-E254 CarbonylContact C-O 3.5Å; K38-E254 VanDerWaalsContact CA-O 3.29Å; K38-E254 WeakPolarHBondContact CA-O 3.46Å; E39-E254 PolarHBondContact N-O 3.12Å; I40-E254 HydrophobicContact CD1-CB 3.79Å; I40-E254 HydrophobicContact CG1-CB 4.14Å; I40-E254 PolarHBondContact N-O 3.21Å; V251-E254 WeakPolarHBondContact O-CB 3.24Å; V251-E254 PolarHBondContact O-N 2.65Å; T252-E254 PolarHBondContact O-N 3.34Å |
| 255 | I | 83.5 | Confident | 83.8 | Confident | 3 Ų | 3 | 42.8 Ų | 42.8 | 2% | 0.015 | 20% | 0.204 | C | C | . | . | B | Isolated β-bridge | trans | -79.4 | 131.5 | -179.1 | -62.4 | 175.1 | 0 | 0 | 0 | 111.1 | I40 L248 V251 T252 N257 P258 N261 L262 | I40-I255 HydrophobicContact CB-CG1 4.21Å; I40-I255 HydrophobicContact CG2-CG1 4.21Å; L248-I255 HydrophobicContact CB-CD1 4.23Å; L248-I255 HydrophobicContact CD2-CD1 4.25Å; V251-I255 PolarHBondContact O-N 3.33Å; T252-I255 PolarHBondContact O-N 3.42Å; I255-N257 PolarHBondContact O-N 2.7Å; I255-P258 HydrophobicContact CB-CB 4.36Å; I255-P258 HydrophobicContact CG2-CB 4.33Å; I255-N261 HydrophobicContact CG2-CB 3.96Å; I255-L262 HydrophobicContact CD1-CD1 4.1Å |
| 256 | K | 85.3 | Confident | 83.9 | Confident | 97 Ų | 97 | 42.8 Ų | 42.8 | 42% | 0.422 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -68.2 | 126.1 | 168 | -66.8 | 179.5 | -180 | 175.8 | 0 | 108.8 | K38 I40 N261 | K38-K256 HydrophobicContact CB-CG 4.34Å; K38-K256 WeakPolarHBondContact O-CE 2.95Å; K38-K256 VanDerWaalsContact O-CG 3.24Å; K38-K256 WeakPolarHBondContact O-CG 3.46Å; I40-K256 WeakPolarHBondContact O-CB 3.13Å; I40-K256 PolarHBondContact O-N 2.98Å; K256-N261 WeakPolarHBondContact O-CB 3.49Å; K256-N261 PolarHBondContact O-ND2 3.16Å |
| 257 | N | 86.4 | Confident | 84.1 | Confident | 115 Ų | 115 | 45 Ų | 45 | 62% | 0.615 | 22% | 0.224 | S | C | * | . | S | Bend | trans | 47.8 | 64.9 | 180 | -61.5 | -24.7 | 0 | 0 | 0 | 113.2 | I255 E259 R260 N261 | I255-N257 PolarHBondContact O-N 2.7Å; N257-E259 VanDerWaalsContact C-N 3.25Å; N257-E259 PolarHBondContact O-N 3.41Å; N257-R260 PolarHBondContact O-N 3.47Å; N257-R260 VanDerWaalsContact O-N 3.11Å; N257-N261 WeakPolarHBondContact O-CB 3.32Å; N257-N261 PolarHBondContact O-N 3.34Å |
| 258 | P | 84.4 | Confident | 84.7 | Confident | 22 Ų | 22 | 46.9 Ų | 46.9 | 14% | 0.143 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.1 | -36.1 | -171.7 | 23.5 | -33.3 | 0 | 0 | 0 | 112.8 | T252 I255 R260 L262 P263 | T252-P258 HydrophobicContact CG2-CB 3.92Å; I255-P258 HydrophobicContact CB-CB 4.36Å; I255-P258 HydrophobicContact CG2-CB 4.33Å; P258-R260 PolarHBondContact O-N 3.41Å; P258-R260 VanDerWaalsContact O-N 3.16Å; P258-L262 WeakPolarHBondContact O-CB 3.01Å; P258-L262 PolarHBondContact O-N 3.03Å; P258-P263 WeakPolarHBondContact O-CD 3.26Å |
| 259 | E | 86.2 | Confident | 85.3 | Confident | 121 Ų | 121 | 46.9 Ų | 46.9 | 57% | 0.565 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -56 | -34.1 | 179.1 | -57.4 | -178.9 | 176.7 | 0 | 0 | 113.6 | N257 P263 P416 | N257-E259 VanDerWaalsContact C-N 3.25Å; N257-E259 PolarHBondContact O-N 3.41Å; E259-P263 WeakPolarHBondContact O-CD 3.4Å; E259-P263 WeakPolarHBondContact O-CG 3.29Å; E259-P416 HydrophobicContact CB-CB 4.06Å; E259-P416 HydrophobicContact CG-CB 3.54Å; E259-P416 HydrophobicContact CG-CG 3.93Å; E259-P416 WeakPolarHBondContact OE1-CG 3.41Å |
| 260 | R | 88.7 | Confident | 85.7 | Confident | 172 Ų | 172 | 46.9 Ų | 46.9 | 65% | 0.649 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -99.5 | -45.6 | 179.4 | 177.8 | 177.7 | 174.8 | -167.3 | -0.4 | 111.8 | N257 P258 P263 L264 | N257-R260 PolarHBondContact O-N 3.47Å; N257-R260 VanDerWaalsContact O-N 3.11Å; P258-R260 PolarHBondContact O-N 3.41Å; P258-R260 VanDerWaalsContact O-N 3.16Å; R260-P263 WeakPolarHBondContact O-CD 3.22Å; R260-L264 HydrophobicContact CG-CD1 3.59Å; R260-L264 HydrophobicContact CG-CG 4.47Å; R260-L264 WeakPolarHBondContact O-CB 3.48Å; R260-L264 WeakPolarHBondContact O-CD1 3.48Å; R260-L264 WeakPolarHBondContact O-CG 3.49Å; R260-L264 PolarHBondContact O-N 3.46Å |
| 261 | N | 89.8 | Confident | 86.5 | Confident | 19 Ų | 19 | 46.8 Ų | 46.8 | 10% | 0.102 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -78.9 | -30.4 | -169.5 | -74.3 | -5.5 | 0 | 0 | 0 | 112.8 | L42 I255 K256 N257 S265 | L42-N261 HydrophobicContact CD1-CB 4.3Å; I255-N261 HydrophobicContact CG2-CB 3.96Å; K256-N261 WeakPolarHBondContact O-CB 3.49Å; K256-N261 PolarHBondContact O-ND2 3.16Å; N257-N261 WeakPolarHBondContact O-CB 3.32Å; N257-N261 PolarHBondContact O-N 3.34Å; N261-S265 VanDerWaalsContact O-CB 3.27Å; N261-S265 WeakPolarHBondContact O-CB 3.46Å; N261-S265 PolarHBondContact O-N 3.38Å; N261-S265 PolarHBondContact O-OG 3.07Å |
| 262 | L | 87.8 | Confident | 87.4 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -65.8 | -53 | 176.6 | 178.4 | 69.7 | 0 | 0 | 0 | 111.2 | A94 T98 L248 T252 I255 P258 L264 S265 I266 | A94-L262 HydrophobicContact CB-CG 4.48Å; T98-L262 HydrophobicContact CG2-CD2 4.29Å; L248-L262 HydrophobicContact CB-CD1 3.48Å; L248-L262 VanDerWaalsContact CB-CD1 3.48Å; L248-L262 HydrophobicContact CD1-CD1 4.04Å; L248-L262 HydrophobicContact CG-CD1 4.43Å; T252-L262 HydrophobicContact CG2-CD2 4.49Å; I255-L262 HydrophobicContact CD1-CD1 4.1Å; P258-L262 WeakPolarHBondContact O-CB 3.01Å; P258-L262 PolarHBondContact O-N 3.03Å; L262-L264 PolarHBondContact O-N 3.13Å; L262-S265 PolarHBondContact O-N 3.34Å; L262-I266 HydrophobicContact CD1-CD1 4.28Å; L262-I266 HydrophobicContact CG-CD1 4.37Å; L262-I266 PolarHBondContact O-N 2.65Å |
| 263 | P | 89.4 | Confident | 88.2 | Confident | 19 Ų | 19 | 49 Ų | 49 | 12% | 0.123 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.2 | -38.5 | 179.5 | -20.9 | 34.6 | 0 | 0 | 0 | 112.8 | A94 P258 E259 R260 I266 A267 L417 | A94-P263 HydrophobicContact CB-CB 4.47Å; A94-P263 HydrophobicContact CB-CG 4.3Å; P258-P263 WeakPolarHBondContact O-CD 3.26Å; E259-P263 WeakPolarHBondContact O-CD 3.4Å; E259-P263 WeakPolarHBondContact O-CG 3.29Å; R260-P263 WeakPolarHBondContact O-CD 3.22Å; P263-I266 PolarHBondContact O-N 2.69Å; P263-A267 WeakPolarHBondContact O-CB 3.46Å; P263-A267 PolarHBondContact O-N 3.12Å; P263-L417 HydrophobicContact CB-CD2 4.27Å; P263-L417 HydrophobicContact CG-CD1 4.26Å; P263-L417 HydrophobicContact CG-CD2 3.82Å |
| 264 | L | 90.2 | Very high | 89 | Confident | 65 Ų | 65 | 46.7 Ų | 46.7 | 34% | 0.34 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -66.3 | -38.7 | 177.3 | -73.2 | 175.8 | 0 | 0 | 0 | 112.3 | L42 R260 L262 I266 A267 I268 | L42-L264 HydrophobicContact CD1-CB 3.62Å; L42-L264 HydrophobicContact CD2-CD1 4.5Å; R260-L264 HydrophobicContact CG-CD1 3.59Å; R260-L264 HydrophobicContact CG-CG 4.47Å; R260-L264 WeakPolarHBondContact O-CB 3.48Å; R260-L264 WeakPolarHBondContact O-CD1 3.48Å; R260-L264 WeakPolarHBondContact O-CG 3.49Å; R260-L264 PolarHBondContact O-N 3.46Å; L262-L264 PolarHBondContact O-N 3.13Å; L264-I266 VanDerWaalsContact C-N 3.28Å; L264-I266 PolarHBondContact O-N 3.42Å; L264-A267 PolarHBondContact O-N 3.38Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.49Å; L264-I268 PolarHBondContact O-N 2.99Å |
| 265 | S | 91.2 | Very high | 89.7 | Confident | 2 Ų | 2 | 48.8 Ų | 48.8 | 1% | 0.014 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60 | -43.5 | 176.4 | -60.8 | 0 | 0 | 0 | 0 | 110.7 | L42 N261 L262 S269 | L42-S265 WeakPolarHBondContact CD1-OG 3.34Å; N261-S265 VanDerWaalsContact O-CB 3.27Å; N261-S265 WeakPolarHBondContact O-CB 3.46Å; N261-S265 PolarHBondContact O-N 3.38Å; N261-S265 PolarHBondContact O-OG 3.07Å; L262-S265 PolarHBondContact O-N 3.34Å; S265-S269 VanDerWaalsContact O-CB 3.23Å; S265-S269 WeakPolarHBondContact O-CB 3.18Å; S265-S269 PolarHBondContact O-N 3.49Å; S265-S269 PolarHBondContact O-OG 3.05Å |
| 266 | I | 90.1 | Very high | 90.2 | Very high | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.005 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -66 | -48.4 | 177 | -70.4 | 165.9 | 0 | 0 | 0 | 111.2 | I49 A90 A94 L262 P263 L264 I268 S269 M270 | I49-I266 HydrophobicContact CD1-CB 4.48Å; I49-I266 HydrophobicContact CD1-CG1 3.66Å; A90-I266 HydrophobicContact CB-CD1 4.34Å; A90-I266 HydrophobicContact CB-CG1 4.43Å; A90-I266 HydrophobicContact CB-CG2 3.41Å; A90-I266 VanDerWaalsContact CB-CG2 3.41Å; A94-I266 HydrophobicContact CB-CD1 3.81Å; L262-I266 HydrophobicContact CD1-CD1 4.28Å; L262-I266 HydrophobicContact CG-CD1 4.37Å; L262-I266 PolarHBondContact O-N 2.65Å; P263-I266 PolarHBondContact O-N 2.69Å; L264-I266 VanDerWaalsContact C-N 3.28Å; L264-I266 PolarHBondContact O-N 3.42Å; I266-I268 PolarHBondContact O-N 3.01Å; I266-S269 PolarHBondContact O-N 3.2Å; I266-S269 PolarHBondContact O-OG 3.44Å; I266-M270 HydrophobicContact CG2-CG 3.87Å; I266-M270 WeakPolarHBondContact O-CB 3.2Å; I266-M270 VanDerWaalsContact O-CG 3.24Å; I266-M270 WeakPolarHBondContact O-CG 3.4Å; I266-M270 PolarHBondContact O-N 2.89Å |
| 267 | A | 89.1 | Confident | 90.7 | Very high | 56 Ų | 56 | 45.4 Ų | 45.4 | 46% | 0.463 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.2 | -30.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | P263 L264 P271 | P263-A267 WeakPolarHBondContact O-CB 3.46Å; P263-A267 PolarHBondContact O-N 3.12Å; L264-A267 PolarHBondContact O-N 3.38Å; A267-P271 WeakPolarHBondContact O-CD 3.35Å; A267-P271 WeakPolarHBondContact O-CG 3.37Å |
| 268 | I | 91.6 | Very high | 91.1 | Very high | 77 Ų | 77 | 42.2 Ų | 42.2 | 40% | 0.395 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -84.3 | -47.4 | 177 | -64.9 | 167.3 | 0 | 0 | 0 | 111.2 | V46 L264 I266 I272 | V46-I268 HydrophobicContact CG1-CG2 4.05Å; V46-I268 HydrophobicContact CG2-CB 4.11Å; V46-I268 HydrophobicContact CG2-CD1 4.35Å; V46-I268 HydrophobicContact CG2-CG2 4.12Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.49Å; L264-I268 PolarHBondContact O-N 2.99Å; I266-I268 PolarHBondContact O-N 3.01Å; I268-I272 HydrophobicContact CG2-CD1 3.76Å; I268-I272 VanDerWaalsContact O-CD1 3.28Å; I268-I272 WeakPolarHBondContact O-CD1 3.42Å; I268-I272 VanDerWaalsContact O-CG1 3.25Å; I268-I272 WeakPolarHBondContact O-CG1 3.25Å |
| 269 | S | 91.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -69.5 | -41.6 | -173.3 | 54 | 0 | 0 | 0 | 0 | 113.2 | I49 S265 I266 I272 V273 | I49-S269 WeakPolarHBondContact CD1-OG 3.21Å; I49-S269 VanDerWaalsContact CG2-OG 3.23Å; I49-S269 WeakPolarHBondContact CG2-OG 3.35Å; S265-S269 VanDerWaalsContact O-CB 3.23Å; S265-S269 WeakPolarHBondContact O-CB 3.18Å; S265-S269 PolarHBondContact O-N 3.49Å; S265-S269 PolarHBondContact O-OG 3.05Å; I266-S269 PolarHBondContact O-N 3.2Å; I266-S269 PolarHBondContact O-OG 3.44Å; S269-I272 PolarHBondContact O-N 3.43Å; S269-V273 WeakPolarHBondContact O-CG2 3.37Å; S269-V273 PolarHBondContact O-N 3.45Å |
| 270 | M | 91.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 38.5 Ų | 38.5 | 1% | 0.005 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.2 | -46.1 | -173.4 | -64.7 | -60.1 | -58.1 | 0 | 0 | 113.7 | M53 V87 A90 W245 I266 I272 T274 | M53-M270 HydrophobicContact CE-CE 3.6Å; M53-M270 HydrophobicContact CE-SD 3.6Å; M53-M270 HydrophobicContact SD-CE 4.36Å; M53-M270 HydrophobicContact SD-SD 3.54Å; V87-M270 HydrophobicContact CG2-CB 3.56Å; V87-M270 HydrophobicContact CG2-CE 4.31Å; V87-M270 HydrophobicContact CG2-CG 4.27Å; A90-M270 HydrophobicContact CB-CG 4.34Å; A90-M270 HydrophobicContact CB-SD 4.37Å; W245-M270 HydrophobicContact CB-SD 3.63Å; W245-M270 HydrophobicContact CG-CE 4.5Å; W245-M270 HydrophobicContact CG-SD 4.19Å; I266-M270 HydrophobicContact CG2-CG 3.87Å; I266-M270 WeakPolarHBondContact O-CB 3.2Å; I266-M270 VanDerWaalsContact O-CG 3.24Å; I266-M270 WeakPolarHBondContact O-CG 3.4Å; I266-M270 PolarHBondContact O-N 2.89Å; M270-I272 PolarHBondContact O-N 3.37Å; M270-T274 WeakPolarHBondContact O-CB 3.46Å; M270-T274 PolarHBondContact O-N 3.24Å; M270-T274 PolarHBondContact O-OG1 3.37Å |
| 271 | P | 92 | Very high | 92.5 | Very high | 62 Ų | 62 | 30.3 Ų | 30.3 | 40% | 0.403 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -63.4 | -39.4 | 174.2 | -23.7 | 35.7 | 0 | 0 | 0 | 112.8 | A267 T274 I275 | A267-P271 WeakPolarHBondContact O-CD 3.35Å; A267-P271 WeakPolarHBondContact O-CG 3.37Å; P271-T274 PolarHBondContact O-N 3.46Å; P271-I275 WeakPolarHBondContact O-CB 3.42Å; P271-I275 VanDerWaalsContact O-CG1 3.27Å; P271-I275 WeakPolarHBondContact O-CG1 3.21Å; P271-I275 PolarHBondContact O-N 2.89Å |
| 272 | I | 91.7 | Very high | 92.8 | Very high | 71 Ų | 71 | 30.9 Ų | 30.9 | 36% | 0.364 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -58.9 | -51.2 | 178.4 | -69.1 | 170.5 | 0 | 0 | 0 | 110.2 | I268 S269 M270 T274 I275 I276 | I268-I272 HydrophobicContact CG2-CD1 3.76Å; I268-I272 VanDerWaalsContact O-CD1 3.28Å; I268-I272 WeakPolarHBondContact O-CD1 3.42Å; I268-I272 VanDerWaalsContact O-CG1 3.25Å; I268-I272 WeakPolarHBondContact O-CG1 3.25Å; S269-I272 PolarHBondContact O-N 3.43Å; M270-I272 PolarHBondContact O-N 3.37Å; I272-T274 VanDerWaalsContact C-N 3.32Å; I272-T274 PolarHBondContact O-N 3.14Å; I272-I275 PolarHBondContact O-N 3.43Å; I272-I276 HydrophobicContact CG2-CD1 3.74Å; I272-I276 VanDerWaalsContact O-CG1 3.27Å; I272-I276 WeakPolarHBondContact O-CG1 3.37Å; I272-I276 PolarHBondContact O-N 3.31Å |
| 273 | V | 93.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.7 | -41.8 | 179.5 | 176.9 | 0 | 0 | 0 | 0 | 110.8 | V50 M53 I54 Y242 S269 I275 I276 Y277 | V50-V273 HydrophobicContact CG1-CG2 4.44Å; V50-V273 HydrophobicContact CG2-CG2 4.21Å; M53-V273 HydrophobicContact CB-CG1 4.22Å; M53-V273 HydrophobicContact CB-CG2 4.27Å; M53-V273 HydrophobicContact CE-CB 4.26Å; M53-V273 HydrophobicContact CE-CG1 3.88Å; M53-V273 HydrophobicContact SD-CB 4.47Å; M53-V273 HydrophobicContact SD-CG1 4.46Å; M53-V273 HydrophobicContact SD-CG2 4.11Å; I54-V273 HydrophobicContact CD1-CG2 4.35Å; I54-V273 HydrophobicContact CG1-CG1 4.3Å; I54-V273 HydrophobicContact CG1-CG2 4.1Å; Y242-V273 HydrophobicContact CD1-CG1 4.24Å; Y242-V273 HydrophobicContact CE1-CG1 4.18Å; S269-V273 WeakPolarHBondContact O-CG2 3.37Å; S269-V273 PolarHBondContact O-N 3.45Å; V273-I275 PolarHBondContact O-N 2.6Å; V273-I276 PolarHBondContact O-N 2.71Å; V273-Y277 HydrophobicContact CG1-CD1 4.24Å; V273-Y277 HydrophobicContact CG1-CD2 3.91Å; V273-Y277 HydrophobicContact CG1-CE1 3.89Å; V273-Y277 HydrophobicContact CG1-CE2 3.51Å; V273-Y277 HydrophobicContact CG1-CG 4.27Å; V273-Y277 WeakPolarHBondContact O-CB 3.45Å; V273-Y277 PolarHBondContact O-N 2.88Å |
| 274 | T | 94.3 | Very high | 93.5 | Very high | 21 Ų | 21 | 30.1 Ų | 30.1 | 13% | 0.129 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61.7 | -45.9 | 179 | -56.1 | 0 | 0 | 0 | 0 | 112 | M270 P271 I272 Y277 I278 | M270-T274 WeakPolarHBondContact O-CB 3.46Å; M270-T274 PolarHBondContact O-N 3.24Å; M270-T274 PolarHBondContact O-OG1 3.37Å; P271-T274 PolarHBondContact O-N 3.46Å; I272-T274 VanDerWaalsContact C-N 3.32Å; I272-T274 PolarHBondContact O-N 3.14Å; T274-Y277 PolarHBondContact O-N 2.89Å; T274-I278 HydrophobicContact CG2-CD1 3.97Å; T274-I278 WeakPolarHBondContact O-CG1 3.44Å; T274-I278 PolarHBondContact O-N 3.02Å |
| 275 | I | 94.6 | Very high | 93.7 | Very high | 100 Ų | 100 | 27 Ų | 27 | 51% | 0.513 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -62.5 | -46.6 | 176.9 | -69.7 | 165.8 | 0 | 0 | 0 | 110.3 | P271 I272 V273 Y277 I278 L279 | P271-I275 WeakPolarHBondContact O-CB 3.42Å; P271-I275 VanDerWaalsContact O-CG1 3.27Å; P271-I275 WeakPolarHBondContact O-CG1 3.21Å; P271-I275 PolarHBondContact O-N 2.89Å; I272-I275 PolarHBondContact O-N 3.43Å; V273-I275 PolarHBondContact O-N 2.6Å; I275-Y277 VanDerWaalsContact C-N 3.35Å; I275-Y277 PolarHBondContact O-N 2.87Å; I275-I278 PolarHBondContact O-N 3.5Å; I275-L279 HydrophobicContact CG2-CD1 3.65Å; I275-L279 HydrophobicContact CG2-CG 4.18Å; I275-L279 WeakPolarHBondContact O-CB 3.25Å; I275-L279 VanDerWaalsContact O-CG 3.23Å; I275-L279 WeakPolarHBondContact O-CG 3.28Å; I275-L279 PolarHBondContact O-N 3.19Å |
| 276 | I | 94.3 | Very high | 93.8 | Very high | 30 Ų | 30 | 27.1 Ų | 27.1 | 15% | 0.154 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -57.9 | -48.5 | 178.4 | -71.3 | 169.6 | 0 | 0 | 0 | 110.3 | I54 L198 I202 I272 V273 I278 L279 T280 | I54-I276 HydrophobicContact CD1-CD1 3.89Å; I54-I276 HydrophobicContact CD1-CG2 4.46Å; L198-I276 HydrophobicContact CB-CG2 4.32Å; L198-I276 HydrophobicContact CD1-CG2 3.8Å; I202-I276 HydrophobicContact CD1-CG2 4.16Å; I272-I276 HydrophobicContact CG2-CD1 3.74Å; I272-I276 VanDerWaalsContact O-CG1 3.27Å; I272-I276 WeakPolarHBondContact O-CG1 3.37Å; I272-I276 PolarHBondContact O-N 3.31Å; V273-I276 PolarHBondContact O-N 2.71Å; I276-I278 PolarHBondContact O-N 3.5Å; I276-L279 PolarHBondContact O-N 2.97Å; I276-T280 WeakPolarHBondContact O-CB 3.42Å; I276-T280 PolarHBondContact O-N 3.1Å; I276-T280 PolarHBondContact O-OG1 2.96Å |
| 277 | Y | 95.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.6 | -43 | -178.5 | -71.2 | -3 | 0 | 0 | 0 | 113.1 | M53 I54 I58 W79 S241 Y242 V273 T274 I275 T280 N281 | M53-Y277 VanDerWaalsContact C-OH 3.27Å; M53-Y277 PolarHBondContact O-OH 3.44Å; I54-Y277 WeakPolarHBondContact CA-OH 3.41Å; I54-Y277 HydrophobicContact CG1-CE1 4.13Å; I58-Y277 HydrophobicContact CB-CD1 4.1Å; I58-Y277 HydrophobicContact CB-CE1 3.74Å; I58-Y277 HydrophobicContact CD1-CD1 3.61Å; I58-Y277 HydrophobicContact CD1-CD2 4.44Å; I58-Y277 HydrophobicContact CD1-CE1 4.14Å; I58-Y277 HydrophobicContact CD1-CG 3.77Å; I58-Y277 HydrophobicContact CG1-CD1 3.69Å; I58-Y277 HydrophobicContact CG1-CE1 3.86Å; I58-Y277 HydrophobicContact CG1-CG 4.37Å; I58-Y277 HydrophobicContact CG2-CE1 4.28Å; W79-Y277 AromaticContact CE3-CD2 3.96Å; W79-Y277 HydrophobicContact CE3-CD2 3.96Å; W79-Y277 HydrophobicContact CE3-CG 4.31Å; W79-Y277 HydrophobicContact CH2-CD2 4.49Å; W79-Y277 AromaticContact CZ3-CD2 3.45Å; W79-Y277 HydrophobicContact CZ3-CD2 3.45Å; W79-Y277 VanDerWaalsContact CZ3-CD2 3.45Å; W79-Y277 HydrophobicContact CZ3-CE2 4.13Å; W79-Y277 AromaticContact CZ3-CG 3.92Å; W79-Y277 HydrophobicContact CZ3-CG 3.92Å; S241-Y277 VanDerWaalsContact O-CE2 3.25Å; S241-Y277 WeakPolarHBondContact O-CE2 3.28Å; S241-Y277 PolarHBondContact O-OH 3.21Å; Y242-Y277 AromaticContact CD1-CD2 3.92Å; Y242-Y277 HydrophobicContact CD1-CD2 3.92Å; Y242-Y277 AromaticContact CD1-CE2 3.87Å; Y242-Y277 HydrophobicContact CD1-CE2 3.87Å; Y242-Y277 HydrophobicContact CD2-CD2 4.44Å; Y242-Y277 AromaticContact CE1-CD2 3.44Å; Y242-Y277 HydrophobicContact CE1-CD2 3.44Å; Y242-Y277 VanDerWaalsContact CE1-CD2 3.44Å; Y242-Y277 AromaticContact CE1-CE2 3.88Å; Y242-Y277 HydrophobicContact CE1-CE2 3.88Å; Y242-Y277 HydrophobicContact CE1-CG 4.43Å; Y242-Y277 HydrophobicContact CE2-CD2 4.02Å; Y242-Y277 HydrophobicContact CG-CD2 4.39Å; Y242-Y277 HydrophobicContact CG-CE2 4.24Å; Y242-Y277 AromaticContact CZ-CD2 3.49Å; Y242-Y277 VanDerWaalsContact CZ-CD2 3.49Å; V273-Y277 HydrophobicContact CG1-CD1 4.24Å; V273-Y277 HydrophobicContact CG1-CD2 3.91Å; V273-Y277 HydrophobicContact CG1-CE1 3.89Å; V273-Y277 HydrophobicContact CG1-CE2 3.51Å; V273-Y277 HydrophobicContact CG1-CG 4.27Å; V273-Y277 WeakPolarHBondContact O-CB 3.45Å; V273-Y277 PolarHBondContact O-N 2.88Å; T274-Y277 PolarHBondContact O-N 2.89Å; I275-Y277 VanDerWaalsContact C-N 3.35Å; I275-Y277 PolarHBondContact O-N 2.87Å; Y277-T280 PolarHBondContact O-N 3.16Å; Y277-N281 PolarHBondContact O-N 3.36Å; Y277-N281 PolarHBondContact O-ND2 3.05Å |
| 278 | I | 96.1 | Very high | 94.1 | Very high | 47 Ų | 47 | 25.7 Ų | 25.7 | 24% | 0.241 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62 | -47.8 | 175.7 | -68.6 | 171.8 | 0 | 0 | 0 | 109.9 | W79 A80 T274 I275 I276 T280 N281 V282 | W79-I278 HydrophobicContact CB-CG1 4.33Å; A80-I278 HydrophobicContact CB-CD1 3.97Å; T274-I278 HydrophobicContact CG2-CD1 3.97Å; T274-I278 WeakPolarHBondContact O-CG1 3.44Å; T274-I278 PolarHBondContact O-N 3.02Å; I275-I278 PolarHBondContact O-N 3.5Å; I276-I278 PolarHBondContact O-N 3.5Å; I278-T280 VanDerWaalsContact C-N 3.33Å; I278-T280 PolarHBondContact O-N 3.43Å; I278-N281 PolarHBondContact O-N 3.17Å; I278-V282 HydrophobicContact CG2-CG2 4.38Å; I278-V282 WeakPolarHBondContact O-CG2 3.42Å; I278-V282 PolarHBondContact O-N 3.21Å |
| 279 | L | 96.5 | Very high | 94.1 | Very high | 66 Ų | 66 | 26.2 Ų | 26.2 | 35% | 0.346 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -64 | -36.7 | 179.9 | -70 | 178.2 | 0 | 0 | 0 | 112.5 | I202 I275 I276 V282 A283 | I202-L279 HydrophobicContact CD1-CB 3.96Å; I202-L279 HydrophobicContact CG1-CB 3.92Å; I202-L279 HydrophobicContact CG2-CB 4.01Å; I202-L279 HydrophobicContact CG2-CD1 4.15Å; I275-L279 HydrophobicContact CG2-CD1 3.65Å; I275-L279 HydrophobicContact CG2-CG 4.18Å; I275-L279 WeakPolarHBondContact O-CB 3.25Å; I275-L279 VanDerWaalsContact O-CG 3.23Å; I275-L279 WeakPolarHBondContact O-CG 3.28Å; I275-L279 PolarHBondContact O-N 3.19Å; I276-L279 PolarHBondContact O-N 2.97Å; L279-V282 PolarHBondContact O-N 2.78Å; L279-A283 WeakPolarHBondContact O-CB 3.37Å; L279-A283 PolarHBondContact O-N 3.15Å |
| 280 | T | 95.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.2 | -43.5 | 174.6 | -63 | 0 | 0 | 0 | 0 | 111.4 | I58 L198 I201 I276 Y277 I278 A283 Y284 | I58-T280 HydrophobicContact CD1-CG2 4.42Å; I58-T280 HydrophobicContact CG1-CG2 4.11Å; L198-T280 HydrophobicContact CD2-CG2 4.06Å; I201-T280 HydrophobicContact CG2-CG2 4.22Å; I276-T280 WeakPolarHBondContact O-CB 3.42Å; I276-T280 PolarHBondContact O-N 3.1Å; I276-T280 PolarHBondContact O-OG1 2.96Å; Y277-T280 PolarHBondContact O-N 3.16Å; I278-T280 VanDerWaalsContact C-N 3.33Å; I278-T280 PolarHBondContact O-N 3.43Å; T280-A283 WeakPolarHBondContact O-CB 3.41Å; T280-A283 PolarHBondContact O-N 3.1Å; T280-Y284 HydrophobicContact CG2-CD2 4.19Å; T280-Y284 HydrophobicContact CG2-CE1 4.39Å; T280-Y284 HydrophobicContact CG2-CE2 3.56Å; T280-Y284 PolarHBondContact O-N 3.18Å |
| 281 | N | 96.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -67.1 | -40.4 | 176.2 | -77.5 | -83.3 | 0 | 0 | 0 | 111.9 | P62 L76 W79 Y277 I278 A283 Y284 Y285 | P62-N281 WeakPolarHBondContact CB-OD1 3.29Å; L76-N281 HydrophobicContact CD2-CB 3.75Å; W79-N281 WeakPolarHBondContact CZ2-ND2 3.26Å; W79-N281 PolarHBondContact NE1-ND2 3.02Å; W79-N281 PolarHBondContact NE1-OD1 3.19Å; Y277-N281 PolarHBondContact O-N 3.36Å; Y277-N281 PolarHBondContact O-ND2 3.05Å; I278-N281 PolarHBondContact O-N 3.17Å; N281-A283 VanDerWaalsContact C-N 3.28Å; N281-A283 PolarHBondContact O-N 3.2Å; N281-Y284 PolarHBondContact O-N 3.2Å; N281-Y285 HydrophobicContact CB-CE2 4.09Å; N281-Y285 VanDerWaalsContact O-CD2 3.3Å; N281-Y285 WeakPolarHBondContact O-CD2 3.4Å; N281-Y285 VanDerWaalsContact O-CG 3.23Å; N281-Y285 PolarHBondContact O-N 3.23Å |
| 282 | V | 96 | Very high | 93.7 | Very high | 31 Ų | 31 | 29.9 Ų | 29.9 | 19% | 0.188 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.1 | -42.6 | 172.2 | 169.1 | 0 | 0 | 0 | 0 | 110.8 | L76 L209 F217 I278 L279 Y285 A286 | L76-V282 HydrophobicContact CD1-CG2 3.94Å; L76-V282 HydrophobicContact CD2-CG2 3.86Å; L209-V282 HydrophobicContact CD1-CG1 3.79Å; F217-V282 HydrophobicContact CZ-CG1 4.16Å; I278-V282 HydrophobicContact CG2-CG2 4.38Å; I278-V282 WeakPolarHBondContact O-CG2 3.42Å; I278-V282 PolarHBondContact O-N 3.21Å; L279-V282 PolarHBondContact O-N 2.78Å; V282-Y285 PolarHBondContact O-N 2.99Å; V282-A286 WeakPolarHBondContact O-CB 3.27Å; V282-A286 PolarHBondContact O-N 2.71Å |
| 283 | A | 96 | Very high | 93.8 | Very high | 2 Ų | 2 | 26.5 Ų | 26.5 | 2% | 0.017 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.8 | -44.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | I201 L279 T280 N281 A286 F303 | I201-A283 HydrophobicContact CG2-CB 3.95Å; I201-A283 WeakPolarHBondContact O-CB 3.47Å; L279-A283 WeakPolarHBondContact O-CB 3.37Å; L279-A283 PolarHBondContact O-N 3.15Å; T280-A283 WeakPolarHBondContact O-CB 3.41Å; T280-A283 PolarHBondContact O-N 3.1Å; N281-A283 VanDerWaalsContact C-N 3.28Å; N281-A283 PolarHBondContact O-N 3.2Å; A283-A286 PolarHBondContact O-N 3.02Å; A283-F303 HydrophobicContact CB-CE2 4.42Å; A283-F303 WeakPolarHBondContact O-CE2 3.11Å |
| 284 | Y | 95.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.7 | -47.8 | 175.6 | -66.3 | -30 | 0 | 0 | 0 | 112.1 | P62 I201 T280 N281 A286 V287 L288 V299 A300 F303 | P62-Y284 HydrophobicContact CB-CD2 4.25Å; P62-Y284 HydrophobicContact CB-CE2 4.49Å; P62-Y284 HydrophobicContact CG-CD2 4.16Å; P62-Y284 HydrophobicContact CG-CE2 3.97Å; I201-Y284 HydrophobicContact CD1-CE1 4.3Å; I201-Y284 HydrophobicContact CG2-CD1 4.21Å; I201-Y284 HydrophobicContact CG2-CE1 3.71Å; T280-Y284 HydrophobicContact CG2-CD2 4.19Å; T280-Y284 HydrophobicContact CG2-CE1 4.39Å; T280-Y284 HydrophobicContact CG2-CE2 3.56Å; T280-Y284 PolarHBondContact O-N 3.18Å; N281-Y284 PolarHBondContact O-N 3.2Å; Y284-A286 VanDerWaalsContact C-N 3.29Å; Y284-A286 PolarHBondContact O-N 2.9Å; Y284-V287 PolarHBondContact O-N 3.5Å; Y284-L288 WeakPolarHBondContact O-CB 3.41Å; Y284-L288 PolarHBondContact O-N 3.05Å; Y284-V299 HydrophobicContact CD1-CG1 4.29Å; Y284-V299 HydrophobicContact CD2-CG1 3.98Å; Y284-V299 HydrophobicContact CE2-CG1 4.19Å; Y284-V299 HydrophobicContact CG-CG1 4.04Å; Y284-A300 HydrophobicContact CE1-CB 4.21Å; Y284-A300 WeakPolarHBondContact OH-CB 3.34Å; Y284-F303 HydrophobicContact CD1-CB 3.9Å; Y284-F303 AromaticContact CD1-CD2 3.77Å; Y284-F303 HydrophobicContact CD1-CD2 3.77Å; Y284-F303 HydrophobicContact CD1-CE2 4.49Å; Y284-F303 AromaticContact CD1-CG 3.89Å; Y284-F303 HydrophobicContact CD1-CG 3.89Å; Y284-F303 HydrophobicContact CE1-CB 3.94Å; Y284-F303 HydrophobicContact CE1-CD2 4.37Å; Y284-F303 HydrophobicContact CE1-CG 4.04Å |
| 285 | Y | 94.7 | Very high | 93.4 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -70.3 | -23.8 | -178.2 | -56.9 | -26.4 | 0 | 0 | 0 | 113.6 | L66 Y72 S75 L76 N216 N281 V282 V287 I293 | L66-Y285 HydrophobicContact CD2-CE1 4.37Å; Y72-Y285 AromaticContact CD1-CD1 3.67Å; Y72-Y285 HydrophobicContact CD1-CD1 3.67Å; Y72-Y285 HydrophobicContact CD1-CD2 4.15Å; Y72-Y285 AromaticContact CD1-CE1 3.92Å; Y72-Y285 HydrophobicContact CD1-CE1 3.92Å; Y72-Y285 HydrophobicContact CD1-CE2 4.35Å; Y72-Y285 AromaticContact CD1-CG 3.82Å; Y72-Y285 HydrophobicContact CD1-CG 3.82Å; Y72-Y285 AromaticContact CE1-CD1 4Å; Y72-Y285 HydrophobicContact CE1-CD1 4Å; Y72-Y285 HydrophobicContact CE1-CE1 4.38Å; Y72-Y285 HydrophobicContact CE1-CG 4.43Å; Y72-Y285 HydrophobicContact CG-CD1 4.4Å; Y72-Y285 HydrophobicContact CG-CD2 4.2Å; Y72-Y285 HydrophobicContact CG-CG 4.08Å; S75-Y285 WeakPolarHBondContact CB-OH 3.23Å; S75-Y285 PolarHBondContact OG-OH 2.62Å; L76-Y285 HydrophobicContact CD1-CD2 4.46Å; L76-Y285 HydrophobicContact CD2-CD2 4.23Å; L76-Y285 HydrophobicContact CD2-CE2 3.97Å; L76-Y285 HydrophobicContact CG-CD2 4.25Å; L76-Y285 HydrophobicContact CG-CE2 4.03Å; N216-Y285 VanDerWaalsContact CB-O 3.28Å; N216-Y285 WeakPolarHBondContact CB-O 3.16Å; N216-Y285 PolarHBondContact ND2-O 3.18Å; N281-Y285 HydrophobicContact CB-CE2 4.09Å; N281-Y285 VanDerWaalsContact O-CD2 3.3Å; N281-Y285 WeakPolarHBondContact O-CD2 3.4Å; N281-Y285 VanDerWaalsContact O-CG 3.23Å; N281-Y285 PolarHBondContact O-N 3.23Å; V282-Y285 PolarHBondContact O-N 2.99Å; Y285-V287 VanDerWaalsContact C-N 3.27Å; Y285-V287 PolarHBondContact O-N 3.33Å; Y285-I293 HydrophobicContact CD1-CD1 3.46Å; Y285-I293 VanDerWaalsContact CD1-CD1 3.46Å; Y285-I293 HydrophobicContact CE1-CD1 3.59Å |
| 286 | A | 93.6 | Very high | 93.2 | Very high | 4 Ų | 4 | 27.6 Ų | 27.6 | 3% | 0.033 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -69.6 | -24 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L209 F217 V282 A283 Y284 | L209-A286 HydrophobicContact CD1-CB 4.48Å; L209-A286 HydrophobicContact CD2-CB 3.71Å; L209-A286 HydrophobicContact CG-CB 3.79Å; F217-A286 HydrophobicContact CE2-CB 3.94Å; F217-A286 HydrophobicContact CZ-CB 4.42Å; V282-A286 WeakPolarHBondContact O-CB 3.27Å; V282-A286 PolarHBondContact O-N 2.71Å; A283-A286 PolarHBondContact O-N 3.02Å; Y284-A286 VanDerWaalsContact C-N 3.29Å; Y284-A286 PolarHBondContact O-N 2.9Å |
| 287 | V | 92.2 | Very high | 92.7 | Very high | 25 Ų | 25 | 29.4 Ų | 29.4 | 15% | 0.152 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -114.6 | -37.9 | -171.8 | 172.5 | 0 | 0 | 0 | 0 | 112.4 | K208 Y284 Y285 F303 H306 T307 | K208-V287 HydrophobicContact CB-CG2 4.06Å; K208-V287 HydrophobicContact CG-CG2 3.85Å; Y284-V287 PolarHBondContact O-N 3.5Å; Y285-V287 VanDerWaalsContact C-N 3.27Å; Y285-V287 PolarHBondContact O-N 3.33Å; V287-F303 HydrophobicContact CB-CD2 3.8Å; V287-F303 HydrophobicContact CB-CE2 3.69Å; V287-F303 HydrophobicContact CG1-CD2 3.96Å; V287-F303 HydrophobicContact CG1-CE2 4.13Å; V287-F303 HydrophobicContact CG2-CD2 4.1Å; V287-F303 HydrophobicContact CG2-CE2 3.45Å; V287-F303 VanDerWaalsContact CG2-CE2 3.45Å; V287-F303 HydrophobicContact CG2-CZ 4.25Å; V287-H306 HydrophobicContact CG1-CB 3.91Å; V287-T307 HydrophobicContact CB-CG2 4.31Å; V287-T307 HydrophobicContact CG1-CG2 3.46Å; V287-T307 VanDerWaalsContact CG1-CG2 3.46Å; V287-T307 HydrophobicContact CG2-CG2 3.89Å |
| 288 | L | 92.5 | Very high | 92.4 | Very high | 2 Ų | 2 | 29.4 Ų | 29.4 | 1% | 0.01 | 18% | 0.184 | C | C | . | . | S | Bend | trans | -108.8 | 136.7 | -173.3 | -58.7 | 178.4 | 0 | 0 | 0 | 110.8 | N216 Y284 I293 V299 T302 F303 H306 | N216-L288 PolarHBondContact ND2-O 2.97Å; Y284-L288 WeakPolarHBondContact O-CB 3.41Å; Y284-L288 PolarHBondContact O-N 3.05Å; L288-I293 HydrophobicContact CB-CD1 4.04Å; L288-I293 HydrophobicContact CB-CG1 3.69Å; L288-I293 HydrophobicContact CD1-CG1 4.07Å; L288-V299 HydrophobicContact CD1-CG1 4.03Å; L288-T302 HydrophobicContact CD1-CG2 4.35Å; L288-T302 HydrophobicContact CD2-CG2 3.96Å; L288-F303 HydrophobicContact CD1-CB 4.06Å; L288-H306 HydrophobicContact CD2-CB 4.45Å |
| 289 | D | 91.4 | Very high | 92.2 | Very high | 89 Ų | 89 | 27.3 Ų | 27.3 | 48% | 0.476 | 17% | 0.173 | S | C | . | . | trans | -77.6 | 159.4 | 170.1 | -61 | -23.4 | 0 | 0 | 0 | 110.9 | N216 S291 A292 I293 | N216-D289 PolarHBondContact ND2-OD1 2.93Å; N216-D289 PolarHBondContact OD1-OD1 3.41Å; D289-S291 VanDerWaalsContact C-N 3.3Å; D289-S291 PolarHBondContact O-N 3.46Å; D289-A292 WeakPolarHBondContact O-CA 3.23Å; D289-A292 WeakPolarHBondContact O-CB 3.33Å; D289-A292 PolarHBondContact O-N 2.99Å; D289-I293 PolarHBondContact O-N 2.97Å | ||
| 290 | G | 87.8 | Confident | 92 | Very high | 16 Ų | 16 | 24.1 Ų | 24.1 | 17% | 0.165 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63 | -39.5 | -170.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y72 A292 I293 L294 | Y72-G290 VanDerWaalsContact OH-CA 3.31Å; Y72-G290 WeakPolarHBondContact OH-CA 3.28Å; Y72-G290 PolarHBondContact OH-N 3.16Å; G290-A292 VanDerWaalsContact C-N 3.3Å; G290-A292 PolarHBondContact O-N 3.49Å; G290-I293 PolarHBondContact O-N 2.87Å; G290-L294 WeakPolarHBondContact O-CB 3.3Å; G290-L294 WeakPolarHBondContact O-CG 3.49Å; G290-L294 PolarHBondContact O-N 3.29Å |
| 291 | S | 89.8 | Confident | 91.8 | Very high | 90 Ų | 90 | 24.2 Ų | 24.2 | 63% | 0.629 | 16% | 0.157 | S | C | * | . | H | α-helix | trans | -60.3 | -38.4 | 173.1 | 52.2 | 0 | 0 | 0 | 0 | 112.6 | D289 L294 A295 | D289-S291 VanDerWaalsContact C-N 3.3Å; D289-S291 PolarHBondContact O-N 3.46Å; S291-L294 PolarHBondContact O-N 2.98Å; S291-A295 VanDerWaalsContact O-CB 3.26Å; S291-A295 WeakPolarHBondContact O-CB 3.29Å; S291-A295 PolarHBondContact O-N 3.24Å |
| 292 | A | 90.7 | Very high | 91.5 | Very high | 33 Ų | 33 | 25.4 Ų | 25.4 | 27% | 0.273 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -68.4 | -38.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | D289 G290 S296 | D289-A292 WeakPolarHBondContact O-CA 3.23Å; D289-A292 WeakPolarHBondContact O-CB 3.33Å; D289-A292 PolarHBondContact O-N 2.99Å; G290-A292 VanDerWaalsContact C-N 3.3Å; G290-A292 PolarHBondContact O-N 3.49Å; A292-S296 VanDerWaalsContact O-CB 3.31Å; A292-S296 WeakPolarHBondContact O-CB 3.25Å; A292-S296 PolarHBondContact O-N 3.49Å |
| 293 | I | 92.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.8 | -43.1 | 175.3 | -62.7 | 174.9 | 0 | 0 | 0 | 110.7 | L66 Y285 L288 D289 G290 S296 V299 | L66-I293 HydrophobicContact CD2-CB 3.92Å; L66-I293 HydrophobicContact CD2-CD1 4.13Å; L66-I293 HydrophobicContact CD2-CG2 3.78Å; Y285-I293 HydrophobicContact CD1-CD1 3.46Å; Y285-I293 VanDerWaalsContact CD1-CD1 3.46Å; Y285-I293 HydrophobicContact CE1-CD1 3.59Å; L288-I293 HydrophobicContact CB-CD1 4.04Å; L288-I293 HydrophobicContact CB-CG1 3.69Å; L288-I293 HydrophobicContact CD1-CG1 4.07Å; D289-I293 PolarHBondContact O-N 2.97Å; G290-I293 PolarHBondContact O-N 2.87Å; I293-S296 PolarHBondContact O-N 3.38Å; I293-V299 HydrophobicContact CG1-CG1 4.42Å; I293-V299 HydrophobicContact CG2-CG1 4.29Å; I293-V299 HydrophobicContact CG2-CG2 4.13Å |
| 294 | L | 91.6 | Very high | 91.2 | Very high | 72 Ų | 72 | 23.9 Ų | 23.9 | 38% | 0.377 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -69.7 | -33.8 | -178.7 | -67.1 | 174.1 | 0 | 0 | 0 | 112.5 | K63 L66 I67 G290 S291 | K63-L294 WeakPolarHBondContact CE-O 3.48Å; K63-L294 PolarHBondContact NZ-O 3.03Å; K63-L294 VanDerWaalsContact NZ-O 3.1Å; L66-L294 HydrophobicContact CB-CD2 4.38Å; L66-L294 HydrophobicContact CD2-CD2 4.42Å; L66-L294 HydrophobicContact CD2-CG 4.37Å; L66-L294 HydrophobicContact CG-CD2 4.34Å; I67-L294 HydrophobicContact CB-CD2 4.31Å; I67-L294 HydrophobicContact CD1-CD2 4.46Å; I67-L294 HydrophobicContact CG1-CD2 3.38Å; G290-L294 WeakPolarHBondContact O-CB 3.3Å; G290-L294 WeakPolarHBondContact O-CG 3.49Å; G290-L294 PolarHBondContact O-N 3.29Å; S291-L294 PolarHBondContact O-N 2.98Å |
| 295 | A | 89.4 | Confident | 90.9 | Very high | 63 Ų | 63 | 27.1 Ų | 27.1 | 52% | 0.521 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -77.1 | -21.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | S291 | S291-A295 VanDerWaalsContact O-CB 3.26Å; S291-A295 WeakPolarHBondContact O-CB 3.29Å; S291-A295 PolarHBondContact O-N 3.24Å |
| 296 | S | 88.5 | Confident | 90.7 | Very high | 9 Ų | 9 | 33.1 Ų | 33.1 | 6% | 0.063 | 20% | 0.2 | C | C | . | . | trans | -88.4 | 128.2 | -174.7 | -177.5 | 0 | 0 | 0 | 0 | 113 | K63 A292 I293 A298 V299 T302 | K63-S296 WeakPolarHBondContact CD-O 3.31Å; K63-S296 PolarHBondContact NZ-O 3.4Å; A292-S296 VanDerWaalsContact O-CB 3.31Å; A292-S296 WeakPolarHBondContact O-CB 3.25Å; A292-S296 PolarHBondContact O-N 3.49Å; I293-S296 PolarHBondContact O-N 3.38Å; S296-A298 VanDerWaalsContact C-N 3.3Å; S296-A298 PolarHBondContact OG-N 2.9Å; S296-A298 PolarHBondContact OG-O 2.78Å; S296-V299 PolarHBondContact OG-N 3.49Å; S296-T302 WeakPolarHBondContact CB-OG1 3.47Å; S296-T302 PolarHBondContact OG-OG1 3.1Å | ||
| 297 | D | 84.6 | Confident | 90.5 | Very high | 69 Ų | 69 | 34.4 Ų | 34.4 | 37% | 0.369 | 21% | 0.207 | S | C | . | . | S | Bend | trans | -83.8 | -7.3 | 169.4 | -72.2 | -23.9 | 0 | 0 | 0 | 113.5 | K63 | K63-D297 IonicContact NZ-OD1 2.69Å; K63-D297 PolarHBondContact NZ-OD1 3.45Å |
| 298 | A | 89.9 | Confident | 90.2 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 21% | 0.209 | C | C | . | . | S | Bend | trans | -140.5 | 72.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | Y145 Q148 S296 A300 V301 T302 | Y145-A298 HydrophobicContact CD1-CB 4.18Å; Y145-A298 HydrophobicContact CD2-CB 3.95Å; Y145-A298 HydrophobicContact CE1-CB 3.99Å; Y145-A298 HydrophobicContact CE2-CB 3.76Å; Y145-A298 HydrophobicContact CG-CB 4.18Å; Q148-A298 HydrophobicContact CB-CB 4.17Å; Q148-A298 HydrophobicContact CG-CB 4.16Å; S296-A298 VanDerWaalsContact C-N 3.3Å; S296-A298 PolarHBondContact OG-N 2.9Å; S296-A298 PolarHBondContact OG-O 2.78Å; A298-A300 PolarHBondContact O-N 2.98Å; A298-V301 HydrophobicContact CB-CB 4.11Å; A298-V301 HydrophobicContact CB-CG2 3.88Å; A298-V301 WeakPolarHBondContact O-CB 3.04Å; A298-V301 PolarHBondContact O-N 2.61Å; A298-T302 PolarHBondContact O-N 3.04Å |
| 299 | V | 91.7 | Very high | 90 | Very high | 2 Ų | 2 | 37.1 Ų | 37.1 | 1% | 0.012 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -51.9 | -38.2 | -171.7 | -178.8 | 0 | 0 | 0 | 0 | 112.6 | K63 Y145 Y284 L288 I293 S296 V301 T302 F303 | K63-V299 HydrophobicContact CB-CG2 4.3Å; Y145-V299 PolarHBondContact OH-N 3.32Å; Y284-V299 HydrophobicContact CD1-CG1 4.29Å; Y284-V299 HydrophobicContact CD2-CG1 3.98Å; Y284-V299 HydrophobicContact CE2-CG1 4.19Å; Y284-V299 HydrophobicContact CG-CG1 4.04Å; L288-V299 HydrophobicContact CD1-CG1 4.03Å; I293-V299 HydrophobicContact CG1-CG1 4.42Å; I293-V299 HydrophobicContact CG2-CG1 4.29Å; I293-V299 HydrophobicContact CG2-CG2 4.13Å; S296-V299 PolarHBondContact OG-N 3.49Å; V299-V301 PolarHBondContact O-N 3.45Å; V299-T302 PolarHBondContact O-N 3.17Å; V299-F303 WeakPolarHBondContact O-CB 3.24Å; V299-F303 PolarHBondContact O-N 3.03Å |
| 300 | A | 91.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -71 | -29.7 | -180 | 0 | 0 | 0 | 0 | 0 | 113.3 | F59 Y145 I201 Y284 A298 A304 I315 | F59-A300 HydrophobicContact CD1-CB 3.89Å; F59-A300 HydrophobicContact CE1-CB 4.23Å; Y145-A300 HydrophobicContact CE1-CB 3.86Å; Y145-A300 PolarHBondContact OH-N 2.85Å; I201-A300 HydrophobicContact CD1-CB 4.08Å; Y284-A300 HydrophobicContact CE1-CB 4.21Å; Y284-A300 WeakPolarHBondContact OH-CB 3.34Å; A298-A300 PolarHBondContact O-N 2.98Å; A300-A304 WeakPolarHBondContact O-CB 3.4Å; A300-A304 PolarHBondContact O-N 2.92Å; A300-I315 HydrophobicContact CB-CG2 3.75Å; A300-I315 WeakPolarHBondContact O-CG2 3.35Å |
| 301 | V | 90.8 | Very high | 89.4 | Confident | 2 Ų | 2 | 43.6 Ų | 43.6 | 1% | 0.012 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -69.2 | -47.4 | 173.9 | -179.7 | 0 | 0 | 0 | 0 | 109.2 | Y145 Q148 P149 A298 V299 F303 A304 D305 P316 | Y145-V301 HydrophobicContact CD1-CG2 3.56Å; Y145-V301 HydrophobicContact CE1-CG2 3.75Å; Y145-V301 HydrophobicContact CG-CG2 4.48Å; Q148-V301 HydrophobicContact CG-CB 4.4Å; Q148-V301 HydrophobicContact CG-CG1 4.09Å; P149-V301 HydrophobicContact CG-CG1 4.39Å; A298-V301 HydrophobicContact CB-CB 4.11Å; A298-V301 HydrophobicContact CB-CG2 3.88Å; A298-V301 WeakPolarHBondContact O-CB 3.04Å; A298-V301 PolarHBondContact O-N 2.61Å; V299-V301 PolarHBondContact O-N 3.45Å; V301-F303 VanDerWaalsContact C-N 3.29Å; V301-F303 PolarHBondContact O-N 3.29Å; V301-A304 WeakPolarHBondContact O-CA 3.41Å; V301-A304 WeakPolarHBondContact O-CB 3.43Å; V301-A304 PolarHBondContact O-N 3.44Å; V301-D305 PolarHBondContact O-N 3.05Å; V301-P316 HydrophobicContact CG2-CB 3.84Å; V301-P316 HydrophobicContact CG2-CG 4.43Å |
| 302 | T | 91 | Very high | 89.1 | Confident | 24 Ų | 24 | 42 Ų | 42 | 15% | 0.147 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.4 | -41.3 | 175.6 | -50.7 | 0 | 0 | 0 | 0 | 111.9 | L288 S296 A298 V299 A304 D305 H306 | L288-T302 HydrophobicContact CD1-CG2 4.35Å; L288-T302 HydrophobicContact CD2-CG2 3.96Å; S296-T302 WeakPolarHBondContact CB-OG1 3.47Å; S296-T302 PolarHBondContact OG-OG1 3.1Å; A298-T302 PolarHBondContact O-N 3.04Å; V299-T302 PolarHBondContact O-N 3.17Å; T302-A304 VanDerWaalsContact C-N 3.34Å; T302-A304 PolarHBondContact O-N 3.23Å; T302-D305 PolarHBondContact O-N 3.13Å; T302-H306 PolarHBondContact O-CD2 3.31Å; T302-H306 VanDerWaalsContact O-CD2 3.3Å; T302-H306 PolarHBondContact O-N 3.46Å |
| 303 | F | 93.2 | Very high | 88.8 | Confident | 1 Ų | 1 | 47.4 Ų | 47.4 | 0% | 0.004 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.6 | -44.7 | 172.6 | 175.7 | -89.1 | 0 | 0 | 0 | 112.1 | I201 T204 A283 Y284 V287 L288 V299 V301 H306 T307 | I201-F303 HydrophobicContact CB-CE1 4.24Å; I201-F303 HydrophobicContact CG1-CD1 4.21Å; I201-F303 HydrophobicContact CG1-CE1 4.19Å; I201-F303 HydrophobicContact CG2-CD1 4.24Å; I201-F303 HydrophobicContact CG2-CE1 3.96Å; I201-F303 HydrophobicContact CG2-CZ 4.16Å; T204-F303 HydrophobicContact CG2-CE1 4.06Å; T204-F303 HydrophobicContact CG2-CZ 3.87Å; A283-F303 HydrophobicContact CB-CE2 4.42Å; A283-F303 WeakPolarHBondContact O-CE2 3.11Å; Y284-F303 HydrophobicContact CD1-CB 3.9Å; Y284-F303 AromaticContact CD1-CD2 3.77Å; Y284-F303 HydrophobicContact CD1-CD2 3.77Å; Y284-F303 HydrophobicContact CD1-CE2 4.49Å; Y284-F303 AromaticContact CD1-CG 3.89Å; Y284-F303 HydrophobicContact CD1-CG 3.89Å; Y284-F303 HydrophobicContact CE1-CB 3.94Å; Y284-F303 HydrophobicContact CE1-CD2 4.37Å; Y284-F303 HydrophobicContact CE1-CG 4.04Å; V287-F303 HydrophobicContact CB-CD2 3.8Å; V287-F303 HydrophobicContact CB-CE2 3.69Å; V287-F303 HydrophobicContact CG1-CD2 3.96Å; V287-F303 HydrophobicContact CG1-CE2 4.13Å; V287-F303 HydrophobicContact CG2-CD2 4.1Å; V287-F303 HydrophobicContact CG2-CE2 3.45Å; V287-F303 VanDerWaalsContact CG2-CE2 3.45Å; V287-F303 HydrophobicContact CG2-CZ 4.25Å; L288-F303 HydrophobicContact CD1-CB 4.06Å; V299-F303 WeakPolarHBondContact O-CB 3.24Å; V299-F303 PolarHBondContact O-N 3.03Å; V301-F303 VanDerWaalsContact C-N 3.29Å; V301-F303 PolarHBondContact O-N 3.29Å; F303-H306 PolarHBondContact O-N 3Å; F303-T307 HydrophobicContact CE1-CG2 4.41Å; F303-T307 HydrophobicContact CE2-CG2 4.3Å; F303-T307 HydrophobicContact CZ-CG2 4.2Å; F303-T307 WeakPolarHBondContact O-CB 3.39Å; F303-T307 WeakPolarHBondContact O-CG2 3.27Å; F303-T307 PolarHBondContact O-N 2.91Å; F303-T307 PolarHBondContact O-OG1 3.42Å |
| 304 | A | 91.6 | Very high | 88.6 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -64.2 | -40.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A300 V301 T302 H306 T307 L308 N312 I315 | A300-A304 WeakPolarHBondContact O-CB 3.4Å; A300-A304 PolarHBondContact O-N 2.92Å; V301-A304 WeakPolarHBondContact O-CA 3.41Å; V301-A304 WeakPolarHBondContact O-CB 3.43Å; V301-A304 PolarHBondContact O-N 3.44Å; T302-A304 VanDerWaalsContact C-N 3.34Å; T302-A304 PolarHBondContact O-N 3.23Å; A304-H306 VanDerWaalsContact C-N 3.3Å; A304-H306 PolarHBondContact O-N 3.48Å; A304-T307 PolarHBondContact O-N 2.94Å; A304-T307 VanDerWaalsContact O-N 3.17Å; A304-L308 HydrophobicContact CB-CD1 4.08Å; A304-L308 PolarHBondContact O-N 3.25Å; A304-N312 HydrophobicContact CB-CB 4.24Å; A304-I315 HydrophobicContact CB-CB 3.89Å; A304-I315 HydrophobicContact CB-CG1 3.73Å; A304-I315 HydrophobicContact CB-CG2 4.41Å |
| 305 | D | 90.1 | Very high | 88.5 | Confident | 69 Ų | 69 | 46.7 Ų | 46.7 | 37% | 0.369 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.1 | -36.6 | 178.4 | -69.6 | -30.4 | 0 | 0 | 0 | 112.2 | V301 T302 T307 N312 | V301-D305 PolarHBondContact O-N 3.05Å; T302-D305 PolarHBondContact O-N 3.13Å; D305-T307 VanDerWaalsContact C-N 3.34Å; D305-T307 PolarHBondContact O-N 3.16Å; D305-N312 PolarHBondContact OD1-ND2 3.39Å |
| 306 | H | 89.2 | Confident | 88.5 | Confident | 126 Ų | 126 | 44 Ų | 44 | 58% | 0.583 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -76.6 | -14.8 | 176.7 | -83.6 | -106.3 | 0 | 0 | 0 | 114.4 | V287 L288 T302 F303 A304 | V287-H306 HydrophobicContact CG1-CB 3.91Å; L288-H306 HydrophobicContact CD2-CB 4.45Å; T302-H306 PolarHBondContact O-CD2 3.31Å; T302-H306 VanDerWaalsContact O-CD2 3.3Å; T302-H306 PolarHBondContact O-N 3.46Å; F303-H306 PolarHBondContact O-N 3Å; A304-H306 VanDerWaalsContact C-N 3.3Å; A304-H306 PolarHBondContact O-N 3.48Å |
| 307 | T | 91.2 | Very high | 88.5 | Confident | 31 Ų | 31 | 47.6 Ų | 47.6 | 19% | 0.19 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -129.8 | -42.1 | -166.3 | 57.9 | 0 | 0 | 0 | 0 | 115.8 | T204 V287 F303 A304 D305 | T204-T307 HydrophobicContact CG2-CG2 4Å; V287-T307 HydrophobicContact CB-CG2 4.31Å; V287-T307 HydrophobicContact CG1-CG2 3.46Å; V287-T307 VanDerWaalsContact CG1-CG2 3.46Å; V287-T307 HydrophobicContact CG2-CG2 3.89Å; F303-T307 HydrophobicContact CE1-CG2 4.41Å; F303-T307 HydrophobicContact CE2-CG2 4.3Å; F303-T307 HydrophobicContact CZ-CG2 4.2Å; F303-T307 WeakPolarHBondContact O-CB 3.39Å; F303-T307 WeakPolarHBondContact O-CG2 3.27Å; F303-T307 PolarHBondContact O-N 2.91Å; F303-T307 PolarHBondContact O-OG1 3.42Å; A304-T307 PolarHBondContact O-N 2.94Å; A304-T307 VanDerWaalsContact O-N 3.17Å; D305-T307 VanDerWaalsContact C-N 3.34Å; D305-T307 PolarHBondContact O-N 3.16Å |
| 308 | L | 86 | Confident | 88.6 | Confident | 36 Ų | 36 | 45 Ų | 45 | 19% | 0.188 | 24% | 0.241 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.3 | -7.1 | -167.6 | -62.6 | -176.9 | 0 | 0 | 0 | 113.5 | V200 T204 A304 V310 M311 I315 | V200-L308 HydrophobicContact CG1-CD1 4.16Å; V200-L308 HydrophobicContact CG1-CD2 4.27Å; T204-L308 HydrophobicContact CG2-CD2 4.31Å; A304-L308 HydrophobicContact CB-CD1 4.08Å; A304-L308 PolarHBondContact O-N 3.25Å; L308-V310 PolarHBondContact O-N 3.45Å; L308-V310 VanDerWaalsContact O-N 3.13Å; L308-M311 HydrophobicContact CB-CB 4.22Å; L308-M311 PolarHBondContact O-N 2.9Å; L308-I315 HydrophobicContact CD1-CD1 4.22Å; L308-I315 HydrophobicContact CD1-CG1 3.68Å |
| 309 | G | 86.6 | Confident | 88.6 | Confident | 47 Ų | 47 | 45 Ų | 45 | 49% | 0.485 | 24% | 0.241 | S | C | . | . | G | 310 helix | trans | 53.2 | -118.4 | 179 | 0 | 0 | 0 | 0 | 0 | 111.4 | M311 N312 | G309-M311 PolarHBondContact O-N 3.41Å; G309-M311 VanDerWaalsContact O-N 3.15Å; G309-N312 WeakPolarHBondContact O-CB 3.38Å; G309-N312 VanDerWaalsContact O-CG 3.27Å; G309-N312 PolarHBondContact O-N 3.26Å; G309-N312 VanDerWaalsContact O-N 3.13Å; G309-N312 PolarHBondContact O-OD1 2.84Å |
| 310 | V | 83.8 | Confident | 88.5 | Confident | 131 Ų | 131 | 45.1 Ų | 45.1 | 79% | 0.794 | 24% | 0.242 | S | C | * | . | G | 310 helix | trans | -63.2 | -20.3 | -179.2 | -174.1 | 0 | 0 | 0 | 0 | 113.2 | L308 W313 | L308-V310 PolarHBondContact O-N 3.45Å; L308-V310 VanDerWaalsContact O-N 3.13Å; V310-W313 PolarHBondContact O-NE1 2.91Å |
| 311 | M | 83 | Confident | 88.2 | Confident | 111 Ų | 111 | 48 Ų | 48 | 55% | 0.547 | 26% | 0.258 | S | S | . | . | G | 310 helix | trans | -92.2 | 7.9 | 179.5 | -65.6 | 179.4 | 68.6 | 0 | 0 | 113.3 | L308 G309 W313 I314 | L308-M311 HydrophobicContact CB-CB 4.22Å; L308-M311 PolarHBondContact O-N 2.9Å; G309-M311 PolarHBondContact O-N 3.41Å; G309-M311 VanDerWaalsContact O-N 3.15Å; M311-W313 PolarHBondContact O-N 3.38Å; M311-I314 HydrophobicContact CB-CD1 4.01Å; M311-I314 HydrophobicContact CE-CD1 3.46Å; M311-I314 VanDerWaalsContact CE-CD1 3.46Å; M311-I314 HydrophobicContact CG-CD1 4.33Å; M311-I314 WeakPolarHBondContact O-CB 3.48Å; M311-I314 PolarHBondContact O-N 3.06Å |
| 312 | N | 84.2 | Confident | 88 | Confident | 55 Ų | 55 | 48 Ų | 48 | 29% | 0.294 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -33.6 | -178.3 | 66.4 | -12.6 | 0 | 0 | 0 | 113.5 | A304 D305 G309 I314 I315 P316 | A304-N312 HydrophobicContact CB-CB 4.24Å; D305-N312 PolarHBondContact OD1-ND2 3.39Å; G309-N312 WeakPolarHBondContact O-CB 3.38Å; G309-N312 VanDerWaalsContact O-CG 3.27Å; G309-N312 PolarHBondContact O-N 3.26Å; G309-N312 VanDerWaalsContact O-N 3.13Å; G309-N312 PolarHBondContact O-OD1 2.84Å; N312-I314 PolarHBondContact O-N 3.42Å; N312-I314 VanDerWaalsContact O-N 3.15Å; N312-I315 PolarHBondContact O-N 3.21Å; N312-P316 WeakPolarHBondContact O-CD 3.31Å |
| 313 | W | 84.9 | Confident | 87.9 | Confident | 148 Ų | 148 | 46.9 Ų | 46.9 | 56% | 0.561 | 25% | 0.251 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -18 | -179.6 | 65.5 | -93.1 | 0 | 0 | 0 | 114.7 | V310 M311 P316 I317 | V310-W313 PolarHBondContact O-NE1 2.91Å; M311-W313 PolarHBondContact O-N 3.38Å; W313-P316 WeakPolarHBondContact O-CD 3.35Å; W313-P316 WeakPolarHBondContact O-CG 3.49Å; W313-I317 HydrophobicContact CE3-CD1 3.71Å; W313-I317 HydrophobicContact CZ3-CD1 4.1Å; W313-I317 WeakPolarHBondContact O-CG1 3.46Å |
| 314 | I | 87.3 | Confident | 87.7 | Confident | 57 Ų | 57 | 49 Ų | 49 | 29% | 0.292 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66.7 | -41.8 | -179.6 | -64.1 | 177.3 | 0 | 0 | 0 | 110.9 | M311 N312 A318 | M311-I314 HydrophobicContact CB-CD1 4.01Å; M311-I314 HydrophobicContact CE-CD1 3.46Å; M311-I314 VanDerWaalsContact CE-CD1 3.46Å; M311-I314 HydrophobicContact CG-CD1 4.33Å; M311-I314 WeakPolarHBondContact O-CB 3.48Å; M311-I314 PolarHBondContact O-N 3.06Å; N312-I314 PolarHBondContact O-N 3.42Å; N312-I314 VanDerWaalsContact O-N 3.15Å; I314-A318 VanDerWaalsContact O-CB 3.28Å; I314-A318 WeakPolarHBondContact O-CB 3.46Å; I314-A318 PolarHBondContact O-N 3.47Å |
| 315 | I | 89.3 | Confident | 87.3 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.9 | -53.7 | -176.4 | -61.2 | -60 | 0 | 0 | 0 | 112.8 | A197 V200 I201 A300 A304 L308 N312 I317 A318 V319 | A197-I315 HydrophobicContact CB-CD1 4.42Å; V200-I315 HydrophobicContact CG1-CD1 4.47Å; I201-I315 HydrophobicContact CD1-CD1 4.29Å; I201-I315 HydrophobicContact CG1-CD1 4.06Å; A300-I315 HydrophobicContact CB-CG2 3.75Å; A300-I315 WeakPolarHBondContact O-CG2 3.35Å; A304-I315 HydrophobicContact CB-CB 3.89Å; A304-I315 HydrophobicContact CB-CG1 3.73Å; A304-I315 HydrophobicContact CB-CG2 4.41Å; L308-I315 HydrophobicContact CD1-CD1 4.22Å; L308-I315 HydrophobicContact CD1-CG1 3.68Å; N312-I315 PolarHBondContact O-N 3.21Å; I315-I317 VanDerWaalsContact C-N 3.3Å; I315-I317 PolarHBondContact O-N 3.48Å; I315-A318 PolarHBondContact O-N 2.83Å; I315-V319 HydrophobicContact CG2-CG2 4.18Å; I315-V319 VanDerWaalsContact O-CG2 3.3Å; I315-V319 WeakPolarHBondContact O-CG2 3.36Å; I315-V319 PolarHBondContact O-N 3.11Å |
| 316 | P | 89.6 | Confident | 87 | Confident | 7 Ų | 7 | 47 Ų | 47 | 5% | 0.045 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59 | -40.6 | 179.7 | 19.7 | -29.8 | 0 | 0 | 0 | 112.5 | Y145 P149 V301 N312 W313 V319 A320 | Y145-P316 WeakPolarHBondContact O-CB 3.39Å; P149-P316 HydrophobicContact CG-CB 3.51Å; P149-P316 HydrophobicContact CG-CG 3.64Å; V301-P316 HydrophobicContact CG2-CB 3.84Å; V301-P316 HydrophobicContact CG2-CG 4.43Å; N312-P316 WeakPolarHBondContact O-CD 3.31Å; W313-P316 WeakPolarHBondContact O-CD 3.35Å; W313-P316 WeakPolarHBondContact O-CG 3.49Å; P316-V319 PolarHBondContact O-N 3.29Å; P316-A320 VanDerWaalsContact O-CB 3.23Å; P316-A320 WeakPolarHBondContact O-CB 3.29Å; P316-A320 PolarHBondContact O-N 3.05Å |
| 317 | I | 88.3 | Confident | 87 | Confident | 84 Ų | 84 | 41 Ų | 41 | 43% | 0.431 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.7 | -47.7 | 176.8 | -63.9 | -176.3 | 0 | 0 | 0 | 110.8 | W313 I315 V319 A320 L321 | W313-I317 HydrophobicContact CE3-CD1 3.71Å; W313-I317 HydrophobicContact CZ3-CD1 4.1Å; W313-I317 WeakPolarHBondContact O-CG1 3.46Å; I315-I317 VanDerWaalsContact C-N 3.3Å; I315-I317 PolarHBondContact O-N 3.48Å; I317-V319 VanDerWaalsContact C-N 3.33Å; I317-V319 PolarHBondContact O-N 2.92Å; I317-A320 PolarHBondContact O-N 2.81Å; I317-L321 HydrophobicContact CG2-CD1 3.95Å; I317-L321 HydrophobicContact CG2-CG 4.31Å; I317-L321 WeakPolarHBondContact O-CB 3.46Å; I317-L321 VanDerWaalsContact O-CG 3.26Å; I317-L321 WeakPolarHBondContact O-CG 3.4Å; I317-L321 PolarHBondContact O-N 2.99Å |
| 318 | A | 88.2 | Confident | 86.8 | Confident | 13 Ų | 13 | 39.8 Ų | 39.8 | 11% | 0.107 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.8 | -39.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A197 I314 I315 S322 | A197-A318 HydrophobicContact CB-CB 3.64Å; I314-A318 VanDerWaalsContact O-CB 3.28Å; I314-A318 WeakPolarHBondContact O-CB 3.46Å; I314-A318 PolarHBondContact O-N 3.47Å; I315-A318 PolarHBondContact O-N 2.83Å; A318-S322 WeakPolarHBondContact O-CB 3.27Å; A318-S322 PolarHBondContact O-N 3.29Å |
| 319 | V | 88.6 | Confident | 86.5 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -69.1 | -42.7 | 176.4 | 178 | 0 | 0 | 0 | 0 | 111.5 | F59 Y145 I315 P316 I317 L321 S322 C323 | F59-V319 HydrophobicContact CB-CG1 4.06Å; F59-V319 HydrophobicContact CD1-CG1 4.19Å; F59-V319 HydrophobicContact CD1-CG2 3.74Å; F59-V319 HydrophobicContact CD2-CB 4.41Å; F59-V319 HydrophobicContact CD2-CG1 3.53Å; F59-V319 HydrophobicContact CD2-CG2 4.13Å; F59-V319 HydrophobicContact CE1-CG2 3.51Å; F59-V319 HydrophobicContact CE2-CB 4.43Å; F59-V319 HydrophobicContact CE2-CG1 3.99Å; F59-V319 HydrophobicContact CE2-CG2 3.92Å; F59-V319 HydrophobicContact CG-CG1 3.64Å; F59-V319 HydrophobicContact CG-CG2 4.05Å; F59-V319 HydrophobicContact CZ-CG2 3.61Å; Y145-V319 HydrophobicContact CD1-CB 3.49Å; Y145-V319 VanDerWaalsContact CD1-CB 3.49Å; Y145-V319 HydrophobicContact CD1-CG1 3.34Å; Y145-V319 HydrophobicContact CD1-CG2 3.96Å; Y145-V319 HydrophobicContact CD2-CG1 3.9Å; Y145-V319 HydrophobicContact CE1-CB 3.89Å; Y145-V319 HydrophobicContact CE1-CG1 3.6Å; Y145-V319 HydrophobicContact CE1-CG2 3.88Å; Y145-V319 HydrophobicContact CE2-CG1 4.13Å; Y145-V319 HydrophobicContact CG-CB 4.02Å; Y145-V319 HydrophobicContact CG-CG1 3.49Å; Y145-V319 VanDerWaalsContact CG-CG1 3.49Å; I315-V319 HydrophobicContact CG2-CG2 4.18Å; I315-V319 VanDerWaalsContact O-CG2 3.3Å; I315-V319 WeakPolarHBondContact O-CG2 3.36Å; I315-V319 PolarHBondContact O-N 3.11Å; P316-V319 PolarHBondContact O-N 3.29Å; I317-V319 VanDerWaalsContact C-N 3.33Å; I317-V319 PolarHBondContact O-N 2.92Å; V319-L321 PolarHBondContact O-N 3.46Å; V319-S322 VanDerWaalsContact O-CB 3.27Å; V319-S322 WeakPolarHBondContact O-CB 3.36Å; V319-S322 PolarHBondContact O-N 3.45Å; V319-S322 VanDerWaalsContact O-N 3.16Å; V319-C323 PolarHBondContact O-N 2.98Å; V319-C323 PolarHBondContact O-SG 2.95Å |
| 320 | A | 89.5 | Confident | 86.5 | Confident | 5 Ų | 5 | 37.6 Ų | 37.6 | 4% | 0.041 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.4 | -45.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | F142 P316 I317 S322 C323 Y324 | F142-A320 HydrophobicContact CD2-CB 3.97Å; F142-A320 VanDerWaalsContact CD2-O 3.28Å; F142-A320 WeakPolarHBondContact CD2-O 3.36Å; F142-A320 HydrophobicContact CE2-CB 4Å; P316-A320 VanDerWaalsContact O-CB 3.23Å; P316-A320 WeakPolarHBondContact O-CB 3.29Å; P316-A320 PolarHBondContact O-N 3.05Å; I317-A320 PolarHBondContact O-N 2.81Å; A320-S322 VanDerWaalsContact C-N 3.3Å; A320-S322 PolarHBondContact O-N 2.74Å; A320-C323 PolarHBondContact O-N 2.93Å; A320-Y324 WeakPolarHBondContact O-CB 3.48Å; A320-Y324 PolarHBondContact O-N 3.44Å |
| 321 | L | 86.2 | Confident | 86.7 | Confident | 62 Ų | 62 | 31.3 Ų | 31.3 | 33% | 0.325 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -62.2 | -37.1 | 175.1 | -67.1 | 176.8 | 0 | 0 | 0 | 112.3 | F190 I317 V319 Y324 G325 | F190-L321 HydrophobicContact CD1-CB 4.02Å; F190-L321 HydrophobicContact CD1-CD1 4.31Å; F190-L321 HydrophobicContact CD1-CD2 4.41Å; F190-L321 HydrophobicContact CD1-CG 4.48Å; F190-L321 HydrophobicContact CE1-CB 4.25Å; F190-L321 HydrophobicContact CE1-CD1 4.09Å; F190-L321 HydrophobicContact CE1-CD2 3.78Å; F190-L321 HydrophobicContact CE1-CG 4.26Å; F190-L321 HydrophobicContact CE2-CD2 4.29Å; F190-L321 HydrophobicContact CG-CB 4.23Å; F190-L321 HydrophobicContact CZ-CD2 3.72Å; I317-L321 HydrophobicContact CG2-CD1 3.95Å; I317-L321 HydrophobicContact CG2-CG 4.31Å; I317-L321 WeakPolarHBondContact O-CB 3.46Å; I317-L321 VanDerWaalsContact O-CG 3.26Å; I317-L321 WeakPolarHBondContact O-CG 3.4Å; I317-L321 PolarHBondContact O-N 2.99Å; V319-L321 PolarHBondContact O-N 3.46Å; L321-Y324 PolarHBondContact O-N 2.92Å; L321-G325 PolarHBondContact O-N 3.19Å |
| 322 | S | 86.6 | Confident | 86.7 | Confident | 2 Ų | 2 | 27 Ų | 27 | 1% | 0.014 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -60.2 | -49.4 | 173.2 | -174.5 | 0 | 0 | 0 | 0 | 111.8 | K194 A318 V319 A320 Y324 G325 G326 | K194-S322 WeakPolarHBondContact CD-OG 3.43Å; A318-S322 WeakPolarHBondContact O-CB 3.27Å; A318-S322 PolarHBondContact O-N 3.29Å; V319-S322 VanDerWaalsContact O-CB 3.27Å; V319-S322 WeakPolarHBondContact O-CB 3.36Å; V319-S322 PolarHBondContact O-N 3.45Å; V319-S322 VanDerWaalsContact O-N 3.16Å; A320-S322 VanDerWaalsContact C-N 3.3Å; A320-S322 PolarHBondContact O-N 2.74Å; S322-Y324 PolarHBondContact O-N 3.17Å; S322-G325 PolarHBondContact O-N 2.95Å; S322-G326 PolarHBondContact O-N 3.03Å |
| 323 | C | 89.2 | Confident | 86.5 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64.7 | -40.4 | 179.7 | -61.4 | 0 | 0 | 0 | 0 | 111.2 | S56 I138 F142 V319 A320 G325 G326 L327 | S56-C323 VanDerWaalsContact CB-SG 3.53Å; I138-C323 HydrophobicContact CG2-CB 4.04Å; I138-C323 WeakPolarHBondContact CG2-O 3.24Å; F142-C323 HydrophobicContact CB-CB 3.66Å; F142-C323 HydrophobicContact CD2-CB 4.42Å; V319-C323 PolarHBondContact O-N 2.98Å; V319-C323 PolarHBondContact O-SG 2.95Å; A320-C323 PolarHBondContact O-N 2.93Å; C323-G325 PolarHBondContact O-N 3.45Å; C323-G326 PolarHBondContact O-N 3.01Å; C323-L327 VanDerWaalsContact O-CB 3.26Å; C323-L327 WeakPolarHBondContact O-CB 3.4Å; C323-L327 PolarHBondContact O-N 3.48Å |
| 324 | Y | 88.1 | Confident | 86.5 | Confident | 45 Ų | 45 | 19.7 Ų | 19.7 | 18% | 0.176 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -59.9 | -45.9 | 175 | -174.3 | -86.4 | 0 | 0 | 0 | 111.8 | F142 L172 I175 V186 F190 A320 L321 S322 N328 | F142-Y324 HydrophobicContact CE2-CD2 4.42Å; L172-Y324 HydrophobicContact CD1-CD2 4.16Å; L172-Y324 HydrophobicContact CD1-CE2 4.14Å; L172-Y324 HydrophobicContact CD2-CD1 4.29Å; L172-Y324 HydrophobicContact CD2-CD2 4.37Å; L172-Y324 HydrophobicContact CD2-CE1 3.61Å; L172-Y324 HydrophobicContact CD2-CE2 3.7Å; L172-Y324 WeakPolarHBondContact CD2-OH 3.3Å; L172-Y324 HydrophobicContact CG-CD2 4.34Å; L172-Y324 HydrophobicContact CG-CE2 3.81Å; I175-Y324 WeakPolarHBondContact CD1-OH 3.39Å; V186-Y324 HydrophobicContact CG1-CE1 4.16Å; F190-Y324 HydrophobicContact CD2-CD1 4.44Å; F190-Y324 AromaticContact CE2-CD1 3.84Å; F190-Y324 HydrophobicContact CE2-CD1 3.84Å; F190-Y324 HydrophobicContact CE2-CE1 4.37Å; A320-Y324 WeakPolarHBondContact O-CB 3.48Å; A320-Y324 PolarHBondContact O-N 3.44Å; L321-Y324 PolarHBondContact O-N 2.92Å; S322-Y324 PolarHBondContact O-N 3.17Å; Y324-N328 WeakPolarHBondContact O-CB 3.49Å; Y324-N328 PolarHBondContact O-N 3.34Å |
| 325 | G | 83.2 | Confident | 86.3 | Confident | 6 Ų | 6 | 17.4 Ų | 17.4 | 6% | 0.062 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.2 | -44.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | L321 S322 C323 N328 A329 | L321-G325 PolarHBondContact O-N 3.19Å; S322-G325 PolarHBondContact O-N 2.95Å; C323-G325 PolarHBondContact O-N 3.45Å; G325-N328 PolarHBondContact O-N 2.99Å; G325-A329 PolarHBondContact O-N 3.29Å |
| 326 | G | 83.7 | Confident | 85.8 | Confident | 22 Ų | 22 | 24 Ų | 24 | 23% | 0.227 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -64.2 | -41.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | S322 C323 A329 S330 | S322-G326 PolarHBondContact O-N 3.03Å; C323-G326 PolarHBondContact O-N 3.01Å; G326-A329 PolarHBondContact O-N 3.4Å; G326-S330 WeakPolarHBondContact O-CB 3.22Å; G326-S330 PolarHBondContact O-N 2.67Å |
| 327 | L | 89.1 | Confident | 85.4 | Confident | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -63.6 | -44.2 | 176.8 | -177.3 | 55.1 | 0 | 0 | 0 | 111.3 | Q135 I138 A139 I169 L172 C323 A329 S330 I331 | Q135-L327 HydrophobicContact CB-CD1 3.66Å; Q135-L327 HydrophobicContact CG-CD1 3.88Å; I138-L327 HydrophobicContact CG2-CB 3.78Å; A139-L327 HydrophobicContact CB-CD2 3.91Å; I169-L327 HydrophobicContact CG1-CD1 4.33Å; I169-L327 HydrophobicContact CG1-CD2 3.86Å; L172-L327 HydrophobicContact CD1-CB 3.82Å; L172-L327 HydrophobicContact CD1-CD2 3.62Å; L172-L327 HydrophobicContact CD1-CG 3.58Å; C323-L327 VanDerWaalsContact O-CB 3.26Å; C323-L327 WeakPolarHBondContact O-CB 3.4Å; C323-L327 PolarHBondContact O-N 3.48Å; L327-A329 PolarHBondContact O-N 2.95Å; L327-S330 PolarHBondContact O-N 3.44Å; L327-I331 HydrophobicContact CD1-CD1 4.13Å; L327-I331 HydrophobicContact CD1-CG1 4.36Å; L327-I331 HydrophobicContact CG-CD1 4.03Å; L327-I331 VanDerWaalsContact O-CG1 3.31Å; L327-I331 WeakPolarHBondContact O-CG1 3.29Å; L327-I331 PolarHBondContact O-N 2.8Å |
| 328 | N | 86.6 | Confident | 85.1 | Confident | 4 Ų | 4 | 20.2 Ų | 20.2 | 2% | 0.021 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -59.9 | -45.2 | 175.5 | -175.6 | 69.9 | 0 | 0 | 0 | 112 | L172 N176 G183 Y324 G325 S330 I331 I332 | L172-N328 HydrophobicContact CD1-CB 4.32Å; L172-N328 HydrophobicContact CD2-CB 3.86Å; N176-N328 PolarHBondContact ND2-OD1 3.11Å; N176-N328 PolarHBondContact OD1-OD1 2.78Å; G183-N328 PolarHBondContact O-ND2 2.99Å; G183-N328 VanDerWaalsContact O-ND2 3.15Å; Y324-N328 WeakPolarHBondContact O-CB 3.49Å; Y324-N328 PolarHBondContact O-N 3.34Å; G325-N328 PolarHBondContact O-N 2.99Å; N328-S330 PolarHBondContact O-N 2.78Å; N328-I331 PolarHBondContact O-N 2.95Å; N328-I332 WeakPolarHBondContact O-CG1 3.36Å; N328-I332 PolarHBondContact O-N 2.98Å; N328-I332 VanDerWaalsContact O-N 3.11Å |
| 329 | A | 80.8 | Confident | 84.4 | Confident | 20 Ų | 20 | 21.4 Ų | 21.4 | 17% | 0.165 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.5 | -43.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | G325 G326 L327 I332 A333 | G325-A329 PolarHBondContact O-N 3.29Å; G326-A329 PolarHBondContact O-N 3.4Å; L327-A329 PolarHBondContact O-N 2.95Å; A329-I332 PolarHBondContact O-N 3.47Å; A329-A333 WeakPolarHBondContact O-CB 3.34Å; A329-A333 PolarHBondContact O-N 3.01Å |
| 330 | S | 86.2 | Confident | 83.8 | Confident | 17 Ų | 17 | 23.2 Ų | 23.2 | 12% | 0.119 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.8 | -44.1 | 177.8 | 179.4 | 0 | 0 | 0 | 0 | 112.2 | Q135 G326 L327 N328 I332 A333 A334 | Q135-S330 WeakPolarHBondContact CG-OG 3.24Å; Q135-S330 PolarHBondContact NE2-OG 3.09Å; G326-S330 WeakPolarHBondContact O-CB 3.22Å; G326-S330 PolarHBondContact O-N 2.67Å; L327-S330 PolarHBondContact O-N 3.44Å; N328-S330 PolarHBondContact O-N 2.78Å; S330-I332 VanDerWaalsContact C-N 3.33Å; S330-I332 PolarHBondContact O-N 3.03Å; S330-A333 PolarHBondContact O-N 3.14Å; S330-A334 WeakPolarHBondContact O-CB 3.44Å; S330-A334 PolarHBondContact O-N 3.49Å |
| 331 | I | 88.6 | Confident | 83.3 | Confident | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -59.6 | -43.9 | 176.7 | -71.5 | 167.4 | 0 | 0 | 0 | 111.1 | Q135 L172 L327 N328 S335 L365 | Q135-I331 HydrophobicContact CG-CG1 4.48Å; L172-I331 HydrophobicContact CB-CD1 3.8Å; L172-I331 HydrophobicContact CD1-CD1 4.45Å; L327-I331 HydrophobicContact CD1-CD1 4.13Å; L327-I331 HydrophobicContact CD1-CG1 4.36Å; L327-I331 HydrophobicContact CG-CD1 4.03Å; L327-I331 VanDerWaalsContact O-CG1 3.31Å; L327-I331 WeakPolarHBondContact O-CG1 3.29Å; L327-I331 PolarHBondContact O-N 2.8Å; N328-I331 PolarHBondContact O-N 2.95Å; I331-S335 PolarHBondContact O-N 3.02Å; I331-S335 VanDerWaalsContact O-N 3.14Å; I331-L365 HydrophobicContact CG2-CD2 3.44Å; I331-L365 VanDerWaalsContact CG2-CD2 3.44Å |
| 332 | I | 82.3 | Confident | 83 | Confident | 19 Ų | 19 | 20.2 Ų | 20.2 | 10% | 0.097 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -64.5 | -46.1 | 176.6 | -66.4 | 169.3 | 0 | 0 | 0 | 110.6 | N176 N328 A329 S330 S335 R336 | N176-I332 WeakPolarHBondContact OD1-CD1 3.48Å; N176-I332 WeakPolarHBondContact OD1-CG1 3.44Å; N328-I332 WeakPolarHBondContact O-CG1 3.36Å; N328-I332 PolarHBondContact O-N 2.98Å; N328-I332 VanDerWaalsContact O-N 3.11Å; A329-I332 PolarHBondContact O-N 3.47Å; S330-I332 VanDerWaalsContact C-N 3.33Å; S330-I332 PolarHBondContact O-N 3.03Å; I332-S335 PolarHBondContact O-N 2.91Å; I332-S335 PolarHBondContact O-OG 2.96Å; I332-R336 PolarHBondContact O-N 2.7Å |
| 333 | A | 80.6 | Confident | 82.4 | Confident | 51 Ų | 51 | 25.6 Ų | 25.6 | 42% | 0.421 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -61 | -46.6 | -180 | 0 | 0 | 0 | 0 | 0 | 112.1 | A329 S330 S335 R336 L337 | A329-A333 WeakPolarHBondContact O-CB 3.34Å; A329-A333 PolarHBondContact O-N 3.01Å; S330-A333 PolarHBondContact O-N 3.14Å; A333-S335 PolarHBondContact O-N 3.18Å; A333-R336 PolarHBondContact O-N 3.42Å; A333-L337 PolarHBondContact O-N 3.23Å |
| 334 | A | 85.4 | Confident | 82 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59 | -45.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | E131 S330 R336 L337 F338 | E131-A334 HydrophobicContact CB-CB 3.87Å; E131-A334 HydrophobicContact CG-CB 3.86Å; S330-A334 WeakPolarHBondContact O-CB 3.44Å; S330-A334 PolarHBondContact O-N 3.49Å; A334-R336 VanDerWaalsContact C-N 3.29Å; A334-R336 PolarHBondContact O-N 3.22Å; A334-L337 PolarHBondContact O-N 3.4Å; A334-F338 HydrophobicContact CB-CE2 4.36Å; A334-F338 HydrophobicContact CB-CZ 4.17Å; A334-F338 WeakPolarHBondContact O-CD1 3.34Å; A334-F338 WeakPolarHBondContact O-CG 3.17Å; A334-F338 PolarHBondContact O-N 3.3Å |
| 335 | S | 82.4 | Confident | 81.7 | Confident | 8 Ų | 8 | 30.7 Ų | 30.7 | 6% | 0.056 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.5 | -36.8 | 177.9 | 73 | 0 | 0 | 0 | 0 | 113.2 | I331 I332 A333 F338 F339 | I331-S335 PolarHBondContact O-N 3.02Å; I331-S335 VanDerWaalsContact O-N 3.14Å; I332-S335 PolarHBondContact O-N 2.91Å; I332-S335 PolarHBondContact O-OG 2.96Å; A333-S335 PolarHBondContact O-N 3.18Å; S335-F338 PolarHBondContact O-N 3.03Å; S335-F339 WeakPolarHBondContact O-CB 3.32Å; S335-F339 PolarHBondContact O-N 2.81Å |
| 336 | R | 77.6 | Confident | 81.7 | Confident | 140 Ų | 140 | 31.2 Ų | 31.2 | 53% | 0.528 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -69 | -41.2 | 176.3 | -70.4 | 178.8 | 179.8 | -168.3 | -0.6 | 111.8 | I332 A333 A334 F338 F339 V340 | I332-R336 PolarHBondContact O-N 2.7Å; A333-R336 PolarHBondContact O-N 3.42Å; A334-R336 VanDerWaalsContact C-N 3.29Å; A334-R336 PolarHBondContact O-N 3.22Å; R336-F338 VanDerWaalsContact C-N 3.31Å; R336-F338 PolarHBondContact O-N 3.41Å; R336-F339 PolarHBondContact O-N 2.75Å; R336-V340 WeakPolarHBondContact O-CG2 3.42Å; R336-V340 PolarHBondContact O-N 2.8Å |
| 337 | L | 81.5 | Confident | 81.8 | Confident | 11 Ų | 11 | 30.7 Ų | 30.7 | 6% | 0.058 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60.3 | -43.2 | 176.2 | 179.7 | 62.9 | 0 | 0 | 0 | 111.1 | L123 A333 A334 V340 G341 | L123-L337 HydrophobicContact CD1-CD1 3.99Å; L123-L337 HydrophobicContact CD1-CD2 4.38Å; L123-L337 HydrophobicContact CD1-CG 3.83Å; A333-L337 PolarHBondContact O-N 3.23Å; A334-L337 PolarHBondContact O-N 3.4Å; L337-V340 PolarHBondContact O-N 2.8Å; L337-G341 PolarHBondContact O-N 3.49Å |
| 338 | F | 82.5 | Confident | 81.5 | Confident | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -68 | -38.6 | 179.6 | -57.2 | -14.3 | 0 | 0 | 0 | 111.8 | L127 E131 A334 S335 R336 G341 S342 L347 A364 F367 N368 | L127-F338 HydrophobicContact CB-CD1 4.24Å; L127-F338 HydrophobicContact CB-CE1 3.59Å; L127-F338 HydrophobicContact CB-CZ 3.98Å; L127-F338 HydrophobicContact CD1-CD1 3.87Å; L127-F338 HydrophobicContact CD1-CD2 4.43Å; L127-F338 HydrophobicContact CD1-CE1 3.96Å; L127-F338 HydrophobicContact CD1-CE2 4.47Å; L127-F338 HydrophobicContact CD1-CG 4.15Å; L127-F338 HydrophobicContact CD1-CZ 4.27Å; L127-F338 HydrophobicContact CG-CD1 4.27Å; L127-F338 HydrophobicContact CG-CE1 3.83Å; L127-F338 HydrophobicContact CG-CE2 4.36Å; L127-F338 HydrophobicContact CG-CZ 3.88Å; E131-F338 HydrophobicContact CG-CE1 4.39Å; E131-F338 HydrophobicContact CG-CZ 4.34Å; A334-F338 HydrophobicContact CB-CE2 4.36Å; A334-F338 HydrophobicContact CB-CZ 4.17Å; A334-F338 WeakPolarHBondContact O-CD1 3.34Å; A334-F338 WeakPolarHBondContact O-CG 3.17Å; A334-F338 PolarHBondContact O-N 3.3Å; S335-F338 PolarHBondContact O-N 3.03Å; R336-F338 VanDerWaalsContact C-N 3.31Å; R336-F338 PolarHBondContact O-N 3.41Å; F338-G341 PolarHBondContact O-N 2.92Å; F338-S342 PolarHBondContact O-N 3.39Å; F338-L347 HydrophobicContact CB-CD1 4.41Å; F338-A364 HydrophobicContact CB-CB 4.22Å; F338-A364 HydrophobicContact CD2-CB 4.18Å; F338-F367 HydrophobicContact CE2-CD1 4.26Å; F338-N368 HydrophobicContact CE2-CB 3.98Å |
| 339 | F | 74.4 | Confident | 81.2 | Confident | 37 Ų | 37 | 36.7 Ų | 36.7 | 16% | 0.162 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.7 | -48 | 173.7 | -179.5 | -95.9 | 0 | 0 | 0 | 112.1 | S335 R336 S342 R343 S352 I354 T495 | S335-F339 WeakPolarHBondContact O-CB 3.32Å; S335-F339 PolarHBondContact O-N 2.81Å; R336-F339 PolarHBondContact O-N 2.75Å; F339-S342 PolarHBondContact O-N 2.75Å; F339-R343 VanDerWaalsContact CE1-CD 3.41Å; F339-R343 HydrophobicContact CE1-CG 4.18Å; F339-R343 HydrophobicContact CZ-CG 4.33Å; F339-R343 PolarHBondContact O-N 2.91Å; F339-S352 WeakPolarHBondContact CD2-O 3.25Å; F339-S352 WeakPolarHBondContact CE2-O 3.42Å; F339-I354 HydrophobicContact CD2-CD1 4.47Å; F339-I354 HydrophobicContact CE2-CD1 3.76Å; F339-I354 HydrophobicContact CE2-CG1 4.03Å; F339-I354 HydrophobicContact CZ-CD1 4.21Å; F339-T495 HydrophobicContact CE2-CG2 3.74Å; F339-T495 HydrophobicContact CZ-CG2 3.79Å |
| 340 | V | 75.1 | Confident | 81.2 | Confident | 39 Ų | 39 | 35.9 Ų | 35.9 | 24% | 0.236 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.6 | -43.8 | 176.9 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | Y107 R336 L337 S342 R343 E344 | Y107-V340 HydrophobicContact CE1-CG1 4.4Å; R336-V340 WeakPolarHBondContact O-CG2 3.42Å; R336-V340 PolarHBondContact O-N 2.8Å; L337-V340 PolarHBondContact O-N 2.8Å; V340-S342 VanDerWaalsContact C-N 3.28Å; V340-S342 PolarHBondContact O-N 3.11Å; V340-R343 PolarHBondContact O-N 3.39Å; V340-R343 VanDerWaalsContact O-N 3.14Å; V340-E344 PolarHBondContact O-N 2.95Å; V340-E344 VanDerWaalsContact O-N 3.15Å |
| 341 | G | 79.9 | Confident | 81 | Confident | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60 | -36.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | L123 L337 F338 H346 L347 | L123-G341 VanDerWaalsContact CD2-CA 3.48Å; L337-G341 PolarHBondContact O-N 3.49Å; F338-G341 PolarHBondContact O-N 2.92Å; G341-H346 WeakPolarHBondContact O-CB 3.27Å; G341-H346 PolarHBondContact O-N 3.5Å; G341-H346 VanDerWaalsContact O-N 3.12Å; G341-L347 PolarHBondContact O-N 2.91Å |
| 342 | S | 79 | Confident | 80.5 | Confident | 4 Ų | 4 | 36.3 Ų | 36.3 | 3% | 0.028 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -74.2 | -35 | 174.5 | 173.6 | 0 | 0 | 0 | 0 | 112.5 | F338 F339 V340 E344 G345 L347 P348 S352 | F338-S342 PolarHBondContact O-N 3.39Å; F339-S342 PolarHBondContact O-N 2.75Å; V340-S342 VanDerWaalsContact C-N 3.28Å; V340-S342 PolarHBondContact O-N 3.11Å; S342-E344 VanDerWaalsContact C-N 3.25Å; S342-E344 PolarHBondContact O-N 3.32Å; S342-G345 PolarHBondContact O-N 3.41Å; S342-L347 PolarHBondContact OG-O 2.92Å; S342-P348 PolarHBondContact OG-O 3.3Å; S342-S352 WeakPolarHBondContact OG-CB 3.41Å; S342-S352 PolarHBondContact OG-OG 3.15Å |
| 343 | R | 74.9 | Confident | 80.5 | Confident | 115 Ų | 115 | 35.4 Ų | 35.4 | 43% | 0.434 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -60.8 | -32.7 | 173.6 | -75.9 | -174.5 | 67.6 | 168.1 | 7 | 113.5 | F339 V340 G345 D498 | F339-R343 VanDerWaalsContact CE1-CD 3.41Å; F339-R343 HydrophobicContact CE1-CG 4.18Å; F339-R343 HydrophobicContact CZ-CG 4.33Å; F339-R343 PolarHBondContact O-N 2.91Å; V340-R343 PolarHBondContact O-N 3.39Å; V340-R343 VanDerWaalsContact O-N 3.14Å; R343-G345 PolarHBondContact O-N 3.02Å; R343-D498 IonicContact CZ-OD2 2.67Å; R343-D498 IonicContact NH2-OD2 2.7Å; R343-D498 PolarHBondContact NH2-OD2 3.29Å |
| 344 | E | 80.8 | Confident | 80.7 | Confident | 108 Ų | 108 | 34.7 Ų | 34.7 | 51% | 0.505 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | 4.9 | 174.5 | -66.3 | -69.4 | 151.3 | 0 | 0 | 113 | Y107 V340 S342 H346 | Y107-E344 HydrophobicContact CE1-CG 4.12Å; Y107-E344 VanDerWaalsContact OH-CB 3.3Å; Y107-E344 WeakPolarHBondContact OH-CB 3.44Å; V340-E344 PolarHBondContact O-N 2.95Å; V340-E344 VanDerWaalsContact O-N 3.15Å; S342-E344 VanDerWaalsContact C-N 3.25Å; S342-E344 PolarHBondContact O-N 3.32Å; E344-H346 PolarHBondContact O-N 3.41Å |
| 345 | G | 81.1 | Confident | 80.8 | Confident | 44 Ų | 44 | 35.7 Ų | 35.7 | 45% | 0.454 | 18% | 0.181 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 72.1 | 10.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | S342 R343 | S342-G345 PolarHBondContact O-N 3.41Å; R343-G345 PolarHBondContact O-N 3.02Å |
| 346 | H | 84.1 | Confident | 80.8 | Confident | 17 Ų | 17 | 39.7 Ų | 39.7 | 8% | 0.079 | 20% | 0.201 | C | C | . | . | S | Bend | trans | -87.6 | -21 | -179 | -75.3 | 174.5 | 0 | 0 | 0 | 113.2 | Y107 G116 F120 L123 G341 E344 | Y107-H346 AromaticContact CE2-ND1 3.78Å; Y107-H346 AromaticContact CZ-ND1 3.72Å; Y107-H346 PolarHBondContact OH-CE1 3.4Å; Y107-H346 PolarHBondContact OH-ND1 3.43Å; G116-H346 PolarHBondContact O-CE1 2.91Å; F120-H346 HydrophobicContact CD2-CB 4.01Å; F120-H346 WeakPolarHBondContact CD2-O 3.23Å; F120-H346 WeakPolarHBondContact CE2-O 3.27Å; L123-H346 HydrophobicContact CD2-CB 3.95Å; G341-H346 WeakPolarHBondContact O-CB 3.27Å; G341-H346 PolarHBondContact O-N 3.5Å; G341-H346 VanDerWaalsContact O-N 3.12Å; E344-H346 PolarHBondContact O-N 3.41Å |
| 347 | L | 84.4 | Confident | 81.1 | Confident | 10 Ų | 10 | 40.8 Ų | 40.8 | 5% | 0.052 | 21% | 0.212 | C | C | . | . | S | Bend | trans | -122.3 | 153.7 | 176.1 | -70.2 | 172.3 | 0 | 0 | 0 | 111.1 | L123 L127 F338 G341 S342 D349 L351 | L123-L347 HydrophobicContact CD1-CD1 4.27Å; L123-L347 HydrophobicContact CD2-CD1 3.75Å; L123-L347 HydrophobicContact CD2-CD2 4.41Å; L123-L347 HydrophobicContact CD2-CG 3.73Å; L123-L347 HydrophobicContact CG-CD1 4.05Å; L123-L347 HydrophobicContact CG-CG 4.35Å; L127-L347 HydrophobicContact CD1-CD1 3.92Å; L127-L347 HydrophobicContact CD1-CD2 3.96Å; F338-L347 HydrophobicContact CB-CD1 4.41Å; G341-L347 PolarHBondContact O-N 2.91Å; S342-L347 PolarHBondContact OG-O 2.92Å; L347-D349 PolarHBondContact O-N 3.44Å; L347-L351 HydrophobicContact CB-CD1 4.47Å |
| 348 | P | 82.7 | Confident | 81 | Confident | 54 Ų | 54 | 45.9 Ų | 45.9 | 35% | 0.351 | 23% | 0.23 | S | C | . | . | trans | -54.1 | 139.7 | 175.7 | -25.5 | 34.4 | 0 | 0 | 0 | 112.5 | S342 A350 L351 L479 | S342-P348 PolarHBondContact OG-O 3.3Å; P348-A350 PolarHBondContact O-N 3.02Å; P348-L351 PolarHBondContact O-N 2.87Å; P348-L479 HydrophobicContact CB-CD2 4.04Å; P348-L479 HydrophobicContact CG-CD2 4.04Å | ||
| 349 | D | 80.1 | Confident | 81 | Confident | 76 Ų | 76 | 53.7 Ų | 53.7 | 41% | 0.406 | 26% | 0.264 | S | S | . | . | G | 310 helix | trans | -57.1 | -25 | -178.6 | -58.5 | -26.2 | 0 | 0 | 0 | 113.6 | L347 L351 S352 M353 L494 | L347-D349 PolarHBondContact O-N 3.44Å; D349-L351 PolarHBondContact O-N 3.35Å; D349-S352 PolarHBondContact O-N 3.31Å; D349-S352 VanDerWaalsContact O-N 3.11Å; D349-S352 PolarHBondContact O-OG 3.48Å; D349-M353 WeakPolarHBondContact O-CG 3.22Å; D349-M353 PolarHBondContact O-N 2.92Å; D349-L494 HydrophobicContact CB-CD1 3.84Å; D349-L494 HydrophobicContact CB-CD2 4.08Å; D349-L494 HydrophobicContact CB-CG 4.33Å |
| 350 | A | 81.5 | Confident | 81.4 | Confident | 3 Ų | 3 | 51.9 Ų | 51.9 | 3% | 0.025 | 26% | 0.257 | C | S | . | . | G | 310 helix | trans | -54.8 | -32.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113 | P348 M353 P363 L482 | P348-A350 PolarHBondContact O-N 3.02Å; A350-M353 HydrophobicContact CB-CE 4.48Å; A350-P363 VanDerWaalsContact O-CB 3.22Å; A350-P363 WeakPolarHBondContact O-CB 3.45Å; A350-P363 WeakPolarHBondContact O-CG 3.49Å; A350-L482 HydrophobicContact CB-CD2 4.06Å; A350-L482 HydrophobicContact CB-CG 4.37Å |
| 351 | L | 81.5 | Confident | 82 | Confident | 23 Ų | 23 | 51.1 Ų | 51.1 | 12% | 0.12 | 25% | 0.252 | C | S | . | . | G | 310 helix | trans | -83.5 | -14.9 | -179 | -64.7 | 176.8 | 0 | 0 | 0 | 113.7 | L127 L347 P348 D349 F367 | L127-L351 HydrophobicContact CD1-CD1 4.23Å; L347-L351 HydrophobicContact CB-CD1 4.47Å; P348-L351 PolarHBondContact O-N 2.87Å; D349-L351 PolarHBondContact O-N 3.35Å; L351-F367 HydrophobicContact CD2-CB 4.02Å; L351-F367 HydrophobicContact CD2-CG 4.29Å |
| 352 | S | 78.3 | Confident | 82.4 | Confident | 4 Ų | 4 | 52 Ų | 52 | 3% | 0.028 | 26% | 0.257 | C | S | . | . | G | 310 helix | trans | -93.4 | -2.2 | 171.6 | 48.7 | 0 | 0 | 0 | 0 | 113.9 | F339 S342 D349 | F339-S352 WeakPolarHBondContact CD2-O 3.25Å; F339-S352 WeakPolarHBondContact CE2-O 3.42Å; S342-S352 WeakPolarHBondContact OG-CB 3.41Å; S342-S352 PolarHBondContact OG-OG 3.15Å; D349-S352 PolarHBondContact O-N 3.31Å; D349-S352 VanDerWaalsContact O-N 3.11Å; D349-S352 PolarHBondContact O-OG 3.48Å |
| 353 | M | 83.5 | Confident | 82.8 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 26% | 0.26 | C | S | . | . | trans | -69.7 | 145.8 | -177.3 | -56.4 | -178.3 | 177.8 | 0 | 0 | 112.5 | D349 A350 P363 T483 T486 Q487 C492 V493 L494 | D349-M353 WeakPolarHBondContact O-CG 3.22Å; D349-M353 PolarHBondContact O-N 2.92Å; A350-M353 HydrophobicContact CB-CE 4.48Å; M353-P363 HydrophobicContact CB-CG 4.37Å; M353-T483 HydrophobicContact CE-CG2 3.25Å; M353-T486 HydrophobicContact SD-CG2 3.97Å; M353-Q487 HydrophobicContact CE-CG 3.68Å; M353-Q487 HydrophobicContact SD-CG 3.61Å; M353-C492 HydrophobicContact CB-CB 3.67Å; M353-C492 HydrophobicContact SD-CB 4.42Å; M353-V493 WeakPolarHBondContact CA-O 3.48Å; M353-L494 HydrophobicContact CE-CD1 3.68Å; M353-L494 HydrophobicContact CG-CD1 4.02Å | ||
| 354 | I | 84.8 | Confident | 83.4 | Confident | 35 Ų | 35 | 47 Ų | 47 | 18% | 0.179 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 139.3 | -179.4 | -61 | -171.4 | 0 | 0 | 0 | 109.9 | F339 F359 C492 V493 T495 | F339-I354 HydrophobicContact CD2-CD1 4.47Å; F339-I354 HydrophobicContact CE2-CD1 3.76Å; F339-I354 HydrophobicContact CE2-CG1 4.03Å; F339-I354 HydrophobicContact CZ-CD1 4.21Å; I354-F359 VanDerWaalsContact CG2-CA 3.4Å; I354-F359 HydrophobicContact CG2-CB 4.34Å; I354-C492 CarbonylContact O-C 3.38Å; I354-C492 VanDerWaalsContact O-CA 3.25Å; I354-C492 WeakPolarHBondContact O-CA 3.49Å; I354-V493 PolarHBondContact N-O 3.4Å; I354-V493 PolarHBondContact O-N 3.22Å; I354-T495 HydrophobicContact CB-CG2 4.39Å; I354-T495 HydrophobicContact CD1-CG2 3.27Å; I354-T495 HydrophobicContact CG1-CG2 3.74Å |
| 355 | H | 86.1 | Confident | 83.9 | Confident | 21 Ų | 21 | 42 Ų | 42 | 10% | 0.097 | 22% | 0.216 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -67.2 | 131.7 | 176.7 | -176 | -67.5 | 0 | 0 | 0 | 112.1 | Q357 R358 F359 T360 I362 C490 | H355-Q357 PolarHBondContact ND1-N 2.76Å; H355-Q357 VanDerWaalsContact ND1-N 3.14Å; H355-Q357 PolarHBondContact O-N 2.87Å; H355-R358 HydrophobicContact CB-CB 4.29Å; H355-R358 PolarHBondContact ND1-N 2.92Å; H355-R358 PolarHBondContact O-N 2.97Å; H355-F359 WeakPolarHBondContact O-CA 3.49Å; H355-F359 PolarHBondContact O-N 3.38Å; H355-T360 PolarHBondContact N-O 3.45Å; H355-I362 HydrophobicContact CB-CD1 3.72Å; H355-I362 HydrophobicContact CB-CG1 4.14Å; H355-I362 VanDerWaalsContact CD2-CD1 3.42Å; H355-I362 WeakPolarHBondContact CD2-CD1 3.4Å; H355-C490 PolarHBondContact CD2-O 3.17Å |
| 356 | I | 84 | Confident | 84.4 | Confident | 92 Ų | 92 | 43.3 Ų | 43.3 | 47% | 0.472 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -46.1 | -170 | -61.5 | 161.3 | 0 | 0 | 0 | 113.3 | F491 V493 | I356-F491 WeakPolarHBondContact CG1-O 3.43Å; I356-F491 PolarHBondContact N-O 3.3Å; I356-V493 HydrophobicContact CD1-CG1 3.92Å; I356-V493 HydrophobicContact CG1-CB 4.46Å; I356-V493 HydrophobicContact CG1-CG1 3.74Å; I356-V493 HydrophobicContact CG1-CG2 3.97Å |
| 357 | Q | 83.6 | Confident | 84.7 | Confident | 163 Ų | 163 | 45.5 Ų | 45.5 | 76% | 0.762 | 22% | 0.221 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -90.2 | -26.2 | -176.2 | -60.5 | 177.2 | -4.9 | 0 | 0 | 114.5 | H355 | H355-Q357 PolarHBondContact ND1-N 2.76Å; H355-Q357 VanDerWaalsContact ND1-N 3.14Å; H355-Q357 PolarHBondContact O-N 2.87Å |
| 358 | R | 79.6 | Confident | 85.1 | Confident | 119 Ų | 119 | 45 Ų | 45 | 45% | 0.449 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104.5 | -16.9 | -167.7 | -61 | 175.4 | -173.8 | -108 | 8.9 | 112.4 | A178 H355 T360 | A178-R358 WeakPolarHBondContact O-CD 3.21Å; A178-R358 PolarHBondContact O-NH1 3.38Å; H355-R358 HydrophobicContact CB-CB 4.29Å; H355-R358 PolarHBondContact ND1-N 2.92Å; H355-R358 PolarHBondContact O-N 2.97Å; R358-T360 HydrophobicContact CB-CG2 4.07Å; R358-T360 WeakPolarHBondContact O-CG2 3.44Å; R358-T360 PolarHBondContact O-N 2.87Å |
| 359 | F | 82.3 | Confident | 85.7 | Confident | 163 Ų | 163 | 43 Ų | 43 | 72% | 0.715 | 21% | 0.206 | S | C | * | . | trans | 55.7 | 37.2 | -177.6 | -56.4 | -84.3 | 0 | 0 | 0 | 112.8 | I354 H355 | I354-F359 VanDerWaalsContact CG2-CA 3.4Å; I354-F359 HydrophobicContact CG2-CB 4.34Å; H355-F359 WeakPolarHBondContact O-CA 3.49Å; H355-F359 PolarHBondContact O-N 3.38Å | ||
| 360 | T | 82.8 | Confident | 86.4 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 21% | 0.209 | C | C | . | . | trans | -115.3 | 141.9 | -178.3 | 59.3 | 0 | 0 | 0 | 0 | 112 | S177 V180 H355 R358 I362 | S177-T360 PolarHBondContact O-OG1 2.92Å; V180-T360 HydrophobicContact CG2-CG2 3.36Å; H355-T360 PolarHBondContact N-O 3.45Å; R358-T360 HydrophobicContact CB-CG2 4.07Å; R358-T360 WeakPolarHBondContact O-CG2 3.44Å; R358-T360 PolarHBondContact O-N 2.87Å; T360-I362 VanDerWaalsContact C-N 3.29Å; T360-I362 PolarHBondContact O-N 3.46Å; T360-I362 WeakPolarHBondContact OG1-CG1 3.36Å | ||
| 361 | P | 86.6 | Confident | 87 | Confident | 22 Ų | 22 | 45 Ų | 45 | 14% | 0.143 | 21% | 0.214 | C | C | . | . | trans | -83.3 | 68.9 | 179.3 | 34.8 | -36.2 | 0 | 0 | 0 | 111.4 | P363 A364 L365 | P361-P363 VanDerWaalsContact C-CD 3.5Å; P361-A364 HydrophobicContact CB-CB 4.35Å; P361-A364 PolarHBondContact O-N 3.22Å; P361-L365 WeakPolarHBondContact O-CG 3.33Å; P361-L365 PolarHBondContact O-N 2.73Å | ||
| 362 | I | 87.9 | Confident | 87.7 | Confident | 20 Ų | 20 | 43.9 Ų | 43.9 | 10% | 0.103 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -55 | -45.1 | -174.6 | -60.5 | -177.7 | 0 | 0 | 0 | 113.3 | H355 T360 A364 L365 I366 C490 | H355-I362 HydrophobicContact CB-CD1 3.72Å; H355-I362 HydrophobicContact CB-CG1 4.14Å; H355-I362 VanDerWaalsContact CD2-CD1 3.42Å; H355-I362 WeakPolarHBondContact CD2-CD1 3.4Å; T360-I362 VanDerWaalsContact C-N 3.29Å; T360-I362 PolarHBondContact O-N 3.46Å; T360-I362 WeakPolarHBondContact OG1-CG1 3.36Å; I362-A364 VanDerWaalsContact C-N 3.34Å; I362-A364 PolarHBondContact O-N 3.13Å; I362-L365 WeakPolarHBondContact O-CB 3.25Å; I362-L365 PolarHBondContact O-N 3.34Å; I362-I366 HydrophobicContact CG2-CD1 3.57Å; I362-I366 HydrophobicContact CG2-CG1 4.09Å; I362-I366 WeakPolarHBondContact O-CG1 3.34Å; I362-I366 PolarHBondContact O-N 3.19Å; I362-C490 HydrophobicContact CG2-CB 4.34Å |
| 363 | P | 88.6 | Confident | 88.6 | Confident | 12 Ų | 12 | 46.3 Ų | 46.3 | 8% | 0.078 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.8 | -39.3 | -176.6 | -24.1 | 36.8 | 0 | 0 | 0 | 113 | A350 M353 P361 I366 F367 T486 | A350-P363 VanDerWaalsContact O-CB 3.22Å; A350-P363 WeakPolarHBondContact O-CB 3.45Å; A350-P363 WeakPolarHBondContact O-CG 3.49Å; M353-P363 HydrophobicContact CB-CG 4.37Å; P361-P363 VanDerWaalsContact C-CD 3.5Å; P363-I366 PolarHBondContact O-N 2.76Å; P363-F367 WeakPolarHBondContact O-CB 3.23Å; P363-F367 PolarHBondContact O-N 3.4Å; P363-T486 HydrophobicContact CB-CG2 3.68Å; P363-T486 HydrophobicContact CG-CG2 3.23Å |
| 364 | A | 87.8 | Confident | 89.2 | Confident | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64 | -41.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | F338 P361 I362 F367 N368 | F338-A364 HydrophobicContact CB-CB 4.22Å; F338-A364 HydrophobicContact CD2-CB 4.18Å; P361-A364 HydrophobicContact CB-CB 4.35Å; P361-A364 PolarHBondContact O-N 3.22Å; I362-A364 VanDerWaalsContact C-N 3.34Å; I362-A364 PolarHBondContact O-N 3.13Å; A364-F367 PolarHBondContact O-N 2.74Å; A364-N368 VanDerWaalsContact O-CB 3.3Å; A364-N368 WeakPolarHBondContact O-CB 3.28Å; A364-N368 PolarHBondContact O-N 3.27Å |
| 365 | L | 90.1 | Very high | 89.6 | Confident | 3 Ų | 3 | 50.1 Ų | 50.1 | 2% | 0.016 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.7 | -44.6 | 176.8 | -69.6 | 170.4 | 0 | 0 | 0 | 111.8 | T173 N176 I331 P361 I362 N368 C369 | T173-L365 HydrophobicContact CG2-CB 4.12Å; N176-L365 HydrophobicContact CB-CD1 4.09Å; N176-L365 HydrophobicContact CB-CD2 4.24Å; I331-L365 HydrophobicContact CG2-CD2 3.44Å; I331-L365 VanDerWaalsContact CG2-CD2 3.44Å; P361-L365 WeakPolarHBondContact O-CG 3.33Å; P361-L365 PolarHBondContact O-N 2.73Å; I362-L365 WeakPolarHBondContact O-CB 3.25Å; I362-L365 PolarHBondContact O-N 3.34Å; L365-N368 PolarHBondContact O-N 2.91Å; L365-C369 VanDerWaalsContact O-CB 3.29Å; L365-C369 WeakPolarHBondContact O-CB 3.35Å; L365-C369 PolarHBondContact O-N 2.97Å |
| 366 | I | 91.8 | Very high | 90 | Very high | 73 Ų | 73 | 49.6 Ų | 49.6 | 37% | 0.374 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.7 | -46.1 | 177.5 | -68.4 | 173.4 | 0 | 0 | 0 | 110.6 | I362 P363 N368 C369 I370 | I362-I366 HydrophobicContact CG2-CD1 3.57Å; I362-I366 HydrophobicContact CG2-CG1 4.09Å; I362-I366 WeakPolarHBondContact O-CG1 3.34Å; I362-I366 PolarHBondContact O-N 3.19Å; P363-I366 PolarHBondContact O-N 2.76Å; I366-N368 VanDerWaalsContact C-N 3.35Å; I366-N368 PolarHBondContact O-N 3.35Å; I366-C369 WeakPolarHBondContact O-CB 3.49Å; I366-C369 PolarHBondContact O-N 3.1Å; I366-I370 HydrophobicContact CG2-CD1 3.79Å; I366-I370 HydrophobicContact CG2-CG1 4.4Å; I366-I370 WeakPolarHBondContact O-CG1 3.4Å; I366-I370 PolarHBondContact O-N 3.35Å |
| 367 | F | 91.3 | Very high | 90.4 | Very high | 62 Ų | 62 | 50.2 Ų | 50.2 | 27% | 0.272 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -57.5 | -49.4 | 177.8 | 177.9 | -88.1 | 0 | 0 | 0 | 111.4 | L127 L128 F338 L351 P363 A364 C369 I370 M371 | L127-F367 HydrophobicContact CD1-CE1 4.12Å; L127-F367 HydrophobicContact CD2-CD1 4.27Å; L127-F367 HydrophobicContact CD2-CE1 3.18Å; L127-F367 HydrophobicContact CD2-CE2 4.48Å; L127-F367 HydrophobicContact CD2-CZ 3.32Å; L127-F367 HydrophobicContact CG-CD1 4.22Å; L127-F367 HydrophobicContact CG-CE1 3.48Å; L127-F367 VanDerWaalsContact CG-CE1 3.48Å; L127-F367 HydrophobicContact CG-CZ 4.14Å; L128-F367 HydrophobicContact CD2-CZ 4.16Å; F338-F367 HydrophobicContact CE2-CD1 4.26Å; L351-F367 HydrophobicContact CD2-CB 4.02Å; L351-F367 HydrophobicContact CD2-CG 4.29Å; P363-F367 WeakPolarHBondContact O-CB 3.23Å; P363-F367 PolarHBondContact O-N 3.4Å; A364-F367 PolarHBondContact O-N 2.74Å; F367-C369 VanDerWaalsContact C-N 3.32Å; F367-C369 PolarHBondContact O-N 3.39Å; F367-I370 PolarHBondContact O-N 3.42Å; F367-M371 HydrophobicContact CD1-CG 4.19Å; F367-M371 HydrophobicContact CE1-CG 3.53Å; F367-M371 HydrophobicContact CE2-CG 4.3Å; F367-M371 HydrophobicContact CZ-CG 3.61Å; F367-M371 HydrophobicContact CZ-SD 4.05Å; F367-M371 WeakPolarHBondContact O-CG 3.33Å; F367-M371 PolarHBondContact O-N 3.45Å |
| 368 | N | 92.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.6 | -39.8 | 178.6 | -172.1 | 47.7 | 0 | 0 | 0 | 112.5 | Q135 F338 A364 L365 I366 M371 S372 | Q135-N368 PolarHBondContact NE2-ND2 3.34Å; Q135-N368 PolarHBondContact NE2-OD1 3.26Å; Q135-N368 VanDerWaalsContact NE2-OD1 3.13Å; Q135-N368 PolarHBondContact OE1-ND2 3.24Å; Q135-N368 PolarHBondContact OE1-OD1 2.71Å; F338-N368 HydrophobicContact CE2-CB 3.98Å; A364-N368 VanDerWaalsContact O-CB 3.3Å; A364-N368 WeakPolarHBondContact O-CB 3.28Å; A364-N368 PolarHBondContact O-N 3.27Å; L365-N368 PolarHBondContact O-N 2.91Å; I366-N368 VanDerWaalsContact C-N 3.35Å; I366-N368 PolarHBondContact O-N 3.35Å; N368-M371 PolarHBondContact O-N 2.88Å; N368-S372 WeakPolarHBondContact O-CB 3.34Å; N368-S372 PolarHBondContact O-N 2.9Å; N368-S372 PolarHBondContact O-OG 3.49Å |
| 369 | C | 94.9 | Very high | 91.2 | Very high | 13 Ų | 13 | 45.4 Ų | 45.4 | 9% | 0.088 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.7 | -50.1 | 175.4 | 178.3 | 0 | 0 | 0 | 0 | 111.3 | I169 T173 L365 I366 F367 M371 S372 L373 | I169-C369 HydrophobicContact CG2-CB 4.48Å; T173-C369 HydrophobicContact CG2-CB 3.7Å; T173-C369 WeakPolarHBondContact OG1-CB 3.42Å; L365-C369 VanDerWaalsContact O-CB 3.29Å; L365-C369 WeakPolarHBondContact O-CB 3.35Å; L365-C369 PolarHBondContact O-N 2.97Å; I366-C369 WeakPolarHBondContact O-CB 3.49Å; I366-C369 PolarHBondContact O-N 3.1Å; F367-C369 VanDerWaalsContact C-N 3.32Å; F367-C369 PolarHBondContact O-N 3.39Å; C369-M371 VanDerWaalsContact C-N 3.33Å; C369-M371 PolarHBondContact O-N 3.22Å; C369-S372 PolarHBondContact O-N 3.45Å; C369-S372 VanDerWaalsContact O-N 3.16Å; C369-L373 VanDerWaalsContact O-CG 3.31Å; C369-L373 WeakPolarHBondContact O-CG 3.19Å; C369-L373 PolarHBondContact O-N 3.46Å |
| 370 | I | 95.6 | Very high | 91.5 | Very high | 92 Ų | 92 | 41.1 Ų | 41.1 | 47% | 0.472 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -58 | -47.1 | 178 | -67.8 | 167.3 | 0 | 0 | 0 | 110.5 | I366 F367 S372 L373 I374 | I366-I370 HydrophobicContact CG2-CD1 3.79Å; I366-I370 HydrophobicContact CG2-CG1 4.4Å; I366-I370 WeakPolarHBondContact O-CG1 3.4Å; I366-I370 PolarHBondContact O-N 3.35Å; F367-I370 PolarHBondContact O-N 3.42Å; I370-S372 VanDerWaalsContact C-N 3.34Å; I370-S372 PolarHBondContact O-N 3.42Å; I370-L373 PolarHBondContact O-N 2.89Å; I370-I374 HydrophobicContact CG2-CD1 4.19Å; I370-I374 WeakPolarHBondContact O-CG1 3.35Å; I370-I374 PolarHBondContact O-N 3.23Å |
| 371 | M | 94.8 | Very high | 91.9 | Very high | 27 Ų | 27 | 42 Ų | 42 | 13% | 0.133 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.8 | -43.2 | 177.5 | -71.3 | -58.8 | -57.6 | 0 | 0 | 112 | L128 P132 F367 N368 C369 L373 I374 Y375 | L128-M371 HydrophobicContact CD2-CE 3.75Å; L128-M371 HydrophobicContact CD2-SD 4.16Å; P132-M371 HydrophobicContact CB-CB 3.71Å; P132-M371 HydrophobicContact CG-CB 3.55Å; P132-M371 HydrophobicContact CG-CG 4.39Å; F367-M371 HydrophobicContact CD1-CG 4.19Å; F367-M371 HydrophobicContact CE1-CG 3.53Å; F367-M371 HydrophobicContact CE2-CG 4.3Å; F367-M371 HydrophobicContact CZ-CG 3.61Å; F367-M371 HydrophobicContact CZ-SD 4.05Å; F367-M371 WeakPolarHBondContact O-CG 3.33Å; F367-M371 PolarHBondContact O-N 3.45Å; N368-M371 PolarHBondContact O-N 2.88Å; C369-M371 VanDerWaalsContact C-N 3.33Å; C369-M371 PolarHBondContact O-N 3.22Å; M371-L373 VanDerWaalsContact C-N 3.34Å; M371-L373 PolarHBondContact O-N 3.14Å; M371-I374 WeakPolarHBondContact O-CB 3.45Å; M371-I374 PolarHBondContact O-N 3.17Å; M371-I374 VanDerWaalsContact O-N 3.17Å; M371-I374 HydrophobicContact SD-CD1 4.22Å; M371-Y375 HydrophobicContact CE-CE2 4.1Å; M371-Y375 VanDerWaalsContact O-CD2 3.32Å; M371-Y375 WeakPolarHBondContact O-CD2 3.43Å; M371-Y375 PolarHBondContact O-N 3.06Å; M371-Y375 VanDerWaalsContact O-N 3.13Å |
| 372 | S | 95.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.3 | -39.3 | 178.7 | -58.7 | 0 | 0 | 0 | 0 | 111.8 | Q135 N368 C369 I370 I374 Y375 L376 | Q135-S372 PolarHBondContact OE1-OG 2.73Å; Q135-S372 VanDerWaalsContact OE1-OG 3.05Å; N368-S372 WeakPolarHBondContact O-CB 3.34Å; N368-S372 PolarHBondContact O-N 2.9Å; N368-S372 PolarHBondContact O-OG 3.49Å; C369-S372 PolarHBondContact O-N 3.45Å; C369-S372 VanDerWaalsContact O-N 3.16Å; I370-S372 VanDerWaalsContact C-N 3.34Å; I370-S372 PolarHBondContact O-N 3.42Å; S372-I374 VanDerWaalsContact C-N 3.31Å; S372-I374 PolarHBondContact O-N 3.13Å; S372-Y375 PolarHBondContact O-N 3.5Å; S372-L376 WeakPolarHBondContact O-CG 3.27Å; S372-L376 PolarHBondContact O-N 3.49Å |
| 373 | L | 96.6 | Very high | 92.3 | Very high | 56 Ų | 56 | 43.6 Ų | 43.6 | 29% | 0.293 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.5 | -34.8 | 174 | -67.7 | 176.1 | 0 | 0 | 0 | 112.4 | A166 C369 I370 M371 L376 | A166-L373 HydrophobicContact CB-CD2 3.7Å; C369-L373 VanDerWaalsContact O-CG 3.31Å; C369-L373 WeakPolarHBondContact O-CG 3.19Å; C369-L373 PolarHBondContact O-N 3.46Å; I370-L373 PolarHBondContact O-N 2.89Å; M371-L373 VanDerWaalsContact C-N 3.34Å; M371-L373 PolarHBondContact O-N 3.14Å; L373-L376 HydrophobicContact CD2-CD1 3.86Å; L373-L376 WeakPolarHBondContact O-CB 3.31Å; L373-L376 PolarHBondContact O-N 3.13Å |
| 374 | I | 95.8 | Very high | 92.5 | Very high | 90 Ų | 90 | 43 Ų | 43 | 46% | 0.462 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -63.4 | -46.2 | 173.3 | -67.5 | 165.8 | 0 | 0 | 0 | 110 | I370 M371 S372 L376 T377 | I370-I374 HydrophobicContact CG2-CD1 4.19Å; I370-I374 WeakPolarHBondContact O-CG1 3.35Å; I370-I374 PolarHBondContact O-N 3.23Å; M371-I374 WeakPolarHBondContact O-CB 3.45Å; M371-I374 PolarHBondContact O-N 3.17Å; M371-I374 VanDerWaalsContact O-N 3.17Å; M371-I374 HydrophobicContact SD-CD1 4.22Å; S372-I374 VanDerWaalsContact C-N 3.31Å; S372-I374 PolarHBondContact O-N 3.13Å; I374-L376 VanDerWaalsContact C-N 3.26Å; I374-L376 PolarHBondContact O-N 3.42Å; I374-T377 WeakPolarHBondContact O-CB 3.39Å; I374-T377 WeakPolarHBondContact O-CG2 3.24Å; I374-T377 PolarHBondContact O-N 3Å; I374-T377 PolarHBondContact O-OG1 3.47Å |
| 375 | Y | 94.8 | Very high | 92.7 | Very high | 25 Ų | 25 | 43 Ų | 43 | 10% | 0.098 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -67.9 | -22.3 | 178.1 | -79 | -76.3 | 0 | 0 | 0 | 114 | L128 P132 T133 M371 S372 T377 V378 L384 | L128-Y375 WeakPolarHBondContact O-CE2 3.14Å; L128-Y375 PolarHBondContact O-OH 3.35Å; P132-Y375 HydrophobicContact CB-CD2 3.63Å; P132-Y375 HydrophobicContact CB-CE2 3.88Å; T133-Y375 WeakPolarHBondContact OG1-CE1 3.47Å; M371-Y375 HydrophobicContact CE-CE2 4.1Å; M371-Y375 VanDerWaalsContact O-CD2 3.32Å; M371-Y375 WeakPolarHBondContact O-CD2 3.43Å; M371-Y375 PolarHBondContact O-N 3.06Å; M371-Y375 VanDerWaalsContact O-N 3.13Å; S372-Y375 PolarHBondContact O-N 3.5Å; Y375-T377 PolarHBondContact O-N 2.84Å; Y375-V378 HydrophobicContact CD1-CG2 4.42Å; Y375-V378 WeakPolarHBondContact O-CB 3.05Å; Y375-V378 PolarHBondContact O-N 3.32Å; Y375-V378 VanDerWaalsContact O-N 3.1Å; Y375-L384 HydrophobicContact CD1-CD2 3.58Å; Y375-L384 HydrophobicContact CG-CD2 4.22Å |
| 376 | L | 94.4 | Very high | 92.8 | Very high | 10 Ų | 10 | 43.3 Ų | 43.3 | 5% | 0.052 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -16.1 | 170 | -69.5 | 179.5 | 0 | 0 | 0 | 113.5 | A136 I140 R162 A165 A166 I169 S372 L373 I374 V378 | A136-L376 HydrophobicContact CB-CD2 4.06Å; I140-L376 HydrophobicContact CD1-CD2 4.02Å; I140-L376 HydrophobicContact CG1-CD2 3.67Å; R162-L376 PolarHBondContact NH1-O 3.34Å; A165-L376 HydrophobicContact CB-CD1 4.34Å; A165-L376 HydrophobicContact CB-CD2 4Å; A166-L376 HydrophobicContact CB-CD1 3.75Å; I169-L376 HydrophobicContact CD1-CD1 3.87Å; I169-L376 HydrophobicContact CD1-CD2 4.31Å; I169-L376 HydrophobicContact CD1-CG 4.21Å; S372-L376 WeakPolarHBondContact O-CG 3.27Å; S372-L376 PolarHBondContact O-N 3.49Å; L373-L376 HydrophobicContact CD2-CD1 3.86Å; L373-L376 WeakPolarHBondContact O-CB 3.31Å; L373-L376 PolarHBondContact O-N 3.13Å; I374-L376 VanDerWaalsContact C-N 3.26Å; I374-L376 PolarHBondContact O-N 3.42Å; L376-V378 PolarHBondContact O-N 2.83Å |
| 377 | T | 92.1 | Very high | 92.7 | Very high | 105 Ų | 105 | 41.1 Ų | 41.1 | 64% | 0.644 | 21% | 0.209 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | -17 | 174.4 | 67.9 | 0 | 0 | 0 | 0 | 112.9 | I374 Y375 E379 | I374-T377 WeakPolarHBondContact O-CB 3.39Å; I374-T377 WeakPolarHBondContact O-CG2 3.24Å; I374-T377 PolarHBondContact O-N 3Å; I374-T377 PolarHBondContact O-OG1 3.47Å; Y375-T377 PolarHBondContact O-N 2.84Å; T377-E379 PolarHBondContact O-N 3.36Å |
| 378 | V | 91.8 | Very high | 92.7 | Very high | 28 Ų | 28 | 38.8 Ų | 38.8 | 17% | 0.17 | 20% | 0.199 | C | C | . | . | trans | -73.7 | 119 | 176 | -178.4 | 0 | 0 | 0 | 0 | 109.4 | R162 Y375 L376 Q383 L384 | R162-V378 PolarHBondContact NH1-O 2.76Å; R162-V378 PolarHBondContact NH2-O 3.49Å; Y375-V378 HydrophobicContact CD1-CG2 4.42Å; Y375-V378 WeakPolarHBondContact O-CB 3.05Å; Y375-V378 PolarHBondContact O-N 3.32Å; Y375-V378 VanDerWaalsContact O-N 3.1Å; L376-V378 PolarHBondContact O-N 2.83Å; V378-Q383 HydrophobicContact CG1-CB 4.29Å; V378-Q383 HydrophobicContact CG1-CG 4.45Å; V378-L384 HydrophobicContact CB-CD1 4.48Å; V378-L384 HydrophobicContact CB-CD2 3.77Å; V378-L384 HydrophobicContact CB-CG 4.1Å; V378-L384 HydrophobicContact CG1-CD2 4.01Å; V378-L384 HydrophobicContact CG1-CG 4.05Å; V378-L384 HydrophobicContact CG2-CD2 3.86Å | ||
| 379 | E | 86.8 | Confident | 92.8 | Very high | 152 Ų | 152 | 38.8 Ų | 38.8 | 71% | 0.71 | 20% | 0.199 | S | C | * | . | S | Bend | trans | -66.4 | -41.4 | -173.5 | -65 | -174.7 | 173.2 | 0 | 0 | 113 | Y158 R162 T377 | Y158-E379 HydrophobicContact CE2-CB 4.37Å; Y158-E379 HydrophobicContact CE2-CG 4.43Å; Y158-E379 WeakPolarHBondContact OH-CA 3.29Å; R162-E379 PolarHBondContact NH2-O 3.47Å; T377-E379 PolarHBondContact O-N 3.36Å |
| 380 | D | 89.8 | Confident | 92.7 | Very high | 73 Ų | 73 | 38.8 Ų | 38.8 | 39% | 0.39 | 20% | 0.198 | S | C | . | . | trans | -92.8 | 122.8 | -177.8 | -176.1 | 10.1 | 0 | 0 | 0 | 112.4 | F382 Q383 L384 | D380-F382 VanDerWaalsContact C-N 3.32Å; D380-F382 WeakPolarHBondContact OD1-CD2 3.31Å; D380-F382 PolarHBondContact OD1-N 2.89Å; D380-Q383 HydrophobicContact CB-CB 3.99Å; D380-Q383 WeakPolarHBondContact O-CB 3.16Å; D380-Q383 PolarHBondContact O-N 2.83Å; D380-Q383 PolarHBondContact OD2-N 2.92Å; D380-L384 PolarHBondContact O-N 3.31Å | ||
| 381 | V | 91.3 | Very high | 92.5 | Very high | 20 Ų | 20 | 34.6 Ų | 34.6 | 12% | 0.121 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -68.1 | -32.9 | 176.1 | -175.9 | 0 | 0 | 0 | 0 | 111.4 | V60 V137 I140 Q383 L384 I385 | V60-V381 HydrophobicContact CG1-CG1 4.2Å; V137-V381 HydrophobicContact CB-CG1 4.39Å; V137-V381 HydrophobicContact CG1-CG1 3.84Å; V137-V381 HydrophobicContact CG2-CG1 4.12Å; I140-V381 HydrophobicContact CB-CG2 4.27Å; I140-V381 HydrophobicContact CD1-CG2 4.05Å; I140-V381 HydrophobicContact CG2-CG2 3.54Å; V381-Q383 VanDerWaalsContact C-N 3.34Å; V381-L384 WeakPolarHBondContact O-CB 3.11Å; V381-L384 PolarHBondContact O-N 3.14Å; V381-I385 HydrophobicContact CG1-CD1 4.39Å; V381-I385 WeakPolarHBondContact O-CG1 3.18Å; V381-I385 PolarHBondContact O-N 2.72Å |
| 382 | F | 90.6 | Very high | 92.4 | Very high | 21 Ų | 21 | 33.7 Ų | 33.7 | 9% | 0.092 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -71.2 | -32.6 | 178.9 | -62.9 | -69.1 | 0 | 0 | 0 | 111.6 | V60 K63 I67 D380 L384 I385 N386 | V60-F382 HydrophobicContact CG1-CE1 4.13Å; V60-F382 HydrophobicContact CG1-CZ 4.36Å; K63-F382 HydrophobicContact CB-CZ 4.1Å; K63-F382 HydrophobicContact CD-CE2 4.36Å; K63-F382 HydrophobicContact CD-CZ 4.28Å; K63-F382 HydrophobicContact CG-CE2 4.2Å; K63-F382 HydrophobicContact CG-CZ 3.85Å; I67-F382 HydrophobicContact CD1-CD2 4.48Å; I67-F382 HydrophobicContact CD1-CE2 4.08Å; I67-F382 HydrophobicContact CD1-CZ 4.44Å; D380-F382 VanDerWaalsContact C-N 3.32Å; D380-F382 WeakPolarHBondContact OD1-CD2 3.31Å; D380-F382 PolarHBondContact OD1-N 2.89Å; F382-L384 VanDerWaalsContact C-N 3.32Å; F382-L384 PolarHBondContact O-N 3.24Å; F382-I385 HydrophobicContact CD1-CD1 4.02Å; F382-I385 HydrophobicContact CE1-CD1 4.37Å; F382-I385 PolarHBondContact O-N 3.45Å; F382-N386 VanDerWaalsContact O-CG 3.27Å; F382-N386 PolarHBondContact O-N 3.45Å; F382-N386 PolarHBondContact O-OD1 2.93Å |
| 383 | Q | 91.6 | Very high | 92.3 | Very high | 53 Ų | 53 | 33.7 Ų | 33.7 | 25% | 0.248 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.7 | -42.7 | 169.6 | -167.1 | 179.8 | 18 | 0 | 0 | 111.8 | V378 D380 V381 N386 Y387 N445 | V378-Q383 HydrophobicContact CG1-CB 4.29Å; V378-Q383 HydrophobicContact CG1-CG 4.45Å; D380-Q383 HydrophobicContact CB-CB 3.99Å; D380-Q383 WeakPolarHBondContact O-CB 3.16Å; D380-Q383 PolarHBondContact O-N 2.83Å; D380-Q383 PolarHBondContact OD2-N 2.92Å; V381-Q383 VanDerWaalsContact C-N 3.34Å; Q383-N386 PolarHBondContact O-N 3.49Å; Q383-Y387 HydrophobicContact CG-CD2 4.27Å; Q383-Y387 HydrophobicContact CG-CE2 3.63Å; Q383-Y387 PolarHBondContact NE2-OH 2.89Å; Q383-Y387 VanDerWaalsContact O-CD2 3.26Å; Q383-Y387 WeakPolarHBondContact O-CD2 3.28Å; Q383-Y387 PolarHBondContact O-N 2.98Å; Q383-N445 PolarHBondContact NE2-OD1 2.92Å |
| 384 | L | 92.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.3 | -45.4 | 172.8 | -65.5 | 174.9 | 0 | 0 | 0 | 111.4 | T133 A136 V137 I140 Y375 V378 D380 V381 F382 N386 Y387 Y388 | T133-L384 HydrophobicContact CG2-CB 3.67Å; T133-L384 HydrophobicContact CG2-CD2 3.94Å; T133-L384 HydrophobicContact CG2-CG 4.4Å; T133-L384 WeakPolarHBondContact CG2-O 3.45Å; A136-L384 HydrophobicContact CB-CD1 4.11Å; V137-L384 HydrophobicContact CG2-CB 3.52Å; V137-L384 HydrophobicContact CG2-CD1 4.13Å; V137-L384 HydrophobicContact CG2-CG 4.49Å; I140-L384 HydrophobicContact CD1-CD1 3.73Å; Y375-L384 HydrophobicContact CD1-CD2 3.58Å; Y375-L384 HydrophobicContact CG-CD2 4.22Å; V378-L384 HydrophobicContact CB-CD1 4.48Å; V378-L384 HydrophobicContact CB-CD2 3.77Å; V378-L384 HydrophobicContact CB-CG 4.1Å; V378-L384 HydrophobicContact CG1-CD2 4.01Å; V378-L384 HydrophobicContact CG1-CG 4.05Å; V378-L384 HydrophobicContact CG2-CD2 3.86Å; D380-L384 PolarHBondContact O-N 3.31Å; V381-L384 WeakPolarHBondContact O-CB 3.11Å; V381-L384 PolarHBondContact O-N 3.14Å; F382-L384 VanDerWaalsContact C-N 3.32Å; F382-L384 PolarHBondContact O-N 3.24Å; L384-N386 PolarHBondContact O-N 2.93Å; L384-Y387 HydrophobicContact CD2-CD2 4.43Å; L384-Y387 PolarHBondContact O-N 3.4Å; L384-Y388 WeakPolarHBondContact O-CB 3.48Å; L384-Y388 PolarHBondContact O-N 3.45Å |
| 385 | I | 92.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58.7 | -38.4 | 176 | -69.1 | 169.3 | 0 | 0 | 0 | 111.2 | V60 V137 F240 V381 F382 S389 | V60-I385 HydrophobicContact CG1-CD1 4.03Å; V137-I385 HydrophobicContact CG1-CD1 4.35Å; V137-I385 HydrophobicContact CG1-CG1 4.14Å; V137-I385 HydrophobicContact CG2-CG1 4.08Å; F240-I385 HydrophobicContact CB-CG2 3.9Å; F240-I385 HydrophobicContact CD1-CD1 4.22Å; F240-I385 HydrophobicContact CD1-CG1 4.23Å; F240-I385 HydrophobicContact CD2-CG1 4.35Å; F240-I385 HydrophobicContact CD2-CG2 4.43Å; F240-I385 HydrophobicContact CE1-CG1 4.45Å; F240-I385 HydrophobicContact CG-CG1 4.19Å; F240-I385 HydrophobicContact CG-CG2 4.15Å; V381-I385 HydrophobicContact CG1-CD1 4.39Å; V381-I385 WeakPolarHBondContact O-CG1 3.18Å; V381-I385 PolarHBondContact O-N 2.72Å; F382-I385 HydrophobicContact CD1-CD1 4.02Å; F382-I385 HydrophobicContact CE1-CD1 4.37Å; F382-I385 PolarHBondContact O-N 3.45Å; I385-S389 WeakPolarHBondContact O-CB 3.28Å; I385-S389 PolarHBondContact O-N 3.2Å; I385-S389 PolarHBondContact O-OG 3.3Å |
| 386 | N | 91.4 | Very high | 92 | Very high | 9 Ų | 9 | 30.3 Ų | 30.3 | 5% | 0.048 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67.8 | -45.9 | 177.6 | -68.6 | -4.1 | 0 | 0 | 0 | 111.9 | Y236 F382 Q383 L384 Y388 S389 F390 D442 | Y236-N386 HydrophobicContact CD2-CB 4.37Å; F382-N386 VanDerWaalsContact O-CG 3.27Å; F382-N386 PolarHBondContact O-N 3.45Å; F382-N386 PolarHBondContact O-OD1 2.93Å; Q383-N386 PolarHBondContact O-N 3.49Å; L384-N386 PolarHBondContact O-N 2.93Å; N386-Y388 VanDerWaalsContact C-N 3.33Å; N386-Y388 PolarHBondContact O-N 3.4Å; N386-S389 PolarHBondContact O-N 3.24Å; N386-F390 WeakPolarHBondContact O-CB 3.13Å; N386-F390 PolarHBondContact O-N 3.33Å; N386-D442 PolarHBondContact ND2-OD2 3.23Å |
| 387 | Y | 88.9 | Confident | 92.1 | Very high | 27 Ų | 27 | 30.3 Ų | 30.3 | 11% | 0.106 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -57.3 | -46.4 | 175.6 | -70.7 | -44.9 | 0 | 0 | 0 | 112.4 | Q383 L384 S391 N445 I448 | Q383-Y387 HydrophobicContact CG-CD2 4.27Å; Q383-Y387 HydrophobicContact CG-CE2 3.63Å; Q383-Y387 PolarHBondContact NE2-OH 2.89Å; Q383-Y387 VanDerWaalsContact O-CD2 3.26Å; Q383-Y387 WeakPolarHBondContact O-CD2 3.28Å; Q383-Y387 PolarHBondContact O-N 2.98Å; L384-Y387 HydrophobicContact CD2-CD2 4.43Å; L384-Y387 PolarHBondContact O-N 3.4Å; Y387-S391 PolarHBondContact O-N 3.04Å; Y387-S391 PolarHBondContact O-OG 3.26Å; Y387-N445 HydrophobicContact CD1-CB 3.97Å; Y387-N445 HydrophobicContact CE1-CB 3.51Å; Y387-N445 PolarHBondContact OH-OD1 3.39Å; Y387-I448 HydrophobicContact CE1-CB 4.22Å; Y387-I448 HydrophobicContact CE1-CD1 4.43Å; Y387-I448 HydrophobicContact CE1-CG2 4.2Å |
| 388 | Y | 92.6 | Very high | 92.3 | Very high | 13 Ų | 13 | 27.1 Ų | 27.1 | 5% | 0.051 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -59.7 | -54.3 | 174.8 | 167.8 | -90.7 | 0 | 0 | 0 | 110.5 | I130 F240 S243 L384 N386 F390 S391 Y392 | I130-Y388 HydrophobicContact CB-CD2 4.44Å; I130-Y388 HydrophobicContact CG2-CD2 3.7Å; I130-Y388 HydrophobicContact CG2-CE2 3.42Å; I130-Y388 VanDerWaalsContact CG2-CE2 3.42Å; I130-Y388 WeakPolarHBondContact O-CD2 3.35Å; F240-Y388 AromaticContact CD2-CD1 3.58Å; F240-Y388 HydrophobicContact CD2-CD1 3.58Å; F240-Y388 AromaticContact CD2-CE1 3.7Å; F240-Y388 HydrophobicContact CD2-CE1 3.7Å; F240-Y388 HydrophobicContact CD2-CG 4.3Å; F240-Y388 HydrophobicContact CE2-CD1 4.05Å; F240-Y388 HydrophobicContact CE2-CE1 4.22Å; F240-Y388 HydrophobicContact CE2-CG 4.35Å; S243-Y388 WeakPolarHBondContact CB-OH 3.24Å; L384-Y388 WeakPolarHBondContact O-CB 3.48Å; L384-Y388 PolarHBondContact O-N 3.45Å; N386-Y388 VanDerWaalsContact C-N 3.33Å; N386-Y388 PolarHBondContact O-N 3.4Å; Y388-F390 PolarHBondContact O-N 3.03Å; Y388-S391 PolarHBondContact O-N 3.39Å; Y388-Y392 HydrophobicContact CE1-CD1 4.33Å; Y388-Y392 HydrophobicContact CE1-CG 4.18Å; Y388-Y392 HydrophobicContact CE2-CD2 4.33Å; Y388-Y392 HydrophobicContact CE2-CG 4.46Å; Y388-Y392 AromaticContact CZ-CG 3.89Å; Y388-Y392 WeakPolarHBondContact O-CB 3.29Å; Y388-Y392 PolarHBondContact O-N 2.9Å |
| 389 | S | 92.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63.7 | -46 | -170.5 | -64.9 | 0 | 0 | 0 | 0 | 112.1 | Y236 I385 N386 S391 Y392 W393 | Y236-S389 VanDerWaalsContact CD2-CB 3.45Å; Y236-S389 VanDerWaalsContact CG-CB 3.45Å; I385-S389 WeakPolarHBondContact O-CB 3.28Å; I385-S389 PolarHBondContact O-N 3.2Å; I385-S389 PolarHBondContact O-OG 3.3Å; N386-S389 PolarHBondContact O-N 3.24Å; S389-S391 PolarHBondContact O-N 3.15Å; S389-Y392 PolarHBondContact O-N 2.97Å; S389-W393 WeakPolarHBondContact O-CB 3.11Å; S389-W393 PolarHBondContact O-N 2.91Å |
| 390 | F | 92.8 | Very high | 92.8 | Very high | 14 Ų | 14 | 18.5 Ų | 18.5 | 6% | 0.061 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -56.3 | -52.9 | 178.6 | 178.1 | -89.5 | 0 | 0 | 0 | 111.5 | Y236 N386 Y388 F394 V435 L439 I450 | Y236-F390 HydrophobicContact CE2-CB 4.29Å; Y236-F390 VanDerWaalsContact OH-CA 3.3Å; Y236-F390 WeakPolarHBondContact OH-CA 3.27Å; N386-F390 WeakPolarHBondContact O-CB 3.13Å; N386-F390 PolarHBondContact O-N 3.33Å; Y388-F390 PolarHBondContact O-N 3.03Å; F390-F394 WeakPolarHBondContact O-CB 3.36Å; F390-F394 PolarHBondContact O-N 3.43Å; F390-F394 VanDerWaalsContact O-N 3.14Å; F390-V435 HydrophobicContact CE2-CB 4.47Å; F390-V435 HydrophobicContact CE2-CG1 3.72Å; F390-V435 HydrophobicContact CZ-CG1 3.94Å; F390-L439 HydrophobicContact CE2-CD2 4.09Å; F390-L439 HydrophobicContact CE2-CG 4.28Å; F390-L439 HydrophobicContact CZ-CD2 4.18Å; F390-I450 HydrophobicContact CE1-CD1 4.39Å; F390-I450 HydrophobicContact CE1-CG1 3.79Å; F390-I450 HydrophobicContact CZ-CD1 3.94Å; F390-I450 HydrophobicContact CZ-CG1 3.85Å |
| 391 | S | 92.7 | Very high | 93.1 | Very high | 4 Ų | 4 | 16.7 Ų | 16.7 | 3% | 0.028 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -67.2 | -44 | -177.8 | -57.4 | 0 | 0 | 0 | 0 | 111.4 | Y387 Y388 S389 F395 | Y387-S391 PolarHBondContact O-N 3.04Å; Y387-S391 PolarHBondContact O-OG 3.26Å; Y388-S391 PolarHBondContact O-N 3.39Å; S389-S391 PolarHBondContact O-N 3.15Å; S391-F395 WeakPolarHBondContact O-CD2 3.26Å; S391-F395 PolarHBondContact O-N 2.83Å |
| 392 | Y | 92.8 | Very high | 93.2 | Very high | 7 Ų | 7 | 15.7 Ų | 15.7 | 3% | 0.027 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -60.9 | -54.4 | -179.8 | -176.8 | -102.4 | 0 | 0 | 0 | 110.9 | I130 D246 Y388 S389 F394 F395 M396 | I130-Y392 HydrophobicContact CG2-CD2 4.1Å; D246-Y392 PolarHBondContact OD1-OH 2.69Å; D246-Y392 PolarHBondContact OD2-OH 2.57Å; Y388-Y392 HydrophobicContact CE1-CD1 4.33Å; Y388-Y392 HydrophobicContact CE1-CG 4.18Å; Y388-Y392 HydrophobicContact CE2-CD2 4.33Å; Y388-Y392 HydrophobicContact CE2-CG 4.46Å; Y388-Y392 AromaticContact CZ-CG 3.89Å; Y388-Y392 WeakPolarHBondContact O-CB 3.29Å; Y388-Y392 PolarHBondContact O-N 2.9Å; S389-Y392 PolarHBondContact O-N 2.97Å; Y392-F394 VanDerWaalsContact C-N 3.33Å; Y392-F394 PolarHBondContact O-N 3.08Å; Y392-F395 PolarHBondContact O-N 3.32Å; Y392-F395 VanDerWaalsContact O-N 3.14Å; Y392-M396 HydrophobicContact CD1-CG 3.87Å; Y392-M396 HydrophobicContact CD2-CG 4.32Å; Y392-M396 HydrophobicContact CE1-CE 4.37Å; Y392-M396 HydrophobicContact CE1-CG 3.6Å; Y392-M396 HydrophobicContact CE1-SD 4.21Å; Y392-M396 HydrophobicContact CE2-CG 4.08Å; Y392-M396 HydrophobicContact CE2-SD 3.87Å; Y392-M396 HydrophobicContact CG-CG 4.22Å; Y392-M396 VanDerWaalsContact O-CG 3.25Å; Y392-M396 WeakPolarHBondContact O-CG 3.47Å; Y392-M396 PolarHBondContact O-N 2.94Å; Y392-M396 WeakPolarHBondContact OH-CE 3.28Å |
| 393 | W | 93.4 | Very high | 93.4 | Very high | 1 Ų | 1 | 14.9 Ų | 14.9 | 0% | 0.004 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -66.7 | -32.1 | -176.6 | -68.7 | 117 | 0 | 0 | 0 | 113.5 | F85 L239 W245 S389 M396 G397 F427 L434 | F85-W393 HydrophobicContact CD1-CH2 4.39Å; F85-W393 HydrophobicContact CD1-CZ3 4.35Å; F85-W393 HydrophobicContact CE1-CD2 4.2Å; F85-W393 AromaticContact CE1-CE3 3.64Å; F85-W393 HydrophobicContact CE1-CE3 3.64Å; F85-W393 AromaticContact CE1-CH2 3.77Å; F85-W393 HydrophobicContact CE1-CH2 3.77Å; F85-W393 HydrophobicContact CE1-CZ2 4.33Å; F85-W393 AromaticContact CE1-CZ3 3.38Å; F85-W393 HydrophobicContact CE1-CZ3 3.38Å; F85-W393 AromaticContact CZ-CE3 3.94Å; F85-W393 HydrophobicContact CZ-CE3 3.94Å; F85-W393 AromaticContact CZ-CZ3 3.91Å; F85-W393 HydrophobicContact CZ-CZ3 3.91Å; L239-W393 HydrophobicContact CB-CZ2 3.62Å; L239-W393 HydrophobicContact CD1-CZ2 3.97Å; L239-W393 HydrophobicContact CD2-CH2 4.38Å; L239-W393 HydrophobicContact CD2-CZ2 4.07Å; L239-W393 HydrophobicContact CG-CZ2 4.09Å; W245-W393 HydrophobicContact CZ2-CH2 4.46Å; W245-W393 HydrophobicContact CZ2-CZ3 4.4Å; S389-W393 WeakPolarHBondContact O-CB 3.11Å; S389-W393 PolarHBondContact O-N 2.91Å; W393-M396 HydrophobicContact CE3-CB 4.16Å; W393-M396 HydrophobicContact CE3-CG 4.39Å; W393-M396 HydrophobicContact CZ3-CB 4.47Å; W393-G397 PolarHBondContact O-N 3.19Å; W393-F427 HydrophobicContact CE3-CZ 4.26Å; W393-F427 HydrophobicContact CZ3-CE2 4.13Å; W393-F427 AromaticContact CZ3-CZ 3.94Å; W393-F427 HydrophobicContact CZ3-CZ 3.94Å; W393-L434 HydrophobicContact CB-CB 4.44Å; W393-L434 HydrophobicContact CB-CD1 4.46Å; W393-L434 HydrophobicContact CD2-CD1 4.15Å; W393-L434 HydrophobicContact CG-CD1 4.03Å |
| 394 | F | 93.9 | Very high | 93.5 | Very high | 95 Ų | 95 | 15 Ų | 15 | 42% | 0.417 | 8% | 0.078 | S | C | . | . | H | α-helix | trans | -56.9 | -50.4 | 170.6 | 176 | -101 | 0 | 0 | 0 | 111.6 | F390 Y392 G397 L398 V435 | F390-F394 WeakPolarHBondContact O-CB 3.36Å; F390-F394 PolarHBondContact O-N 3.43Å; F390-F394 VanDerWaalsContact O-N 3.14Å; Y392-F394 VanDerWaalsContact C-N 3.33Å; Y392-F394 PolarHBondContact O-N 3.08Å; F394-G397 PolarHBondContact O-N 3.09Å; F394-L398 HydrophobicContact CE1-CD2 4.46Å; F394-L398 WeakPolarHBondContact O-CB 3.4Å; F394-L398 PolarHBondContact O-N 3.3Å; F394-V435 HydrophobicContact CB-CG2 3.9Å; F394-V435 HydrophobicContact CD2-CG1 4.31Å; F394-V435 HydrophobicContact CD2-CG2 4.4Å |
| 395 | F | 94.1 | Very high | 93.6 | Very high | 5 Ų | 5 | 18.4 Ų | 18.4 | 2% | 0.022 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -75.9 | -30.5 | -178.1 | -76.8 | -62.4 | 0 | 0 | 0 | 114.3 | I110 I121 R122 T125 I130 S391 Y392 L398 S399 | I110-F395 HydrophobicContact CD1-CD1 4.1Å; I121-F395 HydrophobicContact CG2-CE1 4.44Å; I121-F395 HydrophobicContact CG2-CZ 4.03Å; R122-F395 VanDerWaalsContact CA-CE1 3.5Å; R122-F395 HydrophobicContact CB-CD1 3.79Å; R122-F395 HydrophobicContact CB-CE1 3.78Å; R122-F395 HydrophobicContact CB-CG 4.42Å; R122-F395 HydrophobicContact CB-CZ 4.44Å; R122-F395 HydrophobicContact CG-CD1 4.17Å; R122-F395 HydrophobicContact CG-CG 4.39Å; T125-F395 VanDerWaalsContact CB-CE2 3.46Å; T125-F395 HydrophobicContact CG2-CD2 4.48Å; T125-F395 HydrophobicContact CG2-CE2 3.69Å; T125-F395 WeakPolarHBondContact OG1-CE2 3.31Å; I130-F395 HydrophobicContact CD1-CD2 4.41Å; S391-F395 WeakPolarHBondContact O-CD2 3.26Å; S391-F395 PolarHBondContact O-N 2.83Å; Y392-F395 PolarHBondContact O-N 3.32Å; Y392-F395 VanDerWaalsContact O-N 3.14Å; F395-L398 HydrophobicContact CD1-CD2 4.12Å; F395-L398 HydrophobicContact CE1-CD2 4.39Å; F395-L398 PolarHBondContact O-N 3.3Å; F395-S399 WeakPolarHBondContact O-CB 3.17Å; F395-S399 PolarHBondContact O-N 3.29Å; F395-S399 PolarHBondContact O-OG 3.44Å |
| 396 | M | 93.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -64.6 | -45.4 | 171.1 | -63.3 | -58.2 | -79.4 | 0 | 0 | 110 | Y93 W245 D246 Y392 W393 L398 S399 V400 F427 | Y93-M396 HydrophobicContact CD1-CE 4.39Å; Y93-M396 HydrophobicContact CD2-CE 4.24Å; Y93-M396 HydrophobicContact CE1-CE 3.73Å; Y93-M396 HydrophobicContact CE1-SD 4.24Å; Y93-M396 HydrophobicContact CE2-CE 3.56Å; Y93-M396 HydrophobicContact CE2-SD 4.3Å; Y93-M396 WeakPolarHBondContact OH-CE 3.39Å; Y93-M396 PolarHBondContact OH-SD 3.44Å; W245-M396 HydrophobicContact CH2-CE 3.16Å; W245-M396 HydrophobicContact CZ2-CE 3.58Å; W245-M396 HydrophobicContact CZ3-CE 3.81Å; D246-M396 HydrophobicContact CB-CE 4.05Å; Y392-M396 HydrophobicContact CD1-CG 3.87Å; Y392-M396 HydrophobicContact CD2-CG 4.32Å; Y392-M396 HydrophobicContact CE1-CE 4.37Å; Y392-M396 HydrophobicContact CE1-CG 3.6Å; Y392-M396 HydrophobicContact CE1-SD 4.21Å; Y392-M396 HydrophobicContact CE2-CG 4.08Å; Y392-M396 HydrophobicContact CE2-SD 3.87Å; Y392-M396 HydrophobicContact CG-CG 4.22Å; Y392-M396 VanDerWaalsContact O-CG 3.25Å; Y392-M396 WeakPolarHBondContact O-CG 3.47Å; Y392-M396 PolarHBondContact O-N 2.94Å; Y392-M396 WeakPolarHBondContact OH-CE 3.28Å; W393-M396 HydrophobicContact CE3-CB 4.16Å; W393-M396 HydrophobicContact CE3-CG 4.39Å; W393-M396 HydrophobicContact CZ3-CB 4.47Å; M396-L398 VanDerWaalsContact C-N 3.32Å; M396-L398 PolarHBondContact O-N 3Å; M396-S399 PolarHBondContact O-N 3.41Å; M396-V400 PolarHBondContact O-N 3.47Å; M396-V400 VanDerWaalsContact O-N 3.1Å; M396-F427 HydrophobicContact CB-CE1 4.32Å; M396-F427 HydrophobicContact CB-CZ 4.16Å |
| 397 | G | 95.5 | Very high | 93.6 | Very high | 9 Ų | 9 | 19.9 Ų | 19.9 | 9% | 0.093 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -58.4 | -42.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | W393 F394 V400 A401 | W393-G397 PolarHBondContact O-N 3.19Å; F394-G397 PolarHBondContact O-N 3.09Å; G397-V400 PolarHBondContact O-N 3.16Å; G397-A401 WeakPolarHBondContact O-CB 3.3Å; G397-A401 PolarHBondContact O-N 3.32Å |
| 398 | L | 95.4 | Very high | 93.7 | Very high | 38 Ų | 38 | 28.6 Ų | 28.6 | 20% | 0.199 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -64.4 | -40 | 176.6 | -171.8 | 59.8 | 0 | 0 | 0 | 112.4 | I110 F114 I118 F394 F395 M396 V400 A401 G402 | I110-L398 HydrophobicContact CD1-CD2 4.29Å; I110-L398 HydrophobicContact CD1-CG 4.45Å; F114-L398 HydrophobicContact CD2-CD1 4.29Å; F114-L398 HydrophobicContact CD2-CG 4.32Å; F114-L398 HydrophobicContact CE2-CD1 3.75Å; F114-L398 HydrophobicContact CE2-CG 3.98Å; F114-L398 WeakPolarHBondContact CE2-O 3.41Å; F114-L398 HydrophobicContact CZ-CD1 4Å; I118-L398 HydrophobicContact CG2-CD2 3.47Å; I118-L398 VanDerWaalsContact CG2-CD2 3.47Å; F394-L398 HydrophobicContact CE1-CD2 4.46Å; F394-L398 WeakPolarHBondContact O-CB 3.4Å; F394-L398 PolarHBondContact O-N 3.3Å; F395-L398 HydrophobicContact CD1-CD2 4.12Å; F395-L398 HydrophobicContact CE1-CD2 4.39Å; F395-L398 PolarHBondContact O-N 3.3Å; M396-L398 VanDerWaalsContact C-N 3.32Å; M396-L398 PolarHBondContact O-N 3Å; L398-V400 PolarHBondContact O-N 3.2Å; L398-A401 WeakPolarHBondContact O-CB 3.38Å; L398-A401 PolarHBondContact O-N 3.39Å; L398-G402 PolarHBondContact O-N 3.39Å |
| 399 | S | 94.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 33.8 Ų | 33.8 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.3 | -43.7 | 177 | -57.8 | 0 | 0 | 0 | 0 | 111.6 | Y93 I110 F395 M396 G402 Q403 | Y93-S399 WeakPolarHBondContact OH-CB 3.42Å; Y93-S399 PolarHBondContact OH-OG 3.43Å; I110-S399 WeakPolarHBondContact CD1-OG 3.41Å; F395-S399 WeakPolarHBondContact O-CB 3.17Å; F395-S399 PolarHBondContact O-N 3.29Å; F395-S399 PolarHBondContact O-OG 3.44Å; M396-S399 PolarHBondContact O-N 3.41Å; S399-G402 WeakPolarHBondContact O-CA 3.43Å; S399-G402 PolarHBondContact O-N 3.4Å; S399-G402 VanDerWaalsContact O-N 3.17Å; S399-Q403 PolarHBondContact O-N 2.93Å |
| 400 | V | 95.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -71.3 | -34.1 | 176.1 | 179.3 | 0 | 0 | 0 | 0 | 111.9 | C92 Y93 M396 G397 L398 G402 Q403 I404 P424 F427 | C92-V400 HydrophobicContact CB-CG1 4.06Å; C92-V400 HydrophobicContact CB-CG2 3.93Å; Y93-V400 HydrophobicContact CD2-CG2 4.03Å; Y93-V400 HydrophobicContact CE2-CG2 3.78Å; M396-V400 PolarHBondContact O-N 3.47Å; M396-V400 VanDerWaalsContact O-N 3.1Å; G397-V400 PolarHBondContact O-N 3.16Å; L398-V400 PolarHBondContact O-N 3.2Å; V400-G402 PolarHBondContact O-N 2.87Å; V400-Q403 WeakPolarHBondContact O-CA 3.42Å; V400-Q403 WeakPolarHBondContact O-CB 3.41Å; V400-Q403 PolarHBondContact O-N 3.37Å; V400-I404 PolarHBondContact O-N 3.41Å; V400-P424 HydrophobicContact CG1-CB 3.45Å; V400-P424 VanDerWaalsContact CG1-CB 3.45Å; V400-F427 HydrophobicContact CB-CD1 3.72Å; V400-F427 HydrophobicContact CB-CE1 4.12Å; V400-F427 HydrophobicContact CG1-CB 4.42Å; V400-F427 HydrophobicContact CG1-CD1 3.93Å; V400-F427 HydrophobicContact CG2-CD1 3.51Å; V400-F427 HydrophobicContact CG2-CE1 3.58Å; V400-F427 HydrophobicContact CG2-CG 4.43Å |
| 401 | A | 96.1 | Very high | 93.5 | Very high | 34 Ų | 34 | 40.3 Ų | 40.3 | 28% | 0.281 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -61 | -36.3 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | G397 L398 Q403 I404 Y405 | G397-A401 WeakPolarHBondContact O-CB 3.3Å; G397-A401 PolarHBondContact O-N 3.32Å; L398-A401 WeakPolarHBondContact O-CB 3.38Å; L398-A401 PolarHBondContact O-N 3.39Å; A401-Q403 VanDerWaalsContact C-N 3.31Å; A401-Q403 PolarHBondContact O-N 2.92Å; A401-I404 PolarHBondContact O-N 3.34Å; A401-Y405 WeakPolarHBondContact O-CB 3.48Å; A401-Y405 PolarHBondContact O-N 2.91Å |
| 402 | G | 93.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -57.8 | -39.9 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L398 S399 V400 I404 Y405 L406 | L398-G402 PolarHBondContact O-N 3.39Å; S399-G402 WeakPolarHBondContact O-CA 3.43Å; S399-G402 PolarHBondContact O-N 3.4Å; S399-G402 VanDerWaalsContact O-N 3.17Å; V400-G402 PolarHBondContact O-N 2.87Å; G402-I404 PolarHBondContact O-N 2.96Å; G402-Y405 PolarHBondContact O-N 3.33Å; G402-L406 WeakPolarHBondContact O-CB 3.38Å; G402-L406 VanDerWaalsContact O-CG 3.31Å; G402-L406 WeakPolarHBondContact O-CG 3.34Å; G402-L406 PolarHBondContact O-N 3.42Å |
| 403 | Q | 93.7 | Very high | 93.2 | Very high | 4 Ų | 4 | 49.6 Ų | 49.6 | 2% | 0.019 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.1 | -46.8 | 173.5 | -167.8 | -167.5 | -27.6 | 0 | 0 | 112.1 | C92 E95 L96 S399 V400 A401 Y405 L406 R407 | C92-Q403 PolarHBondContact O-OE1 3.34Å; E95-Q403 PolarHBondContact OE1-NE2 3.48Å; E95-Q403 PolarHBondContact OE2-NE2 3.4Å; L96-Q403 HydrophobicContact CD1-CB 4.22Å; L96-Q403 HydrophobicContact CD2-CB 3.7Å; L96-Q403 HydrophobicContact CD2-CG 3.91Å; L96-Q403 HydrophobicContact CG-CB 3.99Å; L96-Q403 HydrophobicContact CG-CG 4.05Å; S399-Q403 PolarHBondContact O-N 2.93Å; V400-Q403 WeakPolarHBondContact O-CA 3.42Å; V400-Q403 WeakPolarHBondContact O-CB 3.41Å; V400-Q403 PolarHBondContact O-N 3.37Å; A401-Q403 VanDerWaalsContact C-N 3.31Å; A401-Q403 PolarHBondContact O-N 2.92Å; Q403-Y405 VanDerWaalsContact C-N 3.35Å; Q403-L406 PolarHBondContact O-N 2.95Å; Q403-R407 WeakPolarHBondContact O-CG 3.45Å; Q403-R407 PolarHBondContact O-N 2.7Å; Q403-R407 VanDerWaalsContact O-N 3.07Å |
| 404 | I | 94.8 | Very high | 93 | Very high | 55 Ų | 55 | 54.6 Ų | 54.6 | 28% | 0.282 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.3 | -44.7 | 178.1 | -59.9 | 172.8 | 0 | 0 | 0 | 109.8 | V400 A401 G402 R407 W408 P424 V425 | V400-I404 PolarHBondContact O-N 3.41Å; A401-I404 PolarHBondContact O-N 3.34Å; G402-I404 PolarHBondContact O-N 2.96Å; I404-R407 WeakPolarHBondContact O-CB 3.41Å; I404-R407 PolarHBondContact O-N 3.06Å; I404-W408 PolarHBondContact O-N 3.07Å; I404-P424 HydrophobicContact CD1-CB 4.06Å; I404-P424 HydrophobicContact CG1-CB 3.88Å; I404-P424 HydrophobicContact CG1-CG 4.2Å; I404-V425 HydrophobicContact CD1-CG2 4.09Å |
| 405 | Y | 94.6 | Very high | 92.9 | Very high | 72 Ų | 72 | 51.9 Ų | 51.9 | 28% | 0.282 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 177.1 | 171.4 | -103.2 | 0 | 0 | 0 | 112.6 | S113 A401 G402 Q403 R407 W408 K409 | S113-Y405 WeakPolarHBondContact O-CE1 3.33Å; A401-Y405 WeakPolarHBondContact O-CB 3.48Å; A401-Y405 PolarHBondContact O-N 2.91Å; G402-Y405 PolarHBondContact O-N 3.33Å; Q403-Y405 VanDerWaalsContact C-N 3.35Å; Y405-R407 VanDerWaalsContact C-N 3.27Å; Y405-R407 PolarHBondContact O-N 2.68Å; Y405-W408 HydrophobicContact CD2-CE3 4.46Å; Y405-W408 HydrophobicContact CE2-CE3 4.49Å; Y405-W408 PolarHBondContact O-N 3.46Å; Y405-W408 VanDerWaalsContact O-N 3.1Å; Y405-K409 HydrophobicContact CE1-CB 4.45Å; Y405-K409 HydrophobicContact CE1-CD 3.73Å; Y405-K409 HydrophobicContact CE2-CB 4.5Å; Y405-K409 HydrophobicContact CE2-CD 4.14Å; Y405-K409 PolarHBondContact O-N 3.39Å; Y405-K409 WeakPolarHBondContact OH-CD 3.41Å; Y405-K409 PolarHBondContact OH-NZ 3.02Å |
| 406 | L | 92.3 | Very high | 92.6 | Very high | 7 Ų | 7 | 54.7 Ų | 54.7 | 4% | 0.037 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.8 | -30.8 | 176.9 | -75.1 | 176 | 0 | 0 | 0 | 112.4 | I100 S113 G402 Q403 W408 Q410 R415 | I100-L406 HydrophobicContact CD1-CD1 3.9Å; S113-L406 WeakPolarHBondContact OG-CD1 3.47Å; G402-L406 WeakPolarHBondContact O-CB 3.38Å; G402-L406 VanDerWaalsContact O-CG 3.31Å; G402-L406 WeakPolarHBondContact O-CG 3.34Å; G402-L406 PolarHBondContact O-N 3.42Å; Q403-L406 PolarHBondContact O-N 2.95Å; L406-W408 VanDerWaalsContact C-N 3.29Å; L406-W408 PolarHBondContact O-N 2.9Å; L406-Q410 CarbonylContact O-C 3.31Å; L406-Q410 VanDerWaalsContact O-C 3.31Å; L406-Q410 WeakPolarHBondContact O-CA 2.91Å; L406-Q410 PolarHBondContact O-N 3.3Å; L406-Q410 VanDerWaalsContact O-O 3.13Å; L406-R415 PolarHBondContact O-NH2 3.24Å |
| 407 | R | 91.9 | Very high | 92.3 | Very high | 33 Ų | 33 | 56.5 Ų | 56.5 | 13% | 0.125 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -64.4 | -34.3 | 172.4 | -75.5 | 177.3 | 173.1 | -146.8 | 2.1 | 112.8 | E95 Q403 I404 Y405 R415 L419 | E95-R407 IonicContact OE1-CZ 3.48Å; E95-R407 VanDerWaalsContact OE1-CZ 3.24Å; E95-R407 IonicContact OE1-NE 3.83Å; E95-R407 PolarHBondContact OE1-NE 3.36Å; E95-R407 IonicContact OE1-NH2 2.86Å; E95-R407 PolarHBondContact OE1-NH2 3.17Å; E95-R407 IonicContact OE2-CZ 2.82Å; E95-R407 IonicContact OE2-NH2 3.14Å; E95-R407 PolarHBondContact OE2-NH2 3.36Å; Q403-R407 WeakPolarHBondContact O-CG 3.45Å; Q403-R407 PolarHBondContact O-N 2.7Å; Q403-R407 VanDerWaalsContact O-N 3.07Å; I404-R407 WeakPolarHBondContact O-CB 3.41Å; I404-R407 PolarHBondContact O-N 3.06Å; Y405-R407 VanDerWaalsContact C-N 3.27Å; Y405-R407 PolarHBondContact O-N 2.68Å; R407-R415 VanDerWaalsContact CA-NH2 3.33Å; R407-L419 VanDerWaalsContact CZ-O 3.3Å; R407-L419 PolarHBondContact NH1-O 3.29Å; R407-L419 PolarHBondContact NH2-O 2.87Å |
| 408 | W | 91.5 | Very high | 92 | Very high | 209 Ų | 209 | 63.2 Ų | 63.2 | 79% | 0.792 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -81.2 | -46.4 | 177.7 | -179 | 67 | 0 | 0 | 0 | 112.5 | I404 Y405 L406 | I404-W408 PolarHBondContact O-N 3.07Å; Y405-W408 HydrophobicContact CD2-CE3 4.46Å; Y405-W408 HydrophobicContact CE2-CE3 4.49Å; Y405-W408 PolarHBondContact O-N 3.46Å; Y405-W408 VanDerWaalsContact O-N 3.1Å; L406-W408 VanDerWaalsContact C-N 3.29Å; L406-W408 PolarHBondContact O-N 2.9Å |
| 409 | K | 92.6 | Very high | 91.8 | Very high | 122 Ų | 122 | 62.7 Ų | 62.7 | 53% | 0.53 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -78.9 | -33.1 | -175.2 | -173.8 | 170.1 | -178.7 | -179.1 | 0 | 114.1 | Y405 | Y405-K409 HydrophobicContact CE1-CB 4.45Å; Y405-K409 HydrophobicContact CE1-CD 3.73Å; Y405-K409 HydrophobicContact CE2-CB 4.5Å; Y405-K409 HydrophobicContact CE2-CD 4.14Å; Y405-K409 PolarHBondContact O-N 3.39Å; Y405-K409 WeakPolarHBondContact OH-CD 3.41Å; Y405-K409 PolarHBondContact OH-NZ 3.02Å |
| 410 | Q | 91.9 | Very high | 91.7 | Very high | 77 Ų | 77 | 66.9 Ų | 66.9 | 36% | 0.36 | 33% | 0.333 | S | S | . | . | trans | -130.1 | 70.1 | -179 | -66.3 | -179.2 | -1.7 | 0 | 0 | 109.7 | L406 D412 R413 R415 | L406-Q410 CarbonylContact O-C 3.31Å; L406-Q410 VanDerWaalsContact O-C 3.31Å; L406-Q410 WeakPolarHBondContact O-CA 2.91Å; L406-Q410 PolarHBondContact O-N 3.3Å; L406-Q410 VanDerWaalsContact O-O 3.13Å; Q410-D412 VanDerWaalsContact C-N 3.3Å; Q410-D412 PolarHBondContact O-N 3.33Å; Q410-R413 HydrophobicContact CB-CB 4.36Å; Q410-R413 PolarHBondContact O-N 3.2Å; Q410-R413 VanDerWaalsContact OE1-NH1 3.15Å; Q410-R415 PolarHBondContact O-NH2 2.96Å | ||
| 411 | P | 89.4 | Confident | 91.6 | Very high | 74 Ų | 74 | 71.3 Ų | 71.3 | 48% | 0.481 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -37.9 | -175.8 | 25 | -33.1 | 0 | 0 | 0 | 112.2 | R413 R415 | P411-R413 VanDerWaalsContact C-N 3.3Å; P411-R413 PolarHBondContact O-N 3.01Å; P411-R415 PolarHBondContact O-NH1 3.36Å |
| 412 | D | 90 | Very high | 91.5 | Very high | 154 Ų | 154 | 76.2 Ų | 76.2 | 82% | 0.824 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | -0.6 | -173.1 | -54.4 | -46.2 | 0 | 0 | 0 | 114.7 | Q410 | Q410-D412 VanDerWaalsContact C-N 3.3Å; Q410-D412 PolarHBondContact O-N 3.33Å |
| 413 | R | 89.8 | Confident | 91.5 | Very high | 53 Ų | 53 | 80.2 Ų | 80.2 | 20% | 0.2 | 39% | 0.387 | C | S | . | . | S | Bend | trans | -60.9 | 131.4 | 176.7 | -170.4 | 174.2 | -175.3 | 143 | 0.6 | 109.4 | T99 E112 Q410 P411 R415 | T99-R413 HydrophobicContact CG2-CG 4.19Å; E112-R413 IonicContact OE1-CZ 2.74Å; E112-R413 IonicContact OE1-NH1 2.74Å; E112-R413 PolarHBondContact OE1-NH1 3.38Å; E112-R413 IonicContact OE1-NH2 3.82Å; E112-R413 PolarHBondContact OE1-NH2 3Å; E112-R413 VanDerWaalsContact OE1-NH2 3.14Å; Q410-R413 HydrophobicContact CB-CB 4.36Å; Q410-R413 PolarHBondContact O-N 3.2Å; Q410-R413 VanDerWaalsContact OE1-NH1 3.15Å; P411-R413 VanDerWaalsContact C-N 3.3Å; P411-R413 PolarHBondContact O-N 3.01Å; R413-R415 PolarHBondContact O-N 3.04Å |
| 414 | P | 88.6 | Confident | 91.6 | Very high | 105 Ų | 105 | 80 Ų | 80 | 68% | 0.682 | 39% | 0.386 | S | S | * | . | trans | -63.2 | 123.7 | 178.1 | 25.6 | -33.4 | 0 | 0 | 0 | 109.6 | ||||
| 415 | R | 90.8 | Very high | 91.6 | Very high | 39 Ų | 39 | 80.6 Ų | 80.6 | 15% | 0.147 | 39% | 0.392 | C | S | . | . | trans | -121.9 | 96 | 178.1 | -65.8 | -177 | -173.3 | 90.7 | 6.9 | 108.3 | T99 L406 R407 Q410 P411 R413 L417 K418 | T99-R415 HydrophobicContact CG2-CG 4.04Å; L406-R415 PolarHBondContact O-NH2 3.24Å; R407-R415 VanDerWaalsContact CA-NH2 3.33Å; Q410-R415 PolarHBondContact O-NH2 2.96Å; P411-R415 PolarHBondContact O-NH1 3.36Å; R413-R415 PolarHBondContact O-N 3.04Å; R415-L417 VanDerWaalsContact C-N 3.27Å; R415-L417 PolarHBondContact O-N 2.94Å; R415-K418 HydrophobicContact CB-CB 4.46Å | ||
| 416 | P | 88 | Confident | 91.7 | Very high | 63 Ų | 63 | 79.3 Ų | 79.3 | 41% | 0.409 | 39% | 0.391 | S | S | . | . | S | Bend | trans | -60 | -39.1 | -179 | -24.7 | 34.3 | 0 | 0 | 0 | 112.6 | E259 | E259-P416 HydrophobicContact CB-CB 4.06Å; E259-P416 HydrophobicContact CG-CB 3.54Å; E259-P416 HydrophobicContact CG-CG 3.93Å; E259-P416 WeakPolarHBondContact OE1-CG 3.41Å |
| 417 | L | 88.1 | Confident | 91.8 | Very high | 38 Ų | 38 | 79 Ų | 79 | 20% | 0.199 | 39% | 0.39 | C | S | . | . | S | Bend | trans | -105.1 | 125.9 | 166.8 | -172.8 | 74 | 0 | 0 | 0 | 108.8 | A94 E95 T98 P263 R415 | A94-L417 HydrophobicContact CB-CD2 3.74Å; E95-L417 HydrophobicContact CB-CD2 4.21Å; E95-L417 WeakPolarHBondContact CG-O 3.44Å; T98-L417 HydrophobicContact CG2-CB 4.48Å; T98-L417 WeakPolarHBondContact OG1-CB 3.21Å; P263-L417 HydrophobicContact CB-CD2 4.27Å; P263-L417 HydrophobicContact CG-CD1 4.26Å; P263-L417 HydrophobicContact CG-CD2 3.82Å; R415-L417 VanDerWaalsContact C-N 3.27Å; R415-L417 PolarHBondContact O-N 2.94Å |
| 418 | K | 89.4 | Confident | 92 | Very high | 150 Ų | 150 | 78.6 Ų | 78.6 | 65% | 0.652 | 39% | 0.392 | S | S | * | . | trans | -131.3 | 108 | 175.6 | -173.5 | 179.9 | 179 | 179.7 | 0 | 109.9 | R415 | R415-K418 HydrophobicContact CB-CB 4.46Š| ||
| 419 | L | 89.8 | Confident | 92.2 | Very high | 28 Ų | 28 | 74.2 Ų | 74.2 | 15% | 0.147 | 38% | 0.383 | C | S | . | . | trans | -80.8 | 161.9 | 175.9 | -62.4 | 173.7 | 0 | 0 | 0 | 111.5 | L91 E95 R407 Y423 | L91-L419 VanDerWaalsContact C-CD1 3.41Å; L91-L419 HydrophobicContact CB-CD1 3.77Å; L91-L419 WeakPolarHBondContact O-CD1 3.33Å; E95-L419 HydrophobicContact CB-CD1 4.49Å; E95-L419 WeakPolarHBondContact OE2-CB 3.47Å; E95-L419 PolarHBondContact OE2-N 3.47Å; R407-L419 VanDerWaalsContact CZ-O 3.3Å; R407-L419 PolarHBondContact NH1-O 3.29Å; R407-L419 PolarHBondContact NH2-O 2.87Å; L419-Y423 HydrophobicContact CB-CD2 4.3Å | ||
| 420 | T | 93.2 | Very high | 92.3 | Very high | 88 Ų | 88 | 70.7 Ų | 70.7 | 54% | 0.54 | 37% | 0.373 | S | S | . | . | trans | -66.2 | 149.7 | 167.5 | 58.5 | 0 | 0 | 0 | 0 | 109.5 | F422 Y423 P424 | T420-F422 PolarHBondContact O-N 2.9Å; T420-F422 VanDerWaalsContact O-N 3.08Å; T420-Y423 PolarHBondContact O-N 2.87Å; T420-Y423 VanDerWaalsContact OG1-CD2 3.27Å; T420-Y423 WeakPolarHBondContact OG1-CD2 3.26Å; T420-Y423 WeakPolarHBondContact OG1-CE2 3.39Å; T420-P424 VanDerWaalsContact O-CD 3.29Å; T420-P424 WeakPolarHBondContact O-CD 3.42Å | ||
| 421 | L | 93.1 | Very high | 92.4 | Very high | 92 Ų | 92 | 67.2 Ų | 67.2 | 48% | 0.482 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.2 | -15.6 | 179.1 | -78.7 | 171.2 | 0 | 0 | 0 | 113.4 | Y423 P424 V425 | L421-Y423 PolarHBondContact O-N 3.42Å; L421-P424 HydrophobicContact CD2-CG 4.46Å; L421-P424 VanDerWaalsContact O-CD 3.31Å; L421-P424 WeakPolarHBondContact O-CD 3.31Å; L421-P424 WeakPolarHBondContact O-CG 3.4Å; L421-V425 WeakPolarHBondContact O-CB 3.32Å; L421-V425 WeakPolarHBondContact O-CG2 3.46Å; L421-V425 PolarHBondContact O-N 3.48Å |
| 422 | F | 94.2 | Very high | 92.7 | Very high | 137 Ų | 137 | 68.1 Ų | 68.1 | 60% | 0.601 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -54.5 | -48.7 | 175.3 | 177.5 | -101.7 | 0 | 0 | 0 | 112.3 | T420 V425 V426 | T420-F422 PolarHBondContact O-N 2.9Å; T420-F422 VanDerWaalsContact O-N 3.08Å; F422-V425 PolarHBondContact O-N 3.27Å; F422-V426 HydrophobicContact CD1-CG2 4.4Å; F422-V426 HydrophobicContact CD2-CG2 4.05Å; F422-V426 HydrophobicContact CE1-CG2 4.1Å; F422-V426 HydrophobicContact CE2-CG2 3.73Å; F422-V426 HydrophobicContact CG-CG2 4.38Å; F422-V426 HydrophobicContact CZ-CG2 3.76Å; F422-V426 WeakPolarHBondContact O-CB 3.33Å; F422-V426 VanDerWaalsContact O-CG2 3.24Å; F422-V426 WeakPolarHBondContact O-CG2 3.39Å; F422-V426 PolarHBondContact O-N 2.84Å |
| 423 | Y | 94.2 | Very high | 92.9 | Very high | 84 Ų | 84 | 64.3 Ų | 64.3 | 33% | 0.329 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60 | -55.5 | -177.7 | -66.1 | -89.6 | 0 | 0 | 0 | 113.6 | V88 L91 L419 T420 L421 V425 V426 F427 | V88-Y423 HydrophobicContact CG1-CD1 4.2Å; V88-Y423 WeakPolarHBondContact CG1-O 3.02Å; V88-Y423 HydrophobicContact CG2-CD1 4.43Å; L91-Y423 HydrophobicContact CD1-CD1 4.42Å; L91-Y423 HydrophobicContact CD1-CE1 4.21Å; L419-Y423 HydrophobicContact CB-CD2 4.3Å; T420-Y423 PolarHBondContact O-N 2.87Å; T420-Y423 VanDerWaalsContact OG1-CD2 3.27Å; T420-Y423 WeakPolarHBondContact OG1-CD2 3.26Å; T420-Y423 WeakPolarHBondContact OG1-CE2 3.39Å; L421-Y423 PolarHBondContact O-N 3.42Å; Y423-V425 VanDerWaalsContact C-N 3.32Å; Y423-V425 PolarHBondContact O-N 3.02Å; Y423-V426 PolarHBondContact O-N 3.19Å; Y423-F427 WeakPolarHBondContact O-CB 3.31Å; Y423-F427 PolarHBondContact O-N 3.26Å |
| 424 | P | 95.1 | Very high | 93 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -66.8 | -32.7 | -179.2 | 26.4 | -35.8 | 0 | 0 | 0 | 112.6 | V400 I404 T420 L421 F427 C428 | V400-P424 HydrophobicContact CG1-CB 3.45Å; V400-P424 VanDerWaalsContact CG1-CB 3.45Å; I404-P424 HydrophobicContact CD1-CB 4.06Å; I404-P424 HydrophobicContact CG1-CB 3.88Å; I404-P424 HydrophobicContact CG1-CG 4.2Å; T420-P424 VanDerWaalsContact O-CD 3.29Å; T420-P424 WeakPolarHBondContact O-CD 3.42Å; L421-P424 HydrophobicContact CD2-CG 4.46Å; L421-P424 VanDerWaalsContact O-CD 3.31Å; L421-P424 WeakPolarHBondContact O-CD 3.31Å; L421-P424 WeakPolarHBondContact O-CG 3.4Å; P424-F427 PolarHBondContact O-N 2.92Å; P424-C428 WeakPolarHBondContact O-CB 3.35Å; P424-C428 PolarHBondContact O-N 3.42Å; P424-C428 PolarHBondContact O-SG 3.49Å |
| 425 | V | 95.6 | Very high | 93.2 | Very high | 67 Ų | 67 | 58 Ų | 58 | 41% | 0.406 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -66.3 | -47.4 | 175.9 | 171.6 | 0 | 0 | 0 | 0 | 111.1 | I404 L421 F422 Y423 F427 C428 L429 | I404-V425 HydrophobicContact CD1-CG2 4.09Å; L421-V425 WeakPolarHBondContact O-CB 3.32Å; L421-V425 WeakPolarHBondContact O-CG2 3.46Å; L421-V425 PolarHBondContact O-N 3.48Å; F422-V425 PolarHBondContact O-N 3.27Å; Y423-V425 VanDerWaalsContact C-N 3.32Å; Y423-V425 PolarHBondContact O-N 3.02Å; V425-F427 VanDerWaalsContact C-N 3.31Å; V425-F427 PolarHBondContact O-N 3.05Å; V425-C428 PolarHBondContact O-N 3.31Å; V425-L429 HydrophobicContact CG1-CD1 4.13Å; V425-L429 HydrophobicContact CG1-CG 4.48Å; V425-L429 WeakPolarHBondContact O-CG 3.49Å; V425-L429 PolarHBondContact O-N 3.31Å |
| 426 | V | 95.6 | Very high | 93.3 | Very high | 46 Ų | 46 | 58.3 Ų | 58.3 | 28% | 0.279 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -59.5 | -44.7 | 176.2 | 169.6 | 0 | 0 | 0 | 0 | 110.6 | F422 Y423 C428 L429 C430 | F422-V426 HydrophobicContact CD1-CG2 4.4Å; F422-V426 HydrophobicContact CD2-CG2 4.05Å; F422-V426 HydrophobicContact CE1-CG2 4.1Å; F422-V426 HydrophobicContact CE2-CG2 3.73Å; F422-V426 HydrophobicContact CG-CG2 4.38Å; F422-V426 HydrophobicContact CZ-CG2 3.76Å; F422-V426 WeakPolarHBondContact O-CB 3.33Å; F422-V426 VanDerWaalsContact O-CG2 3.24Å; F422-V426 WeakPolarHBondContact O-CG2 3.39Å; F422-V426 PolarHBondContact O-N 2.84Å; Y423-V426 PolarHBondContact O-N 3.19Å; V426-C428 PolarHBondContact O-N 3.37Å; V426-L429 PolarHBondContact O-N 3.06Å; V426-C430 PolarHBondContact O-N 2.87Å; V426-C430 PolarHBondContact O-SG 2.89Å; V426-C430 VanDerWaalsContact O-SG 3.41Å |
| 427 | F | 95.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -60.6 | -46.2 | 177.2 | -173.5 | -96.8 | 0 | 0 | 0 | 112.4 | F85 V88 W393 M396 V400 Y423 P424 V425 L429 C430 A431 | F85-F427 HydrophobicContact CD2-CD2 4.02Å; F85-F427 HydrophobicContact CD2-CE2 4.29Å; F85-F427 AromaticContact CE1-CE2 3.99Å; F85-F427 HydrophobicContact CE1-CE2 3.99Å; F85-F427 AromaticContact CE2-CD2 3.34Å; F85-F427 HydrophobicContact CE2-CD2 3.34Å; F85-F427 AromaticContact CE2-CE2 3.49Å; F85-F427 HydrophobicContact CE2-CE2 3.49Å; F85-F427 VanDerWaalsContact CE2-CE2 3.49Å; F85-F427 HydrophobicContact CE2-CG 4.14Å; F85-F427 HydrophobicContact CE2-CZ 4.4Å; F85-F427 AromaticContact CZ-CD2 3.73Å; F85-F427 HydrophobicContact CZ-CD2 3.73Å; F85-F427 AromaticContact CZ-CE2 3.34Å; F85-F427 HydrophobicContact CZ-CE2 3.34Å; F85-F427 AromaticContact CZ-CZ 3.96Å; F85-F427 HydrophobicContact CZ-CZ 3.96Å; V88-F427 HydrophobicContact CG1-CB 4.04Å; W393-F427 HydrophobicContact CE3-CZ 4.26Å; W393-F427 HydrophobicContact CZ3-CE2 4.13Å; W393-F427 AromaticContact CZ3-CZ 3.94Å; W393-F427 HydrophobicContact CZ3-CZ 3.94Å; M396-F427 HydrophobicContact CB-CE1 4.32Å; M396-F427 HydrophobicContact CB-CZ 4.16Å; V400-F427 HydrophobicContact CB-CD1 3.72Å; V400-F427 HydrophobicContact CB-CE1 4.12Å; V400-F427 HydrophobicContact CG1-CB 4.42Å; V400-F427 HydrophobicContact CG1-CD1 3.93Å; V400-F427 HydrophobicContact CG2-CD1 3.51Å; V400-F427 HydrophobicContact CG2-CE1 3.58Å; V400-F427 HydrophobicContact CG2-CG 4.43Å; Y423-F427 WeakPolarHBondContact O-CB 3.31Å; Y423-F427 PolarHBondContact O-N 3.26Å; P424-F427 PolarHBondContact O-N 2.92Å; V425-F427 VanDerWaalsContact C-N 3.31Å; V425-F427 PolarHBondContact O-N 3.05Å; F427-L429 PolarHBondContact O-N 3.45Å; F427-C430 PolarHBondContact O-N 3.21Å; F427-A431 WeakPolarHBondContact O-CB 3.38Å; F427-A431 PolarHBondContact O-N 3.47Å |
| 428 | C | 95.8 | Very high | 93.6 | Very high | 25 Ų | 25 | 54.1 Ų | 54.1 | 17% | 0.169 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.1 | -40.7 | 177 | -73.2 | 0 | 0 | 0 | 0 | 112.2 | P424 V425 V426 A431 V432 | P424-C428 WeakPolarHBondContact O-CB 3.35Å; P424-C428 PolarHBondContact O-N 3.42Å; P424-C428 PolarHBondContact O-SG 3.49Å; V425-C428 PolarHBondContact O-N 3.31Å; V426-C428 PolarHBondContact O-N 3.37Å; C428-A431 PolarHBondContact O-N 3.49Å; C428-V432 VanDerWaalsContact O-CG2 3.29Å; C428-V432 WeakPolarHBondContact O-CG2 3.47Å; C428-V432 PolarHBondContact O-N 3.38Å |
| 429 | L | 95.6 | Very high | 93.6 | Very high | 116 Ų | 116 | 50.1 Ų | 50.1 | 61% | 0.607 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -62.9 | -44.9 | 176.2 | -71.2 | 173.6 | 0 | 0 | 0 | 111.7 | V425 V426 F427 V432 F433 | V425-L429 HydrophobicContact CG1-CD1 4.13Å; V425-L429 HydrophobicContact CG1-CG 4.48Å; V425-L429 WeakPolarHBondContact O-CG 3.49Å; V425-L429 PolarHBondContact O-N 3.31Å; V426-L429 PolarHBondContact O-N 3.06Å; F427-L429 PolarHBondContact O-N 3.45Å; L429-V432 PolarHBondContact O-N 3.2Å; L429-F433 PolarHBondContact O-N 3Å |
| 430 | C | 94.4 | Very high | 93.6 | Very high | 48 Ų | 48 | 55.1 Ų | 55.1 | 32% | 0.324 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -65.3 | -39.2 | 175.2 | -70.5 | 0 | 0 | 0 | 0 | 112.1 | F85 V426 F427 V432 F433 L434 | F85-C430 HydrophobicContact CD2-CB 3.55Å; F85-C430 HydrophobicContact CE2-CB 3.25Å; F85-C430 HydrophobicContact CZ-CB 4.16Å; V426-C430 PolarHBondContact O-N 2.87Å; V426-C430 PolarHBondContact O-SG 2.89Å; V426-C430 VanDerWaalsContact O-SG 3.41Å; F427-C430 PolarHBondContact O-N 3.21Å; C430-V432 VanDerWaalsContact C-N 3.33Å; C430-V432 PolarHBondContact O-N 2.9Å; C430-F433 WeakPolarHBondContact O-CB 3.26Å; C430-F433 PolarHBondContact O-N 3.15Å; C430-L434 WeakPolarHBondContact O-CB 3.4Å; C430-L434 WeakPolarHBondContact O-CG 3.43Å; C430-L434 PolarHBondContact O-N 3.29Å |
| 431 | A | 94.6 | Very high | 93.2 | Very high | 4 Ų | 4 | 53.1 Ų | 53.1 | 3% | 0.033 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.8 | -39 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | F427 C428 L434 V435 | F427-A431 WeakPolarHBondContact O-CB 3.38Å; F427-A431 PolarHBondContact O-N 3.47Å; C428-A431 PolarHBondContact O-N 3.49Å; A431-L434 PolarHBondContact O-N 3.24Å; A431-V435 WeakPolarHBondContact O-CG2 3.43Å; A431-V435 PolarHBondContact O-N 3.46Å |
| 432 | V | 95 | Very high | 92.9 | Very high | 93 Ų | 93 | 50 Ų | 50 | 56% | 0.564 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -62.9 | -43.8 | 172.8 | 168.8 | 0 | 0 | 0 | 0 | 110.8 | C428 L429 C430 L434 V435 A436 | C428-V432 VanDerWaalsContact O-CG2 3.29Å; C428-V432 WeakPolarHBondContact O-CG2 3.47Å; C428-V432 PolarHBondContact O-N 3.38Å; L429-V432 PolarHBondContact O-N 3.2Å; C430-V432 VanDerWaalsContact C-N 3.33Å; C430-V432 PolarHBondContact O-N 2.9Å; V432-L434 VanDerWaalsContact C-N 3.34Å; V432-L434 PolarHBondContact O-N 3.24Å; V432-V435 PolarHBondContact O-N 2.87Å; V432-A436 WeakPolarHBondContact O-CB 3.18Å; V432-A436 PolarHBondContact O-N 3.38Å |
| 433 | F | 94.1 | Very high | 92.6 | Very high | 75 Ų | 75 | 46.6 Ų | 46.6 | 33% | 0.329 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -57.2 | -48.3 | 173.7 | 171.1 | -93.4 | 0 | 0 | 0 | 111.5 | A232 L235 L429 C430 V435 A436 V437 | A232-F433 HydrophobicContact CB-CE1 4.09Å; A232-F433 HydrophobicContact CB-CZ 4.31Å; L235-F433 HydrophobicContact CD1-CE1 4.09Å; L429-F433 PolarHBondContact O-N 3Å; C430-F433 WeakPolarHBondContact O-CB 3.26Å; C430-F433 PolarHBondContact O-N 3.15Å; F433-V435 PolarHBondContact O-N 2.67Å; F433-A436 PolarHBondContact O-N 3.46Å; F433-V437 HydrophobicContact CD2-CG2 3.65Å; F433-V437 HydrophobicContact CE2-CB 4.49Å; F433-V437 HydrophobicContact CE2-CG2 3.56Å; F433-V437 HydrophobicContact CG-CG2 4.33Å; F433-V437 HydrophobicContact CZ-CG2 4.15Å; F433-V437 WeakPolarHBondContact O-CB 3.45Å; F433-V437 WeakPolarHBondContact O-CG2 3.44Å; F433-V437 PolarHBondContact O-N 3.16Å |
| 434 | L | 92.9 | Very high | 92.4 | Very high | 4 Ų | 4 | 48.3 Ų | 48.3 | 2% | 0.021 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.9 | -22.6 | 179.1 | -72.8 | 175.7 | 0 | 0 | 0 | 113.3 | F85 L235 Y236 L239 W393 C430 A431 V432 P438 | F85-L434 HydrophobicContact CD1-CD1 4.42Å; F85-L434 HydrophobicContact CE1-CD1 3.62Å; F85-L434 HydrophobicContact CZ-CD1 3.81Å; L235-L434 HydrophobicContact CB-CD2 3.98Å; L235-L434 HydrophobicContact CD1-CD2 4.31Å; Y236-L434 HydrophobicContact CD1-CD2 4.01Å; Y236-L434 HydrophobicContact CE1-CB 4.05Å; Y236-L434 HydrophobicContact CE1-CD2 3.94Å; Y236-L434 VanDerWaalsContact CE1-O 3.25Å; Y236-L434 WeakPolarHBondContact CE1-O 3.44Å; Y236-L434 VanDerWaalsContact CZ-O 3.22Å; Y236-L434 PolarHBondContact OH-O 2.79Å; L239-L434 HydrophobicContact CD1-CD1 3.51Å; L239-L434 HydrophobicContact CD1-CD2 4.14Å; L239-L434 HydrophobicContact CD1-CG 4.5Å; W393-L434 HydrophobicContact CB-CB 4.44Å; W393-L434 HydrophobicContact CB-CD1 4.46Å; W393-L434 HydrophobicContact CD2-CD1 4.15Å; W393-L434 HydrophobicContact CG-CD1 4.03Å; C430-L434 WeakPolarHBondContact O-CB 3.4Å; C430-L434 WeakPolarHBondContact O-CG 3.43Å; C430-L434 PolarHBondContact O-N 3.29Å; A431-L434 PolarHBondContact O-N 3.24Å; V432-L434 VanDerWaalsContact C-N 3.34Å; V432-L434 PolarHBondContact O-N 3.24Å; L434-P438 WeakPolarHBondContact O-CD 3.41Å; L434-P438 WeakPolarHBondContact O-CG 3.46Å |
| 435 | V | 92.9 | Very high | 92 | Very high | 22 Ų | 22 | 49.2 Ų | 49.2 | 13% | 0.133 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -95.2 | -41.7 | 176.4 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | F390 F394 A431 V432 F433 L439 | F390-V435 HydrophobicContact CE2-CB 4.47Å; F390-V435 HydrophobicContact CE2-CG1 3.72Å; F390-V435 HydrophobicContact CZ-CG1 3.94Å; F394-V435 HydrophobicContact CB-CG2 3.9Å; F394-V435 HydrophobicContact CD2-CG1 4.31Å; F394-V435 HydrophobicContact CD2-CG2 4.4Å; A431-V435 WeakPolarHBondContact O-CG2 3.43Å; A431-V435 PolarHBondContact O-N 3.46Å; V432-V435 PolarHBondContact O-N 2.87Å; F433-V435 PolarHBondContact O-N 2.67Å; V435-L439 WeakPolarHBondContact O-CG 3.28Å |
| 436 | A | 92.9 | Very high | 91.7 | Very high | 45 Ų | 45 | 46.1 Ų | 46.1 | 37% | 0.372 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -74.2 | -37.6 | -172.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | V432 F433 L439 | V432-A436 WeakPolarHBondContact O-CB 3.18Å; V432-A436 PolarHBondContact O-N 3.38Å; F433-A436 PolarHBondContact O-N 3.46Å; A436-L439 WeakPolarHBondContact O-CB 3.39Å; A436-L439 PolarHBondContact O-N 2.91Å |
| 437 | V | 92 | Very high | 91.4 | Very high | 12 Ų | 12 | 48.5 Ų | 48.5 | 7% | 0.073 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.7 | -44.1 | -177.2 | 168 | 0 | 0 | 0 | 0 | 112.8 | P228 A232 F433 L439 Y440 S441 | P228-V437 WeakPolarHBondContact O-CG1 3.36Å; A232-V437 HydrophobicContact CB-CB 4.01Å; A232-V437 HydrophobicContact CB-CG1 3.49Å; A232-V437 VanDerWaalsContact CB-CG1 3.49Å; F433-V437 HydrophobicContact CD2-CG2 3.65Å; F433-V437 HydrophobicContact CE2-CB 4.49Å; F433-V437 HydrophobicContact CE2-CG2 3.56Å; F433-V437 HydrophobicContact CG-CG2 4.33Å; F433-V437 HydrophobicContact CZ-CG2 4.15Å; F433-V437 WeakPolarHBondContact O-CB 3.45Å; F433-V437 WeakPolarHBondContact O-CG2 3.44Å; F433-V437 PolarHBondContact O-N 3.16Å; V437-L439 PolarHBondContact O-N 2.98Å; V437-Y440 VanDerWaalsContact CA-CE1 3.46Å; V437-Y440 HydrophobicContact CB-CE1 4.11Å; V437-Y440 HydrophobicContact CG1-CE1 4.18Å; V437-Y440 HydrophobicContact CG1-CE2 4.31Å; V437-Y440 WeakPolarHBondContact CG1-OH 3.34Å; V437-Y440 HydrophobicContact CG2-CE1 4.1Å; V437-Y440 VanDerWaalsContact O-CD1 3.24Å; V437-Y440 WeakPolarHBondContact O-CD1 3.44Å; V437-Y440 WeakPolarHBondContact O-CE1 3.39Å; V437-Y440 PolarHBondContact O-N 3Å; V437-S441 PolarHBondContact O-N 2.97Å; V437-S441 VanDerWaalsContact O-N 3.14Å; V437-S441 PolarHBondContact O-OG 3.3Å |
| 438 | P | 89.6 | Confident | 91.1 | Very high | 1 Ų | 1 | 51.4 Ų | 51.4 | 1% | 0.006 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.2 | -18.5 | 176 | -30 | 43.6 | 0 | 0 | 0 | 114.2 | A232 Y236 L434 Y440 S441 D442 S446 | A232-P438 HydrophobicContact CB-CG 4.19Å; Y236-P438 HydrophobicContact CE1-CG 4.15Å; Y236-P438 HydrophobicContact CE2-CB 4.24Å; Y236-P438 HydrophobicContact CE2-CG 3.95Å; Y236-P438 WeakPolarHBondContact OH-CG 3.18Å; L434-P438 WeakPolarHBondContact O-CD 3.41Å; L434-P438 WeakPolarHBondContact O-CG 3.46Å; P438-Y440 PolarHBondContact O-N 3.16Å; P438-S441 PolarHBondContact O-N 2.99Å; P438-D442 CarbonylContact O-C 3.55Å; P438-D442 WeakPolarHBondContact O-CA 3.31Å; P438-D442 PolarHBondContact O-N 2.93Å; P438-S446 PolarHBondContact O-OG 3.09Å |
| 439 | L | 89.8 | Confident | 90.7 | Very high | 66 Ų | 66 | 50.3 Ų | 50.3 | 35% | 0.346 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.6 | -29.1 | 174.6 | -74 | 170.5 | 0 | 0 | 0 | 113.7 | F390 V435 A436 V437 T443 I450 | F390-L439 HydrophobicContact CE2-CD2 4.09Å; F390-L439 HydrophobicContact CE2-CG 4.28Å; F390-L439 HydrophobicContact CZ-CD2 4.18Å; V435-L439 WeakPolarHBondContact O-CG 3.28Å; A436-L439 WeakPolarHBondContact O-CB 3.39Å; A436-L439 PolarHBondContact O-N 2.91Å; V437-L439 PolarHBondContact O-N 2.98Å; L439-T443 WeakPolarHBondContact O-CA 3.33Å; L439-T443 WeakPolarHBondContact O-CB 3.44Å; L439-T443 WeakPolarHBondContact O-CG2 3.27Å; L439-T443 PolarHBondContact O-OG1 3.49Å; L439-I450 HydrophobicContact CD2-CD1 3.71Å |
| 440 | Y | 88.4 | Confident | 90.5 | Very high | 132 Ų | 132 | 47.5 Ų | 47.5 | 52% | 0.518 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -101.2 | -32.3 | 173.6 | 63.2 | -100.4 | 0 | 0 | 0 | 112.4 | V437 P438 T443 | V437-Y440 VanDerWaalsContact CA-CE1 3.46Å; V437-Y440 HydrophobicContact CB-CE1 4.11Å; V437-Y440 HydrophobicContact CG1-CE1 4.18Å; V437-Y440 HydrophobicContact CG1-CE2 4.31Å; V437-Y440 WeakPolarHBondContact CG1-OH 3.34Å; V437-Y440 HydrophobicContact CG2-CE1 4.1Å; V437-Y440 VanDerWaalsContact O-CD1 3.24Å; V437-Y440 WeakPolarHBondContact O-CD1 3.44Å; V437-Y440 WeakPolarHBondContact O-CE1 3.39Å; V437-Y440 PolarHBondContact O-N 3Å; P438-Y440 PolarHBondContact O-N 3.16Å; Y440-T443 PolarHBondContact O-OG1 3.15Å |
| 441 | S | 85.7 | Confident | 90.4 | Very high | 46 Ų | 46 | 48 Ų | 48 | 32% | 0.322 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -77.7 | -38.1 | -176.3 | -46.2 | 0 | 0 | 0 | 0 | 112.4 | G229 V437 P438 | G229-S441 WeakPolarHBondContact CA-OG 3.43Å; V437-S441 PolarHBondContact O-N 2.97Å; V437-S441 VanDerWaalsContact O-N 3.14Å; V437-S441 PolarHBondContact O-OG 3.3Å; P438-S441 PolarHBondContact O-N 2.99Å |
| 442 | D | 86.6 | Confident | 90.2 | Very high | 27 Ų | 27 | 49.8 Ų | 49.8 | 14% | 0.144 | 28% | 0.276 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -133.3 | 60.3 | 178.9 | -169.3 | 6.1 | 0 | 0 | 0 | 109.9 | L233 N386 P438 L444 N445 S446 | L233-D442 HydrophobicContact CD2-CB 4.31Å; N386-D442 PolarHBondContact ND2-OD2 3.23Å; P438-D442 CarbonylContact O-C 3.55Å; P438-D442 WeakPolarHBondContact O-CA 3.31Å; P438-D442 PolarHBondContact O-N 2.93Å; D442-L444 PolarHBondContact O-N 2.93Å; D442-N445 PolarHBondContact O-N 3.25Å; D442-N445 WeakPolarHBondContact OD1-CB 3.4Å; D442-N445 VanDerWaalsContact OD1-CG 3.3Å; D442-N445 PolarHBondContact OD1-ND2 2.93Å; D442-N445 WeakPolarHBondContact OD2-CB 3.46Å; D442-N445 PolarHBondContact OD2-ND2 3.49Å; D442-S446 WeakPolarHBondContact O-CB 3.28Å; D442-S446 PolarHBondContact O-N 3.32Å; D442-S446 VanDerWaalsContact O-N 3.11Å; D442-S446 PolarHBondContact O-OG 3.27Å |
| 443 | T | 89.2 | Confident | 90.1 | Very high | 66 Ų | 66 | 46.1 Ų | 46.1 | 41% | 0.405 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59.2 | -46.1 | -168.5 | -55.2 | 0 | 0 | 0 | 0 | 111.9 | L439 Y440 S446 L447 | L439-T443 WeakPolarHBondContact O-CA 3.33Å; L439-T443 WeakPolarHBondContact O-CB 3.44Å; L439-T443 WeakPolarHBondContact O-CG2 3.27Å; L439-T443 PolarHBondContact O-OG1 3.49Å; Y440-T443 PolarHBondContact O-OG1 3.15Å; T443-S446 PolarHBondContact O-N 3.47Å; T443-L447 HydrophobicContact CG2-CD1 3.75Å; T443-L447 HydrophobicContact CG2-CG 4.19Å; T443-L447 WeakPolarHBondContact O-CB 3.3Å; T443-L447 VanDerWaalsContact O-CG 3.23Å; T443-L447 WeakPolarHBondContact O-CG 3.14Å; T443-L447 PolarHBondContact O-N 3.27Å |
| 444 | L | 89 | Confident | 90 | Very high | 119 Ų | 119 | 47.6 Ų | 47.6 | 62% | 0.623 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -64.1 | -48.3 | -174.9 | -178.6 | 63.3 | 0 | 0 | 0 | 111.1 | D442 S446 L447 I448 | D442-L444 PolarHBondContact O-N 2.93Å; L444-S446 VanDerWaalsContact C-N 3.33Å; L444-S446 PolarHBondContact O-N 3.25Å; L444-L447 PolarHBondContact O-N 3.45Å; L444-I448 HydrophobicContact CD1-CD1 4.25Å; L444-I448 HydrophobicContact CG-CD1 4.05Å; L444-I448 VanDerWaalsContact O-CG1 3.29Å; L444-I448 WeakPolarHBondContact O-CG1 3.46Å; L444-I448 PolarHBondContact O-N 3.12Å |
| 445 | N | 86.9 | Confident | 90.1 | Very high | 19 Ų | 19 | 49.7 Ų | 49.7 | 10% | 0.102 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -67.1 | -39 | -177.3 | -65.2 | -31.1 | 0 | 0 | 0 | 111.5 | Q383 Y387 D442 I448 G449 | Q383-N445 PolarHBondContact NE2-OD1 2.92Å; Y387-N445 HydrophobicContact CD1-CB 3.97Å; Y387-N445 HydrophobicContact CE1-CB 3.51Å; Y387-N445 PolarHBondContact OH-OD1 3.39Å; D442-N445 PolarHBondContact O-N 3.25Å; D442-N445 WeakPolarHBondContact OD1-CB 3.4Å; D442-N445 VanDerWaalsContact OD1-CG 3.3Å; D442-N445 PolarHBondContact OD1-ND2 2.93Å; D442-N445 WeakPolarHBondContact OD2-CB 3.46Å; D442-N445 PolarHBondContact OD2-ND2 3.49Å; N445-I448 PolarHBondContact O-N 3.34Å; N445-G449 PolarHBondContact O-N 3.45Å; N445-G449 VanDerWaalsContact O-N 3.08Å |
| 446 | S | 88.1 | Confident | 90 | Very high | 3 Ų | 3 | 48.7 Ų | 48.7 | 2% | 0.021 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.2 | -43.1 | 176 | -56.5 | 0 | 0 | 0 | 0 | 112.1 | P438 D442 T443 L444 G449 I450 | P438-S446 PolarHBondContact O-OG 3.09Å; D442-S446 WeakPolarHBondContact O-CB 3.28Å; D442-S446 PolarHBondContact O-N 3.32Å; D442-S446 VanDerWaalsContact O-N 3.11Å; D442-S446 PolarHBondContact O-OG 3.27Å; T443-S446 PolarHBondContact O-N 3.47Å; L444-S446 VanDerWaalsContact C-N 3.33Å; L444-S446 PolarHBondContact O-N 3.25Å; S446-G449 PolarHBondContact O-N 3.04Å; S446-I450 WeakPolarHBondContact O-CG1 3.44Å; S446-I450 PolarHBondContact O-N 3.45Å |
| 447 | L | 90.5 | Very high | 90 | Very high | 95 Ų | 95 | 48.4 Ų | 48.4 | 50% | 0.497 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -65.2 | -38.2 | 177.2 | -74.9 | 177.1 | 0 | 0 | 0 | 112.5 | T443 L444 G449 I450 A451 | T443-L447 HydrophobicContact CG2-CD1 3.75Å; T443-L447 HydrophobicContact CG2-CG 4.19Å; T443-L447 WeakPolarHBondContact O-CB 3.3Å; T443-L447 VanDerWaalsContact O-CG 3.23Å; T443-L447 WeakPolarHBondContact O-CG 3.14Å; T443-L447 PolarHBondContact O-N 3.27Å; L444-L447 PolarHBondContact O-N 3.45Å; L447-G449 VanDerWaalsContact C-N 3.34Å; L447-I450 PolarHBondContact O-N 3.31Å; L447-A451 VanDerWaalsContact O-CB 3.31Å; L447-A451 WeakPolarHBondContact O-CB 3.34Å; L447-A451 PolarHBondContact O-N 3.42Å |
| 448 | I | 88.4 | Confident | 90 | Very high | 61 Ų | 61 | 51.3 Ų | 51.3 | 31% | 0.313 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.1 | -45.8 | 173.7 | -68.8 | 165.1 | 0 | 0 | 0 | 110 | Y387 L444 N445 I450 A451 I452 | Y387-I448 HydrophobicContact CE1-CB 4.22Å; Y387-I448 HydrophobicContact CE1-CD1 4.43Å; Y387-I448 HydrophobicContact CE1-CG2 4.2Å; L444-I448 HydrophobicContact CD1-CD1 4.25Å; L444-I448 HydrophobicContact CG-CD1 4.05Å; L444-I448 VanDerWaalsContact O-CG1 3.29Å; L444-I448 WeakPolarHBondContact O-CG1 3.46Å; L444-I448 PolarHBondContact O-N 3.12Å; N445-I448 PolarHBondContact O-N 3.34Å; I448-I450 PolarHBondContact O-N 3.28Å; I448-A451 PolarHBondContact O-N 3.39Å; I448-I452 HydrophobicContact CG2-CD1 3.82Å; I448-I452 HydrophobicContact CG2-CG1 4.46Å; I448-I452 WeakPolarHBondContact O-CG1 3.44Å; I448-I452 PolarHBondContact O-N 3.21Å |
| 449 | G | 87.5 | Confident | 90 | Very high | 3 Ų | 3 | 54 Ų | 54 | 3% | 0.031 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58 | -45.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | N445 S446 L447 I452 A453 | N445-G449 PolarHBondContact O-N 3.45Å; N445-G449 VanDerWaalsContact O-N 3.08Å; S446-G449 PolarHBondContact O-N 3.04Å; L447-G449 VanDerWaalsContact C-N 3.34Å; G449-I452 PolarHBondContact O-N 3.42Å; G449-A453 PolarHBondContact O-N 3.37Å |
| 450 | I | 91.6 | Very high | 89.9 | Confident | 57 Ų | 57 | 52.1 Ų | 52.1 | 29% | 0.292 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.6 | -45.5 | 175.3 | -67.9 | 168.6 | 0 | 0 | 0 | 111.1 | F390 L439 S446 L447 I448 I452 A453 L454 | F390-I450 HydrophobicContact CE1-CD1 4.39Å; F390-I450 HydrophobicContact CE1-CG1 3.79Å; F390-I450 HydrophobicContact CZ-CD1 3.94Å; F390-I450 HydrophobicContact CZ-CG1 3.85Å; L439-I450 HydrophobicContact CD2-CD1 3.71Å; S446-I450 WeakPolarHBondContact O-CG1 3.44Å; S446-I450 PolarHBondContact O-N 3.45Å; L447-I450 PolarHBondContact O-N 3.31Å; I448-I450 PolarHBondContact O-N 3.28Å; I450-I452 VanDerWaalsContact C-N 3.33Å; I450-I452 PolarHBondContact O-N 3.48Å; I450-A453 PolarHBondContact O-N 3.41Å; I450-L454 HydrophobicContact CG2-CD1 3.69Å; I450-L454 HydrophobicContact CG2-CG 4.09Å; I450-L454 WeakPolarHBondContact O-CB 3.26Å; I450-L454 VanDerWaalsContact O-CG 3.32Å; I450-L454 WeakPolarHBondContact O-CG 3.29Å; I450-L454 PolarHBondContact O-N 3.16Å |
| 451 | A | 92.8 | Very high | 89.9 | Confident | 58 Ų | 58 | 50.3 Ų | 50.3 | 48% | 0.479 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.7 | -42.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L447 I448 L454 S455 | L447-A451 VanDerWaalsContact O-CB 3.31Å; L447-A451 WeakPolarHBondContact O-CB 3.34Å; L447-A451 PolarHBondContact O-N 3.42Å; I448-A451 PolarHBondContact O-N 3.39Å; A451-L454 PolarHBondContact O-N 3.39Å; A451-S455 WeakPolarHBondContact O-CB 3.29Å; A451-S455 PolarHBondContact O-N 2.89Å |
| 452 | I | 91.1 | Very high | 89.8 | Confident | 42 Ų | 42 | 51.4 Ų | 51.4 | 22% | 0.215 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66 | -42.5 | 175.5 | -65.8 | 167.8 | 0 | 0 | 0 | 110.6 | W124 L128 I129 I448 G449 I450 L454 S455 | W124-I452 PolarHBondContact NE1-O 3.27Å; L128-I452 HydrophobicContact CB-CG2 3.89Å; L128-I452 HydrophobicContact CD1-CG2 3.9Å; I129-I452 HydrophobicContact CD1-CB 3.76Å; I129-I452 HydrophobicContact CD1-CD1 4.08Å; I129-I452 HydrophobicContact CD1-CG2 3.65Å; I129-I452 HydrophobicContact CG1-CB 4.29Å; I129-I452 HydrophobicContact CG1-CD1 4.23Å; I129-I452 HydrophobicContact CG1-CG2 3.68Å; I448-I452 HydrophobicContact CG2-CD1 3.82Å; I448-I452 HydrophobicContact CG2-CG1 4.46Å; I448-I452 WeakPolarHBondContact O-CG1 3.44Å; I448-I452 PolarHBondContact O-N 3.21Å; G449-I452 PolarHBondContact O-N 3.42Å; I450-I452 VanDerWaalsContact C-N 3.33Å; I450-I452 PolarHBondContact O-N 3.48Å; I452-L454 PolarHBondContact O-N 3.46Å; I452-S455 WeakPolarHBondContact O-CB 3.47Å; I452-S455 PolarHBondContact O-N 2.97Å; I452-S455 PolarHBondContact O-OG 3.46Å |
| 453 | A | 91.2 | Very high | 89.4 | Confident | 16 Ų | 16 | 51.2 Ų | 51.2 | 13% | 0.132 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.9 | -45.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | I121 G449 I450 S455 G456 | I121-A453 HydrophobicContact CG2-CB 4.42Å; G449-A453 PolarHBondContact O-N 3.37Å; I450-A453 PolarHBondContact O-N 3.41Å; A453-S455 VanDerWaalsContact C-N 3.31Å; A453-S455 PolarHBondContact O-N 3.23Å; A453-G456 PolarHBondContact O-N 3.41Å; A453-G456 VanDerWaalsContact O-N 3.14Å |
| 454 | L | 93.3 | Very high | 89 | Confident | 105 Ų | 105 | 49.8 Ų | 49.8 | 55% | 0.55 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -69.3 | -25.6 | 178.1 | -69.5 | 179 | 0 | 0 | 0 | 113.3 | I450 A451 I452 G456 V457 P458 | I450-L454 HydrophobicContact CG2-CD1 3.69Å; I450-L454 HydrophobicContact CG2-CG 4.09Å; I450-L454 WeakPolarHBondContact O-CB 3.26Å; I450-L454 VanDerWaalsContact O-CG 3.32Å; I450-L454 WeakPolarHBondContact O-CG 3.29Å; I450-L454 PolarHBondContact O-N 3.16Å; A451-L454 PolarHBondContact O-N 3.39Å; I452-L454 PolarHBondContact O-N 3.46Å; L454-G456 PolarHBondContact O-N 3.36Å; L454-G456 VanDerWaalsContact O-N 3.14Å; L454-V457 HydrophobicContact CD2-CG2 4.32Å; L454-V457 VanDerWaalsContact O-CB 3.3Å; L454-V457 WeakPolarHBondContact O-CB 3.3Å; L454-V457 WeakPolarHBondContact O-CG2 3.37Å; L454-V457 PolarHBondContact O-N 2.93Å; L454-P458 WeakPolarHBondContact O-CD 3.19Å |
| 455 | S | 94.6 | Very high | 88.7 | Confident | 49 Ų | 49 | 51.7 Ų | 51.7 | 34% | 0.343 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -60.7 | -20.7 | 171.8 | 79.6 | 0 | 0 | 0 | 0 | 112.5 | W124 A451 I452 A453 V457 P458 V459 | W124-S455 PolarHBondContact NE1-OG 3.46Å; W124-S455 VanDerWaalsContact NE1-OG 3.13Å; A451-S455 WeakPolarHBondContact O-CB 3.29Å; A451-S455 PolarHBondContact O-N 2.89Å; I452-S455 WeakPolarHBondContact O-CB 3.47Å; I452-S455 PolarHBondContact O-N 2.97Å; I452-S455 PolarHBondContact O-OG 3.46Å; A453-S455 VanDerWaalsContact C-N 3.31Å; A453-S455 PolarHBondContact O-N 3.23Å; S455-V457 VanDerWaalsContact C-N 3.29Å; S455-V457 PolarHBondContact O-N 3.08Å; S455-P458 VanDerWaalsContact O-CD 3.27Å; S455-P458 WeakPolarHBondContact O-CD 3.21Å; S455-P458 VanDerWaalsContact O-CG 3.28Å; S455-P458 WeakPolarHBondContact O-CG 3.4Å; S455-V459 WeakPolarHBondContact O-CG2 3.29Å |
| 456 | G | 91.4 | Very high | 88.3 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -69.1 | -24.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | F120 W124 A453 L454 V459 Y460 | F120-G456 WeakPolarHBondContact CE1-O 3.23Å; W124-G456 VanDerWaalsContact CD1-CA 3.44Å; A453-G456 PolarHBondContact O-N 3.41Å; A453-G456 VanDerWaalsContact O-N 3.14Å; L454-G456 PolarHBondContact O-N 3.36Å; L454-G456 VanDerWaalsContact O-N 3.14Å; G456-V459 PolarHBondContact O-N 2.99Å; G456-Y460 WeakPolarHBondContact O-CB 3.37Å; G456-Y460 PolarHBondContact O-N 3.23Å |
| 457 | V | 92.7 | Very high | 87.5 | Confident | 40 Ų | 40 | 56.1 Ų | 56.1 | 24% | 0.242 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.8 | -54.7 | -178.4 | -179.6 | 0 | 0 | 0 | 0 | 112.5 | F117 I121 L454 S455 V459 Y460 F461 | F117-V457 HydrophobicContact CE2-CG1 4.32Å; F117-V457 HydrophobicContact CE2-CG2 4.27Å; F117-V457 HydrophobicContact CZ-CG1 4.34Å; F117-V457 HydrophobicContact CZ-CG2 3.96Å; I121-V457 HydrophobicContact CD1-CG2 3.93Å; L454-V457 HydrophobicContact CD2-CG2 4.32Å; L454-V457 VanDerWaalsContact O-CB 3.3Å; L454-V457 WeakPolarHBondContact O-CB 3.3Å; L454-V457 WeakPolarHBondContact O-CG2 3.37Å; L454-V457 PolarHBondContact O-N 2.93Å; S455-V457 VanDerWaalsContact C-N 3.29Å; S455-V457 PolarHBondContact O-N 3.08Å; V457-V459 VanDerWaalsContact C-N 3.26Å; V457-V459 PolarHBondContact O-N 2.85Å; V457-Y460 PolarHBondContact O-N 3.27Å; V457-F461 HydrophobicContact CG1-CD2 3.88Å; V457-F461 HydrophobicContact CG1-CE2 3.74Å; V457-F461 VanDerWaalsContact O-CD2 3.26Å; V457-F461 WeakPolarHBondContact O-CD2 3.34Å; V457-F461 PolarHBondContact O-N 3.36Å; V457-F461 VanDerWaalsContact O-N 3.15Å |
| 458 | P | 91 | Very high | 86.5 | Confident | 73 Ų | 73 | 58 Ų | 58 | 47% | 0.474 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.8 | -35.6 | 176.8 | 23.8 | -34.2 | 0 | 0 | 0 | 112.2 | L454 S455 F461 L462 | L454-P458 WeakPolarHBondContact O-CD 3.19Å; S455-P458 VanDerWaalsContact O-CD 3.27Å; S455-P458 WeakPolarHBondContact O-CD 3.21Å; S455-P458 VanDerWaalsContact O-CG 3.28Å; S455-P458 WeakPolarHBondContact O-CG 3.4Å; P458-F461 PolarHBondContact O-N 2.91Å; P458-L462 WeakPolarHBondContact O-CB 3.25Å; P458-L462 VanDerWaalsContact O-CG 3.24Å; P458-L462 WeakPolarHBondContact O-CG 3.45Å; P458-L462 PolarHBondContact O-N 2.97Å |
| 459 | V | 89.6 | Confident | 85.6 | Confident | 57 Ų | 57 | 60.4 Ų | 60.4 | 35% | 0.345 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 178.4 | -178.5 | 0 | 0 | 0 | 0 | 111.4 | F120 W124 S455 G456 V457 G463 | F120-V459 HydrophobicContact CZ-CB 4.19Å; F120-V459 HydrophobicContact CZ-CG1 3.93Å; W124-V459 HydrophobicContact CH2-CB 4.35Å; W124-V459 HydrophobicContact CH2-CG1 4.02Å; W124-V459 HydrophobicContact CH2-CG2 3.93Å; W124-V459 HydrophobicContact CZ2-CG2 3.97Å; W124-V459 HydrophobicContact CZ3-CG1 3.91Å; S455-V459 WeakPolarHBondContact O-CG2 3.29Å; G456-V459 PolarHBondContact O-N 2.99Å; V457-V459 VanDerWaalsContact C-N 3.26Å; V457-V459 PolarHBondContact O-N 2.85Å; V459-G463 WeakPolarHBondContact O-CA 3.35Å; V459-G463 PolarHBondContact O-N 3.44Å |
| 460 | Y | 88.7 | Confident | 85.1 | Confident | 27 Ų | 27 | 67.5 Ų | 67.5 | 11% | 0.106 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -61.6 | -48 | 176 | 180 | -99.7 | 0 | 0 | 0 | 111.6 | F117 F120 G456 V457 L462 V464 Y465 | F117-Y460 HydrophobicContact CB-CE1 3.96Å; F117-Y460 AromaticContact CD2-CD1 3.42Å; F117-Y460 HydrophobicContact CD2-CD1 3.42Å; F117-Y460 VanDerWaalsContact CD2-CD1 3.42Å; F117-Y460 HydrophobicContact CD2-CD2 4.44Å; F117-Y460 AromaticContact CD2-CE1 3.65Å; F117-Y460 HydrophobicContact CD2-CE1 3.65Å; F117-Y460 AromaticContact CD2-CG 3.83Å; F117-Y460 HydrophobicContact CD2-CG 3.83Å; F117-Y460 HydrophobicContact CE2-CD1 4.06Å; F117-Y460 HydrophobicContact CE2-CG 4.38Å; F117-Y460 HydrophobicContact CG-CD1 4.45Å; F117-Y460 HydrophobicContact CG-CE1 4.26Å; F117-Y460 PolarHBondContact N-OH 3.15Å; F120-Y460 HydrophobicContact CB-CD2 3.47Å; F120-Y460 VanDerWaalsContact CB-CD2 3.47Å; F120-Y460 HydrophobicContact CB-CE2 3.79Å; F120-Y460 HydrophobicContact CB-CG 4.49Å; F120-Y460 AromaticContact CD1-CD2 3.76Å; F120-Y460 HydrophobicContact CD1-CD2 3.76Å; F120-Y460 HydrophobicContact CD1-CG 4.12Å; F120-Y460 AromaticContact CD2-CD2 3.84Å; F120-Y460 HydrophobicContact CD2-CD2 3.84Å; F120-Y460 AromaticContact CG-CD2 3.4Å; F120-Y460 HydrophobicContact CG-CD2 3.4Å; F120-Y460 HydrophobicContact CG-CE2 4.2Å; F120-Y460 HydrophobicContact CG-CG 4.22Å; G456-Y460 WeakPolarHBondContact O-CB 3.37Å; G456-Y460 PolarHBondContact O-N 3.23Å; V457-Y460 PolarHBondContact O-N 3.27Å; Y460-L462 PolarHBondContact O-N 3.3Å; Y460-V464 HydrophobicContact CD2-CB 3.77Å; Y460-V464 HydrophobicContact CD2-CG1 4.1Å; Y460-V464 HydrophobicContact CD2-CG2 4.05Å; Y460-V464 HydrophobicContact CE2-CB 3.85Å; Y460-V464 HydrophobicContact CE2-CG1 3.65Å; Y460-V464 HydrophobicContact CE2-CG2 4.43Å; Y460-V464 HydrophobicContact CG-CB 4.44Å; Y460-V464 WeakPolarHBondContact O-CA 3.3Å; Y460-V464 WeakPolarHBondContact O-CB 3.11Å; Y460-V464 PolarHBondContact O-N 2.86Å; Y460-Y465 HydrophobicContact CE1-CD2 4.47Å; Y460-Y465 PolarHBondContact O-N 3.43Å |
| 461 | F | 86.9 | Confident | 84.6 | Confident | 93 Ų | 93 | 67 Ų | 67 | 41% | 0.408 | 37% | 0.366 | S | S | . | . | I | π-helix | trans | -64.6 | -44 | -178.2 | -79.5 | -68.3 | 0 | 0 | 0 | 111.6 | F117 V457 P458 Y465 L466 | F117-F461 HydrophobicContact CE2-CE2 4.38Å; V457-F461 HydrophobicContact CG1-CD2 3.88Å; V457-F461 HydrophobicContact CG1-CE2 3.74Å; V457-F461 VanDerWaalsContact O-CD2 3.26Å; V457-F461 WeakPolarHBondContact O-CD2 3.34Å; V457-F461 PolarHBondContact O-N 3.36Å; V457-F461 VanDerWaalsContact O-N 3.15Å; P458-F461 PolarHBondContact O-N 2.91Å; F461-Y465 AromaticContact CD1-CD1 3.83Å; F461-Y465 HydrophobicContact CD1-CD1 3.83Å; F461-Y465 AromaticContact CD1-CG 3.96Å; F461-Y465 HydrophobicContact CD1-CG 3.96Å; F461-Y465 HydrophobicContact CE1-CD1 4.25Å; F461-Y465 HydrophobicContact CE1-CG 4.28Å; F461-L466 WeakPolarHBondContact O-CB 3.4Å; F461-L466 VanDerWaalsContact O-CD1 3.28Å; F461-L466 WeakPolarHBondContact O-CD1 3.41Å; F461-L466 WeakPolarHBondContact O-CG 3.47Å; F461-L466 PolarHBondContact O-N 3.47Å; F461-L466 VanDerWaalsContact O-N 3.09Å |
| 462 | L | 84.1 | Confident | 84.2 | Confident | 69 Ų | 69 | 66.6 Ų | 66.6 | 36% | 0.361 | 36% | 0.358 | S | S | . | . | I | π-helix | trans | -73.8 | -36.8 | -179.4 | -67.3 | 171.7 | 0 | 0 | 0 | 113.8 | P458 Y460 L466 P472 I475 | P458-L462 WeakPolarHBondContact O-CB 3.25Å; P458-L462 VanDerWaalsContact O-CG 3.24Å; P458-L462 WeakPolarHBondContact O-CG 3.45Å; P458-L462 PolarHBondContact O-N 2.97Å; Y460-L462 PolarHBondContact O-N 3.3Å; L462-L466 HydrophobicContact CD2-CD1 4.19Å; L462-P472 HydrophobicContact CD2-CG 4.37Å; L462-I475 HydrophobicContact CB-CD1 4.14Å; L462-I475 HydrophobicContact CD1-CD1 4.16Å; L462-I475 HydrophobicContact CD2-CD1 4.44Å; L462-I475 HydrophobicContact CG-CD1 4.49Å |
| 463 | G | 79.7 | Confident | 83.7 | Confident | 24 Ų | 24 | 69.5 Ų | 69.5 | 25% | 0.247 | 38% | 0.379 | C | S | . | . | I | π-helix | trans | -98.6 | -32.7 | -170.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | V459 R471 | V459-G463 WeakPolarHBondContact O-CA 3.35Å; V459-G463 PolarHBondContact O-N 3.44Å; G463-R471 PolarHBondContact O-NE 3.24Å; G463-R471 PolarHBondContact O-NH2 3.42Å |
| 464 | V | 80.7 | Confident | 83.4 | Confident | 35 Ų | 35 | 75.3 Ų | 75.3 | 21% | 0.212 | 41% | 0.407 | C | S | . | . | I | π-helix | trans | -115.8 | -52.1 | -171.2 | -177 | 0 | 0 | 0 | 0 | 111.4 | F120 Y460 | F120-V464 HydrophobicContact CD2-CG2 4.02Å; F120-V464 HydrophobicContact CE2-CG2 4.09Å; Y460-V464 HydrophobicContact CD2-CB 3.77Å; Y460-V464 HydrophobicContact CD2-CG1 4.1Å; Y460-V464 HydrophobicContact CD2-CG2 4.05Å; Y460-V464 HydrophobicContact CE2-CB 3.85Å; Y460-V464 HydrophobicContact CE2-CG1 3.65Å; Y460-V464 HydrophobicContact CE2-CG2 4.43Å; Y460-V464 HydrophobicContact CG-CB 4.44Å; Y460-V464 WeakPolarHBondContact O-CA 3.3Å; Y460-V464 WeakPolarHBondContact O-CB 3.11Å; Y460-V464 PolarHBondContact O-N 2.86Å |
| 465 | Y | 82.6 | Confident | 82.9 | Confident | 159 Ų | 159 | 72.4 Ų | 72.4 | 62% | 0.624 | 39% | 0.391 | S | S | * | . | I | π-helix | trans | -70.9 | -40.4 | -175.1 | -175.6 | -99.6 | 0 | 0 | 0 | 113 | Y460 F461 P467 | Y460-Y465 HydrophobicContact CE1-CD2 4.47Å; Y460-Y465 PolarHBondContact O-N 3.43Å; F461-Y465 AromaticContact CD1-CD1 3.83Å; F461-Y465 HydrophobicContact CD1-CD1 3.83Å; F461-Y465 AromaticContact CD1-CG 3.96Å; F461-Y465 HydrophobicContact CD1-CG 3.96Å; F461-Y465 HydrophobicContact CE1-CD1 4.25Å; F461-Y465 HydrophobicContact CE1-CG 4.28Å; Y465-P467 WeakPolarHBondContact O-CD 3.05Å |
| 466 | L | 77.9 | Confident | 82.2 | Confident | 47 Ų | 47 | 72.8 Ų | 72.8 | 25% | 0.246 | 39% | 0.389 | C | S | . | . | S | Bend | trans | -71.8 | 122.5 | 177.2 | -88.8 | 153.2 | 0 | 0 | 0 | 110.3 | F461 L462 K470 R471 | F461-L466 WeakPolarHBondContact O-CB 3.4Å; F461-L466 VanDerWaalsContact O-CD1 3.28Å; F461-L466 WeakPolarHBondContact O-CD1 3.41Å; F461-L466 WeakPolarHBondContact O-CG 3.47Å; F461-L466 PolarHBondContact O-N 3.47Å; F461-L466 VanDerWaalsContact O-N 3.09Å; L462-L466 HydrophobicContact CD2-CD1 4.19Å; L466-K470 HydrophobicContact CD2-CB 3.58Å; L466-K470 HydrophobicContact CD2-CD 4.45Å; L466-R471 HydrophobicContact CB-CG 4.17Å; L466-R471 PolarHBondContact O-NE 2.98Å |
| 467 | P | 71.6 | Confident | 82 | Confident | 69 Ų | 69 | 80.7 Ų | 80.7 | 45% | 0.448 | 42% | 0.423 | S | S | . | . | trans | -59.9 | 148.6 | 173.2 | 23.7 | -31.2 | 0 | 0 | 0 | 109.6 | Y465 S469 K470 R471 | Y465-P467 WeakPolarHBondContact O-CD 3.05Å; P467-S469 PolarHBondContact O-N 3.02Å; P467-K470 HydrophobicContact CG-CB 4.31Å; P467-K470 HydrophobicContact CG-CD 4.11Å; P467-K470 HydrophobicContact CG-CG 4.18Å; P467-K470 PolarHBondContact O-N 3.32Å; P467-R471 PolarHBondContact O-N 2.86Å | ||
| 468 | E | 69.8 | Low | 81.6 | Confident | 135 Ų | 135 | 84.5 Ų | 84.5 | 63% | 0.631 | 44% | 0.442 | S | S | * | . | G | 310 helix | trans | -50.7 | -35 | -173.1 | -64.7 | -159.8 | 143.8 | 0 | 0 | 113.5 | K470 R471 I476 | E468-K470 VanDerWaalsContact C-N 3.26Å; E468-K470 PolarHBondContact O-N 2.9Å; E468-R471 PolarHBondContact O-N 3.33Å; E468-R471 IonicContact OE1-NH1 3.24Å; E468-I476 WeakPolarHBondContact O-CD1 3.43Å |
| 469 | S | 69.9 | Low | 81.3 | Confident | 111 Ų | 111 | 83.3 Ų | 83.3 | 78% | 0.776 | 43% | 0.431 | S | S | * | . | G | 310 helix | trans | -64.9 | -22.4 | 178.5 | 58 | 0 | 0 | 0 | 0 | 114.9 | P467 | P467-S469 PolarHBondContact O-N 3.02Š|
| 470 | K | 76.6 | Confident | 81 | Confident | 152 Ų | 152 | 88.2 Ų | 88.2 | 66% | 0.661 | 44% | 0.443 | S | S | * | . | G | 310 helix | trans | -105.8 | -1.1 | -179.7 | -65.6 | -173 | 179.5 | -179.2 | 0 | 113.2 | L466 P467 E468 | L466-K470 HydrophobicContact CD2-CB 3.58Å; L466-K470 HydrophobicContact CD2-CD 4.45Å; P467-K470 HydrophobicContact CG-CB 4.31Å; P467-K470 HydrophobicContact CG-CD 4.11Å; P467-K470 HydrophobicContact CG-CG 4.18Å; P467-K470 PolarHBondContact O-N 3.32Å; E468-K470 VanDerWaalsContact C-N 3.26Å; E468-K470 PolarHBondContact O-N 2.9Å |
| 471 | R | 81.4 | Confident | 80.9 | Confident | 47 Ų | 47 | 90.6 Ų | 90.6 | 18% | 0.177 | 46% | 0.464 | C | S | . | . | S | Bend | trans | -70.9 | 142.9 | 178.1 | -64.3 | -176.5 | -171 | 162 | 1.1 | 110 | G463 L466 P467 E468 I476 | G463-R471 PolarHBondContact O-NE 3.24Å; G463-R471 PolarHBondContact O-NH2 3.42Å; L466-R471 HydrophobicContact CB-CG 4.17Å; L466-R471 PolarHBondContact O-NE 2.98Å; P467-R471 PolarHBondContact O-N 2.86Å; E468-R471 PolarHBondContact O-N 3.33Å; E468-R471 IonicContact OE1-NH1 3.24Å; R471-I476 HydrophobicContact CB-CD1 4.01Å; R471-I476 HydrophobicContact CB-CG1 3.83Å |
| 472 | P | 82.6 | Confident | 80.8 | Confident | 48 Ų | 48 | 90 Ų | 90 | 31% | 0.312 | 46% | 0.464 | S | S | . | . | trans | -53.1 | 133.8 | 174.1 | -26.2 | 33.2 | 0 | 0 | 0 | 111.2 | L462 I474 I475 I476 | L462-P472 HydrophobicContact CD2-CG 4.37Å; P472-I474 PolarHBondContact O-N 3.3Å; P472-I474 VanDerWaalsContact O-N 3.09Å; P472-I475 HydrophobicContact CB-CD1 4.25Å; P472-I475 HydrophobicContact CB-CG1 4.23Å; P472-I475 HydrophobicContact CG-CD1 3.94Å; P472-I475 HydrophobicContact CG-CG1 4.46Å; P472-I475 PolarHBondContact O-N 3.49Å; P472-I476 PolarHBondContact O-N 2.7Å | ||
| 473 | P | 81.5 | Confident | 80.9 | Confident | 103 Ų | 103 | 88 Ų | 88 | 67% | 0.669 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -60.7 | -26.7 | -175.4 | 21.2 | -31.8 | 0 | 0 | 0 | 112.9 | K477 | P473-K477 VanDerWaalsContact O-CB 3.31Å; P473-K477 WeakPolarHBondContact O-CB 3.49Å; P473-K477 PolarHBondContact O-N 3.32Å |
| 474 | I | 84.8 | Confident | 81.2 | Confident | 138 Ų | 138 | 91.8 Ų | 91.8 | 71% | 0.708 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.4 | -45.2 | 173.6 | -61.9 | 168.1 | 0 | 0 | 0 | 110.9 | P472 K477 L478 | P472-I474 PolarHBondContact O-N 3.3Å; P472-I474 VanDerWaalsContact O-N 3.09Å; I474-K477 PolarHBondContact O-N 3.38Å; I474-L478 WeakPolarHBondContact O-CB 3.21Å; I474-L478 PolarHBondContact O-N 2.92Å |
| 475 | I | 82.1 | Confident | 81.5 | Confident | 45 Ų | 45 | 96.4 Ų | 96.4 | 23% | 0.231 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -67.8 | -42.9 | -179.5 | -64.2 | -179.8 | 0 | 0 | 0 | 110 | L462 P472 K477 L478 L479 | L462-I475 HydrophobicContact CB-CD1 4.14Å; L462-I475 HydrophobicContact CD1-CD1 4.16Å; L462-I475 HydrophobicContact CD2-CD1 4.44Å; L462-I475 HydrophobicContact CG-CD1 4.49Å; P472-I475 HydrophobicContact CB-CD1 4.25Å; P472-I475 HydrophobicContact CB-CG1 4.23Å; P472-I475 HydrophobicContact CG-CD1 3.94Å; P472-I475 HydrophobicContact CG-CG1 4.46Å; P472-I475 PolarHBondContact O-N 3.49Å; I475-K477 VanDerWaalsContact C-N 3.33Å; I475-K477 PolarHBondContact O-N 3.41Å; I475-L478 PolarHBondContact O-N 3.23Å; I475-L479 HydrophobicContact CG2-CD1 3.83Å; I475-L479 HydrophobicContact CG2-CG 4.2Å; I475-L479 WeakPolarHBondContact O-CB 3.23Å; I475-L479 WeakPolarHBondContact O-CG 3.34Å; I475-L479 PolarHBondContact O-N 2.91Å |
| 476 | I | 81.5 | Confident | 81.6 | Confident | 57 Ų | 57 | 89.5 Ų | 89.5 | 29% | 0.292 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.3 | -45.5 | 175.9 | -60.2 | 172.6 | 0 | 0 | 0 | 110.4 | E468 R471 P472 R480 | E468-I476 WeakPolarHBondContact O-CD1 3.43Å; R471-I476 HydrophobicContact CB-CD1 4.01Å; R471-I476 HydrophobicContact CB-CG1 3.83Å; P472-I476 PolarHBondContact O-N 2.7Å; I476-R480 WeakPolarHBondContact O-CB 3.46Å; I476-R480 PolarHBondContact O-N 3.21Å |
| 477 | K | 85.6 | Confident | 82 | Confident | 166 Ų | 166 | 90.1 Ų | 90.1 | 72% | 0.722 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63.5 | -41.5 | 178 | -170.9 | 176.4 | -179.5 | -179.7 | 0 | 111.6 | P473 I474 I475 S481 | P473-K477 VanDerWaalsContact O-CB 3.31Å; P473-K477 WeakPolarHBondContact O-CB 3.49Å; P473-K477 PolarHBondContact O-N 3.32Å; I474-K477 PolarHBondContact O-N 3.38Å; I475-K477 VanDerWaalsContact C-N 3.33Å; I475-K477 PolarHBondContact O-N 3.41Å; K477-S481 WeakPolarHBondContact O-CB 3.26Å; K477-S481 PolarHBondContact O-N 2.96Å |
| 478 | L | 85.6 | Confident | 82.8 | Confident | 120 Ų | 120 | 95.2 Ų | 95.2 | 63% | 0.628 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -63.9 | -52.3 | 176.9 | -177.2 | 71.8 | 0 | 0 | 0 | 111.4 | I474 I475 R480 S481 L482 | I474-L478 WeakPolarHBondContact O-CB 3.21Å; I474-L478 PolarHBondContact O-N 2.92Å; I475-L478 PolarHBondContact O-N 3.23Å; L478-R480 VanDerWaalsContact C-N 3.34Å; L478-R480 PolarHBondContact O-N 3.39Å; L478-S481 PolarHBondContact O-N 3.47Å; L478-L482 WeakPolarHBondContact O-CB 3.28Å; L478-L482 PolarHBondContact O-N 3.41Å |
| 479 | L | 83.5 | Confident | 83.6 | Confident | 47 Ų | 47 | 92.2 Ų | 92.2 | 25% | 0.246 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 179.1 | -71.8 | 174 | 0 | 0 | 0 | 110.8 | P348 I475 S481 L482 T483 | P348-L479 HydrophobicContact CB-CD2 4.04Å; P348-L479 HydrophobicContact CG-CD2 4.04Å; I475-L479 HydrophobicContact CG2-CD1 3.83Å; I475-L479 HydrophobicContact CG2-CG 4.2Å; I475-L479 WeakPolarHBondContact O-CB 3.23Å; I475-L479 WeakPolarHBondContact O-CG 3.34Å; I475-L479 PolarHBondContact O-N 2.91Å; L479-S481 PolarHBondContact O-N 2.99Å; L479-L482 PolarHBondContact O-N 2.99Å; L479-T483 WeakPolarHBondContact O-CB 3.35Å; L479-T483 PolarHBondContact O-N 2.97Å; L479-T483 PolarHBondContact O-OG1 3.5Å |
| 480 | R | 84.2 | Confident | 84.4 | Confident | 161 Ų | 161 | 88 Ų | 88 | 61% | 0.608 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -62.6 | -43.4 | 176.4 | -173.3 | 179.6 | -69.5 | 175.1 | -0.6 | 111.7 | I476 L478 L482 T483 F484 | I476-R480 WeakPolarHBondContact O-CB 3.46Å; I476-R480 PolarHBondContact O-N 3.21Å; L478-R480 VanDerWaalsContact C-N 3.34Å; L478-R480 PolarHBondContact O-N 3.39Å; R480-L482 VanDerWaalsContact C-N 3.35Å; R480-T483 PolarHBondContact O-N 3.36Å; R480-F484 HydrophobicContact CG-CD2 3.69Å; R480-F484 HydrophobicContact CG-CE2 3.55Å; R480-F484 WeakPolarHBondContact O-CD2 3.34Å; R480-F484 PolarHBondContact O-N 3.13Å |
| 481 | S | 86.3 | Confident | 84.9 | Confident | 76 Ų | 76 | 87.4 Ų | 87.4 | 53% | 0.531 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.7 | -40.8 | 176.8 | -170.2 | 0 | 0 | 0 | 0 | 111.9 | K477 L478 L479 F485 | K477-S481 WeakPolarHBondContact O-CB 3.26Å; K477-S481 PolarHBondContact O-N 2.96Å; L478-S481 PolarHBondContact O-N 3.47Å; L479-S481 PolarHBondContact O-N 2.99Å; S481-F485 WeakPolarHBondContact O-CB 3.47Å; S481-F485 PolarHBondContact O-N 3.47Å |
| 482 | L | 85.5 | Confident | 85.1 | Confident | 80 Ų | 80 | 85.3 Ų | 85.3 | 42% | 0.419 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -62.7 | -51.2 | 175.8 | -173.2 | 79.7 | 0 | 0 | 0 | 110 | A350 L478 L479 R480 F484 F485 T486 | A350-L482 HydrophobicContact CB-CD2 4.06Å; A350-L482 HydrophobicContact CB-CG 4.37Å; L478-L482 WeakPolarHBondContact O-CB 3.28Å; L478-L482 PolarHBondContact O-N 3.41Å; L479-L482 PolarHBondContact O-N 2.99Å; R480-L482 VanDerWaalsContact C-N 3.35Å; L482-F484 PolarHBondContact O-N 3.27Å; L482-F485 PolarHBondContact O-N 3.42Å; L482-T486 WeakPolarHBondContact O-CB 3.45Å; L482-T486 PolarHBondContact O-N 3.14Å; L482-T486 PolarHBondContact O-OG1 3.41Å |
| 483 | T | 85.4 | Confident | 85.1 | Confident | 29 Ų | 29 | 86.4 Ų | 86.4 | 18% | 0.178 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -54 | -50.9 | 176.4 | -64 | 0 | 0 | 0 | 0 | 111.2 | M353 L479 R480 T486 Q487 | M353-T483 HydrophobicContact CE-CG2 3.25Å; L479-T483 WeakPolarHBondContact O-CB 3.35Å; L479-T483 PolarHBondContact O-N 2.97Å; L479-T483 PolarHBondContact O-OG1 3.5Å; R480-T483 PolarHBondContact O-N 3.36Å; T483-T486 PolarHBondContact O-N 2.95Å; T483-Q487 WeakPolarHBondContact O-CB 3.32Å; T483-Q487 VanDerWaalsContact O-CG 3.24Å; T483-Q487 WeakPolarHBondContact O-CG 3.39Å; T483-Q487 PolarHBondContact O-N 2.96Å |
| 484 | F | 85.9 | Confident | 85 | Confident | 102 Ų | 102 | 84.8 Ų | 84.8 | 45% | 0.447 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.8 | -47.1 | 177.4 | -85 | -64.2 | 0 | 0 | 0 | 112.2 | R480 L482 T486 Q487 Y488 | R480-F484 HydrophobicContact CG-CD2 3.69Å; R480-F484 HydrophobicContact CG-CE2 3.55Å; R480-F484 WeakPolarHBondContact O-CD2 3.34Å; R480-F484 PolarHBondContact O-N 3.13Å; L482-F484 PolarHBondContact O-N 3.27Å; F484-T486 VanDerWaalsContact C-N 3.32Å; F484-T486 PolarHBondContact O-N 3.38Å; F484-Q487 PolarHBondContact O-N 3.38Å; F484-Y488 HydrophobicContact CD1-CE2 4.08Å; F484-Y488 VanDerWaalsContact O-CD2 3.26Å; F484-Y488 WeakPolarHBondContact O-CD2 3.42Å; F484-Y488 PolarHBondContact O-N 2.97Å |
| 485 | F | 87.6 | Confident | 84.2 | Confident | 133 Ų | 133 | 80 Ų | 80 | 58% | 0.583 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -55.5 | -50.9 | 178.1 | 179.1 | -99 | 0 | 0 | 0 | 110.5 | S481 L482 Q487 Y488 T489 | S481-F485 WeakPolarHBondContact O-CB 3.47Å; S481-F485 PolarHBondContact O-N 3.47Å; L482-F485 PolarHBondContact O-N 3.42Å; F485-Q487 PolarHBondContact O-N 2.94Å; F485-Y488 PolarHBondContact O-N 3.3Å; F485-T489 HydrophobicContact CD1-CG2 4.27Å; F485-T489 HydrophobicContact CD2-CG2 3.92Å; F485-T489 HydrophobicContact CE1-CG2 3.98Å; F485-T489 HydrophobicContact CE2-CG2 3.61Å; F485-T489 HydrophobicContact CG-CG2 4.26Å; F485-T489 HydrophobicContact CZ-CG2 3.64Å; F485-T489 WeakPolarHBondContact O-CB 3.33Å; F485-T489 WeakPolarHBondContact O-CG2 3.34Å; F485-T489 PolarHBondContact O-N 2.96Å; F485-T489 PolarHBondContact O-OG1 2.79Å |
| 486 | T | 85.1 | Confident | 83.1 | Confident | 14 Ų | 14 | 86.8 Ų | 86.8 | 9% | 0.086 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -59.5 | -42.8 | 177.8 | -58.9 | 0 | 0 | 0 | 0 | 112.5 | M353 P363 L482 T483 F484 C490 | M353-T486 HydrophobicContact SD-CG2 3.97Å; P363-T486 HydrophobicContact CB-CG2 3.68Å; P363-T486 HydrophobicContact CG-CG2 3.23Å; L482-T486 WeakPolarHBondContact O-CB 3.45Å; L482-T486 PolarHBondContact O-N 3.14Å; L482-T486 PolarHBondContact O-OG1 3.41Å; T483-T486 PolarHBondContact O-N 2.95Å; F484-T486 VanDerWaalsContact C-N 3.32Å; F484-T486 PolarHBondContact O-N 3.38Å; T486-C490 WeakPolarHBondContact O-CB 3.34Å; T486-C490 PolarHBondContact O-N 2.82Å |
| 487 | Q | 86.4 | Confident | 81.5 | Confident | 60 Ų | 60 | 88.4 Ų | 88.4 | 28% | 0.28 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -60.8 | -46.5 | 177.1 | -75.4 | 174.7 | -18.3 | 0 | 0 | 111.8 | M353 T483 F484 F485 F491 C492 | M353-Q487 HydrophobicContact CE-CG 3.68Å; M353-Q487 HydrophobicContact SD-CG 3.61Å; T483-Q487 WeakPolarHBondContact O-CB 3.32Å; T483-Q487 VanDerWaalsContact O-CG 3.24Å; T483-Q487 WeakPolarHBondContact O-CG 3.39Å; T483-Q487 PolarHBondContact O-N 2.96Å; F484-Q487 PolarHBondContact O-N 3.38Å; F485-Q487 PolarHBondContact O-N 2.94Å; Q487-F491 VanDerWaalsContact O-CA 3.24Å; Q487-F491 WeakPolarHBondContact O-CA 3.42Å; Q487-F491 PolarHBondContact O-N 3.2Å; Q487-C492 WeakPolarHBondContact CG-O 3.43Å; Q487-C492 PolarHBondContact O-N 3.48Å |
| 488 | Y | 87 | Confident | 79.2 | Confident | 176 Ų | 176 | 85.9 Ų | 85.9 | 69% | 0.69 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -73.3 | -43 | -178.7 | -82.3 | -75.7 | 0 | 0 | 0 | 112.9 | F484 F485 | F484-Y488 HydrophobicContact CD1-CE2 4.08Å; F484-Y488 VanDerWaalsContact O-CD2 3.26Å; F484-Y488 WeakPolarHBondContact O-CD2 3.42Å; F484-Y488 PolarHBondContact O-N 2.97Å; F485-Y488 PolarHBondContact O-N 3.3Å |
| 489 | T | 87.7 | Confident | 76.5 | Confident | 72 Ų | 72 | 89.9 Ų | 89.9 | 44% | 0.442 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -76.5 | -36.2 | -176.7 | 57.6 | 0 | 0 | 0 | 0 | 112.6 | F485 | F485-T489 HydrophobicContact CD1-CG2 4.27Å; F485-T489 HydrophobicContact CD2-CG2 3.92Å; F485-T489 HydrophobicContact CE1-CG2 3.98Å; F485-T489 HydrophobicContact CE2-CG2 3.61Å; F485-T489 HydrophobicContact CG-CG2 4.26Å; F485-T489 HydrophobicContact CZ-CG2 3.64Å; F485-T489 WeakPolarHBondContact O-CB 3.33Å; F485-T489 WeakPolarHBondContact O-CG2 3.34Å; F485-T489 PolarHBondContact O-N 2.96Å; F485-T489 PolarHBondContact O-OG1 2.79Å |
| 490 | C | 85.6 | Confident | 74 | Confident | 22 Ų | 22 | 91.3 Ų | 91.3 | 15% | 0.149 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -102.7 | -0.6 | -175 | -56.8 | 0 | 0 | 0 | 0 | 113.2 | H355 I362 T486 C492 | H355-C490 PolarHBondContact CD2-O 3.17Å; I362-C490 HydrophobicContact CG2-CB 4.34Å; T486-C490 WeakPolarHBondContact O-CB 3.34Å; T486-C490 PolarHBondContact O-N 2.82Å; C490-C492 HydrophobicContact CB-CB 4.4Å; C490-C492 VanDerWaalsContact CB-SG 3.53Å; C490-C492 PolarHBondContact O-N 3.13Å; C490-C492 PolarHBondContact O-SG 3.15Å |
| 491 | F | 87.6 | Confident | 71.3 | Confident | 139 Ų | 139 | 96.5 Ų | 96.5 | 61% | 0.61 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48 | 45.7 | -175.2 | -65.7 | -86.4 | 0 | 0 | 0 | 112.4 | I356 Q487 | I356-F491 WeakPolarHBondContact CG1-O 3.43Å; I356-F491 PolarHBondContact N-O 3.3Å; Q487-F491 VanDerWaalsContact O-CA 3.24Å; Q487-F491 WeakPolarHBondContact O-CA 3.42Å; Q487-F491 PolarHBondContact O-N 3.2Å |
| 492 | C | 85.5 | Confident | 70.6 | Confident | 4 Ų | 4 | 97.5 Ų | 97.5 | 3% | 0.027 | 48% | 0.483 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 151.2 | -176.4 | -65.5 | 0 | 0 | 0 | 0 | 111.4 | M353 I354 Q487 C490 | M353-C492 HydrophobicContact CB-CB 3.67Å; M353-C492 HydrophobicContact SD-CB 4.42Å; I354-C492 CarbonylContact O-C 3.38Å; I354-C492 VanDerWaalsContact O-CA 3.25Å; I354-C492 WeakPolarHBondContact O-CA 3.49Å; Q487-C492 WeakPolarHBondContact CG-O 3.43Å; Q487-C492 PolarHBondContact O-N 3.48Å; C490-C492 HydrophobicContact CB-CB 4.4Å; C490-C492 VanDerWaalsContact CB-SG 3.53Å; C490-C492 PolarHBondContact O-N 3.13Å; C490-C492 PolarHBondContact O-SG 3.15Å |
| 493 | V | 83.9 | Confident | 69.8 | Low | 71 Ų | 71 | 98.4 Ų | 98.4 | 43% | 0.43 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 152 | 176.6 | -69.7 | 0 | 0 | 0 | 0 | 109.7 | M353 I354 I356 | M353-V493 WeakPolarHBondContact CA-O 3.48Å; I354-V493 PolarHBondContact N-O 3.4Å; I354-V493 PolarHBondContact O-N 3.22Å; I356-V493 HydrophobicContact CD1-CG1 3.92Å; I356-V493 HydrophobicContact CG1-CB 4.46Å; I356-V493 HydrophobicContact CG1-CG1 3.74Å; I356-V493 HydrophobicContact CG1-CG2 3.97Å |
| 494 | L | 79.3 | Confident | 68.9 | Low | 68 Ų | 68 | 102.3 Ų | 102.3 | 36% | 0.356 | 50% | 0.503 | S | S | . | . | P | Polyproline II helix | trans | -64.7 | 140 | 168.4 | -107.6 | 94.5 | 0 | 0 | 0 | 109.2 | D349 M353 | D349-L494 HydrophobicContact CB-CD1 3.84Å; D349-L494 HydrophobicContact CB-CD2 4.08Å; D349-L494 HydrophobicContact CB-CG 4.33Å; M353-L494 HydrophobicContact CE-CD1 3.68Å; M353-L494 HydrophobicContact CG-CD1 4.02Å |
| 495 | T | 67.6 | Low | 68 | Low | 39 Ų | 39 | 102.3 Ų | 102.3 | 24% | 0.239 | 51% | 0.507 | C | S | . | . | P | Polyproline II helix | trans | -65.8 | 137.4 | 164.4 | 46 | 0 | 0 | 0 | 0 | 109.5 | F339 I354 T497 | F339-T495 HydrophobicContact CE2-CG2 3.74Å; F339-T495 HydrophobicContact CZ-CG2 3.79Å; I354-T495 HydrophobicContact CB-CG2 4.39Å; I354-T495 HydrophobicContact CD1-CG2 3.27Å; I354-T495 HydrophobicContact CG1-CG2 3.74Å; T495-T497 PolarHBondContact O-N 3.15Å |
| 496 | E | 57.6 | Low | 66.7 | Low | 186 Ų | 186 | 100.4 Ų | 100.4 | 87% | 0.869 | 50% | 0.502 | S | S | * | . | P | Polyproline II helix | trans | -53.4 | 117.5 | 167.5 | -70.7 | -173.7 | 160.3 | 0 | 0 | 108 | D498 | E496-D498 PolarHBondContact O-N 2.98Š|
| 497 | T | 49 | Very low | 65.5 | Low | 91 Ų | 91 | 106.1 Ų | 106.1 | 56% | 0.558 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -57.7 | 122.1 | 167.7 | 40.3 | 0 | 0 | 0 | 0 | 106.8 | T495 K499 | T495-T497 PolarHBondContact O-N 3.15Å; T497-K499 PolarHBondContact O-N 3.13Å |
| 498 | D | 36.7 | Very low | 64 | Low | 114 Ų | 114 | 109.4 Ų | 109.4 | 61% | 0.61 | 55% | 0.547 | S | S | * | . | trans | -47.3 | 106.8 | 163.4 | -79.9 | -47.9 | 0 | 0 | 0 | 107 | R343 E496 S500 | R343-D498 IonicContact CZ-OD2 2.67Å; R343-D498 IonicContact NH2-OD2 2.7Å; R343-D498 PolarHBondContact NH2-OD2 3.29Å; E496-D498 PolarHBondContact O-N 2.98Å; D498-S500 PolarHBondContact O-N 3.25Å | ||
| 499 | K | 29 | Very low | 62.2 | Low | 204 Ų | 204 | 104.3 Ų | 104.3 | 89% | 0.887 | 54% | 0.536 | S | S | * | . | trans | -70.8 | 78.5 | 175.3 | -77.6 | -176.4 | 177.7 | 176.2 | 0 | 107.5 | T497 | T497-K499 PolarHBondContact O-N 3.13Š| ||
| 500 | S | 31 | Very low | 60.1 | Low | 77 Ų | 77 | 107 Ų | 107 | 54% | 0.538 | 54% | 0.544 | S | S | . | . | trans | -158.2 | 91 | 168.9 | 61.8 | 0 | 0 | 0 | 0 | 111 | D498 | D498-S500 PolarHBondContact O-N 3.25Š| ||
| 501 | Q | 28.6 | Very low | 57.8 | Low | 269 Ų | 269 | 114.7 Ų | 114.7 | 100% | 1.257 | 58% | 0.58 | S | S | * | * | -152.4 | 0 | 124.8 | -105.1 | 174.6 | 30.4 | 0 | 0 | 109.1 |
Retrieved 501 of 501 residues in 962.2 ms
(Link to these results)