| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33 | Very low | 30.8 | Very low | 255 Ų | 255 | 152.2 Ų | 152.2 | 100% | 1.256 | 81% | 0.808 | S | S | * | * | 0 | 136.2 | 0 | -81.8 | 177.9 | 168.3 | 0 | 0 | 108.4 | |||||
| 2 | A | 29.7 | Very low | 30.4 | Very low | 95 Ų | 95 | 159 Ų | 159 | 79% | 0.785 | 82% | 0.817 | S | S | * | * | trans | -88.5 | 168.4 | -158 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 3 | S | 29.8 | Very low | 30 | Very low | 105 Ų | 105 | 152.4 Ų | 152.4 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | 84.8 | 118.9 | 150.6 | 81.6 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 4 | R | 31 | Very low | 29.6 | Very low | 240 Ų | 240 | 156.9 Ų | 156.9 | 91% | 0.906 | 82% | 0.821 | S | S | * | * | 176 | 131.2 | 95.2 | -97.4 | -179.5 | 175.6 | 172.6 | -2.2 | 111.9 | |||||
| 5 | R | 32.8 | Very low | 29.3 | Very low | 228 Ų | 228 | 162.9 Ų | 162.9 | 86% | 0.86 | 83% | 0.829 | S | S | * | * | trans | -67.3 | 162.3 | 150.6 | -102.8 | -170.8 | -167.5 | 174.6 | 3.8 | 109.1 | ||||
| 6 | P | 40.8 | Very low | 29.1 | Very low | 108 Ų | 108 | 158.2 Ų | 158.2 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | -154.9 | 166.6 | 65.4 | 31.9 | -6.1 | 0 | 0 | 0 | 119.6 | |||||
| 7 | D | 28.9 | Very low | 28.8 | Very low | 146 Ų | 146 | 158.1 Ų | 158.1 | 78% | 0.781 | 82% | 0.817 | S | S | * | * | trans | 46.1 | 124.6 | 135 | -47.1 | -23 | 0 | 0 | 0 | 123 | ||||
| 8 | S | 29.2 | Very low | 28.6 | Very low | 108 Ų | 108 | 158.6 Ų | 158.6 | 76% | 0.755 | 82% | 0.815 | S | S | * | * | -169.5 | 121.7 | 117.1 | 173.8 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 9 | F | 26.4 | Very low | 28.4 | Very low | 203 Ų | 203 | 162.9 Ų | 162.9 | 89% | 0.89 | 82% | 0.822 | S | S | * | * | trans | -125.8 | 115.4 | 169.8 | 175.4 | -90.8 | 0 | 0 | 0 | 105 | ||||
| 10 | D | 31.7 | Very low | 28.2 | Very low | 141 Ų | 141 | 158.8 Ų | 158.8 | 75% | 0.754 | 82% | 0.821 | S | S | * | * | trans | -133.8 | 133.2 | 168.5 | -75.9 | -43 | 0 | 0 | 0 | 104.9 | ||||
| 11 | G | 25.7 | Very low | 28 | Very low | 45 Ų | 45 | 155.9 Ų | 155.9 | 46% | 0.464 | 82% | 0.821 | S | S | . | * | cis | 152.8 | 155.1 | 11.1 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 12 | Y | 26.3 | Very low | 27.5 | Very low | 234 Ų | 234 | 147.5 Ų | 147.5 | 92% | 0.918 | 80% | 0.8 | S | S | * | * | trans | 78.1 | 133 | 163.1 | -50.9 | -80.1 | 0 | 0 | 0 | 117.4 | ||||
| 13 | G | 24.3 | Very low | 27.3 | Very low | 73 Ų | 73 | 153.7 Ų | 153.7 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | cis | 147.2 | 126.4 | 12.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 14 | F | 24.6 | Very low | 27.2 | Very low | 215 Ų | 215 | 154 Ų | 154 | 94% | 0.943 | 80% | 0.804 | S | S | * | * | trans | -57.9 | 140 | -178.7 | -107.7 | -103.6 | 0 | 0 | 0 | 113.8 | ||||
| 15 | R | 25.3 | Very low | 27.1 | Very low | 247 Ų | 247 | 148.4 Ų | 148.4 | 93% | 0.932 | 80% | 0.799 | S | S | * | * | trans | -155.8 | 124.9 | 143.2 | -138.2 | 171.6 | 176 | 157.9 | -1.5 | 111.7 | ||||
| 16 | S | 26.1 | Very low | 26.7 | Very low | 88 Ų | 88 | 149.7 Ų | 149.7 | 62% | 0.615 | 80% | 0.803 | S | S | * | * | trans | -76.5 | 142.2 | 168.4 | 152.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 17 | D | 24.2 | Very low | 25.8 | Very low | 157 Ų | 157 | 149.9 Ų | 149.9 | 84% | 0.84 | 81% | 0.808 | S | S | * | * | trans | -158.5 | 142.5 | 132.9 | -99.8 | -20 | 0 | 0 | 0 | 112.8 | ||||
| 18 | Q | 25.3 | Very low | 25.8 | Very low | 166 Ų | 166 | 149 Ų | 149 | 78% | 0.776 | 81% | 0.813 | S | S | * | * | trans | -69.7 | 147.7 | -179.6 | -69.9 | 163 | -12.3 | 0 | 0 | 112.2 | ||||
| 19 | Y | 25.6 | Very low | 25.4 | Very low | 242 Ų | 242 | 146.8 Ų | 146.8 | 95% | 0.949 | 81% | 0.807 | S | S | * | * | -173.9 | 126.7 | 129 | -93.5 | -69.3 | 0 | 0 | 0 | 108.2 | |||||
| 20 | G | 23.2 | Very low | 25.3 | Very low | 79 Ų | 79 | 142.7 Ų | 142.7 | 81% | 0.814 | 80% | 0.801 | S | S | * | * | trans | -83 | 168.2 | -167.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 21 | A | 23.8 | Very low | 25.1 | Very low | 99 Ų | 99 | 140.3 Ų | 140.3 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -164.3 | 142.1 | 145.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 22 | G | 23.6 | Very low | 25.1 | Very low | 78 Ų | 78 | 143.7 Ų | 143.7 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 136.3 | -162.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||
| 23 | Y | 24.6 | Very low | 25.1 | Very low | 225 Ų | 225 | 135.5 Ų | 135.5 | 88% | 0.882 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 126.3 | 152.1 | -79.4 | -88.7 | 0 | 0 | 0 | 108.5 | ||
| 24 | P | 28.4 | Very low | 25.2 | Very low | 112 Ų | 112 | 138.2 Ų | 138.2 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 147.3 | 162.7 | 29.7 | -28.9 | 0 | 0 | 0 | 109.8 | ||
| 25 | P | 27.7 | Very low | 25.5 | Very low | 122 Ų | 122 | 129.5 Ų | 129.5 | 79% | 0.792 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 134.4 | -176.9 | 28.1 | -32.7 | 0 | 0 | 0 | 110.7 | S27 | P25-S27 PolarHBondContact O-N 3.42Š|
| 26 | R | 25.3 | Very low | 25.7 | Very low | 255 Ų | 255 | 118.9 Ų | 118.9 | 96% | 0.962 | 73% | 0.733 | S | S | * | * | trans | -54.8 | 107.4 | 165.1 | -92.2 | 176.7 | 165.2 | 172.2 | -4.7 | 108.7 | S28 | R26-S28 PolarHBondContact O-N 3.33Š| ||
| 27 | S | 22.8 | Very low | 26.1 | Very low | 113 Ų | 113 | 117.2 Ų | 117.2 | 79% | 0.79 | 72% | 0.716 | S | S | * | * | trans | -68.6 | 124.6 | 162.7 | 44.5 | 0 | 0 | 0 | 0 | 108.9 | P25 G29 | P25-S27 PolarHBondContact O-N 3.42Å; S27-G29 PolarHBondContact O-N 2.76Å | ||
| 28 | S | 27.2 | Very low | 26.5 | Very low | 127 Ų | 127 | 113.3 Ų | 113.3 | 89% | 0.888 | 69% | 0.694 | S | S | * | * | trans | -59.4 | 97.8 | 164.3 | 35.3 | 0 | 0 | 0 | 0 | 109.6 | R26 | R26-S28 PolarHBondContact O-N 3.33Š| ||
| 29 | G | 21.7 | Very low | 27.1 | Very low | 62 Ų | 62 | 105.8 Ų | 105.8 | 64% | 0.639 | 66% | 0.659 | S | S | * | * | trans | -89.1 | 140.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | S27 A31 | S27-G29 PolarHBondContact O-N 2.76Å; G29-A31 PolarHBondContact O-N 3.03Å | ||
| 30 | P | 24.9 | Very low | 27.6 | Very low | 116 Ų | 116 | 95.7 Ų | 95.7 | 75% | 0.753 | 62% | 0.621 | S | S | * | * | trans | -70.8 | 133.1 | -179.5 | 29 | -31 | 0 | 0 | 0 | 110.3 | S32 | P30-S32 PolarHBondContact O-N 3.32Å; P30-S32 PolarHBondContact O-OG 3.35Å; P30-S32 VanDerWaalsContact O-OG 3.14Å | ||
| 31 | A | 26.9 | Very low | 28.3 | Very low | 92 Ų | 92 | 93.1 Ų | 93.1 | 76% | 0.76 | 59% | 0.587 | S | S | * | * | trans | -53.4 | 107.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | G29 | G29-A31 PolarHBondContact O-N 3.03Š| ||
| 32 | S | 25.8 | Very low | 28.9 | Very low | 115 Ų | 115 | 89.6 Ų | 89.6 | 80% | 0.804 | 55% | 0.554 | S | S | * | * | trans | -124.3 | 33.6 | -175 | 40.6 | 0 | 0 | 0 | 0 | 112 | P30 | P30-S32 PolarHBondContact O-N 3.32Å; P30-S32 PolarHBondContact O-OG 3.35Å; P30-S32 VanDerWaalsContact O-OG 3.14Å | ||
| 33 | G | 25 | Very low | 29.5 | Very low | 62 Ų | 62 | 88.9 Ų | 88.9 | 64% | 0.639 | 53% | 0.527 | S | S | * | . | trans | -110.8 | 1.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 34 | I | 28.2 | Very low | 29.8 | Very low | 130 Ų | 130 | 78.4 Ų | 78.4 | 67% | 0.667 | 49% | 0.487 | S | S | * | . | S | Bend | trans | -105 | -15.4 | -155.9 | -59.2 | 178.2 | 0 | 0 | 0 | 115.2 | ||
| 35 | S | 29.2 | Very low | 30 | Very low | 33 Ų | 33 | 74.4 Ų | 74.4 | 23% | 0.231 | 46% | 0.46 | C | S | . | . | S | Bend | trans | -100.9 | -0 | -172.4 | 2.4 | 0 | 0 | 0 | 0 | 115.6 | E302 | S35-E302 WeakPolarHBondContact CA-OE1 3.25Å; S35-E302 WeakPolarHBondContact CB-OE1 3.41Å; S35-E302 WeakPolarHBondContact CB-OE2 3.3Å; S35-E302 VanDerWaalsContact OG-CD 3.26Å; S35-E302 PolarHBondContact OG-OE2 3.44Å |
| 36 | G | 31.1 | Very low | 30.1 | Very low | 23 Ų | 23 | 71 Ų | 71 | 24% | 0.237 | 44% | 0.439 | C | S | . | . | S | Bend | trans | -84.8 | -17.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115 | Q275 E302 | G36-Q275 PolarHBondContact O-NE2 2.94Å; G36-E302 PolarHBondContact N-OE1 3.36Å |
| 37 | E | 34.5 | Very low | 30.2 | Very low | 54 Ų | 54 | 64 Ų | 64 | 25% | 0.252 | 43% | 0.426 | S | S | . | . | S | Bend | trans | -105 | -11.2 | -170.1 | -138.6 | 167.7 | -174.4 | 0 | 0 | 113.7 | Q39 E179 | E37-Q39 VanDerWaalsContact C-N 3.26Å; E37-Q39 PolarHBondContact O-N 2.95Å; E37-E179 WeakPolarHBondContact OE1-CG 3.45Å; E37-E179 WeakPolarHBondContact OE2-CG 3.39Å |
| 38 | L | 31.6 | Very low | 30.7 | Very low | 75 Ų | 75 | 62.1 Ų | 62.1 | 39% | 0.393 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.9 | -10.1 | -174.1 | -122.3 | 91.5 | 0 | 0 | 0 | 114.8 | ||
| 39 | Q | 36.9 | Very low | 31 | Very low | 7 Ų | 7 | 63.5 Ų | 63.5 | 3% | 0.033 | 41% | 0.409 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -111.4 | 3.1 | -164.7 | -114.3 | 162.8 | -27.4 | 0 | 0 | 115.5 | E37 H41 L303 A306 S310 | E37-Q39 VanDerWaalsContact C-N 3.26Å; E37-Q39 PolarHBondContact O-N 2.95Å; Q39-H41 PolarHBondContact O-N 3.46Å; Q39-L303 PolarHBondContact NE2-O 2.86Å; Q39-L303 PolarHBondContact OE1-O 3.31Å; Q39-A306 HydrophobicContact CB-CB 3.72Å; Q39-A306 VanDerWaalsContact CD-C 3.49Å; Q39-A306 VanDerWaalsContact CD-CB 3.5Å; Q39-A306 HydrophobicContact CG-CB 4.18Å; Q39-S310 PolarHBondContact O-OG 3.27Å |
| 40 | Q | 36.4 | Very low | 31.3 | Very low | 31 Ų | 31 | 66.6 Ų | 66.6 | 15% | 0.145 | 41% | 0.41 | C | S | . | . | S | Bend | trans | -85.3 | 9.4 | -175.8 | -72.5 | 177.1 | -7.2 | 0 | 0 | 114.5 | Y268 | Q40-Y268 HydrophobicContact CG-CD2 4.35Å; Q40-Y268 VanDerWaalsContact NE2-CD2 3.32Å |
| 41 | H | 39.4 | Very low | 31.4 | Very low | 25 Ų | 25 | 66.9 Ų | 66.9 | 12% | 0.116 | 41% | 0.411 | C | S | . | . | trans | -132 | 58.7 | -154.5 | -67.9 | -60.8 | 0 | 0 | 0 | 113.2 | Q39 W43 V44 T45 | Q39-H41 PolarHBondContact O-N 3.46Å; H41-W43 PolarHBondContact O-N 2.98Å; H41-V44 VanDerWaalsContact CB-C 3.48Å; H41-V44 HydrophobicContact CB-CB 4.33Å; H41-V44 WeakPolarHBondContact CB-O 3.28Å; H41-V44 PolarHBondContact CD2-O 3.38Å; H41-V44 VanDerWaalsContact CE1-CG1 3.45Å; H41-V44 WeakPolarHBondContact CE1-CG1 3.43Å; H41-V44 VanDerWaalsContact ND1-CB 3.3Å; H41-V44 WeakPolarHBondContact ND1-CB 3.21Å; H41-V44 WeakPolarHBondContact ND1-CG1 3.27Å; H41-V44 PolarHBondContact ND1-O 3.46Å; H41-T45 HydrophobicContact CB-CG2 4.32Å | ||
| 42 | Q | 35.8 | Very low | 31.6 | Very low | 25 Ų | 25 | 65 Ų | 65 | 12% | 0.117 | 40% | 0.401 | C | S | . | . | S | Bend | trans | -68.9 | 14.8 | 152.8 | -161.5 | 153.6 | 15.3 | 0 | 0 | 112.3 | I111 D314 Q389 | Q42-I111 VanDerWaalsContact NE2-CD1 3.34Å; Q42-D314 PolarHBondContact OE1-OD2 2.82Å; Q42-Q389 VanDerWaalsContact NE2-CD 3.3Å |
| 43 | W | 36.7 | Very low | 31.9 | Very low | 62 Ų | 62 | 63.3 Ų | 63.3 | 24% | 0.235 | 39% | 0.39 | C | S | . | . | S | Bend | trans | -139.8 | -8.7 | 177.3 | -83.3 | 101.8 | 0 | 0 | 0 | 116.1 | H41 R115 V159 H160 Y207 | H41-W43 PolarHBondContact O-N 2.98Å; W43-R115 VanDerWaalsContact CH2-NH2 3.25Å; W43-V159 HydrophobicContact CE3-CG1 3.79Å; W43-V159 HydrophobicContact CZ3-CB 4.25Å; W43-V159 HydrophobicContact CZ3-CG1 3.62Å; W43-H160 VanDerWaalsContact C-NE2 3.34Å; W43-H160 VanDerWaalsContact CA-NE2 3.29Å; W43-H160 WeakPolarHBondContact CA-NE2 3.46Å; W43-H160 PolarHBondContact N-NE2 3.34Å; W43-H160 VanDerWaalsContact O-CA 3.25Å; W43-H160 WeakPolarHBondContact O-CA 3.39Å; W43-H160 PolarHBondContact O-CD2 2.91Å; W43-H160 VanDerWaalsContact O-CG 3.26Å; W43-Y207 HydrophobicContact CE3-CD2 4.21Å; W43-Y207 AromaticContact CH2-CD2 2.9Å; W43-Y207 HydrophobicContact CH2-CD2 2.9Å; W43-Y207 AromaticContact CH2-CE2 2.84Å; W43-Y207 HydrophobicContact CH2-CE2 2.84Å; W43-Y207 AromaticContact CH2-CG 3.97Å; W43-Y207 HydrophobicContact CH2-CG 3.97Å; W43-Y207 AromaticContact CH2-CZ 3.78Å; W43-Y207 AromaticContact CZ2-CD2 3.48Å; W43-Y207 HydrophobicContact CZ2-CD2 3.48Å; W43-Y207 VanDerWaalsContact CZ2-CD2 3.48Å; W43-Y207 HydrophobicContact CZ2-CE1 4.4Å; W43-Y207 AromaticContact CZ2-CE2 2.99Å; W43-Y207 HydrophobicContact CZ2-CE2 2.99Å; W43-Y207 HydrophobicContact CZ2-CG 4.38Å; W43-Y207 AromaticContact CZ2-CZ 3.43Å; W43-Y207 VanDerWaalsContact CZ2-CZ 3.43Å; W43-Y207 WeakPolarHBondContact CZ2-OH 3.22Å; W43-Y207 AromaticContact CZ3-CD2 3.27Å; W43-Y207 HydrophobicContact CZ3-CD2 3.27Å; W43-Y207 AromaticContact CZ3-CE2 3.74Å; W43-Y207 HydrophobicContact CZ3-CE2 3.74Å; W43-Y207 HydrophobicContact CZ3-CG 4.04Å |
| 44 | V | 30.9 | Very low | 32.4 | Very low | 6 Ų | 6 | 71 Ų | 71 | 4% | 0.036 | 40% | 0.399 | C | S | . | . | trans | -166 | 82.8 | -168.6 | 158 | 0 | 0 | 0 | 0 | 113.1 | H41 H160 A163 L164 | H41-V44 VanDerWaalsContact CB-C 3.48Å; H41-V44 HydrophobicContact CB-CB 4.33Å; H41-V44 WeakPolarHBondContact CB-O 3.28Å; H41-V44 PolarHBondContact CD2-O 3.38Å; H41-V44 VanDerWaalsContact CE1-CG1 3.45Å; H41-V44 WeakPolarHBondContact CE1-CG1 3.43Å; H41-V44 VanDerWaalsContact ND1-CB 3.3Å; H41-V44 WeakPolarHBondContact ND1-CB 3.21Å; H41-V44 WeakPolarHBondContact ND1-CG1 3.27Å; H41-V44 PolarHBondContact ND1-O 3.46Å; V44-H160 PolarHBondContact N-CD2 2.85Å; V44-A163 HydrophobicContact CG2-CB 3.05Å; V44-L164 HydrophobicContact CB-CD2 4.29Å; V44-L164 HydrophobicContact CB-CG 4.14Å; V44-L164 HydrophobicContact CG1-CB 4.13Å; V44-L164 HydrophobicContact CG1-CD2 3.16Å; V44-L164 HydrophobicContact CG1-CG 3.34Å | ||
| 45 | T | 31.8 | Very low | 32.7 | Very low | 28 Ų | 28 | 71.6 Ų | 71.6 | 17% | 0.172 | 40% | 0.404 | C | S | . | . | trans | -96.3 | 111.2 | -179.5 | 58.5 | 0 | 0 | 0 | 0 | 113.3 | H41 L100 N104 L164 | H41-T45 HydrophobicContact CB-CG2 4.32Å; T45-L100 HydrophobicContact CG2-CD2 3.47Å; T45-L100 VanDerWaalsContact CG2-CD2 3.47Å; T45-N104 WeakPolarHBondContact CG2-ND2 3.23Å; T45-L164 VanDerWaalsContact C-CD1 3.4Å; T45-L164 WeakPolarHBondContact O-CD1 3.46Å | ||
| 46 | S | 30.1 | Very low | 32.9 | Very low | 50 Ų | 50 | 77.8 Ų | 77.8 | 35% | 0.35 | 43% | 0.433 | S | S | . | . | P | Polyproline II helix | trans | -57.1 | 144.2 | 176.5 | 42.8 | 0 | 0 | 0 | 0 | 112.3 | ||
| 47 | P | 27.5 | Very low | 32.8 | Very low | 107 Ų | 107 | 84.5 Ų | 84.5 | 70% | 0.695 | 46% | 0.458 | S | S | * | . | P | Polyproline II helix | trans | -63.4 | 140.9 | 161 | -13.4 | 27.7 | 0 | 0 | 0 | 109.3 | D49 | P47-D49 PolarHBondContact O-N 3.37Š|
| 48 | P | 33.9 | Very low | 32.8 | Very low | 74 Ų | 74 | 88.6 Ų | 88.6 | 48% | 0.481 | 49% | 0.489 | S | S | . | . | P | Polyproline II helix | trans | -67.6 | 130.6 | 174.1 | 27.2 | -31.8 | 0 | 0 | 0 | 109.9 | I50 F93 | P48-I50 PolarHBondContact O-N 2.95Å; P48-I50 VanDerWaalsContact O-N 3.1Å; P48-F93 HydrophobicContact CB-CE2 4.49Å; P48-F93 HydrophobicContact CG-CE2 4.23Å |
| 49 | D | 32.1 | Very low | 32.9 | Very low | 157 Ų | 157 | 88.2 Ų | 88.2 | 84% | 0.84 | 50% | 0.504 | S | S | * | . | trans | -60.2 | 113.3 | 162.5 | -86.1 | -33.3 | 0 | 0 | 0 | 108.4 | P47 P51 | P47-D49 PolarHBondContact O-N 3.37Å; D49-P51 VanDerWaalsContact O-CD 3.31Å; D49-P51 WeakPolarHBondContact O-CD 3.23Å | ||
| 50 | I | 28 | Very low | 32.6 | Very low | 126 Ų | 126 | 97.2 Ų | 97.2 | 65% | 0.646 | 55% | 0.546 | S | S | * | . | trans | -63.2 | 121.2 | 177.7 | -61 | 171.5 | 0 | 0 | 0 | 108.4 | P48 G52 | P48-I50 PolarHBondContact O-N 2.95Å; P48-I50 VanDerWaalsContact O-N 3.1Å; I50-G52 PolarHBondContact O-N 2.9Å | ||
| 51 | P | 26.4 | Very low | 32.4 | Very low | 122 Ų | 122 | 107.3 Ų | 107.3 | 79% | 0.792 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.1 | 105.8 | 170.4 | -16.2 | 29.9 | 0 | 0 | 0 | 109.2 | D49 | D49-P51 VanDerWaalsContact O-CD 3.31Å; D49-P51 WeakPolarHBondContact O-CD 3.23Å |
| 52 | G | 31.9 | Very low | 31.9 | Very low | 53 Ų | 53 | 112.1 Ų | 112.1 | 55% | 0.546 | 61% | 0.614 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 139.6 | -13.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 116 | I50 R54 | I50-G52 PolarHBondContact O-N 2.9Å; G52-R54 VanDerWaalsContact C-N 3.28Å; G52-R54 PolarHBondContact O-N 3.33Å |
| 53 | S | 32.4 | Very low | 31.6 | Very low | 80 Ų | 80 | 116.9 Ų | 116.9 | 56% | 0.559 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -74.1 | -12.9 | -177.5 | 62.7 | 0 | 0 | 0 | 0 | 114.9 | ||
| 54 | R | 36.3 | Very low | 31.3 | Very low | 224 Ų | 224 | 121.7 Ų | 121.7 | 85% | 0.845 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -86.1 | 0.5 | -178.5 | -73.7 | 178.4 | 81.8 | 150.7 | 2.5 | 115.3 | G52 | G52-R54 VanDerWaalsContact C-N 3.28Å; G52-R54 PolarHBondContact O-N 3.33Å |
| 55 | N | 33.9 | Very low | 31.2 | Very low | 142 Ų | 142 | 132.4 Ų | 132.4 | 76% | 0.759 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -107.2 | 10.6 | -177.2 | -69.4 | -16.2 | 0 | 0 | 0 | 114.9 | H57 | N55-H57 PolarHBondContact O-N 3.42Å; N55-H57 VanDerWaalsContact O-N 3.11Å |
| 56 | L | 32.3 | Very low | 31.2 | Very low | 162 Ų | 162 | 140 Ų | 140 | 85% | 0.848 | 75% | 0.751 | S | S | * | * | trans | -87.3 | 59.2 | 170.3 | -78.5 | 154.6 | 0 | 0 | 0 | 110.7 | ||||
| 57 | H | 30.3 | Very low | 31.2 | Very low | 164 Ų | 164 | 146.8 Ų | 146.8 | 76% | 0.759 | 78% | 0.778 | S | S | * | * | trans | -89.8 | 121.6 | 155.6 | -84.2 | -73.6 | 0 | 0 | 0 | 107.7 | N55 G59 | N55-H57 PolarHBondContact O-N 3.42Å; N55-H57 VanDerWaalsContact O-N 3.11Å; H57-G59 VanDerWaalsContact C-N 3.26Å; H57-G59 PolarHBondContact O-N 2.89Å | ||
| 58 | P | 33.6 | Very low | 31.3 | Very low | 140 Ų | 140 | 146.5 Ų | 146.5 | 91% | 0.909 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | 84.2 | 175.2 | 30.5 | -30.3 | 0 | 0 | 0 | 107.7 | ||
| 59 | G | 34 | Very low | 31.1 | Very low | 67 Ų | 67 | 151.5 Ų | 151.5 | 69% | 0.691 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -163.1 | -9.5 | -170.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | H57 | H57-G59 VanDerWaalsContact C-N 3.26Å; H57-G59 PolarHBondContact O-N 2.89Å |
| 60 | E | 30.7 | Very low | 31.1 | Very low | 197 Ų | 197 | 149.9 Ų | 149.9 | 92% | 0.921 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -117 | 124.2 | 177.8 | -74.9 | -175.2 | 159.6 | 0 | 0 | 111.8 | ||
| 61 | R | 31.6 | Very low | 31.6 | Very low | 242 Ų | 242 | 147.7 Ų | 147.7 | 91% | 0.913 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 135.6 | -175.1 | -75.1 | 171.5 | 171.1 | 154.7 | -3.9 | 111.4 | ||
| 62 | T | 28.5 | Very low | 31.7 | Very low | 126 Ų | 126 | 147.1 Ų | 147.1 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 129.1 | 159.2 | 45.1 | 0 | 0 | 0 | 0 | 110.6 | L64 | T62-L64 PolarHBondContact O-N 2.87Š|
| 63 | P | 30.8 | Very low | 31.7 | Very low | 126 Ų | 126 | 155 Ų | 155 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 122 | 167 | 26.4 | -29.1 | 0 | 0 | 0 | 108.5 | ||
| 64 | L | 29.3 | Very low | 31.6 | Very low | 163 Ų | 163 | 163.3 Ų | 163.3 | 85% | 0.853 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 135 | 168 | -91.7 | 155.3 | 0 | 0 | 0 | 108.8 | T62 E66 | T62-L64 PolarHBondContact O-N 2.87Å; L64-E66 PolarHBondContact O-N 3.38Å |
| 65 | Y | 30 | Very low | 31.4 | Very low | 230 Ų | 230 | 160 Ų | 160 | 90% | 0.902 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 116.3 | 167.2 | -114.8 | -104.6 | 0 | 0 | 0 | 109.2 | ||
| 66 | E | 31.2 | Very low | 31.3 | Very low | 187 Ų | 187 | 156.9 Ų | 156.9 | 87% | 0.874 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 124.1 | 160.2 | -89.9 | -179.3 | 151.4 | 0 | 0 | 108.1 | L64 | L64-E66 PolarHBondContact O-N 3.38Š|
| 67 | E | 30.1 | Very low | 31.5 | Very low | 194 Ų | 194 | 155.2 Ų | 155.2 | 91% | 0.907 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 133.6 | 170.9 | -81.3 | 174.6 | 130.9 | 0 | 0 | 110.4 | ||
| 68 | A | 30.6 | Very low | 31.8 | Very low | 100 Ų | 100 | 155.6 Ų | 155.6 | 83% | 0.826 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 125.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 69 | E | 29.3 | Very low | 32.1 | Very low | 179 Ų | 179 | 153.8 Ų | 153.8 | 84% | 0.836 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 137 | 163.9 | -80.8 | -82.7 | 143.4 | 0 | 0 | 110.9 | G71 | E69-G71 PolarHBondContact O-N 2.94Š|
| 70 | P | 31.5 | Very low | 32.6 | Very low | 124 Ų | 124 | 155.2 Ų | 155.2 | 81% | 0.805 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -87.4 | 100 | -171.9 | 33.3 | -30.4 | 0 | 0 | 0 | 110.8 | ||
| 71 | G | 38.9 | Very low | 33.6 | Very low | 79 Ų | 79 | 148.9 Ų | 148.9 | 81% | 0.814 | 82% | 0.818 | S | S | * | * | trans | -175.5 | 11.6 | 179 | 0 | 0 | 0 | 0 | 0 | 119.4 | E69 | E69-G71 PolarHBondContact O-N 2.94Š| ||
| 72 | S | 29.4 | Very low | 34.8 | Very low | 110 Ų | 110 | 141.2 Ų | 141.2 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | -121.5 | 125.7 | 175.9 | 59.9 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 73 | R | 30 | Very low | 36.7 | Very low | 219 Ų | 219 | 138.2 Ų | 138.2 | 83% | 0.826 | 78% | 0.78 | S | S | * | * | trans | -38.8 | 129.3 | 172.1 | 175.1 | -179.8 | -82.6 | 174.5 | -7.5 | 111.1 | E75 | R73-E75 VanDerWaalsContact C-N 3.28Å; R73-E75 PolarHBondContact O-N 2.81Å | ||
| 74 | W | 31.8 | Very low | 38.2 | Very low | 254 Ų | 254 | 136.7 Ų | 136.7 | 96% | 0.962 | 77% | 0.77 | S | S | * | * | trans | -60.7 | 87.9 | 169.1 | -61.6 | 99.1 | 0 | 0 | 0 | 110.1 | ||||
| 75 | E | 32.4 | Very low | 40 | Very low | 155 Ų | 155 | 135.2 Ų | 135.2 | 72% | 0.724 | 76% | 0.759 | S | S | * | * | trans | -82.5 | 118.4 | 156.4 | -77.4 | -179.7 | 178 | 0 | 0 | 106.8 | R73 | R73-E75 VanDerWaalsContact C-N 3.28Å; R73-E75 PolarHBondContact O-N 2.81Å | ||
| 76 | A | 30.8 | Very low | 42 | Very low | 77 Ų | 77 | 128.9 Ų | 128.9 | 64% | 0.636 | 74% | 0.737 | S | S | * | * | trans | -51.5 | 129.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | H78 | A76-H78 PolarHBondContact O-N 3.33Š| ||
| 77 | P | 37.4 | Very low | 43.7 | Very low | 126 Ų | 126 | 122.6 Ų | 122.6 | 82% | 0.818 | 71% | 0.709 | S | S | * | * | trans | -58.3 | 113.9 | 177.1 | 19 | -25.8 | 0 | 0 | 0 | 107.1 | A79 | P77-A79 PolarHBondContact O-N 3.29Å; P77-A79 VanDerWaalsContact O-N 3.17Å | ||
| 78 | H | 36.1 | Very low | 45.7 | Very low | 172 Ų | 172 | 115 Ų | 115 | 80% | 0.796 | 68% | 0.675 | S | S | * | * | trans | -50.5 | 127.2 | 164.5 | -77.6 | 32.3 | 0 | 0 | 0 | 105.7 | A76 A80 | A76-H78 PolarHBondContact O-N 3.33Å; H78-A80 VanDerWaalsContact C-N 3.3Å; H78-A80 PolarHBondContact O-N 2.96Å | ||
| 79 | A | 39.3 | Very low | 47.8 | Very low | 102 Ų | 102 | 118.7 Ų | 118.7 | 84% | 0.843 | 67% | 0.668 | S | S | * | * | trans | -49.9 | 102.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | P77 G81 | P77-A79 PolarHBondContact O-N 3.29Å; P77-A79 VanDerWaalsContact O-N 3.17Å; A79-G81 VanDerWaalsContact C-N 3.29Å; A79-G81 PolarHBondContact O-N 3.44Å | ||
| 80 | A | 44.9 | Very low | 50 | Low | 97 Ų | 97 | 116.9 Ų | 116.9 | 80% | 0.802 | 66% | 0.657 | S | S | * | * | trans | -64.3 | 101.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 105 | H78 V82 | H78-A80 VanDerWaalsContact C-N 3.3Å; H78-A80 PolarHBondContact O-N 2.96Å; A80-V82 PolarHBondContact O-N 3.37Å | ||
| 81 | G | 51.6 | Low | 52.1 | Low | 65 Ų | 65 | 111.7 Ų | 111.7 | 67% | 0.67 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 132.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | A79 | A79-G81 VanDerWaalsContact C-N 3.29Å; A79-G81 PolarHBondContact O-N 3.44Å |
| 82 | V | 56.7 | Low | 53.8 | Low | 80 Ų | 80 | 109.4 Ų | 109.4 | 49% | 0.485 | 60% | 0.601 | S | S | . | * | P | Polyproline II helix | trans | -52.6 | 126.2 | 178.2 | 178.8 | 0 | 0 | 0 | 0 | 107.7 | A80 Q86 L87 | A80-V82 PolarHBondContact O-N 3.37Å; V82-Q86 HydrophobicContact CG1-CB 3.91Å; V82-L87 HydrophobicContact CB-CD1 4.1Å; V82-L87 HydrophobicContact CB-CG 4.42Å; V82-L87 HydrophobicContact CG1-CD1 4.24Å; V82-L87 HydrophobicContact CG1-CG 4.1Å |
| 83 | P | 67.7 | Low | 56.2 | Low | 63 Ų | 63 | 109.3 Ų | 109.3 | 41% | 0.409 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -59.3 | 139.3 | -175.7 | 19 | -29.1 | 0 | 0 | 0 | 110 | E85 Q86 L87 | P83-E85 PolarHBondContact O-N 3.14Å; P83-Q86 HydrophobicContact CG-CB 4.31Å; P83-Q86 HydrophobicContact CG-CG 3.89Å; P83-Q86 PolarHBondContact O-N 2.95Å; P83-L87 PolarHBondContact O-N 3.4Å |
| 84 | P | 63 | Low | 58.5 | Low | 94 Ų | 94 | 100.2 Ų | 100.2 | 61% | 0.61 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -58.9 | -27 | -171.6 | 22.3 | -33.8 | 0 | 0 | 0 | 112.8 | L87 N88 | P84-L87 PolarHBondContact O-N 2.83Å; P84-N88 WeakPolarHBondContact O-CB 3.31Å; P84-N88 PolarHBondContact O-N 3.33Å; P84-N88 PolarHBondContact O-ND2 2.95Å; P84-N88 VanDerWaalsContact O-ND2 3.11Å; P84-N88 PolarHBondContact O-OD1 2.77Å |
| 85 | E | 67.5 | Low | 60.8 | Low | 133 Ų | 133 | 89.2 Ų | 89.2 | 62% | 0.621 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.9 | -36.8 | 174.1 | -63.9 | -171.2 | 177.4 | 0 | 0 | 113.7 | P83 N88 R89 | P83-E85 PolarHBondContact O-N 3.14Å; E85-N88 PolarHBondContact O-N 3.04Å; E85-R89 WeakPolarHBondContact O-CG 3.49Å; E85-R89 PolarHBondContact O-N 3.18Å; E85-R89 VanDerWaalsContact O-N 3.1Å |
| 86 | Q | 70.9 | Confident | 63 | Low | 96 Ų | 96 | 82.6 Ų | 82.6 | 45% | 0.449 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -70.1 | -44.5 | 176.7 | -73.4 | -179.4 | 2.3 | 0 | 0 | 110.4 | V82 P83 N88 R89 F90 | V82-Q86 HydrophobicContact CG1-CB 3.91Å; P83-Q86 HydrophobicContact CG-CB 4.31Å; P83-Q86 HydrophobicContact CG-CG 3.89Å; P83-Q86 PolarHBondContact O-N 2.95Å; Q86-N88 VanDerWaalsContact C-N 3.28Å; Q86-N88 PolarHBondContact O-N 3.48Å; Q86-R89 PolarHBondContact O-N 3.45Å; Q86-R89 VanDerWaalsContact O-N 3.15Å; Q86-F90 HydrophobicContact CB-CD2 4.47Å; Q86-F90 HydrophobicContact CB-CE2 4.36Å; Q86-F90 WeakPolarHBondContact O-CD2 3.32Å; Q86-F90 PolarHBondContact O-N 3.02Å |
| 87 | L | 68.4 | Low | 65.4 | Low | 55 Ų | 55 | 83.7 Ų | 83.7 | 29% | 0.288 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -55.7 | -41.6 | 173.2 | -86.6 | 151.4 | 0 | 0 | 0 | 112.1 | V82 P83 P84 F90 A91 | V82-L87 HydrophobicContact CB-CD1 4.1Å; V82-L87 HydrophobicContact CB-CG 4.42Å; V82-L87 HydrophobicContact CG1-CD1 4.24Å; V82-L87 HydrophobicContact CG1-CG 4.1Å; P83-L87 PolarHBondContact O-N 3.4Å; P84-L87 PolarHBondContact O-N 2.83Å; L87-F90 PolarHBondContact O-N 3.44Å; L87-A91 WeakPolarHBondContact O-CB 3.39Å; L87-A91 PolarHBondContact O-N 2.88Å |
| 88 | N | 70.4 | Confident | 67.5 | Low | 35 Ų | 35 | 80.8 Ų | 80.8 | 19% | 0.187 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -67.1 | -38 | 177.1 | -66.8 | -21.7 | 0 | 0 | 0 | 113.2 | P84 E85 Q86 A91 G92 P295 | P84-N88 WeakPolarHBondContact O-CB 3.31Å; P84-N88 PolarHBondContact O-N 3.33Å; P84-N88 PolarHBondContact O-ND2 2.95Å; P84-N88 VanDerWaalsContact O-ND2 3.11Å; P84-N88 PolarHBondContact O-OD1 2.77Å; E85-N88 PolarHBondContact O-N 3.04Å; Q86-N88 VanDerWaalsContact C-N 3.28Å; Q86-N88 PolarHBondContact O-N 3.48Å; N88-A91 WeakPolarHBondContact O-CB 3.4Å; N88-A91 PolarHBondContact O-N 3.42Å; N88-G92 PolarHBondContact O-N 3.28Å; N88-P295 VanDerWaalsContact CG-CG 3.5Å; N88-P295 WeakPolarHBondContact ND2-CG 3.29Å; N88-P295 WeakPolarHBondContact OD1-CG 2.94Å |
| 89 | R | 75 | Confident | 69.7 | Low | 177 Ų | 177 | 73.2 Ų | 73.2 | 67% | 0.668 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -67.1 | -43.8 | 175.2 | -71.3 | 174.9 | -169.3 | -177.7 | 7 | 111.4 | E85 Q86 A91 G92 F93 | E85-R89 WeakPolarHBondContact O-CG 3.49Å; E85-R89 PolarHBondContact O-N 3.18Å; E85-R89 VanDerWaalsContact O-N 3.1Å; Q86-R89 PolarHBondContact O-N 3.45Å; Q86-R89 VanDerWaalsContact O-N 3.15Å; R89-A91 VanDerWaalsContact C-N 3.33Å; R89-G92 PolarHBondContact O-N 2.94Å; R89-F93 WeakPolarHBondContact O-CB 3.35Å; R89-F93 PolarHBondContact O-N 3.44Å |
| 90 | F | 77.1 | Confident | 71.7 | Confident | 141 Ų | 141 | 70 Ų | 70 | 62% | 0.618 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -63.8 | -39.6 | 175.1 | -76.1 | -62.8 | 0 | 0 | 0 | 112.1 | Q86 L87 F93 G94 | Q86-F90 HydrophobicContact CB-CD2 4.47Å; Q86-F90 HydrophobicContact CB-CE2 4.36Å; Q86-F90 WeakPolarHBondContact O-CD2 3.32Å; Q86-F90 PolarHBondContact O-N 3.02Å; L87-F90 PolarHBondContact O-N 3.44Å; F90-F93 PolarHBondContact O-N 3.03Å; F90-G94 PolarHBondContact O-N 3.27Å |
| 91 | A | 74.2 | Confident | 73.6 | Confident | 15 Ų | 15 | 70.6 Ų | 70.6 | 12% | 0.124 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59.1 | -51.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L87 N88 R89 F93 G94 I95 L404 | L87-A91 WeakPolarHBondContact O-CB 3.39Å; L87-A91 PolarHBondContact O-N 2.88Å; N88-A91 WeakPolarHBondContact O-CB 3.4Å; N88-A91 PolarHBondContact O-N 3.42Å; R89-A91 VanDerWaalsContact C-N 3.33Å; A91-F93 PolarHBondContact O-N 3.43Å; A91-G94 PolarHBondContact O-N 3.16Å; A91-I95 WeakPolarHBondContact O-CB 3.48Å; A91-I95 WeakPolarHBondContact O-CD1 3.26Å; A91-I95 VanDerWaalsContact O-CG1 3.23Å; A91-I95 WeakPolarHBondContact O-CG1 3.41Å; A91-I95 PolarHBondContact O-N 3.11Å; A91-L404 HydrophobicContact CB-CD1 3.9Å; A91-L404 HydrophobicContact CB-CD2 3.35Å; A91-L404 HydrophobicContact CB-CG 4.25Å |
| 92 | G | 74.8 | Confident | 75.2 | Confident | 31 Ų | 31 | 67.7 Ų | 67.7 | 32% | 0.32 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | N88 R89 G96 | N88-G92 PolarHBondContact O-N 3.28Å; R89-G92 PolarHBondContact O-N 2.94Å; G92-G96 PolarHBondContact O-N 2.88Å |
| 93 | F | 79.8 | Confident | 76.4 | Confident | 109 Ų | 109 | 65 Ų | 65 | 48% | 0.478 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -61.9 | -47.9 | 174.9 | 176.5 | -99.6 | 0 | 0 | 0 | 112.2 | P48 R89 F90 A91 I95 G96 L97 | P48-F93 HydrophobicContact CB-CE2 4.49Å; P48-F93 HydrophobicContact CG-CE2 4.23Å; R89-F93 WeakPolarHBondContact O-CB 3.35Å; R89-F93 PolarHBondContact O-N 3.44Å; F90-F93 PolarHBondContact O-N 3.03Å; A91-F93 PolarHBondContact O-N 3.43Å; F93-I95 PolarHBondContact O-N 3.17Å; F93-G96 PolarHBondContact O-N 3.49Å; F93-L97 PolarHBondContact O-N 3.27Å |
| 94 | G | 79.3 | Confident | 77.2 | Confident | 27 Ų | 27 | 62.7 Ų | 62.7 | 28% | 0.278 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62.7 | -42.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | F90 A91 L97 V98 | F90-G94 PolarHBondContact O-N 3.27Å; A91-G94 PolarHBondContact O-N 3.16Å; G94-L97 PolarHBondContact O-N 3.31Å; G94-V98 WeakPolarHBondContact O-CB 3.44Å; G94-V98 VanDerWaalsContact O-CG2 3.29Å; G94-V98 WeakPolarHBondContact O-CG2 3.24Å; G94-V98 PolarHBondContact O-N 2.93Å |
| 95 | I | 79.7 | Confident | 78.5 | Confident | 23 Ų | 23 | 59.7 Ų | 59.7 | 12% | 0.118 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.3 | -44.3 | 174.8 | -69.6 | 165 | 0 | 0 | 0 | 110.7 | A91 F93 L97 V98 S99 F300 L303 L404 | A91-I95 WeakPolarHBondContact O-CB 3.48Å; A91-I95 WeakPolarHBondContact O-CD1 3.26Å; A91-I95 VanDerWaalsContact O-CG1 3.23Å; A91-I95 WeakPolarHBondContact O-CG1 3.41Å; A91-I95 PolarHBondContact O-N 3.11Å; F93-I95 PolarHBondContact O-N 3.17Å; I95-L97 PolarHBondContact O-N 2.95Å; I95-V98 PolarHBondContact O-N 3.45Å; I95-S99 WeakPolarHBondContact O-CB 3.21Å; I95-S99 PolarHBondContact O-N 3.36Å; I95-F300 HydrophobicContact CD1-CE2 3.61Å; I95-F300 HydrophobicContact CD1-CZ 3.67Å; I95-F300 HydrophobicContact CG1-CZ 4.37Å; I95-L303 HydrophobicContact CG2-CD2 3.27Å; I95-L404 HydrophobicContact CD1-CD2 3.77Å |
| 96 | G | 78.2 | Confident | 79.6 | Confident | 17 Ų | 17 | 56.5 Ų | 56.5 | 18% | 0.175 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -58.9 | -46.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | G92 F93 S99 L100 | G92-G96 PolarHBondContact O-N 2.88Å; F93-G96 PolarHBondContact O-N 3.49Å; G96-S99 PolarHBondContact O-N 3.49Å; G96-L100 WeakPolarHBondContact O-CB 3.48Å; G96-L100 VanDerWaalsContact O-CG 3.3Å; G96-L100 WeakPolarHBondContact O-CG 3.31Å; G96-L100 PolarHBondContact O-N 3.5Å |
| 97 | L | 81.3 | Confident | 80.6 | Confident | 100 Ų | 100 | 52 Ų | 52 | 52% | 0.524 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.8 | -45.8 | 177.3 | -170.2 | 82.5 | 0 | 0 | 0 | 112.1 | F93 G94 I95 S99 L100 F101 | F93-L97 PolarHBondContact O-N 3.27Å; G94-L97 PolarHBondContact O-N 3.31Å; I95-L97 PolarHBondContact O-N 2.95Å; L97-S99 VanDerWaalsContact C-N 3.34Å; L97-L100 PolarHBondContact O-N 3.43Å; L97-F101 WeakPolarHBondContact O-CB 3.5Å; L97-F101 PolarHBondContact O-N 2.99Å |
| 98 | V | 81.9 | Confident | 81.8 | Confident | 65 Ų | 65 | 49.5 Ų | 49.5 | 39% | 0.394 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.1 | -42.1 | 177.6 | 169.8 | 0 | 0 | 0 | 0 | 110.7 | G94 I95 F101 T102 | G94-V98 WeakPolarHBondContact O-CB 3.44Å; G94-V98 VanDerWaalsContact O-CG2 3.29Å; G94-V98 WeakPolarHBondContact O-CG2 3.24Å; G94-V98 PolarHBondContact O-N 2.93Å; I95-V98 PolarHBondContact O-N 3.45Å; V98-F101 PolarHBondContact O-N 3.2Å; V98-T102 WeakPolarHBondContact O-CB 3.39Å; V98-T102 PolarHBondContact O-N 3.26Å; V98-T102 PolarHBondContact O-OG1 2.96Å |
| 99 | S | 81.5 | Confident | 82.9 | Confident | 12 Ų | 12 | 48.3 Ų | 48.3 | 8% | 0.084 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59.8 | -49.2 | 175.9 | -168.7 | 0 | 0 | 0 | 0 | 110.9 | I95 G96 L97 F101 T102 E103 H393 | I95-S99 WeakPolarHBondContact O-CB 3.21Å; I95-S99 PolarHBondContact O-N 3.36Å; G96-S99 PolarHBondContact O-N 3.49Å; L97-S99 VanDerWaalsContact C-N 3.34Å; S99-F101 PolarHBondContact O-N 2.92Å; S99-T102 WeakPolarHBondContact O-CB 3.17Å; S99-T102 PolarHBondContact O-N 2.97Å; S99-E103 WeakPolarHBondContact O-CB 3.09Å; S99-E103 WeakPolarHBondContact O-CG 3.4Å; S99-E103 PolarHBondContact O-N 3.29Å; S99-H393 PolarHBondContact OG-CE1 3.36Å |
| 100 | L | 80.9 | Confident | 83.9 | Confident | 35 Ų | 35 | 40.4 Ų | 40.4 | 18% | 0.183 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.6 | -45.7 | 178.2 | -74.5 | 173.1 | 0 | 0 | 0 | 112.6 | T45 G96 L97 T102 E103 N104 | T45-L100 HydrophobicContact CG2-CD2 3.47Å; T45-L100 VanDerWaalsContact CG2-CD2 3.47Å; G96-L100 WeakPolarHBondContact O-CB 3.48Å; G96-L100 VanDerWaalsContact O-CG 3.3Å; G96-L100 WeakPolarHBondContact O-CG 3.31Å; G96-L100 PolarHBondContact O-N 3.5Å; L97-L100 PolarHBondContact O-N 3.43Å; L100-T102 VanDerWaalsContact C-N 3.29Å; L100-T102 PolarHBondContact O-N 3.5Å; L100-E103 PolarHBondContact O-N 2.89Å; L100-N104 WeakPolarHBondContact O-CB 3.28Å; L100-N104 PolarHBondContact O-N 3.45Å; L100-N104 PolarHBondContact O-ND2 3.31Å |
| 101 | F | 85.2 | Confident | 84.6 | Confident | 109 Ų | 109 | 34.2 Ų | 34.2 | 48% | 0.478 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -64.9 | -38.2 | 177.7 | -172.2 | -96.8 | 0 | 0 | 0 | 111.4 | L97 V98 S99 V105 L106 | L97-F101 WeakPolarHBondContact O-CB 3.5Å; L97-F101 PolarHBondContact O-N 2.99Å; V98-F101 PolarHBondContact O-N 3.2Å; S99-F101 PolarHBondContact O-N 2.92Å; F101-V105 HydrophobicContact CD1-CB 4.43Å; F101-V105 HydrophobicContact CD2-CB 3.98Å; F101-V105 HydrophobicContact CD2-CG1 4.49Å; F101-V105 HydrophobicContact CD2-CG2 3.74Å; F101-V105 HydrophobicContact CE1-CB 4.26Å; F101-V105 HydrophobicContact CE1-CG1 4.28Å; F101-V105 HydrophobicContact CE2-CB 3.79Å; F101-V105 HydrophobicContact CE2-CG1 3.8Å; F101-V105 HydrophobicContact CE2-CG2 3.73Å; F101-V105 HydrophobicContact CG-CB 4.31Å; F101-V105 HydrophobicContact CG-CG2 4.41Å; F101-V105 HydrophobicContact CZ-CB 3.94Å; F101-V105 HydrophobicContact CZ-CG1 3.67Å; F101-V105 HydrophobicContact CZ-CG2 4.39Å; F101-V105 WeakPolarHBondContact O-CA 3.45Å; F101-V105 VanDerWaalsContact O-CB 3.3Å; F101-V105 WeakPolarHBondContact O-CB 3.24Å; F101-V105 PolarHBondContact O-N 3.43Å; F101-L106 HydrophobicContact CD1-CD1 4.03Å; F101-L106 HydrophobicContact CD1-CD2 4.45Å; F101-L106 HydrophobicContact CD1-CG 3.85Å; F101-L106 HydrophobicContact CE1-CD1 4.15Å; F101-L106 HydrophobicContact CE1-CD2 3.82Å; F101-L106 HydrophobicContact CE1-CG 3.73Å; F101-L106 PolarHBondContact O-N 3.13Å; F101-L106 VanDerWaalsContact O-N 3.13Å |
| 102 | T | 86.4 | Confident | 85.6 | Confident | 4 Ų | 4 | 33.6 Ų | 33.6 | 3% | 0.025 | 19% | 0.191 | C | C | . | . | I | π-helix | trans | -65.4 | -47.4 | 177.9 | -60.3 | 0 | 0 | 0 | 0 | 111.4 | V98 S99 L100 A107 H393 L396 | V98-T102 WeakPolarHBondContact O-CB 3.39Å; V98-T102 PolarHBondContact O-N 3.26Å; V98-T102 PolarHBondContact O-OG1 2.96Å; S99-T102 WeakPolarHBondContact O-CB 3.17Å; S99-T102 PolarHBondContact O-N 2.97Å; L100-T102 VanDerWaalsContact C-N 3.29Å; L100-T102 PolarHBondContact O-N 3.5Å; T102-A107 WeakPolarHBondContact O-CB 3.32Å; T102-A107 PolarHBondContact O-N 2.91Å; T102-H393 HydrophobicContact CG2-CB 4.1Å; T102-L396 HydrophobicContact CG2-CB 4.49Å; T102-L396 HydrophobicContact CG2-CD1 3.45Å; T102-L396 VanDerWaalsContact CG2-CD1 3.45Å; T102-L396 WeakPolarHBondContact OG1-CD1 3.28Å |
| 103 | E | 81.8 | Confident | 86.5 | Confident | 25 Ų | 25 | 32.1 Ų | 32.1 | 12% | 0.117 | 18% | 0.176 | C | C | . | . | I | π-helix | trans | -68.3 | -35.6 | -178.2 | -72.7 | 178.1 | 168.5 | 0 | 0 | 113.5 | S99 L100 A107 H393 | S99-E103 WeakPolarHBondContact O-CB 3.09Å; S99-E103 WeakPolarHBondContact O-CG 3.4Å; S99-E103 PolarHBondContact O-N 3.29Å; L100-E103 PolarHBondContact O-N 2.89Å; E103-A107 WeakPolarHBondContact O-CB 3.34Å; E103-H393 VanDerWaalsContact CG-CE1 3.43Å; E103-H393 WeakPolarHBondContact CG-CE1 3.49Å; E103-H393 VanDerWaalsContact CG-ND1 3.32Å; E103-H393 WeakPolarHBondContact CG-ND1 3.46Å; E103-H393 IonicContact OE1-CE1 3.06Å; E103-H393 PolarHBondContact OE1-CE1 3.29Å; E103-H393 IonicContact OE1-ND1 3.63Å |
| 104 | N | 84.7 | Confident | 87.2 | Confident | 14 Ų | 14 | 27.2 Ų | 27.2 | 8% | 0.075 | 15% | 0.154 | C | C | . | . | I | π-helix | trans | -102.2 | -32.1 | -172.2 | -63.4 | -67.2 | 0 | 0 | 0 | 113.9 | T45 L100 F157 | T45-N104 WeakPolarHBondContact CG2-ND2 3.23Å; L100-N104 WeakPolarHBondContact O-CB 3.28Å; L100-N104 PolarHBondContact O-N 3.45Å; L100-N104 PolarHBondContact O-ND2 3.31Å; N104-F157 HydrophobicContact CB-CE1 3.6Å; N104-F157 HydrophobicContact CB-CZ 3.75Å |
| 105 | V | 89.6 | Confident | 87.9 | Confident | 31 Ų | 31 | 26.2 Ų | 26.2 | 19% | 0.188 | 14% | 0.142 | C | C | . | . | I | π-helix | trans | -106.2 | -54.4 | -174.8 | -174.7 | 0 | 0 | 0 | 0 | 111.5 | F101 H108 W150 M153 F157 | F101-V105 HydrophobicContact CD1-CB 4.43Å; F101-V105 HydrophobicContact CD2-CB 3.98Å; F101-V105 HydrophobicContact CD2-CG1 4.49Å; F101-V105 HydrophobicContact CD2-CG2 3.74Å; F101-V105 HydrophobicContact CE1-CB 4.26Å; F101-V105 HydrophobicContact CE1-CG1 4.28Å; F101-V105 HydrophobicContact CE2-CB 3.79Å; F101-V105 HydrophobicContact CE2-CG1 3.8Å; F101-V105 HydrophobicContact CE2-CG2 3.73Å; F101-V105 HydrophobicContact CG-CB 4.31Å; F101-V105 HydrophobicContact CG-CG2 4.41Å; F101-V105 HydrophobicContact CZ-CB 3.94Å; F101-V105 HydrophobicContact CZ-CG1 3.67Å; F101-V105 HydrophobicContact CZ-CG2 4.39Å; F101-V105 WeakPolarHBondContact O-CA 3.45Å; F101-V105 VanDerWaalsContact O-CB 3.3Å; F101-V105 WeakPolarHBondContact O-CB 3.24Å; F101-V105 PolarHBondContact O-N 3.43Å; V105-H108 WeakPolarHBondContact O-CB 3.2Å; V105-H108 PolarHBondContact O-N 3.31Å; V105-W150 PolarHBondContact O-NE1 2.61Å; V105-M153 HydrophobicContact CB-CE 4.4Å; V105-M153 HydrophobicContact CG1-CE 4.15Å; V105-F157 HydrophobicContact CG2-CZ 4.03Å |
| 106 | L | 90.7 | Very high | 88.6 | Confident | 65 Ų | 65 | 25.3 Ų | 25.3 | 34% | 0.34 | 14% | 0.137 | S | C | . | . | I | π-helix | trans | -73 | -33.6 | -176.6 | -62.5 | 178.5 | 0 | 0 | 0 | 112.8 | F101 H108 P109 L392 L396 | F101-L106 HydrophobicContact CD1-CD1 4.03Å; F101-L106 HydrophobicContact CD1-CD2 4.45Å; F101-L106 HydrophobicContact CD1-CG 3.85Å; F101-L106 HydrophobicContact CE1-CD1 4.15Å; F101-L106 HydrophobicContact CE1-CD2 3.82Å; F101-L106 HydrophobicContact CE1-CG 3.73Å; F101-L106 PolarHBondContact O-N 3.13Å; F101-L106 VanDerWaalsContact O-N 3.13Å; L106-H108 VanDerWaalsContact C-N 3.33Å; L106-P109 WeakPolarHBondContact O-CD 3.48Å; L106-L392 HydrophobicContact CB-CD2 4.16Å; L106-L396 HydrophobicContact CD1-CD1 3.65Å |
| 107 | A | 91.1 | Very high | 89.3 | Confident | 3 Ų | 3 | 24.6 Ų | 24.6 | 3% | 0.025 | 13% | 0.13 | C | C | . | . | S | Bend | trans | -78 | -15.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | T102 E103 P109 C110 I111 Q389 | T102-A107 WeakPolarHBondContact O-CB 3.32Å; T102-A107 PolarHBondContact O-N 2.91Å; E103-A107 WeakPolarHBondContact O-CB 3.34Å; A107-P109 VanDerWaalsContact C-CD 3.47Å; A107-C110 WeakPolarHBondContact O-CA 3.44Å; A107-C110 WeakPolarHBondContact O-CB 3.43Å; A107-C110 PolarHBondContact O-N 3.42Å; A107-I111 HydrophobicContact CB-CD1 4.46Å; A107-I111 PolarHBondContact O-N 3.44Å; A107-I111 VanDerWaalsContact O-N 3.1Å; A107-Q389 HydrophobicContact CB-CG 3.58Å |
| 108 | H | 93.3 | Very high | 90 | Very high | 2 Ų | 2 | 19.9 Ų | 19.9 | 1% | 0.009 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -54.3 | -42.8 | -173.8 | -170.1 | -84.4 | 0 | 0 | 0 | 114.5 | V105 L106 C110 I111 V112 L149 K151 M153 | V105-H108 WeakPolarHBondContact O-CB 3.2Å; V105-H108 PolarHBondContact O-N 3.31Å; L106-H108 VanDerWaalsContact C-N 3.33Å; H108-C110 VanDerWaalsContact C-N 3.26Å; H108-C110 PolarHBondContact O-N 3.42Å; H108-I111 WeakPolarHBondContact O-CB 3.26Å; H108-I111 PolarHBondContact O-N 2.94Å; H108-V112 WeakPolarHBondContact CE1-CG2 3.47Å; H108-V112 PolarHBondContact O-N 2.96Å; H108-L149 PolarHBondContact ND1-O 3.39Å; H108-K151 PolarHBondContact CE1-O 2.93Å; H108-K151 VanDerWaalsContact CE1-O 3.24Å; H108-M153 HydrophobicContact CB-CE 3.47Å; H108-M153 VanDerWaalsContact CB-CE 3.47Å; H108-M153 VanDerWaalsContact CG-CE 3.47Å; H108-M153 VanDerWaalsContact NE2-CA 3.28Å; H108-M153 WeakPolarHBondContact NE2-CA 3.33Å; H108-M153 PolarHBondContact NE2-N 3.23Å |
| 109 | P | 94.8 | Very high | 90.5 | Very high | 9 Ų | 9 | 16.9 Ų | 16.9 | 6% | 0.058 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -55.4 | -40.1 | 173.8 | -29.8 | 39.4 | 0 | 0 | 0 | 113.9 | L106 A107 I111 F113 M137 L149 W150 | L106-P109 WeakPolarHBondContact O-CD 3.48Å; A107-P109 VanDerWaalsContact C-CD 3.47Å; P109-I111 VanDerWaalsContact C-N 3.35Å; P109-F113 WeakPolarHBondContact O-CB 3.37Å; P109-F113 PolarHBondContact O-N 3.03Å; P109-M137 HydrophobicContact CB-CE 3.43Å; P109-M137 VanDerWaalsContact CB-CE 3.43Å; P109-M137 WeakPolarHBondContact O-CE 3.31Å; P109-L149 HydrophobicContact CB-CB 3.97Å; P109-L149 HydrophobicContact CB-CD1 4.17Å; P109-L149 HydrophobicContact CG-CB 4.32Å; P109-W150 HydrophobicContact CB-CH2 4.45Å; P109-W150 HydrophobicContact CB-CZ3 4.35Å; P109-W150 HydrophobicContact CG-CD2 4.01Å; P109-W150 HydrophobicContact CG-CE3 3.75Å; P109-W150 HydrophobicContact CG-CH2 3.15Å; P109-W150 HydrophobicContact CG-CZ2 3.4Å; P109-W150 VanDerWaalsContact CG-CZ2 3.4Å; P109-W150 HydrophobicContact CG-CZ3 3.32Å |
| 110 | C | 95.1 | Very high | 90.9 | Very high | 11 Ų | 11 | 16.4 Ų | 16.4 | 7% | 0.074 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -69 | -37.8 | 178.3 | -62.5 | 0 | 0 | 0 | 0 | 110.7 | A107 H108 R114 A385 Q389 | A107-C110 WeakPolarHBondContact O-CA 3.44Å; A107-C110 WeakPolarHBondContact O-CB 3.43Å; A107-C110 PolarHBondContact O-N 3.42Å; H108-C110 VanDerWaalsContact C-N 3.26Å; H108-C110 PolarHBondContact O-N 3.42Å; C110-R114 WeakPolarHBondContact O-CB 3.29Å; C110-R114 PolarHBondContact O-N 3.05Å; C110-A385 HydrophobicContact CB-CB 4.37Å; C110-A385 WeakPolarHBondContact CB-O 3.49Å; C110-Q389 HydrophobicContact CB-CB 3.79Å; C110-Q389 HydrophobicContact CB-CG 4.3Å |
| 111 | I | 93 | Very high | 91 | Very high | 12 Ų | 12 | 18.4 Ų | 18.4 | 6% | 0.062 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -64.6 | -49.7 | 177 | -62.4 | 170.1 | 0 | 0 | 0 | 110.5 | Q42 A107 H108 P109 R114 R115 | Q42-I111 VanDerWaalsContact NE2-CD1 3.34Å; A107-I111 HydrophobicContact CB-CD1 4.46Å; A107-I111 PolarHBondContact O-N 3.44Å; A107-I111 VanDerWaalsContact O-N 3.1Å; H108-I111 WeakPolarHBondContact O-CB 3.26Å; H108-I111 PolarHBondContact O-N 2.94Å; P109-I111 VanDerWaalsContact C-N 3.35Å; I111-R114 PolarHBondContact O-N 3.48Å; I111-R115 VanDerWaalsContact CG2-CZ 3.4Å; I111-R115 WeakPolarHBondContact O-CB 3.06Å; I111-R115 VanDerWaalsContact O-CG 3.29Å; I111-R115 WeakPolarHBondContact O-CG 3.35Å; I111-R115 PolarHBondContact O-N 3.19Å |
| 112 | V | 94 | Very high | 90.9 | Very high | 1 Ų | 1 | 18.3 Ų | 18.3 | 1% | 0.006 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -58.5 | -52.6 | 177.9 | 165.1 | 0 | 0 | 0 | 0 | 110.7 | H108 R114 R115 Q116 L149 K151 | H108-V112 WeakPolarHBondContact CE1-CG2 3.47Å; H108-V112 PolarHBondContact O-N 2.96Å; V112-R114 VanDerWaalsContact C-N 3.35Å; V112-R114 PolarHBondContact O-N 3.17Å; V112-R115 PolarHBondContact O-N 2.88Å; V112-Q116 HydrophobicContact CG1-CG 4.49Å; V112-Q116 WeakPolarHBondContact O-CG 3.32Å; V112-Q116 PolarHBondContact O-N 3.14Å; V112-L149 WeakPolarHBondContact CG2-O 3.31Å; V112-K151 HydrophobicContact CG1-CD 4.38Å; V112-K151 HydrophobicContact CG1-CG 3.94Å; V112-K151 HydrophobicContact CG2-CG 4.39Å |
| 113 | F | 94.7 | Very high | 90.6 | Very high | 1 Ų | 1 | 18.3 Ų | 18.3 | 0% | 0.004 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -63.8 | -39.8 | -178.8 | -177.5 | -99.6 | 0 | 0 | 0 | 112.4 | P109 Q116 C117 H127 A133 V136 M137 I140 T339 A385 | P109-F113 WeakPolarHBondContact O-CB 3.37Å; P109-F113 PolarHBondContact O-N 3.03Å; F113-Q116 PolarHBondContact O-N 3.49Å; F113-C117 WeakPolarHBondContact CE1-SG 3.28Å; F113-C117 VanDerWaalsContact CZ-SG 3.52Å; F113-C117 PolarHBondContact O-N 2.87Å; F113-C117 PolarHBondContact O-SG 2.79Å; F113-H127 HydrophobicContact CE1-CB 4.2Å; F113-H127 HydrophobicContact CZ-CB 4.48Å; F113-H127 AromaticContact CZ-CD2 3.82Å; F113-A133 HydrophobicContact CD1-CB 4.16Å; F113-A133 HydrophobicContact CE1-CB 3.69Å; F113-V136 HydrophobicContact CE2-CB 3.97Å; F113-V136 HydrophobicContact CE2-CG1 3.58Å; F113-V136 HydrophobicContact CZ-CB 3.86Å; F113-V136 HydrophobicContact CZ-CG1 3.9Å; F113-M137 HydrophobicContact CB-CG 3.75Å; F113-M137 HydrophobicContact CB-SD 3.93Å; F113-M137 HydrophobicContact CD1-CG 3.91Å; F113-M137 HydrophobicContact CD1-SD 4.07Å; F113-M137 HydrophobicContact CD2-CG 3.65Å; F113-M137 HydrophobicContact CE1-CG 4.43Å; F113-M137 HydrophobicContact CE2-CG 4.22Å; F113-M137 HydrophobicContact CG-CG 3.46Å; F113-M137 VanDerWaalsContact CG-CG 3.46Å; F113-M137 HydrophobicContact CG-SD 3.99Å; F113-I140 HydrophobicContact CD2-CD1 3.93Å; F113-I140 HydrophobicContact CE2-CD1 3.91Å; F113-T339 HydrophobicContact CE2-CG2 4.27Å; F113-A385 HydrophobicContact CD1-CB 3.87Å |
| 114 | R | 94.8 | Very high | 90.7 | Very high | 5 Ų | 5 | 27.6 Ų | 27.6 | 2% | 0.019 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -58.8 | -51 | 174.1 | -178.9 | 177.9 | 79.8 | -153.6 | 19.3 | 111.2 | C110 I111 V112 Q116 C117 Q118 F318 E321 A385 | C110-R114 WeakPolarHBondContact O-CB 3.29Å; C110-R114 PolarHBondContact O-N 3.05Å; I111-R114 PolarHBondContact O-N 3.48Å; V112-R114 VanDerWaalsContact C-N 3.35Å; V112-R114 PolarHBondContact O-N 3.17Å; R114-Q116 VanDerWaalsContact C-N 3.31Å; R114-Q116 PolarHBondContact O-N 2.95Å; R114-C117 PolarHBondContact O-N 3.23Å; R114-C117 VanDerWaalsContact O-N 3.17Å; R114-Q118 HydrophobicContact CG-CG 4.34Å; R114-Q118 VanDerWaalsContact O-CG 3.3Å; R114-Q118 WeakPolarHBondContact O-CG 3.45Å; R114-Q118 PolarHBondContact O-N 3.23Å; R114-F318 HydrophobicContact CG-CE2 4.23Å; R114-F318 HydrophobicContact CG-CZ 4.12Å; R114-E321 IonicContact CZ-OE1 3.72Å; R114-E321 IonicContact NE-OE1 3.53Å; R114-E321 PolarHBondContact NE-OE1 2.94Å; R114-E321 IonicContact NH2-OE1 3.25Å; R114-E321 PolarHBondContact NH2-OE1 2.94Å; R114-E321 IonicContact NH2-OE2 3.75Å; R114-A385 HydrophobicContact CB-CB 4.11Å |
| 115 | R | 94.3 | Very high | 90.7 | Very high | 6 Ų | 6 | 29.7 Ų | 29.7 | 2% | 0.023 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -58.2 | -44 | 179 | -73.7 | 171.5 | 177.4 | 169.5 | 7.2 | 111.1 | W43 I111 V112 C117 Q118 V119 L211 T214 V215 | W43-R115 VanDerWaalsContact CH2-NH2 3.25Å; I111-R115 VanDerWaalsContact CG2-CZ 3.4Å; I111-R115 WeakPolarHBondContact O-CB 3.06Å; I111-R115 VanDerWaalsContact O-CG 3.29Å; I111-R115 WeakPolarHBondContact O-CG 3.35Å; I111-R115 PolarHBondContact O-N 3.19Å; V112-R115 PolarHBondContact O-N 2.88Å; R115-C117 PolarHBondContact O-N 2.87Å; R115-Q118 PolarHBondContact O-N 3.23Å; R115-V119 WeakPolarHBondContact O-CG1 3.47Å; R115-V119 WeakPolarHBondContact O-CG2 3.29Å; R115-V119 PolarHBondContact O-N 3.03Å; R115-L211 HydrophobicContact CB-CD1 4.31Å; R115-L211 HydrophobicContact CG-CD1 4.09Å; R115-T214 WeakPolarHBondContact CD-OG1 3.3Å; R115-T214 PolarHBondContact NH1-OG1 2.87Å; R115-V215 HydrophobicContact CB-CG1 3.8Å |
| 116 | Q | 93.4 | Very high | 90.8 | Very high | 4 Ų | 4 | 31 Ų | 31 | 2% | 0.019 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -58.4 | -48.1 | 175 | -64.4 | -120.3 | 65.3 | 0 | 0 | 112.2 | V112 F113 R114 Q118 V119 N120 V215 D337 T339 | V112-Q116 HydrophobicContact CG1-CG 4.49Å; V112-Q116 WeakPolarHBondContact O-CG 3.32Å; V112-Q116 PolarHBondContact O-N 3.14Å; F113-Q116 PolarHBondContact O-N 3.49Å; R114-Q116 VanDerWaalsContact C-N 3.31Å; R114-Q116 PolarHBondContact O-N 2.95Å; Q116-Q118 PolarHBondContact O-N 2.99Å; Q116-V119 WeakPolarHBondContact O-CG2 3.29Å; Q116-V119 PolarHBondContact O-N 2.98Å; Q116-N120 VanDerWaalsContact O-CB 3.31Å; Q116-N120 WeakPolarHBondContact O-CB 3.35Å; Q116-N120 PolarHBondContact O-N 3.44Å; Q116-V215 HydrophobicContact CG-CB 4.48Å; Q116-V215 PolarHBondContact OE1-O 3.36Å; Q116-D337 PolarHBondContact NE2-OD2 2.98Å; Q116-D337 VanDerWaalsContact OE1-N 3.12Å; Q116-T339 HydrophobicContact CB-CG2 3.89Å |
| 117 | C | 93.3 | Very high | 90.8 | Very high | 3 Ų | 3 | 28.6 Ų | 28.6 | 2% | 0.02 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.1 | -40.7 | 178.6 | -67.7 | 0 | 0 | 0 | 0 | 112.6 | F113 R114 R115 V119 N120 R381 | F113-C117 WeakPolarHBondContact CE1-SG 3.28Å; F113-C117 VanDerWaalsContact CZ-SG 3.52Å; F113-C117 PolarHBondContact O-N 2.87Å; F113-C117 PolarHBondContact O-SG 2.79Å; R114-C117 PolarHBondContact O-N 3.23Å; R114-C117 VanDerWaalsContact O-N 3.17Å; R115-C117 PolarHBondContact O-N 2.87Å; C117-V119 VanDerWaalsContact C-N 3.26Å; C117-V119 PolarHBondContact O-N 3.41Å; C117-N120 PolarHBondContact O-N 3.35Å; C117-R381 HydrophobicContact CB-CB 4.37Å; C117-R381 WeakPolarHBondContact O-CB 3.39Å; C117-R381 WeakPolarHBondContact O-CD 3.19Å |
| 118 | Q | 94.8 | Very high | 90.9 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62.7 | -35.1 | -179.3 | -75.4 | 170 | -34.4 | 0 | 0 | 111.9 | R114 R115 Q116 F318 T322 H325 R326 R381 | R114-Q118 HydrophobicContact CG-CG 4.34Å; R114-Q118 VanDerWaalsContact O-CG 3.3Å; R114-Q118 WeakPolarHBondContact O-CG 3.45Å; R114-Q118 PolarHBondContact O-N 3.23Å; R115-Q118 PolarHBondContact O-N 3.23Å; Q116-Q118 PolarHBondContact O-N 2.99Å; Q118-F318 HydrophobicContact CG-CE1 4.14Å; Q118-F318 HydrophobicContact CG-CZ 4.21Å; Q118-F318 VanDerWaalsContact NE2-CZ 3.31Å; Q118-T322 HydrophobicContact CB-CG2 4.07Å; Q118-T322 HydrophobicContact CG-CG2 4.25Å; Q118-T322 PolarHBondContact NE2-OG1 2.96Å; Q118-H325 PolarHBondContact OE1-CE1 3.19Å; Q118-H325 PolarHBondContact OE1-ND1 3.45Å; Q118-R326 PolarHBondContact O-NE 3.43Å; Q118-R326 PolarHBondContact O-NH2 3.11Å; Q118-R381 WeakPolarHBondContact CG-O 3.46Å |
| 119 | V | 92.5 | Very high | 91 | Very high | 3 Ų | 3 | 35.1 Ų | 35.1 | 2% | 0.018 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -94.4 | -16 | -175.8 | -52.4 | 0 | 0 | 0 | 0 | 112.6 | R115 Q116 C117 Y121 V215 H325 L329 I336 | R115-V119 WeakPolarHBondContact O-CG1 3.47Å; R115-V119 WeakPolarHBondContact O-CG2 3.29Å; R115-V119 PolarHBondContact O-N 3.03Å; Q116-V119 WeakPolarHBondContact O-CG2 3.29Å; Q116-V119 PolarHBondContact O-N 2.98Å; C117-V119 VanDerWaalsContact C-N 3.26Å; C117-V119 PolarHBondContact O-N 3.41Å; V119-Y121 PolarHBondContact O-N 2.92Å; V119-V215 HydrophobicContact CG2-CB 4.38Å; V119-V215 HydrophobicContact CG2-CG1 4.19Å; V119-H325 HydrophobicContact CG1-CB 3.7Å; V119-L329 HydrophobicContact CB-CD1 3.62Å; V119-L329 HydrophobicContact CG1-CD1 3.39Å; V119-L329 HydrophobicContact CG2-CD1 3.77Å; V119-I336 HydrophobicContact CG2-CD1 4.27Å; V119-I336 HydrophobicContact CG2-CG2 4.06Å |
| 120 | N | 90.4 | Very high | 90.9 | Very high | 2 Ų | 2 | 36.3 Ų | 36.3 | 1% | 0.011 | 17% | 0.173 | C | C | . | . | trans | -73.1 | 91.1 | 174.7 | -171.6 | 1.9 | 0 | 0 | 0 | 111.8 | Q116 C117 H122 G123 I336 T339 R381 | Q116-N120 VanDerWaalsContact O-CB 3.31Å; Q116-N120 WeakPolarHBondContact O-CB 3.35Å; Q116-N120 PolarHBondContact O-N 3.44Å; C117-N120 PolarHBondContact O-N 3.35Å; N120-H122 VanDerWaalsContact C-N 3.33Å; N120-H122 PolarHBondContact OD1-N 3.49Å; N120-H122 VanDerWaalsContact OD1-N 3.09Å; N120-G123 PolarHBondContact OD1-N 3.06Å; N120-I336 HydrophobicContact CB-CD1 3.6Å; N120-T339 PolarHBondContact ND2-OG1 2.7Å; N120-R381 PolarHBondContact O-NH1 2.62Å | ||
| 121 | Y | 83.2 | Confident | 90.8 | Very high | 77 Ų | 77 | 43.9 Ų | 43.9 | 30% | 0.302 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -66 | -33.9 | 173.5 | 174.4 | -96.5 | 0 | 0 | 0 | 113 | V119 K373 E374 | V119-Y121 PolarHBondContact O-N 2.92Å; Y121-K373 HydrophobicContact CE2-CB 4.37Å; Y121-K373 HydrophobicContact CE2-CD 4.22Å; Y121-K373 WeakPolarHBondContact OH-CD 3.49Å; Y121-E374 HydrophobicContact CD2-CG 4.49Å; Y121-E374 VanDerWaalsContact CD2-OE1 3.24Å; Y121-E374 WeakPolarHBondContact CD2-OE1 3.36Å; Y121-E374 HydrophobicContact CE2-CG 4.28Å |
| 122 | H | 82.7 | Confident | 90.7 | Very high | 106 Ų | 106 | 45 Ų | 45 | 49% | 0.491 | 21% | 0.214 | S | C | . | . | S | Bend | trans | -80.6 | -16.8 | -174.9 | -72.5 | -72.3 | 0 | 0 | 0 | 113.8 | N120 R124 | N120-H122 VanDerWaalsContact C-N 3.33Å; N120-H122 PolarHBondContact OD1-N 3.49Å; N120-H122 VanDerWaalsContact OD1-N 3.09Å; H122-R124 PolarHBondContact O-N 3.32Å |
| 123 | G | 81.1 | Confident | 90.6 | Very high | 4 Ų | 4 | 45 Ų | 45 | 4% | 0.041 | 21% | 0.214 | C | C | . | . | trans | -60.5 | 130 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | N120 D340 R381 | N120-G123 PolarHBondContact OD1-N 3.06Å; G123-D340 WeakPolarHBondContact CA-OD2 3.28Å; G123-R381 PolarHBondContact O-NH1 3.25Å; G123-R381 PolarHBondContact O-NH2 3.34Å | ||
| 124 | R | 82.6 | Confident | 90.5 | Very high | 220 Ų | 220 | 48.7 Ų | 48.7 | 83% | 0.83 | 24% | 0.236 | S | C | * | . | S | Bend | trans | -82.3 | -31.9 | 173.3 | -64 | -179.8 | 177.8 | 179.1 | 0.7 | 111.4 | H122 D340 | H122-R124 PolarHBondContact O-N 3.32Å; R124-D340 PolarHBondContact N-OD1 3.2Å; R124-D340 VanDerWaalsContact N-OD1 3.1Å; R124-D340 PolarHBondContact N-OD2 2.96Å |
| 125 | C | 86.2 | Confident | 90.3 | Very high | 58 Ų | 58 | 52.2 Ų | 52.2 | 39% | 0.392 | 26% | 0.262 | S | S | . | . | trans | -92.5 | 125.1 | 180 | -62.1 | 0 | 0 | 0 | 0 | 110.7 | H127 D340 | C125-H127 VanDerWaalsContact CB-CE1 3.47Å; C125-H127 WeakPolarHBondContact CB-CE1 3.47Å; C125-D340 WeakPolarHBondContact CB-OD1 3.36Å; C125-D340 PolarHBondContact N-OD1 2.93Å | ||
| 126 | Y | 89.9 | Confident | 90.1 | Very high | 60 Ų | 60 | 52.2 Ų | 52.2 | 24% | 0.235 | 26% | 0.263 | C | S | . | . | trans | -91.4 | -10.1 | -177 | -64.1 | -1.8 | 0 | 0 | 0 | 113.6 | L128 E374 A377 R381 G382 | Y126-L128 PolarHBondContact O-N 3.21Å; Y126-E374 PolarHBondContact OH-O 2.98Å; Y126-A377 HydrophobicContact CD2-CB 3.63Å; Y126-A377 HydrophobicContact CE2-CB 3.78Å; Y126-R381 HydrophobicContact CD1-CG 4.11Å; Y126-R381 VanDerWaalsContact CD1-NH1 3.27Å; Y126-R381 VanDerWaalsContact CE1-NH1 3.3Å; Y126-R381 HydrophobicContact CG-CG 4.13Å; Y126-R381 WeakPolarHBondContact O-CA 3.37Å; Y126-G382 PolarHBondContact O-N 3.49Å | ||
| 127 | H | 92.6 | Very high | 89.9 | Confident | 13 Ų | 13 | 52.9 Ų | 52.9 | 6% | 0.06 | 27% | 0.266 | C | S | . | . | trans | 50.1 | 53.3 | 177.9 | -56.6 | -55 | 0 | 0 | 0 | 113.6 | F113 C125 T129 S132 V136 T339 G384 | F113-H127 HydrophobicContact CE1-CB 4.2Å; F113-H127 HydrophobicContact CZ-CB 4.48Å; F113-H127 AromaticContact CZ-CD2 3.82Å; C125-H127 VanDerWaalsContact CB-CE1 3.47Å; C125-H127 WeakPolarHBondContact CB-CE1 3.47Å; H127-T129 VanDerWaalsContact C-N 3.31Å; H127-S132 WeakPolarHBondContact CA-OG 3.38Å; H127-V136 VanDerWaalsContact CE1-CG2 3.45Å; H127-V136 WeakPolarHBondContact CE1-CG2 3.31Å; H127-T339 PolarHBondContact CE1-O 3.01Å; H127-T339 PolarHBondContact NE2-O 3.02Å; H127-G384 VanDerWaalsContact O-CA 3.31Å; H127-G384 WeakPolarHBondContact O-CA 3.35Å; H127-G384 PolarHBondContact O-N 3.08Å | ||
| 128 | L | 92.9 | Very high | 89.8 | Confident | 72 Ų | 72 | 60.6 Ų | 60.6 | 38% | 0.377 | 30% | 0.296 | S | S | . | . | trans | -75.8 | -19.9 | -177.9 | -57 | -178.5 | 0 | 0 | 0 | 113 | Y126 A377 Y380 F383 G384 | Y126-L128 PolarHBondContact O-N 3.21Å; L128-A377 HydrophobicContact CD1-CB 4.48Å; L128-Y380 WeakPolarHBondContact CD2-O 3.33Å; L128-F383 HydrophobicContact CD2-CB 4.37Å; L128-G384 WeakPolarHBondContact O-CA 3.37Å; L128-G384 PolarHBondContact O-N 3.25Å | ||
| 129 | T | 93.7 | Very high | 89.4 | Confident | 70 Ų | 70 | 61.4 Ų | 61.4 | 43% | 0.429 | 30% | 0.303 | S | S | . | . | S | Bend | trans | -106.1 | 146.7 | -178.7 | 74.7 | 0 | 0 | 0 | 0 | 111.1 | H127 F131 S132 A133 G384 | H127-T129 VanDerWaalsContact C-N 3.31Å; T129-F131 PolarHBondContact O-N 2.87Å; T129-S132 PolarHBondContact N-OG 3.16Å; T129-S132 PolarHBondContact O-N 3.41Å; T129-S132 PolarHBondContact O-OG 3.4Å; T129-S132 WeakPolarHBondContact OG1-CB 3.34Å; T129-S132 PolarHBondContact OG1-N 3.47Å; T129-S132 PolarHBondContact OG1-OG 3.35Å; T129-A133 PolarHBondContact O-N 3.45Å; T129-A133 VanDerWaalsContact O-N 3.14Å; T129-G384 VanDerWaalsContact C-CA 3.4Å; T129-G384 WeakPolarHBondContact O-CA 3.29Å |
| 130 | P | 93.2 | Very high | 89.1 | Confident | 34 Ų | 34 | 61.6 Ų | 61.6 | 22% | 0.221 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.6 | -35.3 | 178.7 | 24.7 | -34 | 0 | 0 | 0 | 112.1 | A133 V134 G384 L387 A388 | P130-A133 PolarHBondContact O-N 3.37Å; P130-V134 WeakPolarHBondContact O-CB 3.44Å; P130-V134 VanDerWaalsContact O-CG2 3.28Å; P130-V134 WeakPolarHBondContact O-CG2 3.17Å; P130-V134 PolarHBondContact O-N 2.65Å; P130-G384 WeakPolarHBondContact CA-O 3.25Å; P130-L387 HydrophobicContact CB-CB 4.46Å; P130-A388 HydrophobicContact CB-CB 4.05Å |
| 131 | F | 93.1 | Very high | 89 | Confident | 170 Ų | 170 | 63.2 Ų | 63.2 | 75% | 0.746 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -64.2 | -44.5 | 178.2 | -54.8 | -71.4 | 0 | 0 | 0 | 112.5 | T129 A133 S135 | T129-F131 PolarHBondContact O-N 2.87Å; F131-A133 VanDerWaalsContact C-N 3.33Å; F131-A133 PolarHBondContact O-N 3.41Å; F131-S135 VanDerWaalsContact O-CB 3.26Å; F131-S135 WeakPolarHBondContact O-CB 3.25Å; F131-S135 PolarHBondContact O-N 2.87Å |
| 132 | S | 91.4 | Very high | 89.2 | Confident | 37 Ų | 37 | 67.6 Ų | 67.6 | 26% | 0.259 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.6 | -42.2 | 174.8 | 53.8 | 0 | 0 | 0 | 0 | 112 | H127 T129 V136 | H127-S132 WeakPolarHBondContact CA-OG 3.38Å; T129-S132 PolarHBondContact N-OG 3.16Å; T129-S132 PolarHBondContact O-N 3.41Å; T129-S132 PolarHBondContact O-OG 3.4Å; T129-S132 WeakPolarHBondContact OG1-CB 3.34Å; T129-S132 PolarHBondContact OG1-N 3.47Å; T129-S132 PolarHBondContact OG1-OG 3.35Å; S132-V136 WeakPolarHBondContact O-CG2 3.42Å; S132-V136 PolarHBondContact O-N 3.41Å |
| 133 | A | 91.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 65.4 Ų | 65.4 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -65 | -50.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | F113 T129 P130 F131 S135 V136 M137 A385 | F113-A133 HydrophobicContact CD1-CB 4.16Å; F113-A133 HydrophobicContact CE1-CB 3.69Å; T129-A133 PolarHBondContact O-N 3.45Å; T129-A133 VanDerWaalsContact O-N 3.14Å; P130-A133 PolarHBondContact O-N 3.37Å; F131-A133 VanDerWaalsContact C-N 3.33Å; F131-A133 PolarHBondContact O-N 3.41Å; A133-S135 VanDerWaalsContact C-N 3.31Å; A133-S135 PolarHBondContact O-N 3.32Å; A133-V136 PolarHBondContact O-N 3.43Å; A133-M137 WeakPolarHBondContact O-CB 3.32Å; A133-M137 VanDerWaalsContact O-CG 3.22Å; A133-M137 WeakPolarHBondContact O-CG 3.11Å; A133-M137 PolarHBondContact O-N 3.03Å; A133-A385 HydrophobicContact CB-CB 4.18Å |
| 134 | V | 92.3 | Very high | 89.3 | Confident | 78 Ų | 78 | 67.5 Ų | 67.5 | 47% | 0.473 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.6 | -38.4 | -179.9 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | P130 V136 M137 Y138 A388 | P130-V134 WeakPolarHBondContact O-CB 3.44Å; P130-V134 VanDerWaalsContact O-CG2 3.28Å; P130-V134 WeakPolarHBondContact O-CG2 3.17Å; P130-V134 PolarHBondContact O-N 2.65Å; V134-V136 PolarHBondContact O-N 2.98Å; V134-M137 PolarHBondContact O-N 2.91Å; V134-Y138 WeakPolarHBondContact O-CB 3.45Å; V134-Y138 PolarHBondContact O-N 2.85Å; V134-A388 HydrophobicContact CG2-CB 4.37Å |
| 135 | S | 90.9 | Very high | 89.5 | Confident | 80 Ų | 80 | 58.5 Ų | 58.5 | 56% | 0.559 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -60.6 | -45 | 176.5 | 179.1 | 0 | 0 | 0 | 0 | 112.1 | F131 A133 Y138 A139 | F131-S135 VanDerWaalsContact O-CB 3.26Å; F131-S135 WeakPolarHBondContact O-CB 3.25Å; F131-S135 PolarHBondContact O-N 2.87Å; A133-S135 VanDerWaalsContact C-N 3.31Å; A133-S135 PolarHBondContact O-N 3.32Å; S135-Y138 PolarHBondContact O-N 3.22Å; S135-A139 PolarHBondContact O-N 3.34Å; S135-A139 VanDerWaalsContact O-N 3.1Å |
| 136 | V | 89.4 | Confident | 89.6 | Confident | 6 Ų | 6 | 61 Ų | 61 | 4% | 0.036 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -72 | -39.1 | 177.3 | 179.4 | 0 | 0 | 0 | 0 | 111.8 | F113 H127 S132 A133 V134 Y138 A139 I140 A344 | F113-V136 HydrophobicContact CE2-CB 3.97Å; F113-V136 HydrophobicContact CE2-CG1 3.58Å; F113-V136 HydrophobicContact CZ-CB 3.86Å; F113-V136 HydrophobicContact CZ-CG1 3.9Å; H127-V136 VanDerWaalsContact CE1-CG2 3.45Å; H127-V136 WeakPolarHBondContact CE1-CG2 3.31Å; S132-V136 WeakPolarHBondContact O-CG2 3.42Å; S132-V136 PolarHBondContact O-N 3.41Å; A133-V136 PolarHBondContact O-N 3.43Å; V134-V136 PolarHBondContact O-N 2.98Å; V136-Y138 PolarHBondContact O-N 3.03Å; V136-A139 WeakPolarHBondContact O-CB 3.37Å; V136-A139 PolarHBondContact O-N 3Å; V136-A139 VanDerWaalsContact O-N 3.07Å; V136-I140 HydrophobicContact CG1-CD1 3.99Å; V136-I140 HydrophobicContact CG1-CG1 4.31Å; V136-I140 WeakPolarHBondContact O-CG1 3.33Å; V136-I140 PolarHBondContact O-N 3.11Å; V136-A344 HydrophobicContact CG1-CB 3.94Å |
| 137 | M | 91.1 | Very high | 89.4 | Confident | 17 Ų | 17 | 64.5 Ų | 64.5 | 8% | 0.084 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -57.8 | -39.4 | 173.9 | -71.5 | 170.3 | 64.7 | 0 | 0 | 111.8 | P109 F113 A133 V134 T141 L149 | P109-M137 HydrophobicContact CB-CE 3.43Å; P109-M137 VanDerWaalsContact CB-CE 3.43Å; P109-M137 WeakPolarHBondContact O-CE 3.31Å; F113-M137 HydrophobicContact CB-CG 3.75Å; F113-M137 HydrophobicContact CB-SD 3.93Å; F113-M137 HydrophobicContact CD1-CG 3.91Å; F113-M137 HydrophobicContact CD1-SD 4.07Å; F113-M137 HydrophobicContact CD2-CG 3.65Å; F113-M137 HydrophobicContact CE1-CG 4.43Å; F113-M137 HydrophobicContact CE2-CG 4.22Å; F113-M137 HydrophobicContact CG-CG 3.46Å; F113-M137 VanDerWaalsContact CG-CG 3.46Å; F113-M137 HydrophobicContact CG-SD 3.99Å; A133-M137 WeakPolarHBondContact O-CB 3.32Å; A133-M137 VanDerWaalsContact O-CG 3.22Å; A133-M137 WeakPolarHBondContact O-CG 3.11Å; A133-M137 PolarHBondContact O-N 3.03Å; V134-M137 PolarHBondContact O-N 2.91Å; M137-T141 WeakPolarHBondContact O-CB 3.12Å; M137-T141 PolarHBondContact O-N 3Å; M137-T141 PolarHBondContact O-OG1 3.32Å; M137-L149 HydrophobicContact CB-CD1 4.16Å; M137-L149 HydrophobicContact CB-CD2 4.44Å; M137-L149 HydrophobicContact CE-CD1 4.14Å; M137-L149 HydrophobicContact CG-CD2 4.37Å |
| 138 | Y | 90.1 | Very high | 89.1 | Confident | 166 Ų | 166 | 64 Ų | 64 | 65% | 0.651 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -64.6 | -43 | 173.5 | 178.3 | -98.7 | 0 | 0 | 0 | 111.9 | V134 S135 V136 T141 K142 | V134-Y138 WeakPolarHBondContact O-CB 3.45Å; V134-Y138 PolarHBondContact O-N 2.85Å; S135-Y138 PolarHBondContact O-N 3.22Å; V136-Y138 PolarHBondContact O-N 3.03Å; Y138-T141 PolarHBondContact O-N 3.26Å; Y138-K142 WeakPolarHBondContact O-CB 3.26Å; Y138-K142 PolarHBondContact O-N 3.06Å |
| 139 | A | 86.8 | Confident | 89 | Confident | 17 Ų | 17 | 61 Ų | 61 | 14% | 0.14 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60.8 | -45.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S135 V136 T141 K142 A143 A344 | S135-A139 PolarHBondContact O-N 3.34Å; S135-A139 VanDerWaalsContact O-N 3.1Å; V136-A139 WeakPolarHBondContact O-CB 3.37Å; V136-A139 PolarHBondContact O-N 3Å; V136-A139 VanDerWaalsContact O-N 3.07Å; A139-T141 VanDerWaalsContact C-N 3.34Å; A139-T141 PolarHBondContact O-N 2.86Å; A139-K142 WeakPolarHBondContact O-CB 3.42Å; A139-K142 PolarHBondContact O-N 3.3Å; A139-A143 WeakPolarHBondContact O-CB 3.37Å; A139-A143 PolarHBondContact O-N 3.41Å; A139-A344 HydrophobicContact CB-CB 4.32Å |
| 140 | I | 86.3 | Confident | 88.9 | Confident | 7 Ų | 7 | 61.6 Ų | 61.6 | 4% | 0.036 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -59.7 | -46 | 175.1 | -67.3 | 168.8 | 0 | 0 | 0 | 110.4 | F113 V136 K142 A143 Q144 A148 L149 A344 | F113-I140 HydrophobicContact CD2-CD1 3.93Å; F113-I140 HydrophobicContact CE2-CD1 3.91Å; V136-I140 HydrophobicContact CG1-CD1 3.99Å; V136-I140 HydrophobicContact CG1-CG1 4.31Å; V136-I140 WeakPolarHBondContact O-CG1 3.33Å; V136-I140 PolarHBondContact O-N 3.11Å; I140-K142 VanDerWaalsContact C-N 3.28Å; I140-K142 PolarHBondContact O-N 2.99Å; I140-A143 PolarHBondContact O-N 3.27Å; I140-A143 VanDerWaalsContact O-N 3.15Å; I140-Q144 PolarHBondContact O-N 3.03Å; I140-A148 HydrophobicContact CG2-CB 4.17Å; I140-L149 HydrophobicContact CG2-CD2 4.43Å; I140-A344 HydrophobicContact CG1-CB 4.19Å |
| 141 | T | 88.3 | Confident | 88.8 | Confident | 36 Ų | 36 | 60.2 Ų | 60.2 | 22% | 0.221 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60.8 | -39.1 | 177.8 | -57.3 | 0 | 0 | 0 | 0 | 111.7 | M137 Y138 A139 G145 L146 L149 | M137-T141 WeakPolarHBondContact O-CB 3.12Å; M137-T141 PolarHBondContact O-N 3Å; M137-T141 PolarHBondContact O-OG1 3.32Å; Y138-T141 PolarHBondContact O-N 3.26Å; A139-T141 VanDerWaalsContact C-N 3.34Å; A139-T141 PolarHBondContact O-N 2.86Å; T141-G145 CarbonylContact O-C 3.57Å; T141-G145 WeakPolarHBondContact O-CA 3.48Å; T141-G145 PolarHBondContact O-N 3.48Å; T141-L146 HydrophobicContact CG2-CB 4.5Å; T141-L146 HydrophobicContact CG2-CD1 4.06Å; T141-L149 WeakPolarHBondContact OG1-CD1 3.48Å |
| 142 | K | 86.4 | Confident | 88.5 | Confident | 168 Ų | 168 | 52.6 Ų | 52.6 | 73% | 0.73 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -67.8 | -36 | 176.9 | -173 | -178.5 | 177.7 | -175.3 | 0 | 112.1 | Y138 A139 I140 | Y138-K142 WeakPolarHBondContact O-CB 3.26Å; Y138-K142 PolarHBondContact O-N 3.06Å; A139-K142 WeakPolarHBondContact O-CB 3.42Å; A139-K142 PolarHBondContact O-N 3.3Å; I140-K142 VanDerWaalsContact C-N 3.28Å; I140-K142 PolarHBondContact O-N 2.99Å |
| 143 | A | 82.9 | Confident | 88.4 | Confident | 60 Ų | 60 | 52.4 Ų | 52.4 | 50% | 0.496 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -81.9 | -39.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | A139 I140 | A139-A143 WeakPolarHBondContact O-CB 3.37Å; A139-A143 PolarHBondContact O-N 3.41Å; I140-A143 PolarHBondContact O-N 3.27Å; I140-A143 VanDerWaalsContact O-N 3.15Å |
| 144 | Q | 83.8 | Confident | 88.4 | Confident | 49 Ų | 49 | 53.6 Ų | 53.6 | 23% | 0.229 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -118.1 | -5.1 | -170 | -61.4 | -179.1 | -16 | 0 | 0 | 113.9 | I140 A148 I219 D337 | I140-Q144 PolarHBondContact O-N 3.03Å; Q144-A148 HydrophobicContact CB-CB 3.71Å; Q144-I219 HydrophobicContact CG-CD1 4.32Å; Q144-D337 PolarHBondContact NE2-OD1 3.16Å; Q144-D337 PolarHBondContact OE1-OD1 3.24Å |
| 145 | G | 86.1 | Confident | 88.2 | Confident | 31 Ų | 31 | 49.9 Ų | 49.9 | 32% | 0.32 | 27% | 0.266 | S | S | . | . | trans | 84.8 | 172.6 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | T141 K147 A148 | T141-G145 CarbonylContact O-C 3.57Å; T141-G145 WeakPolarHBondContact O-CA 3.48Å; T141-G145 PolarHBondContact O-N 3.48Å; G145-K147 VanDerWaalsContact C-N 3.33Å; G145-K147 PolarHBondContact O-N 3.49Å; G145-A148 WeakPolarHBondContact O-CB 3.12Å; G145-A148 PolarHBondContact O-N 3.46Å | ||
| 146 | L | 87.9 | Confident | 88.2 | Confident | 111 Ų | 111 | 46.6 Ų | 46.6 | 58% | 0.581 | 24% | 0.242 | S | C | * | . | G | 310 helix | trans | -66.7 | -31.8 | -173.6 | -169.1 | 65.2 | 0 | 0 | 0 | 113.4 | T141 A148 L149 W150 | T141-L146 HydrophobicContact CG2-CB 4.5Å; T141-L146 HydrophobicContact CG2-CD1 4.06Å; L146-A148 PolarHBondContact O-N 3.36Å; L146-A148 VanDerWaalsContact O-N 3.16Å; L146-L149 PolarHBondContact O-N 2.97Å; L146-W150 HydrophobicContact CD1-CE3 4.14Å; L146-W150 HydrophobicContact CD1-CZ3 3.6Å; L146-W150 HydrophobicContact CG-CE3 4.14Å; L146-W150 HydrophobicContact CG-CZ3 4.03Å |
| 147 | K | 87.3 | Confident | 88.3 | Confident | 133 Ų | 133 | 50.1 Ų | 50.1 | 58% | 0.578 | 26% | 0.257 | S | S | * | . | G | 310 helix | trans | -58.1 | -29.5 | 179.2 | -167.8 | -171.6 | 178.3 | -138.9 | 0 | 112.1 | G145 L149 W150 K151 E218 | G145-K147 VanDerWaalsContact C-N 3.33Å; G145-K147 PolarHBondContact O-N 3.49Å; K147-L149 PolarHBondContact O-N 3.44Å; K147-W150 CarbonylContact O-C 3.57Å; K147-W150 PolarHBondContact O-N 3.07Å; K147-K151 PolarHBondContact O-N 3.43Å; K147-K151 VanDerWaalsContact O-N 3.16Å; K147-E218 IonicContact NZ-OE2 3.78Å; K147-E218 PolarHBondContact NZ-OE2 3.16Å |
| 148 | A | 86.3 | Confident | 88.3 | Confident | 2 Ų | 2 | 51.2 Ų | 51.2 | 2% | 0.017 | 26% | 0.263 | C | S | . | . | G | 310 helix | trans | -59.5 | -30.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | I140 Q144 G145 L146 K151 | I140-A148 HydrophobicContact CG2-CB 4.17Å; Q144-A148 HydrophobicContact CB-CB 3.71Å; G145-A148 WeakPolarHBondContact O-CB 3.12Å; G145-A148 PolarHBondContact O-N 3.46Å; L146-A148 PolarHBondContact O-N 3.36Å; L146-A148 VanDerWaalsContact O-N 3.16Å; A148-K151 WeakPolarHBondContact O-CD 3.44Å; A148-K151 WeakPolarHBondContact O-CG 3.32Å |
| 149 | L | 90.2 | Very high | 88.3 | Confident | 10 Ų | 10 | 43.3 Ų | 43.3 | 5% | 0.052 | 23% | 0.232 | C | C | . | . | G | 310 helix | trans | -88.4 | -13.3 | 176.7 | -65.8 | -177.5 | 0 | 0 | 0 | 113.5 | H108 P109 V112 M137 I140 T141 L146 K147 | H108-L149 PolarHBondContact ND1-O 3.39Å; P109-L149 HydrophobicContact CB-CB 3.97Å; P109-L149 HydrophobicContact CB-CD1 4.17Å; P109-L149 HydrophobicContact CG-CB 4.32Å; V112-L149 WeakPolarHBondContact CG2-O 3.31Å; M137-L149 HydrophobicContact CB-CD1 4.16Å; M137-L149 HydrophobicContact CB-CD2 4.44Å; M137-L149 HydrophobicContact CE-CD1 4.14Å; M137-L149 HydrophobicContact CG-CD2 4.37Å; I140-L149 HydrophobicContact CG2-CD2 4.43Å; T141-L149 WeakPolarHBondContact OG1-CD1 3.48Å; L146-L149 PolarHBondContact O-N 2.97Å; K147-L149 PolarHBondContact O-N 3.44Å |
| 150 | W | 91.7 | Very high | 88.3 | Confident | 82 Ų | 82 | 43 Ų | 43 | 31% | 0.311 | 23% | 0.227 | S | C | . | . | S | Bend | trans | -105.1 | 10 | 179.2 | -92 | -98.1 | 0 | 0 | 0 | 113.6 | V105 P109 L146 K147 M153 | V105-W150 PolarHBondContact O-NE1 2.61Å; P109-W150 HydrophobicContact CB-CH2 4.45Å; P109-W150 HydrophobicContact CB-CZ3 4.35Å; P109-W150 HydrophobicContact CG-CD2 4.01Å; P109-W150 HydrophobicContact CG-CE3 3.75Å; P109-W150 HydrophobicContact CG-CH2 3.15Å; P109-W150 HydrophobicContact CG-CZ2 3.4Å; P109-W150 VanDerWaalsContact CG-CZ2 3.4Å; P109-W150 HydrophobicContact CG-CZ3 3.32Å; L146-W150 HydrophobicContact CD1-CE3 4.14Å; L146-W150 HydrophobicContact CD1-CZ3 3.6Å; L146-W150 HydrophobicContact CG-CE3 4.14Å; L146-W150 HydrophobicContact CG-CZ3 4.03Å; K147-W150 CarbonylContact O-C 3.57Å; K147-W150 PolarHBondContact O-N 3.07Å; W150-M153 VanDerWaalsContact CD1-SD 3.6Å; W150-M153 HydrophobicContact CG-CE 4.27Å; W150-M153 WeakPolarHBondContact O-CB 3.3Å; W150-M153 PolarHBondContact O-N 2.95Å |
| 151 | K | 90 | Very high | 88.5 | Confident | 4 Ų | 4 | 44.5 Ų | 44.5 | 2% | 0.017 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | 135.2 | 178.9 | 65.1 | -176 | -174.8 | 173.4 | 0 | 112.6 | H108 V112 K147 A148 M153 T214 V215 Q216 E218 D337 | H108-K151 PolarHBondContact CE1-O 2.93Å; H108-K151 VanDerWaalsContact CE1-O 3.24Å; V112-K151 HydrophobicContact CG1-CD 4.38Å; V112-K151 HydrophobicContact CG1-CG 3.94Å; V112-K151 HydrophobicContact CG2-CG 4.39Å; K147-K151 PolarHBondContact O-N 3.43Å; K147-K151 VanDerWaalsContact O-N 3.16Å; A148-K151 WeakPolarHBondContact O-CD 3.44Å; A148-K151 WeakPolarHBondContact O-CG 3.32Å; K151-M153 VanDerWaalsContact C-N 3.26Å; K151-M153 PolarHBondContact O-N 3.38Å; K151-T214 WeakPolarHBondContact CE-O 3.29Å; K151-V215 VanDerWaalsContact NZ-C 3.32Å; K151-V215 PolarHBondContact NZ-O 3.47Å; K151-Q216 WeakPolarHBondContact CD-O 3.23Å; K151-Q216 WeakPolarHBondContact CE-O 3.27Å; K151-Q216 VanDerWaalsContact NZ-C 3.34Å; K151-Q216 PolarHBondContact NZ-O 2.51Å; K151-E218 HydrophobicContact CB-CG 4.48Å; K151-D337 IonicContact NZ-OD2 2.77Å; K151-D337 PolarHBondContact NZ-OD2 3.42Å |
| 152 | G | 87.8 | Confident | 88.6 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 10% | 0.103 | 24% | 0.244 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 72.9 | 9.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | G154 S155 T156 | G152-G154 VanDerWaalsContact C-N 3.32Å; G152-G154 PolarHBondContact O-N 3.32Å; G152-S155 PolarHBondContact O-N 2.95Å; G152-S155 PolarHBondContact O-OG 3.38Å; G152-T156 WeakPolarHBondContact O-CG2 3.42Å; G152-T156 PolarHBondContact O-N 2.95Å |
| 153 | M | 89.9 | Confident | 88.7 | Confident | 34 Ų | 34 | 36.9 Ų | 36.9 | 17% | 0.167 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -55.3 | -46.9 | 176.9 | 172.5 | 169.5 | -80.2 | 0 | 0 | 112.3 | V105 H108 W150 K151 S155 T156 F157 | V105-M153 HydrophobicContact CB-CE 4.4Å; V105-M153 HydrophobicContact CG1-CE 4.15Å; H108-M153 HydrophobicContact CB-CE 3.47Å; H108-M153 VanDerWaalsContact CB-CE 3.47Å; H108-M153 VanDerWaalsContact CG-CE 3.47Å; H108-M153 VanDerWaalsContact NE2-CA 3.28Å; H108-M153 WeakPolarHBondContact NE2-CA 3.33Å; H108-M153 PolarHBondContact NE2-N 3.23Å; W150-M153 VanDerWaalsContact CD1-SD 3.6Å; W150-M153 HydrophobicContact CG-CE 4.27Å; W150-M153 WeakPolarHBondContact O-CB 3.3Å; W150-M153 PolarHBondContact O-N 2.95Å; K151-M153 VanDerWaalsContact C-N 3.26Å; K151-M153 PolarHBondContact O-N 3.38Å; M153-S155 PolarHBondContact O-N 3.2Å; M153-T156 PolarHBondContact O-N 2.9Å; M153-T156 PolarHBondContact O-OG1 3.31Å; M153-F157 HydrophobicContact CG-CD2 3.84Å; M153-F157 HydrophobicContact CG-CE2 3.52Å; M153-F157 VanDerWaalsContact O-CD2 3.29Å; M153-F157 WeakPolarHBondContact O-CD2 3.48Å; M153-F157 PolarHBondContact O-N 3.29Å; M153-F157 VanDerWaalsContact O-N 3.13Å; M153-F157 HydrophobicContact SD-CE2 3.98Å |
| 154 | G | 90.3 | Very high | 89 | Confident | 24 Ų | 24 | 35.2 Ų | 35.2 | 25% | 0.247 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -60.4 | -43.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | G152 F157 I158 | G152-G154 VanDerWaalsContact C-N 3.32Å; G152-G154 PolarHBondContact O-N 3.32Å; G154-F157 PolarHBondContact O-N 3.06Å; G154-I158 WeakPolarHBondContact O-CG1 3.32Å; G154-I158 PolarHBondContact O-N 2.89Å |
| 155 | S | 89.6 | Confident | 89.3 | Confident | 1 Ų | 1 | 34.7 Ų | 34.7 | 1% | 0.007 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.2 | -34.4 | 176.5 | 54.3 | 0 | 0 | 0 | 0 | 112.5 | G152 M153 F157 I158 V159 S210 E213 C231 | G152-S155 PolarHBondContact O-N 2.95Å; G152-S155 PolarHBondContact O-OG 3.38Å; M153-S155 PolarHBondContact O-N 3.2Å; S155-F157 PolarHBondContact O-N 3.41Å; S155-I158 PolarHBondContact O-N 3.48Å; S155-V159 WeakPolarHBondContact O-CG2 3.35Å; S155-V159 PolarHBondContact O-N 2.98Å; S155-S210 PolarHBondContact OG-OG 3.41Å; S155-E213 WeakPolarHBondContact CB-OE2 3.45Å; S155-E213 PolarHBondContact OG-OE2 2.86Å; S155-C231 VanDerWaalsContact CB-SG 3.58Å |
| 156 | T | 89.6 | Confident | 89.5 | Confident | 10 Ų | 10 | 33.8 Ų | 33.8 | 6% | 0.061 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.5 | -48.6 | 173 | 60.6 | 0 | 0 | 0 | 0 | 110.8 | G152 M153 I158 V159 H160 S210 T214 | G152-T156 WeakPolarHBondContact O-CG2 3.42Å; G152-T156 PolarHBondContact O-N 2.95Å; M153-T156 PolarHBondContact O-N 2.9Å; M153-T156 PolarHBondContact O-OG1 3.31Å; T156-I158 VanDerWaalsContact C-N 3.3Å; T156-I158 PolarHBondContact O-N 3.32Å; T156-V159 PolarHBondContact O-N 3.39Å; T156-V159 VanDerWaalsContact O-N 3.13Å; T156-H160 PolarHBondContact O-N 2.89Å; T156-H160 PolarHBondContact O-ND1 3.44Å; T156-S210 WeakPolarHBondContact CA-OG 3.05Å; T156-S210 WeakPolarHBondContact CG2-OG 3.35Å; T156-S210 PolarHBondContact N-OG 3.43Å; T156-T214 HydrophobicContact CG2-CG2 3.76Å |
| 157 | F | 91.2 | Very high | 89.6 | Confident | 80 Ų | 80 | 28.8 Ų | 28.8 | 35% | 0.351 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -59.8 | -38.3 | 176.6 | -76.7 | -61.4 | 0 | 0 | 0 | 113.3 | N104 V105 M153 G154 S155 H160 G161 | N104-F157 HydrophobicContact CB-CE1 3.6Å; N104-F157 HydrophobicContact CB-CZ 3.75Å; V105-F157 HydrophobicContact CG2-CZ 4.03Å; M153-F157 HydrophobicContact CG-CD2 3.84Å; M153-F157 HydrophobicContact CG-CE2 3.52Å; M153-F157 VanDerWaalsContact O-CD2 3.29Å; M153-F157 WeakPolarHBondContact O-CD2 3.48Å; M153-F157 PolarHBondContact O-N 3.29Å; M153-F157 VanDerWaalsContact O-N 3.13Å; M153-F157 HydrophobicContact SD-CE2 3.98Å; G154-F157 PolarHBondContact O-N 3.06Å; S155-F157 PolarHBondContact O-N 3.41Å; F157-H160 WeakPolarHBondContact O-CB 3.25Å; F157-H160 PolarHBondContact O-N 3.02Å; F157-G161 PolarHBondContact O-N 2.87Å |
| 158 | I | 90.9 | Very high | 89.7 | Confident | 40 Ų | 40 | 23.1 Ų | 23.1 | 21% | 0.205 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.3 | -45.8 | 175.2 | -72.4 | 169.2 | 0 | 0 | 0 | 110.9 | G154 S155 T156 H160 G161 I162 L228 V232 | G154-I158 WeakPolarHBondContact O-CG1 3.32Å; G154-I158 PolarHBondContact O-N 2.89Å; S155-I158 PolarHBondContact O-N 3.48Å; T156-I158 VanDerWaalsContact C-N 3.3Å; T156-I158 PolarHBondContact O-N 3.32Å; I158-H160 VanDerWaalsContact C-N 3.26Å; I158-H160 PolarHBondContact O-N 2.93Å; I158-G161 PolarHBondContact O-N 3.38Å; I158-G161 VanDerWaalsContact O-N 3.14Å; I158-I162 HydrophobicContact CG2-CD1 3.77Å; I158-I162 HydrophobicContact CG2-CG1 4.32Å; I158-I162 WeakPolarHBondContact O-CG1 3.31Å; I158-I162 PolarHBondContact O-N 3.47Å; I158-L228 HydrophobicContact CD1-CB 4.1Å; I158-L228 WeakPolarHBondContact CD1-O 3.41Å; I158-V232 HydrophobicContact CG2-CG2 3.55Å |
| 159 | V | 90.2 | Very high | 90 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.1 | -39 | 176.3 | 178.3 | 0 | 0 | 0 | 0 | 110.9 | W43 S155 T156 I162 A163 F206 | W43-V159 HydrophobicContact CE3-CG1 3.79Å; W43-V159 HydrophobicContact CZ3-CB 4.25Å; W43-V159 HydrophobicContact CZ3-CG1 3.62Å; S155-V159 WeakPolarHBondContact O-CG2 3.35Å; S155-V159 PolarHBondContact O-N 2.98Å; T156-V159 PolarHBondContact O-N 3.39Å; T156-V159 VanDerWaalsContact O-N 3.13Å; V159-I162 PolarHBondContact O-N 2.98Å; V159-A163 WeakPolarHBondContact O-CB 3.27Å; V159-A163 PolarHBondContact O-N 2.93Å; V159-F206 HydrophobicContact CG2-CB 3.85Å; V159-F206 WeakPolarHBondContact CG2-O 3.43Å |
| 160 | H | 87.9 | Confident | 90 | Very high | 10 Ų | 10 | 27.6 Ų | 27.6 | 5% | 0.046 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61 | -46 | 174.1 | -70 | 60.1 | 0 | 0 | 0 | 111.3 | W43 V44 T156 F157 I158 A163 L164 | W43-H160 VanDerWaalsContact C-NE2 3.34Å; W43-H160 VanDerWaalsContact CA-NE2 3.29Å; W43-H160 WeakPolarHBondContact CA-NE2 3.46Å; W43-H160 PolarHBondContact N-NE2 3.34Å; W43-H160 VanDerWaalsContact O-CA 3.25Å; W43-H160 WeakPolarHBondContact O-CA 3.39Å; W43-H160 PolarHBondContact O-CD2 2.91Å; W43-H160 VanDerWaalsContact O-CG 3.26Å; V44-H160 PolarHBondContact N-CD2 2.85Å; T156-H160 PolarHBondContact O-N 2.89Å; T156-H160 PolarHBondContact O-ND1 3.44Å; F157-H160 WeakPolarHBondContact O-CB 3.25Å; F157-H160 PolarHBondContact O-N 3.02Å; I158-H160 VanDerWaalsContact C-N 3.26Å; I158-H160 PolarHBondContact O-N 2.93Å; H160-A163 PolarHBondContact O-N 3.24Å; H160-L164 VanDerWaalsContact O-CG 3.29Å; H160-L164 WeakPolarHBondContact O-CG 3.18Å; H160-L164 PolarHBondContact O-N 3.47Å |
| 161 | G | 89.8 | Confident | 89.8 | Confident | 39 Ų | 39 | 24.9 Ų | 24.9 | 40% | 0.402 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -60.5 | -44.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | F157 I158 L164 G165 | F157-G161 PolarHBondContact O-N 2.87Å; I158-G161 PolarHBondContact O-N 3.38Å; I158-G161 VanDerWaalsContact O-N 3.14Å; G161-L164 PolarHBondContact O-N 3.4Å; G161-G165 PolarHBondContact O-N 2.97Å |
| 162 | I | 90.4 | Very high | 89.9 | Confident | 41 Ų | 41 | 32.3 Ų | 32.3 | 21% | 0.21 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.9 | -44.8 | 178.7 | -71.2 | 171.1 | 0 | 0 | 0 | 110.6 | I158 V159 G165 A166 F206 | I158-I162 HydrophobicContact CG2-CD1 3.77Å; I158-I162 HydrophobicContact CG2-CG1 4.32Å; I158-I162 WeakPolarHBondContact O-CG1 3.31Å; I158-I162 PolarHBondContact O-N 3.47Å; V159-I162 PolarHBondContact O-N 2.98Å; I162-G165 PolarHBondContact O-N 2.96Å; I162-A166 VanDerWaalsContact O-CB 3.26Å; I162-A166 WeakPolarHBondContact O-CB 3.47Å; I162-A166 PolarHBondContact O-N 3.26Å; I162-F206 HydrophobicContact CD1-CB 4.08Å; I162-F206 HydrophobicContact CD1-CD1 3.54Å; I162-F206 HydrophobicContact CD1-CD2 3.92Å; I162-F206 HydrophobicContact CD1-CE1 3.87Å; I162-F206 HydrophobicContact CD1-CE2 4.23Å; I162-F206 HydrophobicContact CD1-CG 3.56Å; I162-F206 HydrophobicContact CD1-CZ 4.2Å; I162-F206 HydrophobicContact CG2-CD2 3.85Å; I162-F206 HydrophobicContact CG2-CE2 4.04Å; I162-F206 HydrophobicContact CG2-CG 4.48Å |
| 163 | A | 89.1 | Confident | 90 | Very high | 4 Ų | 4 | 40.2 Ų | 40.2 | 3% | 0.033 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -75.2 | -29.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V44 V159 H160 E167 T199 A203 | V44-A163 HydrophobicContact CG2-CB 3.05Å; V159-A163 WeakPolarHBondContact O-CB 3.27Å; V159-A163 PolarHBondContact O-N 2.93Å; H160-A163 PolarHBondContact O-N 3.24Å; A163-E167 WeakPolarHBondContact O-CB 3.06Å; A163-E167 PolarHBondContact O-N 2.91Å; A163-T199 HydrophobicContact CB-CG2 4.07Å; A163-T199 WeakPolarHBondContact O-CG2 3.47Å; A163-A203 HydrophobicContact CB-CB 3.72Å |
| 164 | L | 88.3 | Confident | 89.8 | Confident | 25 Ų | 25 | 40.7 Ų | 40.7 | 13% | 0.131 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62 | -48.4 | 165.1 | -74.2 | 163 | 0 | 0 | 0 | 112.2 | V44 T45 H160 G161 A166 E167 G168 | V44-L164 HydrophobicContact CB-CD2 4.29Å; V44-L164 HydrophobicContact CB-CG 4.14Å; V44-L164 HydrophobicContact CG1-CB 4.13Å; V44-L164 HydrophobicContact CG1-CD2 3.16Å; V44-L164 HydrophobicContact CG1-CG 3.34Å; T45-L164 VanDerWaalsContact C-CD1 3.4Å; T45-L164 WeakPolarHBondContact O-CD1 3.46Å; H160-L164 VanDerWaalsContact O-CG 3.29Å; H160-L164 WeakPolarHBondContact O-CG 3.18Å; H160-L164 PolarHBondContact O-N 3.47Å; G161-L164 PolarHBondContact O-N 3.4Å; L164-A166 VanDerWaalsContact C-N 3.32Å; L164-E167 PolarHBondContact O-N 3.03Å; L164-G168 PolarHBondContact O-N 2.9Å |
| 165 | G | 90.9 | Very high | 89.4 | Confident | 37 Ų | 37 | 46.1 Ų | 46.1 | 38% | 0.381 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.2 | -43 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | G161 I162 G168 V169 | G161-G165 PolarHBondContact O-N 2.97Å; I162-G165 PolarHBondContact O-N 2.96Å; G165-G168 PolarHBondContact O-N 2.92Å; G165-V169 WeakPolarHBondContact O-CB 3.41Å; G165-V169 VanDerWaalsContact O-CG2 3.23Å; G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.47Å |
| 166 | A | 91.2 | Very high | 89 | Confident | 12 Ų | 12 | 47.5 Ų | 47.5 | 10% | 0.099 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.9 | -47 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | I162 L164 G168 V169 I170 T199 V202 | I162-A166 VanDerWaalsContact O-CB 3.26Å; I162-A166 WeakPolarHBondContact O-CB 3.47Å; I162-A166 PolarHBondContact O-N 3.26Å; L164-A166 VanDerWaalsContact C-N 3.32Å; A166-G168 VanDerWaalsContact C-N 3.34Å; A166-G168 PolarHBondContact O-N 3.45Å; A166-V169 PolarHBondContact O-N 2.94Å; A166-I170 HydrophobicContact CB-CD1 4.45Å; A166-I170 VanDerWaalsContact O-CB 3.3Å; A166-I170 WeakPolarHBondContact O-CB 3.41Å; A166-I170 VanDerWaalsContact O-CD1 3.29Å; A166-I170 WeakPolarHBondContact O-CD1 3.2Å; A166-I170 WeakPolarHBondContact O-CG1 3.43Å; A166-I170 PolarHBondContact O-N 2.96Å; A166-T199 HydrophobicContact CB-CG2 4.44Å; A166-V202 HydrophobicContact CB-CB 4.13Å; A166-V202 HydrophobicContact CB-CG1 3.71Å |
| 167 | E | 89.5 | Confident | 88.5 | Confident | 7 Ų | 7 | 48.6 Ų | 48.6 | 3% | 0.033 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.1 | -45.6 | 176.7 | -172.5 | 170.9 | 163.9 | 0 | 0 | 111.7 | A163 L164 S171 L195 K196 T199 | A163-E167 WeakPolarHBondContact O-CB 3.06Å; A163-E167 PolarHBondContact O-N 2.91Å; L164-E167 PolarHBondContact O-N 3.03Å; E167-S171 VanDerWaalsContact O-CB 3.28Å; E167-S171 WeakPolarHBondContact O-CB 3.31Å; E167-S171 PolarHBondContact O-N 3.03Å; E167-S171 PolarHBondContact O-OG 2.9Å; E167-S171 VanDerWaalsContact O-OG 3.13Å; E167-L195 HydrophobicContact CG-CD1 4.34Å; E167-L195 HydrophobicContact CG-CD2 4.16Å; E167-L195 HydrophobicContact CG-CG 4.18Å; E167-K196 VanDerWaalsContact CD-NZ 3.35Å; E167-K196 IonicContact OE1-NZ 2.85Å; E167-K196 PolarHBondContact OE1-NZ 2.86Å; E167-K196 IonicContact OE2-NZ 3.91Å; E167-K196 PolarHBondContact OE2-NZ 2.98Å; E167-T199 WeakPolarHBondContact CA-OG1 3.27Å; E167-T199 HydrophobicContact CB-CG2 3.98Å |
| 168 | G | 89.1 | Confident | 87.7 | Confident | 14 Ų | 14 | 49.8 Ų | 49.8 | 14% | 0.144 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.5 | -54.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L164 G165 A166 I170 S171 E172 | L164-G168 PolarHBondContact O-N 2.9Å; G165-G168 PolarHBondContact O-N 2.92Å; A166-G168 VanDerWaalsContact C-N 3.34Å; A166-G168 PolarHBondContact O-N 3.45Å; G168-I170 PolarHBondContact O-N 3.34Å; G168-S171 PolarHBondContact O-N 3.25Å; G168-S171 VanDerWaalsContact O-N 3.14Å; G168-S171 PolarHBondContact O-OG 2.93Å; G168-E172 WeakPolarHBondContact O-CG 3.45Å; G168-E172 PolarHBondContact O-N 2.88Å |
| 169 | V | 92.3 | Very high | 86.9 | Confident | 84 Ų | 84 | 53.8 Ų | 53.8 | 51% | 0.509 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -57.3 | -48.6 | 179 | 169 | 0 | 0 | 0 | 0 | 111 | G165 A166 S171 E172 F173 | G165-V169 WeakPolarHBondContact O-CB 3.41Å; G165-V169 VanDerWaalsContact O-CG2 3.23Å; G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.47Å; A166-V169 PolarHBondContact O-N 2.94Å; V169-S171 VanDerWaalsContact C-N 3.31Å; V169-S171 PolarHBondContact O-N 3.16Å; V169-E172 PolarHBondContact O-N 3.33Å; V169-F173 HydrophobicContact CG1-CD2 3.67Å; V169-F173 HydrophobicContact CG1-CE2 3.82Å; V169-F173 WeakPolarHBondContact O-CD2 3.26Å; V169-F173 PolarHBondContact O-N 3.27Å |
| 170 | I | 90.4 | Very high | 86.1 | Confident | 21 Ų | 21 | 55.3 Ų | 55.3 | 11% | 0.108 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 178.4 | -65.6 | 160.9 | 0 | 0 | 0 | 110.1 | A166 G168 E172 F173 T174 L176 L195 L198 V202 | A166-I170 HydrophobicContact CB-CD1 4.45Å; A166-I170 VanDerWaalsContact O-CB 3.3Å; A166-I170 WeakPolarHBondContact O-CB 3.41Å; A166-I170 VanDerWaalsContact O-CD1 3.29Å; A166-I170 WeakPolarHBondContact O-CD1 3.2Å; A166-I170 WeakPolarHBondContact O-CG1 3.43Å; A166-I170 PolarHBondContact O-N 2.96Å; G168-I170 PolarHBondContact O-N 3.34Å; I170-E172 VanDerWaalsContact C-N 3.27Å; I170-E172 PolarHBondContact O-N 3.37Å; I170-F173 PolarHBondContact O-N 2.98Å; I170-T174 HydrophobicContact CG2-CG2 4.21Å; I170-T174 WeakPolarHBondContact O-CB 3.45Å; I170-T174 PolarHBondContact O-N 3.47Å; I170-T174 PolarHBondContact O-OG1 3.31Å; I170-L176 HydrophobicContact CG2-CD1 4.38Å; I170-L195 HydrophobicContact CB-CD1 3.73Å; I170-L195 HydrophobicContact CG2-CD1 3.35Å; I170-L198 HydrophobicContact CD1-CB 4.22Å; I170-L198 HydrophobicContact CD1-CD2 3.92Å; I170-L198 HydrophobicContact CD1-CG 3.72Å; I170-L198 HydrophobicContact CG1-CD2 4.14Å; I170-L198 HydrophobicContact CG1-CG 4.46Å; I170-L198 HydrophobicContact CG2-CD2 3.75Å; I170-V202 HydrophobicContact CD1-CG2 4.32Å |
| 171 | S | 88.6 | Confident | 85.2 | Confident | 25 Ų | 25 | 57.4 Ų | 57.4 | 18% | 0.175 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.4 | -24.4 | 179.5 | 69.9 | 0 | 0 | 0 | 0 | 114.2 | E167 G168 V169 T174 | E167-S171 VanDerWaalsContact O-CB 3.28Å; E167-S171 WeakPolarHBondContact O-CB 3.31Å; E167-S171 PolarHBondContact O-N 3.03Å; E167-S171 PolarHBondContact O-OG 2.9Å; E167-S171 VanDerWaalsContact O-OG 3.13Å; G168-S171 PolarHBondContact O-N 3.25Å; G168-S171 VanDerWaalsContact O-N 3.14Å; G168-S171 PolarHBondContact O-OG 2.93Å; V169-S171 VanDerWaalsContact C-N 3.31Å; V169-S171 PolarHBondContact O-N 3.16Å; S171-T174 CarbonylContact C-O 3.6Å |
| 172 | E | 90.9 | Very high | 84.1 | Confident | 161 Ų | 161 | 65 Ų | 65 | 75% | 0.752 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -78.9 | -40.3 | 173.4 | -70 | -66.8 | 159.8 | 0 | 0 | 111.5 | G168 V169 I170 | G168-E172 WeakPolarHBondContact O-CG 3.45Å; G168-E172 PolarHBondContact O-N 2.88Å; V169-E172 PolarHBondContact O-N 3.33Å; I170-E172 VanDerWaalsContact C-N 3.27Å; I170-E172 PolarHBondContact O-N 3.37Å |
| 173 | F | 89.2 | Confident | 83.1 | Confident | 176 Ų | 176 | 68 Ų | 68 | 77% | 0.772 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -84.4 | -14.3 | -178.8 | -75 | -70.2 | 0 | 0 | 0 | 114.2 | V169 I170 | V169-F173 HydrophobicContact CG1-CD2 3.67Å; V169-F173 HydrophobicContact CG1-CE2 3.82Å; V169-F173 WeakPolarHBondContact O-CD2 3.26Å; V169-F173 PolarHBondContact O-N 3.27Å; I170-F173 PolarHBondContact O-N 2.98Å |
| 174 | T | 87 | Confident | 82.7 | Confident | 44 Ų | 44 | 72.1 Ų | 72.1 | 27% | 0.27 | 39% | 0.387 | S | S | . | . | S | Bend | trans | -126.9 | 146.3 | -179.3 | 68.5 | 0 | 0 | 0 | 0 | 110.1 | I170 S171 L176 | I170-T174 HydrophobicContact CG2-CG2 4.21Å; I170-T174 WeakPolarHBondContact O-CB 3.45Å; I170-T174 PolarHBondContact O-N 3.47Å; I170-T174 PolarHBondContact O-OG1 3.31Å; S171-T174 CarbonylContact C-O 3.6Å; T174-L176 PolarHBondContact O-N 2.89Å; T174-L176 WeakPolarHBondContact OG1-CD1 3.35Å; T174-L176 VanDerWaalsContact OG1-CG 3.25Å; T174-L176 WeakPolarHBondContact OG1-CG 3.28Å |
| 175 | P | 81.1 | Confident | 82.6 | Confident | 137 Ų | 137 | 73.7 Ų | 73.7 | 89% | 0.89 | 40% | 0.4 | S | S | * | . | trans | -74.5 | 27.3 | 177.1 | 33.6 | -37.4 | 0 | 0 | 0 | 112.7 | ||||
| 176 | L | 82 | Confident | 82.3 | Confident | 31 Ų | 31 | 81.6 Ų | 81.6 | 16% | 0.162 | 42% | 0.418 | C | S | . | . | trans | -81.7 | 127.7 | -176.3 | -61.2 | 176.8 | 0 | 0 | 0 | 109.8 | I170 T174 R178 L194 L195 | I170-L176 HydrophobicContact CG2-CD1 4.38Å; T174-L176 PolarHBondContact O-N 2.89Å; T174-L176 WeakPolarHBondContact OG1-CD1 3.35Å; T174-L176 VanDerWaalsContact OG1-CG 3.25Å; T174-L176 WeakPolarHBondContact OG1-CG 3.28Å; L176-R178 PolarHBondContact O-N 3.29Å; L176-L194 HydrophobicContact CD1-CD2 4.31Å; L176-L194 HydrophobicContact CD1-CG 4.3Å; L176-L194 HydrophobicContact CD2-CD2 4.2Å; L176-L195 HydrophobicContact CB-CB 4.09Å; L176-L195 HydrophobicContact CD1-CB 4.12Å | ||
| 177 | P | 78.6 | Confident | 82 | Confident | 33 Ų | 33 | 89.6 Ų | 89.6 | 21% | 0.214 | 45% | 0.451 | C | S | . | . | trans | -69.8 | 122.2 | -176.3 | 26.5 | -32.3 | 0 | 0 | 0 | 111.2 | Q188 H192 | P177-Q188 HydrophobicContact CG-CB 4.22Å; P177-Q188 WeakPolarHBondContact CG-O 3.31Å; P177-H192 HydrophobicContact CG-CB 4.18Å; P177-H192 PolarHBondContact O-ND1 2.88Å | ||
| 178 | R | 74.3 | Confident | 81.9 | Confident | 104 Ų | 104 | 93.1 Ų | 93.1 | 39% | 0.392 | 47% | 0.467 | S | S | . | . | S | Bend | trans | -69.6 | -42.5 | 175.1 | -169.2 | 173.7 | -178.7 | 170.2 | -2.2 | 112.1 | L176 H192 L195 | L176-R178 PolarHBondContact O-N 3.29Å; R178-H192 PolarHBondContact O-CE1 2.83Å; R178-H192 PolarHBondContact O-ND1 2.81Å; R178-H192 VanDerWaalsContact O-ND1 3.09Å; R178-L195 HydrophobicContact CB-CD2 4.43Å |
| 179 | E | 73.9 | Confident | 81.8 | Confident | 124 Ų | 124 | 93.8 Ų | 93.8 | 58% | 0.579 | 47% | 0.467 | S | S | * | . | S | Bend | trans | -115.3 | 146.3 | 177 | -45.3 | -172.6 | 174.5 | 0 | 0 | 109.9 | E37 | E37-E179 WeakPolarHBondContact OE1-CG 3.45Å; E37-E179 WeakPolarHBondContact OE2-CG 3.39Å |
| 180 | L | 73.3 | Confident | 81.6 | Confident | 33 Ų | 33 | 92.6 Ų | 92.6 | 17% | 0.173 | 47% | 0.466 | C | S | . | . | trans | -89 | 123.8 | 175.1 | -72.4 | 175.4 | 0 | 0 | 0 | 110.6 | L189 H192 Y268 | L180-L189 HydrophobicContact CD1-CD1 3.76Å; L180-H192 HydrophobicContact CD2-CB 3.73Å; L180-H192 HydrophobicContact CG-CB 4.15Å; L180-Y268 VanDerWaalsContact CD1-OH 3.29Å; L180-Y268 WeakPolarHBondContact CD1-OH 3.4Å | ||
| 181 | P | 70.4 | Confident | 81.5 | Confident | 53 Ų | 53 | 92.1 Ų | 92.1 | 34% | 0.344 | 47% | 0.466 | S | S | . | . | trans | -66 | 158.4 | 175 | 27.9 | -34 | 0 | 0 | 0 | 111.4 | S183 W184 | P181-S183 WeakPolarHBondContact CG-O 3.47Å; P181-S183 PolarHBondContact O-N 2.9Å; P181-W184 HydrophobicContact CG-CB 4.43Å | ||
| 182 | H | 66.5 | Low | 81.5 | Confident | 199 Ų | 199 | 90.9 Ų | 90.9 | 92% | 0.921 | 46% | 0.458 | S | S | * | . | S | Bend | trans | -55.1 | -36.3 | 179.9 | -170.3 | 66.6 | 0 | 0 | 0 | 112.9 | ||
| 183 | S | 68.1 | Low | 81.4 | Confident | 104 Ų | 104 | 85 Ų | 85 | 73% | 0.727 | 43% | 0.431 | S | S | * | . | S | Bend | trans | -110.4 | 108.9 | 168.9 | 58.8 | 0 | 0 | 0 | 0 | 109.8 | P181 | P181-S183 WeakPolarHBondContact CG-O 3.47Å; P181-S183 PolarHBondContact O-N 2.9Å |
| 184 | W | 80.6 | Confident | 81.6 | Confident | 90 Ų | 90 | 81.6 Ų | 81.6 | 34% | 0.341 | 42% | 0.421 | S | S | . | . | trans | -115 | 140 | -169.7 | 49.9 | -76 | 0 | 0 | 0 | 112 | P181 W186 L189 | P181-W184 HydrophobicContact CG-CB 4.43Å; W184-W186 HydrophobicContact CZ3-CE3 4.49Å; W184-L189 HydrophobicContact CE3-CB 3.58Å; W184-L189 HydrophobicContact CE3-CD1 4.42Å; W184-L189 HydrophobicContact CE3-CD2 4.12Å; W184-L189 HydrophobicContact CE3-CG 4.22Å; W184-L189 HydrophobicContact CH2-CD2 3.82Å; W184-L189 HydrophobicContact CZ3-CB 3.62Å; W184-L189 HydrophobicContact CZ3-CD1 4.18Å; W184-L189 HydrophobicContact CZ3-CD2 3.25Å; W184-L189 HydrophobicContact CZ3-CG 3.83Å | ||
| 185 | S | 86 | Confident | 81.7 | Confident | 58 Ų | 58 | 79.5 Ų | 79.5 | 41% | 0.406 | 41% | 0.408 | S | S | . | . | trans | -84.8 | 151.3 | 171 | 176.7 | 0 | 0 | 0 | 0 | 111.2 | K187 Q188 L189 | S185-K187 PolarHBondContact O-N 3.38Å; S185-K187 PolarHBondContact OG-N 2.73Å; S185-Q188 WeakPolarHBondContact O-CB 3.49Å; S185-Q188 PolarHBondContact O-N 3.37Å; S185-L189 PolarHBondContact O-N 3.14Å | ||
| 186 | W | 84.6 | Confident | 82.1 | Confident | 204 Ų | 204 | 73.9 Ų | 73.9 | 77% | 0.773 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -55.6 | -33.1 | 172.9 | -70 | 104.7 | 0 | 0 | 0 | 113.1 | W184 L189 A190 | W184-W186 HydrophobicContact CZ3-CE3 4.49Å; W186-L189 HydrophobicContact CE3-CD2 4.4Å; W186-L189 HydrophobicContact CZ3-CD2 4.35Å; W186-A190 WeakPolarHBondContact O-CB 3.33Å; W186-A190 PolarHBondContact O-N 3.43Å |
| 187 | K | 86.6 | Confident | 82.6 | Confident | 180 Ų | 180 | 72.6 Ų | 72.6 | 78% | 0.783 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -67.5 | -38.8 | 175 | -66.3 | -176.1 | 179.8 | -179.9 | 0 | 112 | S185 G191 | S185-K187 PolarHBondContact O-N 3.38Å; S185-K187 PolarHBondContact OG-N 2.73Å; K187-G191 PolarHBondContact O-N 2.83Å |
| 188 | Q | 85.9 | Confident | 83.2 | Confident | 80 Ų | 80 | 74.5 Ų | 74.5 | 37% | 0.374 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -71 | -40.4 | 177.7 | -69.9 | 169.3 | -35.2 | 0 | 0 | 111.2 | P177 S185 G191 H192 | P177-Q188 HydrophobicContact CG-CB 4.22Å; P177-Q188 WeakPolarHBondContact CG-O 3.31Å; S185-Q188 WeakPolarHBondContact O-CB 3.49Å; S185-Q188 PolarHBondContact O-N 3.37Å; Q188-G191 PolarHBondContact O-N 2.9Å; Q188-H192 WeakPolarHBondContact O-CB 3.46Å; Q188-H192 PolarHBondContact O-N 3.36Å |
| 189 | L | 87.5 | Confident | 84.1 | Confident | 29 Ų | 29 | 70 Ų | 70 | 15% | 0.152 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -60.7 | -50 | 172 | 179.3 | 68.1 | 0 | 0 | 0 | 111.1 | L180 W184 S185 W186 G191 H192 L193 | L180-L189 HydrophobicContact CD1-CD1 3.76Å; W184-L189 HydrophobicContact CE3-CB 3.58Å; W184-L189 HydrophobicContact CE3-CD1 4.42Å; W184-L189 HydrophobicContact CE3-CD2 4.12Å; W184-L189 HydrophobicContact CE3-CG 4.22Å; W184-L189 HydrophobicContact CH2-CD2 3.82Å; W184-L189 HydrophobicContact CZ3-CB 3.62Å; W184-L189 HydrophobicContact CZ3-CD1 4.18Å; W184-L189 HydrophobicContact CZ3-CD2 3.25Å; W184-L189 HydrophobicContact CZ3-CG 3.83Å; S185-L189 PolarHBondContact O-N 3.14Å; W186-L189 HydrophobicContact CE3-CD2 4.4Å; W186-L189 HydrophobicContact CZ3-CD2 4.35Å; L189-G191 VanDerWaalsContact C-N 3.26Å; L189-G191 PolarHBondContact O-N 3.47Å; L189-H192 PolarHBondContact O-N 2.98Å; L189-H192 VanDerWaalsContact O-N 3.16Å; L189-L193 HydrophobicContact CD1-CD1 4.24Å; L189-L193 HydrophobicContact CD1-CD2 4.36Å; L189-L193 HydrophobicContact CD1-CG 4.08Å; L189-L193 HydrophobicContact CD2-CD1 4.34Å; L189-L193 HydrophobicContact CG-CD1 3.99Å; L189-L193 HydrophobicContact CG-CG 4.2Å; L189-L193 WeakPolarHBondContact O-CG 3.39Å; L189-L193 PolarHBondContact O-N 3.28Å |
| 190 | A | 87.7 | Confident | 85 | Confident | 59 Ų | 59 | 64.9 Ų | 64.9 | 49% | 0.488 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -58.4 | -41.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | W186 L193 L194 | W186-A190 WeakPolarHBondContact O-CB 3.33Å; W186-A190 PolarHBondContact O-N 3.43Å; A190-L193 PolarHBondContact O-N 3.14Å; A190-L194 VanDerWaalsContact O-CB 3.31Å; A190-L194 WeakPolarHBondContact O-CB 3.45Å; A190-L194 PolarHBondContact O-N 2.74Å |
| 191 | G | 88.3 | Confident | 85.9 | Confident | 10 Ų | 10 | 65.2 Ų | 65.2 | 10% | 0.103 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 175 | 0 | 0 | 0 | 0 | 0 | 113.2 | K187 Q188 L189 L194 L195 | K187-G191 PolarHBondContact O-N 2.83Å; Q188-G191 PolarHBondContact O-N 2.9Å; L189-G191 VanDerWaalsContact C-N 3.26Å; L189-G191 PolarHBondContact O-N 3.47Å; G191-L194 PolarHBondContact O-N 2.85Å; G191-L195 PolarHBondContact O-N 2.89Å |
| 192 | H | 88.6 | Confident | 87 | Confident | 0 Ų | 0 | 65.7 Ų | 65.7 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 176.4 | -176.1 | 75.3 | 0 | 0 | 0 | 112.2 | P177 R178 L180 Q188 L189 L194 L195 K196 Y268 | P177-H192 HydrophobicContact CG-CB 4.18Å; P177-H192 PolarHBondContact O-ND1 2.88Å; R178-H192 PolarHBondContact O-CE1 2.83Å; R178-H192 PolarHBondContact O-ND1 2.81Å; R178-H192 VanDerWaalsContact O-ND1 3.09Å; L180-H192 HydrophobicContact CD2-CB 3.73Å; L180-H192 HydrophobicContact CG-CB 4.15Å; Q188-H192 WeakPolarHBondContact O-CB 3.46Å; Q188-H192 PolarHBondContact O-N 3.36Å; L189-H192 PolarHBondContact O-N 2.98Å; L189-H192 VanDerWaalsContact O-N 3.16Å; H192-L194 VanDerWaalsContact C-N 3.31Å; H192-L194 PolarHBondContact O-N 2.98Å; H192-L195 WeakPolarHBondContact O-CB 3.34Å; H192-L195 PolarHBondContact O-N 3.27Å; H192-K196 WeakPolarHBondContact NE2-CE 3.49Å; H192-K196 WeakPolarHBondContact O-CG 3.35Å; H192-K196 PolarHBondContact O-N 2.99Å; H192-Y268 AromaticContact CD2-CE1 3.81Å; H192-Y268 AromaticContact CD2-CE2 3.82Å; H192-Y268 AromaticContact CD2-CZ 3.38Å; H192-Y268 PolarHBondContact CD2-OH 3.44Å; H192-Y268 VanDerWaalsContact CD2-OH 3.26Å; H192-Y268 AromaticContact NE2-CE1 3.93Å; H192-Y268 AromaticContact NE2-CE2 3.06Å; H192-Y268 WeakPolarHBondContact NE2-CE2 3.09Å; H192-Y268 AromaticContact NE2-CZ 3.06Å; H192-Y268 PolarHBondContact NE2-OH 2.9Å |
| 193 | L | 89.8 | Confident | 88.2 | Confident | 37 Ų | 37 | 56.6 Ų | 56.6 | 19% | 0.194 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.6 | -37.9 | 176.6 | -64.3 | -179.1 | 0 | 0 | 0 | 111.5 | L189 A190 K196 G197 I265 Y268 | L189-L193 HydrophobicContact CD1-CD1 4.24Å; L189-L193 HydrophobicContact CD1-CD2 4.36Å; L189-L193 HydrophobicContact CD1-CG 4.08Å; L189-L193 HydrophobicContact CD2-CD1 4.34Å; L189-L193 HydrophobicContact CG-CD1 3.99Å; L189-L193 HydrophobicContact CG-CG 4.2Å; L189-L193 WeakPolarHBondContact O-CG 3.39Å; L189-L193 PolarHBondContact O-N 3.28Å; A190-L193 PolarHBondContact O-N 3.14Å; L193-K196 PolarHBondContact O-N 3.42Å; L193-G197 PolarHBondContact O-N 3.06Å; L193-I265 HydrophobicContact CB-CG2 4.31Å; L193-I265 HydrophobicContact CD1-CG2 4.33Å; L193-I265 HydrophobicContact CD2-CG2 4.23Å; L193-I265 WeakPolarHBondContact O-CG1 3.45Å; L193-Y268 HydrophobicContact CD2-CD1 3.54Å; L193-Y268 HydrophobicContact CD2-CE1 3.85Å |
| 194 | L | 91.8 | Very high | 89.3 | Confident | 105 Ų | 105 | 51.7 Ų | 51.7 | 55% | 0.55 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -63 | -43 | 174.2 | -179.7 | 61.8 | 0 | 0 | 0 | 111.5 | L176 A190 G191 H192 G197 L198 | L176-L194 HydrophobicContact CD1-CD2 4.31Å; L176-L194 HydrophobicContact CD1-CG 4.3Å; L176-L194 HydrophobicContact CD2-CD2 4.2Å; A190-L194 VanDerWaalsContact O-CB 3.31Å; A190-L194 WeakPolarHBondContact O-CB 3.45Å; A190-L194 PolarHBondContact O-N 2.74Å; G191-L194 PolarHBondContact O-N 2.85Å; H192-L194 VanDerWaalsContact C-N 3.31Å; H192-L194 PolarHBondContact O-N 2.98Å; L194-G197 PolarHBondContact O-N 3.44Å; L194-L198 WeakPolarHBondContact O-CB 3.46Å; L194-L198 PolarHBondContact O-N 3.5Å |
| 195 | L | 91 | Very high | 89.8 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -56.9 | -51.2 | 174.6 | 177 | 63.2 | 0 | 0 | 0 | 110.7 | E167 I170 L176 R178 G191 H192 G197 L198 T199 | E167-L195 HydrophobicContact CG-CD1 4.34Å; E167-L195 HydrophobicContact CG-CD2 4.16Å; E167-L195 HydrophobicContact CG-CG 4.18Å; I170-L195 HydrophobicContact CB-CD1 3.73Å; I170-L195 HydrophobicContact CG2-CD1 3.35Å; L176-L195 HydrophobicContact CB-CB 4.09Å; L176-L195 HydrophobicContact CD1-CB 4.12Å; R178-L195 HydrophobicContact CB-CD2 4.43Å; G191-L195 PolarHBondContact O-N 2.89Å; H192-L195 WeakPolarHBondContact O-CB 3.34Å; H192-L195 PolarHBondContact O-N 3.27Å; L195-G197 VanDerWaalsContact C-N 3.32Å; L195-G197 PolarHBondContact O-N 3.38Å; L195-L198 PolarHBondContact O-N 2.86Å; L195-T199 WeakPolarHBondContact O-CB 3.41Å; L195-T199 PolarHBondContact O-N 3.21Å; L195-T199 PolarHBondContact O-OG1 3.49Å |
| 196 | K | 89.3 | Confident | 90.1 | Very high | 18 Ų | 18 | 45.8 Ų | 45.8 | 8% | 0.078 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.8 | -41.1 | 177.9 | -64.7 | -59.9 | -175 | -169.5 | 0 | 112.4 | E167 H192 L193 A200 Y268 | E167-K196 VanDerWaalsContact CD-NZ 3.35Å; E167-K196 IonicContact OE1-NZ 2.85Å; E167-K196 PolarHBondContact OE1-NZ 2.86Å; E167-K196 IonicContact OE2-NZ 3.91Å; E167-K196 PolarHBondContact OE2-NZ 2.98Å; H192-K196 WeakPolarHBondContact NE2-CE 3.49Å; H192-K196 WeakPolarHBondContact O-CG 3.35Å; H192-K196 PolarHBondContact O-N 2.99Å; L193-K196 PolarHBondContact O-N 3.42Å; K196-A200 PolarHBondContact O-N 3.28Å; K196-A200 VanDerWaalsContact O-N 3.11Å; K196-Y268 HydrophobicContact CG-CD2 4.31Å |
| 197 | G | 91.6 | Very high | 90.4 | Very high | 5 Ų | 5 | 37.1 Ų | 37.1 | 5% | 0.052 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.4 | -45.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | L193 L194 L195 A200 V201 | L193-G197 PolarHBondContact O-N 3.06Å; L194-G197 PolarHBondContact O-N 3.44Å; L195-G197 VanDerWaalsContact C-N 3.32Å; L195-G197 PolarHBondContact O-N 3.38Å; G197-A200 PolarHBondContact O-N 3.34Å; G197-V201 WeakPolarHBondContact O-CG2 3.32Å; G197-V201 PolarHBondContact O-N 2.83Å; G197-V201 VanDerWaalsContact O-N 3.08Å |
| 198 | L | 92.4 | Very high | 90.6 | Very high | 73 Ų | 73 | 28.6 Ų | 28.6 | 38% | 0.382 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -67.9 | -41.2 | 179.9 | -173.6 | 59.9 | 0 | 0 | 0 | 111.7 | I170 L194 L195 A200 V201 V202 | I170-L198 HydrophobicContact CD1-CB 4.22Å; I170-L198 HydrophobicContact CD1-CD2 3.92Å; I170-L198 HydrophobicContact CD1-CG 3.72Å; I170-L198 HydrophobicContact CG1-CD2 4.14Å; I170-L198 HydrophobicContact CG1-CG 4.46Å; I170-L198 HydrophobicContact CG2-CD2 3.75Å; L194-L198 WeakPolarHBondContact O-CB 3.46Å; L194-L198 PolarHBondContact O-N 3.5Å; L195-L198 PolarHBondContact O-N 2.86Å; L198-A200 VanDerWaalsContact C-N 3.3Å; L198-A200 PolarHBondContact O-N 3.48Å; L198-V201 WeakPolarHBondContact O-CB 3.43Å; L198-V201 PolarHBondContact O-N 3.5Å; L198-V201 VanDerWaalsContact O-N 3.16Å; L198-V202 WeakPolarHBondContact O-CG2 3.44Å; L198-V202 PolarHBondContact O-N 3.49Å |
| 199 | T | 92.9 | Very high | 90.8 | Very high | 8 Ų | 8 | 25 Ų | 25 | 5% | 0.049 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -55.6 | -46.1 | 172.2 | -61.8 | 0 | 0 | 0 | 0 | 111.2 | A163 A166 E167 L195 V201 V202 A203 | A163-T199 HydrophobicContact CB-CG2 4.07Å; A163-T199 WeakPolarHBondContact O-CG2 3.47Å; A166-T199 HydrophobicContact CB-CG2 4.44Å; E167-T199 WeakPolarHBondContact CA-OG1 3.27Å; E167-T199 HydrophobicContact CB-CG2 3.98Å; L195-T199 WeakPolarHBondContact O-CB 3.41Å; L195-T199 PolarHBondContact O-N 3.21Å; L195-T199 PolarHBondContact O-OG1 3.49Å; T199-V201 VanDerWaalsContact C-N 3.32Å; T199-V201 PolarHBondContact O-N 2.9Å; T199-V202 PolarHBondContact O-N 3.38Å; T199-A203 WeakPolarHBondContact O-CB 3.39Å; T199-A203 PolarHBondContact O-N 2.95Å |
| 200 | A | 91.8 | Very high | 91 | Very high | 18 Ų | 18 | 23.6 Ų | 23.6 | 15% | 0.149 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.8 | -36.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K196 G197 L198 A203 L204 V260 A264 | K196-A200 PolarHBondContact O-N 3.28Å; K196-A200 VanDerWaalsContact O-N 3.11Å; G197-A200 PolarHBondContact O-N 3.34Å; L198-A200 VanDerWaalsContact C-N 3.3Å; L198-A200 PolarHBondContact O-N 3.48Å; A200-A203 PolarHBondContact O-N 3.48Å; A200-L204 PolarHBondContact O-N 2.85Å; A200-V260 HydrophobicContact CB-CG1 4.13Å; A200-A264 HydrophobicContact CB-CB 3.61Å |
| 201 | V | 92.6 | Very high | 91.2 | Very high | 40 Ų | 40 | 20.8 Ų | 20.8 | 24% | 0.242 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -65 | -44.7 | 174.9 | 166 | 0 | 0 | 0 | 0 | 111.6 | G197 L198 T199 A203 L204 L257 A261 | G197-V201 WeakPolarHBondContact O-CG2 3.32Å; G197-V201 PolarHBondContact O-N 2.83Å; G197-V201 VanDerWaalsContact O-N 3.08Å; L198-V201 WeakPolarHBondContact O-CB 3.43Å; L198-V201 PolarHBondContact O-N 3.5Å; L198-V201 VanDerWaalsContact O-N 3.16Å; T199-V201 VanDerWaalsContact C-N 3.32Å; T199-V201 PolarHBondContact O-N 2.9Å; V201-A203 VanDerWaalsContact C-N 3.3Å; V201-A203 PolarHBondContact O-N 3.44Å; V201-L204 WeakPolarHBondContact O-CB 3.23Å; V201-L204 PolarHBondContact O-N 3.34Å; V201-L257 HydrophobicContact CG1-CD2 3.79Å; V201-L257 HydrophobicContact CG2-CB 4.3Å; V201-A261 HydrophobicContact CG2-CB 4.04Å |
| 202 | V | 92.6 | Very high | 91.3 | Very high | 62 Ų | 62 | 21 Ų | 21 | 38% | 0.376 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -64.9 | -36.9 | 177.2 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | A166 I170 L198 T199 P205 | A166-V202 HydrophobicContact CB-CB 4.13Å; A166-V202 HydrophobicContact CB-CG1 3.71Å; I170-V202 HydrophobicContact CD1-CG2 4.32Å; L198-V202 WeakPolarHBondContact O-CG2 3.44Å; L198-V202 PolarHBondContact O-N 3.49Å; T199-V202 PolarHBondContact O-N 3.38Å; V202-P205 WeakPolarHBondContact O-CD 3.33Å |
| 203 | A | 92.1 | Very high | 91.3 | Very high | 9 Ų | 9 | 22 Ų | 22 | 7% | 0.074 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -73.6 | -24.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114 | A163 T199 A200 V201 F206 Y207 | A163-A203 HydrophobicContact CB-CB 3.72Å; T199-A203 WeakPolarHBondContact O-CB 3.39Å; T199-A203 PolarHBondContact O-N 2.95Å; A200-A203 PolarHBondContact O-N 3.48Å; V201-A203 VanDerWaalsContact C-N 3.3Å; V201-A203 PolarHBondContact O-N 3.44Å; A203-F206 PolarHBondContact O-N 2.93Å; A203-Y207 PolarHBondContact O-N 3.15Å |
| 204 | L | 91.8 | Very high | 91.4 | Very high | 1 Ų | 1 | 20.3 Ų | 20.3 | 1% | 0.005 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -49.7 | -51.5 | -171.2 | 179.2 | 57.1 | 0 | 0 | 0 | 115.7 | A200 V201 F206 Y207 C208 L253 L256 L257 V260 | A200-L204 PolarHBondContact O-N 2.85Å; V201-L204 WeakPolarHBondContact O-CB 3.23Å; V201-L204 PolarHBondContact O-N 3.34Å; L204-F206 VanDerWaalsContact C-N 3.29Å; L204-F206 PolarHBondContact O-N 3.49Å; L204-Y207 HydrophobicContact CD1-CD1 4.33Å; L204-Y207 WeakPolarHBondContact O-CB 3.45Å; L204-Y207 PolarHBondContact O-N 3.39Å; L204-Y207 VanDerWaalsContact O-N 3.17Å; L204-C208 PolarHBondContact O-N 2.95Å; L204-C208 PolarHBondContact O-SG 3.25Å; L204-C208 VanDerWaalsContact O-SG 3.38Å; L204-L253 HydrophobicContact CG-CD2 4.47Å; L204-L256 HydrophobicContact CD2-CB 3.77Å; L204-L257 HydrophobicContact CD2-CD2 3.75Å; L204-V260 HydrophobicContact CD1-CB 4.39Å; L204-V260 HydrophobicContact CD1-CG1 4.22Å; L204-V260 HydrophobicContact CD1-CG2 3.67Å; L204-V260 HydrophobicContact CD2-CG2 4.24Å |
| 205 | P | 91.3 | Very high | 91.4 | Very high | 6 Ų | 6 | 15.3 Ų | 15.3 | 4% | 0.039 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -59.5 | -40.7 | -178.4 | 20.7 | -33 | 0 | 0 | 0 | 112.8 | V202 C208 A209 G235 R238 L239 L253 | V202-P205 WeakPolarHBondContact O-CD 3.33Å; P205-C208 PolarHBondContact O-N 2.69Å; P205-A209 PolarHBondContact O-N 3.38Å; P205-G235 WeakPolarHBondContact CB-O 3.31Å; P205-R238 HydrophobicContact CB-CB 4.48Å; P205-L239 HydrophobicContact CB-CB 4.42Å; P205-L239 HydrophobicContact CG-CB 4.43Å; P205-L239 HydrophobicContact CG-CD1 4.44Å; P205-L253 HydrophobicContact CB-CD1 3.92Å |
| 206 | F | 92.1 | Very high | 91.4 | Very high | 17 Ų | 17 | 17.5 Ų | 17.5 | 8% | 0.075 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -71.7 | -37.3 | 177 | -53.5 | -79 | 0 | 0 | 0 | 111.4 | V159 I162 A203 L204 C208 A209 S210 V232 L236 | V159-F206 HydrophobicContact CG2-CB 3.85Å; V159-F206 WeakPolarHBondContact CG2-O 3.43Å; I162-F206 HydrophobicContact CD1-CB 4.08Å; I162-F206 HydrophobicContact CD1-CD1 3.54Å; I162-F206 HydrophobicContact CD1-CD2 3.92Å; I162-F206 HydrophobicContact CD1-CE1 3.87Å; I162-F206 HydrophobicContact CD1-CE2 4.23Å; I162-F206 HydrophobicContact CD1-CG 3.56Å; I162-F206 HydrophobicContact CD1-CZ 4.2Å; I162-F206 HydrophobicContact CG2-CD2 3.85Å; I162-F206 HydrophobicContact CG2-CE2 4.04Å; I162-F206 HydrophobicContact CG2-CG 4.48Å; A203-F206 PolarHBondContact O-N 2.93Å; L204-F206 VanDerWaalsContact C-N 3.29Å; L204-F206 PolarHBondContact O-N 3.49Å; F206-C208 VanDerWaalsContact C-N 3.35Å; F206-C208 PolarHBondContact O-N 2.83Å; F206-A209 PolarHBondContact O-N 3.45Å; F206-A209 VanDerWaalsContact O-N 3.17Å; F206-S210 PolarHBondContact O-N 2.85Å; F206-V232 HydrophobicContact CE1-CG1 4.08Å; F206-L236 HydrophobicContact CE1-CD2 4.43Å; F206-L236 HydrophobicContact CE1-CG 4.15Å; F206-L236 HydrophobicContact CZ-CD2 4.03Å; F206-L236 HydrophobicContact CZ-CG 4.25Å |
| 207 | Y | 91.6 | Very high | 91.2 | Very high | 23 Ų | 23 | 16.7 Ų | 16.7 | 9% | 0.09 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -58.4 | -48 | 172.8 | 172 | -135.1 | 0 | 0 | 0 | 111.3 | W43 A203 L204 A209 S210 L211 H325 | W43-Y207 HydrophobicContact CE3-CD2 4.21Å; W43-Y207 AromaticContact CH2-CD2 2.9Å; W43-Y207 HydrophobicContact CH2-CD2 2.9Å; W43-Y207 AromaticContact CH2-CE2 2.84Å; W43-Y207 HydrophobicContact CH2-CE2 2.84Å; W43-Y207 AromaticContact CH2-CG 3.97Å; W43-Y207 HydrophobicContact CH2-CG 3.97Å; W43-Y207 AromaticContact CH2-CZ 3.78Å; W43-Y207 AromaticContact CZ2-CD2 3.48Å; W43-Y207 HydrophobicContact CZ2-CD2 3.48Å; W43-Y207 VanDerWaalsContact CZ2-CD2 3.48Å; W43-Y207 HydrophobicContact CZ2-CE1 4.4Å; W43-Y207 AromaticContact CZ2-CE2 2.99Å; W43-Y207 HydrophobicContact CZ2-CE2 2.99Å; W43-Y207 HydrophobicContact CZ2-CG 4.38Å; W43-Y207 AromaticContact CZ2-CZ 3.43Å; W43-Y207 VanDerWaalsContact CZ2-CZ 3.43Å; W43-Y207 WeakPolarHBondContact CZ2-OH 3.22Å; W43-Y207 AromaticContact CZ3-CD2 3.27Å; W43-Y207 HydrophobicContact CZ3-CD2 3.27Å; W43-Y207 AromaticContact CZ3-CE2 3.74Å; W43-Y207 HydrophobicContact CZ3-CE2 3.74Å; W43-Y207 HydrophobicContact CZ3-CG 4.04Å; A203-Y207 PolarHBondContact O-N 3.15Å; L204-Y207 HydrophobicContact CD1-CD1 4.33Å; L204-Y207 WeakPolarHBondContact O-CB 3.45Å; L204-Y207 PolarHBondContact O-N 3.39Å; L204-Y207 VanDerWaalsContact O-N 3.17Å; Y207-A209 PolarHBondContact O-N 2.9Å; Y207-S210 PolarHBondContact O-N 2.89Å; Y207-L211 HydrophobicContact CD2-CB 4.49Å; Y207-L211 HydrophobicContact CE2-CB 4.09Å; Y207-L211 VanDerWaalsContact O-CB 3.3Å; Y207-L211 WeakPolarHBondContact O-CB 3.4Å; Y207-L211 PolarHBondContact O-N 2.8Å; Y207-H325 AromaticContact CZ-NE2 3.97Å; Y207-H325 PolarHBondContact OH-CD2 2.94Å; Y207-H325 PolarHBondContact OH-NE2 3.14Å |
| 208 | C | 90.5 | Very high | 90.7 | Very high | 1 Ų | 1 | 18.7 Ų | 18.7 | 1% | 0.007 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -61.3 | -33.8 | 177.1 | -67 | 0 | 0 | 0 | 0 | 112.3 | L204 P205 F206 I212 R238 | L204-C208 PolarHBondContact O-N 2.95Å; L204-C208 PolarHBondContact O-SG 3.25Å; L204-C208 VanDerWaalsContact O-SG 3.38Å; P205-C208 PolarHBondContact O-N 2.69Å; F206-C208 VanDerWaalsContact C-N 3.35Å; F206-C208 PolarHBondContact O-N 2.83Å; C208-I212 WeakPolarHBondContact O-CD1 3.39Å; C208-I212 VanDerWaalsContact O-CG1 3.3Å; C208-I212 WeakPolarHBondContact O-CG1 3.45Å; C208-I212 PolarHBondContact O-N 2.99Å; C208-R238 VanDerWaalsContact CB-NH1 3.32Å; C208-R238 PolarHBondContact O-NH1 2.84Å; C208-R238 VanDerWaalsContact O-NH1 3.14Å |
| 209 | A | 89.7 | Confident | 89.9 | Confident | 3 Ų | 3 | 20.1 Ų | 20.1 | 3% | 0.025 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -69.6 | -48.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | P205 F206 Y207 L211 I212 E213 E234 | P205-A209 PolarHBondContact O-N 3.38Å; F206-A209 PolarHBondContact O-N 3.45Å; F206-A209 VanDerWaalsContact O-N 3.17Å; Y207-A209 PolarHBondContact O-N 2.9Å; A209-L211 VanDerWaalsContact C-N 3.33Å; A209-L211 PolarHBondContact O-N 3.25Å; A209-I212 WeakPolarHBondContact O-CB 3.43Å; A209-I212 PolarHBondContact O-N 2.95Å; A209-E213 PolarHBondContact O-N 2.65Å; A209-E234 HydrophobicContact CB-CB 4.14Å; A209-E234 HydrophobicContact CB-CG 4.04Å |
| 210 | S | 91.5 | Very high | 89.1 | Confident | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -62 | -39 | 175.7 | 179.1 | 0 | 0 | 0 | 0 | 112.2 | S155 T156 F206 Y207 I212 E213 T214 | S155-S210 PolarHBondContact OG-OG 3.41Å; T156-S210 WeakPolarHBondContact CA-OG 3.05Å; T156-S210 WeakPolarHBondContact CG2-OG 3.35Å; T156-S210 PolarHBondContact N-OG 3.43Å; F206-S210 PolarHBondContact O-N 2.85Å; Y207-S210 PolarHBondContact O-N 2.89Å; S210-I212 VanDerWaalsContact C-N 3.31Å; S210-I212 PolarHBondContact O-N 3.1Å; S210-E213 PolarHBondContact O-N 2.95Å; S210-T214 WeakPolarHBondContact O-CG2 3.34Å; S210-T214 PolarHBondContact O-N 3.16Å; S210-T214 PolarHBondContact O-OG1 3.44Å |
| 211 | L | 92.1 | Very high | 88.2 | Confident | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -57.1 | -46.6 | 176.4 | 179.6 | 62.8 | 0 | 0 | 0 | 110.7 | R115 Y207 A209 E213 T214 V215 H325 L329 | R115-L211 HydrophobicContact CB-CD1 4.31Å; R115-L211 HydrophobicContact CG-CD1 4.09Å; Y207-L211 HydrophobicContact CD2-CB 4.49Å; Y207-L211 HydrophobicContact CE2-CB 4.09Å; Y207-L211 VanDerWaalsContact O-CB 3.3Å; Y207-L211 WeakPolarHBondContact O-CB 3.4Å; Y207-L211 PolarHBondContact O-N 2.8Å; A209-L211 VanDerWaalsContact C-N 3.33Å; A209-L211 PolarHBondContact O-N 3.25Å; L211-E213 PolarHBondContact O-N 3.46Å; L211-T214 WeakPolarHBondContact CA-OG1 3.4Å; L211-T214 PolarHBondContact O-N 3.28Å; L211-T214 VanDerWaalsContact O-N 3.16Å; L211-T214 PolarHBondContact O-OG1 2.95Å; L211-V215 HydrophobicContact CD1-CG1 4.24Å; L211-V215 WeakPolarHBondContact O-CG2 3.37Å; L211-V215 PolarHBondContact O-N 3.26Å; L211-V215 VanDerWaalsContact O-N 3.11Å; L211-H325 HydrophobicContact CD2-CB 4.18Å; L211-L329 HydrophobicContact CD2-CD2 4.28Å; L211-L329 HydrophobicContact CD2-CG 3.96Å; L211-L329 HydrophobicContact CG-CD2 4.12Å; L211-L329 HydrophobicContact CG-CG 4.21Å |
| 212 | I | 90.2 | Very high | 87.1 | Confident | 16 Ų | 16 | 27 Ų | 27 | 8% | 0.082 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -58.3 | -49.6 | 176.7 | -71.3 | 163 | 0 | 0 | 0 | 110.8 | C208 A209 S210 T214 V215 Q216 R238 L329 T332 T334 | C208-I212 WeakPolarHBondContact O-CD1 3.39Å; C208-I212 VanDerWaalsContact O-CG1 3.3Å; C208-I212 WeakPolarHBondContact O-CG1 3.45Å; C208-I212 PolarHBondContact O-N 2.99Å; A209-I212 WeakPolarHBondContact O-CB 3.43Å; A209-I212 PolarHBondContact O-N 2.95Å; S210-I212 VanDerWaalsContact C-N 3.31Å; S210-I212 PolarHBondContact O-N 3.1Å; I212-T214 PolarHBondContact O-N 3.4Å; I212-V215 WeakPolarHBondContact O-CG2 3.3Å; I212-V215 PolarHBondContact O-N 3.33Å; I212-V215 VanDerWaalsContact O-N 3.15Å; I212-Q216 WeakPolarHBondContact O-CB 3.49Å; I212-Q216 PolarHBondContact O-N 2.89Å; I212-R238 VanDerWaalsContact CD1-CZ 3.5Å; I212-R238 VanDerWaalsContact CD1-NH1 3.28Å; I212-L329 HydrophobicContact CB-CD2 4.26Å; I212-L329 HydrophobicContact CD1-CD2 4.49Å; I212-L329 HydrophobicContact CG1-CD2 3.34Å; I212-T332 HydrophobicContact CD1-CG2 3.63Å; I212-T332 HydrophobicContact CG1-CG2 4.34Å; I212-T334 HydrophobicContact CB-CG2 4.25Å; I212-T334 HydrophobicContact CG1-CG2 4.01Å; I212-T334 HydrophobicContact CG2-CG2 3.57Å |
| 213 | E | 89.6 | Confident | 85.5 | Confident | 21 Ų | 21 | 33 Ų | 33 | 10% | 0.098 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -61 | -32.9 | 178.4 | -67.4 | -173.6 | -174 | 0 | 0 | 112.9 | S155 A209 S210 L211 V215 R221 | S155-E213 WeakPolarHBondContact CB-OE2 3.45Å; S155-E213 PolarHBondContact OG-OE2 2.86Å; A209-E213 PolarHBondContact O-N 2.65Å; S210-E213 PolarHBondContact O-N 2.95Å; L211-E213 PolarHBondContact O-N 3.46Å; E213-V215 VanDerWaalsContact C-N 3.35Å; E213-R221 IonicContact OE1-NH2 2.8Å |
| 214 | T | 91.4 | Very high | 83.8 | Confident | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -80.6 | -13.4 | -179.5 | 63.7 | 0 | 0 | 0 | 0 | 113.7 | R115 K151 T156 S210 L211 I212 | R115-T214 WeakPolarHBondContact CD-OG1 3.3Å; R115-T214 PolarHBondContact NH1-OG1 2.87Å; K151-T214 WeakPolarHBondContact CE-O 3.29Å; T156-T214 HydrophobicContact CG2-CG2 3.76Å; S210-T214 WeakPolarHBondContact O-CG2 3.34Å; S210-T214 PolarHBondContact O-N 3.16Å; S210-T214 PolarHBondContact O-OG1 3.44Å; L211-T214 WeakPolarHBondContact CA-OG1 3.4Å; L211-T214 PolarHBondContact O-N 3.28Å; L211-T214 VanDerWaalsContact O-N 3.16Å; L211-T214 PolarHBondContact O-OG1 2.95Å; I212-T214 PolarHBondContact O-N 3.4Å |
| 215 | V | 91.3 | Very high | 82.1 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -111.6 | -27.5 | 176.7 | -57.5 | 0 | 0 | 0 | 0 | 112.7 | R115 Q116 V119 K151 L211 I212 E213 S217 L329 I336 | R115-V215 HydrophobicContact CB-CG1 3.8Å; Q116-V215 HydrophobicContact CG-CB 4.48Å; Q116-V215 PolarHBondContact OE1-O 3.36Å; V119-V215 HydrophobicContact CG2-CB 4.38Å; V119-V215 HydrophobicContact CG2-CG1 4.19Å; K151-V215 VanDerWaalsContact NZ-C 3.32Å; K151-V215 PolarHBondContact NZ-O 3.47Å; L211-V215 HydrophobicContact CD1-CG1 4.24Å; L211-V215 WeakPolarHBondContact O-CG2 3.37Å; L211-V215 PolarHBondContact O-N 3.26Å; L211-V215 VanDerWaalsContact O-N 3.11Å; I212-V215 WeakPolarHBondContact O-CG2 3.3Å; I212-V215 PolarHBondContact O-N 3.33Å; I212-V215 VanDerWaalsContact O-N 3.15Å; E213-V215 VanDerWaalsContact C-N 3.35Å; V215-S217 PolarHBondContact O-N 3.22Å; V215-L329 HydrophobicContact CG1-CD1 4.4Å; V215-L329 HydrophobicContact CG2-CD1 3.71Å; V215-L329 HydrophobicContact CG2-CD2 3.85Å; V215-L329 HydrophobicContact CG2-CG 4.46Å; V215-I336 HydrophobicContact CB-CG2 3.97Å; V215-I336 HydrophobicContact CG2-CG2 4.07Å |
| 216 | Q | 90.3 | Very high | 80.6 | Confident | 47 Ų | 47 | 42.8 Ų | 42.8 | 22% | 0.22 | 23% | 0.232 | C | C | . | . | B | Isolated β-bridge | trans | -62.8 | 133.4 | -177.3 | -176.3 | 172.1 | 4.9 | 0 | 0 | 111.1 | K151 I212 I335 | K151-Q216 WeakPolarHBondContact CD-O 3.23Å; K151-Q216 WeakPolarHBondContact CE-O 3.27Å; K151-Q216 VanDerWaalsContact NZ-C 3.34Å; K151-Q216 PolarHBondContact NZ-O 2.51Å; I212-Q216 WeakPolarHBondContact O-CB 3.49Å; I212-Q216 PolarHBondContact O-N 2.89Å; Q216-I335 CarbonylContact C-O 3.49Å; Q216-I335 WeakPolarHBondContact CA-O 3.22Å |
| 217 | S | 86.9 | Confident | 79.4 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 25% | 0.245 | C | C | . | . | trans | -65.4 | 134.1 | 178.5 | -176 | 0 | 0 | 0 | 0 | 110.9 | V215 I219 V220 R221 I335 D337 V353 | V215-S217 PolarHBondContact O-N 3.22Å; S217-I219 PolarHBondContact O-N 3.29Å; S217-I219 PolarHBondContact OG-N 3.22Å; S217-V220 PolarHBondContact O-N 2.78Å; S217-R221 PolarHBondContact O-N 3.42Å; S217-I335 PolarHBondContact N-O 3.04Å; S217-D337 WeakPolarHBondContact CB-OD1 3.45Å; S217-D337 PolarHBondContact OG-OD1 2.83Å; S217-V353 VanDerWaalsContact OG-CG1 3.28Å; S217-V353 WeakPolarHBondContact OG-CG1 3.13Å | ||
| 218 | E | 80.9 | Confident | 78.6 | Confident | 47 Ų | 47 | 47.6 Ų | 47.6 | 22% | 0.22 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -26.3 | 174.7 | -70.5 | -77.2 | 128.8 | 0 | 0 | 111.7 | K147 K151 V220 R221 | K147-E218 IonicContact NZ-OE2 3.78Å; K147-E218 PolarHBondContact NZ-OE2 3.16Å; K151-E218 HydrophobicContact CB-CG 4.48Å; E218-V220 PolarHBondContact O-N 3.32Å; E218-R221 PolarHBondContact O-N 2.61Å |
| 219 | I | 75.6 | Confident | 78.2 | Confident | 103 Ų | 103 | 53.7 Ų | 53.7 | 53% | 0.528 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -31.5 | 178.9 | -58.8 | 173.7 | 0 | 0 | 0 | 111.3 | Q144 S217 L352 V353 | Q144-I219 HydrophobicContact CG-CD1 4.32Å; S217-I219 PolarHBondContact O-N 3.29Å; S217-I219 PolarHBondContact OG-N 3.22Å; I219-L352 HydrophobicContact CD1-CB 4.47Å; I219-V353 HydrophobicContact CB-CG1 4.46Å; I219-V353 HydrophobicContact CD1-CG1 4.07Å |
| 220 | V | 76.1 | Confident | 77.9 | Confident | 55 Ų | 55 | 55.9 Ų | 55.9 | 33% | 0.333 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.5 | -14.4 | -177.1 | 178.3 | 0 | 0 | 0 | 0 | 111.3 | S217 E218 D222 I335 V353 | S217-V220 PolarHBondContact O-N 2.78Å; E218-V220 PolarHBondContact O-N 3.32Å; V220-D222 PolarHBondContact O-N 2.92Å; V220-I335 HydrophobicContact CG1-CB 4.35Å; V220-I335 HydrophobicContact CG1-CD1 3.94Å; V220-I335 HydrophobicContact CG1-CG1 4.3Å; V220-I335 HydrophobicContact CG2-CB 4.15Å; V220-I335 HydrophobicContact CG2-CD1 4.19Å; V220-I335 HydrophobicContact CG2-CG2 4.15Å; V220-V353 HydrophobicContact CG2-CG2 4.47Å |
| 221 | R | 71.6 | Confident | 77.5 | Confident | 39 Ų | 39 | 55.9 Ų | 55.9 | 15% | 0.147 | 31% | 0.31 | C | S | . | . | S | Bend | trans | -77.9 | 121.1 | -174.1 | -170.6 | 173.1 | -178.2 | 147.5 | 0.9 | 110 | E213 S217 E218 E223 S225 | E213-R221 IonicContact OE1-NH2 2.8Å; S217-R221 PolarHBondContact O-N 3.42Å; E218-R221 PolarHBondContact O-N 2.61Å; R221-E223 PolarHBondContact O-N 3.45Å; R221-S225 WeakPolarHBondContact CG-OG 3.33Å; R221-S225 PolarHBondContact NE-O 2.92Å; R221-S225 PolarHBondContact NE-OG 3.46Å; R221-S225 PolarHBondContact NH2-O 3.27Å |
| 222 | D | 69.2 | Low | 77.3 | Confident | 118 Ų | 118 | 57.8 Ų | 57.8 | 63% | 0.631 | 32% | 0.322 | S | S | * | . | trans | -62.9 | 132.5 | 173.9 | -73.6 | -27.5 | 0 | 0 | 0 | 110.4 | V220 S224 S225 | V220-D222 PolarHBondContact O-N 2.92Å; D222-S224 PolarHBondContact O-N 2.94Å; D222-S224 VanDerWaalsContact O-N 3.07Å; D222-S225 WeakPolarHBondContact O-CB 3.35Å; D222-S225 PolarHBondContact O-N 3.33Å; D222-S225 PolarHBondContact O-OG 3.45Å | ||
| 223 | E | 60.3 | Low | 77.1 | Confident | 188 Ų | 188 | 65.3 Ų | 65.3 | 88% | 0.879 | 35% | 0.349 | S | S | * | . | G | 310 helix | trans | -56.8 | -28.3 | -178.4 | -67.5 | -173.7 | 156 | 0 | 0 | 112.9 | R221 S225 S226 | R221-E223 PolarHBondContact O-N 3.45Å; E223-S225 VanDerWaalsContact C-N 3.27Å; E223-S225 PolarHBondContact O-N 2.95Å; E223-S226 WeakPolarHBondContact O-CB 3.38Å; E223-S226 PolarHBondContact O-OG 3.46Å |
| 224 | S | 55.9 | Low | 76.8 | Confident | 110 Ų | 110 | 68.1 Ų | 68.1 | 77% | 0.769 | 36% | 0.363 | S | S | * | . | G | 310 helix | trans | -70.9 | -14.5 | 177.9 | 59.3 | 0 | 0 | 0 | 0 | 114.7 | D222 | D222-S224 PolarHBondContact O-N 2.94Å; D222-S224 VanDerWaalsContact O-N 3.07Å |
| 225 | S | 57.3 | Low | 76.3 | Confident | 39 Ų | 39 | 68.1 Ų | 68.1 | 27% | 0.273 | 36% | 0.363 | S | S | . | . | G | 310 helix | trans | -95.1 | 18.8 | -178.9 | 69.4 | 0 | 0 | 0 | 0 | 113.8 | R221 D222 E223 G227 | R221-S225 WeakPolarHBondContact CG-OG 3.33Å; R221-S225 PolarHBondContact NE-O 2.92Å; R221-S225 PolarHBondContact NE-OG 3.46Å; R221-S225 PolarHBondContact NH2-O 3.27Å; D222-S225 WeakPolarHBondContact O-CB 3.35Å; D222-S225 PolarHBondContact O-N 3.33Å; D222-S225 PolarHBondContact O-OG 3.45Å; E223-S225 VanDerWaalsContact C-N 3.27Å; E223-S225 PolarHBondContact O-N 2.95Å; S225-G227 VanDerWaalsContact C-N 3.32Å; S225-G227 PolarHBondContact O-N 2.95Å |
| 226 | S | 58.2 | Low | 76.1 | Confident | 72 Ų | 72 | 71.8 Ų | 71.8 | 50% | 0.503 | 38% | 0.381 | S | S | . | . | trans | -88.4 | 9.2 | -171.4 | -55.9 | 0 | 0 | 0 | 0 | 114.1 | E223 | E223-S226 WeakPolarHBondContact O-CB 3.38Å; E223-S226 PolarHBondContact O-OG 3.46Å | ||
| 227 | G | 67.6 | Low | 75.8 | Confident | 32 Ų | 32 | 71.5 Ų | 71.5 | 33% | 0.33 | 38% | 0.383 | S | S | . | . | trans | -76.5 | 132.4 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S225 L229 D230 | S225-G227 VanDerWaalsContact C-N 3.32Å; S225-G227 PolarHBondContact O-N 2.95Å; G227-L229 PolarHBondContact O-N 3.46Å; G227-L229 VanDerWaalsContact O-N 3.16Å; G227-D230 WeakPolarHBondContact CA-OD2 3.27Å; G227-D230 PolarHBondContact N-OD2 3.29Å; G227-D230 VanDerWaalsContact O-CB 3.3Å; G227-D230 WeakPolarHBondContact O-CB 3.4Å; G227-D230 PolarHBondContact O-N 3.31Å | ||
| 228 | L | 74.4 | Confident | 75.4 | Confident | 109 Ų | 109 | 74.1 Ų | 74.1 | 57% | 0.571 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -31.9 | 173.7 | -68.6 | 177.2 | 0 | 0 | 0 | 112.7 | I158 D230 | I158-L228 HydrophobicContact CD1-CB 4.1Å; I158-L228 WeakPolarHBondContact CD1-O 3.41Å; L228-D230 VanDerWaalsContact C-N 3.3Å; L228-D230 PolarHBondContact O-N 2.94Å |
| 229 | L | 82.4 | Confident | 75.5 | Confident | 128 Ų | 128 | 77.1 Ų | 77.1 | 67% | 0.67 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.3 | -9.9 | -179.7 | -59.6 | -179.3 | 0 | 0 | 0 | 113.5 | G227 C231 V232 R233 | G227-L229 PolarHBondContact O-N 3.46Å; G227-L229 VanDerWaalsContact O-N 3.16Å; L229-C231 VanDerWaalsContact C-N 3.27Å; L229-C231 PolarHBondContact O-N 3.45Å; L229-V232 WeakPolarHBondContact O-CB 3.24Å; L229-V232 PolarHBondContact O-N 2.95Å; L229-R233 PolarHBondContact O-N 3.32Å |
| 230 | D | 82.8 | Confident | 75.7 | Confident | 49 Ų | 49 | 78.1 Ų | 78.1 | 26% | 0.262 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64.6 | -36.4 | 179.2 | -68 | -32.4 | 0 | 0 | 0 | 110.9 | G227 L228 V232 R233 E234 | G227-D230 WeakPolarHBondContact CA-OD2 3.27Å; G227-D230 PolarHBondContact N-OD2 3.29Å; G227-D230 VanDerWaalsContact O-CB 3.3Å; G227-D230 WeakPolarHBondContact O-CB 3.4Å; G227-D230 PolarHBondContact O-N 3.31Å; L228-D230 VanDerWaalsContact C-N 3.3Å; L228-D230 PolarHBondContact O-N 2.94Å; D230-V232 VanDerWaalsContact C-N 3.3Å; D230-V232 PolarHBondContact O-N 3.39Å; D230-R233 PolarHBondContact O-N 2.95Å; D230-E234 VanDerWaalsContact O-CB 3.26Å; D230-E234 WeakPolarHBondContact O-CB 3.34Å; D230-E234 PolarHBondContact O-N 3.49Å |
| 231 | C | 84 | Confident | 75.4 | Confident | 0 Ų | 0 | 77.9 Ų | 77.9 | 0% | 0 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -59 | -39.6 | 171.6 | 178.1 | 0 | 0 | 0 | 0 | 112.6 | S155 L229 G235 | S155-C231 VanDerWaalsContact CB-SG 3.58Å; L229-C231 VanDerWaalsContact C-N 3.27Å; L229-C231 PolarHBondContact O-N 3.45Å; C231-G235 PolarHBondContact O-N 2.89Å |
| 232 | V | 86.8 | Confident | 75.1 | Confident | 40 Ų | 40 | 80.6 Ų | 80.6 | 24% | 0.242 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -69.4 | -46.8 | 178.1 | -179.2 | 0 | 0 | 0 | 0 | 109.7 | I158 F206 L229 D230 E234 G235 L236 | I158-V232 HydrophobicContact CG2-CG2 3.55Å; F206-V232 HydrophobicContact CE1-CG1 4.08Å; L229-V232 WeakPolarHBondContact O-CB 3.24Å; L229-V232 PolarHBondContact O-N 2.95Å; D230-V232 VanDerWaalsContact C-N 3.3Å; D230-V232 PolarHBondContact O-N 3.39Å; V232-E234 PolarHBondContact O-N 3.11Å; V232-G235 PolarHBondContact O-N 3.09Å; V232-L236 HydrophobicContact CG1-CD1 4.03Å; V232-L236 HydrophobicContact CG1-CG 4.46Å; V232-L236 WeakPolarHBondContact O-CB 3.28Å; V232-L236 WeakPolarHBondContact O-CG 3.36Å; V232-L236 PolarHBondContact O-N 3.37Å |
| 233 | R | 86.1 | Confident | 74.4 | Confident | 174 Ų | 174 | 78.5 Ų | 78.5 | 66% | 0.657 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -57.5 | -49.2 | 177.4 | -177.1 | -177.6 | 178.6 | -173.3 | -0 | 111 | L229 D230 L236 T237 | L229-R233 PolarHBondContact O-N 3.32Å; D230-R233 PolarHBondContact O-N 2.95Å; R233-L236 PolarHBondContact O-N 3.29Å; R233-T237 WeakPolarHBondContact O-CG2 3.43Å; R233-T237 PolarHBondContact O-N 2.96Å; R233-T237 PolarHBondContact O-OG1 2.91Å |
| 234 | E | 83.8 | Confident | 74.1 | Confident | 81 Ų | 81 | 71.7 Ų | 71.7 | 38% | 0.379 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.8 | -33.1 | -179.9 | -177.5 | 57.5 | -161.5 | 0 | 0 | 112.5 | A209 D230 V232 T237 R238 | A209-E234 HydrophobicContact CB-CB 4.14Å; A209-E234 HydrophobicContact CB-CG 4.04Å; D230-E234 VanDerWaalsContact O-CB 3.26Å; D230-E234 WeakPolarHBondContact O-CB 3.34Å; D230-E234 PolarHBondContact O-N 3.49Å; V232-E234 PolarHBondContact O-N 3.11Å; E234-T237 VanDerWaalsContact CA-OG1 3.25Å; E234-T237 WeakPolarHBondContact CA-OG1 3.35Å; E234-T237 PolarHBondContact O-OG1 3.02Å; E234-T237 PolarHBondContact OE2-OG1 2.73Å; E234-R238 WeakPolarHBondContact O-CD 3.2Å; E234-R238 VanDerWaalsContact O-CG 3.24Å; E234-R238 WeakPolarHBondContact O-CG 3.45Å; E234-R238 PolarHBondContact O-N 3.4Å; E234-R238 IonicContact OE1-CZ 3.41Å; E234-R238 VanDerWaalsContact OE1-CZ 3.26Å; E234-R238 IonicContact OE1-NE 2.84Å; E234-R238 PolarHBondContact OE1-NE 3.22Å; E234-R238 IonicContact OE1-NH2 3.66Å; E234-R238 PolarHBondContact OE1-NH2 3.1Å |
| 235 | G | 82.2 | Confident | 73.9 | Confident | 0 Ų | 0 | 70.2 Ų | 70.2 | 0% | 0 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.9 | -45.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | P205 C231 V232 R238 L239 | P205-G235 WeakPolarHBondContact CB-O 3.31Å; C231-G235 PolarHBondContact O-N 2.89Å; V232-G235 PolarHBondContact O-N 3.09Å; G235-R238 PolarHBondContact O-N 3.23Å; G235-L239 WeakPolarHBondContact O-CB 3.24Å; G235-L239 PolarHBondContact O-N 2.87Å |
| 236 | L | 85.8 | Confident | 73.5 | Confident | 76 Ų | 76 | 77.5 Ų | 77.5 | 40% | 0.398 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -67.7 | -40.1 | 179.2 | -71.1 | 172.1 | 0 | 0 | 0 | 112.7 | F206 V232 R233 R238 L239 L240 | F206-L236 HydrophobicContact CE1-CD2 4.43Å; F206-L236 HydrophobicContact CE1-CG 4.15Å; F206-L236 HydrophobicContact CZ-CD2 4.03Å; F206-L236 HydrophobicContact CZ-CG 4.25Å; V232-L236 HydrophobicContact CG1-CD1 4.03Å; V232-L236 HydrophobicContact CG1-CG 4.46Å; V232-L236 WeakPolarHBondContact O-CB 3.28Å; V232-L236 WeakPolarHBondContact O-CG 3.36Å; V232-L236 PolarHBondContact O-N 3.37Å; R233-L236 PolarHBondContact O-N 3.29Å; L236-R238 VanDerWaalsContact C-N 3.3Å; L236-R238 PolarHBondContact O-N 3.29Å; L236-L239 PolarHBondContact O-N 3.2Å; L236-L240 WeakPolarHBondContact O-CB 3.3Å; L236-L240 VanDerWaalsContact O-CG 3.29Å; L236-L240 WeakPolarHBondContact O-CG 3.43Å; L236-L240 PolarHBondContact O-N 3.49Å |
| 237 | T | 84 | Confident | 73.3 | Confident | 41 Ų | 41 | 75.9 Ų | 75.9 | 25% | 0.252 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -60.5 | -42 | 175.9 | 52.3 | 0 | 0 | 0 | 0 | 111 | R233 E234 L240 G241 V242 | R233-T237 WeakPolarHBondContact O-CG2 3.43Å; R233-T237 PolarHBondContact O-N 2.96Å; R233-T237 PolarHBondContact O-OG1 2.91Å; E234-T237 VanDerWaalsContact CA-OG1 3.25Å; E234-T237 WeakPolarHBondContact CA-OG1 3.35Å; E234-T237 PolarHBondContact O-OG1 3.02Å; E234-T237 PolarHBondContact OE2-OG1 2.73Å; T237-L240 PolarHBondContact O-N 3.24Å; T237-G241 PolarHBondContact O-N 3.1Å; T237-V242 WeakPolarHBondContact CB-O 3.31Å; T237-V242 PolarHBondContact O-N 3.38Å; T237-V242 VanDerWaalsContact O-N 3.14Å |
| 238 | R | 79.3 | Confident | 72.6 | Confident | 56 Ų | 56 | 86.3 Ų | 86.3 | 21% | 0.211 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -65.6 | -38.5 | 174.9 | -70.8 | 173.4 | -171.9 | -173 | 1.9 | 113.2 | P205 C208 I212 E234 G235 L236 L253 | P205-R238 HydrophobicContact CB-CB 4.48Å; C208-R238 VanDerWaalsContact CB-NH1 3.32Å; C208-R238 PolarHBondContact O-NH1 2.84Å; C208-R238 VanDerWaalsContact O-NH1 3.14Å; I212-R238 VanDerWaalsContact CD1-CZ 3.5Å; I212-R238 VanDerWaalsContact CD1-NH1 3.28Å; E234-R238 WeakPolarHBondContact O-CD 3.2Å; E234-R238 VanDerWaalsContact O-CG 3.24Å; E234-R238 WeakPolarHBondContact O-CG 3.45Å; E234-R238 PolarHBondContact O-N 3.4Å; E234-R238 IonicContact OE1-CZ 3.41Å; E234-R238 VanDerWaalsContact OE1-CZ 3.26Å; E234-R238 IonicContact OE1-NE 2.84Å; E234-R238 PolarHBondContact OE1-NE 3.22Å; E234-R238 IonicContact OE1-NH2 3.66Å; E234-R238 PolarHBondContact OE1-NH2 3.1Å; G235-R238 PolarHBondContact O-N 3.23Å; L236-R238 VanDerWaalsContact C-N 3.3Å; L236-R238 PolarHBondContact O-N 3.29Å; R238-L253 HydrophobicContact CB-CD1 3.9Å |
| 239 | L | 82.1 | Confident | 72 | Confident | 109 Ų | 109 | 87 Ų | 87 | 57% | 0.571 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -68.1 | -42.8 | 177.8 | -176.6 | 64.8 | 0 | 0 | 0 | 111.8 | P205 G235 L236 G241 | P205-L239 HydrophobicContact CB-CB 4.42Å; P205-L239 HydrophobicContact CG-CB 4.43Å; P205-L239 HydrophobicContact CG-CD1 4.44Å; G235-L239 WeakPolarHBondContact O-CB 3.24Å; G235-L239 PolarHBondContact O-N 2.87Å; L236-L239 PolarHBondContact O-N 3.2Å; L239-G241 VanDerWaalsContact C-N 3.32Å |
| 240 | L | 79.7 | Confident | 71.3 | Confident | 124 Ų | 124 | 83.9 Ų | 83.9 | 65% | 0.649 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -83.4 | -7.1 | -177.6 | -62.8 | 173.2 | 0 | 0 | 0 | 113.2 | L236 T237 V242 | L236-L240 WeakPolarHBondContact O-CB 3.3Å; L236-L240 VanDerWaalsContact O-CG 3.29Å; L236-L240 WeakPolarHBondContact O-CG 3.43Å; L236-L240 PolarHBondContact O-N 3.49Å; T237-L240 PolarHBondContact O-N 3.24Å; L240-V242 HydrophobicContact CB-CB 4.5Å; L240-V242 HydrophobicContact CB-CG2 3.83Å; L240-V242 PolarHBondContact O-N 2.92Å |
| 241 | G | 69.9 | Low | 70.8 | Confident | 51 Ų | 51 | 82.6 Ų | 82.6 | 53% | 0.526 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66 | 12 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114 | T237 L239 G243 | T237-G241 PolarHBondContact O-N 3.1Å; L239-G241 VanDerWaalsContact C-N 3.32Å; G241-G243 PolarHBondContact O-N 3.43Å |
| 242 | V | 64.8 | Low | 70.5 | Confident | 96 Ų | 96 | 85.6 Ų | 85.6 | 58% | 0.582 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.9 | 114.6 | -177.1 | -179 | 0 | 0 | 0 | 0 | 108.6 | T237 L240 | T237-V242 WeakPolarHBondContact CB-O 3.31Å; T237-V242 PolarHBondContact O-N 3.38Å; T237-V242 VanDerWaalsContact O-N 3.14Å; L240-V242 HydrophobicContact CB-CB 4.5Å; L240-V242 HydrophobicContact CB-CG2 3.83Å; L240-V242 PolarHBondContact O-N 2.92Å |
| 243 | G | 56.2 | Low | 70.3 | Confident | 73 Ų | 73 | 85.6 Ų | 85.6 | 75% | 0.753 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.3 | 13 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115 | G241 P245 | G241-G243 PolarHBondContact O-N 3.43Å; G243-P245 WeakPolarHBondContact O-CD 3.26Å; G243-P245 VanDerWaalsContact O-N 3.13Å |
| 244 | A | 53.8 | Low | 70.1 | Confident | 46 Ų | 46 | 80.9 Ų | 80.9 | 38% | 0.38 | 45% | 0.446 | S | S | . | . | trans | -57.4 | 119.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | H246 | A244-H246 PolarHBondContact O-N 3.17Å; A244-H246 VanDerWaalsContact O-N 3.17Å; A244-H246 PolarHBondContact O-ND1 3.39Å | ||
| 245 | P | 51.4 | Low | 70.2 | Confident | 78 Ų | 78 | 84 Ų | 84 | 51% | 0.506 | 46% | 0.455 | S | S | . | . | trans | -58.5 | 128.6 | 174.5 | 22.6 | -30.3 | 0 | 0 | 0 | 107 | G243 S247 | G243-P245 WeakPolarHBondContact O-CD 3.26Å; G243-P245 VanDerWaalsContact O-N 3.13Å; P245-S247 PolarHBondContact O-N 2.89Å | ||
| 246 | H | 49.2 | Very low | 70.5 | Confident | 193 Ų | 193 | 84.1 Ų | 84.1 | 89% | 0.894 | 46% | 0.456 | S | S | * | . | trans | -66.9 | 26.3 | 179.1 | -72.4 | 60.5 | 0 | 0 | 0 | 112.7 | A244 R248 | A244-H246 PolarHBondContact O-N 3.17Å; A244-H246 VanDerWaalsContact O-N 3.17Å; A244-H246 PolarHBondContact O-ND1 3.39Å; H246-R248 PolarHBondContact O-N 2.84Å | ||
| 247 | S | 53 | Low | 70.8 | Confident | 38 Ų | 38 | 83.6 Ų | 83.6 | 27% | 0.266 | 45% | 0.453 | S | S | . | . | trans | -67.4 | 117.1 | 172.3 | -87.5 | 0 | 0 | 0 | 0 | 109.1 | P245 R249 L250 | P245-S247 PolarHBondContact O-N 2.89Å; S247-R249 PolarHBondContact O-N 3.1Å; S247-L250 PolarHBondContact O-N 2.81Å; S247-L250 VanDerWaalsContact O-N 3.11Å | ||
| 248 | R | 53.8 | Low | 71.2 | Confident | 251 Ų | 251 | 88.2 Ų | 88.2 | 95% | 0.947 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.1 | -3.3 | 169.7 | -62.7 | -170.8 | 178.4 | -155.4 | 0.6 | 114.8 | H246 | H246-R248 PolarHBondContact O-N 2.84Š|
| 249 | R | 60.8 | Low | 71.9 | Confident | 123 Ų | 123 | 86.6 Ų | 86.6 | 46% | 0.464 | 47% | 0.472 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | -20 | -179.4 | -62.5 | -173.2 | -177.4 | -150.6 | 0.5 | 113.7 | S247 L251 Q330 N357 | S247-R249 PolarHBondContact O-N 3.1Å; R249-L251 PolarHBondContact O-N 2.67Å; R249-Q330 VanDerWaalsContact O-CG 3.25Å; R249-Q330 WeakPolarHBondContact O-CG 3.43Å; R249-Q330 PolarHBondContact O-NE2 2.77Å; R249-N357 PolarHBondContact NH1-OD1 2.72Å; R249-N357 VanDerWaalsContact NH1-OD1 3.16Å |
| 250 | L | 68.1 | Low | 72.4 | Confident | 62 Ų | 62 | 82.1 Ų | 82.1 | 33% | 0.325 | 45% | 0.449 | S | S | . | . | S | Bend | trans | -73.5 | 119.7 | 177.7 | -169 | 93.1 | 0 | 0 | 0 | 108.7 | S247 P252 T332 | S247-L250 PolarHBondContact O-N 2.81Å; S247-L250 VanDerWaalsContact O-N 3.11Å; L250-P252 WeakPolarHBondContact O-CD 3.49Å; L250-T332 HydrophobicContact CD1-CG2 4.3Å |
| 251 | L | 71.7 | Confident | 73.1 | Confident | 22 Ų | 22 | 76.9 Ų | 76.9 | 12% | 0.115 | 42% | 0.424 | C | S | . | . | P | Polyproline II helix | trans | -72.7 | 126 | 175.4 | -156.2 | 95 | 0 | 0 | 0 | 108.5 | R249 L253 Y255 L256 L327 | R249-L251 PolarHBondContact O-N 2.67Å; L251-L253 PolarHBondContact O-N 3.5Å; L251-Y255 HydrophobicContact CD2-CG 4.48Å; L251-L256 HydrophobicContact CD2-CD2 4.36Å; L251-L256 HydrophobicContact CD2-CG 4.13Å; L251-L327 HydrophobicContact CD2-CD2 4.42Å |
| 252 | P | 77.5 | Confident | 74.2 | Confident | 64 Ų | 64 | 76.7 Ų | 76.7 | 42% | 0.416 | 42% | 0.418 | S | S | . | . | P | Polyproline II helix | trans | -60.5 | 140.5 | 177.1 | -21.2 | 31.5 | 0 | 0 | 0 | 111 | L250 S254 Y255 | L250-P252 WeakPolarHBondContact O-CD 3.49Å; P252-S254 PolarHBondContact O-N 2.89Å; P252-Y255 HydrophobicContact CB-CD2 3.92Å; P252-Y255 HydrophobicContact CB-CE2 4.26Å; P252-Y255 HydrophobicContact CG-CD2 3.93Å; P252-Y255 HydrophobicContact CG-CE2 3.91Å; P252-Y255 PolarHBondContact O-N 2.73Å |
| 253 | L | 82.9 | Confident | 75.6 | Confident | 40 Ų | 40 | 73.2 Ų | 73.2 | 21% | 0.209 | 40% | 0.395 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.3 | -26.6 | -179.5 | -71.1 | -178.4 | 0 | 0 | 0 | 113.1 | L204 P205 R238 L251 Y255 L256 L257 | L204-L253 HydrophobicContact CG-CD2 4.47Å; P205-L253 HydrophobicContact CB-CD1 3.92Å; R238-L253 HydrophobicContact CB-CD1 3.9Å; L251-L253 PolarHBondContact O-N 3.5Å; L253-Y255 PolarHBondContact O-N 3.4Å; L253-L256 HydrophobicContact CD2-CD1 4.3Å; L253-L256 WeakPolarHBondContact O-CB 3.45Å; L253-L256 PolarHBondContact O-N 3.27Å; L253-L257 WeakPolarHBondContact O-CG 3.33Å; L253-L257 PolarHBondContact O-N 3.21Å |
| 254 | S | 83 | Confident | 77.2 | Confident | 74 Ų | 74 | 71 Ų | 71 | 52% | 0.517 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -56 | -36 | 176.1 | 54.5 | 0 | 0 | 0 | 0 | 113.2 | P252 L256 | P252-S254 PolarHBondContact O-N 2.89Å; S254-L256 PolarHBondContact O-N 2.97Å |
| 255 | Y | 85.4 | Confident | 79.1 | Confident | 147 Ų | 147 | 71.2 Ų | 71.2 | 58% | 0.576 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -72.2 | -19.6 | 177.5 | -71.9 | -90.9 | 0 | 0 | 0 | 112.9 | L251 P252 L253 P259 | L251-Y255 HydrophobicContact CD2-CG 4.48Å; P252-Y255 HydrophobicContact CB-CD2 3.92Å; P252-Y255 HydrophobicContact CB-CE2 4.26Å; P252-Y255 HydrophobicContact CG-CD2 3.93Å; P252-Y255 HydrophobicContact CG-CE2 3.91Å; P252-Y255 PolarHBondContact O-N 2.73Å; L253-Y255 PolarHBondContact O-N 3.4Å; Y255-P259 WeakPolarHBondContact O-CD 3.34Å; Y255-P259 WeakPolarHBondContact O-CG 3.43Å |
| 256 | L | 88.9 | Confident | 81.1 | Confident | 3 Ų | 3 | 71.3 Ų | 71.3 | 2% | 0.016 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -92.1 | -18.7 | 179.7 | -72.6 | 172.5 | 0 | 0 | 0 | 113.3 | L204 L251 L253 S254 L258 P259 V260 L324 L327 | L204-L256 HydrophobicContact CD2-CB 3.77Å; L251-L256 HydrophobicContact CD2-CD2 4.36Å; L251-L256 HydrophobicContact CD2-CG 4.13Å; L253-L256 HydrophobicContact CD2-CD1 4.3Å; L253-L256 WeakPolarHBondContact O-CB 3.45Å; L253-L256 PolarHBondContact O-N 3.27Å; S254-L256 PolarHBondContact O-N 2.97Å; L256-L258 PolarHBondContact O-N 2.85Å; L256-P259 WeakPolarHBondContact O-CD 3.32Å; L256-V260 HydrophobicContact CB-CG2 4.4Å; L256-V260 VanDerWaalsContact O-CB 3.27Å; L256-V260 WeakPolarHBondContact O-CB 3.25Å; L256-V260 WeakPolarHBondContact O-CG2 3.47Å; L256-V260 PolarHBondContact O-N 3.17Å; L256-L324 HydrophobicContact CD2-CD2 4.37Å; L256-L327 HydrophobicContact CD2-CB 3.69Å; L256-L327 HydrophobicContact CD2-CD1 4.21Å |
| 257 | L | 91.1 | Very high | 83.2 | Confident | 65 Ų | 65 | 63.3 Ų | 63.3 | 34% | 0.34 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -56.7 | -53 | -174.6 | -56 | 175 | 0 | 0 | 0 | 112.3 | V201 L204 L253 V260 A261 | V201-L257 HydrophobicContact CG1-CD2 3.79Å; V201-L257 HydrophobicContact CG2-CB 4.3Å; L204-L257 HydrophobicContact CD2-CD2 3.75Å; L253-L257 WeakPolarHBondContact O-CG 3.33Å; L253-L257 PolarHBondContact O-N 3.21Å; L257-V260 PolarHBondContact O-N 2.97Å; L257-A261 WeakPolarHBondContact O-CB 3.45Å; L257-A261 PolarHBondContact O-N 3.4Å |
| 258 | L | 93.1 | Very high | 84.9 | Confident | 138 Ų | 138 | 62.7 Ų | 62.7 | 72% | 0.723 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -66.6 | -49.8 | -178.5 | 175.4 | 69.6 | 0 | 0 | 0 | 112 | L256 V260 A261 A262 | L256-L258 PolarHBondContact O-N 2.85Å; L258-V260 VanDerWaalsContact C-N 3.28Å; L258-V260 PolarHBondContact O-N 3.42Å; L258-A261 PolarHBondContact O-N 2.9Å; L258-A262 VanDerWaalsContact O-CB 3.25Å; L258-A262 WeakPolarHBondContact O-CB 3.48Å; L258-A262 PolarHBondContact O-N 3.38Å |
| 259 | P | 93.4 | Very high | 86.7 | Confident | 22 Ų | 22 | 52.8 Ų | 52.8 | 14% | 0.143 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -52.5 | -42.1 | 173.5 | -32.8 | 38.1 | 0 | 0 | 0 | 114.6 | Y255 L256 H263 L324 L363 | Y255-P259 WeakPolarHBondContact O-CD 3.34Å; Y255-P259 WeakPolarHBondContact O-CG 3.43Å; L256-P259 WeakPolarHBondContact O-CD 3.32Å; P259-H263 WeakPolarHBondContact O-CB 3.22Å; P259-H263 PolarHBondContact O-N 3.49Å; P259-L324 HydrophobicContact CB-CD2 3.57Å; P259-L363 HydrophobicContact CB-CD2 4.12Å; P259-L363 HydrophobicContact CG-CB 4.4Å; P259-L363 HydrophobicContact CG-CD2 4.33Å |
| 260 | V | 92.4 | Very high | 88.2 | Confident | 14 Ų | 14 | 48 Ų | 48 | 9% | 0.085 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -72.5 | -45.6 | -178 | 169.5 | 0 | 0 | 0 | 0 | 111.2 | A200 L204 L256 L257 L258 A262 H263 A264 L324 | A200-V260 HydrophobicContact CB-CG1 4.13Å; L204-V260 HydrophobicContact CD1-CB 4.39Å; L204-V260 HydrophobicContact CD1-CG1 4.22Å; L204-V260 HydrophobicContact CD1-CG2 3.67Å; L204-V260 HydrophobicContact CD2-CG2 4.24Å; L256-V260 HydrophobicContact CB-CG2 4.4Å; L256-V260 VanDerWaalsContact O-CB 3.27Å; L256-V260 WeakPolarHBondContact O-CB 3.25Å; L256-V260 WeakPolarHBondContact O-CG2 3.47Å; L256-V260 PolarHBondContact O-N 3.17Å; L257-V260 PolarHBondContact O-N 2.97Å; L258-V260 VanDerWaalsContact C-N 3.28Å; L258-V260 PolarHBondContact O-N 3.42Å; V260-A262 VanDerWaalsContact C-N 3.33Å; V260-A262 PolarHBondContact O-N 3.06Å; V260-H263 PolarHBondContact O-N 3.1Å; V260-A264 PolarHBondContact O-N 2.88Å; V260-L324 HydrophobicContact CG2-CD1 4.48Å; V260-L324 HydrophobicContact CG2-CD2 4.01Å |
| 261 | A | 93.6 | Very high | 89.3 | Confident | 15 Ų | 15 | 45.3 Ų | 45.3 | 12% | 0.124 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | V201 L257 L258 H263 A264 I265 | V201-A261 HydrophobicContact CG2-CB 4.04Å; L257-A261 WeakPolarHBondContact O-CB 3.45Å; L257-A261 PolarHBondContact O-N 3.4Å; L258-A261 PolarHBondContact O-N 2.9Å; A261-H263 PolarHBondContact O-N 3.28Å; A261-A264 PolarHBondContact O-N 3.47Å; A261-I265 WeakPolarHBondContact O-CB 3.48Å; A261-I265 VanDerWaalsContact O-CG1 3.26Å; A261-I265 WeakPolarHBondContact O-CG1 3.43Å; A261-I265 PolarHBondContact O-N 2.89Å |
| 262 | A | 94.1 | Very high | 90.1 | Very high | 47 Ų | 47 | 44.8 Ų | 44.8 | 39% | 0.388 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62 | -43.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L258 V260 L266 | L258-A262 VanDerWaalsContact O-CB 3.25Å; L258-A262 WeakPolarHBondContact O-CB 3.48Å; L258-A262 PolarHBondContact O-N 3.38Å; V260-A262 VanDerWaalsContact C-N 3.33Å; V260-A262 PolarHBondContact O-N 3.06Å; A262-L266 WeakPolarHBondContact O-CB 3.5Å; A262-L266 PolarHBondContact O-N 3.47Å |
| 263 | H | 93.6 | Very high | 90.8 | Very high | 23 Ų | 23 | 45 Ų | 45 | 11% | 0.106 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.8 | -46.3 | 175.2 | 177.1 | 81.6 | 0 | 0 | 0 | 112 | P259 V260 A261 L266 R267 L320 L324 | P259-H263 WeakPolarHBondContact O-CB 3.22Å; P259-H263 PolarHBondContact O-N 3.49Å; V260-H263 PolarHBondContact O-N 3.1Å; A261-H263 PolarHBondContact O-N 3.28Å; H263-L266 PolarHBondContact O-N 2.95Å; H263-R267 VanDerWaalsContact O-CB 3.27Å; H263-R267 WeakPolarHBondContact O-CB 3.39Å; H263-R267 PolarHBondContact O-N 2.86Å; H263-L320 HydrophobicContact CB-CD2 3.76Å; H263-L320 HydrophobicContact CB-CG 4.21Å; H263-L324 HydrophobicContact CB-CD1 3.6Å |
| 264 | A | 90.8 | Very high | 91.2 | Very high | 25 Ų | 25 | 44.8 Ų | 44.8 | 21% | 0.207 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.8 | -46.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A200 V260 A261 R267 Y268 | A200-A264 HydrophobicContact CB-CB 3.61Å; V260-A264 PolarHBondContact O-N 2.88Å; A261-A264 PolarHBondContact O-N 3.47Å; A264-R267 PolarHBondContact O-N 3.13Å; A264-Y268 WeakPolarHBondContact O-CB 3.33Å; A264-Y268 PolarHBondContact O-N 2.87Å |
| 265 | I | 92.6 | Very high | 91.7 | Very high | 51 Ų | 51 | 42.2 Ų | 42.2 | 26% | 0.262 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.8 | -46.9 | 177.1 | -70.1 | 168.3 | 0 | 0 | 0 | 110.6 | L193 A261 Y268 A269 | L193-I265 HydrophobicContact CB-CG2 4.31Å; L193-I265 HydrophobicContact CD1-CG2 4.33Å; L193-I265 HydrophobicContact CD2-CG2 4.23Å; L193-I265 WeakPolarHBondContact O-CG1 3.45Å; A261-I265 WeakPolarHBondContact O-CB 3.48Å; A261-I265 VanDerWaalsContact O-CG1 3.26Å; A261-I265 WeakPolarHBondContact O-CG1 3.43Å; A261-I265 PolarHBondContact O-N 2.89Å; I265-Y268 PolarHBondContact O-N 2.67Å; I265-A269 WeakPolarHBondContact O-CB 3.33Å; I265-A269 PolarHBondContact O-N 3.46Å |
| 266 | L | 93.7 | Very high | 91.9 | Very high | 81 Ų | 81 | 40.7 Ų | 40.7 | 42% | 0.424 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.5 | -39.8 | -178.2 | -173.3 | 57.2 | 0 | 0 | 0 | 111.3 | A262 H263 A269 V270 L317 | A262-L266 WeakPolarHBondContact O-CB 3.5Å; A262-L266 PolarHBondContact O-N 3.47Å; H263-L266 PolarHBondContact O-N 2.95Å; L266-A269 PolarHBondContact O-N 3.21Å; L266-V270 HydrophobicContact CD1-CG2 4.23Å; L266-V270 WeakPolarHBondContact O-CB 3.49Å; L266-V270 VanDerWaalsContact O-CG2 3.28Å; L266-V270 WeakPolarHBondContact O-CG2 3.36Å; L266-V270 PolarHBondContact O-N 2.92Å; L266-L317 HydrophobicContact CB-CD1 4.06Å; L266-L317 HydrophobicContact CB-CD2 4.46Å; L266-L317 HydrophobicContact CD2-CD1 4.4Å; L266-L317 HydrophobicContact CD2-CD2 3.32Å; L266-L317 HydrophobicContact CD2-CG 4.49Å; L266-L317 HydrophobicContact CG-CD1 3.95Å; L266-L317 HydrophobicContact CG-CD2 3.67Å; L266-L317 HydrophobicContact CG-CG 4.4Å |
| 267 | R | 93.6 | Very high | 92 | Very high | 24 Ų | 24 | 42.8 Ų | 42.8 | 9% | 0.091 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.1 | -51.3 | 175.5 | -177 | -167.2 | 179.2 | 74.7 | 4.2 | 110.7 | H263 A264 A269 V270 A271 A313 D314 L317 | H263-R267 VanDerWaalsContact O-CB 3.27Å; H263-R267 WeakPolarHBondContact O-CB 3.39Å; H263-R267 PolarHBondContact O-N 2.86Å; A264-R267 PolarHBondContact O-N 3.13Å; R267-A269 VanDerWaalsContact C-N 3.35Å; R267-A269 PolarHBondContact O-N 3.32Å; R267-V270 PolarHBondContact O-N 3.35Å; R267-A271 WeakPolarHBondContact O-CB 3.16Å; R267-A271 PolarHBondContact O-N 3.37Å; R267-A313 HydrophobicContact CG-CB 4Å; R267-D314 IonicContact CZ-OD1 3.26Å; R267-D314 VanDerWaalsContact CZ-OD1 3.32Å; R267-D314 IonicContact CZ-OD2 3.76Å; R267-D314 VanDerWaalsContact NH1-CG 3.26Å; R267-D314 IonicContact NH1-OD1 2.72Å; R267-D314 PolarHBondContact NH1-OD1 3.39Å; R267-D314 IonicContact NH1-OD2 2.61Å; R267-D314 VanDerWaalsContact NH2-CG 3.25Å; R267-D314 IonicContact NH2-OD1 2.79Å; R267-D314 PolarHBondContact NH2-OD1 3.46Å; R267-D314 VanDerWaalsContact NH2-OD1 3.16Å; R267-D314 IonicContact NH2-OD2 3.26Å; R267-D314 PolarHBondContact NH2-OD2 3.27Å; R267-L317 HydrophobicContact CB-CD1 3.63Å; R267-L317 HydrophobicContact CG-CD1 4.42Å |
| 268 | Y | 89.6 | Confident | 92.1 | Very high | 25 Ų | 25 | 42 Ų | 42 | 10% | 0.098 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -56.8 | -49.7 | 177.1 | 172.6 | -82.9 | 0 | 0 | 0 | 111 | Q40 L180 H192 L193 K196 A264 I265 V270 A271 A272 | Q40-Y268 HydrophobicContact CG-CD2 4.35Å; Q40-Y268 VanDerWaalsContact NE2-CD2 3.32Å; L180-Y268 VanDerWaalsContact CD1-OH 3.29Å; L180-Y268 WeakPolarHBondContact CD1-OH 3.4Å; H192-Y268 AromaticContact CD2-CE1 3.81Å; H192-Y268 AromaticContact CD2-CE2 3.82Å; H192-Y268 AromaticContact CD2-CZ 3.38Å; H192-Y268 PolarHBondContact CD2-OH 3.44Å; H192-Y268 VanDerWaalsContact CD2-OH 3.26Å; H192-Y268 AromaticContact NE2-CE1 3.93Å; H192-Y268 AromaticContact NE2-CE2 3.06Å; H192-Y268 WeakPolarHBondContact NE2-CE2 3.09Å; H192-Y268 AromaticContact NE2-CZ 3.06Å; H192-Y268 PolarHBondContact NE2-OH 2.9Å; L193-Y268 HydrophobicContact CD2-CD1 3.54Å; L193-Y268 HydrophobicContact CD2-CE1 3.85Å; K196-Y268 HydrophobicContact CG-CD2 4.31Å; A264-Y268 WeakPolarHBondContact O-CB 3.33Å; A264-Y268 PolarHBondContact O-N 2.87Å; I265-Y268 PolarHBondContact O-N 2.67Å; Y268-V270 PolarHBondContact O-N 2.99Å; Y268-A271 PolarHBondContact O-N 3.34Å; Y268-A272 HydrophobicContact CE1-CB 4.25Å; Y268-A272 VanDerWaalsContact O-CB 3.29Å; Y268-A272 WeakPolarHBondContact O-CB 3.49Å; Y268-A272 PolarHBondContact O-N 2.8Å |
| 269 | A | 90.6 | Very high | 91.9 | Very high | 43 Ų | 43 | 37.4 Ų | 37.4 | 36% | 0.355 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.4 | -44.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I265 L266 R267 S273 | I265-A269 WeakPolarHBondContact O-CB 3.33Å; I265-A269 PolarHBondContact O-N 3.46Å; L266-A269 PolarHBondContact O-N 3.21Å; R267-A269 VanDerWaalsContact C-N 3.35Å; R267-A269 PolarHBondContact O-N 3.32Å; A269-S273 WeakPolarHBondContact O-CB 3.22Å; A269-S273 PolarHBondContact O-N 3.35Å; A269-S273 PolarHBondContact O-OG 3.44Å |
| 270 | V | 92.7 | Very high | 91.7 | Very high | 23 Ų | 23 | 42.1 Ų | 42.1 | 14% | 0.139 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.5 | -51.1 | 176.5 | 173.5 | 0 | 0 | 0 | 0 | 110.4 | L266 R267 Y268 A272 S273 V274 A313 L316 | L266-V270 HydrophobicContact CD1-CG2 4.23Å; L266-V270 WeakPolarHBondContact O-CB 3.49Å; L266-V270 VanDerWaalsContact O-CG2 3.28Å; L266-V270 WeakPolarHBondContact O-CG2 3.36Å; L266-V270 PolarHBondContact O-N 2.92Å; R267-V270 PolarHBondContact O-N 3.35Å; Y268-V270 PolarHBondContact O-N 2.99Å; V270-A272 PolarHBondContact O-N 3.43Å; V270-S273 PolarHBondContact O-N 2.97Å; V270-S273 PolarHBondContact O-OG 3.32Å; V270-V274 HydrophobicContact CG1-CG2 4.35Å; V270-V274 WeakPolarHBondContact O-CG2 3.3Å; V270-V274 PolarHBondContact O-N 2.91Å; V270-A313 HydrophobicContact CB-CB 4.13Å; V270-A313 HydrophobicContact CG1-CB 3.94Å; V270-L316 HydrophobicContact CG1-CD1 3.67Å |
| 271 | A | 91.1 | Very high | 91.5 | Very high | 6 Ų | 6 | 46.5 Ų | 46.5 | 5% | 0.05 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.5 | -49.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112 | R267 Y268 S273 V274 Q275 G309 A313 | R267-A271 WeakPolarHBondContact O-CB 3.16Å; R267-A271 PolarHBondContact O-N 3.37Å; Y268-A271 PolarHBondContact O-N 3.34Å; A271-S273 PolarHBondContact O-N 3.2Å; A271-V274 PolarHBondContact O-N 3.05Å; A271-Q275 VanDerWaalsContact O-CB 3.29Å; A271-Q275 WeakPolarHBondContact O-CB 3.39Å; A271-Q275 PolarHBondContact O-N 2.71Å; A271-G309 WeakPolarHBondContact CA-O 3.48Å; A271-A313 HydrophobicContact CB-CB 3.91Å |
| 272 | A | 88.8 | Confident | 91.1 | Very high | 11 Ų | 11 | 50.9 Ų | 50.9 | 9% | 0.091 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.1 | -39.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y268 V270 R276 | Y268-A272 HydrophobicContact CE1-CB 4.25Å; Y268-A272 VanDerWaalsContact O-CB 3.29Å; Y268-A272 WeakPolarHBondContact O-CB 3.49Å; Y268-A272 PolarHBondContact O-N 2.8Å; V270-A272 PolarHBondContact O-N 3.43Å; A272-R276 WeakPolarHBondContact O-CB 3.48Å; A272-R276 VanDerWaalsContact O-CG 3.26Å; A272-R276 WeakPolarHBondContact O-CG 3.4Å; A272-R276 PolarHBondContact O-N 3.4Å |
| 273 | S | 91 | Very high | 90.6 | Very high | 67 Ų | 67 | 55 Ų | 55 | 47% | 0.469 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -65.1 | -43.7 | 177.7 | 72.8 | 0 | 0 | 0 | 0 | 112.1 | A269 V270 A271 R276 A277 | A269-S273 WeakPolarHBondContact O-CB 3.22Å; A269-S273 PolarHBondContact O-N 3.35Å; A269-S273 PolarHBondContact O-OG 3.44Å; V270-S273 PolarHBondContact O-N 2.97Å; V270-S273 PolarHBondContact O-OG 3.32Å; A271-S273 PolarHBondContact O-N 3.2Å; S273-R276 PolarHBondContact O-N 2.87Å; S273-A277 WeakPolarHBondContact O-CB 3.29Å; S273-A277 PolarHBondContact O-N 2.93Å |
| 274 | V | 93 | Very high | 90 | Very high | 37 Ų | 37 | 61.2 Ų | 61.2 | 22% | 0.224 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -69.9 | -44.1 | 179.9 | 171.6 | 0 | 0 | 0 | 0 | 110.4 | V270 A271 R276 A277 V278 A312 | V270-V274 HydrophobicContact CG1-CG2 4.35Å; V270-V274 WeakPolarHBondContact O-CG2 3.3Å; V270-V274 PolarHBondContact O-N 2.91Å; A271-V274 PolarHBondContact O-N 3.05Å; V274-R276 VanDerWaalsContact C-N 3.34Å; V274-R276 PolarHBondContact O-N 3.05Å; V274-A277 WeakPolarHBondContact O-CB 3.31Å; V274-A277 PolarHBondContact O-N 2.91Å; V274-A277 VanDerWaalsContact O-N 3.14Å; V274-V278 HydrophobicContact CG1-CG2 4.22Å; V274-V278 VanDerWaalsContact O-CG2 3.31Å; V274-V278 WeakPolarHBondContact O-CG2 3.41Å; V274-V278 PolarHBondContact O-N 3.34Å; V274-A312 HydrophobicContact CB-CB 4.31Å; V274-A312 HydrophobicContact CG1-CB 3.95Å; V274-A312 HydrophobicContact CG2-CB 3.88Å |
| 275 | Q | 91.6 | Very high | 88.9 | Confident | 19 Ų | 19 | 63.3 Ų | 63.3 | 9% | 0.089 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -55.6 | -48.7 | 174.6 | 176.2 | -174.4 | -3.7 | 0 | 0 | 111.4 | G36 A271 A277 V278 L279 A305 A306 | G36-Q275 PolarHBondContact O-NE2 2.94Å; A271-Q275 VanDerWaalsContact O-CB 3.29Å; A271-Q275 WeakPolarHBondContact O-CB 3.39Å; A271-Q275 PolarHBondContact O-N 2.71Å; Q275-A277 VanDerWaalsContact C-N 3.34Å; Q275-A277 PolarHBondContact O-N 3.24Å; Q275-V278 PolarHBondContact O-N 3.5Å; Q275-L279 HydrophobicContact CG-CD1 4.29Å; Q275-L279 WeakPolarHBondContact O-CB 3.35Å; Q275-L279 WeakPolarHBondContact O-CG 3.46Å; Q275-L279 PolarHBondContact O-N 3.35Å; Q275-A305 HydrophobicContact CG-CB 4.16Å; Q275-A306 VanDerWaalsContact CD-CB 3.5Å; Q275-A306 HydrophobicContact CG-CB 3.86Å |
| 276 | R | 90.3 | Very high | 87.6 | Confident | 116 Ų | 116 | 62.9 Ų | 62.9 | 44% | 0.438 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61.7 | -41.5 | 176.5 | -73.7 | 174.5 | 179.8 | -178.4 | -0.2 | 111.9 | A272 S273 V274 W280 | A272-R276 WeakPolarHBondContact O-CB 3.48Å; A272-R276 VanDerWaalsContact O-CG 3.26Å; A272-R276 WeakPolarHBondContact O-CG 3.4Å; A272-R276 PolarHBondContact O-N 3.4Å; S273-R276 PolarHBondContact O-N 2.87Å; V274-R276 VanDerWaalsContact C-N 3.34Å; V274-R276 PolarHBondContact O-N 3.05Å; R276-W280 WeakPolarHBondContact O-CB 3.41Å; R276-W280 PolarHBondContact O-N 2.98Å |
| 277 | A | 92.4 | Very high | 85.7 | Confident | 47 Ų | 47 | 68 Ų | 68 | 39% | 0.388 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S273 V274 Q275 W280 L281 | S273-A277 WeakPolarHBondContact O-CB 3.29Å; S273-A277 PolarHBondContact O-N 2.93Å; V274-A277 WeakPolarHBondContact O-CB 3.31Å; V274-A277 PolarHBondContact O-N 2.91Å; V274-A277 VanDerWaalsContact O-N 3.14Å; Q275-A277 VanDerWaalsContact C-N 3.34Å; Q275-A277 PolarHBondContact O-N 3.24Å; A277-W280 PolarHBondContact O-N 3.24Å; A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 VanDerWaalsContact O-CG 3.28Å; A277-L281 WeakPolarHBondContact O-CG 3.41Å; A277-L281 PolarHBondContact O-N 3.35Å |
| 278 | V | 91.5 | Very high | 83.7 | Confident | 49 Ų | 49 | 78.4 Ų | 78.4 | 30% | 0.297 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.3 | -45.5 | 178.4 | 174.2 | 0 | 0 | 0 | 0 | 111 | V274 Q275 W280 L281 H282 A305 A308 | V274-V278 HydrophobicContact CG1-CG2 4.22Å; V274-V278 VanDerWaalsContact O-CG2 3.31Å; V274-V278 WeakPolarHBondContact O-CG2 3.41Å; V274-V278 PolarHBondContact O-N 3.34Å; Q275-V278 PolarHBondContact O-N 3.5Å; V278-W280 VanDerWaalsContact C-N 3.33Å; V278-W280 PolarHBondContact O-N 2.69Å; V278-L281 PolarHBondContact O-N 3.04Å; V278-H282 WeakPolarHBondContact O-CB 3.3Å; V278-H282 PolarHBondContact O-N 3.26Å; V278-A305 HydrophobicContact CB-CB 3.91Å; V278-A305 HydrophobicContact CG1-CB 3.71Å; V278-A308 HydrophobicContact CG2-CB 4.23Å |
| 279 | L | 89.1 | Confident | 81.8 | Confident | 40 Ų | 40 | 87.8 Ų | 87.8 | 21% | 0.209 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -60 | -43.8 | 175.2 | -75.5 | 176.2 | 0 | 0 | 0 | 111.9 | Q275 H282 Q283 A305 | Q275-L279 HydrophobicContact CG-CD1 4.29Å; Q275-L279 WeakPolarHBondContact O-CB 3.35Å; Q275-L279 WeakPolarHBondContact O-CG 3.46Å; Q275-L279 PolarHBondContact O-N 3.35Å; L279-H282 PolarHBondContact O-N 3.03Å; L279-Q283 WeakPolarHBondContact O-CB 3.33Å; L279-Q283 VanDerWaalsContact O-CG 3.27Å; L279-Q283 WeakPolarHBondContact O-CG 3.29Å; L279-Q283 PolarHBondContact O-N 2.85Å; L279-A305 HydrophobicContact CD1-CB 4.47Å; L279-A305 HydrophobicContact CD2-CB 3.8Å; L279-A305 HydrophobicContact CG-CB 3.63Å |
| 280 | W | 88.9 | Confident | 79.9 | Confident | 121 Ų | 121 | 91.2 Ų | 91.2 | 46% | 0.458 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.6 | -41 | 177.4 | 175.1 | 95.8 | 0 | 0 | 0 | 112.5 | R276 A277 V278 H282 Q283 R284 | R276-W280 WeakPolarHBondContact O-CB 3.41Å; R276-W280 PolarHBondContact O-N 2.98Å; A277-W280 PolarHBondContact O-N 3.24Å; V278-W280 VanDerWaalsContact C-N 3.33Å; V278-W280 PolarHBondContact O-N 2.69Å; W280-H282 VanDerWaalsContact C-N 3.34Å; W280-Q283 PolarHBondContact O-N 3.02Å; W280-R284 HydrophobicContact CD2-CG 4.4Å; W280-R284 WeakPolarHBondContact O-CB 3.48Å; W280-R284 WeakPolarHBondContact O-CG 3.5Å; W280-R284 PolarHBondContact O-N 3.19Å |
| 281 | L | 89.4 | Confident | 77.9 | Confident | 107 Ų | 107 | 95.5 Ų | 95.5 | 56% | 0.56 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.5 | -43.8 | 174.9 | -76.9 | 171.1 | 0 | 0 | 0 | 110.7 | A277 V278 R284 G285 | A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 VanDerWaalsContact O-CG 3.28Å; A277-L281 WeakPolarHBondContact O-CG 3.41Å; A277-L281 PolarHBondContact O-N 3.35Å; V278-L281 PolarHBondContact O-N 3.04Å; L281-R284 PolarHBondContact O-N 3.45Å; L281-G285 PolarHBondContact O-N 3.42Å |
| 282 | H | 84.7 | Confident | 76.2 | Confident | 107 Ų | 107 | 99.9 Ų | 99.9 | 50% | 0.495 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.9 | -46 | 177.2 | -175.8 | -94.5 | 0 | 0 | 0 | 111.8 | V278 L279 W280 R284 G285 G286 | V278-H282 WeakPolarHBondContact O-CB 3.3Å; V278-H282 PolarHBondContact O-N 3.26Å; L279-H282 PolarHBondContact O-N 3.03Å; W280-H282 VanDerWaalsContact C-N 3.34Å; H282-R284 PolarHBondContact O-N 2.98Å; H282-G285 PolarHBondContact O-N 3.04Å; H282-G286 PolarHBondContact O-N 3.4Å |
| 283 | Q | 83.3 | Confident | 74.6 | Confident | 133 Ų | 133 | 104.5 Ų | 104.5 | 62% | 0.621 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.6 | -35.4 | 177.5 | -71.9 | 174.3 | 6.8 | 0 | 0 | 112.7 | L279 W280 G286 | L279-Q283 WeakPolarHBondContact O-CB 3.33Å; L279-Q283 VanDerWaalsContact O-CG 3.27Å; L279-Q283 WeakPolarHBondContact O-CG 3.29Å; L279-Q283 PolarHBondContact O-N 2.85Å; W280-Q283 PolarHBondContact O-N 3.02Å; Q283-G286 PolarHBondContact O-N 3.31Å |
| 284 | R | 81.6 | Confident | 73.4 | Confident | 154 Ų | 154 | 102.5 Ų | 102.5 | 58% | 0.581 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -67.7 | -39.2 | 174.9 | -79.4 | -173.4 | 167 | -159.4 | -0.9 | 112.6 | W280 L281 H282 G286 | W280-R284 HydrophobicContact CD2-CG 4.4Å; W280-R284 WeakPolarHBondContact O-CB 3.48Å; W280-R284 WeakPolarHBondContact O-CG 3.5Å; W280-R284 PolarHBondContact O-N 3.19Å; L281-R284 PolarHBondContact O-N 3.45Å; H282-R284 PolarHBondContact O-N 2.98Å; R284-G286 VanDerWaalsContact C-N 3.32Å |
| 285 | G | 68.1 | Low | 72 | Confident | 68 Ų | 68 | 102.8 Ų | 102.8 | 70% | 0.701 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -70.4 | -26.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | L281 H282 K287 | L281-G285 PolarHBondContact O-N 3.42Å; H282-G285 PolarHBondContact O-N 3.04Å; G285-K287 PolarHBondContact O-N 3.44Å |
| 286 | G | 63.9 | Low | 70.9 | Confident | 43 Ų | 43 | 102.2 Ų | 102.2 | 44% | 0.443 | 53% | 0.526 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80 | -1.1 | -175.2 | 0 | 0 | 0 | 0 | 0 | 117 | H282 Q283 R284 R288 R289 | H282-G286 PolarHBondContact O-N 3.4Å; Q283-G286 PolarHBondContact O-N 3.31Å; R284-G286 VanDerWaalsContact C-N 3.32Å; G286-R288 PolarHBondContact O-N 2.96Å; G286-R289 PolarHBondContact O-N 3.28Å |
| 287 | K | 54.7 | Low | 70 | Confident | 188 Ų | 188 | 99.4 Ų | 99.4 | 82% | 0.817 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.5 | 8.5 | -177.7 | -83.6 | -173.4 | 174.8 | -175.3 | 0 | 116.5 | G285 | G285-K287 PolarHBondContact O-N 3.44Š|
| 288 | R | 51.6 | Low | 69 | Low | 243 Ų | 243 | 100 Ų | 100 | 92% | 0.917 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -118.9 | -2.6 | -179.8 | -85.7 | -175.4 | 175.4 | -179.2 | -0.8 | 116.3 | G286 | G286-R288 PolarHBondContact O-N 2.96Š|
| 289 | R | 50.3 | Low | 68.2 | Low | 222 Ų | 222 | 102.9 Ų | 102.9 | 84% | 0.838 | 53% | 0.53 | S | S | * | . | trans | -107.7 | 113.2 | 177.5 | -101.1 | 179.4 | 166.4 | 152.4 | -3.7 | 111.4 | G286 V291 | G286-R289 PolarHBondContact O-N 3.28Å; R289-V291 PolarHBondContact O-N 3.41Å | ||
| 290 | P | 49.2 | Very low | 67.9 | Low | 115 Ų | 115 | 101.2 Ų | 101.2 | 75% | 0.747 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -74 | 119.3 | 173 | 29.3 | -27.3 | 0 | 0 | 0 | 108.4 | ||
| 291 | V | 52.2 | Low | 67.7 | Low | 113 Ų | 113 | 96.2 Ų | 96.2 | 69% | 0.685 | 51% | 0.505 | S | S | * | . | S | Bend | trans | 67.4 | 122.1 | 172.8 | -168.1 | 0 | 0 | 0 | 0 | 114.9 | R289 S293 | R289-V291 PolarHBondContact O-N 3.41Å; V291-S293 PolarHBondContact O-N 3.4Å; V291-S293 PolarHBondContact O-OG 2.97Å |
| 292 | P | 54.3 | Low | 67.5 | Low | 97 Ų | 97 | 93.1 Ų | 93.1 | 63% | 0.63 | 49% | 0.487 | S | S | * | . | trans | -62.1 | 105.3 | 167.2 | -12.2 | 25.9 | 0 | 0 | 0 | 108.5 | D294 | P292-D294 PolarHBondContact O-N 3.03Š| ||
| 293 | S | 56.4 | Low | 67.5 | Low | 108 Ų | 108 | 89.2 Ų | 89.2 | 76% | 0.755 | 47% | 0.47 | S | S | * | . | S | Bend | trans | -73.8 | -11.1 | -179.5 | -40.2 | 0 | 0 | 0 | 0 | 112.5 | V291 | V291-S293 PolarHBondContact O-N 3.4Å; V291-S293 PolarHBondContact O-OG 2.97Å |
| 294 | D | 65.3 | Low | 67.7 | Low | 26 Ų | 26 | 84.8 Ų | 84.8 | 14% | 0.139 | 46% | 0.456 | C | S | . | . | S | Bend | trans | -132.7 | 122.5 | -176.4 | -166.4 | -10.8 | 0 | 0 | 0 | 110.3 | P292 L296 D297 | P292-D294 PolarHBondContact O-N 3.03Å; D294-L296 PolarHBondContact O-N 3.16Å; D294-L296 VanDerWaalsContact O-N 3.11Å; D294-L296 WeakPolarHBondContact OD1-CB 3.38Å; D294-L296 PolarHBondContact OD1-N 3.27Å; D294-D297 PolarHBondContact O-N 2.74Å |
| 295 | P | 64.1 | Low | 68.1 | Low | 43 Ų | 43 | 77.4 Ų | 77.4 | 28% | 0.279 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.6 | -30.1 | 175.6 | 20.7 | -35 | 0 | 0 | 0 | 112.9 | N88 D297 A298 Y299 | N88-P295 VanDerWaalsContact CG-CG 3.5Å; N88-P295 WeakPolarHBondContact ND2-CG 3.29Å; N88-P295 WeakPolarHBondContact OD1-CG 2.94Å; P295-D297 PolarHBondContact O-N 3.13Å; P295-A298 PolarHBondContact O-N 3.25Å; P295-Y299 WeakPolarHBondContact O-CD2 3.5Å |
| 296 | L | 67.9 | Low | 69.1 | Low | 7 Ų | 7 | 74.2 Ų | 74.2 | 4% | 0.037 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -56.7 | -34.3 | 173.7 | -76.7 | 174.3 | 0 | 0 | 0 | 114.3 | D294 A298 Y299 F300 L404 R405 L408 | D294-L296 PolarHBondContact O-N 3.16Å; D294-L296 VanDerWaalsContact O-N 3.11Å; D294-L296 WeakPolarHBondContact OD1-CB 3.38Å; D294-L296 PolarHBondContact OD1-N 3.27Å; L296-A298 PolarHBondContact O-N 3.08Å; L296-Y299 PolarHBondContact O-N 2.98Å; L296-F300 HydrophobicContact CB-CD2 4.39Å; L296-F300 HydrophobicContact CD2-CD2 3.73Å; L296-F300 HydrophobicContact CD2-CE2 3.33Å; L296-F300 HydrophobicContact CD2-CZ 4.48Å; L296-F300 WeakPolarHBondContact O-CD2 3.31Å; L296-F300 PolarHBondContact O-N 3.14Å; L296-F300 VanDerWaalsContact O-N 3.16Å; L296-L404 HydrophobicContact CD1-CG 4.22Å; L296-L404 HydrophobicContact CD2-CB 4.23Å; L296-L404 HydrophobicContact CD2-CD2 3.3Å; L296-L404 HydrophobicContact CD2-CG 3.73Å; L296-L404 HydrophobicContact CG-CD2 4.33Å; L296-L404 HydrophobicContact CG-CG 4.41Å; L296-R405 HydrophobicContact CD1-CB 4.29Å; L296-R405 HydrophobicContact CD1-CG 3.46Å; L296-R405 VanDerWaalsContact CD1-CG 3.46Å; L296-L408 HydrophobicContact CD1-CD1 3.46Å; L296-L408 VanDerWaalsContact CD1-CD1 3.46Å; L296-L408 HydrophobicContact CD1-CG 4.47Å; L296-L408 HydrophobicContact CG-CD1 3.78Å |
| 297 | D | 70.5 | Confident | 70.4 | Confident | 57 Ų | 57 | 75.4 Ų | 75.4 | 31% | 0.305 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -77.1 | -7.1 | -176.5 | -73.5 | -22.7 | 0 | 0 | 0 | 112.6 | D294 P295 P301 R401 R405 | D294-D297 PolarHBondContact O-N 2.74Å; P295-D297 PolarHBondContact O-N 3.13Å; D297-P301 VanDerWaalsContact O-CD 3.32Å; D297-P301 WeakPolarHBondContact O-CD 3.3Å; D297-P301 VanDerWaalsContact O-CG 3.23Å; D297-P301 WeakPolarHBondContact O-CG 3.34Å; D297-R401 IonicContact OD1-NH2 3.03Å; D297-R401 PolarHBondContact OD1-NH2 2.86Å; D297-R405 IonicContact OD1-CZ 3.96Å; D297-R405 IonicContact OD1-NH2 2.81Å; D297-R405 PolarHBondContact OD1-NH2 3.14Å |
| 298 | A | 71.1 | Confident | 72.2 | Confident | 60 Ų | 60 | 67.6 Ų | 67.6 | 50% | 0.496 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -89.5 | -43.9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | P295 L296 | P295-A298 PolarHBondContact O-N 3.25Å; L296-A298 PolarHBondContact O-N 3.08Å |
| 299 | Y | 75.6 | Confident | 74.2 | Confident | 108 Ų | 108 | 56 Ų | 56 | 42% | 0.424 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -77.7 | -42 | -174 | -68.3 | -74.8 | 0 | 0 | 0 | 114 | P295 L296 E302 L303 | P295-Y299 WeakPolarHBondContact O-CD2 3.5Å; L296-Y299 PolarHBondContact O-N 2.98Å; Y299-E302 PolarHBondContact O-N 3.42Å; Y299-L303 PolarHBondContact O-N 2.61Å; Y299-L303 VanDerWaalsContact O-N 3.13Å |
| 300 | F | 81.9 | Confident | 76.2 | Confident | 5 Ų | 5 | 45.9 Ų | 45.9 | 2% | 0.022 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.4 | -39.1 | -175.1 | -87.7 | -85.7 | 0 | 0 | 0 | 114.6 | I95 L296 E302 L303 A304 L397 R401 | I95-F300 HydrophobicContact CD1-CE2 3.61Å; I95-F300 HydrophobicContact CD1-CZ 3.67Å; I95-F300 HydrophobicContact CG1-CZ 4.37Å; L296-F300 HydrophobicContact CB-CD2 4.39Å; L296-F300 HydrophobicContact CD2-CD2 3.73Å; L296-F300 HydrophobicContact CD2-CE2 3.33Å; L296-F300 HydrophobicContact CD2-CZ 4.48Å; L296-F300 WeakPolarHBondContact O-CD2 3.31Å; L296-F300 PolarHBondContact O-N 3.14Å; L296-F300 VanDerWaalsContact O-N 3.16Å; F300-E302 VanDerWaalsContact C-N 3.28Å; F300-E302 PolarHBondContact O-N 2.91Å; F300-L303 PolarHBondContact O-N 3.4Å; F300-A304 VanDerWaalsContact O-CB 3.24Å; F300-A304 WeakPolarHBondContact O-CB 3.12Å; F300-A304 PolarHBondContact O-N 2.97Å; F300-L397 HydrophobicContact CD1-CD1 4.05Å; F300-L397 HydrophobicContact CD1-CG 4.47Å; F300-L397 HydrophobicContact CE1-CD1 3.63Å; F300-L397 HydrophobicContact CE1-CG 4.27Å; F300-L397 WeakPolarHBondContact CE1-O 2.99Å; F300-R401 HydrophobicContact CD1-CB 3.72Å; F300-R401 HydrophobicContact CD1-CG 3.71Å; F300-R401 HydrophobicContact CD2-CG 3.96Å; F300-R401 HydrophobicContact CE1-CB 3.28Å; F300-R401 HydrophobicContact CE1-CG 3.73Å; F300-R401 HydrophobicContact CE2-CB 4.19Å; F300-R401 HydrophobicContact CE2-CG 3.99Å; F300-R401 HydrophobicContact CG-CB 4.32Å; F300-R401 HydrophobicContact CG-CG 3.82Å; F300-R401 HydrophobicContact CZ-CB 3.55Å; F300-R401 HydrophobicContact CZ-CG 3.86Å |
| 301 | P | 85.5 | Confident | 78.3 | Confident | 17 Ų | 17 | 42.2 Ų | 42.2 | 11% | 0.11 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.8 | -34.7 | 174.2 | -25.7 | 36 | 0 | 0 | 0 | 113.5 | D297 A305 | D297-P301 VanDerWaalsContact O-CD 3.32Å; D297-P301 WeakPolarHBondContact O-CD 3.3Å; D297-P301 VanDerWaalsContact O-CG 3.23Å; D297-P301 WeakPolarHBondContact O-CG 3.34Å; P301-A305 WeakPolarHBondContact O-CB 3.27Å; P301-A305 PolarHBondContact O-N 3.2Å |
| 302 | E | 85.1 | Confident | 80.4 | Confident | 41 Ų | 41 | 38.1 Ų | 38.1 | 19% | 0.192 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -67.4 | -48.1 | 176.4 | -167.9 | 172.1 | -171.1 | 0 | 0 | 111.3 | S35 G36 Y299 F300 A304 A305 A306 | S35-E302 WeakPolarHBondContact CA-OE1 3.25Å; S35-E302 WeakPolarHBondContact CB-OE1 3.41Å; S35-E302 WeakPolarHBondContact CB-OE2 3.3Å; S35-E302 VanDerWaalsContact OG-CD 3.26Å; S35-E302 PolarHBondContact OG-OE2 3.44Å; G36-E302 PolarHBondContact N-OE1 3.36Å; Y299-E302 PolarHBondContact O-N 3.42Å; F300-E302 VanDerWaalsContact C-N 3.28Å; F300-E302 PolarHBondContact O-N 2.91Å; E302-A304 VanDerWaalsContact C-N 3.33Å; E302-A304 PolarHBondContact O-N 3.03Å; E302-A305 PolarHBondContact O-N 3.22Å; E302-A306 PolarHBondContact O-N 3.45Å |
| 303 | L | 84.5 | Confident | 82.3 | Confident | 25 Ų | 25 | 33.5 Ų | 33.5 | 13% | 0.131 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.8 | -36.7 | 178.2 | -169.2 | 55.1 | 0 | 0 | 0 | 112.5 | Q39 I95 Y299 F300 W307 L397 | Q39-L303 PolarHBondContact NE2-O 2.86Å; Q39-L303 PolarHBondContact OE1-O 3.31Å; I95-L303 HydrophobicContact CG2-CD2 3.27Å; Y299-L303 PolarHBondContact O-N 2.61Å; Y299-L303 VanDerWaalsContact O-N 3.13Å; F300-L303 PolarHBondContact O-N 3.4Å; L303-W307 VanDerWaalsContact O-CB 3.23Å; L303-W307 WeakPolarHBondContact O-CB 3.41Å; L303-W307 PolarHBondContact O-N 2.91Å; L303-L397 HydrophobicContact CD2-CD1 3.2Å; L303-L397 HydrophobicContact CD2-CD2 4.45Å; L303-L397 HydrophobicContact CD2-CG 4.45Å; L303-L397 HydrophobicContact CG-CD1 3.67Å; L303-L397 HydrophobicContact CG-CD2 3.98Å |
| 304 | A | 88.1 | Confident | 84.1 | Confident | 40 Ų | 40 | 28.4 Ų | 28.4 | 33% | 0.331 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -69.7 | -38.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | F300 E302 W307 A308 | F300-A304 VanDerWaalsContact O-CB 3.24Å; F300-A304 WeakPolarHBondContact O-CB 3.12Å; F300-A304 PolarHBondContact O-N 2.97Å; E302-A304 VanDerWaalsContact C-N 3.33Å; E302-A304 PolarHBondContact O-N 3.03Å; A304-W307 PolarHBondContact O-N 3.37Å; A304-A308 WeakPolarHBondContact O-CB 3.46Å; A304-A308 PolarHBondContact O-N 3.07Å |
| 305 | A | 90.4 | Very high | 85.6 | Confident | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -66.3 | -42 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | Q275 V278 L279 P301 E302 A308 G309 | Q275-A305 HydrophobicContact CG-CB 4.16Å; V278-A305 HydrophobicContact CB-CB 3.91Å; V278-A305 HydrophobicContact CG1-CB 3.71Å; L279-A305 HydrophobicContact CD1-CB 4.47Å; L279-A305 HydrophobicContact CD2-CB 3.8Å; L279-A305 HydrophobicContact CG-CB 3.63Å; P301-A305 WeakPolarHBondContact O-CB 3.27Å; P301-A305 PolarHBondContact O-N 3.2Å; E302-A305 PolarHBondContact O-N 3.22Å; A305-A308 PolarHBondContact O-N 2.89Å; A305-G309 PolarHBondContact O-N 3.32Å |
| 306 | A | 89.4 | Confident | 87.1 | Confident | 1 Ų | 1 | 32.5 Ų | 32.5 | 1% | 0.008 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -79 | -27.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q39 Q275 E302 A308 G309 S310 | Q39-A306 HydrophobicContact CB-CB 3.72Å; Q39-A306 VanDerWaalsContact CD-C 3.49Å; Q39-A306 VanDerWaalsContact CD-CB 3.5Å; Q39-A306 HydrophobicContact CG-CB 4.18Å; Q275-A306 VanDerWaalsContact CD-CB 3.5Å; Q275-A306 HydrophobicContact CG-CB 3.86Å; E302-A306 PolarHBondContact O-N 3.45Å; A306-A308 VanDerWaalsContact C-N 3.35Å; A306-A308 PolarHBondContact O-N 3.29Å; A306-G309 PolarHBondContact O-N 2.95Å; A306-S310 PolarHBondContact O-N 3.29Å; A306-S310 PolarHBondContact O-OG 2.82Å |
| 307 | W | 90.1 | Very high | 88.4 | Confident | 67 Ų | 67 | 32.8 Ų | 32.8 | 25% | 0.254 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -59.2 | -46.3 | 164.8 | 171.7 | 89.3 | 0 | 0 | 0 | 111.2 | L303 A304 G309 S310 L311 Y390 H393 | L303-W307 VanDerWaalsContact O-CB 3.23Å; L303-W307 WeakPolarHBondContact O-CB 3.41Å; L303-W307 PolarHBondContact O-N 2.91Å; A304-W307 PolarHBondContact O-N 3.37Å; W307-G309 VanDerWaalsContact C-N 3.33Å; W307-G309 PolarHBondContact O-N 2.78Å; W307-S310 PolarHBondContact O-N 2.87Å; W307-L311 HydrophobicContact CH2-CD2 3.76Å; W307-L311 HydrophobicContact CZ2-CD2 4.09Å; W307-L311 HydrophobicContact CZ3-CD2 4.21Å; W307-L311 WeakPolarHBondContact O-CB 3.41Å; W307-L311 PolarHBondContact O-N 3.21Å; W307-Y390 AromaticContact CD1-CD1 3.98Å; W307-Y390 AromaticContact CE2-CD1 3.97Å; W307-Y390 HydrophobicContact CZ2-CD1 4.41Å; W307-Y390 AromaticContact NE1-CD1 3.53Å; W307-Y390 PolarHBondContact NE1-O 2.83Å; W307-H393 AromaticContact CD1-CD2 3.43Å; W307-H393 VanDerWaalsContact CD1-CD2 3.43Å; W307-H393 AromaticContact CD1-CG 3.8Å; W307-H393 AromaticContact CD1-NE2 3.94Å; W307-H393 AromaticContact NE1-CD2 3.92Å |
| 308 | A | 92.9 | Very high | 89.6 | Confident | 24 Ų | 24 | 30 Ų | 30 | 20% | 0.198 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.5 | -37.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | V278 A304 A305 A306 A312 | V278-A308 HydrophobicContact CG2-CB 4.23Å; A304-A308 WeakPolarHBondContact O-CB 3.46Å; A304-A308 PolarHBondContact O-N 3.07Å; A305-A308 PolarHBondContact O-N 2.89Å; A306-A308 VanDerWaalsContact C-N 3.35Å; A306-A308 PolarHBondContact O-N 3.29Å; A308-A312 VanDerWaalsContact O-CB 3.32Å; A308-A312 WeakPolarHBondContact O-CB 3.36Å; A308-A312 PolarHBondContact O-N 2.79Å |
| 309 | G | 93.2 | Very high | 90.8 | Very high | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -59.6 | -50.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | A271 A305 A306 W307 A312 A313 | A271-G309 WeakPolarHBondContact CA-O 3.48Å; A305-G309 PolarHBondContact O-N 3.32Å; A306-G309 PolarHBondContact O-N 2.95Å; W307-G309 VanDerWaalsContact C-N 3.33Å; W307-G309 PolarHBondContact O-N 2.78Å; G309-A312 PolarHBondContact O-N 3.01Å; G309-A313 WeakPolarHBondContact O-CB 3.17Å; G309-A313 PolarHBondContact O-N 3.27Å |
| 310 | S | 91.6 | Very high | 91.7 | Very high | 9 Ų | 9 | 24.9 Ų | 24.9 | 6% | 0.063 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.4 | -43.4 | 178.7 | -63.2 | 0 | 0 | 0 | 0 | 112.1 | Q39 A306 W307 A312 A313 D314 Y390 | Q39-S310 PolarHBondContact O-OG 3.27Å; A306-S310 PolarHBondContact O-N 3.29Å; A306-S310 PolarHBondContact O-OG 2.82Å; W307-S310 PolarHBondContact O-N 2.87Å; S310-A312 PolarHBondContact O-N 2.97Å; S310-A313 PolarHBondContact O-N 3.22Å; S310-D314 PolarHBondContact O-N 2.9Å; S310-Y390 VanDerWaalsContact CB-OH 3.3Å; S310-Y390 WeakPolarHBondContact CB-OH 3.38Å; S310-Y390 PolarHBondContact O-OH 3.23Å |
| 311 | L | 94 | Very high | 92.3 | Very high | 39 Ų | 39 | 25.1 Ų | 25.1 | 20% | 0.204 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -57.8 | -48.4 | 174.3 | 174.9 | 60.1 | 0 | 0 | 0 | 111.6 | W307 A313 D314 V315 Y390 | W307-L311 HydrophobicContact CH2-CD2 3.76Å; W307-L311 HydrophobicContact CZ2-CD2 4.09Å; W307-L311 HydrophobicContact CZ3-CD2 4.21Å; W307-L311 WeakPolarHBondContact O-CB 3.41Å; W307-L311 PolarHBondContact O-N 3.21Å; L311-A313 VanDerWaalsContact C-N 3.34Å; L311-A313 PolarHBondContact O-N 3.09Å; L311-D314 PolarHBondContact O-N 2.78Å; L311-V315 HydrophobicContact CD1-CG2 3.91Å; L311-V315 HydrophobicContact CG-CG2 4.44Å; L311-V315 WeakPolarHBondContact O-CB 3.43Å; L311-V315 VanDerWaalsContact O-CG2 3.23Å; L311-V315 WeakPolarHBondContact O-CG2 3.47Å; L311-V315 PolarHBondContact O-N 3.29Å; L311-Y390 HydrophobicContact CB-CD1 3.71Å; L311-Y390 HydrophobicContact CB-CE1 3.74Å; L311-Y390 HydrophobicContact CB-CG 4.25Å; L311-Y390 HydrophobicContact CD1-CD1 4.03Å; L311-Y390 HydrophobicContact CD1-CD2 3.85Å; L311-Y390 HydrophobicContact CD1-CE2 4.38Å; L311-Y390 HydrophobicContact CD1-CG 3.65Å; L311-Y390 HydrophobicContact CG-CD1 4.34Å; L311-Y390 HydrophobicContact CG-CG 4.44Å |
| 312 | A | 95.9 | Very high | 92.7 | Very high | 27 Ų | 27 | 24.3 Ų | 24.3 | 22% | 0.223 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.3 | -41.3 | -180 | 0 | 0 | 0 | 0 | 0 | 111.9 | V274 A308 G309 S310 V315 L316 | V274-A312 HydrophobicContact CB-CB 4.31Å; V274-A312 HydrophobicContact CG1-CB 3.95Å; V274-A312 HydrophobicContact CG2-CB 3.88Å; A308-A312 VanDerWaalsContact O-CB 3.32Å; A308-A312 WeakPolarHBondContact O-CB 3.36Å; A308-A312 PolarHBondContact O-N 2.79Å; G309-A312 PolarHBondContact O-N 3.01Å; S310-A312 PolarHBondContact O-N 2.97Å; A312-V315 PolarHBondContact O-N 3.24Å; A312-L316 WeakPolarHBondContact O-CB 3.44Å; A312-L316 VanDerWaalsContact O-CG 3.26Å; A312-L316 WeakPolarHBondContact O-CG 3.45Å; A312-L316 PolarHBondContact O-N 2.66Å |
| 313 | A | 94.5 | Very high | 93.2 | Very high | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.1 | -44.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | R267 V270 A271 G309 S310 L311 L317 | R267-A313 HydrophobicContact CG-CB 4Å; V270-A313 HydrophobicContact CB-CB 4.13Å; V270-A313 HydrophobicContact CG1-CB 3.94Å; A271-A313 HydrophobicContact CB-CB 3.91Å; G309-A313 WeakPolarHBondContact O-CB 3.17Å; G309-A313 PolarHBondContact O-N 3.27Å; S310-A313 PolarHBondContact O-N 3.22Å; L311-A313 VanDerWaalsContact C-N 3.34Å; L311-A313 PolarHBondContact O-N 3.09Å; A313-L317 VanDerWaalsContact O-CB 3.32Å; A313-L317 WeakPolarHBondContact O-CB 3.29Å; A313-L317 WeakPolarHBondContact O-CG 3.44Å; A313-L317 PolarHBondContact O-N 3.11Å |
| 314 | D | 94.4 | Very high | 93.7 | Very high | 1 Ų | 1 | 21.5 Ų | 21.5 | 1% | 0.005 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61.7 | -45.9 | 175.1 | -86.1 | -50.1 | 0 | 0 | 0 | 112.4 | Q42 R267 S310 L311 L316 L317 F318 L386 Y390 | Q42-D314 PolarHBondContact OE1-OD2 2.82Å; R267-D314 IonicContact CZ-OD1 3.26Å; R267-D314 VanDerWaalsContact CZ-OD1 3.32Å; R267-D314 IonicContact CZ-OD2 3.76Å; R267-D314 VanDerWaalsContact NH1-CG 3.26Å; R267-D314 IonicContact NH1-OD1 2.72Å; R267-D314 PolarHBondContact NH1-OD1 3.39Å; R267-D314 IonicContact NH1-OD2 2.61Å; R267-D314 VanDerWaalsContact NH2-CG 3.25Å; R267-D314 IonicContact NH2-OD1 2.79Å; R267-D314 PolarHBondContact NH2-OD1 3.46Å; R267-D314 VanDerWaalsContact NH2-OD1 3.16Å; R267-D314 IonicContact NH2-OD2 3.26Å; R267-D314 PolarHBondContact NH2-OD2 3.27Å; S310-D314 PolarHBondContact O-N 2.9Å; L311-D314 PolarHBondContact O-N 2.78Å; D314-L316 PolarHBondContact O-N 3.49Å; D314-L317 PolarHBondContact O-N 3.43Å; D314-F318 WeakPolarHBondContact O-CA 3.3Å; D314-F318 VanDerWaalsContact O-CB 3.31Å; D314-F318 WeakPolarHBondContact O-CB 3.28Å; D314-F318 PolarHBondContact O-N 3.33Å; D314-L386 HydrophobicContact CB-CD1 3.82Å; D314-L386 HydrophobicContact CB-CD2 4.15Å; D314-Y390 HydrophobicContact CB-CE2 4.25Å; D314-Y390 VanDerWaalsContact OD2-CE2 3.32Å; D314-Y390 WeakPolarHBondContact OD2-CE2 3.36Å; D314-Y390 VanDerWaalsContact OD2-CZ 3.28Å; D314-Y390 PolarHBondContact OD2-OH 3.11Å |
| 315 | V | 95.9 | Very high | 93.9 | Very high | 44 Ų | 44 | 19.7 Ų | 19.7 | 27% | 0.267 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -64 | -44.2 | -179.4 | 170.6 | 0 | 0 | 0 | 0 | 111.4 | L311 A312 F383 L386 | L311-V315 HydrophobicContact CD1-CG2 3.91Å; L311-V315 HydrophobicContact CG-CG2 4.44Å; L311-V315 WeakPolarHBondContact O-CB 3.43Å; L311-V315 VanDerWaalsContact O-CG2 3.23Å; L311-V315 WeakPolarHBondContact O-CG2 3.47Å; L311-V315 PolarHBondContact O-N 3.29Å; A312-V315 PolarHBondContact O-N 3.24Å; V315-F383 HydrophobicContact CB-CE2 4.4Å; V315-F383 HydrophobicContact CG1-CE2 4.21Å; V315-F383 HydrophobicContact CG1-CZ 4.21Å; V315-F383 HydrophobicContact CG2-CE2 3.92Å; V315-F383 HydrophobicContact CG2-CZ 3.94Å; V315-L386 HydrophobicContact CG2-CD2 3.95Å |
| 316 | L | 96 | Very high | 94.1 | Very high | 110 Ų | 110 | 19.8 Ų | 19.8 | 58% | 0.576 | 11% | 0.11 | S | C | * | . | H | α-helix | trans | -71.3 | -35 | -178.3 | -71.5 | 171.5 | 0 | 0 | 0 | 112.3 | V270 A312 D314 | V270-L316 HydrophobicContact CG1-CD1 3.67Å; A312-L316 WeakPolarHBondContact O-CB 3.44Å; A312-L316 VanDerWaalsContact O-CG 3.26Å; A312-L316 WeakPolarHBondContact O-CG 3.45Å; A312-L316 PolarHBondContact O-N 2.66Å; D314-L316 PolarHBondContact O-N 3.49Å |
| 317 | L | 95.6 | Very high | 94.2 | Very high | 13 Ų | 13 | 19.9 Ų | 19.9 | 7% | 0.068 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -99.2 | 3.3 | -177.6 | -59.6 | -178.4 | 0 | 0 | 0 | 114.9 | L266 R267 A313 D314 P319 L320 E321 | L266-L317 HydrophobicContact CB-CD1 4.06Å; L266-L317 HydrophobicContact CB-CD2 4.46Å; L266-L317 HydrophobicContact CD2-CD1 4.4Å; L266-L317 HydrophobicContact CD2-CD2 3.32Å; L266-L317 HydrophobicContact CD2-CG 4.49Å; L266-L317 HydrophobicContact CG-CD1 3.95Å; L266-L317 HydrophobicContact CG-CD2 3.67Å; L266-L317 HydrophobicContact CG-CG 4.4Å; R267-L317 HydrophobicContact CB-CD1 3.63Å; R267-L317 HydrophobicContact CG-CD1 4.42Å; A313-L317 VanDerWaalsContact O-CB 3.32Å; A313-L317 WeakPolarHBondContact O-CB 3.29Å; A313-L317 WeakPolarHBondContact O-CG 3.44Å; A313-L317 PolarHBondContact O-N 3.11Å; D314-L317 PolarHBondContact O-N 3.43Å; L317-P319 VanDerWaalsContact C-CD 3.41Å; L317-P319 VanDerWaalsContact C-N 3.32Å; L317-L320 WeakPolarHBondContact O-CB 3.1Å; L317-L320 PolarHBondContact O-N 3.13Å; L317-E321 PolarHBondContact O-N 2.67Å |
| 318 | F | 95.8 | Very high | 94.2 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -50.6 | -43.5 | 175.9 | -157.9 | -79.3 | 0 | 0 | 0 | 113.8 | R114 Q118 D314 L320 E321 T322 F379 Y380 R381 F383 L386 | R114-F318 HydrophobicContact CG-CE2 4.23Å; R114-F318 HydrophobicContact CG-CZ 4.12Å; Q118-F318 HydrophobicContact CG-CE1 4.14Å; Q118-F318 HydrophobicContact CG-CZ 4.21Å; Q118-F318 VanDerWaalsContact NE2-CZ 3.31Å; D314-F318 WeakPolarHBondContact O-CA 3.3Å; D314-F318 VanDerWaalsContact O-CB 3.31Å; D314-F318 WeakPolarHBondContact O-CB 3.28Å; D314-F318 PolarHBondContact O-N 3.33Å; F318-L320 VanDerWaalsContact C-N 3.31Å; F318-L320 PolarHBondContact O-N 2.96Å; F318-E321 PolarHBondContact O-N 2.98Å; F318-T322 WeakPolarHBondContact CE1-OG1 3.37Å; F318-T322 WeakPolarHBondContact O-CB 3.47Å; F318-T322 PolarHBondContact O-N 3.32Å; F318-T322 PolarHBondContact O-OG1 3.48Å; F318-F379 WeakPolarHBondContact CD1-O 3.47Å; F318-F379 WeakPolarHBondContact CE1-O 3.1Å; F318-Y380 HydrophobicContact CB-CD1 4.08Å; F318-Y380 HydrophobicContact CB-CE1 3.89Å; F318-Y380 AromaticContact CD1-CD1 3.88Å; F318-Y380 HydrophobicContact CD1-CD1 3.88Å; F318-Y380 HydrophobicContact CD1-CE1 4.49Å; F318-Y380 HydrophobicContact CD1-CG 4.4Å; F318-Y380 HydrophobicContact CG-CD1 4.05Å; F318-Y380 HydrophobicContact CG-CE1 4.37Å; F318-R381 WeakPolarHBondContact CE1-O 3.4Å; F318-R381 VanDerWaalsContact CZ-O 3.3Å; F318-R381 WeakPolarHBondContact CZ-O 3.45Å; F318-F383 AromaticContact CD2-CD2 3.91Å; F318-F383 HydrophobicContact CD2-CD2 3.91Å; F318-F383 HydrophobicContact CD2-CE2 4.49Å; F318-F383 HydrophobicContact CE2-CB 4.45Å; F318-F383 AromaticContact CE2-CD2 3.95Å; F318-F383 HydrophobicContact CE2-CD2 3.95Å; F318-F383 HydrophobicContact CG-CD2 4.27Å; F318-F383 HydrophobicContact CZ-CB 4.26Å; F318-F383 HydrophobicContact CZ-CD2 4.43Å; F318-L386 HydrophobicContact CD2-CD2 3.89Å; F318-L386 HydrophobicContact CE2-CB 4.15Å; F318-L386 HydrophobicContact CE2-CD2 4.14Å |
| 319 | P | 95.8 | Very high | 94 | Very high | 27 Ų | 27 | 16 Ų | 16 | 18% | 0.175 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63 | -38.1 | 178 | -24.7 | 37.3 | 0 | 0 | 0 | 112.8 | L317 A323 F379 Y380 | L317-P319 VanDerWaalsContact C-CD 3.41Å; L317-P319 VanDerWaalsContact C-N 3.32Å; P319-A323 PolarHBondContact O-N 3.47Å; P319-A323 VanDerWaalsContact O-N 3.16Å; P319-F379 HydrophobicContact CB-CB 3.92Å; P319-F379 HydrophobicContact CB-CD1 3.71Å; P319-F379 HydrophobicContact CB-CG 4.04Å; P319-F379 HydrophobicContact CG-CB 4.18Å; P319-Y380 HydrophobicContact CG-CE1 4.33Å; P319-Y380 HydrophobicContact CG-CE2 4.04Å |
| 320 | L | 94.9 | Very high | 93.7 | Very high | 33 Ų | 33 | 16.3 Ų | 16.3 | 17% | 0.173 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -72.1 | -43.3 | 179.3 | -178.8 | 57.8 | 0 | 0 | 0 | 110.8 | H263 L317 F318 T322 A323 L324 L363 | H263-L320 HydrophobicContact CB-CD2 3.76Å; H263-L320 HydrophobicContact CB-CG 4.21Å; L317-L320 WeakPolarHBondContact O-CB 3.1Å; L317-L320 PolarHBondContact O-N 3.13Å; F318-L320 VanDerWaalsContact C-N 3.31Å; F318-L320 PolarHBondContact O-N 2.96Å; L320-T322 VanDerWaalsContact C-N 3.32Å; L320-T322 PolarHBondContact O-N 3.39Å; L320-A323 PolarHBondContact O-N 2.89Å; L320-L324 HydrophobicContact CD1-CG 4.43Å; L320-L324 HydrophobicContact CG-CD1 4.28Å; L320-L324 VanDerWaalsContact O-CG 3.31Å; L320-L324 WeakPolarHBondContact O-CG 3.32Å; L320-L324 PolarHBondContact O-N 3.3Å; L320-L363 HydrophobicContact CD1-CD1 3.88Å; L320-L363 HydrophobicContact CD1-CD2 3.75Å; L320-L363 HydrophobicContact CD1-CG 4.4Å |
| 321 | E | 94.6 | Very high | 93.2 | Very high | 9 Ų | 9 | 16.7 Ų | 16.7 | 4% | 0.042 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -55.9 | -47 | 173.1 | -177.9 | -175.7 | 170.9 | 0 | 0 | 110.9 | R114 L317 F318 A323 L324 H325 | R114-E321 IonicContact CZ-OE1 3.72Å; R114-E321 IonicContact NE-OE1 3.53Å; R114-E321 PolarHBondContact NE-OE1 2.94Å; R114-E321 IonicContact NH2-OE1 3.25Å; R114-E321 PolarHBondContact NH2-OE1 2.94Å; R114-E321 IonicContact NH2-OE2 3.75Å; L317-E321 PolarHBondContact O-N 2.67Å; F318-E321 PolarHBondContact O-N 2.98Å; E321-A323 PolarHBondContact O-N 3.28Å; E321-L324 PolarHBondContact O-N 3.44Å; E321-H325 WeakPolarHBondContact CG-CE1 3.41Å; E321-H325 VanDerWaalsContact CG-NE2 3.34Å; E321-H325 WeakPolarHBondContact CG-NE2 3.48Å; E321-H325 PolarHBondContact O-CD2 2.98Å; E321-H325 VanDerWaalsContact O-CG 3.29Å; E321-H325 PolarHBondContact O-N 3.1Å; E321-H325 IonicContact OE1-CE1 2.73Å; E321-H325 PolarHBondContact OE1-CE1 3.13Å; E321-H325 VanDerWaalsContact OE1-CE1 3.26Å; E321-H325 IonicContact OE1-NE2 3.22Å |
| 322 | T | 94.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -59.6 | -44.2 | 178.6 | -60.2 | 0 | 0 | 0 | 0 | 112.2 | Q118 F318 L320 H325 R326 F379 | Q118-T322 HydrophobicContact CB-CG2 4.07Å; Q118-T322 HydrophobicContact CG-CG2 4.25Å; Q118-T322 PolarHBondContact NE2-OG1 2.96Å; F318-T322 WeakPolarHBondContact CE1-OG1 3.37Å; F318-T322 WeakPolarHBondContact O-CB 3.47Å; F318-T322 PolarHBondContact O-N 3.32Å; F318-T322 PolarHBondContact O-OG1 3.48Å; L320-T322 VanDerWaalsContact C-N 3.32Å; L320-T322 PolarHBondContact O-N 3.39Å; T322-H325 PolarHBondContact O-N 3.38Å; T322-R326 WeakPolarHBondContact O-CG 3.44Å; T322-R326 PolarHBondContact O-N 2.99Å; T322-F379 PolarHBondContact OG1-O 3.38Å; T322-F379 VanDerWaalsContact OG1-O 3.07Å |
| 323 | A | 94.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -66.4 | -41.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | P319 L320 E321 R326 L327 L363 L367 I370 | P319-A323 PolarHBondContact O-N 3.47Å; P319-A323 VanDerWaalsContact O-N 3.16Å; L320-A323 PolarHBondContact O-N 2.89Å; E321-A323 PolarHBondContact O-N 3.28Å; A323-R326 PolarHBondContact O-N 3.43Å; A323-L327 VanDerWaalsContact O-CG 3.3Å; A323-L327 WeakPolarHBondContact O-CG 3.4Å; A323-L327 PolarHBondContact O-N 3.39Å; A323-L363 HydrophobicContact CB-CD1 3.67Å; A323-L367 HydrophobicContact CB-CD2 3.67Å; A323-L367 HydrophobicContact CB-CG 4.23Å; A323-I370 HydrophobicContact CB-CD1 4.4Å |
| 324 | L | 94.1 | Very high | 91.6 | Very high | 8 Ų | 8 | 25.1 Ų | 25.1 | 4% | 0.042 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.3 | -44.7 | 176.1 | -72.1 | 175.4 | 0 | 0 | 0 | 111.7 | L256 P259 V260 H263 L320 E321 R326 L327 S328 | L256-L324 HydrophobicContact CD2-CD2 4.37Å; P259-L324 HydrophobicContact CB-CD2 3.57Å; V260-L324 HydrophobicContact CG2-CD1 4.48Å; V260-L324 HydrophobicContact CG2-CD2 4.01Å; H263-L324 HydrophobicContact CB-CD1 3.6Å; L320-L324 HydrophobicContact CD1-CG 4.43Å; L320-L324 HydrophobicContact CG-CD1 4.28Å; L320-L324 VanDerWaalsContact O-CG 3.31Å; L320-L324 WeakPolarHBondContact O-CG 3.32Å; L320-L324 PolarHBondContact O-N 3.3Å; E321-L324 PolarHBondContact O-N 3.44Å; L324-R326 VanDerWaalsContact C-N 3.3Å; L324-R326 PolarHBondContact O-N 3.32Å; L324-L327 PolarHBondContact O-N 3.49Å; L324-S328 WeakPolarHBondContact O-CB 3.43Å; L324-S328 PolarHBondContact O-N 3.17Å; L324-S328 PolarHBondContact O-OG 2.85Å |
| 325 | H | 93.9 | Very high | 91.3 | Very high | 2 Ų | 2 | 27.4 Ų | 27.4 | 1% | 0.009 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -59.5 | -42.3 | 178.1 | -67.6 | 175.2 | 0 | 0 | 0 | 112.3 | Q118 V119 Y207 L211 E321 T322 S328 L329 | Q118-H325 PolarHBondContact OE1-CE1 3.19Å; Q118-H325 PolarHBondContact OE1-ND1 3.45Å; V119-H325 HydrophobicContact CG1-CB 3.7Å; Y207-H325 AromaticContact CZ-NE2 3.97Å; Y207-H325 PolarHBondContact OH-CD2 2.94Å; Y207-H325 PolarHBondContact OH-NE2 3.14Å; L211-H325 HydrophobicContact CD2-CB 4.18Å; E321-H325 WeakPolarHBondContact CG-CE1 3.41Å; E321-H325 VanDerWaalsContact CG-NE2 3.34Å; E321-H325 WeakPolarHBondContact CG-NE2 3.48Å; E321-H325 PolarHBondContact O-CD2 2.98Å; E321-H325 VanDerWaalsContact O-CG 3.29Å; E321-H325 PolarHBondContact O-N 3.1Å; E321-H325 IonicContact OE1-CE1 2.73Å; E321-H325 PolarHBondContact OE1-CE1 3.13Å; E321-H325 VanDerWaalsContact OE1-CE1 3.26Å; E321-H325 IonicContact OE1-NE2 3.22Å; T322-H325 PolarHBondContact O-N 3.38Å; H325-S328 PolarHBondContact O-N 3.38Å; H325-L329 WeakPolarHBondContact O-CG 3.45Å; H325-L329 PolarHBondContact O-N 3.36Å; H325-L329 VanDerWaalsContact O-N 3.11Å |
| 326 | R | 93.3 | Very high | 90.9 | Very high | 1 Ų | 1 | 25.5 Ų | 25.5 | 0% | 0.004 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65.9 | -41.5 | 178.4 | -72.7 | 174.8 | 174.5 | -145.7 | 5.6 | 112.4 | Q118 T322 A323 L324 Q330 Y360 E374 | Q118-R326 PolarHBondContact O-NE 3.43Å; Q118-R326 PolarHBondContact O-NH2 3.11Å; T322-R326 WeakPolarHBondContact O-CG 3.44Å; T322-R326 PolarHBondContact O-N 2.99Å; A323-R326 PolarHBondContact O-N 3.43Å; L324-R326 VanDerWaalsContact C-N 3.3Å; L324-R326 PolarHBondContact O-N 3.32Å; R326-Q330 PolarHBondContact O-N 3.19Å; R326-Q330 VanDerWaalsContact O-N 3.13Å; R326-Y360 HydrophobicContact CB-CE2 3.94Å; R326-Y360 PolarHBondContact NH1-OH 2.79Å; R326-E374 IonicContact CZ-OE1 3.32Å; R326-E374 IonicContact CZ-OE2 3.38Å; R326-E374 IonicContact NH1-OE1 3.16Å; R326-E374 PolarHBondContact NH1-OE1 3.42Å; R326-E374 IonicContact NH1-OE2 2.65Å; R326-E374 IonicContact NH2-OE1 2.83Å; R326-E374 PolarHBondContact NH2-OE1 3.22Å; R326-E374 IonicContact NH2-OE2 3.65Å; R326-E374 PolarHBondContact NH2-OE2 3.22Å |
| 327 | L | 91.7 | Very high | 90.5 | Very high | 4 Ų | 4 | 20.3 Ų | 20.3 | 2% | 0.021 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -68.4 | -39.4 | 176.2 | -66.9 | 164.7 | 0 | 0 | 0 | 111.9 | L251 L256 A323 L324 L329 Q330 Y360 L363 C366 | L251-L327 HydrophobicContact CD2-CD2 4.42Å; L256-L327 HydrophobicContact CD2-CB 3.69Å; L256-L327 HydrophobicContact CD2-CD1 4.21Å; A323-L327 VanDerWaalsContact O-CG 3.3Å; A323-L327 WeakPolarHBondContact O-CG 3.4Å; A323-L327 PolarHBondContact O-N 3.39Å; L324-L327 PolarHBondContact O-N 3.49Å; L327-L329 VanDerWaalsContact C-N 3.28Å; L327-L329 PolarHBondContact O-N 3.33Å; L327-Q330 WeakPolarHBondContact O-CB 3.2Å; L327-Q330 PolarHBondContact O-N 3.47Å; L327-Y360 HydrophobicContact CD2-CD2 4.03Å; L327-Y360 HydrophobicContact CD2-CG 4.27Å; L327-L363 HydrophobicContact CD1-CB 4.17Å; L327-L363 HydrophobicContact CD1-CD1 3.92Å; L327-C366 HydrophobicContact CD1-CB 4.32Å; L327-C366 HydrophobicContact CD2-CB 4.11Å; L327-C366 HydrophobicContact CG-CB 4.22Å |
| 328 | S | 89.5 | Confident | 90 | Very high | 8 Ų | 8 | 19.8 Ų | 19.8 | 6% | 0.056 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.2 | -27.9 | 178.3 | -67.2 | 0 | 0 | 0 | 0 | 113.5 | L324 H325 | L324-S328 WeakPolarHBondContact O-CB 3.43Å; L324-S328 PolarHBondContact O-N 3.17Å; L324-S328 PolarHBondContact O-OG 2.85Å; H325-S328 PolarHBondContact O-N 3.38Å |
| 329 | L | 88.9 | Confident | 89.6 | Confident | 0 Ų | 0 | 19.9 Ų | 19.9 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -92 | -15.2 | 176.6 | -70.5 | 177.8 | 0 | 0 | 0 | 114.1 | V119 L211 I212 V215 H325 L327 G331 T332 T334 V356 | V119-L329 HydrophobicContact CB-CD1 3.62Å; V119-L329 HydrophobicContact CG1-CD1 3.39Å; V119-L329 HydrophobicContact CG2-CD1 3.77Å; L211-L329 HydrophobicContact CD2-CD2 4.28Å; L211-L329 HydrophobicContact CD2-CG 3.96Å; L211-L329 HydrophobicContact CG-CD2 4.12Å; L211-L329 HydrophobicContact CG-CG 4.21Å; I212-L329 HydrophobicContact CB-CD2 4.26Å; I212-L329 HydrophobicContact CD1-CD2 4.49Å; I212-L329 HydrophobicContact CG1-CD2 3.34Å; V215-L329 HydrophobicContact CG1-CD1 4.4Å; V215-L329 HydrophobicContact CG2-CD1 3.71Å; V215-L329 HydrophobicContact CG2-CD2 3.85Å; V215-L329 HydrophobicContact CG2-CG 4.46Å; H325-L329 WeakPolarHBondContact O-CG 3.45Å; H325-L329 PolarHBondContact O-N 3.36Å; H325-L329 VanDerWaalsContact O-N 3.11Å; L327-L329 VanDerWaalsContact C-N 3.28Å; L327-L329 PolarHBondContact O-N 3.33Å; L329-G331 PolarHBondContact O-N 3.31Å; L329-T332 WeakPolarHBondContact O-CB 3.11Å; L329-T332 WeakPolarHBondContact O-CG2 3.17Å; L329-T332 PolarHBondContact O-N 2.92Å; L329-T332 PolarHBondContact O-OG1 3.36Å; L329-T334 HydrophobicContact CD2-CG2 4.34Å; L329-V356 HydrophobicContact CB-CG1 4.43Å |
| 330 | Q | 88.6 | Confident | 88.9 | Confident | 8 Ų | 8 | 19.2 Ų | 19.2 | 4% | 0.037 | 9% | 0.092 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | 130.9 | -176.7 | 168.7 | 172 | -38.9 | 0 | 0 | 111.5 | R249 R326 L327 T332 T358 Y360 | R249-Q330 VanDerWaalsContact O-CG 3.25Å; R249-Q330 WeakPolarHBondContact O-CG 3.43Å; R249-Q330 PolarHBondContact O-NE2 2.77Å; R326-Q330 PolarHBondContact O-N 3.19Å; R326-Q330 VanDerWaalsContact O-N 3.13Å; L327-Q330 WeakPolarHBondContact O-CB 3.2Å; L327-Q330 PolarHBondContact O-N 3.47Å; Q330-T332 VanDerWaalsContact C-N 3.29Å; Q330-T332 PolarHBondContact O-N 3.45Å; Q330-T358 WeakPolarHBondContact CG-O 3.48Å; Q330-Y360 PolarHBondContact NE2-O 2.58Å |
| 331 | G | 79.5 | Confident | 87.5 | Confident | 17 Ų | 17 | 19 Ų | 19 | 18% | 0.175 | 10% | 0.098 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 80.5 | 0 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | L329 R333 | L329-G331 PolarHBondContact O-N 3.31Å; G331-R333 VanDerWaalsContact C-N 3.34Å; G331-R333 PolarHBondContact O-N 2.96Å |
| 332 | T | 81.3 | Confident | 85.9 | Confident | 33 Ų | 33 | 22.2 Ų | 22.2 | 20% | 0.202 | 13% | 0.127 | C | C | . | . | S | Bend | trans | -83.4 | -4.1 | -178.3 | 62.6 | 0 | 0 | 0 | 0 | 114.3 | I212 L250 L329 Q330 T334 | I212-T332 HydrophobicContact CD1-CG2 3.63Å; I212-T332 HydrophobicContact CG1-CG2 4.34Å; L250-T332 HydrophobicContact CD1-CG2 4.3Å; L329-T332 WeakPolarHBondContact O-CB 3.11Å; L329-T332 WeakPolarHBondContact O-CG2 3.17Å; L329-T332 PolarHBondContact O-N 2.92Å; L329-T332 PolarHBondContact O-OG1 3.36Å; Q330-T332 VanDerWaalsContact C-N 3.29Å; Q330-T332 PolarHBondContact O-N 3.45Å; T332-T334 PolarHBondContact O-N 2.97Å; T332-T334 VanDerWaalsContact OG1-CG2 3.25Å; T332-T334 WeakPolarHBondContact OG1-CG2 3.37Å; T332-T334 PolarHBondContact OG1-OG1 3.36Å |
| 333 | R | 81.9 | Confident | 84.3 | Confident | 205 Ų | 205 | 24.5 Ų | 24.5 | 77% | 0.774 | 14% | 0.137 | S | C | * | . | trans | 53.6 | 30.8 | -174.9 | -57.4 | -178.9 | 179.8 | 178.4 | -0.9 | 113.4 | G331 | G331-R333 VanDerWaalsContact C-N 3.34Å; G331-R333 PolarHBondContact O-N 2.96Å | ||
| 334 | T | 87.3 | Confident | 82.5 | Confident | 5 Ų | 5 | 24.7 Ų | 24.7 | 3% | 0.031 | 14% | 0.139 | C | C | . | . | trans | -68.2 | 139.8 | 178.8 | 36.5 | 0 | 0 | 0 | 0 | 111.7 | I212 L329 T332 V356 | I212-T334 HydrophobicContact CB-CG2 4.25Å; I212-T334 HydrophobicContact CG1-CG2 4.01Å; I212-T334 HydrophobicContact CG2-CG2 3.57Å; L329-T334 HydrophobicContact CD2-CG2 4.34Å; T332-T334 PolarHBondContact O-N 2.97Å; T332-T334 VanDerWaalsContact OG1-CG2 3.25Å; T332-T334 WeakPolarHBondContact OG1-CG2 3.37Å; T332-T334 PolarHBondContact OG1-OG1 3.36Å; T334-V356 PolarHBondContact O-N 2.79Å | ||
| 335 | I | 87.9 | Confident | 80.7 | Confident | 49 Ų | 49 | 27 Ų | 27 | 25% | 0.251 | 16% | 0.158 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 120.6 | 171.7 | -48.8 | -170.6 | 0 | 0 | 0 | 107.3 | Q216 S217 V220 V353 L354 | Q216-I335 CarbonylContact C-O 3.49Å; Q216-I335 WeakPolarHBondContact CA-O 3.22Å; S217-I335 PolarHBondContact N-O 3.04Å; V220-I335 HydrophobicContact CG1-CB 4.35Å; V220-I335 HydrophobicContact CG1-CD1 3.94Å; V220-I335 HydrophobicContact CG1-CG1 4.3Å; V220-I335 HydrophobicContact CG2-CB 4.15Å; V220-I335 HydrophobicContact CG2-CD1 4.19Å; V220-I335 HydrophobicContact CG2-CG2 4.15Å; I335-V353 HydrophobicContact CG2-CB 3.7Å; I335-V353 HydrophobicContact CG2-CG2 3.86Å; I335-L354 CarbonylContact C-O 3.6Å; I335-L354 WeakPolarHBondContact CA-O 3.43Å; I335-L354 WeakPolarHBondContact CG2-O 3.25Å |
| 336 | I | 89.6 | Confident | 78.9 | Confident | 3 Ų | 3 | 29.5 Ų | 29.5 | 2% | 0.015 | 19% | 0.185 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 164.1 | -176.8 | 59 | 164.6 | 0 | 0 | 0 | 110.9 | V119 N120 V215 V353 L354 V356 | V119-I336 HydrophobicContact CG2-CD1 4.27Å; V119-I336 HydrophobicContact CG2-CG2 4.06Å; N120-I336 HydrophobicContact CB-CD1 3.6Å; V215-I336 HydrophobicContact CB-CG2 3.97Å; V215-I336 HydrophobicContact CG2-CG2 4.07Å; I336-V353 CarbonylContact O-C 3.54Å; I336-V353 WeakPolarHBondContact O-CA 3.45Å; I336-L354 HydrophobicContact CG1-CB 4.19Å; I336-L354 WeakPolarHBondContact CG1-O 3.45Å; I336-L354 PolarHBondContact N-O 3.33Å; I336-L354 PolarHBondContact O-N 3.16Å; I336-V356 HydrophobicContact CB-CG2 4.46Å; I336-V356 HydrophobicContact CD1-CG2 4.35Å; I336-V356 HydrophobicContact CG1-CG2 4.17Å; I336-V356 HydrophobicContact CG2-CG2 3.55Å |
| 337 | D | 87 | Confident | 77 | Confident | 2 Ų | 2 | 34.2 Ų | 34.2 | 1% | 0.011 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 145.3 | 173 | -56.9 | -64 | 0 | 0 | 0 | 110.7 | Q116 Q144 K151 S217 T339 | Q116-D337 PolarHBondContact NE2-OD2 2.98Å; Q116-D337 VanDerWaalsContact OE1-N 3.12Å; Q144-D337 PolarHBondContact NE2-OD1 3.16Å; Q144-D337 PolarHBondContact OE1-OD1 3.24Å; K151-D337 IonicContact NZ-OD2 2.77Å; K151-D337 PolarHBondContact NZ-OD2 3.42Å; S217-D337 WeakPolarHBondContact CB-OD1 3.45Å; S217-D337 PolarHBondContact OG-OD1 2.83Å; D337-T339 PolarHBondContact O-N 2.86Å |
| 338 | A | 85.4 | Confident | 75 | Confident | 2 Ų | 2 | 36.7 Ų | 36.7 | 2% | 0.017 | 25% | 0.245 | C | C | . | . | P | Polyproline II helix | trans | -65.7 | 118.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | E343 L352 L354 | A338-E343 HydrophobicContact CB-CB 4Å; A338-L352 PolarHBondContact N-O 3.22Å; A338-L354 HydrophobicContact CB-CD1 4.16Å; A338-L354 HydrophobicContact CB-CG 4.39Å |
| 339 | T | 85.6 | Confident | 73.4 | Confident | 2 Ų | 2 | 40.9 Ų | 40.9 | 1% | 0.012 | 29% | 0.29 | C | S | . | . | trans | -92.1 | -1.3 | 179.2 | 60.9 | 0 | 0 | 0 | 0 | 112.8 | F113 Q116 N120 H127 D337 | F113-T339 HydrophobicContact CE2-CG2 4.27Å; Q116-T339 HydrophobicContact CB-CG2 3.89Å; N120-T339 PolarHBondContact ND2-OG1 2.7Å; H127-T339 PolarHBondContact CE1-O 3.01Å; H127-T339 PolarHBondContact NE2-O 3.02Å; D337-T339 PolarHBondContact O-N 2.86Å | ||
| 340 | D | 82.7 | Confident | 72 | Confident | 12 Ų | 12 | 43.7 Ų | 43.7 | 6% | 0.064 | 31% | 0.309 | C | S | . | . | S | Bend | trans | -78.6 | 126.8 | 178.9 | -77.7 | -17.3 | 0 | 0 | 0 | 110.1 | G123 R124 C125 A342 E343 A344 | G123-D340 WeakPolarHBondContact CA-OD2 3.28Å; R124-D340 PolarHBondContact N-OD1 3.2Å; R124-D340 VanDerWaalsContact N-OD1 3.1Å; R124-D340 PolarHBondContact N-OD2 2.96Å; C125-D340 WeakPolarHBondContact CB-OD1 3.36Å; C125-D340 PolarHBondContact N-OD1 2.93Å; D340-A342 VanDerWaalsContact C-N 3.26Å; D340-A342 PolarHBondContact O-N 3.19Å; D340-A342 VanDerWaalsContact O-N 3.1Å; D340-E343 HydrophobicContact CB-CB 4.34Å; D340-E343 HydrophobicContact CB-CG 4.1Å; D340-E343 CarbonylContact O-C 3.52Å; D340-E343 WeakPolarHBondContact O-CA 3.42Å; D340-E343 PolarHBondContact O-N 3.46Å; D340-A344 WeakPolarHBondContact O-CB 3.3Å; D340-A344 PolarHBondContact O-N 3.15Å |
| 341 | G | 64 | Low | 70.8 | Confident | 29 Ų | 29 | 46.8 Ų | 46.8 | 30% | 0.299 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60.6 | -27.1 | -166.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | A345 | G341-A345 WeakPolarHBondContact O-CB 3.39Å; G341-A345 PolarHBondContact O-N 3.36Å |
| 342 | A | 61.1 | Low | 70.6 | Confident | 77 Ų | 77 | 49.3 Ų | 49.3 | 64% | 0.636 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -75.7 | -34.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | D340 | D340-A342 VanDerWaalsContact C-N 3.26Å; D340-A342 PolarHBondContact O-N 3.19Å; D340-A342 VanDerWaalsContact O-N 3.1Å |
| 343 | E | 62.3 | Low | 70.6 | Confident | 48 Ų | 48 | 49.5 Ų | 49.5 | 22% | 0.224 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -78.8 | -40 | 179.4 | -56.4 | -172.1 | 156.8 | 0 | 0 | 111 | A338 D340 A345 G346 | A338-E343 HydrophobicContact CB-CB 4Å; D340-E343 HydrophobicContact CB-CB 4.34Å; D340-E343 HydrophobicContact CB-CG 4.1Å; D340-E343 CarbonylContact O-C 3.52Å; D340-E343 WeakPolarHBondContact O-CA 3.42Å; D340-E343 PolarHBondContact O-N 3.46Å; E343-A345 PolarHBondContact O-N 2.89Å; E343-G346 PolarHBondContact O-N 2.84Å |
| 344 | A | 56.5 | Low | 70.8 | Confident | 4 Ų | 4 | 40.8 Ų | 40.8 | 3% | 0.033 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.3 | -23.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | V136 A139 I140 D340 G346 | V136-A344 HydrophobicContact CG1-CB 3.94Å; A139-A344 HydrophobicContact CB-CB 4.32Å; I140-A344 HydrophobicContact CG1-CB 4.19Å; D340-A344 WeakPolarHBondContact O-CB 3.3Å; D340-A344 PolarHBondContact O-N 3.15Å; A344-G346 VanDerWaalsContact C-N 3.32Å |
| 345 | A | 56.5 | Low | 70.7 | Confident | 55 Ų | 55 | 44.3 Ų | 44.3 | 46% | 0.455 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.4 | 6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | G341 E343 S347 | G341-A345 WeakPolarHBondContact O-CB 3.39Å; G341-A345 PolarHBondContact O-N 3.36Å; E343-A345 PolarHBondContact O-N 2.89Å; A345-S347 PolarHBondContact O-N 3.24Å; A345-S347 PolarHBondContact O-OG 3.38Å |
| 346 | G | 56 | Low | 70.6 | Confident | 56 Ų | 56 | 42.9 Ų | 42.9 | 58% | 0.577 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.6 | 15.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | E343 A344 G348 | E343-G346 PolarHBondContact O-N 2.84Å; A344-G346 VanDerWaalsContact C-N 3.32Å; G346-G348 VanDerWaalsContact C-N 3.32Å; G346-G348 PolarHBondContact O-N 2.88Å |
| 347 | S | 53.5 | Low | 70.1 | Confident | 100 Ų | 100 | 47.8 Ų | 47.8 | 70% | 0.699 | 35% | 0.351 | S | S | * | . | trans | -86.2 | 75.3 | -173.5 | -60.9 | 0 | 0 | 0 | 0 | 110.1 | A345 | A345-S347 PolarHBondContact O-N 3.24Å; A345-S347 PolarHBondContact O-OG 3.38Å | ||
| 348 | G | 50 | Low | 70 | Confident | 56 Ų | 56 | 48.1 Ų | 48.1 | 58% | 0.577 | 35% | 0.354 | S | S | * | . | S | Bend | trans | 97.9 | 109.7 | 166.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | G346 S350 | G346-G348 VanDerWaalsContact C-N 3.32Å; G346-G348 PolarHBondContact O-N 2.88Å; G348-S350 PolarHBondContact O-N 3.35Å |
| 349 | G | 55.7 | Low | 70 | Confident | 96 Ų | 96 | 53.4 Ų | 53.4 | 99% | 0.99 | 38% | 0.378 | S | S | * | . | S | Bend | trans | 59.1 | -16.3 | 155.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||
| 350 | S | 60.5 | Low | 70.2 | Confident | 59 Ų | 59 | 53.8 Ų | 53.8 | 41% | 0.413 | 38% | 0.379 | S | S | . | . | trans | -81.9 | 146 | -174 | -73.7 | 0 | 0 | 0 | 0 | 112.2 | G348 L352 | G348-S350 PolarHBondContact O-N 3.35Å; S350-L352 PolarHBondContact O-N 2.79Å | ||
| 351 | P | 63.1 | Low | 70.5 | Confident | 73 Ų | 73 | 59.5 Ų | 59.5 | 47% | 0.474 | 41% | 0.41 | S | S | . | . | trans | -68 | 126.8 | 179.9 | 28.4 | -33.8 | 0 | 0 | 0 | 110.8 | V353 L354 | P351-V353 PolarHBondContact O-N 3.2Å; P351-L354 HydrophobicContact CG-CD2 4.07Å | ||
| 352 | L | 74.3 | Confident | 71.7 | Confident | 69 Ų | 69 | 59 Ų | 59 | 36% | 0.361 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -67.9 | -13.2 | 174.8 | -69 | 170.2 | 0 | 0 | 0 | 113 | I219 A338 S350 | I219-L352 HydrophobicContact CD1-CB 4.47Å; A338-L352 PolarHBondContact N-O 3.22Å; S350-L352 PolarHBondContact O-N 2.79Å |
| 353 | V | 82.6 | Confident | 73.2 | Confident | 37 Ų | 37 | 57.3 Ų | 57.3 | 22% | 0.224 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137 | 146 | -173.7 | -58.2 | 0 | 0 | 0 | 0 | 110.6 | S217 I219 V220 I335 I336 P351 | S217-V353 VanDerWaalsContact OG-CG1 3.28Å; S217-V353 WeakPolarHBondContact OG-CG1 3.13Å; I219-V353 HydrophobicContact CB-CG1 4.46Å; I219-V353 HydrophobicContact CD1-CG1 4.07Å; V220-V353 HydrophobicContact CG2-CG2 4.47Å; I335-V353 HydrophobicContact CG2-CB 3.7Å; I335-V353 HydrophobicContact CG2-CG2 3.86Å; I336-V353 CarbonylContact O-C 3.54Å; I336-V353 WeakPolarHBondContact O-CA 3.45Å; P351-V353 PolarHBondContact O-N 3.2Å |
| 354 | L | 85.2 | Confident | 74.7 | Confident | 22 Ų | 22 | 58.8 Ų | 58.8 | 12% | 0.115 | 41% | 0.405 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134 | 135.6 | -173.5 | -62.7 | 169.2 | 0 | 0 | 0 | 110.4 | I335 I336 A338 P351 | I335-L354 CarbonylContact C-O 3.6Å; I335-L354 WeakPolarHBondContact CA-O 3.43Å; I335-L354 WeakPolarHBondContact CG2-O 3.25Å; I336-L354 HydrophobicContact CG1-CB 4.19Å; I336-L354 WeakPolarHBondContact CG1-O 3.45Å; I336-L354 PolarHBondContact N-O 3.33Å; I336-L354 PolarHBondContact O-N 3.16Å; A338-L354 HydrophobicContact CB-CD1 4.16Å; A338-L354 HydrophobicContact CB-CG 4.39Å; P351-L354 HydrophobicContact CG-CD2 4.07Å |
| 355 | P | 85.9 | Confident | 76.5 | Confident | 80 Ų | 80 | 61.5 Ų | 61.5 | 52% | 0.519 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.9 | 140.5 | 175.5 | 30.8 | -33.8 | 0 | 0 | 0 | 111.6 | N357 | P355-N357 PolarHBondContact O-N 3.38Å |
| 356 | V | 84.5 | Confident | 78.3 | Confident | 18 Ų | 18 | 58.9 Ų | 58.9 | 11% | 0.109 | 40% | 0.397 | C | S | . | . | trans | -79.7 | 101.2 | 171.4 | -177.7 | 0 | 0 | 0 | 0 | 108.8 | L329 T334 I336 | L329-V356 HydrophobicContact CB-CG1 4.43Å; T334-V356 PolarHBondContact O-N 2.79Å; I336-V356 HydrophobicContact CB-CG2 4.46Å; I336-V356 HydrophobicContact CD1-CG2 4.35Å; I336-V356 HydrophobicContact CG1-CG2 4.17Å; I336-V356 HydrophobicContact CG2-CG2 3.55Å | ||
| 357 | N | 80.6 | Confident | 80.1 | Confident | 106 Ų | 106 | 58.7 Ų | 58.7 | 57% | 0.567 | 38% | 0.382 | S | S | * | . | trans | -116.4 | 64.2 | 179.5 | -171.6 | 24.8 | 0 | 0 | 0 | 111.5 | R249 P355 | R249-N357 PolarHBondContact NH1-OD1 2.72Å; R249-N357 VanDerWaalsContact NH1-OD1 3.16Å; P355-N357 PolarHBondContact O-N 3.38Å | ||
| 358 | T | 83.3 | Confident | 82.2 | Confident | 10 Ų | 10 | 59.3 Ų | 59.3 | 6% | 0.061 | 37% | 0.374 | C | S | . | . | trans | -103.9 | 144.9 | 173.7 | 55 | 0 | 0 | 0 | 0 | 111.1 | Q330 Y360 | Q330-T358 WeakPolarHBondContact CG-O 3.48Å; T358-Y360 VanDerWaalsContact CB-CE2 3.44Å; T358-Y360 HydrophobicContact CG2-CE2 3.96Å; T358-Y360 WeakPolarHBondContact CG2-OH 3.42Å | ||
| 359 | Q | 87.1 | Confident | 84.3 | Confident | 112 Ų | 112 | 57.1 Ų | 57.1 | 52% | 0.523 | 35% | 0.35 | S | S | . | . | trans | -140.4 | 114.8 | 173.8 | -174.9 | 175.5 | -0.3 | 0 | 0 | 108.5 | ||||
| 360 | Y | 89.6 | Confident | 86.1 | Confident | 10 Ų | 10 | 52.5 Ų | 52.5 | 4% | 0.039 | 30% | 0.303 | C | S | . | . | trans | -127.5 | 147.1 | 176.9 | -51.2 | -70.1 | 0 | 0 | 0 | 109.2 | R326 L327 Q330 T358 D365 C366 A369 | R326-Y360 HydrophobicContact CB-CE2 3.94Å; R326-Y360 PolarHBondContact NH1-OH 2.79Å; L327-Y360 HydrophobicContact CD2-CD2 4.03Å; L327-Y360 HydrophobicContact CD2-CG 4.27Å; Q330-Y360 PolarHBondContact NE2-O 2.58Å; T358-Y360 VanDerWaalsContact CB-CE2 3.44Å; T358-Y360 HydrophobicContact CG2-CE2 3.96Å; T358-Y360 WeakPolarHBondContact CG2-OH 3.42Å; Y360-D365 VanDerWaalsContact CA-OD2 3.3Å; Y360-D365 WeakPolarHBondContact CA-OD2 3.4Å; Y360-C366 VanDerWaalsContact CD1-CA 3.5Å; Y360-C366 HydrophobicContact CD1-CB 3.91Å; Y360-C366 HydrophobicContact CD2-CB 4.08Å; Y360-C366 HydrophobicContact CE1-CB 4.36Å; Y360-C366 HydrophobicContact CG-CB 3.74Å; Y360-A369 HydrophobicContact CD1-CB 4.04Å; Y360-A369 HydrophobicContact CE1-CB 3.68Å | ||
| 361 | D | 87.5 | Confident | 87.7 | Confident | 133 Ų | 133 | 56.3 Ų | 56.3 | 71% | 0.711 | 31% | 0.308 | S | S | * | . | S | Bend | trans | -83.2 | -17.1 | 177 | -67.4 | -29.4 | 0 | 0 | 0 | 112.4 | D365 | D361-D365 HydrophobicContact CB-CB 4.38Å; D361-D365 PolarHBondContact N-OD2 2.99Å |
| 362 | G | 89.8 | Confident | 89.2 | Confident | 17 Ų | 17 | 60.5 Ų | 60.5 | 18% | 0.175 | 32% | 0.319 | C | S | . | . | S | Bend | trans | 172.3 | -169.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | D365 C366 | G362-D365 PolarHBondContact O-N 2.88Å; G362-C366 WeakPolarHBondContact O-CB 3.29Å; G362-C366 PolarHBondContact O-N 3.22Å |
| 363 | L | 92.6 | Very high | 90.1 | Very high | 43 Ų | 43 | 63.8 Ų | 63.8 | 23% | 0.225 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62 | -47.4 | -177.4 | -177.1 | 69.4 | 0 | 0 | 0 | 113.3 | P259 L320 A323 L327 D365 C366 L367 | P259-L363 HydrophobicContact CB-CD2 4.12Å; P259-L363 HydrophobicContact CG-CB 4.4Å; P259-L363 HydrophobicContact CG-CD2 4.33Å; L320-L363 HydrophobicContact CD1-CD1 3.88Å; L320-L363 HydrophobicContact CD1-CD2 3.75Å; L320-L363 HydrophobicContact CD1-CG 4.4Å; A323-L363 HydrophobicContact CB-CD1 3.67Å; L327-L363 HydrophobicContact CD1-CB 4.17Å; L327-L363 HydrophobicContact CD1-CD1 3.92Å; L363-D365 VanDerWaalsContact C-N 3.34Å; L363-D365 PolarHBondContact O-N 3.16Å; L363-C366 PolarHBondContact O-N 2.83Å; L363-L367 HydrophobicContact CD1-CD1 4.42Å; L363-L367 HydrophobicContact CD1-CG 4.38Å; L363-L367 HydrophobicContact CG-CD1 4.08Å; L363-L367 HydrophobicContact CG-CG 4.43Å; L363-L367 VanDerWaalsContact O-CG 3.31Å; L363-L367 WeakPolarHBondContact O-CG 3.49Å; L363-L367 PolarHBondContact O-N 2.8Å |
| 364 | A | 93.7 | Very high | 90.4 | Very high | 79 Ų | 79 | 62.8 Ų | 62.8 | 65% | 0.653 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -63 | -41.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L367 H368 | A364-L367 PolarHBondContact O-N 2.83Å; A364-H368 WeakPolarHBondContact O-CB 3.37Å; A364-H368 PolarHBondContact O-N 3.42Å |
| 365 | D | 94.6 | Very high | 90.7 | Very high | 60 Ų | 60 | 63.1 Ų | 63.1 | 32% | 0.321 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.9 | -43.2 | 175.1 | 178.2 | 47.7 | 0 | 0 | 0 | 111.5 | Y360 D361 G362 L363 L367 H368 A369 | Y360-D365 VanDerWaalsContact CA-OD2 3.3Å; Y360-D365 WeakPolarHBondContact CA-OD2 3.4Å; D361-D365 HydrophobicContact CB-CB 4.38Å; D361-D365 PolarHBondContact N-OD2 2.99Å; G362-D365 PolarHBondContact O-N 2.88Å; L363-D365 VanDerWaalsContact C-N 3.34Å; L363-D365 PolarHBondContact O-N 3.16Å; D365-L367 PolarHBondContact O-N 3.28Å; D365-H368 PolarHBondContact O-N 2.79Å; D365-A369 VanDerWaalsContact O-CB 3.24Å; D365-A369 WeakPolarHBondContact O-CB 3.26Å; D365-A369 PolarHBondContact O-N 3.11Å |
| 366 | C | 93.8 | Very high | 91 | Very high | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -58 | -48.9 | 174.7 | -171.6 | 0 | 0 | 0 | 0 | 112.2 | L327 Y360 G362 L363 H368 A369 I370 | L327-C366 HydrophobicContact CD1-CB 4.32Å; L327-C366 HydrophobicContact CD2-CB 4.11Å; L327-C366 HydrophobicContact CG-CB 4.22Å; Y360-C366 VanDerWaalsContact CD1-CA 3.5Å; Y360-C366 HydrophobicContact CD1-CB 3.91Å; Y360-C366 HydrophobicContact CD2-CB 4.08Å; Y360-C366 HydrophobicContact CE1-CB 4.36Å; Y360-C366 HydrophobicContact CG-CB 3.74Å; G362-C366 WeakPolarHBondContact O-CB 3.29Å; G362-C366 PolarHBondContact O-N 3.22Å; L363-C366 PolarHBondContact O-N 2.83Å; C366-H368 PolarHBondContact O-N 3.15Å; C366-A369 PolarHBondContact O-N 3.26Å; C366-I370 VanDerWaalsContact O-CG1 3.28Å; C366-I370 WeakPolarHBondContact O-CG1 3.23Å; C366-I370 PolarHBondContact O-N 3.16Å |
| 367 | L | 95.3 | Very high | 91.3 | Very high | 52 Ų | 52 | 63 Ų | 63 | 27% | 0.272 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.8 | -44 | 176.9 | -66.7 | 171.9 | 0 | 0 | 0 | 111.2 | A323 L363 A364 D365 I370 R371 F379 | A323-L367 HydrophobicContact CB-CD2 3.67Å; A323-L367 HydrophobicContact CB-CG 4.23Å; L363-L367 HydrophobicContact CD1-CD1 4.42Å; L363-L367 HydrophobicContact CD1-CG 4.38Å; L363-L367 HydrophobicContact CG-CD1 4.08Å; L363-L367 HydrophobicContact CG-CG 4.43Å; L363-L367 VanDerWaalsContact O-CG 3.31Å; L363-L367 WeakPolarHBondContact O-CG 3.49Å; L363-L367 PolarHBondContact O-N 2.8Å; A364-L367 PolarHBondContact O-N 2.83Å; D365-L367 PolarHBondContact O-N 3.28Å; L367-I370 PolarHBondContact O-N 2.92Å; L367-R371 PolarHBondContact O-N 2.88Å; L367-F379 HydrophobicContact CB-CE1 4.43Å; L367-F379 HydrophobicContact CD2-CD1 4.34Å; L367-F379 HydrophobicContact CD2-CE1 3.65Å; L367-F379 VanDerWaalsContact O-CZ 3.27Å; L367-F379 WeakPolarHBondContact O-CZ 3.38Å |
| 368 | H | 95.7 | Very high | 91.7 | Very high | 114 Ų | 114 | 57.9 Ų | 57.9 | 53% | 0.528 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.3 | -44.3 | 177.2 | -176.7 | 76.3 | 0 | 0 | 0 | 111.8 | A364 D365 C366 R371 K372 | A364-H368 WeakPolarHBondContact O-CB 3.37Å; A364-H368 PolarHBondContact O-N 3.42Å; D365-H368 PolarHBondContact O-N 2.79Å; C366-H368 PolarHBondContact O-N 3.15Å; H368-R371 PolarHBondContact O-N 2.95Å; H368-K372 VanDerWaalsContact O-CB 3.29Å; H368-K372 WeakPolarHBondContact O-CB 3.36Å; H368-K372 PolarHBondContact O-N 3.24Å |
| 369 | A | 94.4 | Very high | 92.2 | Very high | 9 Ų | 9 | 58 Ų | 58 | 7% | 0.074 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y360 D365 C366 K372 K373 | Y360-A369 HydrophobicContact CD1-CB 4.04Å; Y360-A369 HydrophobicContact CE1-CB 3.68Å; D365-A369 VanDerWaalsContact O-CB 3.24Å; D365-A369 WeakPolarHBondContact O-CB 3.26Å; D365-A369 PolarHBondContact O-N 3.11Å; C366-A369 PolarHBondContact O-N 3.26Å; A369-K372 PolarHBondContact O-N 3.34Å; A369-K373 VanDerWaalsContact O-CB 3.27Å; A369-K373 WeakPolarHBondContact O-CB 3.19Å; A369-K373 WeakPolarHBondContact O-CG 3.45Å; A369-K373 PolarHBondContact O-N 3.13Å |
| 370 | I | 93.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59 | -51.5 | 174.2 | -66.2 | 163.9 | 0 | 0 | 0 | 109.6 | A323 C366 L367 K372 E374 G375 F379 | A323-I370 HydrophobicContact CB-CD1 4.4Å; C366-I370 VanDerWaalsContact O-CG1 3.28Å; C366-I370 WeakPolarHBondContact O-CG1 3.23Å; C366-I370 PolarHBondContact O-N 3.16Å; L367-I370 PolarHBondContact O-N 2.92Å; I370-K372 VanDerWaalsContact C-N 3.31Å; I370-K372 PolarHBondContact O-N 3.36Å; I370-E374 CarbonylContact O-C 3.44Å; I370-E374 WeakPolarHBondContact O-CA 3.48Å; I370-E374 WeakPolarHBondContact O-CB 3.11Å; I370-E374 PolarHBondContact O-N 3.21Å; I370-G375 PolarHBondContact O-N 3.16Å; I370-G375 VanDerWaalsContact O-N 3.16Å; I370-F379 HydrophobicContact CB-CD1 4.29Å; I370-F379 HydrophobicContact CB-CE1 3.75Å; I370-F379 HydrophobicContact CB-CE2 4.25Å; I370-F379 HydrophobicContact CB-CZ 3.76Å; I370-F379 HydrophobicContact CD1-CD1 4.21Å; I370-F379 HydrophobicContact CD1-CE1 4Å; I370-F379 HydrophobicContact CG1-CE1 4.49Å; I370-F379 HydrophobicContact CG2-CD1 3.71Å; I370-F379 HydrophobicContact CG2-CD2 3.81Å; I370-F379 HydrophobicContact CG2-CE1 3.63Å; I370-F379 HydrophobicContact CG2-CE2 3.7Å; I370-F379 HydrophobicContact CG2-CG 3.82Å; I370-F379 HydrophobicContact CG2-CZ 3.66Å |
| 371 | R | 95.1 | Very high | 92.8 | Very high | 138 Ų | 138 | 56.1 Ų | 56.1 | 52% | 0.521 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58.8 | -42.4 | -179.1 | -177.7 | 60.4 | 61.1 | 167.3 | -8.8 | 112.3 | L367 H368 G375 A376 F379 | L367-R371 PolarHBondContact O-N 2.88Å; H368-R371 PolarHBondContact O-N 2.95Å; R371-G375 VanDerWaalsContact O-CA 3.26Å; R371-G375 WeakPolarHBondContact O-CA 3.18Å; R371-G375 PolarHBondContact O-N 3.2Å; R371-A376 VanDerWaalsContact NH1-CA 3.33Å; R371-F379 HydrophobicContact CB-CE2 3.86Å; R371-F379 HydrophobicContact CB-CZ 3.95Å; R371-F379 VanDerWaalsContact NE-CE2 3.29Å; R371-F379 VanDerWaalsContact NH2-CE2 3.34Å |
| 372 | K | 94.8 | Very high | 93.1 | Very high | 162 Ų | 162 | 49.8 Ų | 49.8 | 70% | 0.704 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -78.8 | -39.1 | -174.6 | -173.5 | 175.2 | -179.9 | 178.3 | 0 | 113.1 | H368 A369 I370 | H368-K372 VanDerWaalsContact O-CB 3.29Å; H368-K372 WeakPolarHBondContact O-CB 3.36Å; H368-K372 PolarHBondContact O-N 3.24Å; A369-K372 PolarHBondContact O-N 3.34Å; I370-K372 VanDerWaalsContact C-N 3.31Å; I370-K372 PolarHBondContact O-N 3.36Å |
| 373 | K | 91.5 | Very high | 93.4 | Very high | 137 Ų | 137 | 50.8 Ų | 50.8 | 60% | 0.596 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -94.7 | -31.2 | -173.7 | -60 | -176.9 | -176.4 | 176.8 | 0 | 113.4 | Y121 A369 | Y121-K373 HydrophobicContact CE2-CB 4.37Å; Y121-K373 HydrophobicContact CE2-CD 4.22Å; Y121-K373 WeakPolarHBondContact OH-CD 3.49Å; A369-K373 VanDerWaalsContact O-CB 3.27Å; A369-K373 WeakPolarHBondContact O-CB 3.19Å; A369-K373 WeakPolarHBondContact O-CG 3.45Å; A369-K373 PolarHBondContact O-N 3.13Å |
| 374 | E | 90.6 | Very high | 93.5 | Very high | 17 Ų | 17 | 48.7 Ų | 48.7 | 8% | 0.079 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -118.4 | -9.5 | -174.3 | -59.8 | 169.1 | -121.3 | 0 | 0 | 113 | Y121 Y126 R326 I370 R381 | Y121-E374 HydrophobicContact CD2-CG 4.49Å; Y121-E374 VanDerWaalsContact CD2-OE1 3.24Å; Y121-E374 WeakPolarHBondContact CD2-OE1 3.36Å; Y121-E374 HydrophobicContact CE2-CG 4.28Å; Y126-E374 PolarHBondContact OH-O 2.98Å; R326-E374 IonicContact CZ-OE1 3.32Å; R326-E374 IonicContact CZ-OE2 3.38Å; R326-E374 IonicContact NH1-OE1 3.16Å; R326-E374 PolarHBondContact NH1-OE1 3.42Å; R326-E374 IonicContact NH1-OE2 2.65Å; R326-E374 IonicContact NH2-OE1 2.83Å; R326-E374 PolarHBondContact NH2-OE1 3.22Å; R326-E374 IonicContact NH2-OE2 3.65Å; R326-E374 PolarHBondContact NH2-OE2 3.22Å; I370-E374 CarbonylContact O-C 3.44Å; I370-E374 WeakPolarHBondContact O-CA 3.48Å; I370-E374 WeakPolarHBondContact O-CB 3.11Å; I370-E374 PolarHBondContact O-N 3.21Å; E374-R381 IonicContact OE2-CZ 3.22Å; E374-R381 IonicContact OE2-NE 2.69Å; E374-R381 PolarHBondContact OE2-NE 3.25Å; E374-R381 IonicContact OE2-NH2 2.95Å; E374-R381 PolarHBondContact OE2-NH2 3.07Å |
| 375 | G | 91.3 | Very high | 93.6 | Very high | 28 Ų | 28 | 45 Ų | 45 | 29% | 0.289 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 75.4 | -171 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | I370 R371 A377 G378 | I370-G375 PolarHBondContact O-N 3.16Å; I370-G375 VanDerWaalsContact O-N 3.16Å; R371-G375 VanDerWaalsContact O-CA 3.26Å; R371-G375 WeakPolarHBondContact O-CA 3.18Å; R371-G375 PolarHBondContact O-N 3.2Å; G375-A377 VanDerWaalsContact C-N 3.34Å; G375-A377 PolarHBondContact O-N 2.99Å; G375-G378 PolarHBondContact O-N 3.17Å |
| 376 | A | 90.9 | Very high | 93.6 | Very high | 55 Ų | 55 | 42.1 Ų | 42.1 | 46% | 0.455 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -37.6 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | R371 G378 F379 | R371-A376 VanDerWaalsContact NH1-CA 3.33Å; A376-G378 VanDerWaalsContact C-N 3.28Å; A376-G378 PolarHBondContact O-N 3.21Å; A376-F379 WeakPolarHBondContact O-CD2 3.14Å; A376-F379 PolarHBondContact O-N 3.23Å |
| 377 | A | 90.5 | Very high | 93.7 | Very high | 40 Ų | 40 | 44.8 Ų | 44.8 | 33% | 0.331 | 22% | 0.223 | S | C | . | . | G | 310 helix | trans | -75.7 | -19.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y126 L128 G375 F379 Y380 | Y126-A377 HydrophobicContact CD2-CB 3.63Å; Y126-A377 HydrophobicContact CE2-CB 3.78Å; L128-A377 HydrophobicContact CD1-CB 4.48Å; G375-A377 VanDerWaalsContact C-N 3.34Å; G375-A377 PolarHBondContact O-N 2.99Å; A377-F379 PolarHBondContact O-N 3.32Å; A377-Y380 PolarHBondContact O-N 3.5Å |
| 378 | G | 90.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.216 | C | C | . | . | G | 310 helix | trans | -60.6 | -26.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | G375 A376 Y380 R381 | G375-G378 PolarHBondContact O-N 3.17Å; A376-G378 VanDerWaalsContact C-N 3.28Å; A376-G378 PolarHBondContact O-N 3.21Å; G378-Y380 PolarHBondContact O-N 3.41Å; G378-R381 WeakPolarHBondContact O-CG 3.42Å |
| 379 | F | 93.9 | Very high | 93.6 | Very high | 11 Ų | 11 | 38.1 Ų | 38.1 | 5% | 0.048 | 19% | 0.193 | C | C | . | . | G | 310 helix | trans | -67.8 | -24.8 | 173.2 | -69.6 | -77.6 | 0 | 0 | 0 | 113.3 | F318 P319 T322 L367 I370 R371 A376 A377 | F318-F379 WeakPolarHBondContact CD1-O 3.47Å; F318-F379 WeakPolarHBondContact CE1-O 3.1Å; P319-F379 HydrophobicContact CB-CB 3.92Å; P319-F379 HydrophobicContact CB-CD1 3.71Å; P319-F379 HydrophobicContact CB-CG 4.04Å; P319-F379 HydrophobicContact CG-CB 4.18Å; T322-F379 PolarHBondContact OG1-O 3.38Å; T322-F379 VanDerWaalsContact OG1-O 3.07Å; L367-F379 HydrophobicContact CB-CE1 4.43Å; L367-F379 HydrophobicContact CD2-CD1 4.34Å; L367-F379 HydrophobicContact CD2-CE1 3.65Å; L367-F379 VanDerWaalsContact O-CZ 3.27Å; L367-F379 WeakPolarHBondContact O-CZ 3.38Å; I370-F379 HydrophobicContact CB-CD1 4.29Å; I370-F379 HydrophobicContact CB-CE1 3.75Å; I370-F379 HydrophobicContact CB-CE2 4.25Å; I370-F379 HydrophobicContact CB-CZ 3.76Å; I370-F379 HydrophobicContact CD1-CD1 4.21Å; I370-F379 HydrophobicContact CD1-CE1 4Å; I370-F379 HydrophobicContact CG1-CE1 4.49Å; I370-F379 HydrophobicContact CG2-CD1 3.71Å; I370-F379 HydrophobicContact CG2-CD2 3.81Å; I370-F379 HydrophobicContact CG2-CE1 3.63Å; I370-F379 HydrophobicContact CG2-CE2 3.7Å; I370-F379 HydrophobicContact CG2-CG 3.82Å; I370-F379 HydrophobicContact CG2-CZ 3.66Å; R371-F379 HydrophobicContact CB-CE2 3.86Å; R371-F379 HydrophobicContact CB-CZ 3.95Å; R371-F379 VanDerWaalsContact NE-CE2 3.29Å; R371-F379 VanDerWaalsContact NH2-CE2 3.34Å; A376-F379 WeakPolarHBondContact O-CD2 3.14Å; A376-F379 PolarHBondContact O-N 3.23Å; A377-F379 PolarHBondContact O-N 3.32Å |
| 380 | Y | 95.1 | Very high | 93.6 | Very high | 78 Ų | 78 | 38.4 Ų | 38.4 | 31% | 0.306 | 19% | 0.192 | S | C | . | . | G | 310 helix | trans | -107.5 | 25.4 | -172.7 | -69.6 | -85.1 | 0 | 0 | 0 | 112.3 | L128 F318 P319 A377 G378 G382 F383 | L128-Y380 WeakPolarHBondContact CD2-O 3.33Å; F318-Y380 HydrophobicContact CB-CD1 4.08Å; F318-Y380 HydrophobicContact CB-CE1 3.89Å; F318-Y380 AromaticContact CD1-CD1 3.88Å; F318-Y380 HydrophobicContact CD1-CD1 3.88Å; F318-Y380 HydrophobicContact CD1-CE1 4.49Å; F318-Y380 HydrophobicContact CD1-CG 4.4Å; F318-Y380 HydrophobicContact CG-CD1 4.05Å; F318-Y380 HydrophobicContact CG-CE1 4.37Å; P319-Y380 HydrophobicContact CG-CE1 4.33Å; P319-Y380 HydrophobicContact CG-CE2 4.04Å; A377-Y380 PolarHBondContact O-N 3.5Å; G378-Y380 PolarHBondContact O-N 3.41Å; Y380-G382 PolarHBondContact O-N 2.77Å; Y380-F383 AromaticContact CD1-CD2 3.72Å; Y380-F383 HydrophobicContact CD1-CD2 3.72Å; Y380-F383 HydrophobicContact CD1-CE2 4.08Å; Y380-F383 HydrophobicContact CD1-CG 4.3Å; Y380-F383 HydrophobicContact CE1-CD2 4.43Å; Y380-F383 HydrophobicContact CE1-CE2 4.37Å; Y380-F383 WeakPolarHBondContact O-CB 3.37Å; Y380-F383 PolarHBondContact O-N 3.26Å |
| 381 | R | 93.8 | Very high | 93.6 | Very high | 6 Ų | 6 | 41.9 Ų | 41.9 | 2% | 0.023 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | 129.8 | 176.2 | -73.7 | 173.3 | -179.6 | -93 | 9.2 | 111.1 | C117 Q118 N120 G123 Y126 F318 E374 G378 F383 | C117-R381 HydrophobicContact CB-CB 4.37Å; C117-R381 WeakPolarHBondContact O-CB 3.39Å; C117-R381 WeakPolarHBondContact O-CD 3.19Å; Q118-R381 WeakPolarHBondContact CG-O 3.46Å; N120-R381 PolarHBondContact O-NH1 2.62Å; G123-R381 PolarHBondContact O-NH1 3.25Å; G123-R381 PolarHBondContact O-NH2 3.34Å; Y126-R381 HydrophobicContact CD1-CG 4.11Å; Y126-R381 VanDerWaalsContact CD1-NH1 3.27Å; Y126-R381 VanDerWaalsContact CE1-NH1 3.3Å; Y126-R381 HydrophobicContact CG-CG 4.13Å; Y126-R381 WeakPolarHBondContact O-CA 3.37Å; F318-R381 WeakPolarHBondContact CE1-O 3.4Å; F318-R381 VanDerWaalsContact CZ-O 3.3Å; F318-R381 WeakPolarHBondContact CZ-O 3.45Å; E374-R381 IonicContact OE2-CZ 3.22Å; E374-R381 IonicContact OE2-NE 2.69Å; E374-R381 PolarHBondContact OE2-NE 3.25Å; E374-R381 IonicContact OE2-NH2 2.95Å; E374-R381 PolarHBondContact OE2-NH2 3.07Å; G378-R381 WeakPolarHBondContact O-CG 3.42Å; R381-F383 VanDerWaalsContact C-N 3.27Å; R381-F383 PolarHBondContact O-N 3.34Å |
| 382 | G | 93.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 76.1 | 11.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y126 Y380 G384 A385 | Y126-G382 PolarHBondContact O-N 3.49Å; Y380-G382 PolarHBondContact O-N 2.77Å; G382-G384 PolarHBondContact O-N 3.26Å; G382-A385 WeakPolarHBondContact O-CB 3.46Å; G382-A385 PolarHBondContact O-N 3.18Å |
| 383 | F | 95.8 | Very high | 93.3 | Very high | 37 Ų | 37 | 31.4 Ų | 31.4 | 16% | 0.162 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58.6 | -30.4 | 177.4 | -172.3 | -101.8 | 0 | 0 | 0 | 112.9 | L128 V315 F318 Y380 R381 A385 L386 L387 | L128-F383 HydrophobicContact CD2-CB 4.37Å; V315-F383 HydrophobicContact CB-CE2 4.4Å; V315-F383 HydrophobicContact CG1-CE2 4.21Å; V315-F383 HydrophobicContact CG1-CZ 4.21Å; V315-F383 HydrophobicContact CG2-CE2 3.92Å; V315-F383 HydrophobicContact CG2-CZ 3.94Å; F318-F383 AromaticContact CD2-CD2 3.91Å; F318-F383 HydrophobicContact CD2-CD2 3.91Å; F318-F383 HydrophobicContact CD2-CE2 4.49Å; F318-F383 HydrophobicContact CE2-CB 4.45Å; F318-F383 AromaticContact CE2-CD2 3.95Å; F318-F383 HydrophobicContact CE2-CD2 3.95Å; F318-F383 HydrophobicContact CG-CD2 4.27Å; F318-F383 HydrophobicContact CZ-CB 4.26Å; F318-F383 HydrophobicContact CZ-CD2 4.43Å; Y380-F383 AromaticContact CD1-CD2 3.72Å; Y380-F383 HydrophobicContact CD1-CD2 3.72Å; Y380-F383 HydrophobicContact CD1-CE2 4.08Å; Y380-F383 HydrophobicContact CD1-CG 4.3Å; Y380-F383 HydrophobicContact CE1-CD2 4.43Å; Y380-F383 HydrophobicContact CE1-CE2 4.37Å; Y380-F383 WeakPolarHBondContact O-CB 3.37Å; Y380-F383 PolarHBondContact O-N 3.26Å; R381-F383 VanDerWaalsContact C-N 3.27Å; R381-F383 PolarHBondContact O-N 3.34Å; F383-A385 PolarHBondContact O-N 2.94Å; F383-L386 HydrophobicContact CD2-CD2 3.89Å; F383-L386 HydrophobicContact CE2-CD2 3.64Å; F383-L386 HydrophobicContact CZ-CD2 4.42Å; F383-L386 VanDerWaalsContact O-CB 3.31Å; F383-L386 WeakPolarHBondContact O-CB 3.43Å; F383-L386 PolarHBondContact O-N 2.87Å; F383-L387 HydrophobicContact CD1-CD1 3.89Å; F383-L387 HydrophobicContact CD1-CD2 4.48Å; F383-L387 HydrophobicContact CD1-CG 3.95Å; F383-L387 HydrophobicContact CE1-CD1 3.75Å; F383-L387 HydrophobicContact CE1-CD2 3.78Å; F383-L387 HydrophobicContact CE1-CG 3.72Å; F383-L387 HydrophobicContact CZ-CD2 4.13Å; F383-L387 HydrophobicContact CZ-CG 4.44Å; F383-L387 PolarHBondContact O-N 3.25Å |
| 384 | G | 95.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -58.1 | -34.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | H127 L128 T129 P130 G382 L387 A388 | H127-G384 VanDerWaalsContact O-CA 3.31Å; H127-G384 WeakPolarHBondContact O-CA 3.35Å; H127-G384 PolarHBondContact O-N 3.08Å; L128-G384 WeakPolarHBondContact O-CA 3.37Å; L128-G384 PolarHBondContact O-N 3.25Å; T129-G384 VanDerWaalsContact C-CA 3.4Å; T129-G384 WeakPolarHBondContact O-CA 3.29Å; P130-G384 WeakPolarHBondContact CA-O 3.25Å; G382-G384 PolarHBondContact O-N 3.26Å; G384-L387 PolarHBondContact O-N 3.49Å; G384-A388 WeakPolarHBondContact O-CB 3.3Å; G384-A388 PolarHBondContact O-N 3.41Å |
| 385 | A | 95.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -73.7 | -31.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | C110 F113 R114 A133 G382 F383 A388 Q389 | C110-A385 HydrophobicContact CB-CB 4.37Å; C110-A385 WeakPolarHBondContact CB-O 3.49Å; F113-A385 HydrophobicContact CD1-CB 3.87Å; R114-A385 HydrophobicContact CB-CB 4.11Å; A133-A385 HydrophobicContact CB-CB 4.18Å; G382-A385 WeakPolarHBondContact O-CB 3.46Å; G382-A385 PolarHBondContact O-N 3.18Å; F383-A385 PolarHBondContact O-N 2.94Å; A385-A388 PolarHBondContact O-N 3.14Å; A385-Q389 VanDerWaalsContact O-CB 3.27Å; A385-Q389 WeakPolarHBondContact O-CB 3.04Å; A385-Q389 PolarHBondContact O-N 3.17Å |
| 386 | L | 95.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.6 | -46.7 | 168.7 | -178.9 | 76.6 | 0 | 0 | 0 | 110.7 | D314 V315 F318 F383 A388 Q389 Y390 | D314-L386 HydrophobicContact CB-CD1 3.82Å; D314-L386 HydrophobicContact CB-CD2 4.15Å; V315-L386 HydrophobicContact CG2-CD2 3.95Å; F318-L386 HydrophobicContact CD2-CD2 3.89Å; F318-L386 HydrophobicContact CE2-CB 4.15Å; F318-L386 HydrophobicContact CE2-CD2 4.14Å; F383-L386 HydrophobicContact CD2-CD2 3.89Å; F383-L386 HydrophobicContact CE2-CD2 3.64Å; F383-L386 HydrophobicContact CZ-CD2 4.42Å; F383-L386 VanDerWaalsContact O-CB 3.31Å; F383-L386 WeakPolarHBondContact O-CB 3.43Å; F383-L386 PolarHBondContact O-N 2.87Å; L386-A388 VanDerWaalsContact C-N 3.34Å; L386-A388 PolarHBondContact O-N 3.19Å; L386-Q389 WeakPolarHBondContact O-CB 3.35Å; L386-Q389 PolarHBondContact O-N 2.87Å; L386-Y390 HydrophobicContact CD1-CD2 3.69Å; L386-Y390 HydrophobicContact CD1-CE2 3.57Å; L386-Y390 HydrophobicContact CG-CD2 4.05Å; L386-Y390 HydrophobicContact CG-CE2 4.36Å; L386-Y390 PolarHBondContact O-N 3.31Å |
| 387 | L | 96 | Very high | 93 | Very high | 57 Ų | 57 | 27.6 Ų | 27.6 | 30% | 0.298 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -61.7 | -43.4 | 177.2 | -65.7 | -179.8 | 0 | 0 | 0 | 111.5 | P130 F383 G384 S391 | P130-L387 HydrophobicContact CB-CB 4.46Å; F383-L387 HydrophobicContact CD1-CD1 3.89Å; F383-L387 HydrophobicContact CD1-CD2 4.48Å; F383-L387 HydrophobicContact CD1-CG 3.95Å; F383-L387 HydrophobicContact CE1-CD1 3.75Å; F383-L387 HydrophobicContact CE1-CD2 3.78Å; F383-L387 HydrophobicContact CE1-CG 3.72Å; F383-L387 HydrophobicContact CZ-CD2 4.13Å; F383-L387 HydrophobicContact CZ-CG 4.44Å; F383-L387 PolarHBondContact O-N 3.25Å; G384-L387 PolarHBondContact O-N 3.49Å; L387-S391 WeakPolarHBondContact O-CB 3.41Å; L387-S391 PolarHBondContact O-N 2.59Å; L387-S391 PolarHBondContact O-OG 2.79Å |
| 388 | A | 95.1 | Very high | 92.9 | Very high | 15 Ų | 15 | 28.3 Ų | 28.3 | 12% | 0.124 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -61.3 | -45.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | P130 V134 G384 A385 L386 S391 L392 | P130-A388 HydrophobicContact CB-CB 4.05Å; V134-A388 HydrophobicContact CG2-CB 4.37Å; G384-A388 WeakPolarHBondContact O-CB 3.3Å; G384-A388 PolarHBondContact O-N 3.41Å; A385-A388 PolarHBondContact O-N 3.14Å; L386-A388 VanDerWaalsContact C-N 3.34Å; L386-A388 PolarHBondContact O-N 3.19Å; A388-S391 PolarHBondContact O-N 3.41Å; A388-L392 WeakPolarHBondContact O-CB 3.35Å; A388-L392 PolarHBondContact O-N 3.22Å |
| 389 | Q | 94.2 | Very high | 92.8 | Very high | 10 Ų | 10 | 30.6 Ų | 30.6 | 5% | 0.047 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -55.8 | -54.4 | 176.9 | -172.6 | -160 | -60 | 0 | 0 | 111.7 | Q42 A107 C110 A385 L386 L392 H393 | Q42-Q389 VanDerWaalsContact NE2-CD 3.3Å; A107-Q389 HydrophobicContact CB-CG 3.58Å; C110-Q389 HydrophobicContact CB-CB 3.79Å; C110-Q389 HydrophobicContact CB-CG 4.3Å; A385-Q389 VanDerWaalsContact O-CB 3.27Å; A385-Q389 WeakPolarHBondContact O-CB 3.04Å; A385-Q389 PolarHBondContact O-N 3.17Å; L386-Q389 WeakPolarHBondContact O-CB 3.35Å; L386-Q389 PolarHBondContact O-N 2.87Å; Q389-L392 PolarHBondContact O-N 3.21Å; Q389-H393 PolarHBondContact O-N 3.3Å |
| 390 | Y | 93.2 | Very high | 92.4 | Very high | 15 Ų | 15 | 31 Ų | 31 | 6% | 0.059 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -73.1 | -30.3 | -176.8 | -87.1 | -85.4 | 0 | 0 | 0 | 112.8 | W307 S310 L311 D314 L386 G394 | W307-Y390 AromaticContact CD1-CD1 3.98Å; W307-Y390 AromaticContact CE2-CD1 3.97Å; W307-Y390 HydrophobicContact CZ2-CD1 4.41Å; W307-Y390 AromaticContact NE1-CD1 3.53Å; W307-Y390 PolarHBondContact NE1-O 2.83Å; S310-Y390 VanDerWaalsContact CB-OH 3.3Å; S310-Y390 WeakPolarHBondContact CB-OH 3.38Å; S310-Y390 PolarHBondContact O-OH 3.23Å; L311-Y390 HydrophobicContact CB-CD1 3.71Å; L311-Y390 HydrophobicContact CB-CE1 3.74Å; L311-Y390 HydrophobicContact CB-CG 4.25Å; L311-Y390 HydrophobicContact CD1-CD1 4.03Å; L311-Y390 HydrophobicContact CD1-CD2 3.85Å; L311-Y390 HydrophobicContact CD1-CE2 4.38Å; L311-Y390 HydrophobicContact CD1-CG 3.65Å; L311-Y390 HydrophobicContact CG-CD1 4.34Å; L311-Y390 HydrophobicContact CG-CG 4.44Å; D314-Y390 HydrophobicContact CB-CE2 4.25Å; D314-Y390 VanDerWaalsContact OD2-CE2 3.32Å; D314-Y390 WeakPolarHBondContact OD2-CE2 3.36Å; D314-Y390 VanDerWaalsContact OD2-CZ 3.28Å; D314-Y390 PolarHBondContact OD2-OH 3.11Å; L386-Y390 HydrophobicContact CD1-CD2 3.69Å; L386-Y390 HydrophobicContact CD1-CE2 3.57Å; L386-Y390 HydrophobicContact CG-CD2 4.05Å; L386-Y390 HydrophobicContact CG-CE2 4.36Å; L386-Y390 PolarHBondContact O-N 3.31Å; Y390-G394 PolarHBondContact O-N 2.81Å |
| 391 | S | 93.9 | Very high | 91.9 | Very high | 73 Ų | 73 | 30.8 Ų | 30.8 | 51% | 0.51 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -65.7 | -42.6 | 171.8 | -59.5 | 0 | 0 | 0 | 0 | 111.2 | L387 A388 G394 A395 | L387-S391 WeakPolarHBondContact O-CB 3.41Å; L387-S391 PolarHBondContact O-N 2.59Å; L387-S391 PolarHBondContact O-OG 2.79Å; A388-S391 PolarHBondContact O-N 3.41Å; S391-G394 PolarHBondContact O-N 3.01Å; S391-A395 VanDerWaalsContact O-CB 3.25Å; S391-A395 WeakPolarHBondContact O-CB 3.33Å; S391-A395 PolarHBondContact O-N 2.88Å |
| 392 | L | 92.2 | Very high | 91.5 | Very high | 69 Ų | 69 | 34.5 Ų | 34.5 | 36% | 0.361 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -62.3 | -47.4 | 175.1 | 178 | 61.5 | 0 | 0 | 0 | 111 | L106 A388 Q389 A395 L396 | L106-L392 HydrophobicContact CB-CD2 4.16Å; A388-L392 WeakPolarHBondContact O-CB 3.35Å; A388-L392 PolarHBondContact O-N 3.22Å; Q389-L392 PolarHBondContact O-N 3.21Å; L392-A395 PolarHBondContact O-N 3.48Å; L392-L396 HydrophobicContact CD1-CD1 3.88Å; L392-L396 HydrophobicContact CD1-CG 4.29Å; L392-L396 HydrophobicContact CG-CD1 3.99Å; L392-L396 WeakPolarHBondContact O-CB 3.34Å; L392-L396 WeakPolarHBondContact O-CG 3.48Å; L392-L396 PolarHBondContact O-N 2.75Å |
| 393 | H | 90.6 | Very high | 91.1 | Very high | 12 Ų | 12 | 40.2 Ų | 40.2 | 6% | 0.056 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -57.9 | -51.3 | 175.3 | -171.2 | 129.9 | 0 | 0 | 0 | 111.1 | S99 T102 E103 W307 Q389 A395 L396 L397 | S99-H393 PolarHBondContact OG-CE1 3.36Å; T102-H393 HydrophobicContact CG2-CB 4.1Å; E103-H393 VanDerWaalsContact CG-CE1 3.43Å; E103-H393 WeakPolarHBondContact CG-CE1 3.49Å; E103-H393 VanDerWaalsContact CG-ND1 3.32Å; E103-H393 WeakPolarHBondContact CG-ND1 3.46Å; E103-H393 IonicContact OE1-CE1 3.06Å; E103-H393 PolarHBondContact OE1-CE1 3.29Å; E103-H393 IonicContact OE1-ND1 3.63Å; W307-H393 AromaticContact CD1-CD2 3.43Å; W307-H393 VanDerWaalsContact CD1-CD2 3.43Å; W307-H393 AromaticContact CD1-CG 3.8Å; W307-H393 AromaticContact CD1-NE2 3.94Å; W307-H393 AromaticContact NE1-CD2 3.92Å; Q389-H393 PolarHBondContact O-N 3.3Å; H393-A395 VanDerWaalsContact C-N 3.34Å; H393-A395 PolarHBondContact O-N 3.46Å; H393-L396 PolarHBondContact O-N 3.5Å; H393-L397 WeakPolarHBondContact O-CB 3.16Å; H393-L397 PolarHBondContact O-N 2.84Å |
| 394 | G | 91 | Very high | 90.5 | Very high | 20 Ų | 20 | 39.8 Ų | 39.8 | 21% | 0.206 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.1 | -39.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113 | Y390 S391 L397 A398 | Y390-G394 PolarHBondContact O-N 2.81Å; S391-G394 PolarHBondContact O-N 3.01Å; G394-L397 PolarHBondContact O-N 3.27Å; G394-A398 WeakPolarHBondContact O-CB 3.24Å; G394-A398 PolarHBondContact O-N 2.77Å |
| 395 | A | 92.1 | Very high | 89.9 | Confident | 60 Ų | 60 | 44 Ų | 44 | 50% | 0.496 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | S391 L392 H393 A398 A399 | S391-A395 VanDerWaalsContact O-CB 3.25Å; S391-A395 WeakPolarHBondContact O-CB 3.33Å; S391-A395 PolarHBondContact O-N 2.88Å; L392-A395 PolarHBondContact O-N 3.48Å; H393-A395 VanDerWaalsContact C-N 3.34Å; H393-A395 PolarHBondContact O-N 3.46Å; A395-A398 PolarHBondContact O-N 2.92Å; A395-A399 WeakPolarHBondContact O-CB 3.34Å; A395-A399 PolarHBondContact O-N 2.79Å |
| 396 | L | 89.7 | Confident | 89.4 | Confident | 53 Ų | 53 | 47.7 Ų | 47.7 | 28% | 0.277 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66.3 | -39.6 | 176.6 | -75.4 | 167.1 | 0 | 0 | 0 | 111.8 | T102 L106 L392 H393 A399 A400 | T102-L396 HydrophobicContact CG2-CB 4.49Å; T102-L396 HydrophobicContact CG2-CD1 3.45Å; T102-L396 VanDerWaalsContact CG2-CD1 3.45Å; T102-L396 WeakPolarHBondContact OG1-CD1 3.28Å; L106-L396 HydrophobicContact CD1-CD1 3.65Å; L392-L396 HydrophobicContact CD1-CD1 3.88Å; L392-L396 HydrophobicContact CD1-CG 4.29Å; L392-L396 HydrophobicContact CG-CD1 3.99Å; L392-L396 WeakPolarHBondContact O-CB 3.34Å; L392-L396 WeakPolarHBondContact O-CG 3.48Å; L392-L396 PolarHBondContact O-N 2.75Å; H393-L396 PolarHBondContact O-N 3.5Å; L396-A399 PolarHBondContact O-N 3.29Å; L396-A400 WeakPolarHBondContact O-CB 3.39Å; L396-A400 PolarHBondContact O-N 3.27Å |
| 397 | L | 85.7 | Confident | 88.8 | Confident | 23 Ų | 23 | 50.9 Ų | 50.9 | 12% | 0.12 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.4 | -43.9 | 174.1 | 179.7 | 60.2 | 0 | 0 | 0 | 111.5 | F300 L303 H393 G394 A400 R401 | F300-L397 HydrophobicContact CD1-CD1 4.05Å; F300-L397 HydrophobicContact CD1-CG 4.47Å; F300-L397 HydrophobicContact CE1-CD1 3.63Å; F300-L397 HydrophobicContact CE1-CG 4.27Å; F300-L397 WeakPolarHBondContact CE1-O 2.99Å; L303-L397 HydrophobicContact CD2-CD1 3.2Å; L303-L397 HydrophobicContact CD2-CD2 4.45Å; L303-L397 HydrophobicContact CD2-CG 4.45Å; L303-L397 HydrophobicContact CG-CD1 3.67Å; L303-L397 HydrophobicContact CG-CD2 3.98Å; H393-L397 WeakPolarHBondContact O-CB 3.16Å; H393-L397 PolarHBondContact O-N 2.84Å; G394-L397 PolarHBondContact O-N 3.27Å; L397-A400 PolarHBondContact O-N 3.37Å; L397-R401 PolarHBondContact O-N 3.06Å |
| 398 | A | 87.8 | Confident | 87.9 | Confident | 55 Ų | 55 | 49 Ų | 49 | 46% | 0.455 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -63.4 | -43.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | G394 A395 R401 T402 | G394-A398 WeakPolarHBondContact O-CB 3.24Å; G394-A398 PolarHBondContact O-N 2.77Å; A395-A398 PolarHBondContact O-N 2.92Å; A398-R401 VanDerWaalsContact O-CB 3.32Å; A398-R401 WeakPolarHBondContact O-CB 3.26Å; A398-R401 PolarHBondContact O-N 3.4Å; A398-T402 PolarHBondContact O-N 3.31Å; A398-T402 PolarHBondContact O-OG1 2.9Å |
| 399 | A | 88.8 | Confident | 87.2 | Confident | 48 Ų | 48 | 53.6 Ų | 53.6 | 40% | 0.397 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.1 | -44 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A395 L396 R401 T402 L403 | A395-A399 WeakPolarHBondContact O-CB 3.34Å; A395-A399 PolarHBondContact O-N 2.79Å; L396-A399 PolarHBondContact O-N 3.29Å; A399-R401 VanDerWaalsContact C-N 3.31Å; A399-R401 PolarHBondContact O-N 2.71Å; A399-T402 WeakPolarHBondContact CA-OG1 3.46Å; A399-T402 PolarHBondContact O-N 2.88Å; A399-T402 PolarHBondContact O-OG1 3.29Å; A399-L403 WeakPolarHBondContact O-CB 3.25Å; A399-L403 PolarHBondContact O-N 3.47Å |
| 400 | A | 85.6 | Confident | 86.5 | Confident | 21 Ų | 21 | 57.9 Ų | 57.9 | 17% | 0.174 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60.5 | -40.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L396 L397 L404 | L396-A400 WeakPolarHBondContact O-CB 3.39Å; L396-A400 PolarHBondContact O-N 3.27Å; L397-A400 PolarHBondContact O-N 3.37Å; A400-L404 WeakPolarHBondContact O-CB 3.46Å; A400-L404 PolarHBondContact O-N 3.22Å |
| 401 | R | 84.1 | Confident | 85.6 | Confident | 72 Ų | 72 | 59.6 Ų | 59.6 | 27% | 0.272 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.9 | -49.9 | 173.7 | -164.9 | 178 | -179.1 | 154.7 | 4.5 | 111.7 | D297 F300 L397 A398 A399 R405 | D297-R401 IonicContact OD1-NH2 3.03Å; D297-R401 PolarHBondContact OD1-NH2 2.86Å; F300-R401 HydrophobicContact CD1-CB 3.72Å; F300-R401 HydrophobicContact CD1-CG 3.71Å; F300-R401 HydrophobicContact CD2-CG 3.96Å; F300-R401 HydrophobicContact CE1-CB 3.28Å; F300-R401 HydrophobicContact CE1-CG 3.73Å; F300-R401 HydrophobicContact CE2-CB 4.19Å; F300-R401 HydrophobicContact CE2-CG 3.99Å; F300-R401 HydrophobicContact CG-CB 4.32Å; F300-R401 HydrophobicContact CG-CG 3.82Å; F300-R401 HydrophobicContact CZ-CB 3.55Å; F300-R401 HydrophobicContact CZ-CG 3.86Å; L397-R401 PolarHBondContact O-N 3.06Å; A398-R401 VanDerWaalsContact O-CB 3.32Å; A398-R401 WeakPolarHBondContact O-CB 3.26Å; A398-R401 PolarHBondContact O-N 3.4Å; A399-R401 VanDerWaalsContact C-N 3.31Å; A399-R401 PolarHBondContact O-N 2.71Å; R401-R405 WeakPolarHBondContact O-CB 3.37Å; R401-R405 VanDerWaalsContact O-CG 3.31Å; R401-R405 WeakPolarHBondContact O-CG 3.29Å; R401-R405 PolarHBondContact O-N 3.43Å |
| 402 | T | 86.4 | Confident | 84.5 | Confident | 85 Ų | 85 | 62.6 Ų | 62.6 | 52% | 0.521 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.1 | -43.4 | -177.4 | 47.5 | 0 | 0 | 0 | 0 | 111.5 | A398 A399 R405 V406 | A398-T402 PolarHBondContact O-N 3.31Å; A398-T402 PolarHBondContact O-OG1 2.9Å; A399-T402 WeakPolarHBondContact CA-OG1 3.46Å; A399-T402 PolarHBondContact O-N 2.88Å; A399-T402 PolarHBondContact O-OG1 3.29Å; T402-R405 PolarHBondContact O-N 3.24Å; T402-V406 WeakPolarHBondContact O-CG2 3.32Å; T402-V406 PolarHBondContact O-N 3.18Å |
| 403 | L | 85.8 | Confident | 83.4 | Confident | 120 Ų | 120 | 63.6 Ų | 63.6 | 63% | 0.628 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -62.3 | -47.8 | 179.9 | -179.3 | 70.8 | 0 | 0 | 0 | 110.8 | A399 R405 V406 V407 | A399-L403 WeakPolarHBondContact O-CB 3.25Å; A399-L403 PolarHBondContact O-N 3.47Å; L403-R405 VanDerWaalsContact C-N 3.33Å; L403-R405 PolarHBondContact O-N 3.17Å; L403-V406 PolarHBondContact O-N 2.99Å; L403-V407 WeakPolarHBondContact O-CG2 3.33Å; L403-V407 PolarHBondContact O-N 3.49Å |
| 404 | L | 81.9 | Confident | 81.5 | Confident | 28 Ų | 28 | 70.9 Ų | 70.9 | 15% | 0.147 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -68.4 | -34 | -178.9 | -174.1 | 56.8 | 0 | 0 | 0 | 112.2 | A91 I95 L296 A400 V407 L408 | A91-L404 HydrophobicContact CB-CD1 3.9Å; A91-L404 HydrophobicContact CB-CD2 3.35Å; A91-L404 HydrophobicContact CB-CG 4.25Å; I95-L404 HydrophobicContact CD1-CD2 3.77Å; L296-L404 HydrophobicContact CD1-CG 4.22Å; L296-L404 HydrophobicContact CD2-CB 4.23Å; L296-L404 HydrophobicContact CD2-CD2 3.3Å; L296-L404 HydrophobicContact CD2-CG 3.73Å; L296-L404 HydrophobicContact CG-CD2 4.33Å; L296-L404 HydrophobicContact CG-CG 4.41Å; A400-L404 WeakPolarHBondContact O-CB 3.46Å; A400-L404 PolarHBondContact O-N 3.22Å; L404-V407 PolarHBondContact O-N 2.87Å; L404-L408 HydrophobicContact CD1-CG 4.32Å; L404-L408 WeakPolarHBondContact O-CB 3.34Å; L404-L408 VanDerWaalsContact O-CG 3.31Å; L404-L408 WeakPolarHBondContact O-CG 3.5Å; L404-L408 PolarHBondContact O-N 3.4Å |
| 405 | R | 82.8 | Confident | 81 | Confident | 88 Ų | 88 | 73.4 Ų | 73.4 | 33% | 0.332 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.1 | -45.3 | 170.6 | -79.9 | -176.7 | 168.7 | 176.1 | -8.4 | 112 | L296 D297 R401 T402 L403 L408 L409 | L296-R405 HydrophobicContact CD1-CB 4.29Å; L296-R405 HydrophobicContact CD1-CG 3.46Å; L296-R405 VanDerWaalsContact CD1-CG 3.46Å; D297-R405 IonicContact OD1-CZ 3.96Å; D297-R405 IonicContact OD1-NH2 2.81Å; D297-R405 PolarHBondContact OD1-NH2 3.14Å; R401-R405 WeakPolarHBondContact O-CB 3.37Å; R401-R405 VanDerWaalsContact O-CG 3.31Å; R401-R405 WeakPolarHBondContact O-CG 3.29Å; R401-R405 PolarHBondContact O-N 3.43Å; T402-R405 PolarHBondContact O-N 3.24Å; L403-R405 VanDerWaalsContact C-N 3.33Å; L403-R405 PolarHBondContact O-N 3.17Å; R405-L408 PolarHBondContact O-N 3.43Å; R405-L409 VanDerWaalsContact O-CG 3.24Å; R405-L409 WeakPolarHBondContact O-CG 3.33Å; R405-L409 PolarHBondContact O-N 3.45Å |
| 406 | V | 85.2 | Confident | 80.4 | Confident | 78 Ų | 78 | 74.1 Ų | 74.1 | 47% | 0.473 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62 | -48.9 | 178.1 | 172.2 | 0 | 0 | 0 | 0 | 110.3 | T402 L403 L408 L409 D410 | T402-V406 WeakPolarHBondContact O-CG2 3.32Å; T402-V406 PolarHBondContact O-N 3.18Å; L403-V406 PolarHBondContact O-N 2.99Å; V406-L408 VanDerWaalsContact C-N 3.31Å; V406-L408 PolarHBondContact O-N 2.66Å; V406-L409 WeakPolarHBondContact O-CB 3.46Å; V406-L409 PolarHBondContact O-N 2.96Å; V406-D410 PolarHBondContact O-N 3.47Å |
| 407 | V | 82.4 | Confident | 79.9 | Confident | 66 Ų | 66 | 75.3 Ų | 75.3 | 40% | 0.4 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.3 | -40.9 | 178.6 | 172.8 | 0 | 0 | 0 | 0 | 112.1 | L403 L404 L409 D410 A411 | L403-V407 WeakPolarHBondContact O-CG2 3.33Å; L403-V407 PolarHBondContact O-N 3.49Å; L404-V407 PolarHBondContact O-N 2.87Å; V407-L409 VanDerWaalsContact C-N 3.35Å; V407-D410 PolarHBondContact O-N 2.8Å; V407-A411 WeakPolarHBondContact O-CB 3.48Å; V407-A411 PolarHBondContact O-N 3.27Å |
| 408 | L | 76.5 | Confident | 79.6 | Confident | 17 Ų | 17 | 78.4 Ų | 78.4 | 9% | 0.089 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -70.6 | -29.2 | 176.8 | -72.3 | -176.5 | 0 | 0 | 0 | 113.3 | L296 L404 R405 V406 K412 | L296-L408 HydrophobicContact CD1-CD1 3.46Å; L296-L408 VanDerWaalsContact CD1-CD1 3.46Å; L296-L408 HydrophobicContact CD1-CG 4.47Å; L296-L408 HydrophobicContact CG-CD1 3.78Å; L404-L408 HydrophobicContact CD1-CG 4.32Å; L404-L408 WeakPolarHBondContact O-CB 3.34Å; L404-L408 VanDerWaalsContact O-CG 3.31Å; L404-L408 WeakPolarHBondContact O-CG 3.5Å; L404-L408 PolarHBondContact O-N 3.4Å; R405-L408 PolarHBondContact O-N 3.43Å; V406-L408 VanDerWaalsContact C-N 3.31Å; V406-L408 PolarHBondContact O-N 2.66Å; L408-K412 VanDerWaalsContact O-CG 3.28Å; L408-K412 WeakPolarHBondContact O-CG 3.3Å; L408-K412 PolarHBondContact O-N 3.07Å |
| 409 | L | 80.5 | Confident | 79 | Confident | 112 Ų | 112 | 79.8 Ų | 79.8 | 59% | 0.586 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -71.6 | -44.2 | 173.9 | -72.7 | 170.8 | 0 | 0 | 0 | 110.7 | R405 V406 V407 A411 K412 A413 | R405-L409 VanDerWaalsContact O-CG 3.24Å; R405-L409 WeakPolarHBondContact O-CG 3.33Å; R405-L409 PolarHBondContact O-N 3.45Å; V406-L409 WeakPolarHBondContact O-CB 3.46Å; V406-L409 PolarHBondContact O-N 2.96Å; V407-L409 VanDerWaalsContact C-N 3.35Å; L409-A411 VanDerWaalsContact C-N 3.34Å; L409-A411 PolarHBondContact O-N 2.97Å; L409-K412 PolarHBondContact O-N 3.01Å; L409-K412 VanDerWaalsContact O-N 3.16Å; L409-A413 PolarHBondContact O-N 3.45Å |
| 410 | D | 79.4 | Confident | 78.4 | Confident | 101 Ų | 101 | 81.9 Ų | 81.9 | 54% | 0.54 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 176.5 | -69.9 | -16.5 | 0 | 0 | 0 | 111.1 | V406 V407 K412 A413 C414 | V406-D410 PolarHBondContact O-N 3.47Å; V407-D410 PolarHBondContact O-N 2.8Å; D410-K412 PolarHBondContact O-N 3.16Å; D410-A413 PolarHBondContact O-N 2.92Å; D410-A413 VanDerWaalsContact O-N 3.08Å; D410-C414 PolarHBondContact O-N 3.36Å |
| 411 | A | 74.3 | Confident | 77.9 | Confident | 51 Ų | 51 | 86.3 Ų | 86.3 | 42% | 0.421 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66 | -20.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | V407 L409 | V407-A411 WeakPolarHBondContact O-CB 3.48Å; V407-A411 PolarHBondContact O-N 3.27Å; L409-A411 VanDerWaalsContact C-N 3.34Å; L409-A411 PolarHBondContact O-N 2.97Å |
| 412 | K | 72.1 | Confident | 77.4 | Confident | 135 Ų | 135 | 87.4 Ų | 87.4 | 59% | 0.587 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -88.6 | -15.9 | 174 | -74.4 | 172.3 | -177.1 | 175.6 | 0 | 112.8 | L408 L409 D410 | L408-K412 VanDerWaalsContact O-CG 3.28Å; L408-K412 WeakPolarHBondContact O-CG 3.3Å; L408-K412 PolarHBondContact O-N 3.07Å; L409-K412 PolarHBondContact O-N 3.01Å; L409-K412 VanDerWaalsContact O-N 3.16Å; D410-K412 PolarHBondContact O-N 3.16Å |
| 413 | A | 68.4 | Low | 76.7 | Confident | 90 Ų | 90 | 87.6 Ų | 87.6 | 74% | 0.744 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -90.7 | -17.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113 | L409 D410 | L409-A413 PolarHBondContact O-N 3.45Å; D410-A413 PolarHBondContact O-N 2.92Å; D410-A413 VanDerWaalsContact O-N 3.08Å |
| 414 | C | 50.6 | Low | 75.8 | Confident | 165 Ų | 165 | 84.6 Ų | 84.6 | 100% | 1.115 | 49% | 0.494 | S | S | * | . | trans | -90 | 0 | 166.9 | -63.9 | 0 | 0 | 0 | 0 | 110.7 | D410 | D410-C414 PolarHBondContact O-N 3.36Š|
Retrieved 414 of 414 residues in 2601.5 ms
(Link to these results)