| 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 | 37.9 | Very low | 52.9 | Low | 241 Ų | 241 | 140 Ų | 140 | 100% | 1.187 | 75% | 0.754 | S | S | * | * | 0 | 88.5 | 0 | -157.1 | 174.4 | -133.6 | 0 | 0 | 105.1 | |||||
| 2 | E | 38 | Very low | 54.4 | Low | 171 Ų | 171 | 138 Ų | 138 | 80% | 0.799 | 75% | 0.749 | S | S | * | * | trans | -83.7 | 118.1 | -177.2 | -73 | 177.5 | 167 | 0 | 0 | 107.7 | F4 | E2-F4 PolarHBondContact O-N 3.18Å; E2-F4 VanDerWaalsContact O-N 3.13Å | ||
| 3 | I | 44.8 | Very low | 56.2 | Low | 163 Ų | 163 | 137.2 Ų | 137.2 | 84% | 0.836 | 74% | 0.735 | S | S | * | * | trans | -72.4 | 103.1 | 172.1 | -62 | 171.6 | 0 | 0 | 0 | 104.9 | G5 | I3-G5 PolarHBondContact O-N 2.98Š| ||
| 4 | F | 42.5 | Very low | 57.6 | Low | 204 Ų | 204 | 135.7 Ų | 135.7 | 90% | 0.895 | 74% | 0.74 | S | S | * | * | trans | -67.2 | 73.4 | 162.7 | -80.2 | -85.6 | 0 | 0 | 0 | 108.2 | E2 | E2-F4 PolarHBondContact O-N 3.18Å; E2-F4 VanDerWaalsContact O-N 3.13Å | ||
| 5 | G | 49.4 | Very low | 58.7 | Low | 44 Ų | 44 | 139.2 Ų | 139.2 | 45% | 0.454 | 75% | 0.75 | S | S | . | * | trans | -96 | 129.8 | 169 | 0 | 0 | 0 | 0 | 0 | 108.1 | I3 T7 | I3-G5 PolarHBondContact O-N 2.98Å; G5-T7 VanDerWaalsContact C-N 3.32Å; G5-T7 PolarHBondContact O-N 3.31Å | ||
| 6 | S | 52.9 | Low | 59.4 | Low | 107 Ų | 107 | 136.8 Ų | 136.8 | 75% | 0.748 | 75% | 0.754 | S | S | * | * | trans | -55.5 | 93 | 169.4 | 53.9 | 0 | 0 | 0 | 0 | 109.8 | F8 | S6-F8 VanDerWaalsContact C-N 3.28Å; S6-F8 PolarHBondContact O-N 3.02Å | ||
| 7 | T | 52.8 | Low | 60.3 | Low | 137 Ų | 137 | 142.5 Ų | 142.5 | 84% | 0.84 | 76% | 0.762 | S | S | * | * | trans | -69.4 | 97.4 | 162.2 | 49.9 | 0 | 0 | 0 | 0 | 105.6 | G5 D9 | G5-T7 VanDerWaalsContact C-N 3.32Å; G5-T7 PolarHBondContact O-N 3.31Å; T7-D9 PolarHBondContact O-N 3.37Å | ||
| 8 | F | 57.9 | Low | 60.8 | Low | 158 Ų | 158 | 145.1 Ų | 145.1 | 69% | 0.693 | 77% | 0.769 | S | S | * | * | trans | -59.2 | 123.5 | 171.1 | -117.3 | -98.4 | 0 | 0 | 0 | 107.2 | S6 D10 F13 | S6-F8 VanDerWaalsContact C-N 3.28Å; S6-F8 PolarHBondContact O-N 3.02Å; F8-D10 PolarHBondContact O-N 3.44Å; F8-D10 VanDerWaalsContact O-N 3.16Å; F8-F13 HydrophobicContact CD1-CE2 4.11Å; F8-F13 HydrophobicContact CD1-CZ 4.29Å; F8-F13 HydrophobicContact CE1-CZ 4.3Å | ||
| 9 | D | 67.9 | Low | 61.2 | Low | 98 Ų | 98 | 150.3 Ų | 150.3 | 52% | 0.524 | 78% | 0.777 | S | S | . | * | trans | -76.3 | 101.7 | 177 | -175 | -2.4 | 0 | 0 | 0 | 108.1 | T7 S11 V12 | T7-D9 PolarHBondContact O-N 3.37Å; D9-S11 PolarHBondContact O-N 3.5Å; D9-S11 VanDerWaalsContact O-N 3.11Å; D9-S11 WeakPolarHBondContact OD1-CB 3.45Å; D9-S11 PolarHBondContact OD1-N 2.68Å; D9-S11 PolarHBondContact OD1-OG 3.17Å; D9-S11 PolarHBondContact OD2-OG 3.46Å; D9-V12 HydrophobicContact CB-CG2 4.21Å; D9-V12 WeakPolarHBondContact O-CG2 3.28Å; D9-V12 PolarHBondContact O-N 3.22Å | ||
| 10 | D | 67 | Low | 61.7 | Low | 124 Ų | 124 | 148.4 Ų | 148.4 | 66% | 0.663 | 77% | 0.772 | S | S | * | * | G | 310 helix | trans | -63.8 | -12.3 | 179.4 | -84.6 | -17.9 | 0 | 0 | 0 | 112.7 | F8 V12 F13 | F8-D10 PolarHBondContact O-N 3.44Å; F8-D10 VanDerWaalsContact O-N 3.16Å; D10-V12 PolarHBondContact O-N 2.81Å; D10-F13 PolarHBondContact O-N 2.91Å |
| 11 | S | 70.6 | Confident | 61.8 | Low | 93 Ų | 93 | 147.6 Ų | 147.6 | 65% | 0.65 | 78% | 0.778 | S | S | * | * | G | 310 helix | trans | -69.2 | -12.2 | 176.3 | 75.6 | 0 | 0 | 0 | 0 | 114.1 | D9 F13 | D9-S11 PolarHBondContact O-N 3.5Å; D9-S11 VanDerWaalsContact O-N 3.11Å; D9-S11 WeakPolarHBondContact OD1-CB 3.45Å; D9-S11 PolarHBondContact OD1-N 2.68Å; D9-S11 PolarHBondContact OD1-OG 3.17Å; D9-S11 PolarHBondContact OD2-OG 3.46Å; S11-F13 VanDerWaalsContact C-N 3.32Å |
| 12 | V | 71 | Confident | 63.5 | Low | 116 Ų | 116 | 143.4 Ų | 143.4 | 70% | 0.703 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -79.8 | -17.8 | 175.7 | -164.1 | 0 | 0 | 0 | 0 | 111.6 | D9 D10 | D9-V12 HydrophobicContact CB-CG2 4.21Å; D9-V12 WeakPolarHBondContact O-CG2 3.28Å; D9-V12 PolarHBondContact O-N 3.22Å; D10-V12 PolarHBondContact O-N 2.81Å |
| 13 | F | 78.4 | Confident | 65.3 | Low | 128 Ų | 128 | 140.8 Ų | 140.8 | 56% | 0.561 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -88.3 | 134.5 | 175.7 | -60.6 | -80.4 | 0 | 0 | 0 | 110.5 | F8 D10 S11 | F8-F13 HydrophobicContact CD1-CE2 4.11Å; F8-F13 HydrophobicContact CD1-CZ 4.29Å; F8-F13 HydrophobicContact CE1-CZ 4.3Å; D10-F13 PolarHBondContact O-N 2.91Å; S11-F13 VanDerWaalsContact C-N 3.32Å |
| 14 | S | 75.4 | Confident | 66.5 | Low | 116 Ų | 116 | 141 Ų | 141 | 81% | 0.811 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 148.3 | 170.6 | -48.6 | 0 | 0 | 0 | 0 | 110.4 | A16 | S14-A16 PolarHBondContact O-N 3.44Š|
| 15 | E | 74.6 | Confident | 68.2 | Low | 188 Ų | 188 | 136.4 Ų | 136.4 | 88% | 0.879 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 135.3 | 172.4 | -74.6 | -179 | 165.1 | 0 | 0 | 110.5 | R17 | E15-R17 PolarHBondContact O-N 3.29Å; E15-R17 VanDerWaalsContact O-N 3.07Å |
| 16 | A | 69 | Low | 69.6 | Low | 100 Ų | 100 | 139.3 Ų | 139.3 | 83% | 0.826 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 119.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | S14 E18 | S14-A16 PolarHBondContact O-N 3.44Å; A16-E18 PolarHBondContact O-N 2.9Å |
| 17 | R | 74.6 | Confident | 70.9 | Confident | 235 Ų | 235 | 143.5 Ų | 143.5 | 89% | 0.887 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 131.7 | 173.4 | -69.8 | -176.5 | 175.6 | -177.2 | -1.2 | 108.7 | E15 R19 | E15-R17 PolarHBondContact O-N 3.29Å; E15-R17 VanDerWaalsContact O-N 3.07Å; R17-R19 PolarHBondContact O-N 2.96Å |
| 18 | E | 70.5 | Confident | 72.1 | Confident | 189 Ų | 189 | 143.7 Ų | 143.7 | 88% | 0.883 | 76% | 0.761 | S | S | * | * | trans | -51.7 | 111.4 | 172.2 | -79.5 | -172.7 | 158.3 | 0 | 0 | 108.4 | A16 V20 | A16-E18 PolarHBondContact O-N 2.9Å; E18-V20 PolarHBondContact O-N 3.41Å | ||
| 19 | R | 67.1 | Low | 73.1 | Confident | 243 Ų | 243 | 139.2 Ų | 139.2 | 92% | 0.917 | 75% | 0.753 | S | S | * | * | trans | -71.6 | 104.6 | 175.4 | -67.3 | -176.7 | -174.6 | 168.3 | 2.2 | 106.2 | R17 C21 | R17-R19 PolarHBondContact O-N 2.96Å; R19-C21 PolarHBondContact O-N 3.46Å | ||
| 20 | V | 71.8 | Confident | 73.6 | Confident | 112 Ų | 112 | 141.1 Ų | 141.1 | 68% | 0.679 | 76% | 0.757 | S | S | * | * | trans | -55.2 | 118 | 168 | -174.7 | 0 | 0 | 0 | 0 | 106.4 | E18 E22 | E18-V20 PolarHBondContact O-N 3.41Å; V20-E22 HydrophobicContact CB-CG 4.24Å; V20-E22 HydrophobicContact CG1-CG 3.66Å; V20-E22 PolarHBondContact O-N 2.93Å | ||
| 21 | C | 64.6 | Low | 74.2 | Confident | 133 Ų | 133 | 143.1 Ų | 143.1 | 90% | 0.899 | 77% | 0.767 | S | S | * | * | trans | -73.5 | 76.5 | 174.1 | -169 | 0 | 0 | 0 | 0 | 107.5 | R19 | R19-C21 PolarHBondContact O-N 3.46Š| ||
| 22 | E | 73.6 | Confident | 74.7 | Confident | 152 Ų | 152 | 142.1 Ų | 142.1 | 71% | 0.71 | 76% | 0.759 | S | S | * | * | trans | -78 | 131.6 | 169.9 | -67.4 | -171.8 | 166 | 0 | 0 | 108.4 | V20 L24 | V20-E22 HydrophobicContact CB-CG 4.24Å; V20-E22 HydrophobicContact CG1-CG 3.66Å; V20-E22 PolarHBondContact O-N 2.93Å; E22-L24 PolarHBondContact O-N 3.4Å | ||
| 23 | S | 73.9 | Confident | 75.6 | Confident | 117 Ų | 117 | 143 Ų | 143 | 82% | 0.818 | 76% | 0.755 | S | S | * | * | trans | -61.4 | 107.3 | 168.6 | 54.2 | 0 | 0 | 0 | 0 | 108.1 | S25 | S23-S25 PolarHBondContact O-N 3.33Å; S23-S25 VanDerWaalsContact O-N 3.16Å | ||
| 24 | L | 71.8 | Confident | 76.2 | Confident | 168 Ų | 168 | 142.3 Ų | 142.3 | 88% | 0.88 | 76% | 0.763 | S | S | * | * | trans | -55.9 | 122.8 | 175.6 | -67.5 | 171 | 0 | 0 | 0 | 108.5 | E22 S26 | E22-L24 PolarHBondContact O-N 3.4Å; L24-S26 PolarHBondContact O-N 2.99Å | ||
| 25 | S | 77.3 | Confident | 77 | Confident | 106 Ų | 106 | 142.1 Ų | 142.1 | 74% | 0.741 | 75% | 0.75 | S | S | * | * | trans | -56 | 140.9 | 170.4 | 54.9 | 0 | 0 | 0 | 0 | 109.1 | S23 Y27 | S23-S25 PolarHBondContact O-N 3.33Å; S23-S25 VanDerWaalsContact O-N 3.16Å; S25-Y27 PolarHBondContact O-N 3.42Å | ||
| 26 | S | 79.8 | Confident | 77.9 | Confident | 105 Ų | 105 | 136 Ų | 136 | 73% | 0.734 | 72% | 0.718 | S | S | * | * | trans | -53.7 | 110.5 | 175.2 | 56.7 | 0 | 0 | 0 | 0 | 110.1 | L24 N28 | L24-S26 PolarHBondContact O-N 2.99Å; S26-N28 PolarHBondContact O-N 2.88Å | ||
| 27 | Y | 79.8 | Confident | 79 | Confident | 196 Ų | 196 | 132.5 Ų | 132.5 | 77% | 0.769 | 69% | 0.685 | S | S | * | * | trans | -83.5 | 112.6 | 178.5 | 175.9 | -103.6 | 0 | 0 | 0 | 109.3 | S25 A29 | S25-Y27 PolarHBondContact O-N 3.42Å; Y27-A29 HydrophobicContact CE1-CB 3.78Å | ||
| 28 | N | 77.8 | Confident | 79.9 | Confident | 140 Ų | 140 | 124.2 Ų | 124.2 | 75% | 0.749 | 66% | 0.662 | S | S | * | * | trans | -93.5 | 110.1 | 168.2 | -69.6 | -53.3 | 0 | 0 | 0 | 108 | S26 K30 | S26-N28 PolarHBondContact O-N 2.88Å; N28-K30 PolarHBondContact O-N 3.27Å | ||
| 29 | A | 79.4 | Confident | 80.9 | Confident | 64 Ų | 64 | 120.5 Ų | 120.5 | 53% | 0.529 | 65% | 0.645 | S | S | . | * | trans | -60.6 | 133.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | Y27 L31 | Y27-A29 HydrophobicContact CE1-CB 3.78Å; A29-L31 PolarHBondContact O-N 3.18Å | ||
| 30 | K | 78.1 | Confident | 81.9 | Confident | 139 Ų | 139 | 113.7 Ų | 113.7 | 60% | 0.604 | 64% | 0.635 | S | S | * | * | trans | -67.8 | 122.2 | 172 | -66.7 | -177.1 | 179 | 177.9 | 0 | 108.3 | N28 E50 | N28-K30 PolarHBondContact O-N 3.27Å; K30-E50 VanDerWaalsContact NZ-CD 3.26Å; K30-E50 IonicContact NZ-OE1 3.73Å; K30-E50 IonicContact NZ-OE2 2.71Å; K30-E50 PolarHBondContact NZ-OE2 3.31Å | ||
| 31 | L | 78.6 | Confident | 82.8 | Confident | 166 Ų | 166 | 111 Ų | 111 | 87% | 0.869 | 62% | 0.621 | S | S | * | * | trans | -86.2 | 113.6 | 167.7 | -69.8 | 168.1 | 0 | 0 | 0 | 107.3 | A29 | A29-L31 PolarHBondContact O-N 3.18Š| ||
| 32 | C | 81.9 | Confident | 83.9 | Confident | 72 Ų | 72 | 105.4 Ų | 105.4 | 49% | 0.486 | 58% | 0.584 | S | S | . | * | trans | -109.1 | 116.7 | 179.8 | -63.5 | 0 | 0 | 0 | 0 | 109.2 | W36 | C32-W36 HydrophobicContact CB-CD2 4.4Å; C32-W36 HydrophobicContact CB-CG 3.9Å | ||
| 33 | E | 89.6 | Confident | 84.8 | Confident | 134 Ų | 134 | 100.4 Ų | 100.4 | 63% | 0.626 | 56% | 0.562 | S | S | * | * | trans | -65.6 | 158.2 | 173.7 | -67.5 | -57 | 141.8 | 0 | 0 | 111.4 | E35 W36 | E33-E35 PolarHBondContact O-N 2.94Å; E33-W36 WeakPolarHBondContact O-CB 3.46Å; E33-W36 VanDerWaalsContact O-CD1 3.31Å; E33-W36 PolarHBondContact O-N 3.35Å; E33-W36 VanDerWaalsContact O-N 3.1Å | ||
| 34 | P | 91.2 | Very high | 85.6 | Confident | 113 Ų | 113 | 101.2 Ų | 101.2 | 73% | 0.734 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51 | 134.3 | 172.1 | -25.9 | 35.1 | 0 | 0 | 0 | 111.2 | W36 | P34-W36 PolarHBondContact O-N 3.3Å; P34-W36 VanDerWaalsContact O-N 3.12Å |
| 35 | E | 92.7 | Very high | 86.4 | Confident | 112 Ų | 112 | 95.5 Ų | 95.5 | 52% | 0.523 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.6 | 21.3 | -179.4 | -57.6 | -176.5 | -176.7 | 0 | 0 | 115.4 | E33 F37 C38 | E33-E35 PolarHBondContact O-N 2.94Å; E35-F37 PolarHBondContact O-N 3.09Å; E35-C38 HydrophobicContact CB-CB 4.49Å; E35-C38 VanDerWaalsContact O-CB 3.27Å; E35-C38 WeakPolarHBondContact O-CB 3.28Å; E35-C38 PolarHBondContact O-N 3.3Å |
| 36 | W | 92.5 | Very high | 87 | Confident | 59 Ų | 59 | 98.1 Ų | 98.1 | 22% | 0.223 | 54% | 0.535 | C | S | . | . | G | 310 helix | trans | -46.9 | -34.2 | 177.5 | 68 | -85.7 | 0 | 0 | 0 | 113.8 | C32 E33 P34 C38 E39 A42 V54 F57 | C32-W36 HydrophobicContact CB-CD2 4.4Å; C32-W36 HydrophobicContact CB-CG 3.9Å; E33-W36 WeakPolarHBondContact O-CB 3.46Å; E33-W36 VanDerWaalsContact O-CD1 3.31Å; E33-W36 PolarHBondContact O-N 3.35Å; E33-W36 VanDerWaalsContact O-N 3.1Å; P34-W36 PolarHBondContact O-N 3.3Å; P34-W36 VanDerWaalsContact O-N 3.12Å; W36-C38 PolarHBondContact O-N 3.1Å; W36-E39 PolarHBondContact O-N 3.05Å; W36-A42 HydrophobicContact CE3-CB 3.98Å; W36-A42 HydrophobicContact CZ3-CB 3.99Å; W36-V54 HydrophobicContact CH2-CG2 3.76Å; W36-V54 HydrophobicContact CZ3-CG2 3.6Å; W36-F57 HydrophobicContact CZ2-CD2 4.1Å; W36-F57 HydrophobicContact CZ2-CE2 4.04Å |
| 37 | F | 93.5 | Very high | 87.5 | Confident | 28 Ų | 28 | 96.4 Ų | 96.4 | 12% | 0.123 | 52% | 0.518 | C | S | . | . | G | 310 helix | trans | -68.2 | -14.1 | 179.5 | 57.1 | -95.4 | 0 | 0 | 0 | 113.2 | E35 V54 F57 R58 L61 | E35-F37 PolarHBondContact O-N 3.09Å; F37-V54 HydrophobicContact CB-CG1 4.33Å; F37-V54 HydrophobicContact CB-CG2 4.37Å; F37-V54 WeakPolarHBondContact O-CG1 3.13Å; F37-F57 HydrophobicContact CB-CB 4.15Å; F37-F57 HydrophobicContact CB-CD2 4.39Å; F37-F57 HydrophobicContact CD1-CB 3.69Å; F37-F57 HydrophobicContact CD1-CD2 4.07Å; F37-F57 HydrophobicContact CD1-CG 4.16Å; F37-F57 HydrophobicContact CD2-CB 3.63Å; F37-F57 HydrophobicContact CE1-CB 3.93Å; F37-F57 HydrophobicContact CE1-CG 4.46Å; F37-F57 HydrophobicContact CE2-CB 3.87Å; F37-F57 HydrophobicContact CG-CB 3.54Å; F37-F57 HydrophobicContact CG-CD2 4.32Å; F37-F57 HydrophobicContact CG-CG 4.37Å; F37-F57 HydrophobicContact CZ-CB 4.02Å; F37-R58 HydrophobicContact CD2-CG 3.9Å; F37-R58 VanDerWaalsContact O-CZ 3.22Å; F37-R58 PolarHBondContact O-NE 3.08Å; F37-R58 PolarHBondContact O-NH2 3.4Å; F37-L61 HydrophobicContact CE2-CB 4.01Å; F37-L61 HydrophobicContact CE2-CD2 3.71Å; F37-L61 HydrophobicContact CE2-CG 4.49Å; F37-L61 HydrophobicContact CZ-CB 4.26Å; F37-L61 HydrophobicContact CZ-CD2 3.97Å |
| 38 | C | 93.1 | Very high | 88.1 | Confident | 60 Ų | 60 | 90 Ų | 90 | 41% | 0.405 | 50% | 0.501 | S | S | . | . | G | 310 helix | trans | -77.4 | -23.7 | 175.3 | -65.8 | 0 | 0 | 0 | 0 | 112.5 | E35 W36 R58 | E35-C38 HydrophobicContact CB-CB 4.49Å; E35-C38 VanDerWaalsContact O-CB 3.27Å; E35-C38 WeakPolarHBondContact O-CB 3.28Å; E35-C38 PolarHBondContact O-N 3.3Å; W36-C38 PolarHBondContact O-N 3.1Å; C38-R58 PolarHBondContact O-NH2 3.27Å |
| 39 | E | 91.2 | Very high | 88.8 | Confident | 112 Ų | 112 | 87 Ų | 87 | 52% | 0.523 | 49% | 0.485 | S | S | . | . | S | Bend | trans | -67.7 | 144.4 | 178.7 | -59.1 | -175.1 | -174.6 | 0 | 0 | 111.3 | W36 S41 A42 R58 | W36-E39 PolarHBondContact O-N 3.05Å; E39-S41 VanDerWaalsContact CB-OG 3.28Å; E39-S41 WeakPolarHBondContact CB-OG 3.29Å; E39-S41 PolarHBondContact O-N 3.16Å; E39-S41 PolarHBondContact OE2-OG 3.38Å; E39-S41 VanDerWaalsContact OE2-OG 3.06Å; E39-A42 VanDerWaalsContact O-CB 3.31Å; E39-A42 WeakPolarHBondContact O-CB 3.38Å; E39-A42 PolarHBondContact O-N 3.27Å; E39-R58 PolarHBondContact O-NH2 2.84Å |
| 40 | S | 88.7 | Confident | 89.3 | Confident | 100 Ų | 100 | 85.1 Ų | 85.1 | 70% | 0.699 | 47% | 0.465 | S | S | * | . | G | 310 helix | trans | -63.6 | -34.2 | 176.1 | 53.1 | 0 | 0 | 0 | 0 | 111.9 | A42 L43 | S40-A42 PolarHBondContact O-N 3.01Å; S40-A42 VanDerWaalsContact O-N 3.17Å; S40-L43 PolarHBondContact O-N 2.6Å; S40-L43 VanDerWaalsContact O-N 3.12Å |
| 41 | S | 89.6 | Confident | 90.1 | Very high | 55 Ų | 55 | 80.2 Ų | 80.2 | 39% | 0.385 | 44% | 0.444 | S | S | . | . | G | 310 helix | trans | -56.8 | -25.6 | 175.8 | 53.4 | 0 | 0 | 0 | 0 | 113.4 | E39 L43 D44 | E39-S41 VanDerWaalsContact CB-OG 3.28Å; E39-S41 WeakPolarHBondContact CB-OG 3.29Å; E39-S41 PolarHBondContact O-N 3.16Å; E39-S41 PolarHBondContact OE2-OG 3.38Å; E39-S41 VanDerWaalsContact OE2-OG 3.06Å; S41-L43 PolarHBondContact O-N 3.08Å; S41-L43 VanDerWaalsContact O-N 3.12Å; S41-D44 WeakPolarHBondContact CA-OD2 3.44Å; S41-D44 WeakPolarHBondContact O-CB 3.49Å; S41-D44 PolarHBondContact O-N 3Å |
| 42 | A | 88.8 | Confident | 90.9 | Very high | 16 Ų | 16 | 72.8 Ų | 72.8 | 13% | 0.132 | 40% | 0.404 | C | S | . | . | G | 310 helix | trans | -63.2 | -18.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | W36 E39 S40 V54 | W36-A42 HydrophobicContact CE3-CB 3.98Å; W36-A42 HydrophobicContact CZ3-CB 3.99Å; E39-A42 VanDerWaalsContact O-CB 3.31Å; E39-A42 WeakPolarHBondContact O-CB 3.38Å; E39-A42 PolarHBondContact O-N 3.27Å; S40-A42 PolarHBondContact O-N 3.01Å; S40-A42 VanDerWaalsContact O-N 3.17Å; A42-V54 HydrophobicContact CB-CG1 4.29Å; A42-V54 HydrophobicContact CB-CG2 3.82Å |
| 43 | L | 91.1 | Very high | 91.5 | Very high | 47 Ų | 47 | 72.9 Ų | 72.9 | 25% | 0.246 | 40% | 0.397 | C | S | . | . | G | 310 helix | trans | -96.8 | -3.1 | 176 | -64.8 | 176.4 | 0 | 0 | 0 | 113.4 | S40 S41 T45 K51 V54 F55 | S40-L43 PolarHBondContact O-N 2.6Å; S40-L43 VanDerWaalsContact O-N 3.12Å; S41-L43 PolarHBondContact O-N 3.08Å; S41-L43 VanDerWaalsContact O-N 3.12Å; L43-T45 PolarHBondContact O-N 3.04Å; L43-K51 HydrophobicContact CD2-CB 4.5Å; L43-K51 HydrophobicContact CD2-CG 4.22Å; L43-V54 HydrophobicContact CD2-CB 3.99Å; L43-V54 HydrophobicContact CD2-CG1 3.66Å; L43-V54 HydrophobicContact CG-CG1 4.14Å; L43-F55 HydrophobicContact CD1-CE1 4.46Å; L43-F55 HydrophobicContact CD1-CE2 4.35Å; L43-F55 HydrophobicContact CD1-CZ 3.81Å; L43-F55 HydrophobicContact CD2-CD2 4.29Å; L43-F55 HydrophobicContact CD2-CE2 3.7Å; L43-F55 HydrophobicContact CD2-CZ 4Å |
| 44 | D | 90.8 | Very high | 91.9 | Very high | 134 Ų | 134 | 66.5 Ų | 66.5 | 72% | 0.717 | 37% | 0.367 | S | S | * | . | trans | -79 | 60.1 | -179.8 | -63.5 | -14.7 | 0 | 0 | 0 | 110.5 | S41 | S41-D44 WeakPolarHBondContact CA-OD2 3.44Å; S41-D44 WeakPolarHBondContact O-CB 3.49Å; S41-D44 PolarHBondContact O-N 3Å | ||
| 45 | T | 88.9 | Confident | 92.2 | Very high | 48 Ų | 48 | 62.6 Ų | 62.6 | 29% | 0.294 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -149.1 | 152 | 179.6 | -179.5 | 0 | 0 | 0 | 0 | 109.7 | L43 D47 E50 K51 | L43-T45 PolarHBondContact O-N 3.04Å; T45-D47 VanDerWaalsContact C-N 3.34Å; T45-D47 WeakPolarHBondContact OG1-CB 3.37Å; T45-D47 PolarHBondContact OG1-N 3.22Å; T45-D47 VanDerWaalsContact OG1-N 3.14Å; T45-E50 HydrophobicContact CG2-CB 3.88Å; T45-K51 HydrophobicContact CG2-CG 4.32Å; T45-K51 WeakPolarHBondContact O-CE 3.46Å; T45-K51 PolarHBondContact O-NZ 3.27Å |
| 46 | D | 89.4 | Confident | 92.4 | Very high | 161 Ų | 161 | 58.9 Ų | 58.9 | 86% | 0.861 | 32% | 0.32 | S | S | * | . | S | Bend | trans | -90.2 | -5.5 | 171.3 | -68.5 | -37.7 | 0 | 0 | 0 | 112.4 | S48 | D46-S48 PolarHBondContact O-N 3.39Š|
| 47 | D | 91.2 | Very high | 92.6 | Very high | 69 Ų | 69 | 59.7 Ų | 59.7 | 37% | 0.369 | 33% | 0.326 | S | S | . | . | trans | -73.4 | 112.1 | 179.2 | -170.7 | -15.2 | 0 | 0 | 0 | 111.3 | T45 L49 E50 K51 | T45-D47 VanDerWaalsContact C-N 3.34Å; T45-D47 WeakPolarHBondContact OG1-CB 3.37Å; T45-D47 PolarHBondContact OG1-N 3.22Å; T45-D47 VanDerWaalsContact OG1-N 3.14Å; D47-L49 VanDerWaalsContact C-N 3.27Å; D47-L49 PolarHBondContact O-N 2.91Å; D47-L49 VanDerWaalsContact OD1-CB 3.31Å; D47-L49 WeakPolarHBondContact OD1-CB 3.41Å; D47-L49 PolarHBondContact OD1-N 3.5Å; D47-E50 HydrophobicContact CB-CB 4.1Å; D47-E50 HydrophobicContact CB-CG 3.88Å; D47-E50 PolarHBondContact O-N 2.94Å; D47-E50 WeakPolarHBondContact OD2-CG 3.48Å; D47-K51 PolarHBondContact O-N 3Å; D47-K51 VanDerWaalsContact O-N 3.14Å | ||
| 48 | S | 92.1 | Very high | 92.8 | Very high | 61 Ų | 61 | 61.2 Ų | 61.2 | 43% | 0.427 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.7 | -33.7 | 178 | 57.2 | 0 | 0 | 0 | 0 | 112.7 | D46 E50 K51 Q52 | D46-S48 PolarHBondContact O-N 3.39Å; S48-E50 VanDerWaalsContact C-N 3.35Å; S48-K51 PolarHBondContact O-N 3.27Å; S48-Q52 WeakPolarHBondContact O-CB 3.36Å; S48-Q52 PolarHBondContact O-N 2.87Å |
| 49 | L | 91.8 | Very high | 93.1 | Very high | 76 Ų | 76 | 58.3 Ų | 58.3 | 40% | 0.398 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -68.7 | -36.3 | 178.9 | 178.3 | 61.6 | 0 | 0 | 0 | 111.2 | D47 Q52 K53 | D47-L49 VanDerWaalsContact C-N 3.27Å; D47-L49 PolarHBondContact O-N 2.91Å; D47-L49 VanDerWaalsContact OD1-CB 3.31Å; D47-L49 WeakPolarHBondContact OD1-CB 3.41Å; D47-L49 PolarHBondContact OD1-N 3.5Å; L49-Q52 WeakPolarHBondContact O-CB 3.16Å; L49-K53 VanDerWaalsContact O-CG 3.31Å; L49-K53 WeakPolarHBondContact O-CG 3.44Å; L49-K53 PolarHBondContact O-N 2.96Å |
| 50 | E | 91.6 | Very high | 93.4 | Very high | 26 Ų | 26 | 55 Ų | 55 | 12% | 0.121 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -70.8 | -42.2 | 176.5 | -64.3 | -67.6 | 111.3 | 0 | 0 | 110.8 | K30 T45 D47 S48 Q52 K53 V54 | K30-E50 VanDerWaalsContact NZ-CD 3.26Å; K30-E50 IonicContact NZ-OE1 3.73Å; K30-E50 IonicContact NZ-OE2 2.71Å; K30-E50 PolarHBondContact NZ-OE2 3.31Å; T45-E50 HydrophobicContact CG2-CB 3.88Å; D47-E50 HydrophobicContact CB-CB 4.1Å; D47-E50 HydrophobicContact CB-CG 3.88Å; D47-E50 PolarHBondContact O-N 2.94Å; D47-E50 WeakPolarHBondContact OD2-CG 3.48Å; S48-E50 VanDerWaalsContact C-N 3.35Å; E50-Q52 VanDerWaalsContact C-N 3.34Å; E50-Q52 PolarHBondContact O-N 2.92Å; E50-K53 PolarHBondContact O-N 3.36Å; E50-K53 IonicContact OE1-NZ 3.43Å; E50-K53 PolarHBondContact OE1-NZ 3.25Å; E50-V54 WeakPolarHBondContact O-CG2 3.41Å; E50-V54 PolarHBondContact O-N 2.75Å |
| 51 | K | 94.5 | Very high | 93.9 | Very high | 35 Ų | 35 | 52 Ų | 52 | 15% | 0.152 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.3 | -45.7 | 172 | -70.4 | -179.4 | 179 | 158.4 | 0 | 111.9 | L43 T45 D47 S48 K53 V54 F55 W81 | L43-K51 HydrophobicContact CD2-CB 4.5Å; L43-K51 HydrophobicContact CD2-CG 4.22Å; T45-K51 HydrophobicContact CG2-CG 4.32Å; T45-K51 WeakPolarHBondContact O-CE 3.46Å; T45-K51 PolarHBondContact O-NZ 3.27Å; D47-K51 PolarHBondContact O-N 3Å; D47-K51 VanDerWaalsContact O-N 3.14Å; S48-K51 PolarHBondContact O-N 3.27Å; K51-K53 PolarHBondContact O-N 2.85Å; K51-V54 PolarHBondContact O-N 2.88Å; K51-F55 VanDerWaalsContact O-CD2 3.22Å; K51-F55 WeakPolarHBondContact O-CD2 3.39Å; K51-F55 PolarHBondContact O-N 3.15Å; K51-W81 HydrophobicContact CB-CD2 3.93Å; K51-W81 HydrophobicContact CB-CE3 4.29Å; K51-W81 HydrophobicContact CB-CG 4.09Å; K51-W81 HydrophobicContact CD-CD2 4.12Å; K51-W81 HydrophobicContact CD-CE3 4Å; K51-W81 HydrophobicContact CD-CH2 3.57Å; K51-W81 HydrophobicContact CD-CZ2 3.68Å; K51-W81 HydrophobicContact CD-CZ3 3.73Å |
| 52 | Q | 95.9 | Very high | 94.3 | Very high | 10 Ų | 10 | 49.7 Ų | 49.7 | 5% | 0.047 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -54.6 | -50.5 | 175 | -178.2 | -167.4 | -0.2 | 0 | 0 | 111.3 | S48 L49 E50 V54 F55 K56 C78 W81 I82 | S48-Q52 WeakPolarHBondContact O-CB 3.36Å; S48-Q52 PolarHBondContact O-N 2.87Å; L49-Q52 WeakPolarHBondContact O-CB 3.16Å; E50-Q52 VanDerWaalsContact C-N 3.34Å; E50-Q52 PolarHBondContact O-N 2.92Å; Q52-V54 PolarHBondContact O-N 3.17Å; Q52-F55 PolarHBondContact O-N 2.93Å; Q52-K56 WeakPolarHBondContact O-CB 3.35Å; Q52-K56 PolarHBondContact O-N 2.97Å; Q52-C78 PolarHBondContact O-SG 3.24Å; Q52-W81 HydrophobicContact CB-CB 3.92Å; Q52-I82 HydrophobicContact CG-CG1 4.02Å |
| 53 | K | 94.5 | Very high | 94.7 | Very high | 74 Ų | 74 | 51.5 Ų | 51.5 | 32% | 0.322 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.3 | -44.9 | 179.1 | -72.7 | 169.4 | -171.5 | 166.1 | 0 | 112.2 | L49 E50 K51 K56 F57 | L49-K53 VanDerWaalsContact O-CG 3.31Å; L49-K53 WeakPolarHBondContact O-CG 3.44Å; L49-K53 PolarHBondContact O-N 2.96Å; E50-K53 PolarHBondContact O-N 3.36Å; E50-K53 IonicContact OE1-NZ 3.43Å; E50-K53 PolarHBondContact OE1-NZ 3.25Å; K51-K53 PolarHBondContact O-N 2.85Å; K53-K56 PolarHBondContact O-N 2.86Å; K53-F57 HydrophobicContact CB-CE2 4.22Å; K53-F57 WeakPolarHBondContact O-CD2 3.42Å; K53-F57 WeakPolarHBondContact O-CG 3.27Å; K53-F57 PolarHBondContact O-N 3.02Å |
| 54 | V | 96.2 | Very high | 95.1 | Very high | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.9 | -50.9 | 179.5 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | W36 F37 A42 L43 E50 K51 Q52 K56 F57 R58 | W36-V54 HydrophobicContact CH2-CG2 3.76Å; W36-V54 HydrophobicContact CZ3-CG2 3.6Å; F37-V54 HydrophobicContact CB-CG1 4.33Å; F37-V54 HydrophobicContact CB-CG2 4.37Å; F37-V54 WeakPolarHBondContact O-CG1 3.13Å; A42-V54 HydrophobicContact CB-CG1 4.29Å; A42-V54 HydrophobicContact CB-CG2 3.82Å; L43-V54 HydrophobicContact CD2-CB 3.99Å; L43-V54 HydrophobicContact CD2-CG1 3.66Å; L43-V54 HydrophobicContact CG-CG1 4.14Å; E50-V54 WeakPolarHBondContact O-CG2 3.41Å; E50-V54 PolarHBondContact O-N 2.75Å; K51-V54 PolarHBondContact O-N 2.88Å; Q52-V54 PolarHBondContact O-N 3.17Å; V54-K56 PolarHBondContact O-N 3.47Å; V54-F57 PolarHBondContact O-N 3.35Å; V54-R58 WeakPolarHBondContact O-CG 3.38Å; V54-R58 PolarHBondContact O-N 3.49Å |
| 55 | F | 97.9 | Very high | 95.4 | Very high | 31 Ų | 31 | 59.7 Ų | 59.7 | 14% | 0.136 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -66.5 | -37.6 | -180 | -76 | -64.8 | 0 | 0 | 0 | 112.9 | L43 K51 Q52 R58 G59 T77 C78 W81 | L43-F55 HydrophobicContact CD1-CE1 4.46Å; L43-F55 HydrophobicContact CD1-CE2 4.35Å; L43-F55 HydrophobicContact CD1-CZ 3.81Å; L43-F55 HydrophobicContact CD2-CD2 4.29Å; L43-F55 HydrophobicContact CD2-CE2 3.7Å; L43-F55 HydrophobicContact CD2-CZ 4Å; K51-F55 VanDerWaalsContact O-CD2 3.22Å; K51-F55 WeakPolarHBondContact O-CD2 3.39Å; K51-F55 PolarHBondContact O-N 3.15Å; Q52-F55 PolarHBondContact O-N 2.93Å; F55-R58 PolarHBondContact O-N 2.69Å; F55-G59 PolarHBondContact O-N 3.46Å; F55-T77 HydrophobicContact CD1-CG2 3.79Å; F55-T77 HydrophobicContact CD2-CG2 3.78Å; F55-T77 HydrophobicContact CE1-CG2 3.56Å; F55-T77 HydrophobicContact CE2-CG2 3.56Å; F55-T77 HydrophobicContact CG-CG2 3.91Å; F55-T77 HydrophobicContact CZ-CG2 3.45Å; F55-T77 VanDerWaalsContact CZ-CG2 3.45Å; F55-C78 HydrophobicContact CB-CB 3.67Å; F55-W81 AromaticContact CD2-CD1 3.85Å; F55-W81 AromaticContact CD2-NE1 3.97Å; F55-W81 AromaticContact CE2-NE1 3.74Å |
| 56 | K | 97.4 | Very high | 95.8 | Very high | 34 Ų | 34 | 59 Ų | 59 | 15% | 0.148 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -57.4 | -51.9 | 172.3 | -172.7 | -156.2 | -171.3 | -67.6 | 0 | 111.2 | Q52 K53 V54 R58 G59 D60 D92 | Q52-K56 WeakPolarHBondContact O-CB 3.35Å; Q52-K56 PolarHBondContact O-N 2.97Å; K53-K56 PolarHBondContact O-N 2.86Å; V54-K56 PolarHBondContact O-N 3.47Å; K56-R58 PolarHBondContact O-N 3.3Å; K56-G59 PolarHBondContact O-N 3.22Å; K56-G59 VanDerWaalsContact O-N 3.16Å; K56-D60 IonicContact NZ-OD1 2.86Å; K56-D60 IonicContact NZ-OD2 3.74Å; K56-D60 PolarHBondContact NZ-OD2 3.41Å; K56-D60 VanDerWaalsContact O-CG 3.3Å; K56-D60 PolarHBondContact O-N 2.76Å; K56-D92 WeakPolarHBondContact CE-OD2 3.33Å; K56-D92 IonicContact NZ-OD2 2.74Å; K56-D92 PolarHBondContact NZ-OD2 2.93Å |
| 57 | F | 97.1 | Very high | 96.3 | Very high | 76 Ų | 76 | 53.9 Ų | 53.9 | 33% | 0.333 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -66 | -36.8 | -178.3 | -67.1 | -38.7 | 0 | 0 | 0 | 112.9 | W36 F37 K53 V54 G59 D60 L61 | W36-F57 HydrophobicContact CZ2-CD2 4.1Å; W36-F57 HydrophobicContact CZ2-CE2 4.04Å; F37-F57 HydrophobicContact CB-CB 4.15Å; F37-F57 HydrophobicContact CB-CD2 4.39Å; F37-F57 HydrophobicContact CD1-CB 3.69Å; F37-F57 HydrophobicContact CD1-CD2 4.07Å; F37-F57 HydrophobicContact CD1-CG 4.16Å; F37-F57 HydrophobicContact CD2-CB 3.63Å; F37-F57 HydrophobicContact CE1-CB 3.93Å; F37-F57 HydrophobicContact CE1-CG 4.46Å; F37-F57 HydrophobicContact CE2-CB 3.87Å; F37-F57 HydrophobicContact CG-CB 3.54Å; F37-F57 HydrophobicContact CG-CD2 4.32Å; F37-F57 HydrophobicContact CG-CG 4.37Å; F37-F57 HydrophobicContact CZ-CB 4.02Å; K53-F57 HydrophobicContact CB-CE2 4.22Å; K53-F57 WeakPolarHBondContact O-CD2 3.42Å; K53-F57 WeakPolarHBondContact O-CG 3.27Å; K53-F57 PolarHBondContact O-N 3.02Å; V54-F57 PolarHBondContact O-N 3.35Å; F57-G59 VanDerWaalsContact C-N 3.33Å; F57-D60 PolarHBondContact O-N 3.39Å; F57-L61 WeakPolarHBondContact O-CB 3.45Å; F57-L61 PolarHBondContact O-N 3.03Å |
| 58 | R | 97.9 | Very high | 96.6 | Very high | 60 Ų | 60 | 53.8 Ų | 53.8 | 23% | 0.226 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.6 | -43 | 171.3 | -73.6 | -179.7 | 179.5 | 175.6 | 2.9 | 111.7 | F37 C38 E39 V54 F55 K56 A62 A74 | F37-R58 HydrophobicContact CD2-CG 3.9Å; F37-R58 VanDerWaalsContact O-CZ 3.22Å; F37-R58 PolarHBondContact O-NE 3.08Å; F37-R58 PolarHBondContact O-NH2 3.4Å; C38-R58 PolarHBondContact O-NH2 3.27Å; E39-R58 PolarHBondContact O-NH2 2.84Å; V54-R58 WeakPolarHBondContact O-CG 3.38Å; V54-R58 PolarHBondContact O-N 3.49Å; F55-R58 PolarHBondContact O-N 2.69Å; K56-R58 PolarHBondContact O-N 3.3Å; R58-A62 VanDerWaalsContact O-CB 3.28Å; R58-A62 WeakPolarHBondContact O-CB 2.95Å; R58-A62 PolarHBondContact O-N 3.33Å; R58-A74 HydrophobicContact CB-CB 4.24Å |
| 59 | G | 98.3 | Very high | 96.9 | Very high | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.6 | -50.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F55 K56 F57 L61 A62 F63 A71 | F55-G59 PolarHBondContact O-N 3.46Å; K56-G59 PolarHBondContact O-N 3.22Å; K56-G59 VanDerWaalsContact O-N 3.16Å; F57-G59 VanDerWaalsContact C-N 3.33Å; G59-L61 VanDerWaalsContact C-N 3.33Å; G59-L61 PolarHBondContact O-N 3.03Å; G59-A62 PolarHBondContact O-N 3.22Å; G59-F63 WeakPolarHBondContact O-CB 3.35Å; G59-F63 PolarHBondContact O-N 2.84Å; G59-A71 WeakPolarHBondContact O-CB 3.33Å |
| 60 | D | 98.3 | Very high | 97.2 | Very high | 43 Ų | 43 | 58.9 Ų | 58.9 | 23% | 0.23 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.7 | -42.4 | 178.9 | -66.4 | -16.2 | 0 | 0 | 0 | 111.8 | K56 F57 R64 Y75 | K56-D60 IonicContact NZ-OD1 2.86Å; K56-D60 IonicContact NZ-OD2 3.74Å; K56-D60 PolarHBondContact NZ-OD2 3.41Å; K56-D60 VanDerWaalsContact O-CG 3.3Å; K56-D60 PolarHBondContact O-N 2.76Å; F57-D60 PolarHBondContact O-N 3.39Å; D60-R64 WeakPolarHBondContact O-CG 3.49Å; D60-R64 PolarHBondContact O-N 2.81Å; D60-Y75 WeakPolarHBondContact CA-OH 3.23Å; D60-Y75 PolarHBondContact N-OH 3.33Å; D60-Y75 WeakPolarHBondContact OD1-CE1 3.38Å; D60-Y75 PolarHBondContact OD1-OH 3.43Å |
| 61 | L | 98.1 | Very high | 97.6 | Very high | 35 Ų | 35 | 57.6 Ų | 57.6 | 18% | 0.183 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.5 | -47.6 | 177.7 | -177.1 | 63.5 | 0 | 0 | 0 | 111.7 | F37 F57 G59 F63 R64 H65 | F37-L61 HydrophobicContact CE2-CB 4.01Å; F37-L61 HydrophobicContact CE2-CD2 3.71Å; F37-L61 HydrophobicContact CE2-CG 4.49Å; F37-L61 HydrophobicContact CZ-CB 4.26Å; F37-L61 HydrophobicContact CZ-CD2 3.97Å; F57-L61 WeakPolarHBondContact O-CB 3.45Å; F57-L61 PolarHBondContact O-N 3.03Å; G59-L61 VanDerWaalsContact C-N 3.33Å; G59-L61 PolarHBondContact O-N 3.03Å; L61-F63 VanDerWaalsContact C-N 3.3Å; L61-F63 PolarHBondContact O-N 3.48Å; L61-R64 PolarHBondContact O-N 3.48Å; L61-R64 VanDerWaalsContact O-N 3.15Å; L61-H65 PolarHBondContact O-N 3.22Å |
| 62 | A | 98.4 | Very high | 97.8 | Very high | 8 Ų | 8 | 56.3 Ų | 56.3 | 7% | 0.066 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.3 | -40.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | R58 G59 R64 H65 G66 D67 R70 A71 | R58-A62 VanDerWaalsContact O-CB 3.28Å; R58-A62 WeakPolarHBondContact O-CB 2.95Å; R58-A62 PolarHBondContact O-N 3.33Å; G59-A62 PolarHBondContact O-N 3.22Å; A62-R64 VanDerWaalsContact C-N 3.34Å; A62-R64 PolarHBondContact O-N 3.39Å; A62-H65 PolarHBondContact O-N 3.12Å; A62-H65 VanDerWaalsContact O-N 3.17Å; A62-G66 PolarHBondContact O-N 3.19Å; A62-G66 VanDerWaalsContact O-N 3.16Å; A62-D67 PolarHBondContact O-N 2.99Å; A62-R70 HydrophobicContact CB-CB 4.24Å; A62-R70 HydrophobicContact CB-CG 4.08Å; A62-A71 HydrophobicContact CB-CB 3.84Å |
| 63 | F | 98.4 | Very high | 97.9 | Very high | 53 Ų | 53 | 59.9 Ų | 59.9 | 23% | 0.232 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.3 | -43.5 | 175.2 | -174.3 | -87.7 | 0 | 0 | 0 | 111.7 | G59 L61 H65 G66 Y68 A71 R99 K103 | G59-F63 WeakPolarHBondContact O-CB 3.35Å; G59-F63 PolarHBondContact O-N 2.84Å; L61-F63 VanDerWaalsContact C-N 3.3Å; L61-F63 PolarHBondContact O-N 3.48Å; F63-H65 VanDerWaalsContact C-N 3.3Å; F63-H65 PolarHBondContact O-N 3.37Å; F63-G66 PolarHBondContact O-N 3.17Å; F63-G66 VanDerWaalsContact O-N 3.09Å; F63-Y68 AromaticContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CE1 4.07Å; F63-Y68 AromaticContact CE2-CD1 3.96Å; F63-Y68 HydrophobicContact CE2-CD1 3.96Å; F63-Y68 AromaticContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CZ-CE1 4.35Å; F63-A71 HydrophobicContact CB-CB 4.04Å; F63-R99 HydrophobicContact CE2-CB 3.78Å; F63-R99 HydrophobicContact CZ-CB 4.03Å; F63-K103 HydrophobicContact CE2-CG 4.47Å |
| 64 | R | 97.6 | Very high | 98.1 | Very high | 215 Ų | 215 | 56.9 Ų | 56.9 | 81% | 0.811 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -64.3 | -32.9 | 176.4 | -73.5 | -174.9 | -174.5 | -157.1 | 3.6 | 113 | D60 L61 A62 G66 | D60-R64 WeakPolarHBondContact O-CG 3.49Å; D60-R64 PolarHBondContact O-N 2.81Å; L61-R64 PolarHBondContact O-N 3.48Å; L61-R64 VanDerWaalsContact O-N 3.15Å; A62-R64 VanDerWaalsContact C-N 3.34Å; A62-R64 PolarHBondContact O-N 3.39Å; R64-G66 PolarHBondContact O-N 2.9Å |
| 65 | H | 98 | Very high | 98.2 | Very high | 139 Ų | 139 | 57.3 Ų | 57.3 | 64% | 0.644 | 26% | 0.262 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.5 | -6 | 174.2 | -69 | 162.2 | 0 | 0 | 0 | 113.9 | L61 A62 F63 D67 | L61-H65 PolarHBondContact O-N 3.22Å; A62-H65 PolarHBondContact O-N 3.12Å; A62-H65 VanDerWaalsContact O-N 3.17Å; F63-H65 VanDerWaalsContact C-N 3.3Å; F63-H65 PolarHBondContact O-N 3.37Å; H65-D67 VanDerWaalsContact C-N 3.28Å |
| 66 | G | 98 | Very high | 98.2 | Very high | 33 Ų | 33 | 57.8 Ų | 57.8 | 34% | 0.34 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 79.7 | 7.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | A62 F63 R64 Y68 | A62-G66 PolarHBondContact O-N 3.19Å; A62-G66 VanDerWaalsContact O-N 3.16Å; F63-G66 PolarHBondContact O-N 3.17Å; F63-G66 VanDerWaalsContact O-N 3.09Å; R64-G66 PolarHBondContact O-N 2.9Å; G66-Y68 VanDerWaalsContact C-N 3.28Å; G66-Y68 VanDerWaalsContact O-CD2 3.3Å; G66-Y68 WeakPolarHBondContact O-CD2 3.48Å; G66-Y68 WeakPolarHBondContact O-CE2 3.46Å; G66-Y68 PolarHBondContact O-N 3.28Å; G66-Y68 VanDerWaalsContact O-N 3.08Å |
| 67 | D | 98.3 | Very high | 98.2 | Very high | 54 Ų | 54 | 58.2 Ų | 58.2 | 29% | 0.289 | 28% | 0.275 | S | S | . | . | trans | -85.5 | 73.3 | 174.6 | -170.9 | -9.4 | 0 | 0 | 0 | 109.4 | A62 H65 Q69 R70 A71 | A62-D67 PolarHBondContact O-N 2.99Å; H65-D67 VanDerWaalsContact C-N 3.28Å; D67-Q69 VanDerWaalsContact C-N 3.31Å; D67-Q69 PolarHBondContact O-N 3.48Å; D67-R70 HydrophobicContact CB-CB 4.27Å; D67-R70 PolarHBondContact O-N 3.29Å; D67-R70 VanDerWaalsContact OD1-CB 3.25Å; D67-R70 WeakPolarHBondContact OD1-CB 3.25Å; D67-R70 PolarHBondContact OD1-N 2.91Å; D67-R70 WeakPolarHBondContact OD2-CB 3.45Å; D67-R70 WeakPolarHBondContact OD2-CD 3.4Å; D67-R70 IonicContact OD2-CZ 2.6Å; D67-R70 VanDerWaalsContact OD2-CZ 3.26Å; D67-R70 IonicContact OD2-NE 3.09Å; D67-R70 PolarHBondContact OD2-NE 2.8Å; D67-R70 IonicContact OD2-NH1 3.08Å; D67-R70 PolarHBondContact OD2-NH1 2.94Å; D67-A71 WeakPolarHBondContact O-CB 3.42Å; D67-A71 PolarHBondContact O-N 2.79Å | ||
| 68 | Y | 98.6 | Very high | 98.2 | Very high | 66 Ų | 66 | 54.6 Ų | 54.6 | 26% | 0.259 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -68.2 | -28.8 | -170.9 | -54.1 | -58.1 | 0 | 0 | 0 | 113.4 | F63 G66 L72 K103 | F63-Y68 AromaticContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CD1 3.82Å; F63-Y68 HydrophobicContact CD2-CE1 4.07Å; F63-Y68 AromaticContact CE2-CD1 3.96Å; F63-Y68 HydrophobicContact CE2-CD1 3.96Å; F63-Y68 AromaticContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CE2-CE1 3.99Å; F63-Y68 HydrophobicContact CZ-CE1 4.35Å; G66-Y68 VanDerWaalsContact C-N 3.28Å; G66-Y68 VanDerWaalsContact O-CD2 3.3Å; G66-Y68 WeakPolarHBondContact O-CD2 3.48Å; G66-Y68 WeakPolarHBondContact O-CE2 3.46Å; G66-Y68 PolarHBondContact O-N 3.28Å; G66-Y68 VanDerWaalsContact O-N 3.08Å; Y68-L72 WeakPolarHBondContact O-CB 3.32Å; Y68-L72 PolarHBondContact O-N 3.35Å; Y68-K103 HydrophobicContact CD1-CB 3.82Å; Y68-K103 HydrophobicContact CD1-CG 4.04Å; Y68-K103 HydrophobicContact CD2-CB 3.43Å; Y68-K103 VanDerWaalsContact CD2-CB 3.43Å; Y68-K103 HydrophobicContact CD2-CG 4.3Å; Y68-K103 HydrophobicContact CE1-CB 3.93Å; Y68-K103 HydrophobicContact CE1-CD 4.49Å; Y68-K103 HydrophobicContact CE1-CG 3.76Å; Y68-K103 HydrophobicContact CE2-CB 3.54Å; Y68-K103 HydrophobicContact CE2-CD 4.33Å; Y68-K103 HydrophobicContact CE2-CG 4.02Å; Y68-K103 HydrophobicContact CG-CB 3.57Å; Y68-K103 HydrophobicContact CG-CG 4.3Å |
| 69 | Q | 98.6 | Very high | 98.2 | Very high | 82 Ų | 82 | 53.7 Ų | 53.7 | 38% | 0.383 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -68.9 | -48.9 | 175.7 | -174.2 | 60.5 | 55 | 0 | 0 | 110.3 | D67 A71 L72 D73 L104 | D67-Q69 VanDerWaalsContact C-N 3.31Å; D67-Q69 PolarHBondContact O-N 3.48Å; Q69-A71 VanDerWaalsContact C-N 3.26Å; Q69-A71 PolarHBondContact O-N 2.96Å; Q69-L72 WeakPolarHBondContact O-CB 3.41Å; Q69-L72 PolarHBondContact O-N 3.3Å; Q69-L72 VanDerWaalsContact O-N 3.16Å; Q69-D73 PolarHBondContact NE2-OD1 3.27Å; Q69-D73 PolarHBondContact O-N 2.97Å; Q69-L104 HydrophobicContact CB-CD2 4.44Å |
| 70 | R | 98.4 | Very high | 98 | Very high | 162 Ų | 162 | 60.8 Ų | 60.8 | 61% | 0.611 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -61.5 | -37.2 | 175.5 | -178.5 | 177.4 | -77.5 | 153 | -14 | 112 | A62 D67 D73 A74 | A62-R70 HydrophobicContact CB-CB 4.24Å; A62-R70 HydrophobicContact CB-CG 4.08Å; D67-R70 HydrophobicContact CB-CB 4.27Å; D67-R70 PolarHBondContact O-N 3.29Å; D67-R70 VanDerWaalsContact OD1-CB 3.25Å; D67-R70 WeakPolarHBondContact OD1-CB 3.25Å; D67-R70 PolarHBondContact OD1-N 2.91Å; D67-R70 WeakPolarHBondContact OD2-CB 3.45Å; D67-R70 WeakPolarHBondContact OD2-CD 3.4Å; D67-R70 IonicContact OD2-CZ 2.6Å; D67-R70 VanDerWaalsContact OD2-CZ 3.26Å; D67-R70 IonicContact OD2-NE 3.09Å; D67-R70 PolarHBondContact OD2-NE 2.8Å; D67-R70 IonicContact OD2-NH1 3.08Å; D67-R70 PolarHBondContact OD2-NH1 2.94Å; R70-D73 PolarHBondContact O-N 3.5Å; R70-A74 WeakPolarHBondContact O-CB 3.38Å; R70-A74 PolarHBondContact O-N 3.26Å |
| 71 | A | 98.7 | Very high | 97.9 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.6 | -47 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | G59 A62 F63 D67 Q69 D73 A74 Y75 C100 | G59-A71 WeakPolarHBondContact O-CB 3.33Å; A62-A71 HydrophobicContact CB-CB 3.84Å; F63-A71 HydrophobicContact CB-CB 4.04Å; D67-A71 WeakPolarHBondContact O-CB 3.42Å; D67-A71 PolarHBondContact O-N 2.79Å; Q69-A71 VanDerWaalsContact C-N 3.26Å; Q69-A71 PolarHBondContact O-N 2.96Å; A71-D73 PolarHBondContact O-N 3.13Å; A71-A74 PolarHBondContact O-N 2.86Å; A71-Y75 HydrophobicContact CB-CE2 4.31Å; A71-Y75 WeakPolarHBondContact O-CD2 3.27Å; A71-Y75 PolarHBondContact O-N 3.33Å; A71-C100 VanDerWaalsContact CB-SG 3.56Å |
| 72 | L | 98.6 | Very high | 97.7 | Very high | 8 Ų | 8 | 61.7 Ų | 61.7 | 4% | 0.042 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.5 | -42.8 | 177.5 | -176.2 | 59.8 | 0 | 0 | 0 | 112.1 | Y68 Q69 Y75 S76 M97 C100 L104 | Y68-L72 WeakPolarHBondContact O-CB 3.32Å; Y68-L72 PolarHBondContact O-N 3.35Å; Q69-L72 WeakPolarHBondContact O-CB 3.41Å; Q69-L72 PolarHBondContact O-N 3.3Å; Q69-L72 VanDerWaalsContact O-N 3.16Å; L72-Y75 PolarHBondContact O-N 2.97Å; L72-S76 VanDerWaalsContact O-CB 3.32Å; L72-S76 WeakPolarHBondContact O-CB 3.49Å; L72-S76 PolarHBondContact O-N 3.49Å; L72-S76 PolarHBondContact O-OG 3.22Å; L72-M97 HydrophobicContact CD1-CB 3.79Å; L72-M97 HydrophobicContact CD1-CE 4.1Å; L72-M97 HydrophobicContact CD1-CG 3.93Å; L72-C100 HydrophobicContact CB-CB 3.96Å; L72-C100 HydrophobicContact CD1-CB 4.33Å; L72-L104 HydrophobicContact CD2-CD1 4.03Å |
| 73 | D | 98.5 | Very high | 97.3 | Very high | 85 Ų | 85 | 63.9 Ų | 63.9 | 46% | 0.455 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.1 | -42.3 | 177.6 | -61.9 | -20.3 | 0 | 0 | 0 | 111.2 | Q69 R70 A71 S76 T77 | Q69-D73 PolarHBondContact NE2-OD1 3.27Å; Q69-D73 PolarHBondContact O-N 2.97Å; R70-D73 PolarHBondContact O-N 3.5Å; A71-D73 PolarHBondContact O-N 3.13Å; D73-S76 PolarHBondContact O-N 2.86Å; D73-T77 PolarHBondContact O-N 2.94Å; D73-T77 PolarHBondContact O-OG1 3.48Å |
| 74 | A | 98.4 | Very high | 96.8 | Very high | 10 Ų | 10 | 67.7 Ų | 67.7 | 8% | 0.083 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.9 | -44 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | R58 R70 A71 T77 C78 | R58-A74 HydrophobicContact CB-CB 4.24Å; R70-A74 WeakPolarHBondContact O-CB 3.38Å; R70-A74 PolarHBondContact O-N 3.26Å; A71-A74 PolarHBondContact O-N 2.86Å; A74-T77 PolarHBondContact O-N 2.96Å; A74-C78 WeakPolarHBondContact O-CB 3.41Å; A74-C78 PolarHBondContact O-N 3.46Å |
| 75 | Y | 98.6 | Very high | 96.3 | Very high | 9 Ų | 9 | 64.2 Ų | 64.2 | 4% | 0.035 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64.3 | -40.6 | 174.5 | -72.4 | -47.9 | 0 | 0 | 0 | 112.5 | D60 A71 L72 T77 C78 L79 V93 M97 | D60-Y75 WeakPolarHBondContact CA-OH 3.23Å; D60-Y75 PolarHBondContact N-OH 3.33Å; D60-Y75 WeakPolarHBondContact OD1-CE1 3.38Å; D60-Y75 PolarHBondContact OD1-OH 3.43Å; A71-Y75 HydrophobicContact CB-CE2 4.31Å; A71-Y75 WeakPolarHBondContact O-CD2 3.27Å; A71-Y75 PolarHBondContact O-N 3.33Å; L72-Y75 PolarHBondContact O-N 2.97Å; Y75-T77 VanDerWaalsContact C-N 3.28Å; Y75-T77 PolarHBondContact O-N 3.12Å; Y75-C78 VanDerWaalsContact O-CB 3.31Å; Y75-C78 WeakPolarHBondContact O-CB 3.24Å; Y75-C78 PolarHBondContact O-N 3.46Å; Y75-C78 VanDerWaalsContact O-N 3.16Å; Y75-L79 PolarHBondContact O-N 3.22Å; Y75-V93 HydrophobicContact CD1-CG1 4.15Å; Y75-V93 HydrophobicContact CD1-CG2 4.41Å; Y75-V93 HydrophobicContact CG-CG1 4.39Å; Y75-V93 WeakPolarHBondContact O-CG1 3.32Å; Y75-M97 VanDerWaalsContact CB-CG 3.42Å; Y75-M97 HydrophobicContact CD2-CG 4.35Å; Y75-M97 HydrophobicContact CG-CG 4.18Å |
| 76 | S | 98 | Very high | 95.9 | Very high | 42 Ų | 42 | 59.8 Ų | 59.8 | 29% | 0.294 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61.5 | -39.2 | 175.7 | -59.4 | 0 | 0 | 0 | 0 | 111.5 | L72 D73 | L72-S76 VanDerWaalsContact O-CB 3.32Å; L72-S76 WeakPolarHBondContact O-CB 3.49Å; L72-S76 PolarHBondContact O-N 3.49Å; L72-S76 PolarHBondContact O-OG 3.22Å; D73-S76 PolarHBondContact O-N 2.86Å |
| 77 | T | 97.8 | Very high | 95.6 | Very high | 43 Ų | 43 | 62.3 Ų | 62.3 | 26% | 0.264 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -68.9 | -43.1 | 173.7 | -51.3 | 0 | 0 | 0 | 0 | 111 | F55 D73 A74 Y75 L79 Q80 | F55-T77 HydrophobicContact CD1-CG2 3.79Å; F55-T77 HydrophobicContact CD2-CG2 3.78Å; F55-T77 HydrophobicContact CE1-CG2 3.56Å; F55-T77 HydrophobicContact CE2-CG2 3.56Å; F55-T77 HydrophobicContact CG-CG2 3.91Å; F55-T77 HydrophobicContact CZ-CG2 3.45Å; F55-T77 VanDerWaalsContact CZ-CG2 3.45Å; D73-T77 PolarHBondContact O-N 2.94Å; D73-T77 PolarHBondContact O-OG1 3.48Å; A74-T77 PolarHBondContact O-N 2.96Å; Y75-T77 VanDerWaalsContact C-N 3.28Å; Y75-T77 PolarHBondContact O-N 3.12Å; T77-L79 VanDerWaalsContact C-N 3.27Å; T77-L79 PolarHBondContact O-N 3.46Å; T77-Q80 WeakPolarHBondContact O-CB 3.45Å; T77-Q80 PolarHBondContact O-N 2.88Å |
| 78 | C | 97.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 65.1 Ų | 65.1 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -54.1 | -45.5 | 175.7 | -175.4 | 0 | 0 | 0 | 0 | 111.4 | Q52 F55 A74 Y75 Q80 W81 I82 V93 | Q52-C78 PolarHBondContact O-SG 3.24Å; F55-C78 HydrophobicContact CB-CB 3.67Å; A74-C78 WeakPolarHBondContact O-CB 3.41Å; A74-C78 PolarHBondContact O-N 3.46Å; Y75-C78 VanDerWaalsContact O-CB 3.31Å; Y75-C78 WeakPolarHBondContact O-CB 3.24Å; Y75-C78 PolarHBondContact O-N 3.46Å; Y75-C78 VanDerWaalsContact O-N 3.16Å; C78-Q80 PolarHBondContact O-N 3.49Å; C78-Q80 VanDerWaalsContact O-N 3.15Å; C78-W81 PolarHBondContact O-N 3.5Å; C78-I82 WeakPolarHBondContact O-CG1 3.43Å; C78-I82 PolarHBondContact O-N 3.45Å; C78-V93 HydrophobicContact CB-CG1 4.44Å; C78-V93 HydrophobicContact CB-CG2 4.49Å |
| 79 | L | 96.1 | Very high | 95 | Very high | 40 Ų | 40 | 64.1 Ų | 64.1 | 21% | 0.209 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -55.9 | -32.4 | -178.1 | -172.2 | 61.4 | 0 | 0 | 0 | 113.2 | Y75 T77 W81 I82 R90 V93 L94 M97 | Y75-L79 PolarHBondContact O-N 3.22Å; T77-L79 VanDerWaalsContact C-N 3.27Å; T77-L79 PolarHBondContact O-N 3.46Å; L79-W81 PolarHBondContact O-N 3Å; L79-I82 HydrophobicContact CD1-CD1 4.03Å; L79-I82 PolarHBondContact O-N 3.23Å; L79-R90 HydrophobicContact CD1-CG 3.87Å; L79-V93 HydrophobicContact CB-CG1 4.38Å; L79-L94 HydrophobicContact CD2-CD2 4.19Å; L79-M97 HydrophobicContact CD2-SD 4.32Å |
| 80 | Q | 95.1 | Very high | 94.9 | Very high | 150 Ų | 150 | 63 Ų | 63 | 70% | 0.701 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -69.6 | -21.8 | 177.6 | -60.2 | 171.3 | 22.4 | 0 | 0 | 113 | T77 C78 | T77-Q80 WeakPolarHBondContact O-CB 3.45Å; T77-Q80 PolarHBondContact O-N 2.88Å; C78-Q80 PolarHBondContact O-N 3.49Å; C78-Q80 VanDerWaalsContact O-N 3.15Å |
| 81 | W | 95.2 | Very high | 94.8 | Very high | 88 Ų | 88 | 56.4 Ų | 56.4 | 33% | 0.333 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98 | -2.2 | 179.2 | -60.6 | 102.9 | 0 | 0 | 0 | 113.1 | K51 Q52 F55 C78 L79 | K51-W81 HydrophobicContact CB-CD2 3.93Å; K51-W81 HydrophobicContact CB-CE3 4.29Å; K51-W81 HydrophobicContact CB-CG 4.09Å; K51-W81 HydrophobicContact CD-CD2 4.12Å; K51-W81 HydrophobicContact CD-CE3 4Å; K51-W81 HydrophobicContact CD-CH2 3.57Å; K51-W81 HydrophobicContact CD-CZ2 3.68Å; K51-W81 HydrophobicContact CD-CZ3 3.73Å; Q52-W81 HydrophobicContact CB-CB 3.92Å; F55-W81 AromaticContact CD2-CD1 3.85Å; F55-W81 AromaticContact CD2-NE1 3.97Å; F55-W81 AromaticContact CE2-NE1 3.74Å; C78-W81 PolarHBondContact O-N 3.5Å; L79-W81 PolarHBondContact O-N 3Å |
| 82 | I | 94.1 | Very high | 94.7 | Very high | 8 Ų | 8 | 59.7 Ų | 59.7 | 4% | 0.041 | 32% | 0.318 | C | S | . | . | S | Bend | trans | -84.7 | 117.9 | 179 | -51.6 | -177.5 | 0 | 0 | 0 | 109.7 | Q52 C78 L79 N86 I89 R90 V93 | Q52-I82 HydrophobicContact CG-CG1 4.02Å; C78-I82 WeakPolarHBondContact O-CG1 3.43Å; C78-I82 PolarHBondContact O-N 3.45Å; L79-I82 HydrophobicContact CD1-CD1 4.03Å; L79-I82 PolarHBondContact O-N 3.23Å; I82-N86 HydrophobicContact CG2-CB 4.02Å; I82-I89 HydrophobicContact CD1-CG2 4.1Å; I82-R90 HydrophobicContact CD1-CB 4.47Å; I82-R90 HydrophobicContact CG2-CB 4.13Å; I82-R90 PolarHBondContact O-NH1 3.08Å; I82-V93 HydrophobicContact CD1-CB 4.06Å; I82-V93 HydrophobicContact CD1-CG1 4.4Å; I82-V93 HydrophobicContact CD1-CG2 3.9Å |
| 83 | A | 91.3 | Very high | 94.6 | Very high | 54 Ų | 54 | 59.3 Ų | 59.3 | 45% | 0.446 | 32% | 0.316 | S | S | . | . | trans | -58.7 | 142.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | N85 N86 | A83-N85 VanDerWaalsContact CB-OD1 3.27Å; A83-N85 WeakPolarHBondContact CB-OD1 3.34Å; A83-N85 PolarHBondContact O-N 2.93Å; A83-N85 VanDerWaalsContact O-N 3.11Å; A83-N86 WeakPolarHBondContact O-CB 3.08Å; A83-N86 PolarHBondContact O-N 3.31Å | ||
| 84 | D | 86.3 | Confident | 94.6 | Very high | 134 Ų | 134 | 55.6 Ų | 55.6 | 72% | 0.717 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.6 | -26.7 | -173.5 | -65.3 | -31.1 | 0 | 0 | 0 | 113.9 | N86 | D84-N86 VanDerWaalsContact C-N 3.35Š|
| 85 | N | 87.2 | Confident | 94.6 | Very high | 141 Ų | 141 | 57 Ų | 57 | 75% | 0.754 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80 | -13 | 176.7 | 65 | -15.1 | 0 | 0 | 0 | 113.8 | A83 L87 | A83-N85 VanDerWaalsContact CB-OD1 3.27Å; A83-N85 WeakPolarHBondContact CB-OD1 3.34Å; A83-N85 PolarHBondContact O-N 2.93Å; A83-N85 VanDerWaalsContact O-N 3.11Å; N85-L87 VanDerWaalsContact C-N 3.3Å; N85-L87 PolarHBondContact O-N 3.09Å; N85-L87 VanDerWaalsContact O-N 3.08Å |
| 86 | N | 90.7 | Very high | 94.5 | Very high | 46 Ų | 46 | 56.9 Ų | 56.9 | 25% | 0.246 | 30% | 0.303 | C | S | . | . | trans | -88.9 | 68 | -178.2 | -167.9 | -12.3 | 0 | 0 | 0 | 111.2 | I82 A83 D84 T88 I89 R90 | I82-N86 HydrophobicContact CG2-CB 4.02Å; A83-N86 WeakPolarHBondContact O-CB 3.08Å; A83-N86 PolarHBondContact O-N 3.31Å; D84-N86 VanDerWaalsContact C-N 3.35Å; N86-T88 VanDerWaalsContact C-N 3.28Å; N86-T88 PolarHBondContact O-N 3.01Å; N86-I89 WeakPolarHBondContact OD1-CG1 3.26Å; N86-I89 PolarHBondContact OD1-N 2.95Å; N86-R90 WeakPolarHBondContact O-CB 3.37Å; N86-R90 PolarHBondContact O-N 3.37Å; N86-R90 VanDerWaalsContact O-N 3.12Å | ||
| 87 | L | 90.8 | Very high | 94.6 | Very high | 87 Ų | 87 | 55.6 Ų | 55.6 | 46% | 0.455 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.8 | -34.3 | -177.7 | -59.6 | 178.3 | 0 | 0 | 0 | 112.4 | N85 R90 R91 | N85-L87 VanDerWaalsContact C-N 3.3Å; N85-L87 PolarHBondContact O-N 3.09Å; N85-L87 VanDerWaalsContact O-N 3.08Å; L87-R90 PolarHBondContact O-N 3.41Å; L87-R91 WeakPolarHBondContact O-CB 3.47Å; L87-R91 VanDerWaalsContact O-CG 3.23Å; L87-R91 WeakPolarHBondContact O-CG 3.41Å; L87-R91 PolarHBondContact O-N 2.95Å |
| 88 | T | 91.8 | Very high | 94.6 | Very high | 112 Ų | 112 | 53.5 Ų | 53.5 | 69% | 0.687 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -60.5 | -52.5 | -178.4 | -53.7 | 0 | 0 | 0 | 0 | 111.7 | N86 R91 D92 | N86-T88 VanDerWaalsContact C-N 3.28Å; N86-T88 PolarHBondContact O-N 3.01Å; T88-R91 PolarHBondContact O-N 3.41Å; T88-D92 PolarHBondContact O-N 3.02Å |
| 89 | I | 94.3 | Very high | 94.7 | Very high | 46 Ų | 46 | 59.1 Ų | 59.1 | 24% | 0.236 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -73.2 | -33.6 | 179.4 | -55.1 | -63 | 0 | 0 | 0 | 111.1 | I82 N86 R91 D92 V93 | I82-I89 HydrophobicContact CD1-CG2 4.1Å; N86-I89 WeakPolarHBondContact OD1-CG1 3.26Å; N86-I89 PolarHBondContact OD1-N 2.95Å; I89-R91 VanDerWaalsContact C-N 3.31Å; I89-R91 PolarHBondContact O-N 3.42Å; I89-D92 PolarHBondContact O-N 3.39Å; I89-V93 HydrophobicContact CG2-CG2 4.09Å; I89-V93 WeakPolarHBondContact O-CG2 3.4Å; I89-V93 PolarHBondContact O-N 3.45Å |
| 90 | R | 95.2 | Very high | 94.8 | Very high | 58 Ų | 58 | 57.2 Ų | 57.2 | 22% | 0.219 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -57.4 | -46.3 | 175.2 | -162.2 | 177.5 | -150.1 | 85.4 | -0.9 | 111.4 | L79 I82 N86 L87 V93 L94 | L79-R90 HydrophobicContact CD1-CG 3.87Å; I82-R90 HydrophobicContact CD1-CB 4.47Å; I82-R90 HydrophobicContact CG2-CB 4.13Å; I82-R90 PolarHBondContact O-NH1 3.08Å; N86-R90 WeakPolarHBondContact O-CB 3.37Å; N86-R90 PolarHBondContact O-N 3.37Å; N86-R90 VanDerWaalsContact O-N 3.12Å; L87-R90 PolarHBondContact O-N 3.41Å; R90-V93 PolarHBondContact O-N 2.9Å; R90-L94 HydrophobicContact CG-CD1 4.19Å; R90-L94 WeakPolarHBondContact O-CB 3.37Å; R90-L94 VanDerWaalsContact O-CG 3.26Å; R90-L94 WeakPolarHBondContact O-CG 3.37Å; R90-L94 PolarHBondContact O-N 2.92Å |
| 91 | R | 95.9 | Very high | 95 | Very high | 24 Ų | 24 | 50.1 Ų | 50.1 | 9% | 0.091 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.4 | -46 | 177.2 | -71.6 | 176.9 | 68.7 | 78.7 | 10.6 | 112.1 | L87 T88 I89 V93 L94 E95 L117 D120 S121 H126 | L87-R91 WeakPolarHBondContact O-CB 3.47Å; L87-R91 VanDerWaalsContact O-CG 3.23Å; L87-R91 WeakPolarHBondContact O-CG 3.41Å; L87-R91 PolarHBondContact O-N 2.95Å; T88-R91 PolarHBondContact O-N 3.41Å; I89-R91 VanDerWaalsContact C-N 3.31Å; I89-R91 PolarHBondContact O-N 3.42Å; R91-V93 VanDerWaalsContact C-N 3.34Å; R91-V93 PolarHBondContact O-N 3.48Å; R91-L94 PolarHBondContact O-N 3.37Å; R91-E95 WeakPolarHBondContact O-CB 3.31Å; R91-E95 PolarHBondContact O-N 2.93Å; R91-L117 HydrophobicContact CB-CD2 3.89Å; R91-L117 HydrophobicContact CG-CD2 3.92Å; R91-L117 PolarHBondContact NH1-O 3.1Å; R91-D120 VanDerWaalsContact NH1-C 3.27Å; R91-D120 PolarHBondContact NH1-O 3.46Å; R91-S121 PolarHBondContact NH1-OG 2.72Å; R91-H126 VanDerWaalsContact NH2-CB 3.34Å; R91-H126 PolarHBondContact NH2-O 3.48Å |
| 92 | D | 96.3 | Very high | 95.1 | Very high | 68 Ų | 68 | 46.1 Ų | 46.1 | 36% | 0.364 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -58.4 | -45.7 | 177.7 | -172.9 | 42.8 | 0 | 0 | 0 | 111.7 | K56 T88 I89 E95 G96 | K56-D92 WeakPolarHBondContact CE-OD2 3.33Å; K56-D92 IonicContact NZ-OD2 2.74Å; K56-D92 PolarHBondContact NZ-OD2 2.93Å; T88-D92 PolarHBondContact O-N 3.02Å; I89-D92 PolarHBondContact O-N 3.39Å; D92-E95 PolarHBondContact O-N 2.9Å; D92-G96 PolarHBondContact O-N 3.45Å |
| 93 | V | 97.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -66.7 | -45 | 178.4 | 171.4 | 0 | 0 | 0 | 0 | 111.7 | Y75 C78 L79 I82 I89 R90 R91 E95 G96 M97 | Y75-V93 HydrophobicContact CD1-CG1 4.15Å; Y75-V93 HydrophobicContact CD1-CG2 4.41Å; Y75-V93 HydrophobicContact CG-CG1 4.39Å; Y75-V93 WeakPolarHBondContact O-CG1 3.32Å; C78-V93 HydrophobicContact CB-CG1 4.44Å; C78-V93 HydrophobicContact CB-CG2 4.49Å; L79-V93 HydrophobicContact CB-CG1 4.38Å; I82-V93 HydrophobicContact CD1-CB 4.06Å; I82-V93 HydrophobicContact CD1-CG1 4.4Å; I82-V93 HydrophobicContact CD1-CG2 3.9Å; I89-V93 HydrophobicContact CG2-CG2 4.09Å; I89-V93 WeakPolarHBondContact O-CG2 3.4Å; I89-V93 PolarHBondContact O-N 3.45Å; R90-V93 PolarHBondContact O-N 2.9Å; R91-V93 VanDerWaalsContact C-N 3.34Å; R91-V93 PolarHBondContact O-N 3.48Å; V93-E95 VanDerWaalsContact C-N 3.32Å; V93-E95 PolarHBondContact O-N 3.48Å; V93-G96 PolarHBondContact O-N 3.15Å; V93-M97 HydrophobicContact CG1-CG 4.49Å; V93-M97 HydrophobicContact CG1-SD 4.16Å; V93-M97 VanDerWaalsContact O-CG 3.27Å; V93-M97 WeakPolarHBondContact O-CG 3.19Å; V93-M97 PolarHBondContact O-N 3.17Å |
| 94 | L | 97.8 | Very high | 95.7 | Very high | 8 Ų | 8 | 51 Ų | 51 | 4% | 0.042 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.6 | -38.2 | 176.9 | -71.9 | 174.5 | 0 | 0 | 0 | 112.2 | L79 R90 R91 M97 A98 L113 L116 L117 | L79-L94 HydrophobicContact CD2-CD2 4.19Å; R90-L94 HydrophobicContact CG-CD1 4.19Å; R90-L94 WeakPolarHBondContact O-CB 3.37Å; R90-L94 VanDerWaalsContact O-CG 3.26Å; R90-L94 WeakPolarHBondContact O-CG 3.37Å; R90-L94 PolarHBondContact O-N 2.92Å; R91-L94 PolarHBondContact O-N 3.37Å; L94-M97 HydrophobicContact CD2-SD 4.24Å; L94-M97 PolarHBondContact O-N 2.75Å; L94-A98 WeakPolarHBondContact O-CB 3.22Å; L94-A98 PolarHBondContact O-N 3.21Å; L94-L113 HydrophobicContact CD2-CD2 3.78Å; L94-L116 HydrophobicContact CD1-CB 4.39Å; L94-L116 HydrophobicContact CD2-CD1 4.4Å; L94-L117 HydrophobicContact CB-CD1 4.48Å; L94-L117 HydrophobicContact CB-CD2 3.86Å; L94-L117 HydrophobicContact CB-CG 4.1Å; L94-L117 HydrophobicContact CD1-CD2 4.27Å |
| 95 | E | 97.9 | Very high | 96.2 | Very high | 39 Ų | 39 | 46.7 Ų | 46.7 | 18% | 0.182 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.7 | -43.8 | 173.1 | -179.8 | 173.3 | 157.4 | 0 | 0 | 111.4 | R91 D92 V93 M97 A98 R99 L117 L133 | R91-E95 WeakPolarHBondContact O-CB 3.31Å; R91-E95 PolarHBondContact O-N 2.93Å; D92-E95 PolarHBondContact O-N 2.9Å; V93-E95 VanDerWaalsContact C-N 3.32Å; V93-E95 PolarHBondContact O-N 3.48Å; E95-M97 VanDerWaalsContact C-N 3.34Å; E95-M97 PolarHBondContact O-N 3.06Å; E95-A98 PolarHBondContact O-N 3.45Å; E95-R99 VanDerWaalsContact O-CG 3.3Å; E95-R99 WeakPolarHBondContact O-CG 3.5Å; E95-R99 PolarHBondContact O-N 2.98Å; E95-R99 IonicContact OE1-CZ 3.85Å; E95-R99 VanDerWaalsContact OE1-CZ 3.22Å; E95-R99 IonicContact OE1-NE 2.63Å; E95-R99 PolarHBondContact OE1-NE 2.95Å; E95-R99 VanDerWaalsContact OE1-NE 3.09Å; E95-R99 IonicContact OE1-NH2 3.73Å; E95-R99 PolarHBondContact OE1-NH2 3.35Å; E95-L117 HydrophobicContact CB-CD1 4.19Å; E95-L133 HydrophobicContact CG-CD1 4.29Å; E95-L133 HydrophobicContact CG-CD2 4.2Å |
| 96 | G | 98.3 | Very high | 96.7 | Very high | 7 Ų | 7 | 43 Ų | 43 | 7% | 0.072 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -56.4 | -46.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | D92 V93 R99 C100 | D92-G96 PolarHBondContact O-N 3.45Å; V93-G96 PolarHBondContact O-N 3.15Å; G96-R99 PolarHBondContact O-N 3.46Å; G96-C100 PolarHBondContact O-N 2.92Å; G96-C100 PolarHBondContact O-SG 3.01Å |
| 97 | M | 98.7 | Very high | 97.1 | Very high | 14 Ų | 14 | 46 Ų | 46 | 7% | 0.069 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.1 | -47.2 | 174.6 | -66.2 | 172.4 | 69.4 | 0 | 0 | 111.5 | L72 Y75 L79 V93 L94 E95 R99 C100 C101 L113 | L72-M97 HydrophobicContact CD1-CB 3.79Å; L72-M97 HydrophobicContact CD1-CE 4.1Å; L72-M97 HydrophobicContact CD1-CG 3.93Å; Y75-M97 VanDerWaalsContact CB-CG 3.42Å; Y75-M97 HydrophobicContact CD2-CG 4.35Å; Y75-M97 HydrophobicContact CG-CG 4.18Å; L79-M97 HydrophobicContact CD2-SD 4.32Å; V93-M97 HydrophobicContact CG1-CG 4.49Å; V93-M97 HydrophobicContact CG1-SD 4.16Å; V93-M97 VanDerWaalsContact O-CG 3.27Å; V93-M97 WeakPolarHBondContact O-CG 3.19Å; V93-M97 PolarHBondContact O-N 3.17Å; L94-M97 HydrophobicContact CD2-SD 4.24Å; L94-M97 PolarHBondContact O-N 2.75Å; E95-M97 VanDerWaalsContact C-N 3.34Å; E95-M97 PolarHBondContact O-N 3.06Å; M97-R99 VanDerWaalsContact C-N 3.3Å; M97-R99 PolarHBondContact O-N 3.46Å; M97-C100 WeakPolarHBondContact O-CA 3.5Å; M97-C100 WeakPolarHBondContact O-CB 3.27Å; M97-C100 PolarHBondContact O-N 3.05Å; M97-C101 PolarHBondContact O-N 3.07Å; M97-C101 PolarHBondContact O-SG 3.16Å; M97-L113 HydrophobicContact CB-CD1 3.64Å; M97-L113 HydrophobicContact CB-CD2 4.31Å; M97-L113 HydrophobicContact CE-CD2 4.15Å |
| 98 | A | 98.8 | Very high | 97.4 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.6 | -39.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L94 E95 C101 T102 L113 L133 | L94-A98 WeakPolarHBondContact O-CB 3.22Å; L94-A98 PolarHBondContact O-N 3.21Å; E95-A98 PolarHBondContact O-N 3.45Å; A98-C101 PolarHBondContact O-N 2.67Å; A98-T102 WeakPolarHBondContact O-CB 3.46Å; A98-T102 PolarHBondContact O-N 3.27Å; A98-T102 PolarHBondContact O-OG1 3.35Å; A98-L113 HydrophobicContact CB-CB 3.88Å; A98-L113 HydrophobicContact CB-CD1 4.22Å; A98-L133 HydrophobicContact CB-CD1 4.16Å; A98-L133 HydrophobicContact CB-CD2 3.87Å; A98-L133 HydrophobicContact CB-CG 4.48Å |
| 99 | R | 98.6 | Very high | 97.7 | Very high | 118 Ų | 118 | 47.5 Ų | 47.5 | 45% | 0.445 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.8 | -39.8 | 173.3 | -69.2 | 170.3 | 177.4 | -134.1 | 3.2 | 111.7 | F63 E95 G96 M97 T102 K103 L133 | F63-R99 HydrophobicContact CE2-CB 3.78Å; F63-R99 HydrophobicContact CZ-CB 4.03Å; E95-R99 VanDerWaalsContact O-CG 3.3Å; E95-R99 WeakPolarHBondContact O-CG 3.5Å; E95-R99 PolarHBondContact O-N 2.98Å; E95-R99 IonicContact OE1-CZ 3.85Å; E95-R99 VanDerWaalsContact OE1-CZ 3.22Å; E95-R99 IonicContact OE1-NE 2.63Å; E95-R99 PolarHBondContact OE1-NE 2.95Å; E95-R99 VanDerWaalsContact OE1-NE 3.09Å; E95-R99 IonicContact OE1-NH2 3.73Å; E95-R99 PolarHBondContact OE1-NH2 3.35Å; G96-R99 PolarHBondContact O-N 3.46Å; M97-R99 VanDerWaalsContact C-N 3.3Å; M97-R99 PolarHBondContact O-N 3.46Å; R99-T102 WeakPolarHBondContact O-CB 3.37Å; R99-T102 PolarHBondContact O-N 3.01Å; R99-K103 WeakPolarHBondContact O-CG 3.41Å; R99-K103 PolarHBondContact O-N 3.27Å; R99-K103 VanDerWaalsContact O-N 3.16Å; R99-L133 HydrophobicContact CG-CD1 3.87Å |
| 100 | C | 98.8 | Very high | 97.9 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63 | -51.9 | 174.2 | -62.9 | 0 | 0 | 0 | 0 | 111.3 | A71 L72 G96 M97 T102 K103 L104 | A71-C100 VanDerWaalsContact CB-SG 3.56Å; L72-C100 HydrophobicContact CB-CB 3.96Å; L72-C100 HydrophobicContact CD1-CB 4.33Å; G96-C100 PolarHBondContact O-N 2.92Å; G96-C100 PolarHBondContact O-SG 3.01Å; M97-C100 WeakPolarHBondContact O-CA 3.5Å; M97-C100 WeakPolarHBondContact O-CB 3.27Å; M97-C100 PolarHBondContact O-N 3.05Å; C100-T102 PolarHBondContact O-N 3.42Å; C100-K103 PolarHBondContact O-N 3.18Å; C100-L104 WeakPolarHBondContact O-CG 3.25Å; C100-L104 PolarHBondContact O-N 2.88Å |
| 101 | C | 98.8 | Very high | 98 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -56.1 | -40.4 | 178.1 | -63.2 | 0 | 0 | 0 | 0 | 111.5 | M97 A98 K103 L104 G105 Q106 Q109 A110 | M97-C101 PolarHBondContact O-N 3.07Å; M97-C101 PolarHBondContact O-SG 3.16Å; A98-C101 PolarHBondContact O-N 2.67Å; C101-K103 PolarHBondContact O-N 3.22Å; C101-L104 PolarHBondContact O-N 3.12Å; C101-G105 PolarHBondContact O-N 3.38Å; C101-Q106 HydrophobicContact CB-CB 4.11Å; C101-Q106 WeakPolarHBondContact O-CB 3.43Å; C101-Q106 PolarHBondContact O-N 3.3Å; C101-Q109 HydrophobicContact CB-CB 4.41Å; C101-A110 HydrophobicContact CB-CB 3.85Å |
| 102 | T | 98.6 | Very high | 98.1 | Very high | 5 Ų | 5 | 50 Ų | 50 | 3% | 0.031 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -56.4 | -52.2 | 174 | -55.3 | 0 | 0 | 0 | 0 | 110.9 | A98 R99 C100 L104 G105 I137 H140 F141 | A98-T102 WeakPolarHBondContact O-CB 3.46Å; A98-T102 PolarHBondContact O-N 3.27Å; A98-T102 PolarHBondContact O-OG1 3.35Å; R99-T102 WeakPolarHBondContact O-CB 3.37Å; R99-T102 PolarHBondContact O-N 3.01Å; C100-T102 PolarHBondContact O-N 3.42Å; T102-L104 VanDerWaalsContact C-N 3.27Å; T102-L104 PolarHBondContact O-N 3.33Å; T102-G105 PolarHBondContact O-N 3.27Å; T102-I137 WeakPolarHBondContact OG1-CG1 3.45Å; T102-H140 HydrophobicContact CG2-CB 3.57Å; T102-H140 PolarHBondContact O-CD2 3.32Å; T102-H140 PolarHBondContact O-NE2 3.25Å; T102-F141 HydrophobicContact CG2-CE2 4.16Å |
| 103 | K | 98.5 | Very high | 98.2 | Very high | 103 Ų | 103 | 47.4 Ų | 47.4 | 45% | 0.448 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -67.7 | -24.9 | -178.9 | -66.3 | -64.6 | -176.6 | -174.3 | 0 | 114.1 | F63 Y68 R99 C100 C101 G105 | F63-K103 HydrophobicContact CE2-CG 4.47Å; Y68-K103 HydrophobicContact CD1-CB 3.82Å; Y68-K103 HydrophobicContact CD1-CG 4.04Å; Y68-K103 HydrophobicContact CD2-CB 3.43Å; Y68-K103 VanDerWaalsContact CD2-CB 3.43Å; Y68-K103 HydrophobicContact CD2-CG 4.3Å; Y68-K103 HydrophobicContact CE1-CB 3.93Å; Y68-K103 HydrophobicContact CE1-CD 4.49Å; Y68-K103 HydrophobicContact CE1-CG 3.76Å; Y68-K103 HydrophobicContact CE2-CB 3.54Å; Y68-K103 HydrophobicContact CE2-CD 4.33Å; Y68-K103 HydrophobicContact CE2-CG 4.02Å; Y68-K103 HydrophobicContact CG-CB 3.57Å; Y68-K103 HydrophobicContact CG-CG 4.3Å; R99-K103 WeakPolarHBondContact O-CG 3.41Å; R99-K103 PolarHBondContact O-N 3.27Å; R99-K103 VanDerWaalsContact O-N 3.16Å; C100-K103 PolarHBondContact O-N 3.18Å; C101-K103 PolarHBondContact O-N 3.22Å; K103-G105 VanDerWaalsContact C-N 3.28Å |
| 104 | L | 98.4 | Very high | 98.2 | Very high | 60 Ų | 60 | 47.6 Ų | 47.6 | 31% | 0.314 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.2 | -1.9 | 173.7 | -67.9 | 169.7 | 0 | 0 | 0 | 113.2 | Q69 L72 C100 C101 T102 Q106 | Q69-L104 HydrophobicContact CB-CD2 4.44Å; L72-L104 HydrophobicContact CD2-CD1 4.03Å; C100-L104 WeakPolarHBondContact O-CG 3.25Å; C100-L104 PolarHBondContact O-N 2.88Å; C101-L104 PolarHBondContact O-N 3.12Å; T102-L104 VanDerWaalsContact C-N 3.27Å; T102-L104 PolarHBondContact O-N 3.33Å; L104-Q106 VanDerWaalsContact C-N 3.28Å; L104-Q106 HydrophobicContact CB-CG 4.13Å; L104-Q106 PolarHBondContact O-N 3.13Å |
| 105 | G | 97.7 | Very high | 98.1 | Very high | 44 Ų | 44 | 48.8 Ų | 48.8 | 45% | 0.454 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 77.4 | 10 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | C101 T102 K103 R107 F141 | C101-G105 PolarHBondContact O-N 3.38Å; T102-G105 PolarHBondContact O-N 3.27Å; K103-G105 VanDerWaalsContact C-N 3.28Å; G105-R107 PolarHBondContact O-N 3.34Å; G105-R107 VanDerWaalsContact O-N 3.12Å; G105-F141 WeakPolarHBondContact O-CE1 3.44Å |
| 106 | Q | 97.9 | Very high | 98 | Very high | 65 Ų | 65 | 50.2 Ų | 50.2 | 30% | 0.304 | 25% | 0.252 | S | S | . | . | trans | -87.3 | 75.5 | -177.9 | -64.7 | 167.4 | -19.5 | 0 | 0 | 110.7 | C101 L104 E108 Q109 A110 | C101-Q106 HydrophobicContact CB-CB 4.11Å; C101-Q106 WeakPolarHBondContact O-CB 3.43Å; C101-Q106 PolarHBondContact O-N 3.3Å; L104-Q106 VanDerWaalsContact C-N 3.28Å; L104-Q106 HydrophobicContact CB-CG 4.13Å; L104-Q106 PolarHBondContact O-N 3.13Å; Q106-E108 PolarHBondContact O-N 3.44Å; Q106-Q109 HydrophobicContact CB-CB 4.29Å; Q106-Q109 VanDerWaalsContact OE1-OE1 3.11Å; Q106-A110 PolarHBondContact O-N 3.41Å; Q106-A110 VanDerWaalsContact O-N 3.12Å | ||
| 107 | R | 97.6 | Very high | 97.8 | Very high | 109 Ų | 109 | 50 Ų | 50 | 41% | 0.411 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -58.4 | -50.3 | -174.2 | -179.6 | 178.9 | 166.9 | -176.1 | -2.7 | 113.7 | G105 A110 L111 F141 C143 | G105-R107 PolarHBondContact O-N 3.34Å; G105-R107 VanDerWaalsContact O-N 3.12Å; R107-A110 PolarHBondContact O-N 3.19Å; R107-L111 HydrophobicContact CG-CD1 4.05Å; R107-L111 WeakPolarHBondContact O-CG 3.37Å; R107-L111 PolarHBondContact O-N 3.08Å; R107-L111 VanDerWaalsContact O-N 3.09Å; R107-F141 HydrophobicContact CB-CD1 4.03Å; R107-F141 HydrophobicContact CB-CD2 3.93Å; R107-F141 HydrophobicContact CB-CE1 3.8Å; R107-F141 HydrophobicContact CB-CE2 3.72Å; R107-F141 HydrophobicContact CB-CG 4.11Å; R107-F141 HydrophobicContact CB-CZ 3.65Å; R107-F141 HydrophobicContact CG-CD1 4.45Å; R107-F141 HydrophobicContact CG-CD2 3.8Å; R107-F141 HydrophobicContact CG-CE2 4.02Å; R107-F141 HydrophobicContact CG-CG 4.06Å; R107-F141 HydrophobicContact CG-CZ 4.43Å; R107-C143 PolarHBondContact NH1-SG 3.24Å; R107-C143 PolarHBondContact NH2-SG 2.97Å; R107-C143 VanDerWaalsContact NH2-SG 3.43Å |
| 108 | E | 97.5 | Very high | 97.5 | Very high | 154 Ų | 154 | 53.6 Ų | 53.6 | 72% | 0.72 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -62.9 | -45.9 | -174.5 | -66.9 | 178.7 | 174 | 0 | 0 | 111.3 | Q106 A110 L111 E112 | Q106-E108 PolarHBondContact O-N 3.44Å; E108-A110 PolarHBondContact O-N 3.06Å; E108-L111 PolarHBondContact O-N 3.06Å; E108-L111 VanDerWaalsContact O-N 3.15Å; E108-E112 PolarHBondContact O-N 3.28Å |
| 109 | Q | 98.1 | Very high | 97 | Very high | 76 Ų | 76 | 61.7 Ų | 61.7 | 36% | 0.355 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63.8 | -38.8 | 178.1 | -165.1 | 176.4 | 9.4 | 0 | 0 | 112.4 | C101 Q106 L111 E112 L113 | C101-Q109 HydrophobicContact CB-CB 4.41Å; Q106-Q109 HydrophobicContact CB-CB 4.29Å; Q106-Q109 VanDerWaalsContact OE1-OE1 3.11Å; Q109-L111 VanDerWaalsContact C-N 3.31Å; Q109-L111 PolarHBondContact O-N 3.17Å; Q109-E112 PolarHBondContact O-N 3.02Å; Q109-L113 VanDerWaalsContact O-CG 3.32Å; Q109-L113 WeakPolarHBondContact O-CG 3.18Å; Q109-L113 PolarHBondContact O-N 3.47Å |
| 110 | A | 98.5 | Very high | 96.4 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.8 | -40.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | C101 Q106 R107 E108 A114 I137 | C101-A110 HydrophobicContact CB-CB 3.85Å; Q106-A110 PolarHBondContact O-N 3.41Å; Q106-A110 VanDerWaalsContact O-N 3.12Å; R107-A110 PolarHBondContact O-N 3.19Å; E108-A110 PolarHBondContact O-N 3.06Å; A110-A114 PolarHBondContact O-N 3.38Å; A110-A114 VanDerWaalsContact O-N 3.09Å; A110-I137 HydrophobicContact CB-CD1 4.12Å; A110-I137 HydrophobicContact CB-CG1 4.29Å; A110-I137 HydrophobicContact CB-CG2 4.34Å |
| 111 | L | 97.9 | Very high | 95.8 | Very high | 46 Ų | 46 | 59.9 Ų | 59.9 | 24% | 0.241 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -73.4 | -34.4 | 177.9 | -69.5 | 173.8 | 0 | 0 | 0 | 112.8 | R107 E108 Q109 A114 G115 I137 Y138 | R107-L111 HydrophobicContact CG-CD1 4.05Å; R107-L111 WeakPolarHBondContact O-CG 3.37Å; R107-L111 PolarHBondContact O-N 3.08Å; R107-L111 VanDerWaalsContact O-N 3.09Å; E108-L111 PolarHBondContact O-N 3.06Å; E108-L111 VanDerWaalsContact O-N 3.15Å; Q109-L111 VanDerWaalsContact C-N 3.31Å; Q109-L111 PolarHBondContact O-N 3.17Å; L111-A114 PolarHBondContact O-N 3.28Å; L111-G115 PolarHBondContact O-N 3.29Å; L111-I137 HydrophobicContact CD2-CG2 3.92Å; L111-I137 HydrophobicContact CG-CG2 4.23Å; L111-Y138 HydrophobicContact CD1-CE1 4.17Å; L111-Y138 HydrophobicContact CD2-CE1 3.71Å |
| 112 | E | 97.9 | Very high | 95.4 | Very high | 134 Ų | 134 | 63 Ų | 63 | 63% | 0.626 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -61.1 | -47.4 | 172.9 | -173.3 | -177 | -179 | 0 | 0 | 110.9 | E108 Q109 A114 G115 L116 | E108-E112 PolarHBondContact O-N 3.28Å; Q109-E112 PolarHBondContact O-N 3.02Å; E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 3.15Å; E112-G115 WeakPolarHBondContact O-CA 3.43Å; E112-G115 PolarHBondContact O-N 2.88Å; E112-L116 PolarHBondContact O-N 3.02Å |
| 113 | L | 98.1 | Very high | 95 | Very high | 13 Ų | 13 | 64.2 Ų | 64.2 | 7% | 0.068 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -61.7 | -40.8 | 176 | -69.9 | 165.5 | 0 | 0 | 0 | 112 | L94 M97 A98 Q109 G115 L116 L117 | L94-L113 HydrophobicContact CD2-CD2 3.78Å; M97-L113 HydrophobicContact CB-CD1 3.64Å; M97-L113 HydrophobicContact CB-CD2 4.31Å; M97-L113 HydrophobicContact CE-CD2 4.15Å; A98-L113 HydrophobicContact CB-CB 3.88Å; A98-L113 HydrophobicContact CB-CD1 4.22Å; Q109-L113 VanDerWaalsContact O-CG 3.32Å; Q109-L113 WeakPolarHBondContact O-CG 3.18Å; Q109-L113 PolarHBondContact O-N 3.47Å; L113-G115 VanDerWaalsContact C-N 3.28Å; L113-G115 PolarHBondContact O-N 2.96Å; L113-L116 HydrophobicContact CD2-CD1 4.39Å; L113-L116 WeakPolarHBondContact O-CB 3.33Å; L113-L116 PolarHBondContact O-N 2.84Å; L113-L117 PolarHBondContact O-N 2.86Å; L113-L117 VanDerWaalsContact O-N 3.13Å |
| 114 | A | 97.6 | Very high | 94.6 | Very high | 4 Ų | 4 | 59.4 Ų | 59.4 | 3% | 0.033 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.4 | -35.8 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A110 L111 E112 L117 N118 L130 L133 K134 I137 | A110-A114 PolarHBondContact O-N 3.38Å; A110-A114 VanDerWaalsContact O-N 3.09Å; L111-A114 PolarHBondContact O-N 3.28Å; E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 3.15Å; A114-L117 PolarHBondContact O-N 3.4Å; A114-N118 PolarHBondContact O-N 3.38Å; A114-L130 HydrophobicContact CB-CD1 3.94Å; A114-L130 VanDerWaalsContact O-CD1 3.26Å; A114-L130 WeakPolarHBondContact O-CD1 3.37Å; A114-L133 HydrophobicContact CB-CD2 4.4Å; A114-K134 HydrophobicContact CB-CG 4.23Å; A114-I137 HydrophobicContact CB-CD1 4.33Å |
| 115 | G | 96.3 | Very high | 94.3 | Very high | 33 Ų | 33 | 58.9 Ų | 58.9 | 34% | 0.34 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.2 | -37.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | L111 E112 L113 N118 K119 | L111-G115 PolarHBondContact O-N 3.29Å; E112-G115 WeakPolarHBondContact O-CA 3.43Å; E112-G115 PolarHBondContact O-N 2.88Å; L113-G115 VanDerWaalsContact C-N 3.28Å; L113-G115 PolarHBondContact O-N 2.96Å; G115-N118 WeakPolarHBondContact O-CB 3.29Å; G115-N118 PolarHBondContact O-N 3.08Å; G115-K119 PolarHBondContact O-N 3.32Å |
| 116 | L | 95 | Very high | 94 | Very high | 69 Ų | 69 | 59 Ų | 59 | 36% | 0.361 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.1 | -47.3 | 172.8 | -63.2 | 176.8 | 0 | 0 | 0 | 111.2 | L94 E112 L113 N118 K119 D120 | L94-L116 HydrophobicContact CD1-CB 4.39Å; L94-L116 HydrophobicContact CD2-CD1 4.4Å; E112-L116 PolarHBondContact O-N 3.02Å; L113-L116 HydrophobicContact CD2-CD1 4.39Å; L113-L116 WeakPolarHBondContact O-CB 3.33Å; L113-L116 PolarHBondContact O-N 2.84Å; L116-N118 PolarHBondContact O-N 2.75Å; L116-K119 PolarHBondContact O-N 3.17Å; L116-K119 VanDerWaalsContact O-N 3.16Å; L116-D120 PolarHBondContact O-N 3.47Å |
| 117 | L | 94.9 | Very high | 93.8 | Very high | 2 Ų | 2 | 57.1 Ų | 57.1 | 1% | 0.01 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.1 | -31.1 | 176.9 | -72.6 | 170.9 | 0 | 0 | 0 | 113.3 | R91 L94 E95 L113 A114 D120 S121 L130 L133 | R91-L117 HydrophobicContact CB-CD2 3.89Å; R91-L117 HydrophobicContact CG-CD2 3.92Å; R91-L117 PolarHBondContact NH1-O 3.1Å; L94-L117 HydrophobicContact CB-CD1 4.48Å; L94-L117 HydrophobicContact CB-CD2 3.86Å; L94-L117 HydrophobicContact CB-CG 4.1Å; L94-L117 HydrophobicContact CD1-CD2 4.27Å; E95-L117 HydrophobicContact CB-CD1 4.19Å; L113-L117 PolarHBondContact O-N 2.86Å; L113-L117 VanDerWaalsContact O-N 3.13Å; A114-L117 PolarHBondContact O-N 3.4Å; L117-D120 PolarHBondContact O-N 3.39Å; L117-S121 PolarHBondContact O-N 3.31Å; L117-S121 PolarHBondContact O-OG 2.94Å; L117-L130 HydrophobicContact CB-CD1 4.04Å; L117-L133 HydrophobicContact CD1-CD2 3.65Å |
| 118 | N | 91.6 | Very high | 93.6 | Very high | 91 Ų | 91 | 53 Ų | 53 | 49% | 0.487 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -65.5 | -44.5 | 176.7 | -165.7 | 35.4 | 0 | 0 | 0 | 112.3 | A114 G115 L116 D120 S121 L130 | A114-N118 PolarHBondContact O-N 3.38Å; G115-N118 WeakPolarHBondContact O-CB 3.29Å; G115-N118 PolarHBondContact O-N 3.08Å; L116-N118 PolarHBondContact O-N 2.75Å; N118-D120 PolarHBondContact O-N 3.32Å; N118-S121 WeakPolarHBondContact O-CB 3.48Å; N118-S121 PolarHBondContact O-N 2.8Å; N118-S121 VanDerWaalsContact O-N 3.08Å; N118-L130 HydrophobicContact CB-CD2 3.55Å; N118-L130 WeakPolarHBondContact OD1-CD2 3.36Å |
| 119 | K | 89.5 | Confident | 93.5 | Very high | 169 Ų | 169 | 48 Ų | 48 | 74% | 0.735 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -60.4 | -31.1 | 179.2 | -65.7 | 175.7 | -176.9 | 175.9 | 0 | 112.1 | G115 L116 | G115-K119 PolarHBondContact O-N 3.32Å; L116-K119 PolarHBondContact O-N 3.17Å; L116-K119 VanDerWaalsContact O-N 3.16Å |
| 120 | D | 84.9 | Confident | 93.5 | Very high | 62 Ų | 62 | 44.6 Ų | 44.6 | 33% | 0.332 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -94.8 | 10.6 | -179 | -60.2 | -21.5 | 0 | 0 | 0 | 113.3 | R91 L116 L117 N118 H126 | R91-D120 VanDerWaalsContact NH1-C 3.27Å; R91-D120 PolarHBondContact NH1-O 3.46Å; L116-D120 PolarHBondContact O-N 3.47Å; L117-D120 PolarHBondContact O-N 3.39Å; N118-D120 PolarHBondContact O-N 3.32Å; D120-H126 PolarHBondContact O-ND1 3.09Å |
| 121 | S | 87.4 | Confident | 93.4 | Very high | 18 Ų | 18 | 44.8 Ų | 44.8 | 13% | 0.126 | 25% | 0.248 | C | C | . | . | trans | -83.9 | 119.7 | 179.2 | -65.6 | 0 | 0 | 0 | 0 | 110.5 | R91 L117 N118 | R91-S121 PolarHBondContact NH1-OG 2.72Å; L117-S121 PolarHBondContact O-N 3.31Å; L117-S121 PolarHBondContact O-OG 2.94Å; N118-S121 WeakPolarHBondContact O-CB 3.48Å; N118-S121 PolarHBondContact O-N 2.8Å; N118-S121 VanDerWaalsContact O-N 3.08Å | ||
| 122 | S | 88.6 | Confident | 93.4 | Very high | 66 Ų | 66 | 46.3 Ų | 46.3 | 46% | 0.462 | 26% | 0.256 | S | S | . | . | trans | -118.7 | -16.6 | -175.2 | 57.4 | 0 | 0 | 0 | 0 | 113.6 | H126 L293 | S122-H126 PolarHBondContact N-ND1 3.48Å; S122-H126 PolarHBondContact OG-CE1 3.49Å; S122-H126 PolarHBondContact OG-ND1 3.37Å; S122-L293 PolarHBondContact O-N 3.5Å | ||
| 123 | N | 90.7 | Very high | 93.4 | Very high | 30 Ų | 30 | 40.1 Ų | 40.1 | 16% | 0.16 | 23% | 0.227 | C | C | . | . | B | Isolated β-bridge | trans | -139.5 | 169.3 | -178.4 | 60.8 | 54.8 | 0 | 0 | 0 | 111.9 | C125 H126 L127 E291 | N123-C125 VanDerWaalsContact C-N 3.27Å; N123-C125 PolarHBondContact O-N 2.9Å; N123-C125 WeakPolarHBondContact OD1-CA 3.41Å; N123-C125 VanDerWaalsContact OD1-CB 3.32Å; N123-C125 WeakPolarHBondContact OD1-CB 3.33Å; N123-C125 PolarHBondContact OD1-N 3.31Å; N123-C125 VanDerWaalsContact OD1-N 3.1Å; N123-H126 PolarHBondContact ND2-CD2 3.14Å; N123-H126 PolarHBondContact ND2-CE1 3.19Å; N123-H126 PolarHBondContact ND2-NE2 2.96Å; N123-H126 VanDerWaalsContact ND2-NE2 3.15Å; N123-H126 WeakPolarHBondContact O-CB 3.3Å; N123-H126 PolarHBondContact O-N 2.95Å; N123-H126 PolarHBondContact OD1-CD2 2.98Å; N123-H126 PolarHBondContact OD1-N 3.44Å; N123-L127 PolarHBondContact O-N 3.18Å; N123-L127 VanDerWaalsContact O-N 3.16Å; N123-E291 CarbonylContact C-O 3.46Å; N123-E291 WeakPolarHBondContact CA-O 3.46Å; N123-E291 WeakPolarHBondContact CB-O 3.43Å |
| 124 | T | 90.5 | Very high | 93.4 | Very high | 2 Ų | 2 | 42.1 Ų | 42.1 | 1% | 0.012 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.7 | -32.5 | 179.5 | 55.7 | 0 | 0 | 0 | 0 | 113.2 | L127 T128 L157 Q288 G290 E291 L293 V296 | T124-L127 PolarHBondContact O-N 3Å; T124-T128 VanDerWaalsContact O-CB 3.32Å; T124-T128 WeakPolarHBondContact O-CB 3.44Å; T124-T128 PolarHBondContact O-N 2.63Å; T124-T128 PolarHBondContact O-OG1 3.2Å; T124-L157 HydrophobicContact CG2-CD1 3.86Å; T124-Q288 PolarHBondContact OG1-O 3.15Å; T124-G290 PolarHBondContact OG1-N 3.43Å; T124-E291 HydrophobicContact CG2-CB 4.09Å; T124-E291 PolarHBondContact N-O 3.16Å; T124-E291 PolarHBondContact OG1-N 2.73Å; T124-L293 HydrophobicContact CG2-CD2 4.3Å; T124-V296 HydrophobicContact CG2-CG2 3.78Å |
| 125 | C | 91.3 | Very high | 93.4 | Very high | 49 Ų | 49 | 42.7 Ų | 42.7 | 33% | 0.331 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67.1 | -41.7 | 176.1 | -64 | 0 | 0 | 0 | 0 | 112.2 | N123 T128 S129 G290 | N123-C125 VanDerWaalsContact C-N 3.27Å; N123-C125 PolarHBondContact O-N 2.9Å; N123-C125 WeakPolarHBondContact OD1-CA 3.41Å; N123-C125 VanDerWaalsContact OD1-CB 3.32Å; N123-C125 WeakPolarHBondContact OD1-CB 3.33Å; N123-C125 PolarHBondContact OD1-N 3.31Å; N123-C125 VanDerWaalsContact OD1-N 3.1Å; C125-T128 PolarHBondContact O-N 3.28Å; C125-S129 WeakPolarHBondContact O-CB 3.44Å; C125-S129 PolarHBondContact O-N 3.01Å; C125-S129 PolarHBondContact O-OG 2.95Å; C125-G290 PolarHBondContact SG-N 3.27Å |
| 126 | H | 93.1 | Very high | 93.5 | Very high | 48 Ų | 48 | 44 Ų | 44 | 22% | 0.222 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.2 | -45.7 | 176.4 | -70.7 | -169.9 | 0 | 0 | 0 | 110.6 | R91 D120 S122 N123 S129 L130 | R91-H126 VanDerWaalsContact NH2-CB 3.34Å; R91-H126 PolarHBondContact NH2-O 3.48Å; D120-H126 PolarHBondContact O-ND1 3.09Å; S122-H126 PolarHBondContact N-ND1 3.48Å; S122-H126 PolarHBondContact OG-CE1 3.49Å; S122-H126 PolarHBondContact OG-ND1 3.37Å; N123-H126 PolarHBondContact ND2-CD2 3.14Å; N123-H126 PolarHBondContact ND2-CE1 3.19Å; N123-H126 PolarHBondContact ND2-NE2 2.96Å; N123-H126 VanDerWaalsContact ND2-NE2 3.15Å; N123-H126 WeakPolarHBondContact O-CB 3.3Å; N123-H126 PolarHBondContact O-N 2.95Å; N123-H126 PolarHBondContact OD1-CD2 2.98Å; N123-H126 PolarHBondContact OD1-N 3.44Å; H126-S129 PolarHBondContact O-N 2.93Å; H126-L130 WeakPolarHBondContact O-CB 3.43Å; H126-L130 PolarHBondContact O-N 2.98Å |
| 127 | L | 92.9 | Very high | 93.7 | Very high | 24 Ų | 24 | 40.7 Ų | 40.7 | 13% | 0.126 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65.8 | -44 | 178.1 | -178.4 | 58.5 | 0 | 0 | 0 | 111.8 | N123 T124 S129 L130 L131 L157 L293 L298 | N123-L127 PolarHBondContact O-N 3.18Å; N123-L127 VanDerWaalsContact O-N 3.16Å; T124-L127 PolarHBondContact O-N 3Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-S129 PolarHBondContact O-N 2.68Å; L127-L130 PolarHBondContact O-N 2.95Å; L127-L131 HydrophobicContact CD1-CD1 4.16Å; L127-L131 HydrophobicContact CD1-CG 4.14Å; L127-L131 HydrophobicContact CG-CD1 4.01Å; L127-L131 HydrophobicContact CG-CG 4.42Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 2.92Å; L127-L157 HydrophobicContact CB-CD2 4.28Å; L127-L157 HydrophobicContact CD2-CD1 4.47Å; L127-L157 HydrophobicContact CD2-CD2 4.04Å; L127-L157 HydrophobicContact CG-CD2 4Å; L127-L293 HydrophobicContact CB-CD1 4.41Å; L127-L293 HydrophobicContact CB-CD2 4.27Å; L127-L293 HydrophobicContact CD2-CD2 3.93Å; L127-L298 HydrophobicContact CD2-CD1 4.17Å |
| 128 | T | 94.2 | Very high | 93.8 | Very high | 22 Ų | 22 | 41.9 Ų | 41.9 | 14% | 0.135 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -57.3 | -48.6 | 176.6 | -61.2 | 0 | 0 | 0 | 0 | 111.1 | T124 C125 L130 L131 L132 L154 L157 L158 | T124-T128 VanDerWaalsContact O-CB 3.32Å; T124-T128 WeakPolarHBondContact O-CB 3.44Å; T124-T128 PolarHBondContact O-N 2.63Å; T124-T128 PolarHBondContact O-OG1 3.2Å; C125-T128 PolarHBondContact O-N 3.28Å; T128-L130 PolarHBondContact O-N 2.95Å; T128-L131 PolarHBondContact O-N 3.47Å; T128-L132 HydrophobicContact CG2-CD1 4.01Å; T128-L132 WeakPolarHBondContact O-CG 3.17Å; T128-L132 PolarHBondContact O-N 2.86Å; T128-L154 HydrophobicContact CG2-CD2 4Å; T128-L157 WeakPolarHBondContact OG1-CD2 3.39Å; T128-L158 HydrophobicContact CG2-CD1 3.69Å |
| 129 | S | 95.1 | Very high | 94 | Very high | 49 Ų | 49 | 43 Ų | 43 | 34% | 0.343 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.3 | -43 | -179.8 | -54 | 0 | 0 | 0 | 0 | 111.6 | C125 H126 L127 L132 L133 | C125-S129 WeakPolarHBondContact O-CB 3.44Å; C125-S129 PolarHBondContact O-N 3.01Å; C125-S129 PolarHBondContact O-OG 2.95Å; H126-S129 PolarHBondContact O-N 2.93Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-S129 PolarHBondContact O-N 2.68Å; S129-L132 PolarHBondContact O-N 3.09Å; S129-L133 WeakPolarHBondContact O-CB 3.5Å; S129-L133 PolarHBondContact O-N 3.12Å |
| 130 | L | 96.9 | Very high | 94.4 | Very high | 6 Ų | 6 | 39.4 Ų | 39.4 | 3% | 0.031 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.8 | -45.9 | 175.4 | 172.2 | 63.8 | 0 | 0 | 0 | 112.5 | A114 L117 N118 H126 L127 T128 L133 K134 | A114-L130 HydrophobicContact CB-CD1 3.94Å; A114-L130 VanDerWaalsContact O-CD1 3.26Å; A114-L130 WeakPolarHBondContact O-CD1 3.37Å; L117-L130 HydrophobicContact CB-CD1 4.04Å; N118-L130 HydrophobicContact CB-CD2 3.55Å; N118-L130 WeakPolarHBondContact OD1-CD2 3.36Å; H126-L130 WeakPolarHBondContact O-CB 3.43Å; H126-L130 PolarHBondContact O-N 2.98Å; L127-L130 PolarHBondContact O-N 2.95Å; T128-L130 PolarHBondContact O-N 2.95Å; L130-L133 WeakPolarHBondContact O-CB 3.42Å; L130-L133 PolarHBondContact O-N 3.43Å; L130-K134 HydrophobicContact CD1-CD 4.34Å; L130-K134 HydrophobicContact CD1-CG 4.32Å; L130-K134 HydrophobicContact CG-CD 4.4Å; L130-K134 WeakPolarHBondContact O-CG 3.36Å; L130-K134 PolarHBondContact O-N 3.21Å |
| 131 | L | 96.8 | Very high | 94.9 | Very high | 4 Ų | 4 | 39 Ų | 39 | 2% | 0.021 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.9 | -41.8 | 179.5 | -71.2 | 171 | 0 | 0 | 0 | 111.3 | L127 T128 L133 K134 V135 C150 Q153 L154 L157 | L127-L131 HydrophobicContact CD1-CD1 4.16Å; L127-L131 HydrophobicContact CD1-CG 4.14Å; L127-L131 HydrophobicContact CG-CD1 4.01Å; L127-L131 HydrophobicContact CG-CG 4.42Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 2.92Å; T128-L131 PolarHBondContact O-N 3.47Å; L131-L133 VanDerWaalsContact C-N 3.34Å; L131-L133 PolarHBondContact O-N 3.25Å; L131-K134 PolarHBondContact O-N 3.49Å; L131-V135 WeakPolarHBondContact O-CG2 3.4Å; L131-V135 PolarHBondContact O-N 3.4Å; L131-C150 HydrophobicContact CD2-CB 4.21Å; L131-Q153 HydrophobicContact CD1-CB 3.8Å; L131-Q153 HydrophobicContact CD2-CB 4.07Å; L131-L154 HydrophobicContact CB-CD1 4.07Å; L131-L154 HydrophobicContact CB-CD2 3.75Å; L131-L154 HydrophobicContact CB-CG 3.7Å; L131-L154 HydrophobicContact CD1-CD2 4.03Å; L131-L154 HydrophobicContact CD1-CG 4.02Å; L131-L154 HydrophobicContact CG-CG 4.49Å; L131-L157 HydrophobicContact CD1-CD2 4.33Å |
| 132 | L | 97.8 | Very high | 95.1 | Very high | 78 Ų | 78 | 40.9 Ų | 40.9 | 41% | 0.408 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62 | -40.7 | 174.4 | -71.4 | 170.5 | 0 | 0 | 0 | 112.1 | T128 S129 V135 S136 L154 | T128-L132 HydrophobicContact CG2-CD1 4.01Å; T128-L132 WeakPolarHBondContact O-CG 3.17Å; T128-L132 PolarHBondContact O-N 2.86Å; S129-L132 PolarHBondContact O-N 3.09Å; L132-V135 PolarHBondContact O-N 3.06Å; L132-S136 PolarHBondContact O-N 2.94Å; L132-L154 HydrophobicContact CD2-CD1 3.79Å; L132-L154 HydrophobicContact CG-CD1 4.2Å; L132-L154 HydrophobicContact CG-CD2 4.31Å |
| 133 | L | 98.4 | Very high | 95.3 | Very high | 4 Ų | 4 | 38.6 Ų | 38.6 | 2% | 0.021 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.2 | -48.4 | 173.1 | 175.2 | 64.8 | 0 | 0 | 0 | 111.1 | E95 A98 R99 A114 L117 S129 L130 L131 V135 S136 I137 | E95-L133 HydrophobicContact CG-CD1 4.29Å; E95-L133 HydrophobicContact CG-CD2 4.2Å; A98-L133 HydrophobicContact CB-CD1 4.16Å; A98-L133 HydrophobicContact CB-CD2 3.87Å; A98-L133 HydrophobicContact CB-CG 4.48Å; R99-L133 HydrophobicContact CG-CD1 3.87Å; A114-L133 HydrophobicContact CB-CD2 4.4Å; L117-L133 HydrophobicContact CD1-CD2 3.65Å; S129-L133 WeakPolarHBondContact O-CB 3.5Å; S129-L133 PolarHBondContact O-N 3.12Å; L130-L133 WeakPolarHBondContact O-CB 3.42Å; L130-L133 PolarHBondContact O-N 3.43Å; L131-L133 VanDerWaalsContact C-N 3.34Å; L131-L133 PolarHBondContact O-N 3.25Å; L133-V135 PolarHBondContact O-N 3.22Å; L133-S136 WeakPolarHBondContact O-CB 3.37Å; L133-S136 PolarHBondContact O-N 3.34Å; L133-I137 HydrophobicContact CD1-CD1 4.2Å; L133-I137 HydrophobicContact CD1-CG1 4.4Å; L133-I137 HydrophobicContact CG-CD1 3.91Å; L133-I137 WeakPolarHBondContact O-CG1 3.34Å; L133-I137 PolarHBondContact O-N 3.01Å |
| 134 | K | 98.3 | Very high | 95.3 | Very high | 54 Ų | 54 | 39.1 Ų | 39.1 | 24% | 0.235 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.2 | -41.3 | 177.6 | -72 | -179.6 | 70.9 | -177.5 | 0 | 112.2 | A114 L130 L131 S136 I137 Y138 | A114-K134 HydrophobicContact CB-CG 4.23Å; L130-K134 HydrophobicContact CD1-CD 4.34Å; L130-K134 HydrophobicContact CD1-CG 4.32Å; L130-K134 HydrophobicContact CG-CD 4.4Å; L130-K134 WeakPolarHBondContact O-CG 3.36Å; L130-K134 PolarHBondContact O-N 3.21Å; L131-K134 PolarHBondContact O-N 3.49Å; K134-S136 VanDerWaalsContact C-N 3.32Å; K134-S136 PolarHBondContact O-N 3.28Å; K134-I137 PolarHBondContact O-N 3.16Å; K134-Y138 HydrophobicContact CB-CD2 4.25Å; K134-Y138 HydrophobicContact CB-CE2 3.96Å; K134-Y138 WeakPolarHBondContact CE-OH 3.47Å; K134-Y138 WeakPolarHBondContact O-CB 3.25Å; K134-Y138 WeakPolarHBondContact O-CD2 3.36Å; K134-Y138 PolarHBondContact O-N 3.48Å |
| 135 | V | 98.2 | Very high | 95.3 | Very high | 16 Ų | 16 | 40.3 Ų | 40.3 | 10% | 0.097 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -56.6 | -47.8 | 173.5 | 168.6 | 0 | 0 | 0 | 0 | 110.6 | L131 L132 L133 Y138 Q139 Q147 C150 L151 L154 | L131-V135 WeakPolarHBondContact O-CG2 3.4Å; L131-V135 PolarHBondContact O-N 3.4Å; L132-V135 PolarHBondContact O-N 3.06Å; L133-V135 PolarHBondContact O-N 3.22Å; V135-Y138 PolarHBondContact O-N 3.26Å; V135-Q139 WeakPolarHBondContact O-CB 3.45Å; V135-Q139 PolarHBondContact O-N 2.95Å; V135-Q147 HydrophobicContact CG1-CG 4.15Å; V135-C150 HydrophobicContact CG2-CB 3.6Å; V135-L151 HydrophobicContact CG1-CD2 4.23Å; V135-L151 HydrophobicContact CG1-CG 4.34Å; V135-L151 HydrophobicContact CG2-CD2 3.98Å; V135-L151 HydrophobicContact CG2-CG 3.8Å; V135-L154 HydrophobicContact CG2-CD1 4.17Å |
| 136 | S | 98.3 | Very high | 95.4 | Very high | 61 Ų | 61 | 40.1 Ų | 40.1 | 43% | 0.427 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -61.7 | -43.5 | 177.6 | -177.4 | 0 | 0 | 0 | 0 | 112.7 | L132 L133 K134 H140 | L132-S136 PolarHBondContact O-N 2.94Å; L133-S136 WeakPolarHBondContact O-CB 3.37Å; L133-S136 PolarHBondContact O-N 3.34Å; K134-S136 VanDerWaalsContact C-N 3.32Å; K134-S136 PolarHBondContact O-N 3.28Å; S136-H140 WeakPolarHBondContact O-CB 3.47Å; S136-H140 PolarHBondContact O-N 3.43Å |
| 137 | I | 98.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.2 | -56.1 | 175.7 | -67.1 | 165 | 0 | 0 | 0 | 109.7 | T102 A110 L111 A114 L133 K134 Q139 H140 F141 | T102-I137 WeakPolarHBondContact OG1-CG1 3.45Å; A110-I137 HydrophobicContact CB-CD1 4.12Å; A110-I137 HydrophobicContact CB-CG1 4.29Å; A110-I137 HydrophobicContact CB-CG2 4.34Å; L111-I137 HydrophobicContact CD2-CG2 3.92Å; L111-I137 HydrophobicContact CG-CG2 4.23Å; A114-I137 HydrophobicContact CB-CD1 4.33Å; L133-I137 HydrophobicContact CD1-CD1 4.2Å; L133-I137 HydrophobicContact CD1-CG1 4.4Å; L133-I137 HydrophobicContact CG-CD1 3.91Å; L133-I137 WeakPolarHBondContact O-CG1 3.34Å; L133-I137 PolarHBondContact O-N 3.01Å; K134-I137 PolarHBondContact O-N 3.16Å; I137-Q139 VanDerWaalsContact C-N 3.34Å; I137-Q139 PolarHBondContact O-N 3.48Å; I137-H140 WeakPolarHBondContact O-CB 3.47Å; I137-H140 PolarHBondContact O-N 2.87Å; I137-H140 VanDerWaalsContact O-N 3.15Å; I137-F141 HydrophobicContact CG2-CD2 3.94Å; I137-F141 HydrophobicContact CG2-CE2 4.08Å; I137-F141 WeakPolarHBondContact O-CD2 3.28Å; I137-F141 PolarHBondContact O-N 3.09Å; I137-F141 VanDerWaalsContact O-N 3.17Å |
| 138 | Y | 97.6 | Very high | 95.5 | Very high | 27 Ų | 27 | 37.3 Ų | 37.3 | 11% | 0.106 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64.9 | -38.3 | -175.8 | -67.2 | -48.6 | 0 | 0 | 0 | 112.6 | L111 K134 V135 H140 F141 G142 C143 P146 | L111-Y138 HydrophobicContact CD1-CE1 4.17Å; L111-Y138 HydrophobicContact CD2-CE1 3.71Å; K134-Y138 HydrophobicContact CB-CD2 4.25Å; K134-Y138 HydrophobicContact CB-CE2 3.96Å; K134-Y138 WeakPolarHBondContact CE-OH 3.47Å; K134-Y138 WeakPolarHBondContact O-CB 3.25Å; K134-Y138 WeakPolarHBondContact O-CD2 3.36Å; K134-Y138 PolarHBondContact O-N 3.48Å; V135-Y138 PolarHBondContact O-N 3.26Å; Y138-H140 VanDerWaalsContact C-N 3.32Å; Y138-H140 PolarHBondContact O-N 3.13Å; Y138-F141 CarbonylContact O-C 3.54Å; Y138-F141 PolarHBondContact O-N 3.45Å; Y138-G142 PolarHBondContact O-N 3.33Å; Y138-C143 HydrophobicContact CD1-CB 3.74Å; Y138-C143 HydrophobicContact CG-CB 4.22Å; Y138-C143 PolarHBondContact O-N 2.75Å; Y138-P146 HydrophobicContact CD1-CB 3.77Å; Y138-P146 HydrophobicContact CD1-CG 4.48Å; Y138-P146 HydrophobicContact CD2-CB 3.67Å; Y138-P146 HydrophobicContact CE1-CB 3.6Å; Y138-P146 HydrophobicContact CE1-CG 4.29Å; Y138-P146 HydrophobicContact CE2-CB 3.49Å; Y138-P146 VanDerWaalsContact CE2-CB 3.49Å; Y138-P146 HydrophobicContact CG-CB 3.82Å; Y138-P146 VanDerWaalsContact CZ-CB 3.47Å |
| 139 | Q | 96 | Very high | 95.5 | Very high | 115 Ų | 115 | 38.2 Ų | 38.2 | 54% | 0.537 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -60.1 | -43.3 | 173.9 | -176.4 | -179.6 | -3.2 | 0 | 0 | 111.3 | V135 I137 F141 G142 | V135-Q139 WeakPolarHBondContact O-CB 3.45Å; V135-Q139 PolarHBondContact O-N 2.95Å; I137-Q139 VanDerWaalsContact C-N 3.34Å; I137-Q139 PolarHBondContact O-N 3.48Å; Q139-F141 VanDerWaalsContact C-N 3.29Å; Q139-F141 PolarHBondContact O-N 3.03Å; Q139-G142 PolarHBondContact O-N 2.72Å |
| 140 | H | 97.2 | Very high | 95.5 | Very high | 92 Ų | 92 | 36 Ų | 36 | 43% | 0.426 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -62 | -37.2 | 178.7 | -173.4 | 64.9 | 0 | 0 | 0 | 112.7 | T102 S136 I137 Y138 | T102-H140 HydrophobicContact CG2-CB 3.57Å; T102-H140 PolarHBondContact O-CD2 3.32Å; T102-H140 PolarHBondContact O-NE2 3.25Å; S136-H140 WeakPolarHBondContact O-CB 3.47Å; S136-H140 PolarHBondContact O-N 3.43Å; I137-H140 WeakPolarHBondContact O-CB 3.47Å; I137-H140 PolarHBondContact O-N 2.87Å; I137-H140 VanDerWaalsContact O-N 3.15Å; Y138-H140 VanDerWaalsContact C-N 3.32Å; Y138-H140 PolarHBondContact O-N 3.13Å |
| 141 | F | 95.8 | Very high | 95.5 | Very high | 54 Ų | 54 | 35.9 Ų | 35.9 | 24% | 0.237 | 21% | 0.211 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.9 | 11.3 | -179.9 | -65.3 | -70 | 0 | 0 | 0 | 114.1 | T102 G105 R107 I137 Y138 Q139 C143 | T102-F141 HydrophobicContact CG2-CE2 4.16Å; G105-F141 WeakPolarHBondContact O-CE1 3.44Å; R107-F141 HydrophobicContact CB-CD1 4.03Å; R107-F141 HydrophobicContact CB-CD2 3.93Å; R107-F141 HydrophobicContact CB-CE1 3.8Å; R107-F141 HydrophobicContact CB-CE2 3.72Å; R107-F141 HydrophobicContact CB-CG 4.11Å; R107-F141 HydrophobicContact CB-CZ 3.65Å; R107-F141 HydrophobicContact CG-CD1 4.45Å; R107-F141 HydrophobicContact CG-CD2 3.8Å; R107-F141 HydrophobicContact CG-CE2 4.02Å; R107-F141 HydrophobicContact CG-CG 4.06Å; R107-F141 HydrophobicContact CG-CZ 4.43Å; I137-F141 HydrophobicContact CG2-CD2 3.94Å; I137-F141 HydrophobicContact CG2-CE2 4.08Å; I137-F141 WeakPolarHBondContact O-CD2 3.28Å; I137-F141 PolarHBondContact O-N 3.09Å; I137-F141 VanDerWaalsContact O-N 3.17Å; Y138-F141 CarbonylContact O-C 3.54Å; Y138-F141 PolarHBondContact O-N 3.45Å; Q139-F141 VanDerWaalsContact C-N 3.29Å; Q139-F141 PolarHBondContact O-N 3.03Å; F141-C143 PolarHBondContact O-N 3.16Å; F141-C143 PolarHBondContact O-SG 2.85Å; F141-C143 VanDerWaalsContact O-SG 3.41Å |
| 142 | G | 91.8 | Very high | 95.4 | Very high | 57 Ų | 57 | 36.9 Ų | 36.9 | 59% | 0.588 | 22% | 0.216 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 62.8 | 21.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | Y138 Q139 V144 | Y138-G142 PolarHBondContact O-N 3.33Å; Q139-G142 PolarHBondContact O-N 2.72Å; G142-V144 PolarHBondContact O-N 3.35Å; G142-V144 VanDerWaalsContact O-N 3.08Å |
| 143 | C | 91.8 | Very high | 95.2 | Very high | 18 Ų | 18 | 37.3 Ų | 37.3 | 12% | 0.122 | 22% | 0.216 | C | C | . | . | trans | -86.3 | 73.1 | -176.4 | -64.7 | 0 | 0 | 0 | 0 | 111.3 | R107 Y138 F141 G145 P146 Q147 | R107-C143 PolarHBondContact NH1-SG 3.24Å; R107-C143 PolarHBondContact NH2-SG 2.97Å; R107-C143 VanDerWaalsContact NH2-SG 3.43Å; Y138-C143 HydrophobicContact CD1-CB 3.74Å; Y138-C143 HydrophobicContact CG-CB 4.22Å; Y138-C143 PolarHBondContact O-N 2.75Å; F141-C143 PolarHBondContact O-N 3.16Å; F141-C143 PolarHBondContact O-SG 2.85Å; F141-C143 VanDerWaalsContact O-SG 3.41Å; C143-G145 PolarHBondContact O-N 2.72Å; C143-P146 WeakPolarHBondContact O-CD 3.42Å; C143-Q147 WeakPolarHBondContact O-CB 3.4Å; C143-Q147 PolarHBondContact O-N 3.43Å; C143-Q147 VanDerWaalsContact O-N 3.13Å | ||
| 144 | V | 90.7 | Very high | 95 | Very high | 41 Ų | 41 | 37.1 Ų | 37.1 | 25% | 0.248 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60 | -43.5 | -169.5 | -177.5 | 0 | 0 | 0 | 0 | 113.6 | G142 Q147 M148 T171 L175 | G142-V144 PolarHBondContact O-N 3.35Å; G142-V144 VanDerWaalsContact O-N 3.08Å; V144-Q147 WeakPolarHBondContact O-CB 3.47Å; V144-Q147 PolarHBondContact O-N 3.39Å; V144-M148 HydrophobicContact CG1-CG 4.18Å; V144-M148 HydrophobicContact CG1-SD 3.87Å; V144-M148 WeakPolarHBondContact O-CG 3.41Å; V144-M148 PolarHBondContact O-N 3.01Å; V144-T171 HydrophobicContact CG1-CG2 3.85Å; V144-L175 HydrophobicContact CG1-CB 4.2Å; V144-L175 HydrophobicContact CG1-CD1 4.22Å; V144-L175 HydrophobicContact CG1-CD2 4.05Å; V144-L175 HydrophobicContact CG1-CG 4.39Å |
| 145 | G | 90.3 | Very high | 94.8 | Very high | 28 Ų | 28 | 34.6 Ų | 34.6 | 29% | 0.289 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -58.1 | -58.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | C143 Q147 M148 S149 | C143-G145 PolarHBondContact O-N 2.72Å; G145-Q147 VanDerWaalsContact C-N 3.28Å; G145-Q147 PolarHBondContact O-N 2.88Å; G145-M148 PolarHBondContact O-N 2.93Å; G145-M148 VanDerWaalsContact O-N 3.16Å; G145-S149 PolarHBondContact O-N 3.28Å |
| 146 | P | 93.4 | Very high | 94.5 | Very high | 45 Ų | 45 | 34.3 Ų | 34.3 | 29% | 0.292 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -59.7 | -33.9 | 175.2 | -27.5 | 36 | 0 | 0 | 0 | 114.1 | Y138 C143 S149 C150 | Y138-P146 HydrophobicContact CD1-CB 3.77Å; Y138-P146 HydrophobicContact CD1-CG 4.48Å; Y138-P146 HydrophobicContact CD2-CB 3.67Å; Y138-P146 HydrophobicContact CE1-CB 3.6Å; Y138-P146 HydrophobicContact CE1-CG 4.29Å; Y138-P146 HydrophobicContact CE2-CB 3.49Å; Y138-P146 VanDerWaalsContact CE2-CB 3.49Å; Y138-P146 HydrophobicContact CG-CB 3.82Å; Y138-P146 VanDerWaalsContact CZ-CB 3.47Å; C143-P146 WeakPolarHBondContact O-CD 3.42Å; P146-S149 PolarHBondContact O-N 3.17Å; P146-C150 PolarHBondContact O-N 3.05Å; P146-C150 VanDerWaalsContact O-N 3.09Å; P146-C150 PolarHBondContact O-SG 3.44Å |
| 147 | Q | 95 | Very high | 94.1 | Very high | 9 Ų | 9 | 31.5 Ų | 31.5 | 4% | 0.042 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.2 | -48.4 | 173.3 | -174.9 | -173.8 | -11.8 | 0 | 0 | 111.3 | V135 C143 V144 G145 S149 C150 L151 T171 | V135-Q147 HydrophobicContact CG1-CG 4.15Å; C143-Q147 WeakPolarHBondContact O-CB 3.4Å; C143-Q147 PolarHBondContact O-N 3.43Å; C143-Q147 VanDerWaalsContact O-N 3.13Å; V144-Q147 WeakPolarHBondContact O-CB 3.47Å; V144-Q147 PolarHBondContact O-N 3.39Å; G145-Q147 VanDerWaalsContact C-N 3.28Å; G145-Q147 PolarHBondContact O-N 2.88Å; Q147-S149 VanDerWaalsContact C-N 3.34Å; Q147-S149 PolarHBondContact O-N 3.01Å; Q147-C150 PolarHBondContact O-N 3.28Å; Q147-L151 HydrophobicContact CG-CD1 4.15Å; Q147-L151 WeakPolarHBondContact O-CG 3.48Å; Q147-L151 PolarHBondContact O-N 2.84Å; Q147-T171 HydrophobicContact CG-CG2 4.4Å; Q147-T171 PolarHBondContact NE2-OG1 3.45Å |
| 148 | M | 94.1 | Very high | 93.7 | Very high | 4 Ų | 4 | 33.1 Ų | 33.1 | 2% | 0.02 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.6 | -42.9 | 177.3 | -73 | 177.8 | 62 | 0 | 0 | 111.6 | V144 G145 C150 L151 Q152 L168 T171 L175 L211 | V144-M148 HydrophobicContact CG1-CG 4.18Å; V144-M148 HydrophobicContact CG1-SD 3.87Å; V144-M148 WeakPolarHBondContact O-CG 3.41Å; V144-M148 PolarHBondContact O-N 3.01Å; G145-M148 PolarHBondContact O-N 2.93Å; G145-M148 VanDerWaalsContact O-N 3.16Å; M148-C150 VanDerWaalsContact C-N 3.35Å; M148-C150 PolarHBondContact O-N 3.44Å; M148-L151 PolarHBondContact O-N 2.93Å; M148-Q152 WeakPolarHBondContact O-CG 3.17Å; M148-Q152 PolarHBondContact O-N 3.4Å; M148-L168 HydrophobicContact CB-CD1 4.18Å; M148-L168 HydrophobicContact CG-CD1 4.18Å; M148-T171 HydrophobicContact CG-CG2 3.6Å; M148-T171 HydrophobicContact SD-CG2 4.45Å; M148-L175 HydrophobicContact SD-CD2 4.14Å; M148-L211 HydrophobicContact CE-CD2 4.31Å; M148-L211 HydrophobicContact SD-CD2 4.03Å |
| 149 | S | 93.4 | Very high | 93.4 | Very high | 41 Ų | 41 | 32.3 Ų | 32.3 | 29% | 0.287 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -59.4 | -43.9 | 176.5 | 179.7 | 0 | 0 | 0 | 0 | 112.1 | G145 P146 Q147 L151 Q152 Q153 | G145-S149 PolarHBondContact O-N 3.28Å; P146-S149 PolarHBondContact O-N 3.17Å; Q147-S149 VanDerWaalsContact C-N 3.34Å; Q147-S149 PolarHBondContact O-N 3.01Å; S149-L151 PolarHBondContact O-N 3.42Å; S149-Q152 PolarHBondContact O-N 3.47Å; S149-Q153 WeakPolarHBondContact O-CG 3.45Å; S149-Q153 PolarHBondContact O-N 3.18Å |
| 150 | C | 95.9 | Very high | 93.1 | Very high | 2 Ų | 2 | 28.4 Ų | 28.4 | 1% | 0.014 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.8 | -39.2 | 176.2 | -64 | 0 | 0 | 0 | 0 | 112.2 | L131 V135 P146 Q147 M148 Q153 L154 | L131-C150 HydrophobicContact CD2-CB 4.21Å; V135-C150 HydrophobicContact CG2-CB 3.6Å; P146-C150 PolarHBondContact O-N 3.05Å; P146-C150 VanDerWaalsContact O-N 3.09Å; P146-C150 PolarHBondContact O-SG 3.44Å; Q147-C150 PolarHBondContact O-N 3.28Å; M148-C150 VanDerWaalsContact C-N 3.35Å; M148-C150 PolarHBondContact O-N 3.44Å; C150-Q153 PolarHBondContact O-N 3.47Å; C150-L154 WeakPolarHBondContact O-CG 3.05Å; C150-L154 PolarHBondContact O-N 3.43Å |
| 151 | L | 96.9 | Very high | 92.9 | Very high | 3 Ų | 3 | 26.3 Ų | 26.3 | 2% | 0.016 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67 | -38.3 | 176.3 | -75.7 | 167.6 | 0 | 0 | 0 | 112.5 | V135 Q147 M148 S149 L154 C155 L168 T171 | V135-L151 HydrophobicContact CG1-CD2 4.23Å; V135-L151 HydrophobicContact CG1-CG 4.34Å; V135-L151 HydrophobicContact CG2-CD2 3.98Å; V135-L151 HydrophobicContact CG2-CG 3.8Å; Q147-L151 HydrophobicContact CG-CD1 4.15Å; Q147-L151 WeakPolarHBondContact O-CG 3.48Å; Q147-L151 PolarHBondContact O-N 2.84Å; M148-L151 PolarHBondContact O-N 2.93Å; S149-L151 PolarHBondContact O-N 3.42Å; L151-L154 HydrophobicContact CD2-CD1 4.29Å; L151-L154 WeakPolarHBondContact O-CB 3.45Å; L151-L154 PolarHBondContact O-N 3.46Å; L151-C155 PolarHBondContact O-N 3.2Å; L151-C155 PolarHBondContact O-SG 3.45Å; L151-C155 VanDerWaalsContact O-SG 3.37Å; L151-L168 HydrophobicContact CB-CB 4.08Å; L151-L168 HydrophobicContact CB-CD1 3.89Å; L151-L168 HydrophobicContact CB-CG 4.42Å; L151-L168 HydrophobicContact CD1-CB 4.46Å; L151-L168 HydrophobicContact CD1-CD1 4.42Å; L151-T171 WeakPolarHBondContact CD1-OG1 3.41Å |
| 152 | Q | 95 | Very high | 92.8 | Very high | 26 Ų | 26 | 24 Ų | 24 | 12% | 0.121 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.1 | -42.9 | 172.9 | -74 | 171.2 | -46.6 | 0 | 0 | 111.5 | M148 S149 L154 C155 S156 L168 F301 | M148-Q152 WeakPolarHBondContact O-CG 3.17Å; M148-Q152 PolarHBondContact O-N 3.4Å; S149-Q152 PolarHBondContact O-N 3.47Å; Q152-L154 VanDerWaalsContact C-N 3.34Å; Q152-L154 PolarHBondContact O-N 3.17Å; Q152-C155 WeakPolarHBondContact O-CB 3.48Å; Q152-C155 PolarHBondContact O-N 2.91Å; Q152-S156 PolarHBondContact O-N 3.03Å; Q152-L168 HydrophobicContact CG-CD1 4.35Å; Q152-L168 HydrophobicContact CG-CD2 3.79Å; Q152-F301 HydrophobicContact CB-CB 4Å; Q152-F301 HydrophobicContact CB-CD1 4.44Å; Q152-F301 HydrophobicContact CB-CD2 3.94Å; Q152-F301 HydrophobicContact CB-CG 3.88Å; Q152-F301 HydrophobicContact CG-CD1 4.06Å; Q152-F301 HydrophobicContact CG-CD2 4.03Å; Q152-F301 HydrophobicContact CG-CE1 4.26Å; Q152-F301 HydrophobicContact CG-CE2 4.2Å; Q152-F301 HydrophobicContact CG-CG 3.95Å; Q152-F301 HydrophobicContact CG-CZ 4.32Å |
| 153 | Q | 93.8 | Very high | 92.9 | Very high | 87 Ų | 87 | 24.2 Ų | 24.2 | 41% | 0.407 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -61.7 | -41.3 | 173.9 | -70.4 | 178.2 | 51 | 0 | 0 | 111.7 | L131 S149 C150 C155 S156 L157 | L131-Q153 HydrophobicContact CD1-CB 3.8Å; L131-Q153 HydrophobicContact CD2-CB 4.07Å; S149-Q153 WeakPolarHBondContact O-CG 3.45Å; S149-Q153 PolarHBondContact O-N 3.18Å; C150-Q153 PolarHBondContact O-N 3.47Å; Q153-C155 VanDerWaalsContact C-N 3.34Å; Q153-C155 PolarHBondContact O-N 3.25Å; Q153-S156 PolarHBondContact O-N 3.15Å; Q153-L157 VanDerWaalsContact O-CB 3.28Å; Q153-L157 WeakPolarHBondContact O-CB 3.4Å; Q153-L157 PolarHBondContact O-N 3.39Å |
| 154 | L | 94.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -63 | -38.4 | 173.9 | -77.2 | 166.7 | 0 | 0 | 0 | 112.6 | T128 L131 L132 V135 C150 L151 Q152 L157 L158 H164 | T128-L154 HydrophobicContact CG2-CD2 4Å; L131-L154 HydrophobicContact CB-CD1 4.07Å; L131-L154 HydrophobicContact CB-CD2 3.75Å; L131-L154 HydrophobicContact CB-CG 3.7Å; L131-L154 HydrophobicContact CD1-CD2 4.03Å; L131-L154 HydrophobicContact CD1-CG 4.02Å; L131-L154 HydrophobicContact CG-CG 4.49Å; L132-L154 HydrophobicContact CD2-CD1 3.79Å; L132-L154 HydrophobicContact CG-CD1 4.2Å; L132-L154 HydrophobicContact CG-CD2 4.31Å; V135-L154 HydrophobicContact CG2-CD1 4.17Å; C150-L154 WeakPolarHBondContact O-CG 3.05Å; C150-L154 PolarHBondContact O-N 3.43Å; L151-L154 HydrophobicContact CD2-CD1 4.29Å; L151-L154 WeakPolarHBondContact O-CB 3.45Å; L151-L154 PolarHBondContact O-N 3.46Å; Q152-L154 VanDerWaalsContact C-N 3.34Å; Q152-L154 PolarHBondContact O-N 3.17Å; L154-L157 PolarHBondContact O-N 3.44Å; L154-L158 PolarHBondContact O-N 3.18Å; L154-H164 HydrophobicContact CB-CB 4.14Å |
| 155 | C | 93.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -65.6 | -39.2 | 173.9 | -73.6 | 0 | 0 | 0 | 0 | 112 | L151 Q152 Q153 L158 P159 W165 F301 W305 | L151-C155 PolarHBondContact O-N 3.2Å; L151-C155 PolarHBondContact O-SG 3.45Å; L151-C155 VanDerWaalsContact O-SG 3.37Å; Q152-C155 WeakPolarHBondContact O-CB 3.48Å; Q152-C155 PolarHBondContact O-N 2.91Å; Q153-C155 VanDerWaalsContact C-N 3.34Å; Q153-C155 PolarHBondContact O-N 3.25Å; C155-L158 CarbonylContact O-C 3.49Å; C155-P159 WeakPolarHBondContact O-CA 3.44Å; C155-W165 HydrophobicContact CB-CD2 4.11Å; C155-W165 HydrophobicContact CB-CE3 4.25Å; C155-W165 HydrophobicContact CB-CH2 3.88Å; C155-W165 HydrophobicContact CB-CZ2 3.71Å; C155-W165 HydrophobicContact CB-CZ3 4.16Å; C155-F301 HydrophobicContact CB-CD2 4.06Å; C155-F301 HydrophobicContact CB-CE2 4.08Å; C155-W305 WeakPolarHBondContact O-CH2 3.34Å |
| 156 | S | 91.7 | Very high | 93.8 | Very high | 11 Ų | 11 | 21.6 Ų | 21.6 | 8% | 0.077 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -66.7 | -42.3 | 173.6 | -77 | 0 | 0 | 0 | 0 | 112.9 | Q152 Q153 Q299 F301 | Q152-S156 PolarHBondContact O-N 3.03Å; Q153-S156 PolarHBondContact O-N 3.15Å; S156-Q299 PolarHBondContact OG-O 3.49Å; S156-F301 VanDerWaalsContact OG-CA 3.28Å; S156-F301 WeakPolarHBondContact OG-CA 3.46Å; S156-F301 PolarHBondContact OG-N 3.15Å |
| 157 | L | 89.9 | Confident | 94.1 | Very high | 2 Ų | 2 | 21.4 Ų | 21.4 | 1% | 0.01 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -71.9 | -37.6 | -178 | -175.5 | 60.6 | 0 | 0 | 0 | 112.3 | T124 L127 T128 L131 Q153 L154 L298 | T124-L157 HydrophobicContact CG2-CD1 3.86Å; L127-L157 HydrophobicContact CB-CD2 4.28Å; L127-L157 HydrophobicContact CD2-CD1 4.47Å; L127-L157 HydrophobicContact CD2-CD2 4.04Å; L127-L157 HydrophobicContact CG-CD2 4Å; T128-L157 WeakPolarHBondContact OG1-CD2 3.39Å; L131-L157 HydrophobicContact CD1-CD2 4.33Å; Q153-L157 VanDerWaalsContact O-CB 3.28Å; Q153-L157 WeakPolarHBondContact O-CB 3.4Å; Q153-L157 PolarHBondContact O-N 3.39Å; L154-L157 PolarHBondContact O-N 3.44Å; L157-L298 HydrophobicContact CD1-CD1 3.96Å; L157-L298 HydrophobicContact CD1-CD2 3.65Å; L157-L298 HydrophobicContact CD1-CG 4.44Å |
| 158 | L | 90.3 | Very high | 94.2 | Very high | 34 Ų | 34 | 21 Ų | 21 | 18% | 0.178 | 11% | 0.109 | C | C | . | . | S | Bend | trans | -130 | 67.8 | -176.3 | -64.9 | 167.4 | 0 | 0 | 0 | 109.6 | T128 L154 C155 F160 N161 | T128-L158 HydrophobicContact CG2-CD1 3.69Å; L154-L158 PolarHBondContact O-N 3.18Å; C155-L158 CarbonylContact O-C 3.49Å; L158-F160 PolarHBondContact O-N 3.37Å; L158-N161 HydrophobicContact CB-CB 3.97Å; L158-N161 WeakPolarHBondContact O-CB 3.25Å; L158-N161 PolarHBondContact O-N 2.89Å |
| 159 | P | 90.6 | Very high | 94.4 | Very high | 10 Ų | 10 | 20.8 Ų | 20.8 | 7% | 0.065 | 11% | 0.108 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -22 | -170.2 | 26.1 | -37.2 | 0 | 0 | 0 | 114.3 | C155 W165 R226 W305 | C155-P159 WeakPolarHBondContact O-CA 3.44Å; P159-W165 PolarHBondContact O-NE1 3.43Å; P159-R226 PolarHBondContact O-NH2 3.48Å; P159-W305 HydrophobicContact CB-CH2 3.9Å; P159-W305 HydrophobicContact CB-CZ2 3.85Å |
| 160 | F | 90.7 | Very high | 94.6 | Very high | 32 Ų | 32 | 22.3 Ų | 22.3 | 14% | 0.14 | 11% | 0.111 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -100.1 | 1.1 | -178.1 | -52.9 | -45.2 | 0 | 0 | 0 | 113.7 | L158 P162 L230 L278 M283 D286 | L158-F160 PolarHBondContact O-N 3.37Å; F160-P162 VanDerWaalsContact O-CD 3.25Å; F160-P162 WeakPolarHBondContact O-CD 3.44Å; F160-L230 HydrophobicContact CB-CD2 4.36Å; F160-L230 HydrophobicContact CD1-CD2 4.34Å; F160-L278 HydrophobicContact CD1-CD2 4.03Å; F160-L278 HydrophobicContact CE1-CD2 4.16Å; F160-M283 HydrophobicContact CB-CE 3.98Å; F160-M283 HydrophobicContact CD1-CE 3.92Å; F160-M283 HydrophobicContact CD1-CG 3.79Å; F160-M283 HydrophobicContact CD1-SD 4.24Å; F160-M283 HydrophobicContact CD2-CB 4.35Å; F160-M283 HydrophobicContact CD2-CG 4.14Å; F160-M283 HydrophobicContact CE1-CG 3.73Å; F160-M283 HydrophobicContact CE1-SD 4.48Å; F160-M283 HydrophobicContact CE2-CB 4.45Å; F160-M283 HydrophobicContact CE2-CG 4.08Å; F160-M283 HydrophobicContact CG-CE 4.01Å; F160-M283 HydrophobicContact CG-CG 4Å; F160-M283 HydrophobicContact CZ-CG 3.88Å; F160-D286 HydrophobicContact CE2-CB 3.9Å |
| 161 | N | 91.1 | Very high | 94.6 | Very high | 49 Ų | 49 | 22.4 Ų | 22.4 | 26% | 0.262 | 11% | 0.111 | S | C | . | . | trans | -85.3 | 108.7 | 175.3 | -174.2 | -35.3 | 0 | 0 | 0 | 110.3 | L158 W163 H164 W165 | L158-N161 HydrophobicContact CB-CB 3.97Å; L158-N161 WeakPolarHBondContact O-CB 3.25Å; L158-N161 PolarHBondContact O-N 2.89Å; N161-W163 PolarHBondContact O-N 3.22Å; N161-W163 WeakPolarHBondContact OD1-CB 3.41Å; N161-W163 PolarHBondContact OD1-N 3.24Å; N161-H164 PolarHBondContact ND2-CE1 3.13Å; N161-W165 VanDerWaalsContact O-CD1 3.24Å | ||
| 162 | P | 94.1 | Very high | 94.6 | Very high | 6 Ų | 6 | 22.2 Ų | 22.2 | 4% | 0.039 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.8 | -23.5 | -175.8 | 25.9 | -34.6 | 0 | 0 | 0 | 113.6 | F160 F166 L230 L231 L234 | F160-P162 VanDerWaalsContact O-CD 3.25Å; F160-P162 WeakPolarHBondContact O-CD 3.44Å; P162-F166 WeakPolarHBondContact O-CB 3.34Å; P162-F166 PolarHBondContact O-N 3.4Å; P162-L230 HydrophobicContact CB-CB 3.88Å; P162-L230 HydrophobicContact CB-CD1 4.3Å; P162-L231 HydrophobicContact CB-CD2 3.73Å; P162-L231 HydrophobicContact CB-CG 3.82Å; P162-L231 HydrophobicContact CG-CD2 3.62Å; P162-L231 HydrophobicContact CG-CG 4.28Å; P162-L234 HydrophobicContact CG-CD1 4.19Å |
| 163 | W | 95.1 | Very high | 94.5 | Very high | 61 Ų | 61 | 22.3 Ų | 22.3 | 23% | 0.231 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -75.5 | -32.1 | -171.3 | -52.8 | 109.9 | 0 | 0 | 0 | 112.8 | N161 S167 L231 R245 T249 | N161-W163 PolarHBondContact O-N 3.22Å; N161-W163 WeakPolarHBondContact OD1-CB 3.41Å; N161-W163 PolarHBondContact OD1-N 3.24Å; W163-S167 WeakPolarHBondContact O-CB 3.46Å; W163-S167 PolarHBondContact O-N 3.07Å; W163-S167 PolarHBondContact O-OG 2.8Å; W163-L231 HydrophobicContact CH2-CD2 4.38Å; W163-L231 HydrophobicContact CZ2-CD2 4.32Å; W163-R245 HydrophobicContact CH2-CG 3.7Å; W163-R245 HydrophobicContact CZ2-CG 4.38Å; W163-R245 HydrophobicContact CZ3-CG 4.28Å; W163-T249 HydrophobicContact CE3-CG2 4.45Å; W163-T249 HydrophobicContact CZ3-CG2 3.77Å; W163-T249 VanDerWaalsContact CZ3-OG1 3.27Å; W163-T249 WeakPolarHBondContact CZ3-OG1 3.27Å |
| 164 | H | 95.9 | Very high | 94.5 | Very high | 14 Ų | 14 | 23 Ų | 23 | 7% | 0.065 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -69.6 | -43.5 | 175.4 | -58.3 | 146.6 | 0 | 0 | 0 | 111 | L154 N161 F166 S167 L168 | L154-H164 HydrophobicContact CB-CB 4.14Å; N161-H164 PolarHBondContact ND2-CE1 3.13Å; H164-F166 PolarHBondContact O-N 3.18Å; H164-S167 PolarHBondContact O-N 3.34Å; H164-L168 WeakPolarHBondContact O-CB 3.38Å; H164-L168 PolarHBondContact O-N 2.89Å |
| 165 | W | 97.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -59 | -46.5 | 172.8 | -67.5 | 106.5 | 0 | 0 | 0 | 111.7 | C155 P159 N161 S167 L168 G169 M222 C223 R226 T227 L230 M274 F301 W305 | C155-W165 HydrophobicContact CB-CD2 4.11Å; C155-W165 HydrophobicContact CB-CE3 4.25Å; C155-W165 HydrophobicContact CB-CH2 3.88Å; C155-W165 HydrophobicContact CB-CZ2 3.71Å; C155-W165 HydrophobicContact CB-CZ3 4.16Å; P159-W165 PolarHBondContact O-NE1 3.43Å; N161-W165 VanDerWaalsContact O-CD1 3.24Å; W165-S167 VanDerWaalsContact C-N 3.34Å; W165-S167 PolarHBondContact O-N 2.97Å; W165-L168 PolarHBondContact O-N 3.01Å; W165-G169 PolarHBondContact O-N 3.05Å; W165-M222 HydrophobicContact CZ3-CE 3.97Å; W165-C223 WeakPolarHBondContact O-CB 3.42Å; W165-R226 HydrophobicContact CB-CG 4.41Å; W165-R226 HydrophobicContact CD2-CB 4.04Å; W165-R226 HydrophobicContact CD2-CG 3.45Å; W165-R226 VanDerWaalsContact CD2-CG 3.45Å; W165-R226 HydrophobicContact CE3-CB 4.11Å; W165-R226 HydrophobicContact CE3-CG 3.93Å; W165-R226 HydrophobicContact CG-CB 4.23Å; W165-R226 HydrophobicContact CG-CG 3.66Å; W165-R226 HydrophobicContact CH2-CG 4.46Å; W165-R226 HydrophobicContact CZ2-CG 4.05Å; W165-R226 HydrophobicContact CZ3-CG 4.4Å; W165-T227 WeakPolarHBondContact CB-OG1 3.28Å; W165-L230 HydrophobicContact CG-CD1 4.46Å; W165-M274 HydrophobicContact CE3-CE 4.22Å; W165-M274 HydrophobicContact CH2-CE 3.57Å; W165-M274 HydrophobicContact CZ2-CE 4.19Å; W165-M274 HydrophobicContact CZ3-CE 3.58Å; W165-F301 HydrophobicContact CE3-CE2 4.48Å; W165-F301 HydrophobicContact CH2-CD2 4.3Å; W165-F301 AromaticContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CZ 4.41Å; W165-F301 AromaticContact CZ3-CE2 3.46Å; W165-F301 HydrophobicContact CZ3-CE2 3.46Å; W165-F301 VanDerWaalsContact CZ3-CE2 3.46Å; W165-F301 AromaticContact CZ3-CZ 3.98Å; W165-F301 HydrophobicContact CZ3-CZ 3.98Å; W165-W305 AromaticContact CH2-CD2 3.77Å; W165-W305 HydrophobicContact CH2-CD2 3.77Å; W165-W305 AromaticContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CG 4.43Å; W165-W305 HydrophobicContact CH2-CH2 4.02Å; W165-W305 HydrophobicContact CH2-CZ2 4.14Å; W165-W305 AromaticContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CZ2-CD2 4.25Å; W165-W305 HydrophobicContact CZ2-CE3 4.17Å; W165-W305 AromaticContact CZ2-CH2 3.66Å; W165-W305 HydrophobicContact CZ2-CH2 3.66Å; W165-W305 AromaticContact CZ2-CZ2 3.74Å; W165-W305 HydrophobicContact CZ2-CZ2 3.74Å; W165-W305 AromaticContact CZ2-CZ3 3.89Å; W165-W305 HydrophobicContact CZ2-CZ3 3.89Å |
| 166 | F | 98.3 | Very high | 94.3 | Very high | 18 Ų | 18 | 25 Ų | 25 | 8% | 0.079 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -59.6 | -46.4 | 177.1 | -178.2 | -109.2 | 0 | 0 | 0 | 111.4 | P162 H164 L168 G169 Q170 F224 T227 T249 I252 | P162-F166 WeakPolarHBondContact O-CB 3.34Å; P162-F166 PolarHBondContact O-N 3.4Å; H164-F166 PolarHBondContact O-N 3.18Å; F166-L168 VanDerWaalsContact C-N 3.35Å; F166-L168 PolarHBondContact O-N 2.99Å; F166-G169 PolarHBondContact O-N 3.03Å; F166-Q170 HydrophobicContact CD1-CG 4.29Å; F166-Q170 HydrophobicContact CE1-CG 3.95Å; F166-Q170 HydrophobicContact CE2-CG 4.22Å; F166-Q170 VanDerWaalsContact CZ-CD 3.43Å; F166-Q170 HydrophobicContact CZ-CG 3.91Å; F166-Q170 WeakPolarHBondContact O-CG 3.35Å; F166-Q170 PolarHBondContact O-N 3.07Å; F166-F224 HydrophobicContact CD2-CD1 4.31Å; F166-F224 HydrophobicContact CD2-CE1 4.02Å; F166-F224 HydrophobicContact CE2-CE1 4.05Å; F166-T227 WeakPolarHBondContact CA-OG1 3.41Å; F166-T227 HydrophobicContact CB-CG2 3.75Å; F166-T227 HydrophobicContact CD2-CG2 4Å; F166-T227 HydrophobicContact CG-CG2 4.28Å; F166-T227 PolarHBondContact N-OG1 3.46Å; F166-T249 HydrophobicContact CD1-CG2 4.09Å; F166-T249 HydrophobicContact CD2-CG2 3.66Å; F166-T249 HydrophobicContact CE1-CG2 4.11Å; F166-T249 HydrophobicContact CE2-CG2 3.7Å; F166-T249 HydrophobicContact CG-CG2 3.86Å; F166-T249 HydrophobicContact CZ-CG2 3.92Å; F166-I252 HydrophobicContact CE2-CB 4.39Å; F166-I252 HydrophobicContact CE2-CG2 3.95Å; F166-I252 HydrophobicContact CZ-CB 4.38Å; F166-I252 HydrophobicContact CZ-CG2 3.84Å |
| 167 | S | 98 | Very high | 94.1 | Very high | 41 Ų | 41 | 26.6 Ų | 26.6 | 29% | 0.287 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -63.8 | -38.8 | 179.8 | -56.9 | 0 | 0 | 0 | 0 | 112.2 | W163 H164 W165 Q170 T171 | W163-S167 WeakPolarHBondContact O-CB 3.46Å; W163-S167 PolarHBondContact O-N 3.07Å; W163-S167 PolarHBondContact O-OG 2.8Å; H164-S167 PolarHBondContact O-N 3.34Å; W165-S167 VanDerWaalsContact C-N 3.34Å; W165-S167 PolarHBondContact O-N 2.97Å; S167-Q170 PolarHBondContact O-N 3.05Å; S167-T171 WeakPolarHBondContact O-CB 3.49Å; S167-T171 PolarHBondContact O-N 3.09Å; S167-T171 PolarHBondContact O-OG1 3.09Å |
| 168 | L | 97.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.6 | -44.8 | 174 | -176.3 | 54.2 | 0 | 0 | 0 | 111.5 | M148 L151 Q152 H164 W165 F166 T171 C172 C223 F301 | M148-L168 HydrophobicContact CB-CD1 4.18Å; M148-L168 HydrophobicContact CG-CD1 4.18Å; L151-L168 HydrophobicContact CB-CB 4.08Å; L151-L168 HydrophobicContact CB-CD1 3.89Å; L151-L168 HydrophobicContact CB-CG 4.42Å; L151-L168 HydrophobicContact CD1-CB 4.46Å; L151-L168 HydrophobicContact CD1-CD1 4.42Å; Q152-L168 HydrophobicContact CG-CD1 4.35Å; Q152-L168 HydrophobicContact CG-CD2 3.79Å; H164-L168 WeakPolarHBondContact O-CB 3.38Å; H164-L168 PolarHBondContact O-N 2.89Å; W165-L168 PolarHBondContact O-N 3.01Å; F166-L168 VanDerWaalsContact C-N 3.35Å; F166-L168 PolarHBondContact O-N 2.99Å; L168-T171 PolarHBondContact O-N 3.5Å; L168-C172 PolarHBondContact O-N 3.33Å; L168-C172 PolarHBondContact O-SG 2.96Å; L168-C223 VanDerWaalsContact CD2-SG 3.56Å; L168-C223 VanDerWaalsContact CG-SG 3.56Å; L168-F301 HydrophobicContact CD2-CE2 4.02Å; L168-F301 HydrophobicContact CD2-CZ 4.15Å |
| 169 | G | 97.8 | Very high | 93 | Very high | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -60.4 | -44.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | W165 F166 T171 C172 L173 | W165-G169 PolarHBondContact O-N 3.05Å; F166-G169 PolarHBondContact O-N 3.03Å; G169-T171 PolarHBondContact O-N 3.12Å; G169-C172 PolarHBondContact O-N 3.02Å; G169-L173 PolarHBondContact O-N 2.93Å |
| 170 | Q | 97.3 | Very high | 91.6 | Very high | 72 Ų | 72 | 34.1 Ų | 34.1 | 34% | 0.336 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -62.5 | -41.8 | 174.9 | -72.3 | -171.2 | -57.4 | 0 | 0 | 112.5 | F166 S167 C172 L173 Q174 F224 | F166-Q170 HydrophobicContact CD1-CG 4.29Å; F166-Q170 HydrophobicContact CE1-CG 3.95Å; F166-Q170 HydrophobicContact CE2-CG 4.22Å; F166-Q170 VanDerWaalsContact CZ-CD 3.43Å; F166-Q170 HydrophobicContact CZ-CG 3.91Å; F166-Q170 WeakPolarHBondContact O-CG 3.35Å; F166-Q170 PolarHBondContact O-N 3.07Å; S167-Q170 PolarHBondContact O-N 3.05Å; Q170-C172 VanDerWaalsContact C-N 3.32Å; Q170-C172 PolarHBondContact O-N 3.39Å; Q170-L173 PolarHBondContact O-N 3.44Å; Q170-Q174 VanDerWaalsContact O-CG 3.32Å; Q170-Q174 WeakPolarHBondContact O-CG 3.42Å; Q170-Q174 PolarHBondContact O-N 3.16Å; Q170-F224 HydrophobicContact CG-CE1 4.36Å; Q170-F224 HydrophobicContact CG-CZ 4.38Å |
| 171 | T | 96.4 | Very high | 89.9 | Confident | 4 Ų | 4 | 37.9 Ų | 37.9 | 3% | 0.025 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63 | -40.8 | 177.3 | -55.5 | 0 | 0 | 0 | 0 | 110.8 | V144 Q147 M148 L151 S167 L168 G169 L175 | V144-T171 HydrophobicContact CG1-CG2 3.85Å; Q147-T171 HydrophobicContact CG-CG2 4.4Å; Q147-T171 PolarHBondContact NE2-OG1 3.45Å; M148-T171 HydrophobicContact CG-CG2 3.6Å; M148-T171 HydrophobicContact SD-CG2 4.45Å; L151-T171 WeakPolarHBondContact CD1-OG1 3.41Å; S167-T171 WeakPolarHBondContact O-CB 3.49Å; S167-T171 PolarHBondContact O-N 3.09Å; S167-T171 PolarHBondContact O-OG1 3.09Å; L168-T171 PolarHBondContact O-N 3.5Å; G169-T171 PolarHBondContact O-N 3.12Å; T171-L175 PolarHBondContact O-N 3.27Å; T171-L175 VanDerWaalsContact O-N 3.12Å |
| 172 | C | 96.1 | Very high | 87.9 | Confident | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64 | -44 | 174.5 | -62.7 | 0 | 0 | 0 | 0 | 111.5 | L168 G169 Q170 Q174 L175 L176 V216 A220 | L168-C172 PolarHBondContact O-N 3.33Å; L168-C172 PolarHBondContact O-SG 2.96Å; G169-C172 PolarHBondContact O-N 3.02Å; Q170-C172 VanDerWaalsContact C-N 3.32Å; Q170-C172 PolarHBondContact O-N 3.39Å; C172-Q174 PolarHBondContact O-N 3.34Å; C172-L175 WeakPolarHBondContact O-CB 3.41Å; C172-L175 PolarHBondContact O-N 2.89Å; C172-L176 WeakPolarHBondContact O-CG 3.46Å; C172-L176 PolarHBondContact O-N 3.46Å; C172-V216 HydrophobicContact CB-CG1 3.86Å; C172-V216 WeakPolarHBondContact O-CG1 3.5Å; C172-A220 HydrophobicContact CB-CB 3.66Å |
| 173 | L | 94.4 | Very high | 85.6 | Confident | 28 Ų | 28 | 50.3 Ų | 50.3 | 15% | 0.147 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 179.2 | -169.9 | 65.1 | 0 | 0 | 0 | 112 | G169 Q170 L175 L176 D177 F224 A256 L260 | G169-L173 PolarHBondContact O-N 2.93Å; Q170-L173 PolarHBondContact O-N 3.44Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.47Å; L173-L176 PolarHBondContact O-N 2.76Å; L173-D177 PolarHBondContact O-N 2.98Å; L173-F224 HydrophobicContact CB-CE2 4.43Å; L173-F224 HydrophobicContact CD2-CE2 4.48Å; L173-F224 HydrophobicContact CD2-CZ 4.43Å; L173-A256 HydrophobicContact CD2-CB 4.32Å; L173-L260 HydrophobicContact CD1-CD2 4Å; L173-L260 HydrophobicContact CD1-CG 4.34Å |
| 174 | Q | 92.6 | Very high | 83.1 | Confident | 100 Ų | 100 | 53.2 Ų | 53.2 | 47% | 0.467 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -59 | -39.5 | 173.8 | -74.1 | 171.2 | -5.1 | 0 | 0 | 112 | Q170 C172 D177 C178 | Q170-Q174 VanDerWaalsContact O-CG 3.32Å; Q170-Q174 WeakPolarHBondContact O-CG 3.42Å; Q170-Q174 PolarHBondContact O-N 3.16Å; C172-Q174 PolarHBondContact O-N 3.34Å; Q174-D177 PolarHBondContact O-N 3.47Å; Q174-C178 PolarHBondContact O-N 3.48Å; Q174-C178 PolarHBondContact O-SG 3.31Å |
| 175 | L | 91.2 | Very high | 80.2 | Confident | 27 Ų | 27 | 59.6 Ų | 59.6 | 14% | 0.141 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.4 | -40.1 | 177.5 | -176.1 | 59.4 | 0 | 0 | 0 | 112.2 | V144 M148 T171 C172 L173 D177 N179 L211 V216 | V144-L175 HydrophobicContact CG1-CB 4.2Å; V144-L175 HydrophobicContact CG1-CD1 4.22Å; V144-L175 HydrophobicContact CG1-CD2 4.05Å; V144-L175 HydrophobicContact CG1-CG 4.39Å; M148-L175 HydrophobicContact SD-CD2 4.14Å; T171-L175 PolarHBondContact O-N 3.27Å; T171-L175 VanDerWaalsContact O-N 3.12Å; C172-L175 WeakPolarHBondContact O-CB 3.41Å; C172-L175 PolarHBondContact O-N 2.89Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.47Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-N179 VanDerWaalsContact O-CG 3.25Å; L175-N179 PolarHBondContact O-N 3.14Å; L175-N179 VanDerWaalsContact O-N 3.1Å; L175-N179 PolarHBondContact O-ND2 3.35Å; L175-L211 HydrophobicContact CD2-CD2 3.99Å; L175-V216 HydrophobicContact CB-CG1 4.23Å; L175-V216 HydrophobicContact CD2-CG1 4.01Å; L175-V216 HydrophobicContact CD2-CG2 3.8Å; L175-V216 HydrophobicContact CG-CG1 4.34Å |
| 176 | L | 92.2 | Very high | 77.5 | Confident | 16 Ų | 16 | 64.5 Ų | 64.5 | 8% | 0.084 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 174.3 | -65 | 169.9 | 0 | 0 | 0 | 111.3 | C172 L173 N179 S180 E213 V216 W217 L260 | C172-L176 WeakPolarHBondContact O-CG 3.46Å; C172-L176 PolarHBondContact O-N 3.46Å; L173-L176 PolarHBondContact O-N 2.76Å; L176-N179 PolarHBondContact O-N 3.06Å; L176-S180 PolarHBondContact O-N 3.36Å; L176-E213 HydrophobicContact CD2-CG 3.66Å; L176-V216 HydrophobicContact CD1-CG1 4.44Å; L176-V216 HydrophobicContact CD2-CB 4Å; L176-V216 HydrophobicContact CD2-CG1 3.84Å; L176-V216 HydrophobicContact CG-CG1 3.81Å; L176-W217 HydrophobicContact CD1-CB 4.25Å; L176-W217 HydrophobicContact CD2-CB 4.39Å; L176-L260 HydrophobicContact CD1-CD2 3.87Å |
| 177 | D | 89.2 | Confident | 74.4 | Confident | 45 Ų | 45 | 72.6 Ų | 72.6 | 24% | 0.241 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 179.3 | -65.3 | -6.5 | 0 | 0 | 0 | 111.1 | L173 Q174 L175 N179 S180 D181 R259 | L173-D177 PolarHBondContact O-N 2.98Å; Q174-D177 PolarHBondContact O-N 3.47Å; L175-D177 VanDerWaalsContact C-N 3.33Å; D177-N179 VanDerWaalsContact C-N 3.27Å; D177-N179 PolarHBondContact O-N 2.98Å; D177-S180 PolarHBondContact O-N 2.95Å; D177-S180 VanDerWaalsContact O-N 3.16Å; D177-S180 PolarHBondContact O-OG 2.95Å; D177-D181 PolarHBondContact O-N 3.23Å; D177-R259 VanDerWaalsContact CG-NH2 3.29Å; D177-R259 IonicContact OD1-CZ 2.72Å; D177-R259 IonicContact OD1-NH1 3.26Å; D177-R259 PolarHBondContact OD1-NH1 2.96Å; D177-R259 VanDerWaalsContact OD1-NH1 3.08Å; D177-R259 IonicContact OD1-NH2 3.35Å; D177-R259 PolarHBondContact OD1-NH2 2.89Å; D177-R259 IonicContact OD2-CZ 3.59Å; D177-R259 IonicContact OD2-NH1 2.81Å; D177-R259 PolarHBondContact OD2-NH1 3.24Å; D177-R259 IonicContact OD2-NH2 3.46Å; D177-R259 PolarHBondContact OD2-NH2 3.24Å |
| 178 | C | 83.7 | Confident | 71.1 | Confident | 75 Ų | 75 | 76.4 Ų | 76.4 | 51% | 0.507 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.5 | -34 | 176.9 | -69.6 | 0 | 0 | 0 | 0 | 113.1 | Q174 D181 M182 | Q174-C178 PolarHBondContact O-N 3.48Å; Q174-C178 PolarHBondContact O-SG 3.31Å; C178-D181 PolarHBondContact O-N 3.25Å; C178-M182 PolarHBondContact O-N 3.04Å |
| 179 | N | 72.1 | Confident | 67.9 | Low | 64 Ų | 64 | 83 Ų | 83 | 34% | 0.342 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -71.8 | -35.5 | 177.1 | -71.9 | -16.7 | 0 | 0 | 0 | 111.9 | L175 L176 D177 D181 M182 | L175-N179 VanDerWaalsContact O-CG 3.25Å; L175-N179 PolarHBondContact O-N 3.14Å; L175-N179 VanDerWaalsContact O-N 3.1Å; L175-N179 PolarHBondContact O-ND2 3.35Å; L176-N179 PolarHBondContact O-N 3.06Å; D177-N179 VanDerWaalsContact C-N 3.27Å; D177-N179 PolarHBondContact O-N 2.98Å; N179-D181 VanDerWaalsContact C-N 3.29Å; N179-D181 PolarHBondContact O-N 2.92Å; N179-M182 PolarHBondContact O-N 3.36Å |
| 180 | S | 62.1 | Low | 64.9 | Low | 64 Ų | 64 | 88.4 Ų | 88.4 | 45% | 0.448 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.8 | -28.4 | 174.5 | 62.7 | 0 | 0 | 0 | 0 | 113.5 | L176 D177 | L176-S180 PolarHBondContact O-N 3.36Å; D177-S180 PolarHBondContact O-N 2.95Å; D177-S180 VanDerWaalsContact O-N 3.16Å; D177-S180 PolarHBondContact O-OG 2.95Å |
| 181 | D | 54.9 | Low | 61.6 | Low | 111 Ų | 111 | 93.8 Ų | 93.8 | 59% | 0.594 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -78.9 | -23.7 | 176.4 | -70.3 | -28.7 | 0 | 0 | 0 | 112.9 | D177 C178 N179 E183 T184 | D177-D181 PolarHBondContact O-N 3.23Å; C178-D181 PolarHBondContact O-N 3.25Å; N179-D181 VanDerWaalsContact C-N 3.29Å; N179-D181 PolarHBondContact O-N 2.92Å; D181-E183 VanDerWaalsContact C-N 3.27Å; D181-E183 PolarHBondContact O-N 3.12Å; D181-T184 PolarHBondContact O-N 2.73Å |
| 182 | M | 49.6 | Very low | 58.8 | Low | 132 Ų | 132 | 105.3 Ų | 105.3 | 65% | 0.65 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -16.2 | 178.2 | -85.1 | -79 | -165.5 | 0 | 0 | 113.8 | C178 N179 T184 | C178-M182 PolarHBondContact O-N 3.04Å; N179-M182 PolarHBondContact O-N 3.36Å; M182-T184 PolarHBondContact O-N 3.14Å |
| 183 | E | 44.5 | Very low | 55.6 | Low | 184 Ų | 184 | 110.8 Ų | 110.8 | 86% | 0.86 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | -13.1 | 166.9 | -74.7 | -167.3 | 152.6 | 0 | 0 | 112.5 | D181 | D181-E183 VanDerWaalsContact C-N 3.27Å; D181-E183 PolarHBondContact O-N 3.12Å |
| 184 | T | 43.3 | Very low | 52.7 | Low | 123 Ų | 123 | 114.9 Ų | 114.9 | 76% | 0.755 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.5 | -11.1 | -179 | -55.2 | 0 | 0 | 0 | 0 | 114.6 | D181 M182 | D181-T184 PolarHBondContact O-N 2.73Å; M182-T184 PolarHBondContact O-N 3.14Å |
| 185 | M | 35 | Very low | 49.6 | Very low | 147 Ų | 147 | 119.1 Ų | 119.1 | 72% | 0.724 | 65% | 0.645 | S | S | * | * | trans | -139.1 | 93.4 | -178.9 | -90.7 | -88.3 | -172.3 | 0 | 0 | 112.1 | ||||
| 186 | C | 40.8 | Very low | 46.8 | Very low | 104 Ų | 104 | 122.4 Ų | 122.4 | 70% | 0.703 | 68% | 0.676 | S | S | * | * | trans | -68.9 | 143.5 | 163.7 | -167 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 187 | F | 33.3 | Very low | 43.9 | Very low | 188 Ų | 188 | 128.6 Ų | 128.6 | 83% | 0.825 | 71% | 0.708 | S | S | * | * | trans | 83.1 | 101.7 | 175.8 | -62.6 | -85.4 | 0 | 0 | 0 | 117.1 | ||||
| 188 | C | 28.9 | Very low | 41.1 | Very low | 121 Ų | 121 | 136.5 Ų | 136.5 | 82% | 0.818 | 74% | 0.741 | S | S | * | * | -179.2 | 82 | 122 | -85.5 | 0 | 0 | 0 | 0 | 108.8 | P190 | C188-P190 WeakPolarHBondContact O-CD 3.46Š| |||
| 189 | V | 31.4 | Very low | 38.6 | Very low | 138 Ų | 138 | 136.4 Ų | 136.4 | 84% | 0.836 | 75% | 0.752 | S | S | * | * | trans | -87.4 | 115 | 160.5 | 178.5 | 0 | 0 | 0 | 0 | 106 | E191 | V189-E191 PolarHBondContact O-N 2.93Š| ||
| 190 | P | 33.3 | Very low | 36.7 | Very low | 113 Ų | 113 | 140.8 Ų | 140.8 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | trans | -68.6 | 124.8 | 165.4 | -7.2 | 24 | 0 | 0 | 0 | 107.1 | C188 R192 | C188-P190 WeakPolarHBondContact O-CD 3.46Å; P190-R192 PolarHBondContact O-N 3.2Å | ||
| 191 | E | 28.7 | Very low | 35.7 | Very low | 186 Ų | 186 | 141.6 Ų | 141.6 | 87% | 0.869 | 78% | 0.776 | S | S | * | * | trans | -46.3 | 128.9 | 172.9 | -69.6 | 178.4 | 146.5 | 0 | 0 | 110.2 | V189 S193 | V189-E191 PolarHBondContact O-N 2.93Å; E191-S193 PolarHBondContact O-N 2.9Å | ||
| 192 | R | 37.2 | Very low | 34.6 | Very low | 245 Ų | 245 | 144.9 Ų | 144.9 | 93% | 0.925 | 79% | 0.788 | S | S | * | * | trans | -59.3 | 102.2 | 166.1 | -80.7 | 179.3 | 174.4 | -177.9 | -3.5 | 107.5 | P190 S194 | P190-R192 PolarHBondContact O-N 3.2Å; R192-S194 VanDerWaalsContact C-N 3.31Å; R192-S194 PolarHBondContact O-N 3.32Å | ||
| 193 | S | 28.7 | Very low | 34.1 | Very low | 116 Ų | 116 | 141.7 Ų | 141.7 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -64.6 | 99.7 | 160.6 | 52 | 0 | 0 | 0 | 0 | 107.5 | E191 E195 | E191-S193 PolarHBondContact O-N 2.9Å; S193-E195 PolarHBondContact O-N 3.39Å; S193-E195 VanDerWaalsContact O-N 3.09Å | ||
| 194 | S | 34.2 | Very low | 34 | Very low | 114 Ų | 114 | 137.9 Ų | 137.9 | 80% | 0.797 | 77% | 0.768 | S | S | * | * | trans | -62.6 | 97.5 | 169.5 | 153.3 | 0 | 0 | 0 | 0 | 109.1 | R192 | R192-S194 VanDerWaalsContact C-N 3.31Å; R192-S194 PolarHBondContact O-N 3.32Å | ||
| 195 | E | 26.9 | Very low | 33.7 | Very low | 189 Ų | 189 | 139.7 Ų | 139.7 | 88% | 0.883 | 77% | 0.768 | S | S | * | * | trans | -144.8 | 111.7 | 152.1 | -107.8 | 165.5 | -158.7 | 0 | 0 | 108.6 | S193 L197 | S193-E195 PolarHBondContact O-N 3.39Å; S193-E195 VanDerWaalsContact O-N 3.09Å; E195-L197 PolarHBondContact O-N 3.36Å | ||
| 196 | A | 33.6 | Very low | 34 | Very low | 95 Ų | 95 | 138 Ų | 138 | 79% | 0.785 | 76% | 0.758 | S | S | * | * | trans | -74 | 118.7 | -166 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 197 | L | 31.3 | Very low | 34.3 | Very low | 147 Ų | 147 | 134.4 Ų | 134.4 | 77% | 0.77 | 74% | 0.739 | S | S | * | * | trans | -88.5 | 98.6 | 153.2 | -89 | 138.6 | 0 | 0 | 0 | 107.9 | E195 G199 | E195-L197 PolarHBondContact O-N 3.36Å; L197-G199 PolarHBondContact O-N 3.39Å | ||
| 198 | K | 30.3 | Very low | 34.8 | Very low | 211 Ų | 211 | 129.4 Ų | 129.4 | 92% | 0.917 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -57.1 | 99.2 | 171.3 | -80.6 | 175.9 | 173.1 | 175.5 | 0 | 109.8 | ||
| 199 | G | 30.6 | Very low | 35.9 | Very low | 73 Ų | 73 | 126.8 Ų | 126.8 | 75% | 0.753 | 72% | 0.719 | S | S | * | * | trans | 175.8 | 31.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | L197 S201 | L197-G199 PolarHBondContact O-N 3.39Å; G199-S201 PolarHBondContact O-N 2.95Å | ||
| 200 | E | 32.6 | Very low | 37.4 | Very low | 155 Ų | 155 | 121.3 Ų | 121.3 | 72% | 0.724 | 69% | 0.685 | S | S | * | * | trans | -80.9 | 116.3 | 176.5 | -65.1 | -178.9 | 171.4 | 0 | 0 | 108.1 | ||||
| 201 | S | 39.8 | Very low | 39.2 | Very low | 81 Ų | 81 | 119.2 Ų | 119.2 | 57% | 0.566 | 67% | 0.667 | S | S | * | * | trans | -71.8 | 148.9 | 173.3 | 179.7 | 0 | 0 | 0 | 0 | 109.2 | G199 A203 D204 | G199-S201 PolarHBondContact O-N 2.95Å; S201-A203 PolarHBondContact O-N 3.16Å; S201-D204 PolarHBondContact O-N 2.57Å | ||
| 202 | E | 32.4 | Very low | 42 | Very low | 180 Ų | 180 | 113.6 Ų | 113.6 | 84% | 0.841 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.6 | -17.1 | 177 | -63.5 | -175.5 | 159.3 | 0 | 0 | 113.9 | D204 | E202-D204 VanDerWaalsContact C-N 3.32Å; E202-D204 PolarHBondContact O-N 2.64Å |
| 203 | A | 40.2 | Very low | 44.4 | Very low | 65 Ų | 65 | 107.8 Ų | 107.8 | 54% | 0.537 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -63.8 | -25.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | S201 | S201-A203 PolarHBondContact O-N 3.16Å |
| 204 | D | 40.9 | Very low | 47.3 | Very low | 104 Ų | 104 | 108.5 Ų | 108.5 | 56% | 0.556 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -82.5 | -19.9 | -174.3 | -74.5 | -36.2 | 0 | 0 | 0 | 113.5 | S201 E202 | S201-D204 PolarHBondContact O-N 2.57Å; E202-D204 VanDerWaalsContact C-N 3.32Å; E202-D204 PolarHBondContact O-N 2.64Å |
| 205 | Q | 37.3 | Very low | 50 | Low | 162 Ų | 162 | 106.9 Ų | 106.9 | 76% | 0.757 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -84.2 | -26 | 177.7 | -69.5 | -177.3 | 15.1 | 0 | 0 | 112.8 | ||
| 206 | E | 41.4 | Very low | 53.1 | Low | 110 Ų | 110 | 97.9 Ų | 97.9 | 51% | 0.514 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -82.7 | -16.8 | -179.5 | -158.8 | 152 | -172.3 | 0 | 0 | 113.2 | R302 | E206-R302 IonicContact OE1-CZ 3.87Å; E206-R302 VanDerWaalsContact OE1-CZ 3.3Å; E206-R302 IonicContact OE1-NH1 2.81Å; E206-R302 PolarHBondContact OE1-NH1 3.36Å; E206-R302 IonicContact OE1-NH2 3.13Å; E206-R302 PolarHBondContact OE1-NH2 3.11Å |
| 207 | G | 46.3 | Very low | 56.1 | Low | 30 Ų | 30 | 96.6 Ų | 96.6 | 31% | 0.309 | 53% | 0.533 | S | S | . | . | S | Bend | trans | -71.7 | -27.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | A209 E210 L211 | G207-A209 PolarHBondContact O-N 3.09Å; G207-E210 PolarHBondContact O-N 2.97Å; G207-L211 WeakPolarHBondContact O-CG 3.47Å |
| 208 | A | 45.5 | Very low | 59.1 | Low | 82 Ų | 82 | 90.2 Ų | 90.2 | 68% | 0.678 | 50% | 0.499 | S | S | * | . | G | 310 helix | trans | -71.5 | -31.8 | -174 | 0 | 0 | 0 | 0 | 0 | 113.7 | E210 | A208-E210 VanDerWaalsContact C-N 3.31Š|
| 209 | A | 51.1 | Low | 62.1 | Low | 66 Ų | 66 | 80.2 Ų | 80.2 | 55% | 0.545 | 46% | 0.456 | S | S | . | . | G | 310 helix | trans | -81.9 | -9.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | G207 R215 | G207-A209 PolarHBondContact O-N 3.09Å; A209-R215 PolarHBondContact O-NH1 3.48Å |
| 210 | E | 62.1 | Low | 65.3 | Low | 23 Ų | 23 | 76.8 Ų | 76.8 | 11% | 0.107 | 42% | 0.42 | C | S | . | . | G | 310 helix | trans | -94.7 | 1.5 | -178.9 | -74.6 | -159.9 | 173.5 | 0 | 0 | 114.7 | G207 A208 R219 R302 | G207-E210 PolarHBondContact O-N 2.97Å; A208-E210 VanDerWaalsContact C-N 3.31Å; E210-R219 PolarHBondContact O-NH1 2.79Å; E210-R219 IonicContact OE2-CZ 2.89Å; E210-R219 IonicContact OE2-NH2 3.3Å; E210-R219 PolarHBondContact OE2-NH2 2.98Å; E210-R302 IonicContact OE1-CZ 2.76Å; E210-R302 IonicContact OE1-NE 3.22Å; E210-R302 PolarHBondContact OE1-NE 3.28Å; E210-R302 IonicContact OE1-NH2 2.64Å; E210-R302 PolarHBondContact OE1-NH2 3.44Å |
| 211 | L | 72.7 | Confident | 68.4 | Low | 70 Ų | 70 | 69.4 Ų | 69.4 | 37% | 0.366 | 39% | 0.386 | S | S | . | . | trans | -107.3 | 17.3 | -177.8 | -64.2 | 173.7 | 0 | 0 | 0 | 113.7 | M148 L175 G207 V216 | M148-L211 HydrophobicContact CE-CD2 4.31Å; M148-L211 HydrophobicContact SD-CD2 4.03Å; L175-L211 HydrophobicContact CD2-CD2 3.99Å; G207-L211 WeakPolarHBondContact O-CG 3.47Å; L211-V216 HydrophobicContact CD2-CG2 4.42Å | ||
| 212 | T | 86.1 | Confident | 71.1 | Confident | 67 Ų | 67 | 65.5 Ų | 65.5 | 41% | 0.411 | 36% | 0.359 | S | S | . | . | S | Bend | trans | -63.2 | 147.7 | 169.6 | 66.3 | 0 | 0 | 0 | 0 | 110.1 | D214 R215 V216 | T212-D214 VanDerWaalsContact C-N 3.32Å; T212-D214 PolarHBondContact O-N 2.9Å; T212-R215 PolarHBondContact O-N 2.97Å; T212-R215 WeakPolarHBondContact OG1-CB 3.14Å; T212-R215 VanDerWaalsContact OG1-CG 3.25Å; T212-R215 WeakPolarHBondContact OG1-CG 3.34Å; T212-V216 WeakPolarHBondContact O-CG2 3.36Å; T212-V216 PolarHBondContact O-N 3.37Å |
| 213 | E | 88.1 | Confident | 74.2 | Confident | 123 Ų | 123 | 57 Ų | 57 | 58% | 0.575 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -53.7 | -47.6 | -176.3 | -166.7 | 178 | 164.3 | 0 | 0 | 112.2 | L176 R215 V216 W217 | L176-E213 HydrophobicContact CD2-CG 3.66Å; E213-R215 VanDerWaalsContact C-N 3.3Å; E213-R215 PolarHBondContact O-N 3.49Å; E213-V216 PolarHBondContact O-N 2.86Å; E213-V216 VanDerWaalsContact O-N 3.17Å; E213-W217 WeakPolarHBondContact O-CB 3.36Å; E213-W217 PolarHBondContact O-N 3.3Å |
| 214 | D | 89.6 | Confident | 77 | Confident | 132 Ų | 132 | 54 Ų | 54 | 71% | 0.706 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -57.5 | -39.3 | 176.3 | -65.9 | -26.1 | 0 | 0 | 0 | 113.2 | T212 L218 | T212-D214 VanDerWaalsContact C-N 3.32Å; T212-D214 PolarHBondContact O-N 2.9Å; D214-L218 VanDerWaalsContact O-CB 3.27Å; D214-L218 WeakPolarHBondContact O-CB 3.37Å; D214-L218 PolarHBondContact O-N 3.46Å |
| 215 | R | 91.1 | Very high | 79.7 | Confident | 80 Ų | 80 | 49 Ų | 49 | 30% | 0.302 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -73.3 | -39 | 179.1 | -73.8 | -177 | -179.9 | -150.1 | -0.2 | 111.2 | A209 T212 E213 L218 R219 W306 | A209-R215 PolarHBondContact O-NH1 3.48Å; T212-R215 PolarHBondContact O-N 2.97Å; T212-R215 WeakPolarHBondContact OG1-CB 3.14Å; T212-R215 VanDerWaalsContact OG1-CG 3.25Å; T212-R215 WeakPolarHBondContact OG1-CG 3.34Å; E213-R215 VanDerWaalsContact C-N 3.3Å; E213-R215 PolarHBondContact O-N 3.49Å; R215-L218 PolarHBondContact O-N 3Å; R215-R219 VanDerWaalsContact O-CB 3.24Å; R215-R219 WeakPolarHBondContact O-CB 3.5Å; R215-R219 PolarHBondContact O-N 3Å; R215-W306 HydrophobicContact CB-CH2 4.43Å; R215-W306 HydrophobicContact CB-CZ2 4.17Å; R215-W306 HydrophobicContact CG-CZ2 4.28Å; R215-W306 WeakPolarHBondContact O-CH2 3.43Å |
| 216 | V | 92.6 | Very high | 82.6 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66 | -42.4 | 175.6 | 177.7 | 0 | 0 | 0 | 0 | 110.1 | C172 L175 L176 L211 T212 E213 R219 A220 | C172-V216 HydrophobicContact CB-CG1 3.86Å; C172-V216 WeakPolarHBondContact O-CG1 3.5Å; L175-V216 HydrophobicContact CB-CG1 4.23Å; L175-V216 HydrophobicContact CD2-CG1 4.01Å; L175-V216 HydrophobicContact CD2-CG2 3.8Å; L175-V216 HydrophobicContact CG-CG1 4.34Å; L176-V216 HydrophobicContact CD1-CG1 4.44Å; L176-V216 HydrophobicContact CD2-CB 4Å; L176-V216 HydrophobicContact CD2-CG1 3.84Å; L176-V216 HydrophobicContact CG-CG1 3.81Å; L211-V216 HydrophobicContact CD2-CG2 4.42Å; T212-V216 WeakPolarHBondContact O-CG2 3.36Å; T212-V216 PolarHBondContact O-N 3.37Å; E213-V216 PolarHBondContact O-N 2.86Å; E213-V216 VanDerWaalsContact O-N 3.17Å; V216-R219 PolarHBondContact O-N 3.21Å; V216-A220 WeakPolarHBondContact O-CB 3.09Å; V216-A220 PolarHBondContact O-N 3.23Å |
| 217 | W | 95.3 | Very high | 85.3 | Confident | 67 Ų | 67 | 36 Ų | 36 | 25% | 0.254 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -59.2 | -50.2 | 173.6 | 177.3 | 92.4 | 0 | 0 | 0 | 111.8 | L176 E213 R219 A220 C221 L260 P262 T266 | L176-W217 HydrophobicContact CD1-CB 4.25Å; L176-W217 HydrophobicContact CD2-CB 4.39Å; E213-W217 WeakPolarHBondContact O-CB 3.36Å; E213-W217 PolarHBondContact O-N 3.3Å; W217-R219 VanDerWaalsContact C-N 3.27Å; W217-R219 PolarHBondContact O-N 3.23Å; W217-A220 WeakPolarHBondContact O-CB 3.49Å; W217-A220 PolarHBondContact O-N 2.94Å; W217-A220 VanDerWaalsContact O-N 3.13Å; W217-C221 PolarHBondContact O-N 3.25Å; W217-C221 PolarHBondContact O-SG 2.93Å; W217-L260 HydrophobicContact CG-CD2 4.42Å; W217-L260 PolarHBondContact NE1-O 2.69Å; W217-P262 HydrophobicContact CH2-CB 3.79Å; W217-P262 HydrophobicContact CZ2-CB 3.77Å; W217-T266 HydrophobicContact CH2-CG2 4.11Å; W217-T266 HydrophobicContact CZ3-CG2 4.25Å |
| 218 | L | 94.7 | Very high | 87.7 | Confident | 13 Ų | 13 | 36.1 Ų | 36.1 | 7% | 0.068 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61.5 | -39.6 | 179.3 | -170.9 | 63.9 | 0 | 0 | 0 | 111.4 | D214 R215 C221 M222 T266 L270 W306 I309 L310 A313 | D214-L218 VanDerWaalsContact O-CB 3.27Å; D214-L218 WeakPolarHBondContact O-CB 3.37Å; D214-L218 PolarHBondContact O-N 3.46Å; R215-L218 PolarHBondContact O-N 3Å; L218-C221 PolarHBondContact O-N 2.88Å; L218-M222 PolarHBondContact O-N 3.12Å; L218-T266 HydrophobicContact CD1-CG2 4.41Å; L218-L270 HydrophobicContact CD1-CD1 4.1Å; L218-L270 HydrophobicContact CD1-CD2 4.05Å; L218-L270 HydrophobicContact CD1-CG 4.49Å; L218-W306 HydrophobicContact CB-CH2 4.32Å; L218-W306 HydrophobicContact CD2-CH2 4.3Å; L218-W306 HydrophobicContact CG-CH2 4.46Å; L218-W306 HydrophobicContact CG-CZ3 4.46Å; L218-I309 HydrophobicContact CD1-CG2 4.21Å; L218-I309 HydrophobicContact CD2-CG2 3.56Å; L218-I309 HydrophobicContact CG-CG2 3.74Å; L218-L310 HydrophobicContact CD2-CD2 4.33Å; L218-A313 HydrophobicContact CD2-CB 3.94Å |
| 219 | R | 94.6 | Very high | 90.1 | Very high | 2 Ų | 2 | 33.7 Ų | 33.7 | 1% | 0.008 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.6 | -42 | 175.1 | -168.1 | 173.6 | -71.6 | 137 | -13.6 | 112 | E210 R215 V216 W217 M222 C223 W306 | E210-R219 PolarHBondContact O-NH1 2.79Å; E210-R219 IonicContact OE2-CZ 2.89Å; E210-R219 IonicContact OE2-NH2 3.3Å; E210-R219 PolarHBondContact OE2-NH2 2.98Å; R215-R219 VanDerWaalsContact O-CB 3.24Å; R215-R219 WeakPolarHBondContact O-CB 3.5Å; R215-R219 PolarHBondContact O-N 3Å; V216-R219 PolarHBondContact O-N 3.21Å; W217-R219 VanDerWaalsContact C-N 3.27Å; W217-R219 PolarHBondContact O-N 3.23Å; R219-M222 HydrophobicContact CG-SD 4.49Å; R219-M222 WeakPolarHBondContact O-CG 3.48Å; R219-C223 WeakPolarHBondContact O-CB 3.34Å; R219-C223 PolarHBondContact O-N 3.1Å; R219-C223 VanDerWaalsContact O-N 3.09Å; R219-C223 PolarHBondContact O-SG 3.5Å; R219-W306 HydrophobicContact CB-CH2 4.05Å; R219-W306 HydrophobicContact CB-CZ3 3.97Å; R219-W306 HydrophobicContact CG-CZ3 4.41Å |
| 220 | A | 97 | Very high | 92.1 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59.6 | -49.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | C172 V216 W217 M222 C223 F224 L260 | C172-A220 HydrophobicContact CB-CB 3.66Å; V216-A220 WeakPolarHBondContact O-CB 3.09Å; V216-A220 PolarHBondContact O-N 3.23Å; W217-A220 WeakPolarHBondContact O-CB 3.49Å; W217-A220 PolarHBondContact O-N 2.94Å; W217-A220 VanDerWaalsContact O-N 3.13Å; A220-M222 PolarHBondContact O-N 2.91Å; A220-C223 PolarHBondContact O-N 2.79Å; A220-F224 HydrophobicContact CB-CE2 4.39Å; A220-F224 WeakPolarHBondContact O-CD2 3.39Å; A220-F224 PolarHBondContact O-N 3.01Å; A220-L260 HydrophobicContact CB-CD1 3.85Å; A220-L260 HydrophobicContact CB-CD2 4.22Å |
| 221 | C | 97.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -55.6 | -53.5 | 178.2 | -73.4 | 0 | 0 | 0 | 0 | 112 | W217 L218 C223 F224 I225 L270 | W217-C221 PolarHBondContact O-N 3.25Å; W217-C221 PolarHBondContact O-SG 2.93Å; L218-C221 PolarHBondContact O-N 2.88Å; C221-C223 VanDerWaalsContact C-N 3.28Å; C221-C223 PolarHBondContact O-N 3.34Å; C221-F224 PolarHBondContact O-N 3.48Å; C221-I225 WeakPolarHBondContact O-CB 3.37Å; C221-I225 WeakPolarHBondContact O-CD1 3.5Å; C221-I225 VanDerWaalsContact O-CG1 3.23Å; C221-I225 WeakPolarHBondContact O-CG1 3.5Å; C221-I225 PolarHBondContact O-N 2.74Å; C221-L270 HydrophobicContact CB-CD1 3.63Å |
| 222 | M | 96.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.9 | -37.3 | 180 | 66.8 | 170.2 | -65.2 | 0 | 0 | 112.4 | W165 L218 R219 A220 I225 R226 L270 M274 F301 W305 W306 I309 | W165-M222 HydrophobicContact CZ3-CE 3.97Å; L218-M222 PolarHBondContact O-N 3.12Å; R219-M222 HydrophobicContact CG-SD 4.49Å; R219-M222 WeakPolarHBondContact O-CG 3.48Å; A220-M222 PolarHBondContact O-N 2.91Å; M222-I225 PolarHBondContact O-N 3.46Å; M222-R226 VanDerWaalsContact O-CB 3.31Å; M222-R226 WeakPolarHBondContact O-CB 3.33Å; M222-R226 PolarHBondContact O-N 3.02Å; M222-L270 HydrophobicContact CB-CD2 4.26Å; M222-M274 HydrophobicContact CB-CG 4.18Å; M222-M274 HydrophobicContact CB-SD 4.31Å; M222-M274 HydrophobicContact CE-CE 3.68Å; M222-M274 HydrophobicContact CE-SD 3.57Å; M222-M274 VanDerWaalsContact CE-SD 3.57Å; M222-F301 HydrophobicContact CE-CE1 4.19Å; M222-F301 HydrophobicContact CE-CE2 4.39Å; M222-F301 HydrophobicContact CE-CZ 3.6Å; M222-F301 HydrophobicContact SD-CE1 4.31Å; M222-F301 HydrophobicContact SD-CZ 4.01Å; M222-W305 HydrophobicContact CE-CB 4Å; M222-W306 HydrophobicContact SD-CE3 3.62Å; M222-W306 HydrophobicContact SD-CZ3 3.7Å; M222-I309 HydrophobicContact CB-CD1 3.7Å; M222-I309 HydrophobicContact CE-CD1 3.31Å; M222-I309 HydrophobicContact CG-CD1 4.07Å; M222-I309 HydrophobicContact SD-CD1 3.36Å; M222-I309 WeakPolarHBondContact SD-CD1 3.46Å |
| 223 | C | 98.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -68.9 | -43.6 | -178.2 | -72.5 | 0 | 0 | 0 | 0 | 111.6 | W165 L168 R219 A220 C221 R226 T227 | W165-C223 WeakPolarHBondContact O-CB 3.42Å; L168-C223 VanDerWaalsContact CD2-SG 3.56Å; L168-C223 VanDerWaalsContact CG-SG 3.56Å; R219-C223 WeakPolarHBondContact O-CB 3.34Å; R219-C223 PolarHBondContact O-N 3.1Å; R219-C223 VanDerWaalsContact O-N 3.09Å; R219-C223 PolarHBondContact O-SG 3.5Å; A220-C223 PolarHBondContact O-N 2.79Å; C221-C223 VanDerWaalsContact C-N 3.28Å; C221-C223 PolarHBondContact O-N 3.34Å; C223-R226 PolarHBondContact O-N 2.8Å; C223-T227 WeakPolarHBondContact O-CB 3.44Å; C223-T227 PolarHBondContact O-N 3.45Å; C223-T227 PolarHBondContact O-OG1 2.86Å |
| 224 | F | 98.5 | Very high | 94.4 | Very high | 2 Ų | 2 | 27.8 Ų | 27.8 | 1% | 0.009 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -68.3 | -39.1 | 175.9 | -73.7 | -53.3 | 0 | 0 | 0 | 112.1 | F166 Q170 L173 A220 C221 T227 R228 T253 A256 L257 L260 | F166-F224 HydrophobicContact CD2-CD1 4.31Å; F166-F224 HydrophobicContact CD2-CE1 4.02Å; F166-F224 HydrophobicContact CE2-CE1 4.05Å; Q170-F224 HydrophobicContact CG-CE1 4.36Å; Q170-F224 HydrophobicContact CG-CZ 4.38Å; L173-F224 HydrophobicContact CB-CE2 4.43Å; L173-F224 HydrophobicContact CD2-CE2 4.48Å; L173-F224 HydrophobicContact CD2-CZ 4.43Å; A220-F224 HydrophobicContact CB-CE2 4.39Å; A220-F224 WeakPolarHBondContact O-CD2 3.39Å; A220-F224 PolarHBondContact O-N 3.01Å; C221-F224 PolarHBondContact O-N 3.48Å; F224-T227 PolarHBondContact O-N 2.92Å; F224-R228 WeakPolarHBondContact O-CB 3.17Å; F224-R228 PolarHBondContact O-N 3.04Å; F224-T253 HydrophobicContact CB-CG2 3.87Å; F224-T253 HydrophobicContact CD1-CG2 4.03Å; F224-T253 HydrophobicContact CG-CG2 4.37Å; F224-T253 WeakPolarHBondContact O-CG2 3.44Å; F224-A256 HydrophobicContact CD1-CB 4.23Å; F224-A256 HydrophobicContact CD2-CB 3.9Å; F224-A256 HydrophobicContact CE1-CB 3.99Å; F224-A256 HydrophobicContact CE2-CB 3.65Å; F224-A256 HydrophobicContact CG-CB 4.2Å; F224-A256 HydrophobicContact CZ-CB 3.69Å; F224-L257 HydrophobicContact CB-CD1 4.3Å; F224-L257 HydrophobicContact CB-CD2 3.76Å; F224-L257 HydrophobicContact CB-CG 3.84Å; F224-L260 HydrophobicContact CD2-CD1 3.73Å; F224-L260 HydrophobicContact CE2-CD1 4.04Å |
| 225 | I | 98.1 | Very high | 94 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.8 | -49.2 | 173 | -69.9 | 164.1 | 0 | 0 | 0 | 110.5 | C221 M222 T227 R228 L229 L257 L267 L270 M274 | C221-I225 WeakPolarHBondContact O-CB 3.37Å; C221-I225 WeakPolarHBondContact O-CD1 3.5Å; C221-I225 VanDerWaalsContact O-CG1 3.23Å; C221-I225 WeakPolarHBondContact O-CG1 3.5Å; C221-I225 PolarHBondContact O-N 2.74Å; M222-I225 PolarHBondContact O-N 3.46Å; I225-T227 PolarHBondContact O-N 2.85Å; I225-R228 WeakPolarHBondContact O-CB 3.42Å; I225-R228 PolarHBondContact O-N 2.73Å; I225-L229 HydrophobicContact CG2-CD1 3.98Å; I225-L229 HydrophobicContact CG2-CG 4.44Å; I225-L229 WeakPolarHBondContact O-CG 3.34Å; I225-L229 PolarHBondContact O-N 2.88Å; I225-L257 HydrophobicContact CG1-CD1 4.31Å; I225-L257 HydrophobicContact CG1-CD2 4.04Å; I225-L267 HydrophobicContact CD1-CD1 3.66Å; I225-L267 HydrophobicContact CG1-CD1 3.93Å; I225-L270 HydrophobicContact CD1-CB 3.46Å; I225-L270 VanDerWaalsContact CD1-CB 3.46Å; I225-L270 HydrophobicContact CD1-CD1 3.76Å; I225-L270 HydrophobicContact CD1-CG 4.28Å; I225-M274 HydrophobicContact CG2-CB 4.26Å |
| 226 | R | 97.6 | Very high | 93 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.8 | -42.9 | 178.5 | -175.2 | 55.2 | 168.9 | -150.6 | -3.2 | 112.5 | P159 W165 M222 C223 R228 L229 L230 M274 D277 L278 | P159-R226 PolarHBondContact O-NH2 3.48Å; W165-R226 HydrophobicContact CB-CG 4.41Å; W165-R226 HydrophobicContact CD2-CB 4.04Å; W165-R226 HydrophobicContact CD2-CG 3.45Å; W165-R226 VanDerWaalsContact CD2-CG 3.45Å; W165-R226 HydrophobicContact CE3-CB 4.11Å; W165-R226 HydrophobicContact CE3-CG 3.93Å; W165-R226 HydrophobicContact CG-CB 4.23Å; W165-R226 HydrophobicContact CG-CG 3.66Å; W165-R226 HydrophobicContact CH2-CG 4.46Å; W165-R226 HydrophobicContact CZ2-CG 4.05Å; W165-R226 HydrophobicContact CZ3-CG 4.4Å; M222-R226 VanDerWaalsContact O-CB 3.31Å; M222-R226 WeakPolarHBondContact O-CB 3.33Å; M222-R226 PolarHBondContact O-N 3.02Å; C223-R226 PolarHBondContact O-N 2.8Å; R226-R228 VanDerWaalsContact C-N 3.34Å; R226-R228 PolarHBondContact O-N 3.07Å; R226-L229 PolarHBondContact O-N 3.01Å; R226-L230 HydrophobicContact CG-CD1 4.04Å; R226-L230 WeakPolarHBondContact O-CB 3.33Å; R226-L230 WeakPolarHBondContact O-CG 3.28Å; R226-L230 PolarHBondContact O-N 3.43Å; R226-M274 HydrophobicContact CB-CB 4.33Å; R226-M274 HydrophobicContact CB-CE 3.48Å; R226-M274 VanDerWaalsContact CB-CE 3.48Å; R226-M274 HydrophobicContact CB-CG 4.46Å; R226-M274 WeakPolarHBondContact CD-O 3.43Å; R226-M274 HydrophobicContact CG-CE 3.53Å; R226-M274 PolarHBondContact NH1-O 3.02Å; R226-D277 IonicContact CZ-OD1 3.78Å; R226-D277 IonicContact CZ-OD2 2.79Å; R226-D277 IonicContact NH1-OD1 3.09Å; R226-D277 PolarHBondContact NH1-OD1 3.15Å; R226-D277 VanDerWaalsContact NH2-CG 3.29Å; R226-D277 IonicContact NH2-OD1 2.76Å; R226-D277 PolarHBondContact NH2-OD1 3.23Å; R226-D277 IonicContact NH2-OD2 3.86Å; R226-D277 PolarHBondContact NH2-OD2 2.99Å; R226-L278 VanDerWaalsContact NH1-CD2 3.32Å; R226-L278 VanDerWaalsContact NH1-CG 3.26Å |
| 227 | T | 98.1 | Very high | 92 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -56 | -49.4 | 173.8 | -59.1 | 0 | 0 | 0 | 0 | 111 | W165 F166 C223 F224 I225 L230 L231 T249 | W165-T227 WeakPolarHBondContact CB-OG1 3.28Å; F166-T227 WeakPolarHBondContact CA-OG1 3.41Å; F166-T227 HydrophobicContact CB-CG2 3.75Å; F166-T227 HydrophobicContact CD2-CG2 4Å; F166-T227 HydrophobicContact CG-CG2 4.28Å; F166-T227 PolarHBondContact N-OG1 3.46Å; C223-T227 WeakPolarHBondContact O-CB 3.44Å; C223-T227 PolarHBondContact O-N 3.45Å; C223-T227 PolarHBondContact O-OG1 2.86Å; F224-T227 PolarHBondContact O-N 2.92Å; I225-T227 PolarHBondContact O-N 2.85Å; T227-L230 PolarHBondContact O-N 3.15Å; T227-L231 HydrophobicContact CG2-CD1 3.87Å; T227-L231 HydrophobicContact CG2-CG 4.39Å; T227-L231 WeakPolarHBondContact O-CB 3.28Å; T227-L231 WeakPolarHBondContact O-CG 3.46Å; T227-L231 PolarHBondContact O-N 3.43Å; T227-T249 HydrophobicContact CG2-CG2 4.5Å |
| 228 | R | 97.2 | Very high | 90.8 | Very high | 31 Ų | 31 | 36.7 Ų | 36.7 | 12% | 0.117 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.7 | -47.3 | 179.1 | 176.8 | 177 | 68.1 | 172.1 | 4 | 112.1 | F224 I225 R226 R232 L250 T253 E254 | F224-R228 WeakPolarHBondContact O-CB 3.17Å; F224-R228 PolarHBondContact O-N 3.04Å; I225-R228 WeakPolarHBondContact O-CB 3.42Å; I225-R228 PolarHBondContact O-N 2.73Å; R226-R228 VanDerWaalsContact C-N 3.34Å; R226-R228 PolarHBondContact O-N 3.07Å; R228-R232 WeakPolarHBondContact O-CB 3.3Å; R228-R232 VanDerWaalsContact O-CG 3.25Å; R228-R232 WeakPolarHBondContact O-CG 3.49Å; R228-R232 PolarHBondContact O-N 3.39Å; R228-L250 HydrophobicContact CB-CD2 4.39Å; R228-L250 HydrophobicContact CG-CD2 4.14Å; R228-T253 HydrophobicContact CB-CG2 3.97Å; R228-E254 WeakPolarHBondContact CD-OE1 3.47Å; R228-E254 IonicContact NH1-OE1 3.95Å; R228-E254 IonicContact NH1-OE2 3.33Å; R228-E254 PolarHBondContact NH1-OE2 2.86Å; R228-E254 VanDerWaalsContact NH1-OE2 3.09Å |
| 229 | L | 95.8 | Very high | 89.8 | Confident | 31 Ų | 31 | 39.6 Ų | 39.6 | 16% | 0.162 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.5 | -50.3 | 179.5 | -68.7 | 170.8 | 0 | 0 | 0 | 111.2 | I225 R226 R232 I233 T271 M274 L278 | I225-L229 HydrophobicContact CG2-CD1 3.98Å; I225-L229 HydrophobicContact CG2-CG 4.44Å; I225-L229 WeakPolarHBondContact O-CG 3.34Å; I225-L229 PolarHBondContact O-N 2.88Å; R226-L229 PolarHBondContact O-N 3.01Å; L229-R232 PolarHBondContact O-N 3.09Å; L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 2.86Å; L229-T271 HydrophobicContact CD1-CG2 4.43Å; L229-T271 HydrophobicContact CD2-CG2 4.35Å; L229-M274 HydrophobicContact CD1-CB 4.2Å; L229-M274 WeakPolarHBondContact CD1-O 3.47Å; L229-L278 HydrophobicContact CB-CD1 3.58Å; L229-L278 HydrophobicContact CD1-CD1 4.07Å; L229-L278 HydrophobicContact CG-CD1 4.41Å |
| 230 | L | 93.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61 | -48.2 | 179.8 | -73.4 | 170.9 | 0 | 0 | 0 | 112.4 | F160 P162 W165 R226 T227 R232 I233 L234 L278 M283 | F160-L230 HydrophobicContact CB-CD2 4.36Å; F160-L230 HydrophobicContact CD1-CD2 4.34Å; P162-L230 HydrophobicContact CB-CB 3.88Å; P162-L230 HydrophobicContact CB-CD1 4.3Å; W165-L230 HydrophobicContact CG-CD1 4.46Å; R226-L230 HydrophobicContact CG-CD1 4.04Å; R226-L230 WeakPolarHBondContact O-CB 3.33Å; R226-L230 WeakPolarHBondContact O-CG 3.28Å; R226-L230 PolarHBondContact O-N 3.43Å; T227-L230 PolarHBondContact O-N 3.15Å; L230-R232 VanDerWaalsContact C-N 3.28Å; L230-R232 PolarHBondContact O-N 3.42Å; L230-I233 PolarHBondContact O-N 3.43Å; L230-L234 WeakPolarHBondContact O-CB 3.27Å; L230-L234 VanDerWaalsContact O-CG 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.34Å; L230-L234 PolarHBondContact O-N 3.31Å; L230-L278 HydrophobicContact CD2-CD2 3.51Å; L230-L278 HydrophobicContact CG-CD2 4.34Å; L230-M283 HydrophobicContact CD2-CE 3.82Å |
| 231 | L | 92.8 | Very high | 87.2 | Confident | 1 Ų | 1 | 51.8 Ų | 51.8 | 1% | 0.005 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -63.7 | -33.8 | 179.3 | -71.2 | 177.9 | 0 | 0 | 0 | 112.4 | P162 W163 T227 R235 T249 L250 | P162-L231 HydrophobicContact CB-CD2 3.73Å; P162-L231 HydrophobicContact CB-CG 3.82Å; P162-L231 HydrophobicContact CG-CD2 3.62Å; P162-L231 HydrophobicContact CG-CG 4.28Å; W163-L231 HydrophobicContact CH2-CD2 4.38Å; W163-L231 HydrophobicContact CZ2-CD2 4.32Å; T227-L231 HydrophobicContact CG2-CD1 3.87Å; T227-L231 HydrophobicContact CG2-CG 4.39Å; T227-L231 WeakPolarHBondContact O-CB 3.28Å; T227-L231 WeakPolarHBondContact O-CG 3.46Å; T227-L231 PolarHBondContact O-N 3.43Å; L231-R235 PolarHBondContact O-N 3.36Å; L231-T249 HydrophobicContact CD1-CG2 3.85Å; L231-L250 HydrophobicContact CB-CD1 4.21Å; L231-L250 HydrophobicContact CB-CD2 3.81Å; L231-L250 HydrophobicContact CB-CG 3.89Å; L231-L250 HydrophobicContact CD1-CD2 4.18Å; L231-L250 HydrophobicContact CD1-CG 3.94Å |
| 232 | R | 91.6 | Very high | 86.1 | Confident | 132 Ų | 132 | 54.5 Ų | 54.5 | 50% | 0.498 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -68.9 | -43 | 175.3 | -75.2 | 177.8 | -178.1 | -169.4 | 2.5 | 112 | R228 L229 L230 R235 L250 E254 | R228-R232 WeakPolarHBondContact O-CB 3.3Å; R228-R232 VanDerWaalsContact O-CG 3.25Å; R228-R232 WeakPolarHBondContact O-CG 3.49Å; R228-R232 PolarHBondContact O-N 3.39Å; L229-R232 PolarHBondContact O-N 3.09Å; L230-R232 VanDerWaalsContact C-N 3.28Å; L230-R232 PolarHBondContact O-N 3.42Å; R232-R235 VanDerWaalsContact O-CB 3.29Å; R232-R235 WeakPolarHBondContact O-CB 3.32Å; R232-R235 PolarHBondContact O-N 2.82Å; R232-L250 HydrophobicContact CG-CD2 4.28Å; R232-E254 IonicContact CZ-OE1 2.75Å; R232-E254 IonicContact NH2-OE1 3.43Å; R232-E254 PolarHBondContact NH2-OE1 2.94Å |
| 233 | I | 88.3 | Confident | 85.4 | Confident | 53 Ų | 53 | 56.8 Ų | 56.8 | 27% | 0.272 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.9 | -46.7 | 176.9 | -69.4 | 167.9 | 0 | 0 | 0 | 110.6 | L229 L230 R235 L278 M283 | L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 2.86Å; L230-I233 PolarHBondContact O-N 3.43Å; I233-R235 PolarHBondContact O-N 2.96Å; I233-L278 HydrophobicContact CD1-CB 3.76Å; I233-L278 HydrophobicContact CD1-CD1 3.85Å; I233-L278 HydrophobicContact CD1-CG 4.28Å; I233-M283 HydrophobicContact CD1-SD 4.5Å; I233-M283 HydrophobicContact CG2-CE 4.32Å; I233-M283 HydrophobicContact CG2-SD 4.3Å |
| 234 | L | 82.7 | Confident | 84.9 | Confident | 39 Ų | 39 | 63.4 Ų | 63.4 | 20% | 0.204 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -72.1 | -14.9 | -177.3 | -64.9 | 173.3 | 0 | 0 | 0 | 113.2 | P162 L230 Q236 Q237 Q238 | P162-L234 HydrophobicContact CG-CD1 4.19Å; L230-L234 WeakPolarHBondContact O-CB 3.27Å; L230-L234 VanDerWaalsContact O-CG 3.28Å; L230-L234 WeakPolarHBondContact O-CG 3.34Å; L230-L234 PolarHBondContact O-N 3.31Å; L234-Q236 VanDerWaalsContact C-N 3.25Å; L234-Q236 PolarHBondContact O-N 2.87Å; L234-Q236 VanDerWaalsContact O-N 3.13Å; L234-Q237 PolarHBondContact O-N 3.46Å; L234-Q238 WeakPolarHBondContact O-CG 3.2Å |
| 235 | R | 81.4 | Confident | 84.5 | Confident | 133 Ų | 133 | 70.2 Ų | 70.2 | 50% | 0.502 | 34% | 0.335 | S | S | . | . | G | 310 helix | trans | -52.9 | -40 | -173.8 | -166.8 | -179.4 | -170.9 | -175.6 | 3.8 | 113.5 | L231 R232 I233 Q237 L243 E247 | L231-R235 PolarHBondContact O-N 3.36Å; R232-R235 VanDerWaalsContact O-CB 3.29Å; R232-R235 WeakPolarHBondContact O-CB 3.32Å; R232-R235 PolarHBondContact O-N 2.82Å; I233-R235 PolarHBondContact O-N 2.96Å; R235-Q237 PolarHBondContact O-N 2.84Å; R235-L243 HydrophobicContact CG-CD1 3.68Å; R235-E247 IonicContact CZ-OE1 3.21Å; R235-E247 IonicContact NE-OE1 2.8Å; R235-E247 IonicContact NH2-OE1 2.97Å; R235-E247 PolarHBondContact NH2-OE1 3.44Å |
| 236 | Q | 71.7 | Confident | 84.1 | Confident | 188 Ų | 188 | 70.3 Ų | 70.3 | 88% | 0.879 | 34% | 0.336 | S | S | * | . | G | 310 helix | trans | -71.4 | -16.8 | -177.1 | -64.5 | -177.8 | 1.2 | 0 | 0 | 113.5 | L234 | L234-Q236 VanDerWaalsContact C-N 3.25Å; L234-Q236 PolarHBondContact O-N 2.87Å; L234-Q236 VanDerWaalsContact O-N 3.13Å |
| 237 | Q | 70.5 | Confident | 83.9 | Confident | 101 Ų | 101 | 73.1 Ų | 73.1 | 47% | 0.472 | 35% | 0.349 | S | S | . | . | G | 310 helix | trans | -103.3 | -0.8 | -174.1 | -60.7 | 179.1 | 3.4 | 0 | 0 | 113.1 | L234 R235 | L234-Q237 PolarHBondContact O-N 3.46Å; R235-Q237 PolarHBondContact O-N 2.84Å |
| 238 | Q | 69.9 | Low | 83.7 | Confident | 44 Ų | 44 | 79.9 Ų | 79.9 | 21% | 0.206 | 38% | 0.378 | C | S | . | . | trans | -94.6 | 141.7 | -170.1 | -73 | 178.8 | 0.9 | 0 | 0 | 113.5 | L234 V242 S246 | L234-Q238 WeakPolarHBondContact O-CG 3.2Å; Q238-V242 HydrophobicContact CB-CB 4.2Å; Q238-V242 HydrophobicContact CB-CG1 4.09Å; Q238-V242 HydrophobicContact CG-CB 4.36Å; Q238-V242 HydrophobicContact CG-CG1 3.71Å; Q238-S246 VanDerWaalsContact CD-OG 3.3Å; Q238-S246 PolarHBondContact NE2-OG 2.96Å; Q238-S246 VanDerWaalsContact NE2-OG 3.16Å; Q238-S246 VanDerWaalsContact OE1-CB 3.24Å; Q238-S246 PolarHBondContact OE1-OG 3.44Å | ||
| 239 | S | 73.3 | Confident | 83.6 | Confident | 74 Ų | 74 | 78.9 Ų | 78.9 | 52% | 0.517 | 38% | 0.376 | S | S | . | . | trans | -69.9 | 161.7 | 167 | 67.7 | 0 | 0 | 0 | 0 | 111.4 | F241 V242 L243 | S239-F241 VanDerWaalsContact C-N 3.33Å; S239-F241 PolarHBondContact O-N 3.42Å; S239-V242 PolarHBondContact O-N 3.05Å; S239-V242 VanDerWaalsContact O-N 3.12Å; S239-V242 WeakPolarHBondContact OG-CG2 3.32Å; S239-L243 WeakPolarHBondContact O-CB 3.24Å; S239-L243 PolarHBondContact O-N 3.24Å | ||
| 240 | S | 72 | Confident | 83.6 | Confident | 106 Ų | 106 | 78.5 Ų | 78.5 | 74% | 0.741 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -56.5 | -38.4 | -171.8 | 56 | 0 | 0 | 0 | 0 | 114.8 | Q244 | S240-Q244 PolarHBondContact O-N 2.87Å |
| 241 | F | 64.9 | Low | 83.7 | Confident | 153 Ų | 153 | 86.5 Ų | 86.5 | 67% | 0.671 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -70.6 | -43.1 | 177.4 | 177.4 | -99.1 | 0 | 0 | 0 | 112.3 | S239 L243 Q244 R245 | S239-F241 VanDerWaalsContact C-N 3.33Å; S239-F241 PolarHBondContact O-N 3.42Å; F241-L243 PolarHBondContact O-N 3.34Å; F241-Q244 PolarHBondContact O-N 2.72Å; F241-R245 PolarHBondContact O-N 3.36Å |
| 242 | V | 75.8 | Confident | 84 | Confident | 57 Ų | 57 | 89.2 Ų | 89.2 | 35% | 0.345 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63.8 | -38 | 177.1 | -178.3 | 0 | 0 | 0 | 0 | 109.8 | Q238 S239 Q244 R245 S246 | Q238-V242 HydrophobicContact CB-CB 4.2Å; Q238-V242 HydrophobicContact CB-CG1 4.09Å; Q238-V242 HydrophobicContact CG-CB 4.36Å; Q238-V242 HydrophobicContact CG-CG1 3.71Å; S239-V242 PolarHBondContact O-N 3.05Å; S239-V242 VanDerWaalsContact O-N 3.12Å; S239-V242 WeakPolarHBondContact OG-CG2 3.32Å; V242-Q244 PolarHBondContact O-N 2.96Å; V242-R245 PolarHBondContact O-N 3.45Å; V242-S246 PolarHBondContact O-N 3.43Å; V242-S246 PolarHBondContact O-OG 3.13Å; V242-S246 VanDerWaalsContact O-OG 3.07Å |
| 243 | L | 81.8 | Confident | 84.3 | Confident | 48 Ų | 48 | 83 Ų | 83 | 25% | 0.251 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60 | -44.9 | 176.7 | -176.2 | 64.7 | 0 | 0 | 0 | 112.3 | R235 S239 F241 R245 S246 E247 | R235-L243 HydrophobicContact CG-CD1 3.68Å; S239-L243 WeakPolarHBondContact O-CB 3.24Å; S239-L243 PolarHBondContact O-N 3.24Å; F241-L243 PolarHBondContact O-N 3.34Å; L243-R245 VanDerWaalsContact C-N 3.34Å; L243-R245 PolarHBondContact O-N 3.19Å; L243-S246 PolarHBondContact O-N 3.44Å; L243-E247 HydrophobicContact CD1-CG 4.22Å; L243-E247 HydrophobicContact CG-CG 4.36Å; L243-E247 WeakPolarHBondContact O-CB 3.07Å; L243-E247 WeakPolarHBondContact O-CG 3.32Å; L243-E247 PolarHBondContact O-N 2.93Å |
| 244 | Q | 86.3 | Confident | 84.7 | Confident | 138 Ų | 138 | 82.8 Ų | 82.8 | 65% | 0.645 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -60.2 | -43.1 | 179 | -172.8 | -176 | 5 | 0 | 0 | 112.1 | S240 F241 V242 E247 K248 | S240-Q244 PolarHBondContact O-N 2.87Å; F241-Q244 PolarHBondContact O-N 2.72Å; V242-Q244 PolarHBondContact O-N 2.96Å; Q244-E247 PolarHBondContact O-N 3.48Å; Q244-K248 PolarHBondContact O-N 2.92Å |
| 245 | R | 90.3 | Very high | 85.4 | Confident | 146 Ų | 146 | 86.7 Ų | 86.7 | 55% | 0.551 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -64.7 | -43.3 | 176.9 | -173.9 | -174.2 | 167.9 | 164.8 | -2.2 | 111.2 | W163 F241 V242 L243 K248 T249 | W163-R245 HydrophobicContact CH2-CG 3.7Å; W163-R245 HydrophobicContact CZ2-CG 4.38Å; W163-R245 HydrophobicContact CZ3-CG 4.28Å; F241-R245 PolarHBondContact O-N 3.36Å; V242-R245 PolarHBondContact O-N 3.45Å; L243-R245 VanDerWaalsContact C-N 3.34Å; L243-R245 PolarHBondContact O-N 3.19Å; R245-K248 PolarHBondContact O-N 3.42Å; R245-T249 WeakPolarHBondContact O-CB 3.4Å; R245-T249 PolarHBondContact O-N 2.9Å; R245-T249 PolarHBondContact O-OG1 3.21Å |
| 246 | S | 91.4 | Very high | 86.2 | Confident | 2 Ų | 2 | 80.7 Ų | 80.7 | 1% | 0.014 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.9 | -44.6 | 176.7 | -63.3 | 0 | 0 | 0 | 0 | 112 | Q238 V242 L243 T249 L250 | Q238-S246 VanDerWaalsContact CD-OG 3.3Å; Q238-S246 PolarHBondContact NE2-OG 2.96Å; Q238-S246 VanDerWaalsContact NE2-OG 3.16Å; Q238-S246 VanDerWaalsContact OE1-CB 3.24Å; Q238-S246 PolarHBondContact OE1-OG 3.44Å; V242-S246 PolarHBondContact O-N 3.43Å; V242-S246 PolarHBondContact O-OG 3.13Å; V242-S246 VanDerWaalsContact O-OG 3.07Å; L243-S246 PolarHBondContact O-N 3.44Å; S246-T249 PolarHBondContact O-N 3.36Å; S246-L250 WeakPolarHBondContact O-CB 3.26Å; S246-L250 WeakPolarHBondContact O-CG 3.32Å; S246-L250 PolarHBondContact O-N 3.3Å |
| 247 | E | 91.8 | Very high | 87.5 | Confident | 58 Ų | 58 | 72.3 Ų | 72.3 | 27% | 0.271 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.7 | -41.6 | 178.5 | -73.7 | -176.5 | 163.4 | 0 | 0 | 112.4 | R235 L243 Q244 T249 L250 R251 | R235-E247 IonicContact CZ-OE1 3.21Å; R235-E247 IonicContact NE-OE1 2.8Å; R235-E247 IonicContact NH2-OE1 2.97Å; R235-E247 PolarHBondContact NH2-OE1 3.44Å; L243-E247 HydrophobicContact CD1-CG 4.22Å; L243-E247 HydrophobicContact CG-CG 4.36Å; L243-E247 WeakPolarHBondContact O-CB 3.07Å; L243-E247 WeakPolarHBondContact O-CG 3.32Å; L243-E247 PolarHBondContact O-N 2.93Å; Q244-E247 PolarHBondContact O-N 3.48Å; E247-T249 VanDerWaalsContact C-N 3.3Å; E247-T249 PolarHBondContact O-N 2.94Å; E247-L250 PolarHBondContact O-N 3.3Å; E247-R251 WeakPolarHBondContact O-CG 3.49Å; E247-R251 PolarHBondContact O-N 3.06Å; E247-R251 VanDerWaalsContact O-N 3.08Å |
| 248 | K | 93.8 | Very high | 88.7 | Confident | 143 Ų | 143 | 74.5 Ų | 74.5 | 62% | 0.622 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -59 | -45.2 | 172.8 | -178.8 | 179.4 | 177.6 | -179.2 | 0 | 111.1 | Q244 R245 R251 I252 | Q244-K248 PolarHBondContact O-N 2.92Å; R245-K248 PolarHBondContact O-N 3.42Å; K248-R251 PolarHBondContact O-N 3.43Å; K248-I252 HydrophobicContact CG-CD1 4.18Å; K248-I252 WeakPolarHBondContact O-CG1 3.33Å; K248-I252 PolarHBondContact O-N 3.23Å; K248-I252 VanDerWaalsContact O-N 3.15Å |
| 249 | T | 95.6 | Very high | 90 | Very high | 10 Ų | 10 | 79.4 Ų | 79.4 | 6% | 0.061 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -68.4 | -38 | -177.8 | -52.4 | 0 | 0 | 0 | 0 | 111.3 | W163 F166 T227 L231 R245 S246 E247 R251 I252 T253 | W163-T249 HydrophobicContact CE3-CG2 4.45Å; W163-T249 HydrophobicContact CZ3-CG2 3.77Å; W163-T249 VanDerWaalsContact CZ3-OG1 3.27Å; W163-T249 WeakPolarHBondContact CZ3-OG1 3.27Å; F166-T249 HydrophobicContact CD1-CG2 4.09Å; F166-T249 HydrophobicContact CD2-CG2 3.66Å; F166-T249 HydrophobicContact CE1-CG2 4.11Å; F166-T249 HydrophobicContact CE2-CG2 3.7Å; F166-T249 HydrophobicContact CG-CG2 3.86Å; F166-T249 HydrophobicContact CZ-CG2 3.92Å; T227-T249 HydrophobicContact CG2-CG2 4.5Å; L231-T249 HydrophobicContact CD1-CG2 3.85Å; R245-T249 WeakPolarHBondContact O-CB 3.4Å; R245-T249 PolarHBondContact O-N 2.9Å; R245-T249 PolarHBondContact O-OG1 3.21Å; S246-T249 PolarHBondContact O-N 3.36Å; E247-T249 VanDerWaalsContact C-N 3.3Å; E247-T249 PolarHBondContact O-N 2.94Å; T249-R251 PolarHBondContact O-N 3.5Å; T249-I252 PolarHBondContact O-N 3.4Å; T249-T253 WeakPolarHBondContact O-CB 3.34Å; T249-T253 PolarHBondContact O-N 3.23Å; T249-T253 PolarHBondContact O-OG1 3.46Å |
| 250 | L | 95.9 | Very high | 91 | Very high | 23 Ų | 23 | 76.6 Ų | 76.6 | 12% | 0.12 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -58.4 | -45.3 | 172.1 | -81.6 | 170.3 | 0 | 0 | 0 | 111.6 | R228 L231 R232 S246 E247 T253 E254 | R228-L250 HydrophobicContact CB-CD2 4.39Å; R228-L250 HydrophobicContact CG-CD2 4.14Å; L231-L250 HydrophobicContact CB-CD1 4.21Å; L231-L250 HydrophobicContact CB-CD2 3.81Å; L231-L250 HydrophobicContact CB-CG 3.89Å; L231-L250 HydrophobicContact CD1-CD2 4.18Å; L231-L250 HydrophobicContact CD1-CG 3.94Å; R232-L250 HydrophobicContact CG-CD2 4.28Å; S246-L250 WeakPolarHBondContact O-CB 3.26Å; S246-L250 WeakPolarHBondContact O-CG 3.32Å; S246-L250 PolarHBondContact O-N 3.3Å; E247-L250 PolarHBondContact O-N 3.3Å; L250-T253 WeakPolarHBondContact O-CB 3.4Å; L250-T253 PolarHBondContact O-N 2.95Å; L250-T253 VanDerWaalsContact O-N 3.17Å; L250-E254 WeakPolarHBondContact O-CG 3.31Å; L250-E254 PolarHBondContact O-N 3.33Å |
| 251 | R | 96.9 | Very high | 92.2 | Very high | 167 Ų | 167 | 77.9 Ų | 77.9 | 63% | 0.63 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -59 | -49.6 | 176.1 | -67.8 | 175.6 | -169.8 | -179.3 | 3.4 | 112 | E247 K248 T249 T253 E254 E255 | E247-R251 WeakPolarHBondContact O-CG 3.49Å; E247-R251 PolarHBondContact O-N 3.06Å; E247-R251 VanDerWaalsContact O-N 3.08Å; K248-R251 PolarHBondContact O-N 3.43Å; T249-R251 PolarHBondContact O-N 3.5Å; R251-T253 PolarHBondContact O-N 3.29Å; R251-E254 PolarHBondContact O-N 3.15Å; R251-E255 WeakPolarHBondContact O-CG 3.36Å; R251-E255 PolarHBondContact O-N 3.06Å |
| 252 | I | 97.8 | Very high | 93.6 | Very high | 59 Ų | 59 | 71.4 Ų | 71.4 | 30% | 0.303 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.6 | -37.7 | 176.9 | -63.1 | 165.9 | 0 | 0 | 0 | 110.9 | F166 K248 T249 A256 | F166-I252 HydrophobicContact CE2-CB 4.39Å; F166-I252 HydrophobicContact CE2-CG2 3.95Å; F166-I252 HydrophobicContact CZ-CB 4.38Å; F166-I252 HydrophobicContact CZ-CG2 3.84Å; K248-I252 HydrophobicContact CG-CD1 4.18Å; K248-I252 WeakPolarHBondContact O-CG1 3.33Å; K248-I252 PolarHBondContact O-N 3.23Å; K248-I252 VanDerWaalsContact O-N 3.15Å; T249-I252 PolarHBondContact O-N 3.4Å; I252-A256 WeakPolarHBondContact O-CB 3.22Å; I252-A256 PolarHBondContact O-N 3.45Å |
| 253 | T | 97.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 75.8 Ų | 75.8 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -67.2 | -43.4 | 179.1 | -60.5 | 0 | 0 | 0 | 0 | 111.5 | F224 R228 T249 L250 R251 A256 L257 | F224-T253 HydrophobicContact CB-CG2 3.87Å; F224-T253 HydrophobicContact CD1-CG2 4.03Å; F224-T253 HydrophobicContact CG-CG2 4.37Å; F224-T253 WeakPolarHBondContact O-CG2 3.44Å; R228-T253 HydrophobicContact CB-CG2 3.97Å; T249-T253 WeakPolarHBondContact O-CB 3.34Å; T249-T253 PolarHBondContact O-N 3.23Å; T249-T253 PolarHBondContact O-OG1 3.46Å; L250-T253 WeakPolarHBondContact O-CB 3.4Å; L250-T253 PolarHBondContact O-N 2.95Å; L250-T253 VanDerWaalsContact O-N 3.17Å; R251-T253 PolarHBondContact O-N 3.29Å; T253-A256 PolarHBondContact O-N 2.85Å; T253-L257 HydrophobicContact CG2-CD1 4.4Å; T253-L257 WeakPolarHBondContact O-CG 3.39Å; T253-L257 PolarHBondContact O-N 2.84Å |
| 254 | E | 97.4 | Very high | 95 | Very high | 50 Ų | 50 | 80.1 Ų | 80.1 | 23% | 0.234 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -68.2 | -39.9 | 176.7 | -59.1 | -68.3 | -178.5 | 0 | 0 | 111.2 | R228 R232 L250 R251 A256 L257 Q258 | R228-E254 WeakPolarHBondContact CD-OE1 3.47Å; R228-E254 IonicContact NH1-OE1 3.95Å; R228-E254 IonicContact NH1-OE2 3.33Å; R228-E254 PolarHBondContact NH1-OE2 2.86Å; R228-E254 VanDerWaalsContact NH1-OE2 3.09Å; R232-E254 IonicContact CZ-OE1 2.75Å; R232-E254 IonicContact NH2-OE1 3.43Å; R232-E254 PolarHBondContact NH2-OE1 2.94Å; L250-E254 WeakPolarHBondContact O-CG 3.31Å; L250-E254 PolarHBondContact O-N 3.33Å; R251-E254 PolarHBondContact O-N 3.15Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.47Å; E254-L257 PolarHBondContact O-N 3.2Å; E254-Q258 WeakPolarHBondContact O-CB 3.47Å; E254-Q258 VanDerWaalsContact O-CG 3.29Å; E254-Q258 WeakPolarHBondContact O-CG 3.28Å; E254-Q258 PolarHBondContact O-N 3.1Å |
| 255 | E | 97.8 | Very high | 95.3 | Very high | 120 Ų | 120 | 76 Ų | 76 | 56% | 0.561 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -59.7 | -43 | 173.6 | -72.3 | 167.6 | -167.6 | 0 | 0 | 111.4 | R251 Q258 R259 | R251-E255 WeakPolarHBondContact O-CG 3.36Å; R251-E255 PolarHBondContact O-N 3.06Å; E255-Q258 PolarHBondContact O-N 2.83Å; E255-R259 WeakPolarHBondContact O-CB 3.47Å; E255-R259 PolarHBondContact O-N 3.32Å |
| 256 | A | 97.8 | Very high | 95.3 | Very high | 8 Ų | 8 | 70.1 Ų | 70.1 | 7% | 0.066 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -64.5 | -42 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L173 F224 I252 T253 E254 R259 L260 | L173-A256 HydrophobicContact CD2-CB 4.32Å; F224-A256 HydrophobicContact CD1-CB 4.23Å; F224-A256 HydrophobicContact CD2-CB 3.9Å; F224-A256 HydrophobicContact CE1-CB 3.99Å; F224-A256 HydrophobicContact CE2-CB 3.65Å; F224-A256 HydrophobicContact CG-CB 4.2Å; F224-A256 HydrophobicContact CZ-CB 3.69Å; I252-A256 WeakPolarHBondContact O-CB 3.22Å; I252-A256 PolarHBondContact O-N 3.45Å; T253-A256 PolarHBondContact O-N 2.85Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.47Å; A256-R259 PolarHBondContact O-N 3.46Å; A256-L260 WeakPolarHBondContact O-CB 3.41Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 2.83Å; A256-L260 PolarHBondContact O-N 3.16Å |
| 257 | L | 97.7 | Very high | 95.5 | Very high | 11 Ų | 11 | 71.5 Ų | 71.5 | 6% | 0.058 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -66.5 | -37.9 | 176.3 | -73.2 | 171.5 | 0 | 0 | 0 | 112.3 | F224 I225 T253 E254 R259 L260 N261 P262 | F224-L257 HydrophobicContact CB-CD1 4.3Å; F224-L257 HydrophobicContact CB-CD2 3.76Å; F224-L257 HydrophobicContact CB-CG 3.84Å; I225-L257 HydrophobicContact CG1-CD1 4.31Å; I225-L257 HydrophobicContact CG1-CD2 4.04Å; T253-L257 HydrophobicContact CG2-CD1 4.4Å; T253-L257 WeakPolarHBondContact O-CG 3.39Å; T253-L257 PolarHBondContact O-N 2.84Å; E254-L257 PolarHBondContact O-N 3.2Å; L257-R259 VanDerWaalsContact C-N 3.33Å; L257-L260 PolarHBondContact O-N 3.07Å; L257-N261 PolarHBondContact O-N 3.31Å; L257-P262 VanDerWaalsContact O-CD 3.28Å; L257-P262 WeakPolarHBondContact O-CD 3.37Å |
| 258 | Q | 96.9 | Very high | 95.6 | Very high | 147 Ų | 147 | 74.9 Ų | 74.9 | 69% | 0.687 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -62.1 | -42.4 | 172.7 | -74.1 | 173.6 | -0 | 0 | 0 | 111.4 | E254 E255 N261 | E254-Q258 WeakPolarHBondContact O-CB 3.47Å; E254-Q258 VanDerWaalsContact O-CG 3.29Å; E254-Q258 WeakPolarHBondContact O-CG 3.28Å; E254-Q258 PolarHBondContact O-N 3.1Å; E255-Q258 PolarHBondContact O-N 2.83Å; Q258-N261 PolarHBondContact O-N 2.93Å |
| 259 | R | 95.9 | Very high | 95.6 | Very high | 147 Ų | 147 | 68.7 Ų | 68.7 | 56% | 0.555 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -64.7 | -42.9 | 176.6 | -176.6 | -178.6 | 178.2 | -158.4 | -4.3 | 112.5 | D177 E255 A256 L257 N261 | D177-R259 VanDerWaalsContact CG-NH2 3.29Å; D177-R259 IonicContact OD1-CZ 2.72Å; D177-R259 IonicContact OD1-NH1 3.26Å; D177-R259 PolarHBondContact OD1-NH1 2.96Å; D177-R259 VanDerWaalsContact OD1-NH1 3.08Å; D177-R259 IonicContact OD1-NH2 3.35Å; D177-R259 PolarHBondContact OD1-NH2 2.89Å; D177-R259 IonicContact OD2-CZ 3.59Å; D177-R259 IonicContact OD2-NH1 2.81Å; D177-R259 PolarHBondContact OD2-NH1 3.24Å; D177-R259 IonicContact OD2-NH2 3.46Å; D177-R259 PolarHBondContact OD2-NH2 3.24Å; E255-R259 WeakPolarHBondContact O-CB 3.47Å; E255-R259 PolarHBondContact O-N 3.32Å; A256-R259 PolarHBondContact O-N 3.46Å; L257-R259 VanDerWaalsContact C-N 3.33Å; R259-N261 PolarHBondContact O-N 3.39Å |
| 260 | L | 95.7 | Very high | 95.6 | Very high | 16 Ų | 16 | 68.5 Ų | 68.5 | 8% | 0.084 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -69.6 | -23.4 | 178.1 | -71.4 | 165.1 | 0 | 0 | 0 | 112.5 | L173 L176 W217 A220 F224 A256 L257 | L173-L260 HydrophobicContact CD1-CD2 4Å; L173-L260 HydrophobicContact CD1-CG 4.34Å; L176-L260 HydrophobicContact CD1-CD2 3.87Å; W217-L260 HydrophobicContact CG-CD2 4.42Å; W217-L260 PolarHBondContact NE1-O 2.69Å; A220-L260 HydrophobicContact CB-CD1 3.85Å; A220-L260 HydrophobicContact CB-CD2 4.22Å; F224-L260 HydrophobicContact CD2-CD1 3.73Å; F224-L260 HydrophobicContact CE2-CD1 4.04Å; A256-L260 WeakPolarHBondContact O-CB 3.41Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 2.83Å; A256-L260 PolarHBondContact O-N 3.16Å; L257-L260 PolarHBondContact O-N 3.07Å |
| 261 | N | 96.1 | Very high | 95.6 | Very high | 132 Ų | 132 | 69.2 Ų | 69.2 | 71% | 0.706 | 33% | 0.333 | S | S | * | . | trans | 46.6 | 52.8 | 175 | -166.6 | 39.4 | 0 | 0 | 0 | 114.8 | L257 Q258 R259 | L257-N261 PolarHBondContact O-N 3.31Å; Q258-N261 PolarHBondContact O-N 2.93Å; R259-N261 PolarHBondContact O-N 3.39Å | ||
| 262 | P | 94.9 | Very high | 95.5 | Very high | 17 Ų | 17 | 67.8 Ų | 67.8 | 11% | 0.11 | 33% | 0.334 | C | S | . | . | trans | -64.3 | 140.6 | 174.5 | 29.4 | -34.2 | 0 | 0 | 0 | 110.8 | W217 L257 L267 | W217-P262 HydrophobicContact CH2-CB 3.79Å; W217-P262 HydrophobicContact CZ2-CB 3.77Å; L257-P262 VanDerWaalsContact O-CD 3.28Å; L257-P262 WeakPolarHBondContact O-CD 3.37Å; P262-L267 HydrophobicContact CG-CB 4.49Å; P262-L267 HydrophobicContact CG-CD1 4.38Å | ||
| 263 | K | 93.9 | Very high | 95.3 | Very high | 150 Ų | 150 | 65.9 Ų | 65.9 | 65% | 0.652 | 33% | 0.325 | S | S | * | . | trans | -57.5 | 150.7 | 170.8 | -65.9 | -178.9 | -179.8 | 178.5 | 0 | 110 | A265 T266 L267 | K263-A265 VanDerWaalsContact C-N 3.28Å; K263-A265 PolarHBondContact O-N 3.05Å; K263-T266 WeakPolarHBondContact O-CA 3.31Å; K263-T266 WeakPolarHBondContact O-CB 3.41Å; K263-T266 PolarHBondContact O-N 3.44Å; K263-L267 PolarHBondContact O-N 3.16Å | ||
| 264 | E | 93.3 | Very high | 95.2 | Very high | 138 Ų | 138 | 65.9 Ų | 65.9 | 65% | 0.645 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -55.6 | -42.6 | -179.3 | -171.2 | 60.3 | -152.6 | 0 | 0 | 112.3 | T266 L267 Q268 | E264-T266 VanDerWaalsContact C-N 3.3Å; E264-T266 PolarHBondContact O-N 3.19Å; E264-L267 PolarHBondContact O-N 3.49Å; E264-Q268 WeakPolarHBondContact O-CB 3.47Å; E264-Q268 PolarHBondContact O-N 3.44Å |
| 265 | A | 91.6 | Very high | 95 | Very high | 52 Ų | 52 | 65.9 Ų | 65.9 | 43% | 0.43 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.4 | -41.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | K263 A269 Q316 | K263-A265 VanDerWaalsContact C-N 3.28Å; K263-A265 PolarHBondContact O-N 3.05Å; A265-A269 WeakPolarHBondContact O-CB 3.45Å; A265-A269 PolarHBondContact O-N 3.31Å; A265-Q316 VanDerWaalsContact C-NE2 3.33Å; A265-Q316 VanDerWaalsContact C-OE1 3.26Å; A265-Q316 PolarHBondContact O-NE2 3.01Å |
| 266 | T | 91.7 | Very high | 94.8 | Very high | 22 Ų | 22 | 67.2 Ų | 67.2 | 14% | 0.135 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -70.3 | -43.4 | 178.6 | -51.7 | 0 | 0 | 0 | 0 | 110.6 | W217 L218 K263 E264 Q268 A269 L270 Q316 | W217-T266 HydrophobicContact CH2-CG2 4.11Å; W217-T266 HydrophobicContact CZ3-CG2 4.25Å; L218-T266 HydrophobicContact CD1-CG2 4.41Å; K263-T266 WeakPolarHBondContact O-CA 3.31Å; K263-T266 WeakPolarHBondContact O-CB 3.41Å; K263-T266 PolarHBondContact O-N 3.44Å; E264-T266 VanDerWaalsContact C-N 3.3Å; E264-T266 PolarHBondContact O-N 3.19Å; T266-Q268 VanDerWaalsContact C-N 3.31Å; T266-Q268 PolarHBondContact O-N 3.33Å; T266-A269 PolarHBondContact O-N 3.4Å; T266-L270 HydrophobicContact CG2-CD1 4.09Å; T266-L270 HydrophobicContact CG2-CG 4.33Å; T266-L270 WeakPolarHBondContact O-CB 3.26Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.42Å; T266-L270 PolarHBondContact O-N 2.9Å; T266-Q316 PolarHBondContact OG1-OE1 3.2Å |
| 267 | L | 94 | Very high | 94.4 | Very high | 32 Ų | 32 | 68.4 Ų | 68.4 | 17% | 0.168 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.7 | -43.5 | 175.4 | -177.3 | 63.2 | 0 | 0 | 0 | 111.4 | I225 P262 K263 E264 T271 | I225-L267 HydrophobicContact CD1-CD1 3.66Å; I225-L267 HydrophobicContact CG1-CD1 3.93Å; P262-L267 HydrophobicContact CG-CB 4.49Å; P262-L267 HydrophobicContact CG-CD1 4.38Å; K263-L267 PolarHBondContact O-N 3.16Å; E264-L267 PolarHBondContact O-N 3.49Å; L267-T271 VanDerWaalsContact O-CB 3.27Å; L267-T271 WeakPolarHBondContact O-CB 3.43Å; L267-T271 PolarHBondContact O-N 3.16Å; L267-T271 PolarHBondContact O-OG1 3.22Å |
| 268 | Q | 94.7 | Very high | 94.1 | Very high | 128 Ų | 128 | 68.8 Ų | 68.8 | 60% | 0.598 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -64.2 | -51 | 178.2 | -175.2 | 174.6 | 1.6 | 0 | 0 | 111.5 | E264 T266 L270 T271 E272 | E264-Q268 WeakPolarHBondContact O-CB 3.47Å; E264-Q268 PolarHBondContact O-N 3.44Å; T266-Q268 VanDerWaalsContact C-N 3.31Å; T266-Q268 PolarHBondContact O-N 3.33Å; Q268-L270 PolarHBondContact O-N 3.08Å; Q268-T271 WeakPolarHBondContact O-CB 3.37Å; Q268-T271 PolarHBondContact O-N 3.17Å; Q268-T271 VanDerWaalsContact O-N 3.15Å; Q268-E272 PolarHBondContact O-N 3.26Å |
| 269 | A | 93.9 | Very high | 93.6 | Very high | 14 Ų | 14 | 64.8 Ų | 64.8 | 12% | 0.116 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -64 | -41.4 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | A265 T266 T271 E272 V273 A312 | A265-A269 WeakPolarHBondContact O-CB 3.45Å; A265-A269 PolarHBondContact O-N 3.31Å; T266-A269 PolarHBondContact O-N 3.4Å; A269-T271 VanDerWaalsContact C-N 3.31Å; A269-T271 PolarHBondContact O-N 3.12Å; A269-E272 PolarHBondContact O-N 3.43Å; A269-V273 WeakPolarHBondContact O-CG2 3.22Å; A269-V273 PolarHBondContact O-N 3.4Å; A269-V273 VanDerWaalsContact O-N 3.17Å; A269-A312 HydrophobicContact CB-CB 4.21Å |
| 270 | L | 95.3 | Very high | 92.9 | Very high | 5 Ų | 5 | 60.5 Ų | 60.5 | 3% | 0.026 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -64.6 | -38 | 174 | -69.5 | -179 | 0 | 0 | 0 | 111.7 | L218 C221 M222 I225 T266 Q268 M274 I309 | L218-L270 HydrophobicContact CD1-CD1 4.1Å; L218-L270 HydrophobicContact CD1-CD2 4.05Å; L218-L270 HydrophobicContact CD1-CG 4.49Å; C221-L270 HydrophobicContact CB-CD1 3.63Å; M222-L270 HydrophobicContact CB-CD2 4.26Å; I225-L270 HydrophobicContact CD1-CB 3.46Å; I225-L270 VanDerWaalsContact CD1-CB 3.46Å; I225-L270 HydrophobicContact CD1-CD1 3.76Å; I225-L270 HydrophobicContact CD1-CG 4.28Å; T266-L270 HydrophobicContact CG2-CD1 4.09Å; T266-L270 HydrophobicContact CG2-CG 4.33Å; T266-L270 WeakPolarHBondContact O-CB 3.26Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.42Å; T266-L270 PolarHBondContact O-N 2.9Å; Q268-L270 PolarHBondContact O-N 3.08Å; L270-M274 WeakPolarHBondContact O-CB 3.37Å; L270-M274 WeakPolarHBondContact O-CG 3.4Å; L270-M274 PolarHBondContact O-N 3.22Å; L270-I309 HydrophobicContact CD2-CB 4.3Å; L270-I309 HydrophobicContact CD2-CD1 4.08Å; L270-I309 HydrophobicContact CD2-CG1 3.85Å; L270-I309 HydrophobicContact CD2-CG2 3.64Å |
| 271 | T | 96.1 | Very high | 91.9 | Very high | 38 Ų | 38 | 65.8 Ų | 65.8 | 23% | 0.233 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65 | -41.4 | 177.3 | -61.3 | 0 | 0 | 0 | 0 | 111.2 | L229 L267 Q268 A269 M274 S275 | L229-T271 HydrophobicContact CD1-CG2 4.43Å; L229-T271 HydrophobicContact CD2-CG2 4.35Å; L267-T271 VanDerWaalsContact O-CB 3.27Å; L267-T271 WeakPolarHBondContact O-CB 3.43Å; L267-T271 PolarHBondContact O-N 3.16Å; L267-T271 PolarHBondContact O-OG1 3.22Å; Q268-T271 WeakPolarHBondContact O-CB 3.37Å; Q268-T271 PolarHBondContact O-N 3.17Å; Q268-T271 VanDerWaalsContact O-N 3.15Å; A269-T271 VanDerWaalsContact C-N 3.31Å; A269-T271 PolarHBondContact O-N 3.12Å; T271-M274 PolarHBondContact O-N 2.9Å; T271-S275 WeakPolarHBondContact O-CB 3.23Å; T271-S275 PolarHBondContact O-N 3.06Å; T271-S275 PolarHBondContact O-OG 3.43Å |
| 272 | E | 94.8 | Very high | 90.8 | Very high | 137 Ų | 137 | 65.1 Ų | 65.1 | 64% | 0.64 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -57.3 | -58 | 176.2 | -175.4 | 174.6 | 179.5 | 0 | 0 | 110.8 | Q268 A269 M274 S275 E276 | Q268-E272 PolarHBondContact O-N 3.26Å; A269-E272 PolarHBondContact O-N 3.43Å; E272-M274 PolarHBondContact O-N 3.42Å; E272-S275 PolarHBondContact O-N 3.41Å; E272-S275 VanDerWaalsContact O-N 3.09Å; E272-S275 PolarHBondContact O-OG 2.83Å; E272-E276 PolarHBondContact O-N 3.37Å |
| 273 | V | 93.9 | Very high | 90 | Very high | 20 Ų | 20 | 65.1 Ų | 65.1 | 12% | 0.121 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59.5 | -45 | 179.6 | 178.6 | 0 | 0 | 0 | 0 | 111.6 | A269 S275 E276 I309 | A269-V273 WeakPolarHBondContact O-CG2 3.22Å; A269-V273 PolarHBondContact O-N 3.4Å; A269-V273 VanDerWaalsContact O-N 3.17Å; V273-S275 PolarHBondContact O-N 2.9Å; V273-E276 PolarHBondContact O-N 3.5Å; V273-I309 HydrophobicContact CB-CG1 4.33Å; V273-I309 HydrophobicContact CG1-CD1 4.47Å; V273-I309 HydrophobicContact CG1-CG1 3.94Å |
| 274 | M | 95.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | 4.6 | -178.5 | -61.5 | -48.1 | -70.6 | 0 | 0 | 113.8 | W165 M222 I225 R226 L229 L270 T271 E272 L278 W305 I309 | W165-M274 HydrophobicContact CE3-CE 4.22Å; W165-M274 HydrophobicContact CH2-CE 3.57Å; W165-M274 HydrophobicContact CZ2-CE 4.19Å; W165-M274 HydrophobicContact CZ3-CE 3.58Å; M222-M274 HydrophobicContact CB-CG 4.18Å; M222-M274 HydrophobicContact CB-SD 4.31Å; M222-M274 HydrophobicContact CE-CE 3.68Å; M222-M274 HydrophobicContact CE-SD 3.57Å; M222-M274 VanDerWaalsContact CE-SD 3.57Å; I225-M274 HydrophobicContact CG2-CB 4.26Å; R226-M274 HydrophobicContact CB-CB 4.33Å; R226-M274 HydrophobicContact CB-CE 3.48Å; R226-M274 VanDerWaalsContact CB-CE 3.48Å; R226-M274 HydrophobicContact CB-CG 4.46Å; R226-M274 WeakPolarHBondContact CD-O 3.43Å; R226-M274 HydrophobicContact CG-CE 3.53Å; R226-M274 PolarHBondContact NH1-O 3.02Å; L229-M274 HydrophobicContact CD1-CB 4.2Å; L229-M274 WeakPolarHBondContact CD1-O 3.47Å; L270-M274 WeakPolarHBondContact O-CB 3.37Å; L270-M274 WeakPolarHBondContact O-CG 3.4Å; L270-M274 PolarHBondContact O-N 3.22Å; T271-M274 PolarHBondContact O-N 2.9Å; E272-M274 PolarHBondContact O-N 3.42Å; M274-L278 WeakPolarHBondContact O-CD1 3.38Å; M274-W305 HydrophobicContact CE-CG 4.28Å; M274-W305 HydrophobicContact SD-CB 4.26Å; M274-W305 HydrophobicContact SD-CG 4.22Å; M274-I309 HydrophobicContact SD-CD1 3.9Å |
| 275 | S | 94.3 | Very high | 87 | Confident | 49 Ų | 49 | 66.5 Ų | 66.5 | 34% | 0.343 | 33% | 0.333 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.6 | -11.4 | 175.4 | 69.1 | 0 | 0 | 0 | 0 | 114 | T271 E272 V273 D277 L278 | T271-S275 WeakPolarHBondContact O-CB 3.23Å; T271-S275 PolarHBondContact O-N 3.06Å; T271-S275 PolarHBondContact O-OG 3.43Å; E272-S275 PolarHBondContact O-N 3.41Å; E272-S275 VanDerWaalsContact O-N 3.09Å; E272-S275 PolarHBondContact O-OG 2.83Å; V273-S275 PolarHBondContact O-N 2.9Å; S275-D277 VanDerWaalsContact C-N 3.29Å; S275-D277 PolarHBondContact O-N 2.89Å; S275-L278 WeakPolarHBondContact O-CB 3.33Å; S275-L278 PolarHBondContact O-N 3.46Å |
| 276 | E | 92.6 | Very high | 85.5 | Confident | 149 Ų | 149 | 67.6 Ų | 67.6 | 70% | 0.696 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.1 | -41.2 | -172.8 | -171.6 | -178.2 | 168.1 | 0 | 0 | 113.5 | E272 V273 | E272-E276 PolarHBondContact O-N 3.37Å; V273-E276 PolarHBondContact O-N 3.5Å |
| 277 | D | 89.7 | Confident | 83.8 | Confident | 33 Ų | 33 | 74.1 Ų | 74.1 | 18% | 0.176 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.5 | 4.8 | -179 | 68.5 | -27.6 | 0 | 0 | 0 | 114.1 | R226 S275 I279 R304 | R226-D277 IonicContact CZ-OD1 3.78Å; R226-D277 IonicContact CZ-OD2 2.79Å; R226-D277 IonicContact NH1-OD1 3.09Å; R226-D277 PolarHBondContact NH1-OD1 3.15Å; R226-D277 VanDerWaalsContact NH2-CG 3.29Å; R226-D277 IonicContact NH2-OD1 2.76Å; R226-D277 PolarHBondContact NH2-OD1 3.23Å; R226-D277 IonicContact NH2-OD2 3.86Å; R226-D277 PolarHBondContact NH2-OD2 2.99Å; S275-D277 VanDerWaalsContact C-N 3.29Å; S275-D277 PolarHBondContact O-N 2.89Å; D277-I279 VanDerWaalsContact C-N 3.28Å; D277-I279 PolarHBondContact O-N 3.47Å; D277-R304 IonicContact OD2-CZ 3.96Å; D277-R304 IonicContact OD2-NE 2.85Å; D277-R304 IonicContact OD2-NH2 3.66Å; D277-R304 PolarHBondContact OD2-NH2 3.12Å |
| 278 | L | 90.6 | Very high | 82.1 | Confident | 18 Ų | 18 | 75 Ų | 75 | 9% | 0.094 | 36% | 0.359 | C | S | . | . | trans | -86.7 | 61.8 | -178.6 | -62.3 | -174.4 | 0 | 0 | 0 | 112.6 | F160 R226 L229 L230 I233 M274 S275 M283 | F160-L278 HydrophobicContact CD1-CD2 4.03Å; F160-L278 HydrophobicContact CE1-CD2 4.16Å; R226-L278 VanDerWaalsContact NH1-CD2 3.32Å; R226-L278 VanDerWaalsContact NH1-CG 3.26Å; L229-L278 HydrophobicContact CB-CD1 3.58Å; L229-L278 HydrophobicContact CD1-CD1 4.07Å; L229-L278 HydrophobicContact CG-CD1 4.41Å; L230-L278 HydrophobicContact CD2-CD2 3.51Å; L230-L278 HydrophobicContact CG-CD2 4.34Å; I233-L278 HydrophobicContact CD1-CB 3.76Å; I233-L278 HydrophobicContact CD1-CD1 3.85Å; I233-L278 HydrophobicContact CD1-CG 4.28Å; M274-L278 WeakPolarHBondContact O-CD1 3.38Å; S275-L278 WeakPolarHBondContact O-CB 3.33Å; S275-L278 PolarHBondContact O-N 3.46Å; L278-M283 HydrophobicContact CB-SD 4.42Å; L278-M283 HydrophobicContact CD2-CE 4.45Å; L278-M283 HydrophobicContact CD2-SD 4.09Å | ||
| 279 | I | 86.8 | Confident | 80.5 | Confident | 64 Ų | 64 | 74.8 Ų | 74.8 | 33% | 0.328 | 36% | 0.361 | S | S | . | . | trans | -97.7 | 113 | 177.9 | -59.1 | 168.3 | 0 | 0 | 0 | 108.4 | D277 E281 K282 M283 | D277-I279 VanDerWaalsContact C-N 3.28Å; D277-I279 PolarHBondContact O-N 3.47Å; I279-E281 HydrophobicContact CG2-CB 4.46Å; I279-E281 WeakPolarHBondContact CG2-OE2 3.48Å; I279-E281 PolarHBondContact O-N 3.3Å; I279-E281 VanDerWaalsContact O-N 3.07Å; I279-K282 HydrophobicContact CB-CB 4.36Å; I279-K282 HydrophobicContact CB-CD 4.34Å; I279-K282 HydrophobicContact CB-CG 4.25Å; I279-K282 HydrophobicContact CD1-CD 4.05Å; I279-K282 HydrophobicContact CG2-CG 4.24Å; I279-K282 PolarHBondContact O-N 3Å; I279-M283 WeakPolarHBondContact O-CG 3.47Å; I279-M283 PolarHBondContact O-N 3.46Å | ||
| 280 | P | 80.8 | Confident | 79.5 | Confident | 57 Ų | 57 | 75.9 Ų | 75.9 | 37% | 0.37 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -53.6 | -33.2 | -172.3 | -29.3 | 36.2 | 0 | 0 | 0 | 115.1 | R284 | P280-R284 PolarHBondContact O-N 3.45Å |
| 281 | E | 75.6 | Confident | 78.9 | Confident | 127 Ų | 127 | 79.4 Ų | 79.4 | 59% | 0.593 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -66 | -50.4 | 177.6 | -65.5 | 69.2 | -152.2 | 0 | 0 | 111 | I279 M283 R284 | I279-E281 HydrophobicContact CG2-CB 4.46Å; I279-E281 WeakPolarHBondContact CG2-OE2 3.48Å; I279-E281 PolarHBondContact O-N 3.3Å; I279-E281 VanDerWaalsContact O-N 3.07Å; E281-M283 PolarHBondContact O-N 3.44Å; E281-R284 PolarHBondContact O-N 2.89Å |
| 282 | K | 73.7 | Confident | 78.3 | Confident | 117 Ų | 117 | 80.1 Ų | 80.1 | 51% | 0.509 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -65.7 | -38.3 | 178.6 | -63.9 | -172 | -180 | 179.6 | 0 | 112.2 | I279 R284 E285 D286 | I279-K282 HydrophobicContact CB-CB 4.36Å; I279-K282 HydrophobicContact CB-CD 4.34Å; I279-K282 HydrophobicContact CB-CG 4.25Å; I279-K282 HydrophobicContact CD1-CD 4.05Å; I279-K282 HydrophobicContact CG2-CG 4.24Å; I279-K282 PolarHBondContact O-N 3Å; K282-R284 PolarHBondContact O-N 3.23Å; K282-R284 VanDerWaalsContact O-N 3.15Å; K282-E285 PolarHBondContact O-N 3.04Å; K282-D286 PolarHBondContact O-N 3.12Å |
| 283 | M | 78.2 | Confident | 77.8 | Confident | 18 Ų | 18 | 76 Ų | 76 | 9% | 0.089 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -61.2 | -24.5 | 177.9 | -69.1 | 178.8 | 65.6 | 0 | 0 | 113.5 | F160 L230 I233 L278 I279 E281 | F160-M283 HydrophobicContact CB-CE 3.98Å; F160-M283 HydrophobicContact CD1-CE 3.92Å; F160-M283 HydrophobicContact CD1-CG 3.79Å; F160-M283 HydrophobicContact CD1-SD 4.24Å; F160-M283 HydrophobicContact CD2-CB 4.35Å; F160-M283 HydrophobicContact CD2-CG 4.14Å; F160-M283 HydrophobicContact CE1-CG 3.73Å; F160-M283 HydrophobicContact CE1-SD 4.48Å; F160-M283 HydrophobicContact CE2-CB 4.45Å; F160-M283 HydrophobicContact CE2-CG 4.08Å; F160-M283 HydrophobicContact CG-CE 4.01Å; F160-M283 HydrophobicContact CG-CG 4Å; F160-M283 HydrophobicContact CZ-CG 3.88Å; L230-M283 HydrophobicContact CD2-CE 3.82Å; I233-M283 HydrophobicContact CD1-SD 4.5Å; I233-M283 HydrophobicContact CG2-CE 4.32Å; I233-M283 HydrophobicContact CG2-SD 4.3Å; L278-M283 HydrophobicContact CB-SD 4.42Å; L278-M283 HydrophobicContact CD2-CE 4.45Å; L278-M283 HydrophobicContact CD2-SD 4.09Å; I279-M283 WeakPolarHBondContact O-CG 3.47Å; I279-M283 PolarHBondContact O-N 3.46Å; E281-M283 PolarHBondContact O-N 3.44Å |
| 284 | R | 66.8 | Low | 77.1 | Confident | 158 Ų | 158 | 82.8 Ų | 82.8 | 60% | 0.596 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -86.9 | -18.7 | 175.5 | -71.5 | -174.5 | -166.6 | -170.3 | 5.7 | 113.6 | P280 E281 K282 Y287 | P280-R284 PolarHBondContact O-N 3.45Å; E281-R284 PolarHBondContact O-N 2.89Å; K282-R284 PolarHBondContact O-N 3.23Å; K282-R284 VanDerWaalsContact O-N 3.15Å; R284-Y287 WeakPolarHBondContact O-CD2 3.32Å; R284-Y287 VanDerWaalsContact O-CE2 3.24Å; R284-Y287 WeakPolarHBondContact O-CE2 3.07Å |
| 285 | E | 56.1 | Low | 76.1 | Confident | 158 Ų | 158 | 87 Ų | 87 | 74% | 0.738 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -92.1 | -31.6 | -178.1 | -68.7 | 174.1 | 177.2 | 0 | 0 | 110.9 | K282 Y287 | K282-E285 PolarHBondContact O-N 3.04Å; E285-Y287 PolarHBondContact O-N 3.29Å |
| 286 | D | 60.1 | Low | 75.2 | Confident | 75 Ų | 75 | 85.8 Ų | 85.8 | 40% | 0.401 | 44% | 0.435 | S | S | . | . | trans | -80.9 | 34.6 | -177.9 | -66.2 | -26.7 | 0 | 0 | 0 | 114.6 | F160 K282 Q288 | F160-D286 HydrophobicContact CE2-CB 3.9Å; K282-D286 PolarHBondContact O-N 3.12Å; D286-Q288 PolarHBondContact O-N 3.37Å | ||
| 287 | Y | 56.2 | Low | 74.3 | Confident | 159 Ų | 159 | 84.4 Ų | 84.4 | 62% | 0.624 | 44% | 0.44 | S | S | * | . | trans | -71.5 | 80.6 | 171.6 | -76.3 | -83.8 | 0 | 0 | 0 | 110.1 | R284 E285 D289 | R284-Y287 WeakPolarHBondContact O-CD2 3.32Å; R284-Y287 VanDerWaalsContact O-CE2 3.24Å; R284-Y287 WeakPolarHBondContact O-CE2 3.07Å; E285-Y287 PolarHBondContact O-N 3.29Å; Y287-D289 PolarHBondContact O-N 3.37Å | ||
| 288 | Q | 57.9 | Low | 73.6 | Confident | 51 Ų | 51 | 86.3 Ų | 86.3 | 24% | 0.238 | 45% | 0.45 | C | S | . | . | trans | -74.9 | 33.9 | -178.9 | -64.8 | -178.6 | -13.9 | 0 | 0 | 113.5 | T124 D286 G290 E291 | T124-Q288 PolarHBondContact OG1-O 3.15Å; D286-Q288 PolarHBondContact O-N 3.37Å; Q288-G290 PolarHBondContact O-N 3.38Å; Q288-E291 HydrophobicContact CB-CG 4.43Å | ||
| 289 | D | 60.8 | Low | 73 | Confident | 123 Ų | 123 | 90.5 Ų | 90.5 | 66% | 0.658 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | 112.3 | 178.7 | -83.8 | -10.1 | 0 | 0 | 0 | 109.8 | Y287 | Y287-D289 PolarHBondContact O-N 3.37Š|
| 290 | G | 73.8 | Confident | 72.9 | Confident | 38 Ų | 38 | 89.8 Ų | 89.8 | 39% | 0.392 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.2 | 11.4 | 172 | 0 | 0 | 0 | 0 | 0 | 115.3 | T124 C125 Q288 | T124-G290 PolarHBondContact OG1-N 3.43Å; C125-G290 PolarHBondContact SG-N 3.27Å; Q288-G290 PolarHBondContact O-N 3.38Å |
| 291 | E | 81.9 | Confident | 73.2 | Confident | 79 Ų | 79 | 87.7 Ų | 87.7 | 37% | 0.369 | 46% | 0.455 | S | S | . | . | trans | -61.4 | 143.5 | 174.2 | -67.3 | -169.9 | 168.3 | 0 | 0 | 111.6 | N123 T124 Q288 L293 V296 | N123-E291 CarbonylContact C-O 3.46Å; N123-E291 WeakPolarHBondContact CA-O 3.46Å; N123-E291 WeakPolarHBondContact CB-O 3.43Å; T124-E291 HydrophobicContact CG2-CB 4.09Å; T124-E291 PolarHBondContact N-O 3.16Å; T124-E291 PolarHBondContact OG1-N 2.73Å; Q288-E291 HydrophobicContact CB-CG 4.43Å; E291-L293 PolarHBondContact O-N 2.92Å; E291-V296 HydrophobicContact CB-CG2 3.58Å; E291-V296 WeakPolarHBondContact OE2-CG2 3.2Å | ||
| 292 | S | 84.9 | Confident | 73.8 | Confident | 52 Ų | 52 | 85.9 Ų | 85.9 | 36% | 0.364 | 44% | 0.443 | S | S | . | . | B | Isolated β-bridge | trans | -66.3 | 132.1 | 177.8 | 177 | 0 | 0 | 0 | 0 | 110.8 | N294 S295 V296 | S292-N294 PolarHBondContact O-N 3.09Å; S292-N294 PolarHBondContact OG-N 2.97Å; S292-S295 PolarHBondContact O-N 3.42Å; S292-S295 PolarHBondContact O-OG 3.37Å; S292-V296 WeakPolarHBondContact O-CG2 3.38Å; S292-V296 PolarHBondContact O-N 3.27Å |
| 293 | L | 82.8 | Confident | 74.4 | Confident | 50 Ų | 50 | 86.6 Ų | 86.6 | 26% | 0.262 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -18.9 | 178.6 | -65.4 | 178.4 | 0 | 0 | 0 | 113.1 | S122 T124 L127 E291 S295 | S122-L293 PolarHBondContact O-N 3.5Å; T124-L293 HydrophobicContact CG2-CD2 4.3Å; L127-L293 HydrophobicContact CB-CD1 4.41Å; L127-L293 HydrophobicContact CB-CD2 4.27Å; L127-L293 HydrophobicContact CD2-CD2 3.93Å; E291-L293 PolarHBondContact O-N 2.92Å; L293-S295 VanDerWaalsContact C-N 3.32Å |
| 294 | N | 80 | Confident | 74.9 | Confident | 164 Ų | 164 | 89 Ų | 89 | 88% | 0.877 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | -22 | 176.1 | -65.7 | -17.8 | 0 | 0 | 0 | 113.1 | S292 | S292-N294 PolarHBondContact O-N 3.09Å; S292-N294 PolarHBondContact OG-N 2.97Å |
| 295 | S | 74.5 | Confident | 76 | Confident | 89 Ų | 89 | 81.6 Ų | 81.6 | 62% | 0.622 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.5 | -16.6 | -178.9 | 51.8 | 0 | 0 | 0 | 0 | 113.4 | S292 L293 C297 | S292-S295 PolarHBondContact O-N 3.42Å; S292-S295 PolarHBondContact O-OG 3.37Å; L293-S295 VanDerWaalsContact C-N 3.32Å; S295-C297 PolarHBondContact O-N 2.96Å |
| 296 | V | 75.7 | Confident | 77.7 | Confident | 23 Ų | 23 | 74.1 Ų | 74.1 | 14% | 0.139 | 39% | 0.393 | C | S | . | . | trans | -82.4 | 118.5 | -179.2 | -172.4 | 0 | 0 | 0 | 0 | 110.7 | T124 E291 S292 L298 | T124-V296 HydrophobicContact CG2-CG2 3.78Å; E291-V296 HydrophobicContact CB-CG2 3.58Å; E291-V296 WeakPolarHBondContact OE2-CG2 3.2Å; S292-V296 WeakPolarHBondContact O-CG2 3.38Å; S292-V296 PolarHBondContact O-N 3.27Å; V296-L298 HydrophobicContact CG1-CD2 3.49Å; V296-L298 VanDerWaalsContact CG1-CD2 3.49Å; V296-L298 HydrophobicContact CG1-CG 3.68Å; V296-L298 PolarHBondContact O-N 3.03Å | ||
| 297 | C | 73.4 | Confident | 79.2 | Confident | 119 Ų | 119 | 73 Ų | 73 | 80% | 0.804 | 39% | 0.391 | S | S | * | . | trans | -86.5 | 96.8 | 167.1 | -172.9 | 0 | 0 | 0 | 0 | 109.3 | S295 Q299 | S295-C297 PolarHBondContact O-N 2.96Å; C297-Q299 PolarHBondContact O-N 2.92Å | ||
| 298 | L | 74.9 | Confident | 80.8 | Confident | 73 Ų | 73 | 67.8 Ų | 67.8 | 38% | 0.382 | 38% | 0.377 | S | S | . | . | trans | -86.9 | 105.9 | 176.9 | -66.3 | 175.4 | 0 | 0 | 0 | 110.3 | L127 L157 V296 | L127-L298 HydrophobicContact CD2-CD1 4.17Å; L157-L298 HydrophobicContact CD1-CD1 3.96Å; L157-L298 HydrophobicContact CD1-CD2 3.65Å; L157-L298 HydrophobicContact CD1-CG 4.44Å; V296-L298 HydrophobicContact CG1-CD2 3.49Å; V296-L298 VanDerWaalsContact CG1-CD2 3.49Å; V296-L298 HydrophobicContact CG1-CG 3.68Å; V296-L298 PolarHBondContact O-N 3.03Å | ||
| 299 | Q | 78.8 | Confident | 82.2 | Confident | 107 Ų | 107 | 65.3 Ų | 65.3 | 50% | 0.5 | 37% | 0.366 | S | S | . | . | trans | -65.8 | 138.5 | 167.7 | -70.2 | -177.7 | -10.2 | 0 | 0 | 110.4 | S156 C297 R304 | S156-Q299 PolarHBondContact OG-O 3.49Å; C297-Q299 PolarHBondContact O-N 2.92Å; Q299-R304 HydrophobicContact CB-CB 4.28Å | ||
| 300 | S | 84.6 | Confident | 83.5 | Confident | 48 Ų | 48 | 62.1 Ų | 62.1 | 34% | 0.336 | 35% | 0.349 | S | S | . | . | trans | -64.7 | 150 | 177.2 | 69.3 | 0 | 0 | 0 | 0 | 110.7 | R302 E303 R304 | S300-R302 PolarHBondContact O-N 2.85Å; S300-R302 VanDerWaalsContact O-N 3.12Å; S300-E303 WeakPolarHBondContact CB-OE2 3.35Å; S300-E303 PolarHBondContact N-OE2 2.74Å; S300-E303 VanDerWaalsContact N-OE2 3.15Å; S300-E303 PolarHBondContact O-N 2.71Å; S300-E303 WeakPolarHBondContact OG-CB 3.49Å; S300-E303 WeakPolarHBondContact OG-CG 3.4Å; S300-E303 PolarHBondContact OG-N 2.8Å; S300-E303 VanDerWaalsContact OG-N 3.14Å; S300-E303 PolarHBondContact OG-OE2 3.13Å; S300-R304 WeakPolarHBondContact O-CB 2.84Å; S300-R304 PolarHBondContact O-N 3.41Å | ||
| 301 | F | 87.1 | Confident | 84.2 | Confident | 14 Ų | 14 | 66.1 Ų | 66.1 | 6% | 0.061 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -53.3 | -35.2 | 174.5 | -178.6 | -85.8 | 0 | 0 | 0 | 111.2 | Q152 C155 S156 W165 L168 M222 W305 W306 | Q152-F301 HydrophobicContact CB-CB 4Å; Q152-F301 HydrophobicContact CB-CD1 4.44Å; Q152-F301 HydrophobicContact CB-CD2 3.94Å; Q152-F301 HydrophobicContact CB-CG 3.88Å; Q152-F301 HydrophobicContact CG-CD1 4.06Å; Q152-F301 HydrophobicContact CG-CD2 4.03Å; Q152-F301 HydrophobicContact CG-CE1 4.26Å; Q152-F301 HydrophobicContact CG-CE2 4.2Å; Q152-F301 HydrophobicContact CG-CG 3.95Å; Q152-F301 HydrophobicContact CG-CZ 4.32Å; C155-F301 HydrophobicContact CB-CD2 4.06Å; C155-F301 HydrophobicContact CB-CE2 4.08Å; S156-F301 VanDerWaalsContact OG-CA 3.28Å; S156-F301 WeakPolarHBondContact OG-CA 3.46Å; S156-F301 PolarHBondContact OG-N 3.15Å; W165-F301 HydrophobicContact CE3-CE2 4.48Å; W165-F301 HydrophobicContact CH2-CD2 4.3Å; W165-F301 AromaticContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CE2 3.62Å; W165-F301 HydrophobicContact CH2-CZ 4.41Å; W165-F301 AromaticContact CZ3-CE2 3.46Å; W165-F301 HydrophobicContact CZ3-CE2 3.46Å; W165-F301 VanDerWaalsContact CZ3-CE2 3.46Å; W165-F301 AromaticContact CZ3-CZ 3.98Å; W165-F301 HydrophobicContact CZ3-CZ 3.98Å; L168-F301 HydrophobicContact CD2-CE2 4.02Å; L168-F301 HydrophobicContact CD2-CZ 4.15Å; M222-F301 HydrophobicContact CE-CE1 4.19Å; M222-F301 HydrophobicContact CE-CE2 4.39Å; M222-F301 HydrophobicContact CE-CZ 3.6Å; M222-F301 HydrophobicContact SD-CE1 4.31Å; M222-F301 HydrophobicContact SD-CZ 4.01Å; F301-W305 AromaticContact CD2-CE3 3.79Å; F301-W305 HydrophobicContact CD2-CE3 3.79Å; F301-W305 AromaticContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CE2-CE3 4.17Å; F301-W305 HydrophobicContact CG-CE3 4.27Å; F301-W305 PolarHBondContact O-N 3.35Å; F301-W306 HydrophobicContact CD1-CB 4.25Å; F301-W306 HydrophobicContact CE1-CB 4.29Å; F301-W306 HydrophobicContact CE1-CE3 4.4Å; F301-W306 PolarHBondContact O-N 3.39Å |
| 302 | R | 87.8 | Confident | 84.3 | Confident | 89 Ų | 89 | 63.4 Ų | 63.4 | 34% | 0.336 | 35% | 0.352 | S | S | . | . | I | π-helix | trans | -64.8 | -54.4 | 179.8 | 177.9 | 177.6 | -95.4 | -156.8 | 5.8 | 111.8 | E206 E210 S300 R304 W306 S307 | E206-R302 IonicContact OE1-CZ 3.87Å; E206-R302 VanDerWaalsContact OE1-CZ 3.3Å; E206-R302 IonicContact OE1-NH1 2.81Å; E206-R302 PolarHBondContact OE1-NH1 3.36Å; E206-R302 IonicContact OE1-NH2 3.13Å; E206-R302 PolarHBondContact OE1-NH2 3.11Å; E210-R302 IonicContact OE1-CZ 2.76Å; E210-R302 IonicContact OE1-NE 3.22Å; E210-R302 PolarHBondContact OE1-NE 3.28Å; E210-R302 IonicContact OE1-NH2 2.64Å; E210-R302 PolarHBondContact OE1-NH2 3.44Å; S300-R302 PolarHBondContact O-N 2.85Å; S300-R302 VanDerWaalsContact O-N 3.12Å; R302-R304 VanDerWaalsContact C-N 3.34Å; R302-R304 PolarHBondContact O-N 2.91Å; R302-W306 HydrophobicContact CB-CB 4.36Å; R302-W306 HydrophobicContact CG-CB 4.33Å; R302-W306 PolarHBondContact O-N 3.14Å; R302-W306 VanDerWaalsContact O-N 3.13Å; R302-S307 PolarHBondContact O-N 3.25Å; R302-S307 PolarHBondContact O-OG 3.36Å |
| 303 | E | 86.6 | Confident | 84.1 | Confident | 131 Ų | 131 | 62.6 Ų | 62.6 | 61% | 0.612 | 35% | 0.348 | S | S | * | . | I | π-helix | trans | -63.7 | -41.4 | -178.7 | -70.4 | 159.5 | 155.3 | 0 | 0 | 111.8 | S300 | S300-E303 WeakPolarHBondContact CB-OE2 3.35Å; S300-E303 PolarHBondContact N-OE2 2.74Å; S300-E303 VanDerWaalsContact N-OE2 3.15Å; S300-E303 PolarHBondContact O-N 2.71Å; S300-E303 WeakPolarHBondContact OG-CB 3.49Å; S300-E303 WeakPolarHBondContact OG-CG 3.4Å; S300-E303 PolarHBondContact OG-N 2.8Å; S300-E303 VanDerWaalsContact OG-N 3.14Å; S300-E303 PolarHBondContact OG-OE2 3.13Å |
| 304 | R | 87.3 | Confident | 83.8 | Confident | 68 Ų | 68 | 63 Ų | 63 | 26% | 0.257 | 36% | 0.359 | S | S | . | . | I | π-helix | trans | -75.4 | -35.7 | -172.3 | -168.6 | 170.3 | 170.9 | 174.5 | -0.1 | 113.8 | D277 Q299 S300 R302 | D277-R304 IonicContact OD2-CZ 3.96Å; D277-R304 IonicContact OD2-NE 2.85Å; D277-R304 IonicContact OD2-NH2 3.66Å; D277-R304 PolarHBondContact OD2-NH2 3.12Å; Q299-R304 HydrophobicContact CB-CB 4.28Å; S300-R304 WeakPolarHBondContact O-CB 2.84Å; S300-R304 PolarHBondContact O-N 3.41Å; R302-R304 VanDerWaalsContact C-N 3.34Å; R302-R304 PolarHBondContact O-N 2.91Å |
| 305 | W | 91.4 | Very high | 83.1 | Confident | 4 Ų | 4 | 60.2 Ų | 60.2 | 2% | 0.015 | 35% | 0.352 | C | S | . | . | I | π-helix | trans | -135.6 | -44.3 | -176 | -57.6 | -70.9 | 0 | 0 | 0 | 113.9 | C155 P159 W165 M222 M274 F301 S307 S308 I309 | C155-W305 WeakPolarHBondContact O-CH2 3.34Å; P159-W305 HydrophobicContact CB-CH2 3.9Å; P159-W305 HydrophobicContact CB-CZ2 3.85Å; W165-W305 AromaticContact CH2-CD2 3.77Å; W165-W305 HydrophobicContact CH2-CD2 3.77Å; W165-W305 AromaticContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CE3 3.65Å; W165-W305 HydrophobicContact CH2-CG 4.43Å; W165-W305 HydrophobicContact CH2-CH2 4.02Å; W165-W305 HydrophobicContact CH2-CZ2 4.14Å; W165-W305 AromaticContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CH2-CZ3 3.78Å; W165-W305 HydrophobicContact CZ2-CD2 4.25Å; W165-W305 HydrophobicContact CZ2-CE3 4.17Å; W165-W305 AromaticContact CZ2-CH2 3.66Å; W165-W305 HydrophobicContact CZ2-CH2 3.66Å; W165-W305 AromaticContact CZ2-CZ2 3.74Å; W165-W305 HydrophobicContact CZ2-CZ2 3.74Å; W165-W305 AromaticContact CZ2-CZ3 3.89Å; W165-W305 HydrophobicContact CZ2-CZ3 3.89Å; M222-W305 HydrophobicContact CE-CB 4Å; M274-W305 HydrophobicContact CE-CG 4.28Å; M274-W305 HydrophobicContact SD-CB 4.26Å; M274-W305 HydrophobicContact SD-CG 4.22Å; F301-W305 AromaticContact CD2-CE3 3.79Å; F301-W305 HydrophobicContact CD2-CE3 3.79Å; F301-W305 AromaticContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CD2-CZ3 3.96Å; F301-W305 HydrophobicContact CE2-CE3 4.17Å; F301-W305 HydrophobicContact CG-CE3 4.27Å; F301-W305 PolarHBondContact O-N 3.35Å; W305-S307 PolarHBondContact O-N 3.37Å; W305-S308 PolarHBondContact O-N 2.85Å; W305-I309 WeakPolarHBondContact O-CG1 3.32Å; W305-I309 PolarHBondContact O-N 3.08Å; W305-I309 VanDerWaalsContact O-N 3.14Å |
| 306 | W | 91.6 | Very high | 82.6 | Confident | 1 Ų | 1 | 58.4 Ų | 58.4 | 0% | 0.004 | 33% | 0.334 | C | S | . | . | I | π-helix | trans | -64.5 | -43 | -167.8 | -166.5 | -125.9 | 0 | 0 | 0 | 113.5 | R215 L218 R219 M222 F301 R302 S308 I309 L310 | R215-W306 HydrophobicContact CB-CH2 4.43Å; R215-W306 HydrophobicContact CB-CZ2 4.17Å; R215-W306 HydrophobicContact CG-CZ2 4.28Å; R215-W306 WeakPolarHBondContact O-CH2 3.43Å; L218-W306 HydrophobicContact CB-CH2 4.32Å; L218-W306 HydrophobicContact CD2-CH2 4.3Å; L218-W306 HydrophobicContact CG-CH2 4.46Å; L218-W306 HydrophobicContact CG-CZ3 4.46Å; R219-W306 HydrophobicContact CB-CH2 4.05Å; R219-W306 HydrophobicContact CB-CZ3 3.97Å; R219-W306 HydrophobicContact CG-CZ3 4.41Å; M222-W306 HydrophobicContact SD-CE3 3.62Å; M222-W306 HydrophobicContact SD-CZ3 3.7Å; F301-W306 HydrophobicContact CD1-CB 4.25Å; F301-W306 HydrophobicContact CE1-CB 4.29Å; F301-W306 HydrophobicContact CE1-CE3 4.4Å; F301-W306 PolarHBondContact O-N 3.39Å; R302-W306 HydrophobicContact CB-CB 4.36Å; R302-W306 HydrophobicContact CG-CB 4.33Å; R302-W306 PolarHBondContact O-N 3.14Å; R302-W306 VanDerWaalsContact O-N 3.13Å; W306-S308 PolarHBondContact O-N 3.43Å; W306-I309 HydrophobicContact CE3-CG2 4.36Å; W306-I309 HydrophobicContact CZ3-CG2 4.28Å; W306-I309 WeakPolarHBondContact O-CB 3.31Å; W306-I309 PolarHBondContact O-N 3.14Å; W306-L310 HydrophobicContact CD2-CG 4.48Å; W306-L310 HydrophobicContact CZ2-CD2 4.02Å; W306-L310 WeakPolarHBondContact O-CG 3.31Å; W306-L310 PolarHBondContact O-N 3.46Å |
| 307 | S | 90.5 | Very high | 81.3 | Confident | 50 Ų | 50 | 63 Ų | 63 | 35% | 0.35 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -61.5 | -44.3 | -178.6 | -64.6 | 0 | 0 | 0 | 0 | 111.8 | R302 W305 I309 L310 L311 | R302-S307 PolarHBondContact O-N 3.25Å; R302-S307 PolarHBondContact O-OG 3.36Å; W305-S307 PolarHBondContact O-N 3.37Å; S307-I309 VanDerWaalsContact C-N 3.32Å; S307-I309 PolarHBondContact O-N 2.9Å; S307-L310 PolarHBondContact O-N 2.94Å; S307-L311 WeakPolarHBondContact O-CG 3.48Å; S307-L311 PolarHBondContact O-N 2.98Å; S307-L311 VanDerWaalsContact O-N 3.1Å |
| 308 | S | 89.6 | Confident | 79.7 | Confident | 50 Ų | 50 | 64.2 Ų | 64.2 | 35% | 0.35 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.2 | -38.6 | 176.1 | -56.8 | 0 | 0 | 0 | 0 | 111.9 | W305 W306 L311 A312 | W305-S308 PolarHBondContact O-N 2.85Å; W306-S308 PolarHBondContact O-N 3.43Å; S308-L311 PolarHBondContact O-N 2.83Å; S308-A312 WeakPolarHBondContact O-CB 3.27Å; S308-A312 PolarHBondContact O-N 3.49Å |
| 309 | I | 89.1 | Confident | 77.9 | Confident | 0 Ų | 0 | 63.5 Ų | 63.5 | 0% | 0 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -64.8 | -43.1 | 176.1 | -74.3 | 171.3 | 0 | 0 | 0 | 111.8 | L218 M222 L270 V273 M274 W305 W306 S307 L311 A312 A313 | L218-I309 HydrophobicContact CD1-CG2 4.21Å; L218-I309 HydrophobicContact CD2-CG2 3.56Å; L218-I309 HydrophobicContact CG-CG2 3.74Å; M222-I309 HydrophobicContact CB-CD1 3.7Å; M222-I309 HydrophobicContact CE-CD1 3.31Å; M222-I309 HydrophobicContact CG-CD1 4.07Å; M222-I309 HydrophobicContact SD-CD1 3.36Å; M222-I309 WeakPolarHBondContact SD-CD1 3.46Å; L270-I309 HydrophobicContact CD2-CB 4.3Å; L270-I309 HydrophobicContact CD2-CD1 4.08Å; L270-I309 HydrophobicContact CD2-CG1 3.85Å; L270-I309 HydrophobicContact CD2-CG2 3.64Å; V273-I309 HydrophobicContact CB-CG1 4.33Å; V273-I309 HydrophobicContact CG1-CD1 4.47Å; V273-I309 HydrophobicContact CG1-CG1 3.94Å; M274-I309 HydrophobicContact SD-CD1 3.9Å; W305-I309 WeakPolarHBondContact O-CG1 3.32Å; W305-I309 PolarHBondContact O-N 3.08Å; W305-I309 VanDerWaalsContact O-N 3.14Å; W306-I309 HydrophobicContact CE3-CG2 4.36Å; W306-I309 HydrophobicContact CZ3-CG2 4.28Å; W306-I309 WeakPolarHBondContact O-CB 3.31Å; W306-I309 PolarHBondContact O-N 3.14Å; S307-I309 VanDerWaalsContact C-N 3.32Å; S307-I309 PolarHBondContact O-N 2.9Å; I309-L311 VanDerWaalsContact C-N 3.32Å; I309-L311 PolarHBondContact O-N 3.26Å; I309-A312 PolarHBondContact O-N 3.43Å; I309-A313 WeakPolarHBondContact O-CB 3.34Å; I309-A313 PolarHBondContact O-N 3.16Å |
| 310 | L | 88.1 | Confident | 75.8 | Confident | 55 Ų | 55 | 64.7 Ų | 64.7 | 29% | 0.288 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.6 | -39.5 | 177.5 | -69.7 | 177.7 | 0 | 0 | 0 | 111.7 | L218 W306 S307 A313 A314 | L218-L310 HydrophobicContact CD2-CD2 4.33Å; W306-L310 HydrophobicContact CD2-CG 4.48Å; W306-L310 HydrophobicContact CZ2-CD2 4.02Å; W306-L310 WeakPolarHBondContact O-CG 3.31Å; W306-L310 PolarHBondContact O-N 3.46Å; S307-L310 PolarHBondContact O-N 2.94Å; L310-A313 PolarHBondContact O-N 3.26Å; L310-A314 WeakPolarHBondContact O-CB 3.45Å; L310-A314 PolarHBondContact O-N 3.16Å |
| 311 | L | 86.8 | Confident | 73.5 | Confident | 122 Ų | 122 | 71.1 Ų | 71.1 | 64% | 0.639 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -65.2 | -43.3 | 175 | -70.2 | 171.4 | 0 | 0 | 0 | 112 | S307 S308 I309 A314 S315 | S307-L311 WeakPolarHBondContact O-CG 3.48Å; S307-L311 PolarHBondContact O-N 2.98Å; S307-L311 VanDerWaalsContact O-N 3.1Å; S308-L311 PolarHBondContact O-N 2.83Å; I309-L311 VanDerWaalsContact C-N 3.32Å; I309-L311 PolarHBondContact O-N 3.26Å; L311-A314 PolarHBondContact O-N 2.97Å; L311-S315 PolarHBondContact O-N 2.83Å; L311-S315 VanDerWaalsContact O-N 3.12Å; L311-S315 PolarHBondContact O-OG 3.07Å |
| 312 | A | 83.9 | Confident | 71.2 | Confident | 23 Ų | 23 | 75.2 Ų | 75.2 | 19% | 0.19 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -63.9 | -41.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A269 S308 I309 S315 Q316 | A269-A312 HydrophobicContact CB-CB 4.21Å; S308-A312 WeakPolarHBondContact O-CB 3.27Å; S308-A312 PolarHBondContact O-N 3.49Å; I309-A312 PolarHBondContact O-N 3.43Å; A312-S315 PolarHBondContact O-N 2.93Å; A312-Q316 WeakPolarHBondContact O-CG 3.19Å |
| 313 | A | 80.7 | Confident | 68.7 | Low | 35 Ų | 35 | 79.2 Ų | 79.2 | 29% | 0.289 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -67.4 | -40.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L218 I309 L310 S315 Q316 | L218-A313 HydrophobicContact CD2-CB 3.94Å; I309-A313 WeakPolarHBondContact O-CB 3.34Å; I309-A313 PolarHBondContact O-N 3.16Å; L310-A313 PolarHBondContact O-N 3.26Å; A313-S315 VanDerWaalsContact C-N 3.3Å; A313-S315 PolarHBondContact O-N 3.11Å; A313-Q316 PolarHBondContact O-N 3.25Å |
| 314 | A | 77.3 | Confident | 67 | Low | 59 Ų | 59 | 82.6 Ų | 82.6 | 49% | 0.488 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.4 | -35.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L310 L311 Q316 T317 | L310-A314 WeakPolarHBondContact O-CB 3.45Å; L310-A314 PolarHBondContact O-N 3.16Å; L311-A314 PolarHBondContact O-N 2.97Å; A314-Q316 PolarHBondContact O-N 3.36Å; A314-T317 PolarHBondContact O-N 3.24Å; A314-T317 PolarHBondContact O-OG1 3.04Å |
| 315 | S | 66.3 | Low | 66 | Low | 104 Ų | 104 | 83.4 Ų | 83.4 | 73% | 0.727 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.9 | -9.9 | 178.6 | -55.3 | 0 | 0 | 0 | 0 | 113.7 | L311 A312 A313 | L311-S315 PolarHBondContact O-N 2.83Å; L311-S315 VanDerWaalsContact O-N 3.12Å; L311-S315 PolarHBondContact O-OG 3.07Å; A312-S315 PolarHBondContact O-N 2.93Å; A313-S315 VanDerWaalsContact C-N 3.3Å; A313-S315 PolarHBondContact O-N 3.11Å |
| 316 | Q | 64.3 | Low | 64.7 | Low | 52 Ų | 52 | 87.5 Ų | 87.5 | 24% | 0.243 | 54% | 0.543 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.3 | 14.7 | 177.9 | -64.6 | -174.3 | 12.8 | 0 | 0 | 113.4 | A265 T266 A312 A313 A314 D318 | A265-Q316 VanDerWaalsContact C-NE2 3.33Å; A265-Q316 VanDerWaalsContact C-OE1 3.26Å; A265-Q316 PolarHBondContact O-NE2 3.01Å; T266-Q316 PolarHBondContact OG1-OE1 3.2Å; A312-Q316 WeakPolarHBondContact O-CG 3.19Å; A313-Q316 PolarHBondContact O-N 3.25Å; A314-Q316 PolarHBondContact O-N 3.36Å; Q316-D318 VanDerWaalsContact C-N 3.29Å; Q316-D318 PolarHBondContact O-N 3.02Å |
| 317 | T | 46.9 | Very low | 63.2 | Low | 118 Ų | 118 | 92.3 Ų | 92.3 | 72% | 0.724 | 57% | 0.573 | S | S | * | * | trans | -72.3 | 85.8 | 168.5 | 45.5 | 0 | 0 | 0 | 0 | 110 | A314 G319 | A314-T317 PolarHBondContact O-N 3.24Å; A314-T317 PolarHBondContact O-OG1 3.04Å; T317-G319 PolarHBondContact O-N 2.62Å | ||
| 318 | D | 40.3 | Very low | 61.6 | Low | 146 Ų | 146 | 94.8 Ų | 94.8 | 78% | 0.781 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 126.2 | 169.3 | -75.2 | -36.6 | 0 | 0 | 0 | 109.8 | Q316 | Q316-D318 VanDerWaalsContact C-N 3.29Å; Q316-D318 PolarHBondContact O-N 3.02Å |
| 319 | G | 36.3 | Very low | 59.9 | Low | 57 Ų | 57 | 97.6 Ų | 97.6 | 59% | 0.588 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 168.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | T317 Q321 | T317-G319 PolarHBondContact O-N 2.62Å; G319-Q321 PolarHBondContact O-N 3.07Å; G319-Q321 VanDerWaalsContact O-N 3.17Å |
| 320 | P | 35.2 | Very low | 57.9 | Low | 133 Ų | 133 | 104.1 Ų | 104.1 | 86% | 0.864 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 123.9 | -175.5 | 23.4 | -31.3 | 0 | 0 | 0 | 110.4 | A322 | P320-A322 PolarHBondContact O-N 3.03Š|
| 321 | Q | 36.8 | Very low | 55.7 | Low | 182 Ų | 182 | 107.6 Ų | 107.6 | 85% | 0.85 | 67% | 0.667 | S | S | * | * | trans | -61.6 | 104.3 | 163.4 | -74 | -173.8 | -12.2 | 0 | 0 | 107.3 | G319 E323 | G319-Q321 PolarHBondContact O-N 3.07Å; G319-Q321 VanDerWaalsContact O-N 3.17Å; Q321-E323 PolarHBondContact O-N 3.27Å | ||
| 322 | A | 37.8 | Very low | 53.4 | Low | 100 Ų | 100 | 106.5 Ų | 106.5 | 83% | 0.826 | 67% | 0.669 | S | S | * | * | trans | -67.7 | 106.9 | 161.3 | 0 | 0 | 0 | 0 | 0 | 106.7 | P320 | P320-A322 PolarHBondContact O-N 3.03Š| ||
| 323 | E | 35.5 | Very low | 50.8 | Low | 174 Ų | 174 | 113.5 Ų | 113.5 | 81% | 0.813 | 71% | 0.709 | S | S | * | * | trans | -66.6 | 142 | 165.1 | -72.9 | -173 | 158.9 | 0 | 0 | 109.4 | Q321 | Q321-E323 PolarHBondContact O-N 3.27Š| ||
| 324 | P | 52.5 | Low | 48.1 | Very low | 202 Ų | 202 | 120.6 Ų | 120.6 | 100% | 1.312 | 75% | 0.747 | S | S | * | * | trans | -71.1 | 0 | -178.3 | 28.4 | -34.2 | 0 | 0 | 0 | 114.7 |
Retrieved 324 of 324 residues in 289.8 ms
(Link to these results)