| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.5 | Very low | 33.7 | Very low | 254 Ų | 254 | 146.4 Ų | 146.4 | 100% | 1.251 | 86% | 0.864 | S | S | * | * | 0 | 108.4 | 0 | -69.8 | 169.1 | 169.3 | 0 | 0 | 105.5 | |||||
| 2 | G | 31 | Very low | 33.6 | Very low | 80 Ų | 80 | 147.2 Ų | 147.2 | 83% | 0.825 | 86% | 0.861 | S | S | * | * | cis | 134.3 | 105.8 | 23.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 3 | G | 30.1 | Very low | 33.3 | Very low | 74 Ų | 74 | 151.5 Ų | 151.5 | 76% | 0.763 | 86% | 0.864 | S | S | * | * | trans | 71.9 | 146.4 | 158.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 4 | T | 33.2 | Very low | 33.1 | Very low | 135 Ų | 135 | 153.1 Ų | 153.1 | 83% | 0.828 | 87% | 0.867 | S | S | * | * | cis | -168.3 | 133.4 | 28.6 | 43.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 5 | E | 33.3 | Very low | 32.6 | Very low | 199 Ų | 199 | 155.2 Ų | 155.2 | 93% | 0.93 | 86% | 0.863 | S | S | * | * | trans | -146.1 | 134.3 | 154.3 | -73.4 | -163.8 | 145.9 | 0 | 0 | 111.5 | ||||
| 6 | N | 33.9 | Very low | 32.2 | Very low | 162 Ų | 162 | 153.3 Ų | 153.3 | 87% | 0.866 | 85% | 0.85 | S | S | * | * | trans | -74.9 | 131.9 | -175.3 | -80.2 | -41.8 | 0 | 0 | 0 | 112.2 | F8 | N6-F8 PolarHBondContact O-N 3.39Š| ||
| 7 | P | 34.5 | Very low | 31.9 | Very low | 120 Ų | 120 | 151.5 Ų | 151.5 | 78% | 0.779 | 84% | 0.839 | S | S | * | * | trans | -97.8 | 79.5 | 170.8 | 35.4 | -27.3 | 0 | 0 | 0 | 110.3 | ||||
| 8 | F | 36.8 | Very low | 31.7 | Very low | 201 Ų | 201 | 151.1 Ų | 151.1 | 88% | 0.882 | 84% | 0.835 | S | S | * | * | trans | -136.5 | 72 | 159 | -93.8 | -77.1 | 0 | 0 | 0 | 108 | N6 | N6-F8 PolarHBondContact O-N 3.39Š| ||
| 9 | S | 34.3 | Very low | 31.4 | Very low | 115 Ų | 115 | 153.5 Ų | 153.5 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | trans | -171.8 | 80.7 | 167.4 | -71.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 10 | D | 33.2 | Very low | 31.3 | Very low | 156 Ų | 156 | 151.3 Ų | 151.3 | 83% | 0.834 | 83% | 0.833 | S | S | * | * | trans | -163.4 | 131.7 | 134.5 | -111.9 | -24.5 | 0 | 0 | 0 | 112.2 | ||||
| 11 | P | 36.1 | Very low | 31.7 | Very low | 114 Ų | 114 | 149.1 Ų | 149.1 | 74% | 0.74 | 83% | 0.826 | S | S | * | * | trans | -106.6 | 71.6 | -168.1 | 39.3 | -27.7 | 0 | 0 | 0 | 111.7 | ||||
| 12 | D | 32.8 | Very low | 31.1 | Very low | 156 Ų | 156 | 144 Ų | 144 | 83% | 0.834 | 80% | 0.804 | S | S | * | * | trans | -143.7 | 24.7 | -177.8 | -98.3 | -25.9 | 0 | 0 | 0 | 115.2 | ||||
| 13 | F | 29.1 | Very low | 31.1 | Very low | 204 Ų | 204 | 147.3 Ų | 147.3 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -106 | 11.9 | -174 | -124.6 | -87.2 | 0 | 0 | 0 | 116.7 | ||
| 14 | L | 30.9 | Very low | 31.2 | Very low | 173 Ų | 173 | 149.5 Ų | 149.5 | 91% | 0.906 | 80% | 0.801 | S | S | * | * | trans | -143.1 | 76.8 | 178.8 | -79 | 172 | 0 | 0 | 0 | 112.6 | ||||
| 15 | K | 25.6 | Very low | 31.2 | Very low | 185 Ų | 185 | 148 Ų | 148 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -160.7 | 126.5 | 148 | -116.8 | -179.9 | 174 | 170.3 | 0 | 111.6 | ||||
| 16 | N | 26.1 | Very low | 31.2 | Very low | 124 Ų | 124 | 142 Ų | 142 | 66% | 0.663 | 78% | 0.779 | S | S | * | * | trans | 77.3 | 132.1 | 148.6 | -67 | 11.7 | 0 | 0 | 0 | 117.2 | ||||
| 17 | D | 27.9 | Very low | 31.1 | Very low | 124 Ų | 124 | 140.9 Ų | 140.9 | 66% | 0.663 | 77% | 0.773 | S | S | * | * | cis | -159.9 | 154 | 9.2 | -85.2 | -35.5 | 0 | 0 | 0 | 110.6 | ||||
| 18 | D | 26.9 | Very low | 31 | Very low | 143 Ų | 143 | 142 Ų | 142 | 77% | 0.765 | 78% | 0.778 | S | S | * | * | trans | 45.2 | 115.8 | 143.6 | -70.4 | -25.2 | 0 | 0 | 0 | 122.5 | ||||
| 19 | F | 25.8 | Very low | 30.8 | Very low | 197 Ų | 197 | 136.7 Ų | 136.7 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | -177.5 | 117.5 | 107.2 | -124.9 | -106.5 | 0 | 0 | 0 | 111 | |||||
| 20 | S | 29.3 | Very low | 30.9 | Very low | 109 Ų | 109 | 138 Ų | 138 | 76% | 0.762 | 76% | 0.763 | S | S | * | * | trans | -86.1 | 147.6 | 152.3 | -68.1 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 21 | P | 40.9 | Very low | 31.1 | Very low | 107 Ų | 107 | 138 Ų | 138 | 70% | 0.695 | 76% | 0.762 | S | S | * | * | -150.1 | -178 | 56.4 | 36.5 | -13.7 | 0 | 0 | 0 | 116.1 | |||||
| 22 | N | 22.4 | Very low | 31 | Very low | 147 Ų | 147 | 142.7 Ų | 142.7 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | trans | 92.5 | 107.4 | 164 | -81.9 | -18.7 | 0 | 0 | 0 | 120.1 | ||||
| 23 | L | 31.1 | Very low | 31.3 | Very low | 149 Ų | 149 | 140.2 Ų | 140.2 | 78% | 0.78 | 76% | 0.759 | S | S | * | * | 64 | 97.7 | 119.7 | -158 | 79.9 | 0 | 0 | 0 | 116.8 | |||||
| 24 | T | 30.6 | Very low | 32.3 | Very low | 119 Ų | 119 | 136 Ų | 136 | 73% | 0.73 | 75% | 0.754 | S | S | * | * | -161.9 | 116.3 | 118.2 | -0.4 | 0 | 0 | 0 | 0 | 111.8 | T26 | T24-T26 WeakPolarHBondContact CB-OG1 3.5Å; T24-T26 WeakPolarHBondContact CG2-OG1 3.33Å; T24-T26 PolarHBondContact O-N 3.23Å | |||
| 25 | A | 34.8 | Very low | 33.1 | Very low | 103 Ų | 103 | 135.1 Ų | 135.1 | 85% | 0.851 | 75% | 0.75 | S | S | * | * | trans | -69.8 | 48.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 26 | T | 31.5 | Very low | 34.4 | Very low | 75 Ų | 75 | 129.7 Ų | 129.7 | 46% | 0.46 | 73% | 0.73 | S | S | . | * | trans | -110.7 | -11.3 | -163.6 | -44 | 0 | 0 | 0 | 0 | 114.1 | T24 S29 | T24-T26 WeakPolarHBondContact CB-OG1 3.5Å; T24-T26 WeakPolarHBondContact CG2-OG1 3.33Å; T24-T26 PolarHBondContact O-N 3.23Å; T26-S29 PolarHBondContact O-OG 2.95Å | ||
| 27 | N | 32.8 | Very low | 36.4 | Very low | 138 Ų | 138 | 126.7 Ų | 126.7 | 74% | 0.738 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -113.2 | 5.3 | -169 | -67.1 | -9.7 | 0 | 0 | 0 | 115.7 | ||
| 28 | T | 33.1 | Very low | 38.4 | Very low | 144 Ų | 144 | 126 Ų | 126 | 88% | 0.883 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -101 | 1.1 | 173.4 | -8.5 | 0 | 0 | 0 | 0 | 113.7 | ||
| 29 | S | 32.5 | Very low | 40.5 | Very low | 88 Ų | 88 | 124.1 Ų | 124.1 | 62% | 0.615 | 71% | 0.714 | S | S | * | * | trans | -89.1 | 12 | -179.7 | 48.6 | 0 | 0 | 0 | 0 | 114.6 | T26 | T26-S29 PolarHBondContact O-OG 2.95Š| ||
| 30 | L | 36.6 | Very low | 42.4 | Very low | 142 Ų | 142 | 119.2 Ų | 119.2 | 74% | 0.743 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -99.7 | 11.4 | -168.3 | -89 | 160.9 | 0 | 0 | 0 | 116.3 | ||
| 31 | L | 35.4 | Very low | 44.3 | Very low | 158 Ų | 158 | 117.8 Ų | 117.8 | 83% | 0.827 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -120.8 | 2.7 | 177 | -94.3 | 157.5 | 0 | 0 | 0 | 116.3 | ||
| 32 | Y | 34.5 | Very low | 45.9 | Very low | 211 Ų | 211 | 119.6 Ų | 119.6 | 83% | 0.827 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -141.9 | 102.5 | 161.3 | -80.3 | -88.5 | 0 | 0 | 0 | 108.4 | S34 | Y32-S34 PolarHBondContact O-N 3.08Å; Y32-S34 VanDerWaalsContact O-N 3.12Å |
| 33 | P | 40.4 | Very low | 48.5 | Very low | 105 Ų | 105 | 115.7 Ų | 115.7 | 68% | 0.682 | 66% | 0.657 | S | S | * | * | trans | -61.7 | 122 | 170.1 | 25.5 | -28.7 | 0 | 0 | 0 | 107.3 | L35 | P33-L35 VanDerWaalsContact C-N 3.27Å; P33-L35 PolarHBondContact O-N 3.25Å | ||
| 34 | S | 48.5 | Very low | 50.4 | Low | 114 Ų | 114 | 112.1 Ų | 112.1 | 80% | 0.797 | 64% | 0.638 | S | S | * | * | trans | -54.2 | 90.2 | 168 | 50.5 | 0 | 0 | 0 | 0 | 109.4 | Y32 L36 | Y32-S34 PolarHBondContact O-N 3.08Å; Y32-S34 VanDerWaalsContact O-N 3.12Å; S34-L36 PolarHBondContact O-N 3.01Å | ||
| 35 | L | 48.2 | Very low | 52.4 | Low | 156 Ų | 156 | 111.1 Ų | 111.1 | 82% | 0.817 | 63% | 0.628 | S | S | * | * | trans | -78 | -1 | -179.3 | -137 | 85.3 | 0 | 0 | 0 | 112.6 | P33 | P33-L35 VanDerWaalsContact C-N 3.27Å; P33-L35 PolarHBondContact O-N 3.25Å | ||
| 36 | L | 52.4 | Low | 54.5 | Low | 71 Ų | 71 | 110.8 Ų | 110.8 | 37% | 0.372 | 61% | 0.611 | S | S | . | * | S | Bend | trans | -105.5 | 121.8 | -179.3 | -106.1 | 58.7 | 0 | 0 | 0 | 110 | S34 M40 D41 I44 | S34-L36 PolarHBondContact O-N 3.01Å; L36-M40 HydrophobicContact CB-CB 4.25Å; L36-M40 HydrophobicContact CD1-CG 4.09Å; L36-M40 HydrophobicContact CD2-CB 4.3Å; L36-M40 HydrophobicContact CD2-CG 3.93Å; L36-M40 HydrophobicContact CG-CB 3.75Å; L36-M40 HydrophobicContact CG-CG 3.51Å; L36-D41 WeakPolarHBondContact CD2-OD1 3.3Å; L36-I44 HydrophobicContact CD2-CD1 3.32Å; L36-I44 HydrophobicContact CG-CD1 4.47Å |
| 37 | S | 69.4 | Low | 56.6 | Low | 60 Ų | 60 | 111.7 Ų | 111.7 | 42% | 0.42 | 61% | 0.612 | S | S | . | * | trans | -60 | 151 | 167.5 | 72.5 | 0 | 0 | 0 | 0 | 109.3 | V39 M40 D41 | S37-V39 PolarHBondContact O-N 3.15Å; S37-M40 WeakPolarHBondContact O-CA 3.32Å; S37-M40 WeakPolarHBondContact O-CB 3.29Å; S37-M40 PolarHBondContact O-N 3.16Å; S37-M40 PolarHBondContact OG-N 3.48Å; S37-D41 PolarHBondContact O-N 3.11Å; S37-D41 VanDerWaalsContact O-N 3.14Å | ||
| 38 | P | 70 | Confident | 58.5 | Low | 110 Ų | 110 | 109.2 Ų | 109.2 | 71% | 0.714 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -56 | -21.1 | 176 | 18.9 | -31 | 0 | 0 | 0 | 113.2 | K42 | P38-K42 WeakPolarHBondContact O-CB 3.2Å; P38-K42 PolarHBondContact O-N 3.26Å |
| 39 | V | 70.1 | Confident | 60.5 | Low | 103 Ų | 103 | 106.9 Ų | 106.9 | 62% | 0.624 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -71.9 | -40.4 | 172.2 | -177.6 | 0 | 0 | 0 | 0 | 111.6 | S37 K42 T43 | S37-V39 PolarHBondContact O-N 3.15Å; V39-K42 PolarHBondContact O-N 3.36Å; V39-T43 WeakPolarHBondContact O-CB 3.31Å; V39-T43 PolarHBondContact O-N 3.39Å; V39-T43 PolarHBondContact O-OG1 3.33Å |
| 40 | M | 66.6 | Low | 62.8 | Low | 95 Ų | 95 | 106 Ų | 106 | 47% | 0.468 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -68.8 | -41.1 | 178.1 | -164.1 | 72.4 | 71.8 | 0 | 0 | 111.3 | L36 S37 K42 T43 I44 | L36-M40 HydrophobicContact CB-CB 4.25Å; L36-M40 HydrophobicContact CD1-CG 4.09Å; L36-M40 HydrophobicContact CD2-CB 4.3Å; L36-M40 HydrophobicContact CD2-CG 3.93Å; L36-M40 HydrophobicContact CG-CB 3.75Å; L36-M40 HydrophobicContact CG-CG 3.51Å; S37-M40 WeakPolarHBondContact O-CA 3.32Å; S37-M40 WeakPolarHBondContact O-CB 3.29Å; S37-M40 PolarHBondContact O-N 3.16Å; S37-M40 PolarHBondContact OG-N 3.48Å; M40-K42 PolarHBondContact O-N 3.33Å; M40-T43 PolarHBondContact O-N 3.22Å; M40-I44 HydrophobicContact CG-CD1 4.35Å; M40-I44 WeakPolarHBondContact O-CG1 3.43Å; M40-I44 PolarHBondContact O-N 2.83Å |
| 41 | D | 68.6 | Low | 64.7 | Low | 78 Ų | 78 | 101 Ų | 101 | 42% | 0.417 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.5 | -43.1 | 173.6 | -84.7 | -18.9 | 0 | 0 | 0 | 112.3 | L36 S37 T43 I44 N45 | L36-D41 WeakPolarHBondContact CD2-OD1 3.3Å; S37-D41 PolarHBondContact O-N 3.11Å; S37-D41 VanDerWaalsContact O-N 3.14Å; D41-T43 VanDerWaalsContact C-N 3.32Å; D41-T43 PolarHBondContact O-N 2.94Å; D41-I44 PolarHBondContact O-N 3.02Å; D41-N45 WeakPolarHBondContact O-CB 3.43Å; D41-N45 PolarHBondContact O-N 2.61Å; D41-N45 PolarHBondContact O-ND2 3.46Å |
| 42 | K | 74.4 | Confident | 66.4 | Low | 145 Ų | 145 | 95.4 Ų | 95.4 | 63% | 0.63 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.1 | -40.1 | 176 | -168.1 | 173.3 | -176.7 | 177.6 | 0 | 111.6 | P38 V39 M40 N45 I46 | P38-K42 WeakPolarHBondContact O-CB 3.2Å; P38-K42 PolarHBondContact O-N 3.26Å; V39-K42 PolarHBondContact O-N 3.36Å; M40-K42 PolarHBondContact O-N 3.33Å; K42-N45 PolarHBondContact O-N 2.99Å; K42-I46 HydrophobicContact CG-CD1 4.21Å; K42-I46 VanDerWaalsContact O-CG1 3.3Å; K42-I46 WeakPolarHBondContact O-CG1 3.27Å; K42-I46 PolarHBondContact O-N 3.29Å |
| 43 | T | 76.5 | Confident | 68.6 | Low | 65 Ų | 65 | 89.4 Ų | 89.4 | 40% | 0.399 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.1 | -44.9 | 178.5 | -57.3 | 0 | 0 | 0 | 0 | 111.2 | V39 M40 D41 N45 I46 I47 | V39-T43 WeakPolarHBondContact O-CB 3.31Å; V39-T43 PolarHBondContact O-N 3.39Å; V39-T43 PolarHBondContact O-OG1 3.33Å; M40-T43 PolarHBondContact O-N 3.22Å; D41-T43 VanDerWaalsContact C-N 3.32Å; D41-T43 PolarHBondContact O-N 2.94Å; T43-N45 PolarHBondContact O-N 2.8Å; T43-I46 PolarHBondContact O-N 2.68Å; T43-I47 HydrophobicContact CG2-CD1 3.94Å; T43-I47 VanDerWaalsContact O-CG1 3.29Å; T43-I47 WeakPolarHBondContact O-CG1 3.23Å; T43-I47 PolarHBondContact O-N 2.94Å |
| 44 | I | 72.5 | Confident | 70.5 | Confident | 74 Ų | 74 | 87.6 Ų | 87.6 | 38% | 0.379 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.6 | -45.1 | 176.2 | -71.3 | 172.9 | 0 | 0 | 0 | 111 | L36 M40 D41 I46 I47 M48 | L36-I44 HydrophobicContact CD2-CD1 3.32Å; L36-I44 HydrophobicContact CG-CD1 4.47Å; M40-I44 HydrophobicContact CG-CD1 4.35Å; M40-I44 WeakPolarHBondContact O-CG1 3.43Å; M40-I44 PolarHBondContact O-N 2.83Å; D41-I44 PolarHBondContact O-N 3.02Å; I44-I46 VanDerWaalsContact C-N 3.35Å; I44-I46 PolarHBondContact O-N 2.82Å; I44-I47 PolarHBondContact O-N 3.33Å; I44-M48 HydrophobicContact CG2-CG 4.2Å; I44-M48 WeakPolarHBondContact O-CB 3.24Å; I44-M48 WeakPolarHBondContact O-CG 3.42Å; I44-M48 PolarHBondContact O-N 2.86Å |
| 45 | N | 71.5 | Confident | 71.8 | Confident | 98 Ų | 98 | 82.5 Ų | 82.5 | 52% | 0.524 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60.7 | -42.4 | 177.8 | -79.2 | -52.8 | 0 | 0 | 0 | 112.4 | D41 K42 T43 M48 I49 | D41-N45 WeakPolarHBondContact O-CB 3.43Å; D41-N45 PolarHBondContact O-N 2.61Å; D41-N45 PolarHBondContact O-ND2 3.46Å; K42-N45 PolarHBondContact O-N 2.99Å; T43-N45 PolarHBondContact O-N 2.8Å; N45-M48 PolarHBondContact O-N 3.02Å; N45-I49 VanDerWaalsContact O-CG1 3.29Å; N45-I49 WeakPolarHBondContact O-CG1 3.39Å; N45-I49 PolarHBondContact O-N 3.47Å |
| 46 | I | 78.8 | Confident | 73.1 | Confident | 97 Ų | 97 | 75 Ų | 75 | 50% | 0.497 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 176.5 | -68.5 | 166.2 | 0 | 0 | 0 | 111.2 | K42 T43 I44 I49 T50 | K42-I46 HydrophobicContact CG-CD1 4.21Å; K42-I46 VanDerWaalsContact O-CG1 3.3Å; K42-I46 WeakPolarHBondContact O-CG1 3.27Å; K42-I46 PolarHBondContact O-N 3.29Å; T43-I46 PolarHBondContact O-N 2.68Å; I44-I46 VanDerWaalsContact C-N 3.35Å; I44-I46 PolarHBondContact O-N 2.82Å; I46-I49 PolarHBondContact O-N 3.12Å; I46-T50 WeakPolarHBondContact O-CB 3.45Å; I46-T50 PolarHBondContact O-N 2.78Å; I46-T50 PolarHBondContact O-OG1 2.86Å |
| 47 | I | 76.9 | Confident | 74.5 | Confident | 93 Ų | 93 | 73 Ų | 73 | 48% | 0.477 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.3 | -46.3 | 176.9 | -69.5 | 167.4 | 0 | 0 | 0 | 110.2 | T43 I44 I49 T50 V51 | T43-I47 HydrophobicContact CG2-CD1 3.94Å; T43-I47 VanDerWaalsContact O-CG1 3.29Å; T43-I47 WeakPolarHBondContact O-CG1 3.23Å; T43-I47 PolarHBondContact O-N 2.94Å; I44-I47 PolarHBondContact O-N 3.33Å; I47-I49 PolarHBondContact O-N 3.26Å; I47-T50 PolarHBondContact O-N 3.08Å; I47-V51 HydrophobicContact CG2-CG2 4.32Å; I47-V51 WeakPolarHBondContact O-CB 3.37Å; I47-V51 WeakPolarHBondContact O-CG2 3.34Å; I47-V51 PolarHBondContact O-N 3.08Å |
| 48 | M | 71 | Confident | 75.1 | Confident | 86 Ų | 86 | 70.3 Ų | 70.3 | 42% | 0.424 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | -179.7 | -69.3 | -67 | -93.3 | 0 | 0 | 111.9 | I44 N45 T50 V51 L52 P291 | I44-M48 HydrophobicContact CG2-CG 4.2Å; I44-M48 WeakPolarHBondContact O-CB 3.24Å; I44-M48 WeakPolarHBondContact O-CG 3.42Å; I44-M48 PolarHBondContact O-N 2.86Å; N45-M48 PolarHBondContact O-N 3.02Å; M48-T50 VanDerWaalsContact C-N 3.33Å; M48-T50 PolarHBondContact O-N 3.16Å; M48-V51 PolarHBondContact O-N 3.16Å; M48-L52 WeakPolarHBondContact O-CB 3.36Å; M48-L52 PolarHBondContact O-N 2.96Å; M48-P291 HydrophobicContact CE-CG 3.77Å |
| 49 | I | 76.8 | Confident | 75.3 | Confident | 96 Ų | 96 | 65.6 Ų | 65.6 | 49% | 0.492 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64 | -38.9 | 175.9 | -67.3 | 166.3 | 0 | 0 | 0 | 111.2 | N45 I46 I47 L52 L53 | N45-I49 VanDerWaalsContact O-CG1 3.29Å; N45-I49 WeakPolarHBondContact O-CG1 3.39Å; N45-I49 PolarHBondContact O-N 3.47Å; I46-I49 PolarHBondContact O-N 3.12Å; I47-I49 PolarHBondContact O-N 3.26Å; I49-L52 VanDerWaalsContact O-CB 3.31Å; I49-L52 WeakPolarHBondContact O-CB 3.28Å; I49-L52 PolarHBondContact O-N 2.82Å; I49-L53 HydrophobicContact CG2-CD1 4.46Å; I49-L53 WeakPolarHBondContact O-CG 3.28Å; I49-L53 PolarHBondContact O-N 2.89Å |
| 50 | T | 79.8 | Confident | 75.5 | Confident | 69 Ų | 69 | 60.7 Ų | 60.7 | 42% | 0.423 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -68.6 | -45.7 | 179.4 | -55.2 | 0 | 0 | 0 | 0 | 111.4 | I46 I47 M48 L52 L53 I54 | I46-T50 WeakPolarHBondContact O-CB 3.45Å; I46-T50 PolarHBondContact O-N 2.78Å; I46-T50 PolarHBondContact O-OG1 2.86Å; I47-T50 PolarHBondContact O-N 3.08Å; M48-T50 VanDerWaalsContact C-N 3.33Å; M48-T50 PolarHBondContact O-N 3.16Å; T50-L52 VanDerWaalsContact C-N 3.29Å; T50-L52 PolarHBondContact O-N 2.9Å; T50-L53 PolarHBondContact O-N 3.03Å; T50-I54 HydrophobicContact CG2-CD1 4.15Å; T50-I54 WeakPolarHBondContact O-CG1 3.34Å; T50-I54 PolarHBondContact O-N 3Å |
| 51 | V | 75.8 | Confident | 76.1 | Confident | 38 Ų | 38 | 56.3 Ų | 56.3 | 23% | 0.23 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59 | -44.3 | 174.5 | 166.9 | 0 | 0 | 0 | 0 | 110.4 | I47 M48 L53 I54 V55 V209 | I47-V51 HydrophobicContact CG2-CG2 4.32Å; I47-V51 WeakPolarHBondContact O-CB 3.37Å; I47-V51 WeakPolarHBondContact O-CG2 3.34Å; I47-V51 PolarHBondContact O-N 3.08Å; M48-V51 PolarHBondContact O-N 3.16Å; V51-L53 PolarHBondContact O-N 2.95Å; V51-I54 PolarHBondContact O-N 3.34Å; V51-V55 HydrophobicContact CG1-CG2 4.23Å; V51-V55 WeakPolarHBondContact O-CB 3.39Å; V51-V55 VanDerWaalsContact O-CG2 3.24Å; V51-V55 WeakPolarHBondContact O-CG2 3.36Å; V51-V55 PolarHBondContact O-N 3.43Å; V51-V209 HydrophobicContact CB-CG1 4.5Å; V51-V209 HydrophobicContact CG1-CG1 3.76Å; V51-V209 HydrophobicContact CG2-CG1 4.28Å |
| 52 | L | 72.4 | Confident | 76.2 | Confident | 40 Ų | 40 | 55 Ų | 55 | 21% | 0.209 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -52.7 | -53.9 | 173.6 | 158.8 | 60 | 0 | 0 | 0 | 112 | M48 I49 T50 I54 V55 M56 V287 | M48-L52 WeakPolarHBondContact O-CB 3.36Å; M48-L52 PolarHBondContact O-N 2.96Å; I49-L52 VanDerWaalsContact O-CB 3.31Å; I49-L52 WeakPolarHBondContact O-CB 3.28Å; I49-L52 PolarHBondContact O-N 2.82Å; T50-L52 VanDerWaalsContact C-N 3.29Å; T50-L52 PolarHBondContact O-N 2.9Å; L52-I54 PolarHBondContact O-N 2.89Å; L52-V55 PolarHBondContact O-N 3.47Å; L52-M56 HydrophobicContact CD1-CG 3.83Å; L52-M56 WeakPolarHBondContact O-CG 3.49Å; L52-M56 PolarHBondContact O-N 3.17Å; L52-V287 HydrophobicContact CB-CG2 4.45Å; L52-V287 HydrophobicContact CD1-CB 3.68Å; L52-V287 HydrophobicContact CD1-CG1 3.01Å; L52-V287 HydrophobicContact CD1-CG2 3.33Å; L52-V287 HydrophobicContact CD2-CG1 4.4Å; L52-V287 HydrophobicContact CG-CG1 4.29Å; L52-V287 HydrophobicContact CG-CG2 4.49Å |
| 53 | L | 79.5 | Confident | 75.8 | Confident | 85 Ų | 85 | 48.6 Ų | 48.6 | 45% | 0.445 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.4 | -45.4 | -179.3 | -71.7 | 174.4 | 0 | 0 | 0 | 111.8 | I49 T50 V51 V55 M56 V57 P184 | I49-L53 HydrophobicContact CG2-CD1 4.46Å; I49-L53 WeakPolarHBondContact O-CG 3.28Å; I49-L53 PolarHBondContact O-N 2.89Å; T50-L53 PolarHBondContact O-N 3.03Å; V51-L53 PolarHBondContact O-N 2.95Å; L53-V55 PolarHBondContact O-N 3.3Å; L53-M56 PolarHBondContact O-N 3.15Å; L53-V57 VanDerWaalsContact O-CG2 3.29Å; L53-V57 WeakPolarHBondContact O-CG2 3.38Å; L53-V57 PolarHBondContact O-N 3.25Å; L53-P184 HydrophobicContact CD2-CB 3.9Å; L53-P184 HydrophobicContact CD2-CG 4.02Å |
| 54 | I | 80.9 | Confident | 75.4 | Confident | 66 Ų | 66 | 49.8 Ų | 49.8 | 34% | 0.338 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 178.7 | -67.4 | 168.1 | 0 | 0 | 0 | 110.7 | T50 V51 L52 M56 S58 | T50-I54 HydrophobicContact CG2-CD1 4.15Å; T50-I54 WeakPolarHBondContact O-CG1 3.34Å; T50-I54 PolarHBondContact O-N 3Å; V51-I54 PolarHBondContact O-N 3.34Å; L52-I54 PolarHBondContact O-N 2.89Å; I54-M56 VanDerWaalsContact C-N 3.34Å; I54-M56 PolarHBondContact O-N 3.39Å; I54-S58 WeakPolarHBondContact O-CB 3.3Å; I54-S58 PolarHBondContact O-N 3.4Å |
| 55 | V | 75.5 | Confident | 74.9 | Confident | 7 Ų | 7 | 47.9 Ų | 47.9 | 4% | 0.042 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.7 | -39.1 | -179.3 | 170.7 | 0 | 0 | 0 | 0 | 111 | V51 L52 L53 S58 L59 V209 L210 T283 | V51-V55 HydrophobicContact CG1-CG2 4.23Å; V51-V55 WeakPolarHBondContact O-CB 3.39Å; V51-V55 VanDerWaalsContact O-CG2 3.24Å; V51-V55 WeakPolarHBondContact O-CG2 3.36Å; V51-V55 PolarHBondContact O-N 3.43Å; L52-V55 PolarHBondContact O-N 3.47Å; L53-V55 PolarHBondContact O-N 3.3Å; V55-S58 WeakPolarHBondContact O-CB 3.41Å; V55-S58 PolarHBondContact O-N 3.31Å; V55-L59 WeakPolarHBondContact O-CB 3.24Å; V55-L59 PolarHBondContact O-N 2.98Å; V55-V209 HydrophobicContact CG2-CG1 4.23Å; V55-L210 HydrophobicContact CG1-CD1 4.37Å; V55-L210 HydrophobicContact CG2-CB 4.46Å; V55-T283 HydrophobicContact CG1-CG2 3.34Å |
| 56 | M | 75.8 | Confident | 74.4 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -73.3 | -39.2 | 179.4 | -71.3 | -57.2 | 171.3 | 0 | 0 | 113.4 | L52 L53 I54 S58 L59 G60 I181 P184 C185 T283 V284 V287 | L52-M56 HydrophobicContact CD1-CG 3.83Å; L52-M56 WeakPolarHBondContact O-CG 3.49Å; L52-M56 PolarHBondContact O-N 3.17Å; L53-M56 PolarHBondContact O-N 3.15Å; I54-M56 VanDerWaalsContact C-N 3.34Å; I54-M56 PolarHBondContact O-N 3.39Å; M56-S58 VanDerWaalsContact C-N 3.33Å; M56-L59 WeakPolarHBondContact O-CB 3.36Å; M56-L59 PolarHBondContact O-N 2.97Å; M56-L59 HydrophobicContact SD-CD2 3.8Å; M56-G60 PolarHBondContact O-N 3.19Å; M56-I181 HydrophobicContact CE-CB 4.46Å; M56-I181 HydrophobicContact CE-CD1 4.48Å; M56-I181 HydrophobicContact CE-CG1 4.1Å; M56-I181 HydrophobicContact CE-CG2 3.69Å; M56-I181 HydrophobicContact CG-CG2 4.41Å; M56-I181 HydrophobicContact SD-CG2 3.65Å; M56-P184 HydrophobicContact CB-CB 3.82Å; M56-P184 HydrophobicContact CB-CG 3.65Å; M56-P184 HydrophobicContact CG-CG 4.31Å; M56-C185 WeakPolarHBondContact O-CA 3.45Å; M56-T283 HydrophobicContact CE-CG2 3.44Å; M56-T283 VanDerWaalsContact CE-CG2 3.44Å; M56-T283 HydrophobicContact SD-CG2 3.89Å; M56-V284 HydrophobicContact CE-CG2 4.35Å; M56-V287 HydrophobicContact CE-CB 3.64Å; M56-V287 HydrophobicContact CE-CG1 3.52Å; M56-V287 HydrophobicContact CE-CG2 3.71Å |
| 57 | V | 81.9 | Confident | 73.7 | Confident | 29 Ų | 29 | 46.5 Ų | 46.5 | 18% | 0.176 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.3 | -42.2 | 171.3 | 177.6 | 0 | 0 | 0 | 0 | 110.3 | L53 L59 G60 C61 P184 G188 I191 I202 | L53-V57 VanDerWaalsContact O-CG2 3.29Å; L53-V57 WeakPolarHBondContact O-CG2 3.38Å; L53-V57 PolarHBondContact O-N 3.25Å; V57-L59 VanDerWaalsContact C-N 3.32Å; V57-L59 PolarHBondContact O-N 2.99Å; V57-G60 PolarHBondContact O-N 3.34Å; V57-C61 WeakPolarHBondContact O-CB 3.36Å; V57-C61 PolarHBondContact O-N 3.41Å; V57-C61 PolarHBondContact O-SG 3.5Å; V57-P184 WeakPolarHBondContact CA-O 3.34Å; V57-P184 HydrophobicContact CG2-CB 3.98Å; V57-P184 WeakPolarHBondContact CG2-O 3.19Å; V57-G188 WeakPolarHBondContact O-CA 3.35Å; V57-I191 HydrophobicContact CG1-CD1 3.88Å; V57-I202 HydrophobicContact CG1-CG2 4.05Å |
| 58 | S | 80.9 | Confident | 72.9 | Confident | 3 Ų | 3 | 42.9 Ų | 42.9 | 2% | 0.021 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.1 | -42.1 | 174.6 | 171.7 | 0 | 0 | 0 | 0 | 112.4 | I54 V55 M56 C61 T62 I202 T203 G206 | I54-S58 WeakPolarHBondContact O-CB 3.3Å; I54-S58 PolarHBondContact O-N 3.4Å; V55-S58 WeakPolarHBondContact O-CB 3.41Å; V55-S58 PolarHBondContact O-N 3.31Å; M56-S58 VanDerWaalsContact C-N 3.33Å; S58-C61 WeakPolarHBondContact O-CB 3.21Å; S58-C61 PolarHBondContact O-N 3.1Å; S58-T62 WeakPolarHBondContact O-CG2 3.49Å; S58-T62 PolarHBondContact O-N 2.9Å; S58-I202 PolarHBondContact OG-O 3.18Å; S58-T203 WeakPolarHBondContact OG-CA 3.4Å; S58-T203 PolarHBondContact OG-O 2.82Å; S58-G206 WeakPolarHBondContact OG-CA 3.14Å |
| 59 | L | 75.1 | Confident | 72.5 | Confident | 11 Ų | 11 | 47 Ų | 47 | 6% | 0.058 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.9 | -49.2 | 176.3 | 175.2 | 74 | 0 | 0 | 0 | 110.9 | V55 M56 V57 C61 T62 L280 T283 | V55-L59 WeakPolarHBondContact O-CB 3.24Å; V55-L59 PolarHBondContact O-N 2.98Å; M56-L59 WeakPolarHBondContact O-CB 3.36Å; M56-L59 PolarHBondContact O-N 2.97Å; M56-L59 HydrophobicContact SD-CD2 3.8Å; V57-L59 VanDerWaalsContact C-N 3.32Å; V57-L59 PolarHBondContact O-N 2.99Å; L59-C61 PolarHBondContact O-N 3.2Å; L59-T62 WeakPolarHBondContact O-CB 3.37Å; L59-T62 PolarHBondContact O-N 3.43Å; L59-T62 PolarHBondContact O-OG1 3.37Å; L59-L280 HydrophobicContact CD1-CB 4.11Å; L59-L280 HydrophobicContact CD1-CD1 3.41Å; L59-L280 VanDerWaalsContact CD1-CD1 3.41Å; L59-L280 HydrophobicContact CD1-CG 4.35Å; L59-L280 HydrophobicContact CD2-CD1 3.11Å; L59-L280 HydrophobicContact CG-CD1 3.73Å; L59-T283 HydrophobicContact CD2-CG2 4.25Å |
| 60 | G | 75.3 | Confident | 71.5 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.1 | -35.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | M56 V57 T62 M63 C185 I189 | M56-G60 PolarHBondContact O-N 3.19Å; V57-G60 PolarHBondContact O-N 3.34Å; G60-T62 PolarHBondContact O-N 3.18Å; G60-M63 WeakPolarHBondContact O-CB 3.36Å; G60-M63 WeakPolarHBondContact O-CG 3.31Å; G60-M63 PolarHBondContact O-N 3.26Å; G60-M63 VanDerWaalsContact O-N 3.16Å; G60-C185 WeakPolarHBondContact CA-O 3.39Å; G60-I189 WeakPolarHBondContact O-CA 3.44Å; G60-I189 WeakPolarHBondContact O-CG1 3.47Å; G60-I189 PolarHBondContact O-N 3.44Å |
| 61 | C | 77.6 | Confident | 70.4 | Confident | 2 Ų | 2 | 47.7 Ų | 47.7 | 1% | 0.014 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.2 | -26.7 | 176.2 | -74.1 | 0 | 0 | 0 | 0 | 113.2 | V57 S58 L59 M63 G188 N192 S199 T203 | V57-C61 WeakPolarHBondContact O-CB 3.36Å; V57-C61 PolarHBondContact O-N 3.41Å; V57-C61 PolarHBondContact O-SG 3.5Å; S58-C61 WeakPolarHBondContact O-CB 3.21Å; S58-C61 PolarHBondContact O-N 3.1Å; L59-C61 PolarHBondContact O-N 3.2Å; C61-M63 PolarHBondContact O-N 2.72Å; C61-G188 PolarHBondContact SG-O 3.28Å; C61-N192 PolarHBondContact O-ND2 3.3Å; C61-N192 PolarHBondContact O-OD1 3.27Å; C61-S199 VanDerWaalsContact CB-OG 3.31Å; C61-S199 WeakPolarHBondContact CB-OG 3.41Å; C61-S199 PolarHBondContact O-OG 3.26Å; C61-T203 WeakPolarHBondContact CB-OG1 3.3Å |
| 62 | T | 70.8 | Confident | 69.6 | Low | 51 Ų | 51 | 51 Ų | 51 | 31% | 0.313 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.3 | -9.8 | 177.8 | 70.3 | 0 | 0 | 0 | 0 | 114.2 | S58 L59 G60 E64 T203 | S58-T62 WeakPolarHBondContact O-CG2 3.49Å; S58-T62 PolarHBondContact O-N 2.9Å; L59-T62 WeakPolarHBondContact O-CB 3.37Å; L59-T62 PolarHBondContact O-N 3.43Å; L59-T62 PolarHBondContact O-OG1 3.37Å; G60-T62 PolarHBondContact O-N 3.18Å; T62-E64 PolarHBondContact O-N 2.98Å; T62-T203 HydrophobicContact CG2-CG2 3.55Å |
| 63 | M | 67.7 | Low | 68.7 | Low | 10 Ų | 10 | 56 Ų | 56 | 5% | 0.049 | 29% | 0.287 | C | S | . | . | trans | -87.3 | 109.8 | -170 | -54.2 | 178.6 | 85 | 0 | 0 | 111.6 | G60 C61 V65 T144 L145 L148 I189 N192 | G60-M63 WeakPolarHBondContact O-CB 3.36Å; G60-M63 WeakPolarHBondContact O-CG 3.31Å; G60-M63 PolarHBondContact O-N 3.26Å; G60-M63 VanDerWaalsContact O-N 3.16Å; C61-M63 PolarHBondContact O-N 2.72Å; M63-V65 PolarHBondContact O-N 3.38Å; M63-T144 HydrophobicContact CB-CG2 4.2Å; M63-T144 HydrophobicContact CE-CG2 3.28Å; M63-T144 WeakPolarHBondContact CE-O 3.34Å; M63-T144 HydrophobicContact CG-CG2 3.64Å; M63-T144 HydrophobicContact SD-CG2 4.19Å; M63-L145 HydrophobicContact CE-CD2 4.22Å; M63-L148 HydrophobicContact CE-CD1 4.27Å; M63-L148 HydrophobicContact CE-CD2 4.07Å; M63-L148 HydrophobicContact CE-CG 3.98Å; M63-L148 HydrophobicContact SD-CD2 4.25Å; M63-I189 HydrophobicContact CB-CG1 4.15Å; M63-I189 HydrophobicContact CE-CD1 4Å; M63-I189 HydrophobicContact CG-CG1 4.19Å; M63-I189 HydrophobicContact SD-CD1 3.25Å; M63-I189 WeakPolarHBondContact SD-CD1 3.44Å; M63-I189 HydrophobicContact SD-CG1 3.34Å; M63-I189 WeakPolarHBondContact SD-CG1 3.28Å; M63-N192 PolarHBondContact O-ND2 3.32Å | ||
| 64 | E | 67.2 | Low | 68 | Low | 91 Ų | 91 | 58.2 Ų | 58.2 | 43% | 0.425 | 29% | 0.293 | S | S | . | . | trans | -80.5 | 81.1 | -177.4 | -67.4 | -176.8 | 141.4 | 0 | 0 | 113 | T62 T66 K67 | T62-E64 PolarHBondContact O-N 2.98Å; E64-T66 VanDerWaalsContact C-N 3.28Å; E64-T66 PolarHBondContact O-N 3.18Å; E64-K67 HydrophobicContact CB-CD 4.42Å; E64-K67 HydrophobicContact CB-CG 4.43Å; E64-K67 VanDerWaalsContact CD-NZ 3.27Å; E64-K67 IonicContact OE1-NZ 3.15Å; E64-K67 PolarHBondContact OE1-NZ 2.9Å; E64-K67 VanDerWaalsContact OE1-NZ 3.15Å; E64-K67 VanDerWaalsContact OE2-CD 3.26Å; E64-K67 WeakPolarHBondContact OE2-CD 3.35Å; E64-K67 WeakPolarHBondContact OE2-CE 3.5Å; E64-K67 IonicContact OE2-NZ 2.66Å; E64-K67 PolarHBondContact OE2-NZ 3.2Å | ||
| 65 | V | 62.2 | Low | 67.6 | Low | 34 Ų | 34 | 59.4 Ų | 59.4 | 21% | 0.206 | 31% | 0.305 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -31.1 | -179.6 | -170.2 | 0 | 0 | 0 | 0 | 113 | M63 K67 I68 L145 I189 Y193 | M63-V65 PolarHBondContact O-N 3.38Å; V65-K67 VanDerWaalsContact C-N 3.33Å; V65-K67 PolarHBondContact O-N 2.88Å; V65-I68 WeakPolarHBondContact O-CB 3.43Å; V65-I68 PolarHBondContact O-N 3.45Å; V65-L145 HydrophobicContact CG2-CD2 4.18Å; V65-I189 HydrophobicContact CG2-CG2 3.44Å; V65-I189 VanDerWaalsContact CG2-CG2 3.44Å; V65-Y193 HydrophobicContact CB-CD2 4.2Å; V65-Y193 HydrophobicContact CG1-CD2 4.15Å |
| 66 | T | 61.3 | Low | 67.5 | Low | 91 Ų | 91 | 67.3 Ų | 67.3 | 56% | 0.558 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -66.5 | -31.5 | -174.6 | 49.3 | 0 | 0 | 0 | 0 | 113.2 | E64 I68 | E64-T66 VanDerWaalsContact C-N 3.28Å; E64-T66 PolarHBondContact O-N 3.18Å; T66-I68 PolarHBondContact O-N 3.05Å |
| 67 | K | 63 | Low | 67.2 | Low | 75 Ų | 75 | 67.6 Ų | 67.6 | 33% | 0.326 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -71.9 | -13.2 | -179.5 | -65.5 | -169.7 | -177.9 | 165.2 | 0 | 113.9 | E64 V65 H71 I137 | E64-K67 HydrophobicContact CB-CD 4.42Å; E64-K67 HydrophobicContact CB-CG 4.43Å; E64-K67 VanDerWaalsContact CD-NZ 3.27Å; E64-K67 IonicContact OE1-NZ 3.15Å; E64-K67 PolarHBondContact OE1-NZ 2.9Å; E64-K67 VanDerWaalsContact OE1-NZ 3.15Å; E64-K67 VanDerWaalsContact OE2-CD 3.26Å; E64-K67 WeakPolarHBondContact OE2-CD 3.35Å; E64-K67 WeakPolarHBondContact OE2-CE 3.5Å; E64-K67 IonicContact OE2-NZ 2.66Å; E64-K67 PolarHBondContact OE2-NZ 3.2Å; V65-K67 VanDerWaalsContact C-N 3.33Å; V65-K67 PolarHBondContact O-N 2.88Å; K67-H71 PolarHBondContact O-ND1 2.67Å; K67-I137 HydrophobicContact CB-CG2 4.48Å; K67-I137 HydrophobicContact CD-CG2 3.76Å |
| 68 | I | 61.1 | Low | 66.8 | Low | 16 Ų | 16 | 67.5 Ų | 67.5 | 8% | 0.082 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -79.3 | -37.6 | -174.7 | -59.9 | 174.5 | 0 | 0 | 0 | 111.3 | V65 T66 D70 H71 I72 L145 | V65-I68 WeakPolarHBondContact O-CB 3.43Å; V65-I68 PolarHBondContact O-N 3.45Å; T66-I68 PolarHBondContact O-N 3.05Å; I68-D70 VanDerWaalsContact C-N 3.29Å; I68-D70 PolarHBondContact O-N 2.98Å; I68-H71 PolarHBondContact O-N 2.82Å; I68-I72 HydrophobicContact CG2-CD1 3.66Å; I68-I72 HydrophobicContact CG2-CG1 3.96Å; I68-I72 WeakPolarHBondContact O-CG1 3.45Å; I68-I72 PolarHBondContact O-N 3.2Å; I68-L145 HydrophobicContact CD1-CB 4.47Å; I68-L145 HydrophobicContact CD1-CD1 3.12Å; I68-L145 HydrophobicContact CD1-CD2 4.49Å; I68-L145 HydrophobicContact CD1-CG 3.46Å; I68-L145 VanDerWaalsContact CD1-CG 3.46Å |
| 69 | K | 61.5 | Low | 66.9 | Low | 174 Ų | 174 | 70.1 Ų | 70.1 | 76% | 0.757 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -61.5 | -39.1 | -177 | -168.8 | 179.5 | 178.7 | -175.2 | 0 | 112.1 | H71 | K69-H71 VanDerWaalsContact C-N 3.29Å; K69-H71 PolarHBondContact O-N 2.93Å |
| 70 | D | 57 | Low | 67.2 | Low | 117 Ų | 117 | 69.9 Ų | 69.9 | 63% | 0.626 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -15.7 | -176.3 | -61.5 | -23.2 | 0 | 0 | 0 | 113 | I68 | I68-D70 VanDerWaalsContact C-N 3.29Å; I68-D70 PolarHBondContact O-N 2.98Å |
| 71 | H | 55.5 | Low | 67.2 | Low | 61 Ų | 61 | 70 Ų | 70 | 28% | 0.282 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -122.5 | -6.9 | -169 | -68.7 | 90.2 | 0 | 0 | 0 | 115.8 | K67 I68 K69 L73 K74 V138 | K67-H71 PolarHBondContact O-ND1 2.67Å; I68-H71 PolarHBondContact O-N 2.82Å; K69-H71 VanDerWaalsContact C-N 3.29Å; K69-H71 PolarHBondContact O-N 2.93Å; H71-L73 PolarHBondContact O-N 3.31Å; H71-K74 PolarHBondContact O-N 3.43Å; H71-V138 HydrophobicContact CB-CB 4.19Å; H71-V138 HydrophobicContact CB-CG1 3.98Å; H71-V138 HydrophobicContact CB-CG2 3.12Å; H71-V138 WeakPolarHBondContact CD2-CG2 3.39Å |
| 72 | I | 58.8 | Low | 67.5 | Low | 107 Ų | 107 | 72.4 Ų | 72.4 | 55% | 0.549 | 38% | 0.375 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.9 | -15.7 | 167.7 | -92.5 | 173.3 | 0 | 0 | 0 | 112.6 | I68 K74 | I68-I72 HydrophobicContact CG2-CD1 3.66Å; I68-I72 HydrophobicContact CG2-CG1 3.96Å; I68-I72 WeakPolarHBondContact O-CG1 3.45Å; I68-I72 PolarHBondContact O-N 3.2Å; I72-K74 PolarHBondContact O-N 3Å |
| 73 | L | 54.8 | Low | 68.4 | Low | 147 Ų | 147 | 73.8 Ų | 73.8 | 77% | 0.77 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -8.6 | 177.7 | -64.3 | 168.9 | 0 | 0 | 0 | 115 | H71 P75 | H71-L73 PolarHBondContact O-N 3.31Å; L73-P75 VanDerWaalsContact C-CD 3.5Å; L73-P75 VanDerWaalsContact O-CD 3.27Å; L73-P75 WeakPolarHBondContact O-CD 3.31Å |
| 74 | K | 64.8 | Low | 69.2 | Low | 130 Ų | 130 | 73.3 Ų | 73.3 | 57% | 0.565 | 38% | 0.378 | S | S | * | . | trans | -114.3 | 74.3 | 174.9 | -68.2 | -170.2 | 179.9 | -176.1 | 0 | 112.6 | H71 I72 K76 G77 | H71-K74 PolarHBondContact O-N 3.43Å; I72-K74 PolarHBondContact O-N 3Å; K74-K76 VanDerWaalsContact C-N 3.28Å; K74-K76 PolarHBondContact O-N 3.49Å; K74-K76 VanDerWaalsContact O-N 3.15Å; K74-G77 PolarHBondContact O-N 3.1Å | ||
| 75 | P | 71.4 | Confident | 70.3 | Confident | 91 Ų | 91 | 69.1 Ų | 69.1 | 59% | 0.591 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -62.8 | -28 | -169.6 | 23.9 | -34.9 | 0 | 0 | 0 | 114.5 | L73 V78 A79 | L73-P75 VanDerWaalsContact C-CD 3.5Å; L73-P75 VanDerWaalsContact O-CD 3.27Å; L73-P75 WeakPolarHBondContact O-CD 3.31Å; P75-V78 PolarHBondContact O-N 2.93Å; P75-A79 PolarHBondContact O-N 3.32Å |
| 76 | K | 73.2 | Confident | 71.6 | Confident | 174 Ų | 174 | 67.9 Ų | 67.9 | 76% | 0.757 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -65.2 | -42.2 | -179.3 | -66.6 | -175.5 | 178.8 | -179.6 | 0 | 112.6 | K74 I80 | K74-K76 VanDerWaalsContact C-N 3.28Å; K74-K76 PolarHBondContact O-N 3.49Å; K74-K76 VanDerWaalsContact O-N 3.15Å; K76-I80 WeakPolarHBondContact O-CD1 3.36Å; K76-I80 VanDerWaalsContact O-CG1 3.23Å; K76-I80 WeakPolarHBondContact O-CG1 3.46Å; K76-I80 PolarHBondContact O-N 3.49Å |
| 77 | G | 70.7 | Confident | 72.9 | Confident | 6 Ų | 6 | 64.8 Ų | 64.8 | 6% | 0.062 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67.6 | -39.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K74 I80 A81 | K74-G77 PolarHBondContact O-N 3.1Å; G77-I80 PolarHBondContact O-N 3.29Å; G77-A81 WeakPolarHBondContact O-CB 3.43Å; G77-A81 PolarHBondContact O-N 3.4Å |
| 78 | V | 73.6 | Confident | 74.3 | Confident | 26 Ų | 26 | 62.2 Ų | 62.2 | 16% | 0.158 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -64 | -46.5 | 177.3 | 179.3 | 0 | 0 | 0 | 0 | 111.4 | P75 I80 A81 I82 V138 C142 | P75-V78 PolarHBondContact O-N 2.93Å; V78-I80 VanDerWaalsContact C-N 3.28Å; V78-I80 PolarHBondContact O-N 3.29Å; V78-A81 WeakPolarHBondContact O-CB 3.41Å; V78-A81 PolarHBondContact O-N 3.23Å; V78-I82 HydrophobicContact CG1-CD1 3.93Å; V78-I82 HydrophobicContact CG1-CG1 4.47Å; V78-I82 VanDerWaalsContact O-CG1 3.3Å; V78-I82 WeakPolarHBondContact O-CG1 3.29Å; V78-I82 PolarHBondContact O-N 3.37Å; V78-V138 HydrophobicContact CG2-CG1 3.95Å; V78-C142 HydrophobicContact CG1-CB 4.3Å |
| 79 | A | 82.6 | Confident | 75.8 | Confident | 59 Ų | 59 | 61.5 Ų | 61.5 | 49% | 0.488 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.6 | -40.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | P75 I82 L83 | P75-A79 PolarHBondContact O-N 3.32Å; A79-I82 PolarHBondContact O-N 2.95Å; A79-L83 WeakPolarHBondContact O-CB 3.47Å; A79-L83 PolarHBondContact O-N 3.33Å |
| 80 | I | 81.9 | Confident | 77.3 | Confident | 5 Ų | 5 | 53.2 Ų | 53.2 | 3% | 0.026 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -68.9 | -39 | 178.7 | -64.7 | 168 | 0 | 0 | 0 | 110.8 | K76 G77 V78 I82 L83 S84 I255 F259 L261 V269 | K76-I80 WeakPolarHBondContact O-CD1 3.36Å; K76-I80 VanDerWaalsContact O-CG1 3.23Å; K76-I80 WeakPolarHBondContact O-CG1 3.46Å; K76-I80 PolarHBondContact O-N 3.49Å; G77-I80 PolarHBondContact O-N 3.29Å; V78-I80 VanDerWaalsContact C-N 3.28Å; V78-I80 PolarHBondContact O-N 3.29Å; I80-I82 VanDerWaalsContact C-N 3.35Å; I80-L83 PolarHBondContact O-N 3.46Å; I80-S84 WeakPolarHBondContact O-CB 3.43Å; I80-S84 PolarHBondContact O-N 2.93Å; I80-S84 PolarHBondContact O-OG 3.47Å; I80-I255 HydrophobicContact CG2-CG2 4.16Å; I80-F259 HydrophobicContact CD1-CB 3.41Å; I80-F259 VanDerWaalsContact CD1-CB 3.41Å; I80-F259 HydrophobicContact CD1-CD1 4.15Å; I80-F259 HydrophobicContact CD1-CD2 3.94Å; I80-F259 HydrophobicContact CD1-CG 3.58Å; I80-F259 HydrophobicContact CG1-CB 4.23Å; I80-F259 HydrophobicContact CG1-CD1 4.27Å; I80-F259 HydrophobicContact CG1-CD2 3.8Å; I80-F259 HydrophobicContact CG1-CE2 4.24Å; I80-F259 HydrophobicContact CG1-CG 3.84Å; I80-L261 HydrophobicContact CD1-CD1 3.22Å; I80-L261 HydrophobicContact CD1-CD2 4.41Å; I80-L261 HydrophobicContact CD1-CG 4.23Å; I80-V269 HydrophobicContact CG2-CG1 3.87Å; I80-V269 HydrophobicContact CG2-CG2 4.33Å |
| 81 | A | 74.4 | Confident | 79.1 | Confident | 2 Ų | 2 | 51.7 Ų | 51.7 | 2% | 0.017 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G77 V78 L83 S84 Q85 M139 | G77-A81 WeakPolarHBondContact O-CB 3.43Å; G77-A81 PolarHBondContact O-N 3.4Å; V78-A81 WeakPolarHBondContact O-CB 3.41Å; V78-A81 PolarHBondContact O-N 3.23Å; A81-L83 VanDerWaalsContact C-N 3.35Å; A81-S84 PolarHBondContact O-OG 3.35Å; A81-Q85 WeakPolarHBondContact O-CB 3.48Å; A81-Q85 PolarHBondContact O-N 3.44Å; A81-M139 VanDerWaalsContact CA-CE 3.47Å; A81-M139 HydrophobicContact CB-CB 3.79Å; A81-M139 HydrophobicContact CB-CE 3.37Å; A81-M139 HydrophobicContact CB-CG 3.63Å; A81-M139 HydrophobicContact CB-SD 4.29Å |
| 82 | I | 83.9 | Confident | 80.9 | Confident | 53 Ų | 53 | 49.6 Ų | 49.6 | 27% | 0.272 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.4 | -45.4 | 178.5 | -64.6 | 170.9 | 0 | 0 | 0 | 109.8 | V78 A79 I80 Y86 L146 | V78-I82 HydrophobicContact CG1-CD1 3.93Å; V78-I82 HydrophobicContact CG1-CG1 4.47Å; V78-I82 VanDerWaalsContact O-CG1 3.3Å; V78-I82 WeakPolarHBondContact O-CG1 3.29Å; V78-I82 PolarHBondContact O-N 3.37Å; A79-I82 PolarHBondContact O-N 2.95Å; I80-I82 VanDerWaalsContact C-N 3.35Å; I82-Y86 HydrophobicContact CG2-CD2 4.45Å; I82-Y86 WeakPolarHBondContact O-CB 3.45Å; I82-Y86 PolarHBondContact O-N 3.35Å; I82-L146 HydrophobicContact CD1-CD2 3.68Å; I82-L146 HydrophobicContact CG1-CD2 3.84Å; I82-L146 HydrophobicContact CG2-CD2 4.2Å |
| 83 | L | 89.1 | Confident | 82.6 | Confident | 81 Ų | 81 | 44.5 Ų | 44.5 | 42% | 0.424 | 24% | 0.243 | S | C | . | . | I | π-helix | trans | -65.6 | -41.9 | -179.7 | -176.7 | 58.2 | 0 | 0 | 0 | 112.4 | A79 I80 A81 G87 I88 I255 F259 | A79-L83 WeakPolarHBondContact O-CB 3.47Å; A79-L83 PolarHBondContact O-N 3.33Å; I80-L83 PolarHBondContact O-N 3.46Å; A81-L83 VanDerWaalsContact C-N 3.35Å; L83-G87 WeakPolarHBondContact O-CA 3.29Å; L83-G87 PolarHBondContact O-N 2.97Å; L83-I88 PolarHBondContact O-N 3.25Å; L83-I255 HydrophobicContact CD2-CD1 3.53Å; L83-I255 HydrophobicContact CD2-CG1 4.48Å; L83-I255 HydrophobicContact CG-CD1 3.73Å; L83-F259 HydrophobicContact CD2-CE2 4.02Å; L83-F259 HydrophobicContact CD2-CZ 4.18Å |
| 84 | S | 85.8 | Confident | 84.4 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 22% | 0.216 | C | C | . | . | I | π-helix | trans | -72.4 | -43.9 | 178.7 | 72.9 | 0 | 0 | 0 | 0 | 111.7 | I80 A81 I88 M89 T273 | I80-S84 WeakPolarHBondContact O-CB 3.43Å; I80-S84 PolarHBondContact O-N 2.93Å; I80-S84 PolarHBondContact O-OG 3.47Å; A81-S84 PolarHBondContact O-OG 3.35Å; S84-I88 WeakPolarHBondContact O-CB 3.11Å; S84-I88 PolarHBondContact O-N 2.85Å; S84-M89 PolarHBondContact O-N 2.87Å; S84-T273 VanDerWaalsContact CB-OG1 3.24Å; S84-T273 WeakPolarHBondContact CB-OG1 3.36Å; S84-T273 PolarHBondContact OG-OG1 3.25Å |
| 85 | Q | 88.9 | Confident | 85.8 | Confident | 2 Ų | 2 | 36.9 Ų | 36.9 | 1% | 0.009 | 21% | 0.212 | C | C | . | . | I | π-helix | trans | -76.3 | -40.3 | -175.2 | -159.6 | 67.4 | 29.3 | 0 | 0 | 113.4 | A81 P90 C116 E272 Q276 | A81-Q85 WeakPolarHBondContact O-CB 3.48Å; A81-Q85 PolarHBondContact O-N 3.44Å; Q85-P90 VanDerWaalsContact O-CD 3.24Å; Q85-P90 WeakPolarHBondContact O-CD 3.21Å; Q85-C116 PolarHBondContact NE2-O 2.84Å; Q85-E272 PolarHBondContact OE1-O 3.45Å; Q85-Q276 VanDerWaalsContact NE2-CD 3.28Å |
| 86 | Y | 89.7 | Confident | 86.9 | Confident | 8 Ų | 8 | 33.5 Ų | 33.5 | 3% | 0.031 | 19% | 0.189 | C | C | . | . | I | π-helix | trans | -109.3 | -10.5 | -174.9 | -67.3 | -58.4 | 0 | 0 | 0 | 114.2 | I82 P90 S143 L146 A147 M150 L154 | I82-Y86 HydrophobicContact CG2-CD2 4.45Å; I82-Y86 WeakPolarHBondContact O-CB 3.45Å; I82-Y86 PolarHBondContact O-N 3.35Å; Y86-P90 WeakPolarHBondContact O-CG 3.23Å; Y86-S143 PolarHBondContact OH-O 3.07Å; Y86-L146 HydrophobicContact CD2-CB 4.48Å; Y86-L146 HydrophobicContact CE2-CB 3.77Å; Y86-A147 WeakPolarHBondContact OH-CA 3.34Å; Y86-A147 WeakPolarHBondContact OH-CB 3.44Å; Y86-A147 PolarHBondContact OH-N 2.6Å; Y86-A147 VanDerWaalsContact OH-N 3.12Å; Y86-M150 HydrophobicContact CD1-CB 3.64Å; Y86-M150 HydrophobicContact CD1-CG 4.42Å; Y86-M150 HydrophobicContact CD2-CB 4.14Å; Y86-M150 HydrophobicContact CD2-CG 4.08Å; Y86-M150 HydrophobicContact CE1-CB 3.74Å; Y86-M150 HydrophobicContact CE2-CB 4.22Å; Y86-M150 HydrophobicContact CE2-CG 4.32Å; Y86-M150 HydrophobicContact CG-CB 3.86Å; Y86-M150 HydrophobicContact CG-CE 4.13Å; Y86-M150 HydrophobicContact CG-CG 4.15Å; Y86-L154 HydrophobicContact CD1-CD1 3.54Å; Y86-L154 HydrophobicContact CG-CD1 4.15Å |
| 87 | G | 89.8 | Confident | 87.8 | Confident | 26 Ų | 26 | 25.2 Ų | 25.2 | 27% | 0.268 | 15% | 0.153 | S | C | . | . | I | π-helix | trans | -93.8 | -64.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | L83 L91 | L83-G87 WeakPolarHBondContact O-CA 3.29Å; L83-G87 PolarHBondContact O-N 2.97Å; G87-L91 WeakPolarHBondContact O-CB 3.08Å; G87-L91 PolarHBondContact O-N 3.14Å |
| 88 | I | 91.2 | Very high | 88.7 | Confident | 22 Ų | 22 | 29.1 Ų | 29.1 | 11% | 0.113 | 17% | 0.168 | C | C | . | . | I | π-helix | trans | -71.1 | -51 | -167.7 | -57.9 | 171.6 | 0 | 0 | 0 | 112.3 | L83 S84 L91 T92 F251 I255 | L83-I88 PolarHBondContact O-N 3.25Å; S84-I88 WeakPolarHBondContact O-CB 3.11Å; S84-I88 PolarHBondContact O-N 2.85Å; I88-L91 PolarHBondContact O-N 3.43Å; I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.37Å; I88-T92 PolarHBondContact O-N 3.2Å; I88-T92 PolarHBondContact O-OG1 2.89Å; I88-F251 HydrophobicContact CD1-CB 3.94Å; I88-F251 HydrophobicContact CG2-CB 3.7Å; I88-F251 HydrophobicContact CG2-CD1 4.41Å; I88-F251 HydrophobicContact CG2-CG 4.03Å; I88-I255 HydrophobicContact CD1-CB 4.38Å; I88-I255 HydrophobicContact CD1-CD1 3.75Å; I88-I255 HydrophobicContact CD1-CG2 4.29Å |
| 89 | M | 93.6 | Very high | 89.5 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -65.3 | -45.1 | -173.5 | -68.2 | -66.2 | -81.9 | 0 | 0 | 113.5 | S84 L91 T92 A93 G114 L244 G248 T273 Q276 | S84-M89 PolarHBondContact O-N 2.87Å; M89-L91 PolarHBondContact O-N 3.48Å; M89-T92 PolarHBondContact O-N 3.21Å; M89-A93 PolarHBondContact O-N 3.33Å; M89-G114 CarbonylContact C-O 3.55Å; M89-G114 VanDerWaalsContact CB-O 3.25Å; M89-G114 WeakPolarHBondContact CB-O 3.32Å; M89-L244 HydrophobicContact CE-CG 4.22Å; M89-G248 WeakPolarHBondContact SD-CA 3.43Å; M89-T273 WeakPolarHBondContact CE-O 3.16Å; M89-T273 HydrophobicContact CG-CG2 3.87Å; M89-T273 WeakPolarHBondContact CG-O 3.48Å; M89-T273 HydrophobicContact SD-CG2 4.24Å; M89-Q276 HydrophobicContact CE-CG 3.69Å |
| 90 | P | 92.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.1 | -42.3 | 174.5 | -25.7 | 35.9 | 0 | 0 | 0 | 112.7 | Q85 Y86 T92 A93 F94 G114 L154 Y158 | Q85-P90 VanDerWaalsContact O-CD 3.24Å; Q85-P90 WeakPolarHBondContact O-CD 3.21Å; Y86-P90 WeakPolarHBondContact O-CG 3.23Å; P90-T92 VanDerWaalsContact C-N 3.32Å; P90-T92 PolarHBondContact O-N 2.77Å; P90-A93 PolarHBondContact O-N 2.85Å; P90-F94 WeakPolarHBondContact O-CB 3.05Å; P90-F94 PolarHBondContact O-N 2.93Å; P90-G114 WeakPolarHBondContact CD-O 3.22Å; P90-L154 HydrophobicContact CB-CD1 4.34Å; P90-L154 HydrophobicContact CG-CD1 3.77Å; P90-Y158 HydrophobicContact CB-CD2 4.18Å; P90-Y158 HydrophobicContact CB-CE2 3.53Å |
| 91 | L | 94 | Very high | 90.2 | Very high | 85 Ų | 85 | 40 Ų | 40 | 45% | 0.445 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.7 | -41.7 | 177.8 | -178.1 | 61.9 | 0 | 0 | 0 | 111 | G87 I88 M89 F94 C95 Y158 | G87-L91 WeakPolarHBondContact O-CB 3.08Å; G87-L91 PolarHBondContact O-N 3.14Å; I88-L91 PolarHBondContact O-N 3.43Å; M89-L91 PolarHBondContact O-N 3.48Å; L91-F94 PolarHBondContact O-N 3.21Å; L91-C95 WeakPolarHBondContact O-CB 3.44Å; L91-C95 PolarHBondContact O-N 3.27Å; L91-C95 PolarHBondContact O-SG 3.5Å; L91-Y158 WeakPolarHBondContact CA-OH 3.36Å; L91-Y158 WeakPolarHBondContact CB-OH 3.35Å; L91-Y158 HydrophobicContact CD1-CE1 4.26Å; L91-Y158 PolarHBondContact N-OH 3.43Å |
| 92 | T | 94.6 | Very high | 90.8 | Very high | 17 Ų | 17 | 41.3 Ų | 41.3 | 10% | 0.104 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -61.5 | -48 | 176.1 | -59 | 0 | 0 | 0 | 0 | 110.6 | I88 M89 P90 F94 C95 L96 L244 I247 | I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.37Å; I88-T92 PolarHBondContact O-N 3.2Å; I88-T92 PolarHBondContact O-OG1 2.89Å; M89-T92 PolarHBondContact O-N 3.21Å; P90-T92 VanDerWaalsContact C-N 3.32Å; P90-T92 PolarHBondContact O-N 2.77Å; T92-F94 VanDerWaalsContact C-N 3.31Å; T92-F94 PolarHBondContact O-N 3.45Å; T92-C95 PolarHBondContact O-N 3.45Å; T92-L96 HydrophobicContact CG2-CD1 3.81Å; T92-L96 HydrophobicContact CG2-CG 4.21Å; T92-L96 WeakPolarHBondContact O-CB 3.3Å; T92-L96 VanDerWaalsContact O-CG 3.26Å; T92-L96 WeakPolarHBondContact O-CG 3.49Å; T92-L96 PolarHBondContact O-N 3.45Å; T92-L244 HydrophobicContact CG2-CD1 3.8Å; T92-I247 HydrophobicContact CG2-CB 3.94Å; T92-I247 HydrophobicContact CG2-CD1 3.7Å; T92-I247 HydrophobicContact CG2-CG1 4.44Å; T92-I247 HydrophobicContact CG2-CG2 3.58Å |
| 93 | A | 94.4 | Very high | 90.8 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.6 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | M89 P90 T97 I110 L111 L244 | M89-A93 PolarHBondContact O-N 3.33Å; P90-A93 PolarHBondContact O-N 2.85Å; A93-T97 WeakPolarHBondContact O-CB 3.24Å; A93-T97 WeakPolarHBondContact O-CG2 3.25Å; A93-T97 PolarHBondContact O-N 3.46Å; A93-T97 PolarHBondContact O-OG1 2.91Å; A93-I110 HydrophobicContact CB-CG2 4.11Å; A93-L111 HydrophobicContact CB-CD2 4.17Å; A93-L244 HydrophobicContact CB-CD1 4Å |
| 94 | F | 92.8 | Very high | 90.5 | Very high | 45 Ų | 45 | 40.2 Ų | 40.2 | 20% | 0.197 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.1 | -48.4 | 175.6 | -178.3 | -103.4 | 0 | 0 | 0 | 112.7 | P90 L91 T92 L96 T97 K98 L111 Y158 F162 | P90-F94 WeakPolarHBondContact O-CB 3.05Å; P90-F94 PolarHBondContact O-N 2.93Å; L91-F94 PolarHBondContact O-N 3.21Å; T92-F94 VanDerWaalsContact C-N 3.31Å; T92-F94 PolarHBondContact O-N 3.45Å; F94-L96 PolarHBondContact O-N 2.91Å; F94-T97 WeakPolarHBondContact CA-OG1 3.4Å; F94-T97 PolarHBondContact O-N 2.73Å; F94-T97 PolarHBondContact O-OG1 3.35Å; F94-K98 HydrophobicContact CE1-CG 4.16Å; F94-K98 HydrophobicContact CE2-CG 4.18Å; F94-K98 HydrophobicContact CZ-CG 3.99Å; F94-K98 WeakPolarHBondContact O-CB 3.49Å; F94-K98 WeakPolarHBondContact O-CG 3.18Å; F94-K98 PolarHBondContact O-N 3.06Å; F94-L111 HydrophobicContact CB-CD2 3.95Å; F94-Y158 HydrophobicContact CB-CD1 3.49Å; F94-Y158 VanDerWaalsContact CB-CD1 3.49Å; F94-Y158 HydrophobicContact CB-CE1 3.65Å; F94-Y158 HydrophobicContact CB-CG 4.27Å; F94-Y158 HydrophobicContact CD1-CD1 4.02Å; F94-Y158 HydrophobicContact CD1-CE1 4.11Å; F94-Y158 AromaticContact CD2-CD1 3.47Å; F94-Y158 HydrophobicContact CD2-CD1 3.47Å; F94-Y158 VanDerWaalsContact CD2-CD1 3.47Å; F94-Y158 HydrophobicContact CD2-CE1 4.32Å; F94-Y158 HydrophobicContact CD2-CG 4.18Å; F94-Y158 HydrophobicContact CE2-CD1 4.14Å; F94-Y158 AromaticContact CG-CD1 3.37Å; F94-Y158 HydrophobicContact CG-CD1 3.37Å; F94-Y158 AromaticContact CG-CE1 3.78Å; F94-Y158 HydrophobicContact CG-CE1 3.78Å; F94-Y158 HydrophobicContact CG-CG 4.36Å; F94-F162 AromaticContact CD2-CE2 3.8Å; F94-F162 HydrophobicContact CD2-CE2 3.8Å; F94-F162 AromaticContact CD2-CZ 4Å; F94-F162 HydrophobicContact CD2-CZ 4Å; F94-F162 HydrophobicContact CE2-CD2 4.34Å; F94-F162 AromaticContact CE2-CE2 3.6Å; F94-F162 HydrophobicContact CE2-CE2 3.6Å; F94-F162 AromaticContact CE2-CZ 3.91Å; F94-F162 HydrophobicContact CE2-CZ 3.91Å |
| 95 | C | 94 | Very high | 90.2 | Very high | 72 Ų | 72 | 41.9 Ų | 41.9 | 49% | 0.486 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.7 | -42.6 | 179.3 | -71.3 | 0 | 0 | 0 | 0 | 111.9 | L91 T92 G99 | L91-C95 WeakPolarHBondContact O-CB 3.44Å; L91-C95 PolarHBondContact O-N 3.27Å; L91-C95 PolarHBondContact O-SG 3.5Å; T92-C95 PolarHBondContact O-N 3.45Å; C95-G99 PolarHBondContact O-N 3.48Å |
| 96 | L | 94 | Very high | 90 | Very high | 20 Ų | 20 | 42.7 Ų | 42.7 | 11% | 0.105 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.8 | -47.3 | 177.4 | -71.8 | 175.8 | 0 | 0 | 0 | 111.3 | T92 F94 K98 G99 F100 I240 L243 L244 I247 | T92-L96 HydrophobicContact CG2-CD1 3.81Å; T92-L96 HydrophobicContact CG2-CG 4.21Å; T92-L96 WeakPolarHBondContact O-CB 3.3Å; T92-L96 VanDerWaalsContact O-CG 3.26Å; T92-L96 WeakPolarHBondContact O-CG 3.49Å; T92-L96 PolarHBondContact O-N 3.45Å; F94-L96 PolarHBondContact O-N 2.91Å; L96-K98 VanDerWaalsContact C-N 3.32Å; L96-K98 PolarHBondContact O-N 3.33Å; L96-G99 PolarHBondContact O-N 3.32Å; L96-F100 HydrophobicContact CD2-CE2 4.08Å; L96-F100 VanDerWaalsContact O-CD2 3.3Å; L96-F100 WeakPolarHBondContact O-CD2 3.4Å; L96-F100 PolarHBondContact O-N 3.4Å; L96-I240 HydrophobicContact CB-CD1 4.37Å; L96-I240 HydrophobicContact CB-CG1 4.16Å; L96-I240 HydrophobicContact CD1-CG2 4.22Å; L96-L243 HydrophobicContact CD1-CB 4.14Å; L96-L243 HydrophobicContact CD2-CB 4.21Å; L96-L243 HydrophobicContact CD2-CD1 3.96Å; L96-L244 HydrophobicContact CD1-CB 4.14Å; L96-L244 HydrophobicContact CD1-CD1 4.13Å; L96-I247 HydrophobicContact CD1-CD1 4.45Å; L96-I247 HydrophobicContact CD2-CD1 4.46Å |
| 97 | T | 91.7 | Very high | 89.9 | Confident | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.006 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63 | -38.1 | -179.9 | 52.4 | 0 | 0 | 0 | 0 | 112.7 | A93 F94 Q101 L102 A107 I110 | A93-T97 WeakPolarHBondContact O-CB 3.24Å; A93-T97 WeakPolarHBondContact O-CG2 3.25Å; A93-T97 PolarHBondContact O-N 3.46Å; A93-T97 PolarHBondContact O-OG1 2.91Å; F94-T97 WeakPolarHBondContact CA-OG1 3.4Å; F94-T97 PolarHBondContact O-N 2.73Å; F94-T97 PolarHBondContact O-OG1 3.35Å; T97-Q101 PolarHBondContact O-N 2.9Å; T97-L102 HydrophobicContact CG2-CD1 4.04Å; T97-L102 PolarHBondContact O-N 3.31Å; T97-A107 HydrophobicContact CG2-CB 4.03Å; T97-I110 HydrophobicContact CG2-CB 3.61Å; T97-I110 HydrophobicContact CG2-CD1 3.9Å; T97-I110 HydrophobicContact CG2-CG1 4.38Å; T97-I110 HydrophobicContact CG2-CG2 3.5Å; T97-I110 VanDerWaalsContact CG2-CG2 3.5Å |
| 98 | K | 89.3 | Confident | 89.6 | Confident | 87 Ų | 87 | 41.4 Ų | 41.4 | 38% | 0.378 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -69.4 | -44.9 | 172.7 | -74.3 | -69 | -170.3 | 176 | 0 | 112.7 | F94 L96 F100 Q101 G161 F162 | F94-K98 HydrophobicContact CE1-CG 4.16Å; F94-K98 HydrophobicContact CE2-CG 4.18Å; F94-K98 HydrophobicContact CZ-CG 3.99Å; F94-K98 WeakPolarHBondContact O-CB 3.49Å; F94-K98 WeakPolarHBondContact O-CG 3.18Å; F94-K98 PolarHBondContact O-N 3.06Å; L96-K98 VanDerWaalsContact C-N 3.32Å; L96-K98 PolarHBondContact O-N 3.33Å; K98-F100 VanDerWaalsContact C-N 3.35Å; K98-F100 PolarHBondContact O-N 3.48Å; K98-Q101 PolarHBondContact O-N 3.21Å; K98-Q101 VanDerWaalsContact O-N 3.13Å; K98-G161 VanDerWaalsContact CE-O 3.3Å; K98-G161 WeakPolarHBondContact CE-O 3.2Å; K98-G161 PolarHBondContact NZ-O 3.35Å; K98-F162 HydrophobicContact CD-CE1 3.95Å; K98-F162 HydrophobicContact CD-CZ 4.38Å; K98-F162 HydrophobicContact CG-CE1 4.43Å; K98-F162 HydrophobicContact CG-CZ 4.44Å |
| 99 | G | 91.6 | Very high | 89.5 | Confident | 61 Ų | 61 | 40.3 Ų | 40.3 | 63% | 0.629 | 23% | 0.23 | S | C | * | . | H | α-helix | trans | -62.6 | -40.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | C95 L96 Q101 | C95-G99 PolarHBondContact O-N 3.48Å; L96-G99 PolarHBondContact O-N 3.32Å; G99-Q101 VanDerWaalsContact C-N 3.31Å |
| 100 | F | 90.9 | Very high | 89.4 | Confident | 80 Ų | 80 | 40.3 Ų | 40.3 | 35% | 0.351 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.8 | 3.1 | 176.2 | -74.3 | -78.7 | 0 | 0 | 0 | 114 | L96 K98 L102 P236 A239 I240 L243 | L96-F100 HydrophobicContact CD2-CE2 4.08Å; L96-F100 VanDerWaalsContact O-CD2 3.3Å; L96-F100 WeakPolarHBondContact O-CD2 3.4Å; L96-F100 PolarHBondContact O-N 3.4Å; K98-F100 VanDerWaalsContact C-N 3.35Å; K98-F100 PolarHBondContact O-N 3.48Å; F100-L102 VanDerWaalsContact C-N 3.28Å; F100-L102 HydrophobicContact CB-CD2 4.01Å; F100-L102 HydrophobicContact CB-CG 4.08Å; F100-L102 PolarHBondContact O-N 3.14Å; F100-P236 HydrophobicContact CB-CB 4.19Å; F100-P236 HydrophobicContact CD1-CB 3.67Å; F100-P236 HydrophobicContact CE1-CB 4.36Å; F100-P236 HydrophobicContact CG-CB 4.15Å; F100-A239 HydrophobicContact CE1-CB 4.06Å; F100-A239 HydrophobicContact CE2-CB 4.45Å; F100-A239 HydrophobicContact CZ-CB 3.71Å; F100-I240 HydrophobicContact CB-CD1 4.21Å; F100-I240 HydrophobicContact CD2-CD1 3.76Å; F100-I240 HydrophobicContact CD2-CG1 3.65Å; F100-I240 HydrophobicContact CE2-CD1 4.49Å; F100-I240 HydrophobicContact CE2-CG1 3.89Å; F100-I240 HydrophobicContact CG-CD1 4.17Å; F100-I240 HydrophobicContact CG-CG1 4.38Å; F100-L243 HydrophobicContact CE2-CD1 4.15Å; F100-L243 HydrophobicContact CZ-CD1 4.26Å |
| 101 | Q | 88.3 | Confident | 89.3 | Confident | 177 Ų | 177 | 40.3 Ų | 40.3 | 83% | 0.827 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.2 | 44.4 | 177.3 | -57.6 | -179.2 | 9.3 | 0 | 0 | 113.6 | T97 K98 G99 | T97-Q101 PolarHBondContact O-N 2.9Å; K98-Q101 PolarHBondContact O-N 3.21Å; K98-Q101 VanDerWaalsContact O-N 3.13Å; G99-Q101 VanDerWaalsContact C-N 3.31Å |
| 102 | L | 85.6 | Confident | 89 | Confident | 30 Ų | 30 | 36.3 Ų | 36.3 | 16% | 0.157 | 21% | 0.208 | C | C | . | . | trans | -70.4 | 157.1 | -176 | -58.8 | -180 | 0 | 0 | 0 | 112.4 | T97 F100 T106 I110 P236 L237 I240 | T97-L102 HydrophobicContact CG2-CD1 4.04Å; T97-L102 PolarHBondContact O-N 3.31Å; F100-L102 VanDerWaalsContact C-N 3.28Å; F100-L102 HydrophobicContact CB-CD2 4.01Å; F100-L102 HydrophobicContact CB-CG 4.08Å; F100-L102 PolarHBondContact O-N 3.14Å; L102-T106 HydrophobicContact CB-CG2 4.13Å; L102-T106 HydrophobicContact CD1-CG2 3.79Å; L102-T106 HydrophobicContact CG-CG2 4.39Å; L102-I110 HydrophobicContact CD1-CD1 3.2Å; L102-P236 HydrophobicContact CD2-CB 4.1Å; L102-P236 HydrophobicContact CD2-CG 4.43Å; L102-L237 HydrophobicContact CD1-CD2 4.39Å; L102-I240 HydrophobicContact CD1-CD1 3.47Å; L102-I240 VanDerWaalsContact CD1-CD1 3.47Å; L102-I240 HydrophobicContact CG-CD1 4.33Å | ||
| 103 | S | 85.1 | Confident | 88.8 | Confident | 73 Ų | 73 | 35.5 Ų | 35.5 | 51% | 0.51 | 20% | 0.204 | S | C | . | . | trans | -60.6 | 151.4 | 169.6 | 70.3 | 0 | 0 | 0 | 0 | 110.9 | A105 T106 A107 | S103-A105 PolarHBondContact O-N 3.47Å; S103-T106 WeakPolarHBondContact O-CB 3.36Å; S103-T106 PolarHBondContact O-N 2.86Å; S103-T106 VanDerWaalsContact O-N 3.11Å; S103-T106 WeakPolarHBondContact OG-CB 3.33Å; S103-T106 PolarHBondContact OG-OG1 3.02Å; S103-A107 PolarHBondContact O-N 2.9Å | ||
| 104 | E | 81.6 | Confident | 88.7 | Confident | 39 Ų | 39 | 35.5 Ų | 35.5 | 18% | 0.182 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.6 | -41.9 | -171.5 | -64.9 | -166.4 | 143.6 | 0 | 0 | 113.2 | T106 A107 V108 N164 L165 | E104-T106 VanDerWaalsContact C-N 3.3Å; E104-T106 PolarHBondContact O-N 3.41Å; E104-A107 PolarHBondContact O-N 3.27Å; E104-V108 WeakPolarHBondContact O-CG2 3.38Å; E104-V108 PolarHBondContact O-N 3.39Å; E104-N164 VanDerWaalsContact OE1-CA 3.23Å; E104-N164 WeakPolarHBondContact OE1-CA 3.28Å; E104-N164 WeakPolarHBondContact OE1-CB 3.26Å; E104-N164 PolarHBondContact OE1-N 3.19Å; E104-N164 VanDerWaalsContact OE1-N 3.15Å; E104-L165 HydrophobicContact CB-CD1 3.59Å; E104-L165 HydrophobicContact CG-CD1 4.28Å; E104-L165 PolarHBondContact OE1-N 2.76Å; E104-L165 VanDerWaalsContact OE2-CA 3.28Å; E104-L165 WeakPolarHBondContact OE2-CA 3.01Å; E104-L165 PolarHBondContact OE2-N 3.49Å |
| 105 | A | 79.4 | Confident | 88.6 | Confident | 35 Ų | 35 | 33.3 Ų | 33.3 | 29% | 0.289 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -60 | -41.5 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | S103 V108 V109 | S103-A105 PolarHBondContact O-N 3.47Å; A105-V108 PolarHBondContact O-N 2.88Å; A105-V109 WeakPolarHBondContact O-CG2 3.49Å; A105-V109 PolarHBondContact O-N 2.72Å |
| 106 | T | 85.3 | Confident | 88.2 | Confident | 19 Ų | 19 | 29.9 Ų | 29.9 | 12% | 0.117 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.1 | -43.3 | 176.4 | -56.9 | 0 | 0 | 0 | 0 | 111.3 | L102 S103 E104 V108 V109 I110 L237 M297 | L102-T106 HydrophobicContact CB-CG2 4.13Å; L102-T106 HydrophobicContact CD1-CG2 3.79Å; L102-T106 HydrophobicContact CG-CG2 4.39Å; S103-T106 WeakPolarHBondContact O-CB 3.36Å; S103-T106 PolarHBondContact O-N 2.86Å; S103-T106 VanDerWaalsContact O-N 3.11Å; S103-T106 WeakPolarHBondContact OG-CB 3.33Å; S103-T106 PolarHBondContact OG-OG1 3.02Å; E104-T106 VanDerWaalsContact C-N 3.3Å; E104-T106 PolarHBondContact O-N 3.41Å; T106-V108 VanDerWaalsContact C-N 3.33Å; T106-V108 PolarHBondContact O-N 3.34Å; T106-V109 PolarHBondContact O-N 2.95Å; T106-I110 HydrophobicContact CG2-CD1 3.96Å; T106-I110 PolarHBondContact O-N 3.47Å; T106-I110 VanDerWaalsContact O-N 3.08Å; T106-L237 HydrophobicContact CG2-CD2 3.62Å; T106-M297 HydrophobicContact CG2-CE 3.58Å; T106-M297 HydrophobicContact CG2-SD 3.91Å |
| 107 | A | 87.7 | Confident | 87.9 | Confident | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.008 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -61.5 | -41.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T97 S103 E104 I110 L111 F162 | T97-A107 HydrophobicContact CG2-CB 4.03Å; S103-A107 PolarHBondContact O-N 2.9Å; E104-A107 PolarHBondContact O-N 3.27Å; A107-I110 PolarHBondContact O-N 3.29Å; A107-L111 WeakPolarHBondContact O-CB 3.43Å; A107-L111 WeakPolarHBondContact O-CG 3.45Å; A107-L111 PolarHBondContact O-N 2.85Å; A107-F162 HydrophobicContact CB-CE1 3.85Å; A107-F162 HydrophobicContact CB-CZ 3.91Å |
| 108 | V | 84.4 | Confident | 87.6 | Confident | 5 Ų | 5 | 29 Ų | 29 | 3% | 0.03 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -66.8 | -38.2 | 177.7 | -175.1 | 0 | 0 | 0 | 0 | 111.8 | E104 A105 T106 I110 L111 I112 L155 L165 F289 | E104-V108 WeakPolarHBondContact O-CG2 3.38Å; E104-V108 PolarHBondContact O-N 3.39Å; A105-V108 PolarHBondContact O-N 2.88Å; T106-V108 VanDerWaalsContact C-N 3.33Å; T106-V108 PolarHBondContact O-N 3.34Å; V108-I110 VanDerWaalsContact C-N 3.35Å; V108-I110 PolarHBondContact O-N 2.84Å; V108-L111 PolarHBondContact O-N 3.28Å; V108-I112 HydrophobicContact CG1-CD1 4.18Å; V108-I112 HydrophobicContact CG1-CG1 4.46Å; V108-I112 VanDerWaalsContact O-CG1 3.29Å; V108-I112 WeakPolarHBondContact O-CG1 3.26Å; V108-I112 PolarHBondContact O-N 2.83Å; V108-L155 HydrophobicContact CG1-CD2 4.33Å; V108-L165 HydrophobicContact CG2-CD1 4.36Å; V108-L165 HydrophobicContact CG2-CD2 4.4Å; V108-F289 HydrophobicContact CB-CZ 4.04Å; V108-F289 HydrophobicContact CG1-CE2 4.04Å; V108-F289 HydrophobicContact CG1-CZ 3.49Å; V108-F289 VanDerWaalsContact CG1-CZ 3.49Å |
| 109 | V | 87.6 | Confident | 87.1 | Confident | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61.5 | -43.1 | 174.9 | 171.2 | 0 | 0 | 0 | 0 | 111.7 | A105 T106 I112 C113 V285 I294 M297 F300 | A105-V109 WeakPolarHBondContact O-CG2 3.49Å; A105-V109 PolarHBondContact O-N 2.72Å; T106-V109 PolarHBondContact O-N 2.95Å; V109-I112 WeakPolarHBondContact O-CB 3.49Å; V109-I112 PolarHBondContact O-N 3.09Å; V109-C113 PolarHBondContact O-N 2.69Å; V109-V285 HydrophobicContact CG1-CG1 4.28Å; V109-V285 HydrophobicContact CG1-CG2 3.9Å; V109-V285 HydrophobicContact CG2-CG1 4.02Å; V109-V285 HydrophobicContact CG2-CG2 4.42Å; V109-I294 HydrophobicContact CG2-CG2 3.96Å; V109-M297 HydrophobicContact CB-CE 3.94Å; V109-M297 HydrophobicContact CG1-CB 4.32Å; V109-M297 HydrophobicContact CG1-CE 3.76Å; V109-M297 HydrophobicContact CG2-CB 4.09Å; V109-F300 HydrophobicContact CG1-CB 4.27Å; V109-F300 HydrophobicContact CG1-CD1 4.32Å |
| 110 | I | 91.9 | Very high | 86.4 | Confident | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -68 | -39.8 | 177.2 | -69.2 | 159.9 | 0 | 0 | 0 | 111.2 | A93 T97 L102 T106 A107 V108 I112 C113 G114 L237 I240 F300 | A93-I110 HydrophobicContact CB-CG2 4.11Å; T97-I110 HydrophobicContact CG2-CB 3.61Å; T97-I110 HydrophobicContact CG2-CD1 3.9Å; T97-I110 HydrophobicContact CG2-CG1 4.38Å; T97-I110 HydrophobicContact CG2-CG2 3.5Å; T97-I110 VanDerWaalsContact CG2-CG2 3.5Å; L102-I110 HydrophobicContact CD1-CD1 3.2Å; T106-I110 HydrophobicContact CG2-CD1 3.96Å; T106-I110 PolarHBondContact O-N 3.47Å; T106-I110 VanDerWaalsContact O-N 3.08Å; A107-I110 PolarHBondContact O-N 3.29Å; V108-I110 VanDerWaalsContact C-N 3.35Å; V108-I110 PolarHBondContact O-N 2.84Å; I110-I112 VanDerWaalsContact C-N 3.32Å; I110-I112 PolarHBondContact O-N 3.18Å; I110-C113 PolarHBondContact O-N 3.04Å; I110-G114 PolarHBondContact O-N 2.8Å; I110-L237 HydrophobicContact CD1-CD2 4.05Å; I110-I240 HydrophobicContact CD1-CD1 3.93Å; I110-I240 HydrophobicContact CD1-CG2 4.18Å; I110-I240 HydrophobicContact CG1-CG2 4.38Å; I110-I240 HydrophobicContact CG2-CG2 3.87Å; I110-F300 HydrophobicContact CD1-CZ 4.4Å; I110-F300 HydrophobicContact CG1-CD1 4.17Å; I110-F300 HydrophobicContact CG1-CE1 3.64Å; I110-F300 HydrophobicContact CG1-CE2 4.42Å; I110-F300 HydrophobicContact CG1-CZ 3.79Å |
| 111 | L | 90.4 | Very high | 86.1 | Confident | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.4 | -40.8 | 173.3 | -79.5 | 167.3 | 0 | 0 | 0 | 112 | A93 F94 A107 V108 C113 G114 C115 Y158 F162 | A93-L111 HydrophobicContact CB-CD2 4.17Å; F94-L111 HydrophobicContact CB-CD2 3.95Å; A107-L111 WeakPolarHBondContact O-CB 3.43Å; A107-L111 WeakPolarHBondContact O-CG 3.45Å; A107-L111 PolarHBondContact O-N 2.85Å; V108-L111 PolarHBondContact O-N 3.28Å; L111-C113 VanDerWaalsContact C-N 3.32Å; L111-C113 PolarHBondContact O-N 3.22Å; L111-G114 PolarHBondContact O-N 2.97Å; L111-C115 WeakPolarHBondContact O-CB 3.42Å; L111-C115 PolarHBondContact O-N 3.35Å; L111-C115 PolarHBondContact O-SG 2.74Å; L111-Y158 HydrophobicContact CD2-CG 4.14Å; L111-F162 HydrophobicContact CD1-CE2 3.78Å; L111-F162 HydrophobicContact CD1-CZ 4.28Å |
| 112 | I | 87.9 | Confident | 86.1 | Confident | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -57.2 | -47.6 | 174.2 | -74 | 166.3 | 0 | 0 | 0 | 110.4 | V108 V109 I110 G114 C115 C116 M151 L155 V284 V285 F289 | V108-I112 HydrophobicContact CG1-CD1 4.18Å; V108-I112 HydrophobicContact CG1-CG1 4.46Å; V108-I112 VanDerWaalsContact O-CG1 3.29Å; V108-I112 WeakPolarHBondContact O-CG1 3.26Å; V108-I112 PolarHBondContact O-N 2.83Å; V109-I112 WeakPolarHBondContact O-CB 3.49Å; V109-I112 PolarHBondContact O-N 3.09Å; I110-I112 VanDerWaalsContact C-N 3.32Å; I110-I112 PolarHBondContact O-N 3.18Å; I112-G114 VanDerWaalsContact C-N 3.33Å; I112-G114 PolarHBondContact O-N 2.77Å; I112-C115 PolarHBondContact O-N 3.4Å; I112-C116 PolarHBondContact O-N 3.44Å; I112-C116 PolarHBondContact O-SG 3.26Å; I112-M151 HydrophobicContact CB-CE 4.42Å; I112-M151 HydrophobicContact CG2-CE 3.58Å; I112-M151 WeakPolarHBondContact O-CE 3.12Å; I112-L155 HydrophobicContact CD1-CD2 4.24Å; I112-L155 HydrophobicContact CG1-CD1 4.24Å; I112-L155 HydrophobicContact CG1-CD2 3.65Å; I112-L155 HydrophobicContact CG1-CG 4.34Å; I112-V284 HydrophobicContact CD1-CG1 4.22Å; I112-V284 HydrophobicContact CG1-CG1 4.38Å; I112-V284 HydrophobicContact CG2-CB 3.94Å; I112-V284 HydrophobicContact CG2-CG1 3.77Å; I112-V285 HydrophobicContact CB-CG2 4.27Å; I112-V285 HydrophobicContact CD1-CG2 4.17Å; I112-V285 HydrophobicContact CG2-CG2 3.84Å; I112-F289 HydrophobicContact CD1-CD2 4.46Å; I112-F289 HydrophobicContact CD1-CE2 3.58Å; I112-F289 HydrophobicContact CD1-CZ 4.43Å |
| 113 | C | 91.4 | Very high | 86.3 | Confident | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -65.9 | -35.1 | 178.3 | -80.3 | 0 | 0 | 0 | 0 | 112.9 | V109 I110 L111 C281 L304 | V109-C113 PolarHBondContact O-N 2.69Å; I110-C113 PolarHBondContact O-N 3.04Å; L111-C113 VanDerWaalsContact C-N 3.32Å; L111-C113 PolarHBondContact O-N 3.22Å; C113-C281 WeakPolarHBondContact CA-SG 3.36Å; C113-C281 HydrophobicContact CB-CB 4.24Å; C113-C281 WeakPolarHBondContact CB-SG 3.27Å; C113-C281 PolarHBondContact N-SG 3.32Å; C113-C281 VanDerWaalsContact N-SG 3.41Å; C113-C281 WeakPolarHBondContact SG-CB 3.31Å; C113-C281 CovalentContact SG-SG 2.07Å; C113-C281 PolarHBondContact SG-SG 3.1Å; C113-L304 HydrophobicContact CB-CD2 3.63Å |
| 114 | G | 92 | Very high | 86.5 | Confident | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -71.2 | -26.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | M89 P90 I110 L111 I112 | M89-G114 CarbonylContact C-O 3.55Å; M89-G114 VanDerWaalsContact CB-O 3.25Å; M89-G114 WeakPolarHBondContact CB-O 3.32Å; P90-G114 WeakPolarHBondContact CD-O 3.22Å; I110-G114 PolarHBondContact O-N 2.8Å; L111-G114 PolarHBondContact O-N 2.97Å; I112-G114 VanDerWaalsContact C-N 3.33Å; I112-G114 PolarHBondContact O-N 2.77Å |
| 115 | C | 89.6 | Confident | 87 | Confident | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 11% | 0.106 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90 | -0.4 | 178.3 | -62.4 | 0 | 0 | 0 | 0 | 113.7 | L111 I112 M151 L155 | L111-C115 WeakPolarHBondContact O-CB 3.42Å; L111-C115 PolarHBondContact O-N 3.35Å; L111-C115 PolarHBondContact O-SG 2.74Å; I112-C115 PolarHBondContact O-N 3.4Å; C115-M151 HydrophobicContact CB-CB 4.5Å; C115-M151 HydrophobicContact CB-CG 3.87Å; C115-L155 HydrophobicContact CB-CD1 3.84Å |
| 116 | C | 87.4 | Confident | 87.5 | Confident | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 9% | 0.092 | C | C | . | . | P | Polyproline II helix | trans | -66.8 | 152.3 | 175 | -74.9 | 0 | 0 | 0 | 0 | 110.8 | Q85 I112 Q276 L280 C281 | Q85-C116 PolarHBondContact NE2-O 2.84Å; I112-C116 PolarHBondContact O-N 3.44Å; I112-C116 PolarHBondContact O-SG 3.26Å; C116-Q276 PolarHBondContact O-OE1 3.27Å; C116-L280 HydrophobicContact CB-CD2 4.41Å; C116-C281 VanDerWaalsContact SG-CA 3.55Å; C116-C281 VanDerWaalsContact SG-CB 3.54Å |
| 117 | P | 87.6 | Confident | 87.8 | Confident | 1 Ų | 1 | 19.7 Ų | 19.7 | 1% | 0.006 | 11% | 0.114 | C | C | . | . | P | Polyproline II helix | trans | -73.7 | 172.2 | 166.9 | 33.4 | -30.7 | 0 | 0 | 0 | 110.7 | A147 Q276 N277 L280 | P117-A147 HydrophobicContact CB-CB 4.16Å; P117-A147 HydrophobicContact CG-CB 3.86Å; P117-Q276 PolarHBondContact O-OE1 3.22Å; P117-N277 HydrophobicContact CG-CB 4.38Å; P117-N277 WeakPolarHBondContact O-CB 3.5Å; P117-N277 PolarHBondContact O-N 3.22Å; P117-L280 HydrophobicContact CG-CD2 3.67Å |
| 118 | G | 84.5 | Confident | 88 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 12% | 0.124 | C | C | . | . | B | Isolated β-bridge | trans | -56.2 | 145.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S143 C275 | G118-S143 PolarHBondContact N-OG 2.69Å; G118-C275 WeakPolarHBondContact CA-O 3.32Å |
| 119 | G | 79.4 | Confident | 88.4 | Confident | 3 Ų | 3 | 21.3 Ų | 21.3 | 3% | 0.031 | 13% | 0.126 | C | C | . | . | P | Polyproline II helix | trans | -96 | 152.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L121 S122 C275 | G119-L121 PolarHBondContact O-N 3.47Å; G119-S122 VanDerWaalsContact O-CB 3.28Å; G119-S122 WeakPolarHBondContact O-CB 3.37Å; G119-S122 PolarHBondContact O-N 2.83Å; G119-S122 PolarHBondContact O-OG 2.85Å; G119-C275 PolarHBondContact N-O 3.38Å |
| 120 | A | 77.1 | Confident | 88.6 | Confident | 71 Ų | 71 | 27 Ų | 27 | 59% | 0.587 | 15% | 0.151 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -20.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | S122 N123 | A120-S122 VanDerWaalsContact C-N 3.27Å; A120-S122 PolarHBondContact O-N 3.06Å; A120-N123 WeakPolarHBondContact O-CB 3.31Å; A120-N123 PolarHBondContact O-N 2.94Å |
| 121 | L | 84.8 | Confident | 88.5 | Confident | 65 Ų | 65 | 27.7 Ų | 27.7 | 34% | 0.34 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -62.1 | -32.9 | 172.5 | -179.6 | 67.2 | 0 | 0 | 0 | 112.2 | G119 N123 I124 L125 V309 | G119-L121 PolarHBondContact O-N 3.47Å; L121-N123 PolarHBondContact O-N 2.66Å; L121-I124 PolarHBondContact O-N 2.88Å; L121-I124 VanDerWaalsContact O-N 3.09Å; L121-L125 HydrophobicContact CD2-CD1 4.29Å; L121-L125 HydrophobicContact CG-CD1 3.97Å; L121-L125 HydrophobicContact CG-CG 4.16Å; L121-L125 WeakPolarHBondContact O-CG 3.39Å; L121-L125 PolarHBondContact O-N 3.35Å; L121-V309 HydrophobicContact CD2-CG2 3.63Å |
| 122 | S | 87.4 | Confident | 88.5 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -56.4 | -38.2 | 178.9 | 67.6 | 0 | 0 | 0 | 0 | 112 | G119 A120 I124 L125 A126 T140 E272 C275 | G119-S122 VanDerWaalsContact O-CB 3.28Å; G119-S122 WeakPolarHBondContact O-CB 3.37Å; G119-S122 PolarHBondContact O-N 2.83Å; G119-S122 PolarHBondContact O-OG 2.85Å; A120-S122 VanDerWaalsContact C-N 3.27Å; A120-S122 PolarHBondContact O-N 3.06Å; S122-I124 VanDerWaalsContact C-N 3.35Å; S122-I124 PolarHBondContact O-N 3.13Å; S122-L125 PolarHBondContact O-N 3.3Å; S122-A126 VanDerWaalsContact O-CB 3.31Å; S122-A126 WeakPolarHBondContact O-CB 3.42Å; S122-A126 PolarHBondContact O-N 3.44Å; S122-T140 PolarHBondContact OG-OG1 2.88Å; S122-E272 WeakPolarHBondContact CB-OE2 3.45Å; S122-E272 PolarHBondContact OG-OE2 3.46Å; S122-C275 PolarHBondContact N-SG 3.11Å; S122-C275 VanDerWaalsContact N-SG 3.37Å |
| 123 | N | 88.9 | Confident | 88.4 | Confident | 29 Ų | 29 | 31.8 Ų | 31.8 | 16% | 0.155 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -57.7 | -47.4 | 176.9 | -64.6 | -36 | 0 | 0 | 0 | 111.3 | A120 L121 A126 L127 M133 S136 I137 | A120-N123 WeakPolarHBondContact O-CB 3.31Å; A120-N123 PolarHBondContact O-N 2.94Å; L121-N123 PolarHBondContact O-N 2.66Å; N123-A126 PolarHBondContact O-N 2.94Å; N123-L127 PolarHBondContact O-N 3.32Å; N123-M133 HydrophobicContact CB-SD 3.79Å; N123-M133 WeakPolarHBondContact O-CE 3.39Å; N123-S136 VanDerWaalsContact OD1-C 3.26Å; N123-S136 VanDerWaalsContact OD1-CB 3.22Å; N123-S136 WeakPolarHBondContact OD1-CB 3.2Å; N123-S136 PolarHBondContact OD1-OG 2.95Å; N123-S136 VanDerWaalsContact OD1-OG 3.11Å; N123-I137 PolarHBondContact OD1-N 2.91Å |
| 124 | I | 89.9 | Confident | 88 | Confident | 112 Ų | 112 | 36.4 Ų | 36.4 | 57% | 0.574 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -65.7 | -41.5 | 179.2 | -57.7 | 174.7 | 0 | 0 | 0 | 110.3 | L121 S122 L127 A128 | L121-I124 PolarHBondContact O-N 2.88Å; L121-I124 VanDerWaalsContact O-N 3.09Å; S122-I124 VanDerWaalsContact C-N 3.35Å; S122-I124 PolarHBondContact O-N 3.13Å; I124-L127 WeakPolarHBondContact O-CB 3.47Å; I124-L127 PolarHBondContact O-N 3.39Å; I124-A128 WeakPolarHBondContact O-CB 3.43Å; I124-A128 PolarHBondContact O-N 2.91Å |
| 125 | L | 91.4 | Very high | 87.7 | Confident | 16 Ų | 16 | 37 Ų | 37 | 8% | 0.084 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.4 | -40.4 | 178.4 | -61.4 | 174.5 | 0 | 0 | 0 | 112 | L121 S122 L127 A128 I129 M271 C275 A312 I316 | L121-L125 HydrophobicContact CD2-CD1 4.29Å; L121-L125 HydrophobicContact CG-CD1 3.97Å; L121-L125 HydrophobicContact CG-CG 4.16Å; L121-L125 WeakPolarHBondContact O-CG 3.39Å; L121-L125 PolarHBondContact O-N 3.35Å; S122-L125 PolarHBondContact O-N 3.3Å; L125-L127 VanDerWaalsContact C-N 3.32Å; L125-L127 PolarHBondContact O-N 3.36Å; L125-A128 PolarHBondContact O-N 3.47Å; L125-I129 PolarHBondContact O-N 3.43Å; L125-I129 VanDerWaalsContact O-N 3.08Å; L125-M271 HydrophobicContact CB-CB 4.36Å; L125-M271 HydrophobicContact CB-CG 4.22Å; L125-M271 HydrophobicContact CB-SD 3.92Å; L125-C275 HydrophobicContact CD1-CB 4.27Å; L125-A312 HydrophobicContact CD1-CB 3.55Å; L125-A312 HydrophobicContact CD2-CB 3.79Å; L125-A312 HydrophobicContact CG-CB 4.23Å; L125-I316 HydrophobicContact CD2-CD1 3.73Å |
| 126 | A | 91.1 | Very high | 87.6 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.7 | -43.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | S122 N123 A128 K130 G131 T268 | S122-A126 VanDerWaalsContact O-CB 3.31Å; S122-A126 WeakPolarHBondContact O-CB 3.42Å; S122-A126 PolarHBondContact O-N 3.44Å; N123-A126 PolarHBondContact O-N 2.94Å; A126-A128 PolarHBondContact O-N 3.45Å; A126-K130 PolarHBondContact O-N 2.85Å; A126-G131 WeakPolarHBondContact O-CA 3.29Å; A126-G131 PolarHBondContact O-N 3.38Å; A126-T268 HydrophobicContact CB-CG2 4.34Å |
| 127 | L | 91.1 | Very high | 87.4 | Confident | 111 Ų | 111 | 38.7 Ų | 38.7 | 58% | 0.581 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -59.3 | -48.3 | 172.7 | -162.5 | 55.6 | 0 | 0 | 0 | 112 | N123 I124 L125 I129 K130 M133 | N123-L127 PolarHBondContact O-N 3.32Å; I124-L127 WeakPolarHBondContact O-CB 3.47Å; I124-L127 PolarHBondContact O-N 3.39Å; L125-L127 VanDerWaalsContact C-N 3.32Å; L125-L127 PolarHBondContact O-N 3.36Å; L127-I129 PolarHBondContact O-N 2.94Å; L127-K130 PolarHBondContact O-N 3.43Å; L127-M133 HydrophobicContact CB-CE 3.43Å; L127-M133 VanDerWaalsContact CB-CE 3.43Å; L127-M133 HydrophobicContact CD1-CE 3.85Å; L127-M133 HydrophobicContact CD2-CE 3.97Å; L127-M133 HydrophobicContact CG-CE 3.93Å |
| 128 | A | 91.4 | Very high | 87.1 | Confident | 27 Ų | 27 | 39.1 Ų | 39.1 | 22% | 0.223 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.1 | -31.1 | -173 | 0 | 0 | 0 | 0 | 0 | 112.6 | I124 L125 A126 I316 | I124-A128 WeakPolarHBondContact O-CB 3.43Å; I124-A128 PolarHBondContact O-N 2.91Å; L125-A128 PolarHBondContact O-N 3.47Å; A126-A128 PolarHBondContact O-N 3.45Å; A128-I316 HydrophobicContact CB-CD1 3.65Å; A128-I316 HydrophobicContact CB-CG1 4.14Å; A128-I316 HydrophobicContact CB-CG2 4.26Å |
| 129 | I | 93.6 | Very high | 87.2 | Confident | 13 Ų | 13 | 39.1 Ų | 39.1 | 7% | 0.067 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.6 | 13.8 | 176 | -151.5 | 170.4 | 0 | 0 | 0 | 113.2 | L125 L127 G131 R267 M271 I316 F319 | L125-I129 PolarHBondContact O-N 3.43Å; L125-I129 VanDerWaalsContact O-N 3.08Å; L127-I129 PolarHBondContact O-N 2.94Å; I129-G131 VanDerWaalsContact C-N 3.3Å; I129-G131 PolarHBondContact O-N 3.5Å; I129-R267 HydrophobicContact CG2-CB 3.88Å; I129-R267 PolarHBondContact O-NH1 3.44Å; I129-M271 HydrophobicContact CB-CE 4.33Å; I129-M271 HydrophobicContact CD1-CE 3.5Å; I129-M271 HydrophobicContact CG1-CE 4.48Å; I129-M271 HydrophobicContact CG2-CE 4.25Å; I129-M271 HydrophobicContact CG2-CG 4.15Å; I129-I316 HydrophobicContact CB-CG1 4.31Å; I129-F319 HydrophobicContact CB-CD1 4.4Å; I129-F319 HydrophobicContact CD1-CB 3.89Å; I129-F319 HydrophobicContact CD1-CG 4.12Å; I129-F319 HydrophobicContact CG1-CB 3.67Å; I129-F319 HydrophobicContact CG1-CD1 3.53Å; I129-F319 HydrophobicContact CG1-CD2 4.07Å; I129-F319 HydrophobicContact CG1-CE1 4.24Å; I129-F319 HydrophobicContact CG1-CG 3.44Å; I129-F319 VanDerWaalsContact CG1-CG 3.44Å; I129-F319 WeakPolarHBondContact O-CE1 3.33Å |
| 130 | K | 91.9 | Very high | 87.4 | Confident | 118 Ų | 118 | 39.6 Ų | 39.6 | 51% | 0.513 | 22% | 0.221 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.3 | 37.6 | -177 | -55.8 | -176.9 | 179.7 | -175.5 | 0 | 113.7 | A126 L127 R267 F319 H323 | A126-K130 PolarHBondContact O-N 2.85Å; L127-K130 PolarHBondContact O-N 3.43Å; K130-R267 PolarHBondContact O-NH1 3.03Å; K130-R267 PolarHBondContact O-NH2 3.2Å; K130-F319 HydrophobicContact CB-CE1 4.32Å; K130-F319 HydrophobicContact CB-CZ 4.36Å; K130-F319 HydrophobicContact CD-CE1 4.22Å; K130-F319 HydrophobicContact CD-CZ 4.28Å; K130-F319 HydrophobicContact CG-CE1 4.11Å; K130-F319 HydrophobicContact CG-CZ 4.45Å; K130-H323 PolarHBondContact NZ-CE1 2.87Å; K130-H323 VanDerWaalsContact NZ-CE1 3.32Å; K130-H323 PolarHBondContact NZ-NE2 2.72Å |
| 131 | G | 90.6 | Very high | 87.5 | Confident | 16 Ų | 16 | 36.8 Ų | 36.8 | 17% | 0.165 | 20% | 0.196 | C | C | . | . | trans | -76.8 | 179.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | A126 I129 M133 P264 | A126-G131 WeakPolarHBondContact O-CA 3.29Å; A126-G131 PolarHBondContact O-N 3.38Å; I129-G131 VanDerWaalsContact C-N 3.3Å; I129-G131 PolarHBondContact O-N 3.5Å; G131-M133 PolarHBondContact O-N 3.3Å; G131-P264 WeakPolarHBondContact CA-O 3.28Å | ||
| 132 | D | 89.6 | Confident | 87.2 | Confident | 38 Ų | 38 | 34.1 Ų | 34.1 | 20% | 0.203 | 18% | 0.183 | C | C | . | . | trans | -82 | 106.5 | 169.2 | -172.1 | -32.1 | 0 | 0 | 0 | 109.7 | N134 L135 S136 P264 E265 T268 | D132-N134 WeakPolarHBondContact OD1-CA 3.4Å; D132-N134 WeakPolarHBondContact OD1-CB 3.09Å; D132-N134 PolarHBondContact OD1-N 3.25Å; D132-L135 HydrophobicContact CB-CB 3.91Å; D132-L135 PolarHBondContact OD1-N 3.37Å; D132-S136 PolarHBondContact O-N 3.2Å; D132-P264 PolarHBondContact N-O 2.82Å; D132-E265 HydrophobicContact CB-CG 4.22Å; D132-T268 WeakPolarHBondContact CA-OG1 3.34Å; D132-T268 PolarHBondContact N-OG1 3.3Å; D132-T268 VanDerWaalsContact O-CG2 3.26Å; D132-T268 WeakPolarHBondContact O-CG2 3.41Å; D132-T268 PolarHBondContact O-OG1 3.42Å | ||
| 133 | M | 85.6 | Confident | 87.1 | Confident | 48 Ų | 48 | 34.2 Ų | 34.2 | 24% | 0.236 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -65.7 | -38.5 | 177.9 | 176.5 | 63.6 | 71 | 0 | 0 | 112.3 | N123 L127 G131 L135 S136 I137 | N123-M133 HydrophobicContact CB-SD 3.79Å; N123-M133 WeakPolarHBondContact O-CE 3.39Å; L127-M133 HydrophobicContact CB-CE 3.43Å; L127-M133 VanDerWaalsContact CB-CE 3.43Å; L127-M133 HydrophobicContact CD1-CE 3.85Å; L127-M133 HydrophobicContact CD2-CE 3.97Å; L127-M133 HydrophobicContact CG-CE 3.93Å; G131-M133 PolarHBondContact O-N 3.3Å; M133-L135 VanDerWaalsContact C-N 3.28Å; M133-L135 PolarHBondContact O-N 3.45Å; M133-S136 WeakPolarHBondContact O-CB 3.38Å; M133-S136 PolarHBondContact O-N 3.46Å; M133-S136 VanDerWaalsContact O-N 3.14Å; M133-I137 HydrophobicContact CG-CD1 3.87Å; M133-I137 HydrophobicContact CG-CG1 4.41Å; M133-I137 WeakPolarHBondContact O-CG1 3.36Å; M133-I137 PolarHBondContact O-N 2.85Å; M133-I137 HydrophobicContact SD-CD1 4.1Å; M133-I137 HydrophobicContact SD-CG1 4.15Å |
| 134 | N | 83.8 | Confident | 86.6 | Confident | 96 Ų | 96 | 33.7 Ų | 33.7 | 51% | 0.513 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -64.3 | -42.3 | -178.9 | -65.2 | -23.8 | 0 | 0 | 0 | 109.1 | D132 S136 V138 | D132-N134 WeakPolarHBondContact OD1-CA 3.4Å; D132-N134 WeakPolarHBondContact OD1-CB 3.09Å; D132-N134 PolarHBondContact OD1-N 3.25Å; N134-S136 VanDerWaalsContact C-N 3.35Å; N134-S136 PolarHBondContact O-N 3.34Å; N134-V138 WeakPolarHBondContact O-CG2 3.28Å; N134-V138 PolarHBondContact O-N 2.82Å |
| 135 | L | 85.3 | Confident | 85.9 | Confident | 13 Ų | 13 | 30.7 Ų | 30.7 | 7% | 0.068 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.6 | -44.8 | 173.2 | -178.7 | 61.8 | 0 | 0 | 0 | 111.6 | D132 M133 I137 V138 M139 L261 E265 T268 V269 | D132-L135 HydrophobicContact CB-CB 3.91Å; D132-L135 PolarHBondContact OD1-N 3.37Å; M133-L135 VanDerWaalsContact C-N 3.28Å; M133-L135 PolarHBondContact O-N 3.45Å; L135-I137 PolarHBondContact O-N 3.32Å; L135-V138 PolarHBondContact O-N 3.21Å; L135-M139 HydrophobicContact CD1-CG 3.97Å; L135-M139 HydrophobicContact CD1-SD 4.11Å; L135-M139 HydrophobicContact CD2-SD 4.32Å; L135-M139 HydrophobicContact CG-CG 4.17Å; L135-M139 HydrophobicContact CG-SD 3.84Å; L135-M139 WeakPolarHBondContact O-CG 3.42Å; L135-M139 PolarHBondContact O-N 3.3Å; L135-L261 HydrophobicContact CD2-CD2 4.31Å; L135-E265 HydrophobicContact CD2-CB 3.7Å; L135-E265 HydrophobicContact CD2-CG 3.8Å; L135-T268 HydrophobicContact CB-CG2 4.09Å; L135-T268 HydrophobicContact CD2-CG2 4.23Å; L135-T268 HydrophobicContact CG-CG2 4.06Å; L135-V269 HydrophobicContact CD2-CG2 4.21Å |
| 136 | S | 87.5 | Confident | 85.4 | Confident | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -58.1 | -51 | -179.2 | -151.1 | 0 | 0 | 0 | 0 | 111.4 | N123 D132 M133 N134 V138 M139 T140 E272 | N123-S136 VanDerWaalsContact OD1-C 3.26Å; N123-S136 VanDerWaalsContact OD1-CB 3.22Å; N123-S136 WeakPolarHBondContact OD1-CB 3.2Å; N123-S136 PolarHBondContact OD1-OG 2.95Å; N123-S136 VanDerWaalsContact OD1-OG 3.11Å; D132-S136 PolarHBondContact O-N 3.2Å; M133-S136 WeakPolarHBondContact O-CB 3.38Å; M133-S136 PolarHBondContact O-N 3.46Å; M133-S136 VanDerWaalsContact O-N 3.14Å; N134-S136 VanDerWaalsContact C-N 3.35Å; N134-S136 PolarHBondContact O-N 3.34Å; S136-V138 PolarHBondContact O-N 3.02Å; S136-M139 PolarHBondContact O-N 3.24Å; S136-M139 VanDerWaalsContact O-N 3.14Å; S136-T140 PolarHBondContact O-N 3.04Å; S136-T140 PolarHBondContact O-OG1 3Å; S136-E272 PolarHBondContact OG-OE2 2.95Å |
| 137 | I | 82.8 | Confident | 84.8 | Confident | 35 Ų | 35 | 33 Ų | 33 | 18% | 0.179 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.5 | -41.9 | -179.8 | -68 | 168.5 | 0 | 0 | 0 | 110.6 | K67 N123 M133 L135 T140 S141 | K67-I137 HydrophobicContact CB-CG2 4.48Å; K67-I137 HydrophobicContact CD-CG2 3.76Å; N123-I137 PolarHBondContact OD1-N 2.91Å; M133-I137 HydrophobicContact CG-CD1 3.87Å; M133-I137 HydrophobicContact CG-CG1 4.41Å; M133-I137 WeakPolarHBondContact O-CG1 3.36Å; M133-I137 PolarHBondContact O-N 2.85Å; M133-I137 HydrophobicContact SD-CD1 4.1Å; M133-I137 HydrophobicContact SD-CG1 4.15Å; L135-I137 PolarHBondContact O-N 3.32Å; I137-T140 PolarHBondContact O-N 2.71Å; I137-S141 WeakPolarHBondContact O-CB 3.12Å; I137-S141 PolarHBondContact O-N 3.32Å; I137-S141 PolarHBondContact O-OG 3.36Å |
| 138 | V | 81.9 | Confident | 84 | Confident | 10 Ų | 10 | 29.7 Ų | 29.7 | 6% | 0.061 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -67.6 | -46.4 | -179.2 | 176.4 | 0 | 0 | 0 | 0 | 111.4 | H71 V78 N134 L135 S136 T140 S141 C142 | H71-V138 HydrophobicContact CB-CB 4.19Å; H71-V138 HydrophobicContact CB-CG1 3.98Å; H71-V138 HydrophobicContact CB-CG2 3.12Å; H71-V138 WeakPolarHBondContact CD2-CG2 3.39Å; V78-V138 HydrophobicContact CG2-CG1 3.95Å; N134-V138 WeakPolarHBondContact O-CG2 3.28Å; N134-V138 PolarHBondContact O-N 2.82Å; L135-V138 PolarHBondContact O-N 3.21Å; S136-V138 PolarHBondContact O-N 3.02Å; V138-T140 VanDerWaalsContact C-N 3.33Å; V138-T140 PolarHBondContact O-N 3.11Å; V138-S141 PolarHBondContact O-N 3.38Å; V138-C142 VanDerWaalsContact O-CB 3.23Å; V138-C142 WeakPolarHBondContact O-CB 3.19Å; V138-C142 PolarHBondContact O-N 3.03Å; V138-C142 PolarHBondContact O-SG 2.86Å; V138-C142 VanDerWaalsContact O-SG 3.35Å |
| 139 | M | 85.4 | Confident | 83.3 | Confident | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.5 | -43.4 | 177.1 | -63.6 | -179.4 | 68.6 | 0 | 0 | 111.1 | A81 L135 S136 S143 T268 V269 E272 | A81-M139 VanDerWaalsContact CA-CE 3.47Å; A81-M139 HydrophobicContact CB-CB 3.79Å; A81-M139 HydrophobicContact CB-CE 3.37Å; A81-M139 HydrophobicContact CB-CG 3.63Å; A81-M139 HydrophobicContact CB-SD 4.29Å; L135-M139 HydrophobicContact CD1-CG 3.97Å; L135-M139 HydrophobicContact CD1-SD 4.11Å; L135-M139 HydrophobicContact CD2-SD 4.32Å; L135-M139 HydrophobicContact CG-CG 4.17Å; L135-M139 HydrophobicContact CG-SD 3.84Å; L135-M139 WeakPolarHBondContact O-CG 3.42Å; L135-M139 PolarHBondContact O-N 3.3Å; S136-M139 PolarHBondContact O-N 3.24Å; S136-M139 VanDerWaalsContact O-N 3.14Å; M139-S143 WeakPolarHBondContact O-CB 3.3Å; M139-S143 PolarHBondContact O-N 2.8Å; M139-S143 PolarHBondContact O-OG 3.12Å; M139-T268 HydrophobicContact SD-CG2 4.41Å; M139-V269 HydrophobicContact CE-CB 4.16Å; M139-V269 HydrophobicContact CE-CG1 3.98Å; M139-V269 HydrophobicContact CE-CG2 3.86Å; M139-V269 HydrophobicContact SD-CB 4.49Å; M139-V269 HydrophobicContact SD-CG2 3.81Å; M139-E272 HydrophobicContact CB-CG 3.65Å; M139-E272 HydrophobicContact CE-CB 3.96Å; M139-E272 HydrophobicContact CE-CG 3.83Å; M139-E272 HydrophobicContact SD-CB 4.22Å; M139-E272 HydrophobicContact SD-CG 4.15Å |
| 140 | T | 84.2 | Confident | 82.8 | Confident | 14 Ų | 14 | 33.1 Ų | 33.1 | 9% | 0.086 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.3 | -49.8 | 177.3 | -53.4 | 0 | 0 | 0 | 0 | 110.9 | S122 S136 I137 V138 S143 T144 E272 | S122-T140 PolarHBondContact OG-OG1 2.88Å; S136-T140 PolarHBondContact O-N 3.04Å; S136-T140 PolarHBondContact O-OG1 3Å; I137-T140 PolarHBondContact O-N 2.71Å; V138-T140 VanDerWaalsContact C-N 3.33Å; V138-T140 PolarHBondContact O-N 3.11Å; T140-S143 PolarHBondContact O-OG 2.89Å; T140-S143 VanDerWaalsContact O-OG 3.07Å; T140-T144 WeakPolarHBondContact O-CB 3.37Å; T140-T144 PolarHBondContact O-N 3.03Å; T140-T144 PolarHBondContact O-OG1 3.07Å; T140-E272 WeakPolarHBondContact CA-OE1 3.34Å; T140-E272 VanDerWaalsContact CB-OE1 3.29Å; T140-E272 WeakPolarHBondContact CB-OE1 3.23Å; T140-E272 PolarHBondContact N-OE1 3.29Å; T140-E272 VanDerWaalsContact OG1-CD 3.22Å; T140-E272 PolarHBondContact OG1-OE1 2.88Å; T140-E272 PolarHBondContact OG1-OE2 3.28Å; T140-E272 VanDerWaalsContact OG1-OE2 3.13Å |
| 141 | S | 78.4 | Confident | 82.3 | Confident | 11 Ų | 11 | 28 Ų | 28 | 8% | 0.077 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.7 | -44.2 | -178.6 | -62.8 | 0 | 0 | 0 | 0 | 112.1 | I137 V138 L145 | I137-S141 WeakPolarHBondContact O-CB 3.12Å; I137-S141 PolarHBondContact O-N 3.32Å; I137-S141 PolarHBondContact O-OG 3.36Å; V138-S141 PolarHBondContact O-N 3.38Å; S141-L145 PolarHBondContact O-N 3.13Å |
| 142 | C | 80.4 | Confident | 81.6 | Confident | 9 Ų | 9 | 28.6 Ų | 28.6 | 6% | 0.061 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -65.6 | -49.2 | 177.5 | -73.5 | 0 | 0 | 0 | 0 | 111.6 | V78 V138 T144 L145 L146 | V78-C142 HydrophobicContact CG1-CB 4.3Å; V138-C142 VanDerWaalsContact O-CB 3.23Å; V138-C142 WeakPolarHBondContact O-CB 3.19Å; V138-C142 PolarHBondContact O-N 3.03Å; V138-C142 PolarHBondContact O-SG 2.86Å; V138-C142 VanDerWaalsContact O-SG 3.35Å; C142-T144 VanDerWaalsContact C-N 3.34Å; C142-T144 PolarHBondContact O-N 2.91Å; C142-L145 PolarHBondContact O-N 3.43Å; C142-L146 WeakPolarHBondContact O-CD1 3.41Å; C142-L146 PolarHBondContact O-N 3.01Å |
| 143 | S | 84.1 | Confident | 81.2 | Confident | 2 Ų | 2 | 31.5 Ų | 31.5 | 1% | 0.014 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.2 | -47.1 | 178 | 60.4 | 0 | 0 | 0 | 0 | 110.5 | Y86 G118 M139 T140 L145 L146 A147 | Y86-S143 PolarHBondContact OH-O 3.07Å; G118-S143 PolarHBondContact N-OG 2.69Å; M139-S143 WeakPolarHBondContact O-CB 3.3Å; M139-S143 PolarHBondContact O-N 2.8Å; M139-S143 PolarHBondContact O-OG 3.12Å; T140-S143 PolarHBondContact O-OG 2.89Å; T140-S143 VanDerWaalsContact O-OG 3.07Å; S143-L145 VanDerWaalsContact C-N 3.34Å; S143-L145 PolarHBondContact O-N 3.46Å; S143-L146 CarbonylContact O-C 3.13Å; S143-L146 PolarHBondContact O-N 3.41Å; S143-A147 PolarHBondContact O-N 3.47Å |
| 144 | T | 78.8 | Confident | 81.2 | Confident | 18 Ų | 18 | 29.9 Ų | 29.9 | 11% | 0.11 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -54.7 | -47.9 | 178.3 | -62.6 | 0 | 0 | 0 | 0 | 111.4 | M63 T140 C142 A147 | M63-T144 HydrophobicContact CB-CG2 4.2Å; M63-T144 HydrophobicContact CE-CG2 3.28Å; M63-T144 WeakPolarHBondContact CE-O 3.34Å; M63-T144 HydrophobicContact CG-CG2 3.64Å; M63-T144 HydrophobicContact SD-CG2 4.19Å; T140-T144 WeakPolarHBondContact O-CB 3.37Å; T140-T144 PolarHBondContact O-N 3.03Å; T140-T144 PolarHBondContact O-OG1 3.07Å; C142-T144 VanDerWaalsContact C-N 3.34Å; C142-T144 PolarHBondContact O-N 2.91Å; T144-A147 WeakPolarHBondContact O-CB 3.42Å; T144-A147 PolarHBondContact O-N 2.85Å |
| 145 | L | 76 | Confident | 81 | Confident | 49 Ų | 49 | 25.6 Ų | 25.6 | 26% | 0.257 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -60.6 | -46.6 | 173.7 | -82.2 | -161.2 | 0 | 0 | 0 | 113.7 | M63 V65 I68 S141 C142 S143 A147 L148 I189 | M63-L145 HydrophobicContact CE-CD2 4.22Å; V65-L145 HydrophobicContact CG2-CD2 4.18Å; I68-L145 HydrophobicContact CD1-CB 4.47Å; I68-L145 HydrophobicContact CD1-CD1 3.12Å; I68-L145 HydrophobicContact CD1-CD2 4.49Å; I68-L145 HydrophobicContact CD1-CG 3.46Å; I68-L145 VanDerWaalsContact CD1-CG 3.46Å; S141-L145 PolarHBondContact O-N 3.13Å; C142-L145 PolarHBondContact O-N 3.43Å; S143-L145 VanDerWaalsContact C-N 3.34Å; S143-L145 PolarHBondContact O-N 3.46Å; L145-A147 PolarHBondContact O-N 3.05Å; L145-L148 WeakPolarHBondContact O-CB 3.4Å; L145-L148 WeakPolarHBondContact O-CG 3.04Å; L145-L148 PolarHBondContact O-N 3.03Å; L145-I189 HydrophobicContact CD2-CD1 4.47Å |
| 146 | L | 80.5 | Confident | 80.6 | Confident | 57 Ų | 57 | 30.2 Ų | 30.2 | 30% | 0.298 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -64.5 | -26.4 | 179.4 | -90.7 | 84.1 | 0 | 0 | 0 | 112.1 | I82 Y86 C142 S143 L148 A149 M150 | I82-L146 HydrophobicContact CD1-CD2 3.68Å; I82-L146 HydrophobicContact CG1-CD2 3.84Å; I82-L146 HydrophobicContact CG2-CD2 4.2Å; Y86-L146 HydrophobicContact CD2-CB 4.48Å; Y86-L146 HydrophobicContact CE2-CB 3.77Å; C142-L146 WeakPolarHBondContact O-CD1 3.41Å; C142-L146 PolarHBondContact O-N 3.01Å; S143-L146 CarbonylContact O-C 3.13Å; S143-L146 PolarHBondContact O-N 3.41Å; L146-L148 PolarHBondContact O-N 3.23Å; L146-L148 VanDerWaalsContact O-N 3.11Å; L146-A149 PolarHBondContact O-N 3.15Å; L146-M150 HydrophobicContact CB-CG 4.12Å; L146-M150 HydrophobicContact CD2-CG 4.31Å; L146-M150 WeakPolarHBondContact O-CB 3.13Å; L146-M150 WeakPolarHBondContact O-CG 3.36Å; L146-M150 PolarHBondContact O-N 3.12Å |
| 147 | A | 79 | Confident | 80.4 | Confident | 8 Ų | 8 | 35.4 Ų | 35.4 | 7% | 0.066 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -53 | -35.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y86 P117 S143 T144 L145 A149 M151 P152 | Y86-A147 WeakPolarHBondContact OH-CA 3.34Å; Y86-A147 WeakPolarHBondContact OH-CB 3.44Å; Y86-A147 PolarHBondContact OH-N 2.6Å; Y86-A147 VanDerWaalsContact OH-N 3.12Å; P117-A147 HydrophobicContact CB-CB 4.16Å; P117-A147 HydrophobicContact CG-CB 3.86Å; S143-A147 PolarHBondContact O-N 3.47Å; T144-A147 WeakPolarHBondContact O-CB 3.42Å; T144-A147 PolarHBondContact O-N 2.85Å; L145-A147 PolarHBondContact O-N 3.05Å; A147-A149 PolarHBondContact O-N 3.27Å; A147-M151 WeakPolarHBondContact O-CB 3.47Å; A147-M151 PolarHBondContact O-N 2.87Å; A147-P152 WeakPolarHBondContact O-CD 3.43Å |
| 148 | L | 73.7 | Confident | 80.3 | Confident | 41 Ų | 41 | 35.4 Ų | 35.4 | 22% | 0.215 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -53.4 | -39 | 177.9 | -64.4 | 178.6 | 0 | 0 | 0 | 113.3 | M63 L145 L146 P152 L182 C185 I189 | M63-L148 HydrophobicContact CE-CD1 4.27Å; M63-L148 HydrophobicContact CE-CD2 4.07Å; M63-L148 HydrophobicContact CE-CG 3.98Å; M63-L148 HydrophobicContact SD-CD2 4.25Å; L145-L148 WeakPolarHBondContact O-CB 3.4Å; L145-L148 WeakPolarHBondContact O-CG 3.04Å; L145-L148 PolarHBondContact O-N 3.03Å; L146-L148 PolarHBondContact O-N 3.23Å; L146-L148 VanDerWaalsContact O-N 3.11Å; L148-P152 WeakPolarHBondContact O-CD 3.16Å; L148-P152 WeakPolarHBondContact O-CG 3.41Å; L148-L182 HydrophobicContact CB-CD1 3.59Å; L148-L182 HydrophobicContact CD2-CD1 3.94Å; L148-L182 HydrophobicContact CG-CD1 4.26Å; L148-L182 WeakPolarHBondContact O-CD1 3.28Å; L148-C185 HydrophobicContact CD2-CB 4.2Å; L148-C185 WeakPolarHBondContact CD2-SG 3.15Å; L148-I189 HydrophobicContact CD1-CD1 3.15Å; L148-I189 HydrophobicContact CD2-CD1 3.98Å; L148-I189 HydrophobicContact CG-CD1 4.07Å |
| 149 | A | 76.4 | Confident | 80 | Confident | 66 Ų | 66 | 35 Ų | 35 | 55% | 0.545 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -99.7 | -44 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L146 A147 P152 L153 | L146-A149 PolarHBondContact O-N 3.15Å; A147-A149 PolarHBondContact O-N 3.27Å; A149-P152 WeakPolarHBondContact O-CD 3.21Å; A149-L153 VanDerWaalsContact O-CB 3.29Å; A149-L153 WeakPolarHBondContact O-CB 3.48Å; A149-L153 PolarHBondContact O-N 3.24Å |
| 150 | M | 83 | Confident | 79.4 | Confident | 47 Ų | 47 | 40.2 Ų | 40.2 | 23% | 0.232 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -70.8 | -40.3 | -173.2 | -67.8 | -60.8 | -69.3 | 0 | 0 | 112.4 | Y86 L146 L153 L154 | Y86-M150 HydrophobicContact CD1-CB 3.64Å; Y86-M150 HydrophobicContact CD1-CG 4.42Å; Y86-M150 HydrophobicContact CD2-CB 4.14Å; Y86-M150 HydrophobicContact CD2-CG 4.08Å; Y86-M150 HydrophobicContact CE1-CB 3.74Å; Y86-M150 HydrophobicContact CE2-CB 4.22Å; Y86-M150 HydrophobicContact CE2-CG 4.32Å; Y86-M150 HydrophobicContact CG-CB 3.86Å; Y86-M150 HydrophobicContact CG-CE 4.13Å; Y86-M150 HydrophobicContact CG-CG 4.15Å; L146-M150 HydrophobicContact CB-CG 4.12Å; L146-M150 HydrophobicContact CD2-CG 4.31Å; L146-M150 WeakPolarHBondContact O-CB 3.13Å; L146-M150 WeakPolarHBondContact O-CG 3.36Å; L146-M150 PolarHBondContact O-N 3.12Å; M150-L153 PolarHBondContact O-N 3.46Å; M150-L153 HydrophobicContact SD-CD2 4.37Å; M150-L154 HydrophobicContact CB-CD1 4.32Å; M150-L154 HydrophobicContact CE-CD1 4.33Å; M150-L154 HydrophobicContact CE-CG 4.5Å; M150-L154 VanDerWaalsContact O-CB 3.28Å; M150-L154 WeakPolarHBondContact O-CB 3.09Å; M150-L154 WeakPolarHBondContact O-CD1 3.08Å; M150-L154 WeakPolarHBondContact O-CG 2.8Å; M150-L154 PolarHBondContact O-N 3.44Å |
| 151 | M | 82.1 | Confident | 78.8 | Confident | 11 Ų | 11 | 41.2 Ų | 41.2 | 5% | 0.054 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.2 | -49.7 | -178.5 | -172.6 | -177.4 | -170.8 | 0 | 0 | 111 | I112 C115 A147 L153 L155 L280 V284 | I112-M151 HydrophobicContact CB-CE 4.42Å; I112-M151 HydrophobicContact CG2-CE 3.58Å; I112-M151 WeakPolarHBondContact O-CE 3.12Å; C115-M151 HydrophobicContact CB-CB 4.5Å; C115-M151 HydrophobicContact CB-CG 3.87Å; A147-M151 WeakPolarHBondContact O-CB 3.47Å; A147-M151 PolarHBondContact O-N 2.87Å; M151-L153 PolarHBondContact O-N 2.94Å; M151-L155 HydrophobicContact CG-CD1 3.84Å; M151-L155 WeakPolarHBondContact O-CB 3.39Å; M151-L155 WeakPolarHBondContact O-CD1 3.26Å; M151-L155 PolarHBondContact O-N 3.28Å; M151-L280 HydrophobicContact SD-CD2 4.07Å; M151-V284 HydrophobicContact CE-CB 4.06Å; M151-V284 HydrophobicContact CE-CG1 3.87Å; M151-V284 HydrophobicContact CE-CG2 3.92Å; M151-V284 HydrophobicContact SD-CG2 4.29Å |
| 152 | P | 75.1 | Confident | 78.5 | Confident | 27 Ų | 27 | 41.2 Ų | 41.2 | 18% | 0.175 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -56.9 | -45.9 | 171.3 | -27.9 | 35.2 | 0 | 0 | 0 | 114.9 | A147 L148 A149 L155 Y156 L178 | A147-P152 WeakPolarHBondContact O-CD 3.43Å; L148-P152 WeakPolarHBondContact O-CD 3.16Å; L148-P152 WeakPolarHBondContact O-CG 3.41Å; A149-P152 WeakPolarHBondContact O-CD 3.21Å; P152-L155 PolarHBondContact O-N 3.2Å; P152-Y156 WeakPolarHBondContact O-CB 3.28Å; P152-Y156 PolarHBondContact O-N 3.22Å; P152-L178 HydrophobicContact CB-CB 3.9Å; P152-L178 HydrophobicContact CB-CD1 3.93Å; P152-L178 HydrophobicContact CB-CD2 4.04Å; P152-L178 HydrophobicContact CB-CG 4.17Å; P152-L178 HydrophobicContact CG-CB 4.21Å; P152-L178 HydrophobicContact CG-CD2 4.03Å |
| 153 | L | 80.6 | Confident | 77.6 | Confident | 100 Ų | 100 | 45.2 Ų | 45.2 | 52% | 0.524 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63 | -45.4 | -176.8 | 179.9 | 68.7 | 0 | 0 | 0 | 111.6 | A149 M150 M151 Y156 L157 | A149-L153 VanDerWaalsContact O-CB 3.29Å; A149-L153 WeakPolarHBondContact O-CB 3.48Å; A149-L153 PolarHBondContact O-N 3.24Å; M150-L153 PolarHBondContact O-N 3.46Å; M150-L153 HydrophobicContact SD-CD2 4.37Å; M151-L153 PolarHBondContact O-N 2.94Å; L153-Y156 WeakPolarHBondContact O-CB 3.06Å; L153-Y156 PolarHBondContact O-N 2.77Å; L153-L157 WeakPolarHBondContact O-CB 3.39Å; L153-L157 PolarHBondContact O-N 3.3Å |
| 154 | L | 85.3 | Confident | 76.5 | Confident | 14 Ų | 14 | 50.3 Ų | 50.3 | 7% | 0.073 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -69.9 | -41.3 | -180 | -68.9 | 166.6 | 0 | 0 | 0 | 111.2 | Y86 P90 M150 Y156 L157 Y158 | Y86-L154 HydrophobicContact CD1-CD1 3.54Å; Y86-L154 HydrophobicContact CG-CD1 4.15Å; P90-L154 HydrophobicContact CB-CD1 4.34Å; P90-L154 HydrophobicContact CG-CD1 3.77Å; M150-L154 HydrophobicContact CB-CD1 4.32Å; M150-L154 HydrophobicContact CE-CD1 4.33Å; M150-L154 HydrophobicContact CE-CG 4.5Å; M150-L154 VanDerWaalsContact O-CB 3.28Å; M150-L154 WeakPolarHBondContact O-CB 3.09Å; M150-L154 WeakPolarHBondContact O-CD1 3.08Å; M150-L154 WeakPolarHBondContact O-CG 2.8Å; M150-L154 PolarHBondContact O-N 3.44Å; L154-Y156 VanDerWaalsContact C-N 3.3Å; L154-Y156 PolarHBondContact O-N 2.82Å; L154-L157 PolarHBondContact O-N 2.97Å; L154-Y158 HydrophobicContact CB-CD2 4.28Å; L154-Y158 HydrophobicContact CB-CE2 4.45Å; L154-Y158 HydrophobicContact CD2-CE2 4Å; L154-Y158 WeakPolarHBondContact O-CB 3.06Å; L154-Y158 WeakPolarHBondContact O-CD2 3.29Å; L154-Y158 PolarHBondContact O-N 3.11Å |
| 155 | L | 80.6 | Confident | 75.3 | Confident | 5 Ų | 5 | 49.7 Ų | 49.7 | 3% | 0.026 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -56.6 | -47.7 | 172.1 | -98.3 | 91.2 | 0 | 0 | 0 | 111 | V108 I112 C115 M151 P152 L157 C159 L178 | V108-L155 HydrophobicContact CG1-CD2 4.33Å; I112-L155 HydrophobicContact CD1-CD2 4.24Å; I112-L155 HydrophobicContact CG1-CD1 4.24Å; I112-L155 HydrophobicContact CG1-CD2 3.65Å; I112-L155 HydrophobicContact CG1-CG 4.34Å; C115-L155 HydrophobicContact CB-CD1 3.84Å; M151-L155 HydrophobicContact CG-CD1 3.84Å; M151-L155 WeakPolarHBondContact O-CB 3.39Å; M151-L155 WeakPolarHBondContact O-CD1 3.26Å; M151-L155 PolarHBondContact O-N 3.28Å; P152-L155 PolarHBondContact O-N 3.2Å; L155-L157 PolarHBondContact O-N 3Å; L155-C159 WeakPolarHBondContact O-CB 3.42Å; L155-C159 PolarHBondContact O-N 3.25Å; L155-C159 PolarHBondContact O-SG 2.79Å; L155-L178 HydrophobicContact CB-CD1 4.28Å |
| 156 | Y | 76.8 | Confident | 74 | Confident | 110 Ų | 110 | 52.9 Ų | 52.9 | 43% | 0.431 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -57.7 | -47.4 | 177.1 | 172.9 | -99.8 | 0 | 0 | 0 | 111.9 | P152 L153 L154 H160 V175 | P152-Y156 WeakPolarHBondContact O-CB 3.28Å; P152-Y156 PolarHBondContact O-N 3.22Å; L153-Y156 WeakPolarHBondContact O-CB 3.06Å; L153-Y156 PolarHBondContact O-N 2.77Å; L154-Y156 VanDerWaalsContact C-N 3.3Å; L154-Y156 PolarHBondContact O-N 2.82Å; Y156-H160 PolarHBondContact O-N 3.02Å; Y156-V175 HydrophobicContact CD2-CG2 3.57Å; Y156-V175 HydrophobicContact CE2-CG2 4.08Å; Y156-V175 HydrophobicContact CG-CG2 4.41Å |
| 157 | L | 82.5 | Confident | 72.4 | Confident | 110 Ų | 110 | 59.8 Ų | 59.8 | 58% | 0.576 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -64 | -50.4 | -178.7 | -174.2 | 66.6 | 0 | 0 | 0 | 112.2 | L153 L154 L155 H160 | L153-L157 WeakPolarHBondContact O-CB 3.39Å; L153-L157 PolarHBondContact O-N 3.3Å; L154-L157 PolarHBondContact O-N 2.97Å; L155-L157 PolarHBondContact O-N 3Å; L157-H160 WeakPolarHBondContact O-CB 3.41Å; L157-H160 PolarHBondContact O-N 2.58Å |
| 158 | Y | 82.4 | Confident | 70.9 | Confident | 35 Ų | 35 | 62.8 Ų | 62.8 | 14% | 0.137 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -73.2 | -30.7 | -177.1 | -75.7 | -69.4 | 0 | 0 | 0 | 112.8 | P90 L91 F94 L111 L154 H160 G161 F162 | P90-Y158 HydrophobicContact CB-CD2 4.18Å; P90-Y158 HydrophobicContact CB-CE2 3.53Å; L91-Y158 WeakPolarHBondContact CA-OH 3.36Å; L91-Y158 WeakPolarHBondContact CB-OH 3.35Å; L91-Y158 HydrophobicContact CD1-CE1 4.26Å; L91-Y158 PolarHBondContact N-OH 3.43Å; F94-Y158 HydrophobicContact CB-CD1 3.49Å; F94-Y158 VanDerWaalsContact CB-CD1 3.49Å; F94-Y158 HydrophobicContact CB-CE1 3.65Å; F94-Y158 HydrophobicContact CB-CG 4.27Å; F94-Y158 HydrophobicContact CD1-CD1 4.02Å; F94-Y158 HydrophobicContact CD1-CE1 4.11Å; F94-Y158 AromaticContact CD2-CD1 3.47Å; F94-Y158 HydrophobicContact CD2-CD1 3.47Å; F94-Y158 VanDerWaalsContact CD2-CD1 3.47Å; F94-Y158 HydrophobicContact CD2-CE1 4.32Å; F94-Y158 HydrophobicContact CD2-CG 4.18Å; F94-Y158 HydrophobicContact CE2-CD1 4.14Å; F94-Y158 AromaticContact CG-CD1 3.37Å; F94-Y158 HydrophobicContact CG-CD1 3.37Å; F94-Y158 AromaticContact CG-CE1 3.78Å; F94-Y158 HydrophobicContact CG-CE1 3.78Å; F94-Y158 HydrophobicContact CG-CG 4.36Å; L111-Y158 HydrophobicContact CD2-CG 4.14Å; L154-Y158 HydrophobicContact CB-CD2 4.28Å; L154-Y158 HydrophobicContact CB-CE2 4.45Å; L154-Y158 HydrophobicContact CD2-CE2 4Å; L154-Y158 WeakPolarHBondContact O-CB 3.06Å; L154-Y158 WeakPolarHBondContact O-CD2 3.29Å; L154-Y158 PolarHBondContact O-N 3.11Å; Y158-H160 PolarHBondContact O-N 3.41Å; Y158-G161 PolarHBondContact O-N 2.97Å; Y158-F162 VanDerWaalsContact O-CD2 3.28Å; Y158-F162 WeakPolarHBondContact O-CD2 3.22Å; Y158-F162 WeakPolarHBondContact O-CE2 3.46Å |
| 159 | C | 75.8 | Confident | 69.8 | Low | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -64.7 | -24.7 | 172.7 | -72.4 | 0 | 0 | 0 | 0 | 112.5 | L155 G161 F162 L165 Y171 | L155-C159 WeakPolarHBondContact O-CB 3.42Å; L155-C159 PolarHBondContact O-N 3.25Å; L155-C159 PolarHBondContact O-SG 2.79Å; C159-G161 PolarHBondContact O-N 3.42Å; C159-F162 PolarHBondContact O-N 3.05Å; C159-L165 HydrophobicContact CB-CD2 3.7Å; C159-Y171 HydrophobicContact CB-CE1 4.2Å; C159-Y171 PolarHBondContact O-OH 3.13Å |
| 160 | H | 72.8 | Confident | 68.8 | Low | 111 Ų | 111 | 64 Ų | 64 | 51% | 0.514 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -22.6 | 173.7 | -153.8 | 77.9 | 0 | 0 | 0 | 112.6 | Y156 L157 Y158 F162 | Y156-H160 PolarHBondContact O-N 3.02Å; L157-H160 WeakPolarHBondContact O-CB 3.41Å; L157-H160 PolarHBondContact O-N 2.58Å; Y158-H160 PolarHBondContact O-N 3.41Å; H160-F162 PolarHBondContact O-N 2.88Å |
| 161 | G | 70.9 | Confident | 67.4 | Low | 35 Ų | 35 | 63.4 Ų | 63.4 | 36% | 0.361 | 34% | 0.341 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73 | -3.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | K98 Y158 C159 | K98-G161 VanDerWaalsContact CE-O 3.3Å; K98-G161 WeakPolarHBondContact CE-O 3.2Å; K98-G161 PolarHBondContact NZ-O 3.35Å; Y158-G161 PolarHBondContact O-N 2.97Å; C159-G161 PolarHBondContact O-N 3.42Å |
| 162 | F | 72.7 | Confident | 66.2 | Low | 11 Ų | 11 | 68.1 Ų | 68.1 | 5% | 0.048 | 37% | 0.37 | C | S | . | . | trans | -110.7 | 113.7 | 179.1 | -61.9 | -91.3 | 0 | 0 | 0 | 110.2 | F94 K98 A107 L111 Y158 C159 H160 L165 Y171 | F94-F162 AromaticContact CD2-CE2 3.8Å; F94-F162 HydrophobicContact CD2-CE2 3.8Å; F94-F162 AromaticContact CD2-CZ 4Å; F94-F162 HydrophobicContact CD2-CZ 4Å; F94-F162 HydrophobicContact CE2-CD2 4.34Å; F94-F162 AromaticContact CE2-CE2 3.6Å; F94-F162 HydrophobicContact CE2-CE2 3.6Å; F94-F162 AromaticContact CE2-CZ 3.91Å; F94-F162 HydrophobicContact CE2-CZ 3.91Å; K98-F162 HydrophobicContact CD-CE1 3.95Å; K98-F162 HydrophobicContact CD-CZ 4.38Å; K98-F162 HydrophobicContact CG-CE1 4.43Å; K98-F162 HydrophobicContact CG-CZ 4.44Å; A107-F162 HydrophobicContact CB-CE1 3.85Å; A107-F162 HydrophobicContact CB-CZ 3.91Å; L111-F162 HydrophobicContact CD1-CE2 3.78Å; L111-F162 HydrophobicContact CD1-CZ 4.28Å; Y158-F162 VanDerWaalsContact O-CD2 3.28Å; Y158-F162 WeakPolarHBondContact O-CD2 3.22Å; Y158-F162 WeakPolarHBondContact O-CE2 3.46Å; C159-F162 PolarHBondContact O-N 3.05Å; H160-F162 PolarHBondContact O-N 2.88Å; F162-L165 HydrophobicContact CB-CB 3.92Å; F162-Y171 PolarHBondContact O-OH 3.29Å | ||
| 163 | S | 61.1 | Low | 65.4 | Low | 92 Ų | 92 | 68.2 Ų | 68.2 | 64% | 0.643 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.1 | -25.4 | -170.6 | 49.6 | 0 | 0 | 0 | 0 | 114.7 | ||
| 164 | N | 60.2 | Low | 64.4 | Low | 110 Ų | 110 | 64.5 Ų | 64.5 | 59% | 0.588 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87 | -16.6 | 176.9 | -51.8 | -55.4 | 0 | 0 | 0 | 112.1 | E104 Q166 K167 A168 | E104-N164 VanDerWaalsContact OE1-CA 3.23Å; E104-N164 WeakPolarHBondContact OE1-CA 3.28Å; E104-N164 WeakPolarHBondContact OE1-CB 3.26Å; E104-N164 PolarHBondContact OE1-N 3.19Å; E104-N164 VanDerWaalsContact OE1-N 3.15Å; N164-Q166 PolarHBondContact O-N 2.97Å; N164-K167 PolarHBondContact O-N 3.46Å; N164-A168 PolarHBondContact O-N 3.4Å |
| 165 | L | 54.8 | Low | 63.2 | Low | 4 Ų | 4 | 66.6 Ų | 66.6 | 2% | 0.021 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -63.9 | -29.7 | 177.9 | -152.6 | 81.8 | 0 | 0 | 0 | 111.9 | E104 V108 C159 F162 K167 A168 V169 I174 | E104-L165 HydrophobicContact CB-CD1 3.59Å; E104-L165 HydrophobicContact CG-CD1 4.28Å; E104-L165 PolarHBondContact OE1-N 2.76Å; E104-L165 VanDerWaalsContact OE2-CA 3.28Å; E104-L165 WeakPolarHBondContact OE2-CA 3.01Å; E104-L165 PolarHBondContact OE2-N 3.49Å; V108-L165 HydrophobicContact CG2-CD1 4.36Å; V108-L165 HydrophobicContact CG2-CD2 4.4Å; C159-L165 HydrophobicContact CB-CD2 3.7Å; F162-L165 HydrophobicContact CB-CB 3.92Å; L165-K167 PolarHBondContact O-N 3.29Å; L165-A168 PolarHBondContact O-N 3.08Å; L165-V169 HydrophobicContact CD1-CG2 4.44Å; L165-V169 PolarHBondContact O-N 3.17Å; L165-V169 VanDerWaalsContact O-O 3.09Å; L165-I174 HydrophobicContact CD2-CD1 4.35Å |
| 166 | Q | 47.7 | Very low | 62.4 | Low | 116 Ų | 116 | 70.3 Ų | 70.3 | 54% | 0.542 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -58.7 | -27.6 | 170.8 | -85.6 | -179.5 | -8.1 | 0 | 0 | 114.8 | N164 Y171 | N164-Q166 PolarHBondContact O-N 2.97Å; Q166-Y171 HydrophobicContact CB-CE2 3.91Å; Q166-Y171 HydrophobicContact CG-CD2 3.91Å; Q166-Y171 HydrophobicContact CG-CE2 3.1Å |
| 167 | K | 46.6 | Very low | 61.7 | Low | 202 Ų | 202 | 67.6 Ų | 67.6 | 88% | 0.878 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -94.2 | -24.6 | 176.8 | -71.6 | -178.3 | 177.6 | 178.4 | 0 | 112.8 | N164 L165 | N164-K167 PolarHBondContact O-N 3.46Å; L165-K167 PolarHBondContact O-N 3.29Å |
| 168 | A | 47.7 | Very low | 60.8 | Low | 71 Ų | 71 | 63 Ų | 63 | 59% | 0.587 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -99.3 | -31 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | N164 L165 | N164-A168 PolarHBondContact O-N 3.4Å; L165-A168 PolarHBondContact O-N 3.08Å |
| 169 | V | 50.8 | Low | 60.2 | Low | 43 Ų | 43 | 65 Ų | 65 | 26% | 0.261 | 38% | 0.382 | S | S | . | . | S | Bend | trans | -138.1 | 113.1 | -179.1 | -171.6 | 0 | 0 | 0 | 0 | 109.6 | L165 Y171 I174 | L165-V169 HydrophobicContact CD1-CG2 4.44Å; L165-V169 PolarHBondContact O-N 3.17Å; L165-V169 VanDerWaalsContact O-O 3.09Å; V169-Y171 PolarHBondContact O-N 2.97Å; V169-Y171 VanDerWaalsContact O-N 3.1Å; V169-I174 HydrophobicContact CB-CD1 4.31Å; V169-I174 HydrophobicContact CG1-CD1 3.73Å; V169-I174 HydrophobicContact CG1-CG1 3.6Å |
| 170 | P | 55.6 | Low | 59.8 | Low | 90 Ų | 90 | 67.7 Ų | 67.7 | 58% | 0.584 | 40% | 0.403 | S | S | * | . | trans | -61.2 | 120.8 | 179.1 | 23.6 | -30.9 | 0 | 0 | 0 | 109.1 | V172 G173 I174 | P170-V172 PolarHBondContact O-N 3.46Å; P170-V172 VanDerWaalsContact O-N 3.1Å; P170-G173 VanDerWaalsContact O-CA 3.29Å; P170-G173 WeakPolarHBondContact O-CA 3.15Å; P170-G173 PolarHBondContact O-N 2.94Å; P170-I174 PolarHBondContact O-N 3.44Å | ||
| 171 | Y | 54.2 | Low | 59.6 | Low | 35 Ų | 35 | 63.2 Ų | 63.2 | 14% | 0.137 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -53 | -33.9 | 179.4 | -76.1 | -97.3 | 0 | 0 | 0 | 112.5 | C159 F162 Q166 V169 G173 I174 V175 | C159-Y171 HydrophobicContact CB-CE1 4.2Å; C159-Y171 PolarHBondContact O-OH 3.13Å; F162-Y171 PolarHBondContact O-OH 3.29Å; Q166-Y171 HydrophobicContact CB-CE2 3.91Å; Q166-Y171 HydrophobicContact CG-CD2 3.91Å; Q166-Y171 HydrophobicContact CG-CE2 3.1Å; V169-Y171 PolarHBondContact O-N 2.97Å; V169-Y171 VanDerWaalsContact O-N 3.1Å; Y171-G173 VanDerWaalsContact C-N 3.29Å; Y171-G173 PolarHBondContact O-N 2.88Å; Y171-I174 PolarHBondContact O-N 3.45Å; Y171-V175 WeakPolarHBondContact O-CG2 3.3Å; Y171-V175 PolarHBondContact O-N 3.26Å |
| 172 | V | 56.4 | Low | 59.7 | Low | 109 Ų | 109 | 64.5 Ų | 64.5 | 66% | 0.661 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -59.7 | -40.6 | 172.8 | -178.1 | 0 | 0 | 0 | 0 | 110.8 | P170 V175 T176 | P170-V172 PolarHBondContact O-N 3.46Å; P170-V172 VanDerWaalsContact O-N 3.1Å; V172-V175 PolarHBondContact O-N 3.38Å; V172-T176 VanDerWaalsContact O-CB 3.28Å; V172-T176 WeakPolarHBondContact O-CB 3.41Å; V172-T176 PolarHBondContact O-N 3.19Å; V172-T176 PolarHBondContact O-OG1 3.21Å |
| 173 | G | 58.8 | Low | 60.1 | Low | 29 Ų | 29 | 68.7 Ų | 68.7 | 30% | 0.299 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | P170 Y171 T176 S177 | P170-G173 VanDerWaalsContact O-CA 3.29Å; P170-G173 WeakPolarHBondContact O-CA 3.15Å; P170-G173 PolarHBondContact O-N 2.94Å; Y171-G173 VanDerWaalsContact C-N 3.29Å; Y171-G173 PolarHBondContact O-N 2.88Å; G173-T176 PolarHBondContact O-N 2.8Å; G173-S177 VanDerWaalsContact O-CB 3.26Å; G173-S177 WeakPolarHBondContact O-CB 3.32Å; G173-S177 PolarHBondContact O-N 3.43Å; G173-S177 PolarHBondContact O-OG 3.39Å |
| 174 | I | 59.1 | Low | 61 | Low | 23 Ų | 23 | 64.8 Ų | 64.8 | 12% | 0.118 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 176.4 | -61.9 | 174.4 | 0 | 0 | 0 | 110.6 | L165 V169 P170 Y171 S177 L178 | L165-I174 HydrophobicContact CD2-CD1 4.35Å; V169-I174 HydrophobicContact CB-CD1 4.31Å; V169-I174 HydrophobicContact CG1-CD1 3.73Å; V169-I174 HydrophobicContact CG1-CG1 3.6Å; P170-I174 PolarHBondContact O-N 3.44Å; Y171-I174 PolarHBondContact O-N 3.45Å; I174-S177 PolarHBondContact O-N 2.88Å; I174-L178 HydrophobicContact CG2-CD1 3.73Å; I174-L178 HydrophobicContact CG2-CG 4.46Å; I174-L178 WeakPolarHBondContact O-CB 3.34Å; I174-L178 WeakPolarHBondContact O-CD1 3.31Å; I174-L178 VanDerWaalsContact O-CG 3.24Å; I174-L178 WeakPolarHBondContact O-CG 2.9Å; I174-L178 PolarHBondContact O-N 3Å |
| 175 | V | 59.9 | Low | 61.7 | Low | 57 Ų | 57 | 59.8 Ų | 59.8 | 35% | 0.345 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -63.9 | -42.5 | 178 | 175.7 | 0 | 0 | 0 | 0 | 111.1 | Y156 Y171 V172 L178 V179 | Y156-V175 HydrophobicContact CD2-CG2 3.57Å; Y156-V175 HydrophobicContact CE2-CG2 4.08Å; Y156-V175 HydrophobicContact CG-CG2 4.41Å; Y171-V175 WeakPolarHBondContact O-CG2 3.3Å; Y171-V175 PolarHBondContact O-N 3.26Å; V172-V175 PolarHBondContact O-N 3.38Å; V175-L178 PolarHBondContact O-N 3.29Å; V175-V179 WeakPolarHBondContact O-CG2 3.35Å; V175-V179 PolarHBondContact O-N 2.87Å |
| 176 | T | 64.6 | Low | 62.8 | Low | 84 Ų | 84 | 61 Ų | 61 | 52% | 0.515 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66 | -41.6 | 178.4 | -47.7 | 0 | 0 | 0 | 0 | 111 | V172 G173 V179 A180 | V172-T176 VanDerWaalsContact O-CB 3.28Å; V172-T176 WeakPolarHBondContact O-CB 3.41Å; V172-T176 PolarHBondContact O-N 3.19Å; V172-T176 PolarHBondContact O-OG1 3.21Å; G173-T176 PolarHBondContact O-N 2.8Å; T176-V179 PolarHBondContact O-N 3.32Å; T176-A180 VanDerWaalsContact O-CB 3.26Å; T176-A180 WeakPolarHBondContact O-CB 3.21Å; T176-A180 PolarHBondContact O-N 3.4Å |
| 177 | S | 61.6 | Low | 64.5 | Low | 52 Ų | 52 | 57.6 Ų | 57.6 | 36% | 0.364 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -62.5 | -41.9 | 173.4 | -68.3 | 0 | 0 | 0 | 0 | 111.6 | G173 I174 A180 I181 | G173-S177 VanDerWaalsContact O-CB 3.26Å; G173-S177 WeakPolarHBondContact O-CB 3.32Å; G173-S177 PolarHBondContact O-N 3.43Å; G173-S177 PolarHBondContact O-OG 3.39Å; I174-S177 PolarHBondContact O-N 2.88Å; S177-A180 CarbonylContact O-C 3.41Å; S177-A180 PolarHBondContact O-N 3.49Å; S177-I181 WeakPolarHBondContact O-CD1 3.22Å; S177-I181 WeakPolarHBondContact O-CG1 3.14Å; S177-I181 PolarHBondContact O-N 2.9Å |
| 178 | L | 64.1 | Low | 66.2 | Low | 13 Ų | 13 | 48 Ų | 48 | 7% | 0.068 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -65.4 | -40.3 | 176.8 | -75.4 | 161.4 | 0 | 0 | 0 | 112.4 | P152 L155 I174 V175 I181 L182 | P152-L178 HydrophobicContact CB-CB 3.9Å; P152-L178 HydrophobicContact CB-CD1 3.93Å; P152-L178 HydrophobicContact CB-CD2 4.04Å; P152-L178 HydrophobicContact CB-CG 4.17Å; P152-L178 HydrophobicContact CG-CB 4.21Å; P152-L178 HydrophobicContact CG-CD2 4.03Å; L155-L178 HydrophobicContact CB-CD1 4.28Å; I174-L178 HydrophobicContact CG2-CD1 3.73Å; I174-L178 HydrophobicContact CG2-CG 4.46Å; I174-L178 WeakPolarHBondContact O-CB 3.34Å; I174-L178 WeakPolarHBondContact O-CD1 3.31Å; I174-L178 VanDerWaalsContact O-CG 3.24Å; I174-L178 WeakPolarHBondContact O-CG 2.9Å; I174-L178 PolarHBondContact O-N 3Å; V175-L178 PolarHBondContact O-N 3.29Å; L178-I181 WeakPolarHBondContact O-CB 3.08Å; L178-I181 PolarHBondContact O-N 2.91Å; L178-L182 WeakPolarHBondContact O-CB 3.42Å; L178-L182 PolarHBondContact O-N 3.28Å |
| 179 | V | 68.2 | Low | 67.7 | Low | 79 Ų | 79 | 45.6 Ų | 45.6 | 48% | 0.479 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.6 | -41.3 | 172.8 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | V175 T176 I181 L182 V183 | V175-V179 WeakPolarHBondContact O-CG2 3.35Å; V175-V179 PolarHBondContact O-N 2.87Å; T176-V179 PolarHBondContact O-N 3.32Å; V179-I181 PolarHBondContact O-N 3.33Å; V179-L182 WeakPolarHBondContact O-CB 3.43Å; V179-L182 PolarHBondContact O-N 2.9Å; V179-L182 VanDerWaalsContact O-N 3.09Å; V179-V183 WeakPolarHBondContact O-CG2 3.41Å; V179-V183 PolarHBondContact O-N 3.21Å; V179-V183 VanDerWaalsContact O-N 3.1Å |
| 180 | A | 67.6 | Low | 69.2 | Low | 55 Ų | 55 | 48.2 Ų | 48.2 | 46% | 0.455 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.2 | -25.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | T176 S177 P184 | T176-A180 VanDerWaalsContact O-CB 3.26Å; T176-A180 WeakPolarHBondContact O-CB 3.21Å; T176-A180 PolarHBondContact O-N 3.4Å; S177-A180 CarbonylContact O-C 3.41Å; S177-A180 PolarHBondContact O-N 3.49Å; A180-P184 WeakPolarHBondContact O-CD 3.38Å; A180-P184 WeakPolarHBondContact O-CG 3.1Å |
| 181 | I | 70 | Confident | 70.6 | Confident | 17 Ų | 17 | 46.6 Ų | 46.6 | 9% | 0.087 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -78.4 | -40.5 | 171 | -70.8 | 165.4 | 0 | 0 | 0 | 111.1 | M56 S177 L178 V179 P184 C185 V287 A288 | M56-I181 HydrophobicContact CE-CB 4.46Å; M56-I181 HydrophobicContact CE-CD1 4.48Å; M56-I181 HydrophobicContact CE-CG1 4.1Å; M56-I181 HydrophobicContact CE-CG2 3.69Å; M56-I181 HydrophobicContact CG-CG2 4.41Å; M56-I181 HydrophobicContact SD-CG2 3.65Å; S177-I181 WeakPolarHBondContact O-CD1 3.22Å; S177-I181 WeakPolarHBondContact O-CG1 3.14Å; S177-I181 PolarHBondContact O-N 2.9Å; L178-I181 WeakPolarHBondContact O-CB 3.08Å; L178-I181 PolarHBondContact O-N 2.91Å; V179-I181 PolarHBondContact O-N 3.33Å; I181-P184 WeakPolarHBondContact O-CD 3.36Å; I181-P184 WeakPolarHBondContact O-CG 3.34Å; I181-C185 VanDerWaalsContact O-CB 3.28Å; I181-C185 WeakPolarHBondContact O-CB 3.21Å; I181-C185 PolarHBondContact O-N 3.28Å; I181-V287 HydrophobicContact CD1-CG1 3.61Å; I181-V287 HydrophobicContact CG1-CG1 3.49Å; I181-V287 VanDerWaalsContact CG1-CG1 3.49Å; I181-A288 HydrophobicContact CD1-CB 4.46Å |
| 182 | L | 71.7 | Confident | 72 | Confident | 62 Ų | 62 | 46.1 Ų | 46.1 | 33% | 0.325 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -66 | -41.3 | -174.7 | -175.9 | 57.9 | 0 | 0 | 0 | 112.9 | L148 L178 V179 C185 G186 | L148-L182 HydrophobicContact CB-CD1 3.59Å; L148-L182 HydrophobicContact CD2-CD1 3.94Å; L148-L182 HydrophobicContact CG-CD1 4.26Å; L148-L182 WeakPolarHBondContact O-CD1 3.28Å; L178-L182 WeakPolarHBondContact O-CB 3.42Å; L178-L182 PolarHBondContact O-N 3.28Å; V179-L182 WeakPolarHBondContact O-CB 3.43Å; V179-L182 PolarHBondContact O-N 2.9Å; V179-L182 VanDerWaalsContact O-N 3.09Å; L182-C185 PolarHBondContact O-N 2.85Å; L182-G186 PolarHBondContact O-N 2.58Å |
| 183 | V | 80.7 | Confident | 73.2 | Confident | 100 Ų | 100 | 47.1 Ų | 47.1 | 61% | 0.606 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -59.3 | -56.9 | -179.1 | 173.1 | 0 | 0 | 0 | 0 | 112.9 | V179 C185 G186 A187 | V179-V183 WeakPolarHBondContact O-CG2 3.41Å; V179-V183 PolarHBondContact O-N 3.21Å; V179-V183 VanDerWaalsContact O-N 3.1Å; V183-C185 VanDerWaalsContact C-N 3.3Å; V183-C185 PolarHBondContact O-N 3.46Å; V183-G186 PolarHBondContact O-N 2.84Å; V183-A187 PolarHBondContact O-N 3.45Å |
| 184 | P | 79.9 | Confident | 74.5 | Confident | 10 Ų | 10 | 51.4 Ų | 51.4 | 7% | 0.065 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.9 | -32.7 | 177.7 | 24.4 | -32.9 | 0 | 0 | 0 | 112.4 | L53 M56 V57 A180 I181 A187 G188 | L53-P184 HydrophobicContact CD2-CB 3.9Å; L53-P184 HydrophobicContact CD2-CG 4.02Å; M56-P184 HydrophobicContact CB-CB 3.82Å; M56-P184 HydrophobicContact CB-CG 3.65Å; M56-P184 HydrophobicContact CG-CG 4.31Å; V57-P184 WeakPolarHBondContact CA-O 3.34Å; V57-P184 HydrophobicContact CG2-CB 3.98Å; V57-P184 WeakPolarHBondContact CG2-O 3.19Å; A180-P184 WeakPolarHBondContact O-CD 3.38Å; A180-P184 WeakPolarHBondContact O-CG 3.1Å; I181-P184 WeakPolarHBondContact O-CD 3.36Å; I181-P184 WeakPolarHBondContact O-CG 3.34Å; P184-A187 PolarHBondContact O-N 3.4Å; P184-G188 PolarHBondContact O-N 2.71Å |
| 185 | C | 75.7 | Confident | 75.8 | Confident | 5 Ų | 5 | 57.9 Ų | 57.9 | 3% | 0.034 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.7 | -48.7 | 173.9 | -168.3 | 0 | 0 | 0 | 0 | 111.4 | M56 G60 L148 I181 L182 V183 A187 G188 I189 | M56-C185 WeakPolarHBondContact O-CA 3.45Å; G60-C185 WeakPolarHBondContact CA-O 3.39Å; L148-C185 HydrophobicContact CD2-CB 4.2Å; L148-C185 WeakPolarHBondContact CD2-SG 3.15Å; I181-C185 VanDerWaalsContact O-CB 3.28Å; I181-C185 WeakPolarHBondContact O-CB 3.21Å; I181-C185 PolarHBondContact O-N 3.28Å; L182-C185 PolarHBondContact O-N 2.85Å; V183-C185 VanDerWaalsContact C-N 3.3Å; V183-C185 PolarHBondContact O-N 3.46Å; C185-A187 VanDerWaalsContact C-N 3.29Å; C185-A187 PolarHBondContact O-N 2.83Å; C185-G188 WeakPolarHBondContact O-CA 3.32Å; C185-G188 PolarHBondContact O-N 3.26Å; C185-I189 WeakPolarHBondContact O-CG1 3.33Å; C185-I189 PolarHBondContact O-N 2.88Å |
| 186 | G | 76.9 | Confident | 76.8 | Confident | 30 Ų | 30 | 58.4 Ų | 58.4 | 31% | 0.309 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -58.4 | -39 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L182 V183 G188 I189 L190 | L182-G186 PolarHBondContact O-N 2.58Å; V183-G186 PolarHBondContact O-N 2.84Å; G186-G188 PolarHBondContact O-N 3.37Å; G186-I189 WeakPolarHBondContact O-CB 3.5Å; G186-I189 PolarHBondContact O-N 3.28Å; G186-L190 PolarHBondContact O-N 2.93Å |
| 187 | A | 84.1 | Confident | 77.7 | Confident | 44 Ų | 44 | 61.8 Ų | 61.8 | 36% | 0.364 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.5 | -42.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112 | V183 P184 C185 I189 L190 I191 | V183-A187 PolarHBondContact O-N 3.45Å; P184-A187 PolarHBondContact O-N 3.4Å; C185-A187 VanDerWaalsContact C-N 3.29Å; C185-A187 PolarHBondContact O-N 2.83Å; A187-I189 VanDerWaalsContact C-N 3.34Å; A187-I189 PolarHBondContact O-N 3.04Å; A187-L190 WeakPolarHBondContact O-CB 3.35Å; A187-L190 PolarHBondContact O-N 3.05Å; A187-I191 VanDerWaalsContact O-CG1 3.3Å; A187-I191 WeakPolarHBondContact O-CG1 3.48Å; A187-I191 PolarHBondContact O-N 3.43Å |
| 188 | G | 82.8 | Confident | 78.8 | Confident | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.4 | -41.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | V57 C61 P184 C185 G186 L190 I191 N192 | V57-G188 WeakPolarHBondContact O-CA 3.35Å; C61-G188 PolarHBondContact SG-O 3.28Å; P184-G188 PolarHBondContact O-N 2.71Å; C185-G188 WeakPolarHBondContact O-CA 3.32Å; C185-G188 PolarHBondContact O-N 3.26Å; G186-G188 PolarHBondContact O-N 3.37Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-I191 PolarHBondContact O-N 2.66Å; G188-N192 PolarHBondContact O-N 3.23Å |
| 189 | I | 78.4 | Confident | 79.6 | Confident | 20 Ų | 20 | 65.5 Ų | 65.5 | 10% | 0.103 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.1 | -44.1 | 175.8 | -61.2 | 171.5 | 0 | 0 | 0 | 110.8 | G60 M63 V65 L145 L148 C185 G186 A187 I191 N192 Y193 | G60-I189 WeakPolarHBondContact O-CA 3.44Å; G60-I189 WeakPolarHBondContact O-CG1 3.47Å; G60-I189 PolarHBondContact O-N 3.44Å; M63-I189 HydrophobicContact CB-CG1 4.15Å; M63-I189 HydrophobicContact CE-CD1 4Å; M63-I189 HydrophobicContact CG-CG1 4.19Å; M63-I189 HydrophobicContact SD-CD1 3.25Å; M63-I189 WeakPolarHBondContact SD-CD1 3.44Å; M63-I189 HydrophobicContact SD-CG1 3.34Å; M63-I189 WeakPolarHBondContact SD-CG1 3.28Å; V65-I189 HydrophobicContact CG2-CG2 3.44Å; V65-I189 VanDerWaalsContact CG2-CG2 3.44Å; L145-I189 HydrophobicContact CD2-CD1 4.47Å; L148-I189 HydrophobicContact CD1-CD1 3.15Å; L148-I189 HydrophobicContact CD2-CD1 3.98Å; L148-I189 HydrophobicContact CG-CD1 4.07Å; C185-I189 WeakPolarHBondContact O-CG1 3.33Å; C185-I189 PolarHBondContact O-N 2.88Å; G186-I189 WeakPolarHBondContact O-CB 3.5Å; G186-I189 PolarHBondContact O-N 3.28Å; A187-I189 VanDerWaalsContact C-N 3.34Å; A187-I189 PolarHBondContact O-N 3.04Å; I189-I191 VanDerWaalsContact C-N 3.31Å; I189-I191 PolarHBondContact O-N 3.15Å; I189-N192 WeakPolarHBondContact O-CB 3.47Å; I189-N192 PolarHBondContact O-N 2.74Å; I189-N192 VanDerWaalsContact O-N 3.15Å; I189-Y193 WeakPolarHBondContact O-CB 3.25Å; I189-Y193 PolarHBondContact O-N 3.1Å |
| 190 | L | 83.4 | Confident | 80.2 | Confident | 98 Ų | 98 | 69.5 Ų | 69.5 | 51% | 0.513 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.8 | -40.5 | 179.6 | -160.1 | 63.8 | 0 | 0 | 0 | 111.4 | G186 A187 G188 Y193 F194 | G186-L190 PolarHBondContact O-N 2.93Å; A187-L190 WeakPolarHBondContact O-CB 3.35Å; A187-L190 PolarHBondContact O-N 3.05Å; G188-L190 VanDerWaalsContact C-N 3.34Å; L190-Y193 PolarHBondContact O-N 3.1Å; L190-F194 HydrophobicContact CD1-CD2 3.85Å; L190-F194 HydrophobicContact CD1-CE2 3.37Å; L190-F194 HydrophobicContact CD1-CZ 4.4Å; L190-F194 HydrophobicContact CD2-CE2 4.45Å; L190-F194 HydrophobicContact CG-CD2 3.81Å; L190-F194 HydrophobicContact CG-CE2 3.74Å; L190-F194 WeakPolarHBondContact O-CD2 3.44Å; L190-F194 PolarHBondContact O-N 2.87Å |
| 191 | I | 85.4 | Confident | 81.1 | Confident | 56 Ų | 56 | 72 Ų | 72 | 29% | 0.287 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.6 | -45.4 | 172.7 | -68.1 | 163.9 | 0 | 0 | 0 | 110.4 | V57 A187 G188 I189 Y193 R195 I202 | V57-I191 HydrophobicContact CG1-CD1 3.88Å; A187-I191 VanDerWaalsContact O-CG1 3.3Å; A187-I191 WeakPolarHBondContact O-CG1 3.48Å; A187-I191 PolarHBondContact O-N 3.43Å; G188-I191 PolarHBondContact O-N 2.66Å; I189-I191 VanDerWaalsContact C-N 3.31Å; I189-I191 PolarHBondContact O-N 3.15Å; I191-Y193 VanDerWaalsContact C-N 3.29Å; I191-Y193 PolarHBondContact O-N 3.01Å; I191-R195 CarbonylContact O-C 3.59Å; I191-R195 VanDerWaalsContact O-CA 3.28Å; I191-R195 WeakPolarHBondContact O-CA 3.39Å; I191-R195 PolarHBondContact O-N 3.29Å; I191-I202 HydrophobicContact CD1-CD1 4.36Å; I191-I202 HydrophobicContact CG2-CD1 3.92Å |
| 192 | N | 83.7 | Confident | 81.8 | Confident | 26 Ų | 26 | 73.3 Ų | 73.3 | 14% | 0.139 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.6 | -37.8 | 177.6 | -164.3 | 41.8 | 0 | 0 | 0 | 112.6 | C61 M63 G188 I189 S199 | C61-N192 PolarHBondContact O-ND2 3.3Å; C61-N192 PolarHBondContact O-OD1 3.27Å; M63-N192 PolarHBondContact O-ND2 3.32Å; G188-N192 PolarHBondContact O-N 3.23Å; I189-N192 WeakPolarHBondContact O-CB 3.47Å; I189-N192 PolarHBondContact O-N 2.74Å; I189-N192 VanDerWaalsContact O-N 3.15Å; N192-S199 WeakPolarHBondContact OD1-CB 3.48Å; N192-S199 PolarHBondContact OD1-OG 3.26Å |
| 193 | Y | 80.6 | Confident | 82.2 | Confident | 129 Ų | 129 | 71.7 Ų | 71.7 | 51% | 0.506 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -68.2 | -49.8 | 179.9 | -176.4 | -101.3 | 0 | 0 | 0 | 112.5 | V65 I189 L190 I191 | V65-Y193 HydrophobicContact CB-CD2 4.2Å; V65-Y193 HydrophobicContact CG1-CD2 4.15Å; I189-Y193 WeakPolarHBondContact O-CB 3.25Å; I189-Y193 PolarHBondContact O-N 3.1Å; L190-Y193 PolarHBondContact O-N 3.1Å; I191-Y193 VanDerWaalsContact C-N 3.29Å; I191-Y193 PolarHBondContact O-N 3.01Å |
| 194 | F | 85.4 | Confident | 82.3 | Confident | 120 Ų | 120 | 74.5 Ų | 74.5 | 53% | 0.526 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -86.7 | -25.8 | -176.1 | -70.9 | -62.8 | 0 | 0 | 0 | 114.3 | L190 | L190-F194 HydrophobicContact CD1-CD2 3.85Å; L190-F194 HydrophobicContact CD1-CE2 3.37Å; L190-F194 HydrophobicContact CD1-CZ 4.4Å; L190-F194 HydrophobicContact CD2-CE2 4.45Å; L190-F194 HydrophobicContact CG-CD2 3.81Å; L190-F194 HydrophobicContact CG-CE2 3.74Å; L190-F194 WeakPolarHBondContact O-CD2 3.44Å; L190-F194 PolarHBondContact O-N 2.87Å |
| 195 | R | 86.7 | Confident | 82.5 | Confident | 158 Ų | 158 | 77.7 Ų | 77.7 | 60% | 0.596 | 38% | 0.378 | S | S | * | . | trans | -146.4 | 62.7 | -168.1 | -70 | -61.3 | -176 | -96.1 | 2.5 | 111.4 | I191 Q197 Y198 S199 | I191-R195 CarbonylContact O-C 3.59Å; I191-R195 VanDerWaalsContact O-CA 3.28Å; I191-R195 WeakPolarHBondContact O-CA 3.39Å; I191-R195 PolarHBondContact O-N 3.29Å; R195-Q197 PolarHBondContact O-N 2.89Å; R195-Y198 HydrophobicContact CB-CD2 3.96Å; R195-Y198 PolarHBondContact O-N 2.83Å; R195-S199 PolarHBondContact O-N 3Å | ||
| 196 | P | 81.2 | Confident | 82.6 | Confident | 68 Ų | 68 | 77.5 Ų | 77.5 | 44% | 0.442 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.5 | -22.3 | -175 | 23.9 | -34.9 | 0 | 0 | 0 | 114.2 | S199 K200 | P196-S199 PolarHBondContact O-N 3.04Å; P196-K200 PolarHBondContact O-N 3.3Å |
| 197 | Q | 83.6 | Confident | 82.6 | Confident | 156 Ų | 156 | 79.2 Ų | 79.2 | 73% | 0.729 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -63.2 | -41.1 | 176.2 | -62.5 | 178.6 | 4 | 0 | 0 | 112.2 | R195 | R195-Q197 PolarHBondContact O-N 2.89Å |
| 198 | Y | 83.9 | Confident | 82.5 | Confident | 139 Ų | 139 | 80.4 Ų | 80.4 | 55% | 0.545 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -76.4 | -34.4 | 178.7 | -68.2 | -86.6 | 0 | 0 | 0 | 111.7 | R195 K200 I201 I202 | R195-Y198 HydrophobicContact CB-CD2 3.96Å; R195-Y198 PolarHBondContact O-N 2.83Å; Y198-K200 VanDerWaalsContact C-N 3.26Å; Y198-K200 PolarHBondContact O-N 3.47Å; Y198-I201 PolarHBondContact O-N 3.48Å; Y198-I202 WeakPolarHBondContact O-CG1 3.47Å; Y198-I202 PolarHBondContact O-N 3.44Å |
| 199 | S | 81.9 | Confident | 82.3 | Confident | 3 Ų | 3 | 82 Ų | 82 | 2% | 0.021 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -53.6 | -41.5 | 175.8 | 159.2 | 0 | 0 | 0 | 0 | 112.7 | C61 N192 R195 P196 I201 I202 T203 | C61-S199 VanDerWaalsContact CB-OG 3.31Å; C61-S199 WeakPolarHBondContact CB-OG 3.41Å; C61-S199 PolarHBondContact O-OG 3.26Å; N192-S199 WeakPolarHBondContact OD1-CB 3.48Å; N192-S199 PolarHBondContact OD1-OG 3.26Å; R195-S199 PolarHBondContact O-N 3Å; P196-S199 PolarHBondContact O-N 3.04Å; S199-I201 VanDerWaalsContact C-N 3.33Å; S199-I201 PolarHBondContact O-N 3.33Å; S199-I202 PolarHBondContact O-N 2.87Å; S199-T203 VanDerWaalsContact O-CB 3.26Å; S199-T203 WeakPolarHBondContact O-CB 3.34Å; S199-T203 PolarHBondContact O-N 3.46Å; S199-T203 PolarHBondContact O-OG1 3.18Å |
| 200 | K | 81.5 | Confident | 82 | Confident | 163 Ų | 163 | 81.6 Ų | 81.6 | 71% | 0.709 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -61 | -40.8 | 177.2 | -67.8 | -177.5 | -178.8 | -177.7 | 0 | 112.7 | P196 Y198 K204 | P196-K200 PolarHBondContact O-N 3.3Å; Y198-K200 VanDerWaalsContact C-N 3.26Å; Y198-K200 PolarHBondContact O-N 3.47Å; K200-K204 WeakPolarHBondContact O-CB 3.38Å; K200-K204 PolarHBondContact O-N 2.95Å; K200-K204 VanDerWaalsContact O-N 3.13Å |
| 201 | I | 85.9 | Confident | 81.5 | Confident | 107 Ų | 107 | 82 Ų | 82 | 55% | 0.549 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -68.7 | -49.5 | 179 | -61.2 | 169.5 | 0 | 0 | 0 | 109.5 | Y198 S199 T203 K204 V205 | Y198-I201 PolarHBondContact O-N 3.48Å; S199-I201 VanDerWaalsContact C-N 3.33Å; S199-I201 PolarHBondContact O-N 3.33Å; I201-T203 VanDerWaalsContact C-N 3.3Å; I201-T203 PolarHBondContact O-N 3.41Å; I201-K204 PolarHBondContact O-N 3.33Å; I201-V205 HydrophobicContact CG2-CG2 4.47Å; I201-V205 WeakPolarHBondContact O-CG2 3.29Å; I201-V205 PolarHBondContact O-N 2.95Å |
| 202 | I | 83.8 | Confident | 81.2 | Confident | 46 Ų | 46 | 84.3 Ų | 84.3 | 24% | 0.236 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -60 | -42.8 | 179.9 | -63.1 | 165.9 | 0 | 0 | 0 | 110.6 | V57 S58 I191 Y198 S199 K204 V205 G206 | V57-I202 HydrophobicContact CG1-CG2 4.05Å; S58-I202 PolarHBondContact OG-O 3.18Å; I191-I202 HydrophobicContact CD1-CD1 4.36Å; I191-I202 HydrophobicContact CG2-CD1 3.92Å; Y198-I202 WeakPolarHBondContact O-CG1 3.47Å; Y198-I202 PolarHBondContact O-N 3.44Å; S199-I202 PolarHBondContact O-N 2.87Å; I202-K204 PolarHBondContact O-N 3.15Å; I202-V205 PolarHBondContact O-N 3.16Å; I202-G206 PolarHBondContact O-N 2.93Å |
| 203 | T | 80.9 | Confident | 80.6 | Confident | 28 Ų | 28 | 84.6 Ų | 84.6 | 17% | 0.172 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -58.7 | -47.8 | 176 | -61.3 | 0 | 0 | 0 | 0 | 111.5 | S58 C61 T62 S199 I201 V205 G206 L207 | S58-T203 WeakPolarHBondContact OG-CA 3.4Å; S58-T203 PolarHBondContact OG-O 2.82Å; C61-T203 WeakPolarHBondContact CB-OG1 3.3Å; T62-T203 HydrophobicContact CG2-CG2 3.55Å; S199-T203 VanDerWaalsContact O-CB 3.26Å; S199-T203 WeakPolarHBondContact O-CB 3.34Å; S199-T203 PolarHBondContact O-N 3.46Å; S199-T203 PolarHBondContact O-OG1 3.18Å; I201-T203 VanDerWaalsContact C-N 3.3Å; I201-T203 PolarHBondContact O-N 3.41Å; T203-V205 PolarHBondContact O-N 3.01Å; T203-G206 PolarHBondContact O-N 3.09Å; T203-L207 VanDerWaalsContact O-CB 3.26Å; T203-L207 WeakPolarHBondContact O-CB 3.24Å; T203-L207 PolarHBondContact O-N 3.21Å |
| 204 | K | 82.6 | Confident | 80 | Confident | 158 Ų | 158 | 79.3 Ų | 79.3 | 69% | 0.687 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -63.9 | -43.4 | -179.4 | -170.3 | 173.9 | -177.1 | 178.8 | 0 | 111.5 | K200 I201 I202 C208 | K200-K204 WeakPolarHBondContact O-CB 3.38Å; K200-K204 PolarHBondContact O-N 2.95Å; K200-K204 VanDerWaalsContact O-N 3.13Å; I201-K204 PolarHBondContact O-N 3.33Å; I202-K204 PolarHBondContact O-N 3.15Å; K204-C208 PolarHBondContact O-N 3.37Å |
| 205 | V | 84.4 | Confident | 79.5 | Confident | 77 Ų | 77 | 78.6 Ų | 78.6 | 47% | 0.467 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.3 | -49.6 | 177.4 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | I201 I202 T203 L207 C208 V209 | I201-V205 HydrophobicContact CG2-CG2 4.47Å; I201-V205 WeakPolarHBondContact O-CG2 3.29Å; I201-V205 PolarHBondContact O-N 2.95Å; I202-V205 PolarHBondContact O-N 3.16Å; T203-V205 PolarHBondContact O-N 3.01Å; V205-L207 VanDerWaalsContact C-N 3.31Å; V205-L207 PolarHBondContact O-N 3.46Å; V205-C208 WeakPolarHBondContact O-CB 3.13Å; V205-C208 PolarHBondContact O-N 2.84Å; V205-V209 HydrophobicContact CG1-CG2 4.41Å; V205-V209 WeakPolarHBondContact O-CG2 3.49Å; V205-V209 PolarHBondContact O-N 3.37Å |
| 206 | G | 78.4 | Confident | 78.8 | Confident | 2 Ų | 2 | 74.6 Ų | 74.6 | 2% | 0.021 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.6 | -34.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S58 I202 T203 V209 L210 | S58-G206 WeakPolarHBondContact OG-CA 3.14Å; I202-G206 PolarHBondContact O-N 2.93Å; T203-G206 PolarHBondContact O-N 3.09Å; G206-V209 PolarHBondContact O-N 2.88Å; G206-L210 VanDerWaalsContact O-CB 3.3Å; G206-L210 WeakPolarHBondContact O-CB 3.15Å; G206-L210 PolarHBondContact O-N 3.1Å |
| 207 | L | 76.6 | Confident | 78 | Confident | 65 Ų | 65 | 73 Ų | 73 | 34% | 0.34 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -68.7 | -41.5 | 174.1 | -156.7 | 148.4 | 0 | 0 | 0 | 111.7 | T203 V205 L210 M211 | T203-L207 VanDerWaalsContact O-CB 3.26Å; T203-L207 WeakPolarHBondContact O-CB 3.24Å; T203-L207 PolarHBondContact O-N 3.21Å; V205-L207 VanDerWaalsContact C-N 3.31Å; V205-L207 PolarHBondContact O-N 3.46Å; L207-L210 PolarHBondContact O-N 3.07Å; L207-M211 HydrophobicContact CD2-CG 4.14Å; L207-M211 WeakPolarHBondContact O-CB 3.28Å; L207-M211 VanDerWaalsContact O-CG 3.27Å; L207-M211 WeakPolarHBondContact O-CG 3.23Å; L207-M211 PolarHBondContact O-N 3.41Å |
| 208 | C | 81.1 | Confident | 77.1 | Confident | 70 Ų | 70 | 66.7 Ų | 66.7 | 47% | 0.473 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -58.5 | -48.4 | 170.7 | -87.4 | 0 | 0 | 0 | 0 | 111.8 | K204 V205 L210 M211 I212 | K204-C208 PolarHBondContact O-N 3.37Å; V205-C208 WeakPolarHBondContact O-CB 3.13Å; V205-C208 PolarHBondContact O-N 2.84Å; C208-L210 PolarHBondContact O-N 3.24Å; C208-M211 PolarHBondContact O-N 3.11Å; C208-I212 VanDerWaalsContact O-CG1 3.28Å; C208-I212 WeakPolarHBondContact O-CG1 3.25Å; C208-I212 PolarHBondContact O-N 2.87Å |
| 209 | V | 78.7 | Confident | 76.5 | Confident | 33 Ų | 33 | 64.3 Ų | 64.3 | 20% | 0.2 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.5 | -46.7 | 177.6 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | V51 V55 V205 G206 M211 I212 S213 | V51-V209 HydrophobicContact CB-CG1 4.5Å; V51-V209 HydrophobicContact CG1-CG1 3.76Å; V51-V209 HydrophobicContact CG2-CG1 4.28Å; V55-V209 HydrophobicContact CG2-CG1 4.23Å; V205-V209 HydrophobicContact CG1-CG2 4.41Å; V205-V209 WeakPolarHBondContact O-CG2 3.49Å; V205-V209 PolarHBondContact O-N 3.37Å; G206-V209 PolarHBondContact O-N 2.88Å; V209-M211 VanDerWaalsContact C-N 3.34Å; V209-M211 PolarHBondContact O-N 3.34Å; V209-I212 PolarHBondContact O-N 3.22Å; V209-S213 PolarHBondContact O-N 3.08Å; V209-S213 PolarHBondContact O-OG 3.39Å; V209-S213 VanDerWaalsContact O-OG 3.06Å |
| 210 | L | 72.6 | Confident | 75.7 | Confident | 11 Ų | 11 | 68.1 Ų | 68.1 | 6% | 0.058 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -57.3 | -46.3 | 177.3 | 177.7 | 68.5 | 0 | 0 | 0 | 111.9 | V55 G206 L207 C208 S213 I214 Q279 T283 K286 | V55-L210 HydrophobicContact CG1-CD1 4.37Å; V55-L210 HydrophobicContact CG2-CB 4.46Å; G206-L210 VanDerWaalsContact O-CB 3.3Å; G206-L210 WeakPolarHBondContact O-CB 3.15Å; G206-L210 PolarHBondContact O-N 3.1Å; L207-L210 PolarHBondContact O-N 3.07Å; C208-L210 PolarHBondContact O-N 3.24Å; L210-S213 PolarHBondContact O-N 3.24Å; L210-I214 HydrophobicContact CD1-CD1 4.3Å; L210-I214 HydrophobicContact CG-CD1 4.08Å; L210-I214 PolarHBondContact O-N 3.31Å; L210-Q279 HydrophobicContact CD2-CG 4.07Å; L210-T283 WeakPolarHBondContact CD2-OG1 3.33Å; L210-K286 HydrophobicContact CD1-CD 3.76Å; L210-K286 PolarHBondContact O-NZ 3.21Å |
| 211 | M | 72.7 | Confident | 74.7 | Confident | 108 Ų | 108 | 61.6 Ų | 61.6 | 53% | 0.532 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.9 | -44.9 | 179.7 | -72.5 | -59.5 | -66.5 | 0 | 0 | 111.7 | L207 C208 V209 S213 I214 L215 | L207-M211 HydrophobicContact CD2-CG 4.14Å; L207-M211 WeakPolarHBondContact O-CB 3.28Å; L207-M211 VanDerWaalsContact O-CG 3.27Å; L207-M211 WeakPolarHBondContact O-CG 3.23Å; L207-M211 PolarHBondContact O-N 3.41Å; C208-M211 PolarHBondContact O-N 3.11Å; V209-M211 VanDerWaalsContact C-N 3.34Å; V209-M211 PolarHBondContact O-N 3.34Å; M211-S213 VanDerWaalsContact C-N 3.31Å; M211-S213 PolarHBondContact O-N 2.88Å; M211-I214 PolarHBondContact O-N 3.32Å; M211-L215 WeakPolarHBondContact O-CB 3.41Å; M211-L215 PolarHBondContact O-N 3.41Å |
| 212 | I | 79.8 | Confident | 73.7 | Confident | 104 Ų | 104 | 61 Ų | 61 | 53% | 0.533 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -59.8 | -44.4 | 175 | -67.2 | 165.2 | 0 | 0 | 0 | 109.9 | C208 V209 I214 L215 V216 | C208-I212 VanDerWaalsContact O-CG1 3.28Å; C208-I212 WeakPolarHBondContact O-CG1 3.25Å; C208-I212 PolarHBondContact O-N 2.87Å; V209-I212 PolarHBondContact O-N 3.22Å; I212-I214 PolarHBondContact O-N 2.86Å; I212-L215 WeakPolarHBondContact O-CB 3.29Å; I212-L215 PolarHBondContact O-N 3.08Å; I212-L215 VanDerWaalsContact O-N 3.14Å; I212-V216 HydrophobicContact CG2-CG2 4.24Å; I212-V216 WeakPolarHBondContact O-CG2 3.46Å; I212-V216 PolarHBondContact O-N 3.36Å |
| 213 | S | 69.3 | Low | 72.9 | Confident | 31 Ų | 31 | 64.3 Ų | 64.3 | 22% | 0.217 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.2 | -35.2 | 176.5 | -57.9 | 0 | 0 | 0 | 0 | 113 | V209 L210 M211 L215 I217 | V209-S213 PolarHBondContact O-N 3.08Å; V209-S213 PolarHBondContact O-OG 3.39Å; V209-S213 VanDerWaalsContact O-OG 3.06Å; L210-S213 PolarHBondContact O-N 3.24Å; M211-S213 VanDerWaalsContact C-N 3.31Å; M211-S213 PolarHBondContact O-N 2.88Å; S213-L215 VanDerWaalsContact C-N 3.32Å; S213-I217 WeakPolarHBondContact O-CB 3.33Å; S213-I217 WeakPolarHBondContact O-CD1 3.35Å; S213-I217 WeakPolarHBondContact O-CG1 3.24Å; S213-I217 PolarHBondContact O-N 2.88Å |
| 214 | I | 69.8 | Low | 71.9 | Confident | 19 Ų | 19 | 70 Ų | 70 | 10% | 0.097 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -60.7 | -49.5 | 171.2 | -94.1 | 121.9 | 0 | 0 | 0 | 107.9 | L210 M211 I212 V216 I217 C218 K286 | L210-I214 HydrophobicContact CD1-CD1 4.3Å; L210-I214 HydrophobicContact CG-CD1 4.08Å; L210-I214 PolarHBondContact O-N 3.31Å; M211-I214 PolarHBondContact O-N 3.32Å; I212-I214 PolarHBondContact O-N 2.86Å; I214-V216 PolarHBondContact O-N 3.35Å; I214-I217 PolarHBondContact O-N 3.49Å; I214-C218 WeakPolarHBondContact O-CB 3.36Å; I214-C218 PolarHBondContact O-N 3.33Å; I214-C218 PolarHBondContact O-SG 3.44Å; I214-K286 VanDerWaalsContact CA-NZ 3.31Å |
| 215 | L | 73.6 | Confident | 70.6 | Confident | 105 Ų | 105 | 65.7 Ų | 65.7 | 55% | 0.55 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.7 | -45.4 | -173.2 | -173.8 | 70.5 | 0 | 0 | 0 | 111.7 | M211 I212 S213 I217 C218 I219 | M211-L215 WeakPolarHBondContact O-CB 3.41Å; M211-L215 PolarHBondContact O-N 3.41Å; I212-L215 WeakPolarHBondContact O-CB 3.29Å; I212-L215 PolarHBondContact O-N 3.08Å; I212-L215 VanDerWaalsContact O-N 3.14Å; S213-L215 VanDerWaalsContact C-N 3.32Å; L215-I217 PolarHBondContact O-N 3.33Å; L215-C218 WeakPolarHBondContact O-CB 3.47Å; L215-C218 PolarHBondContact O-N 2.99Å; L215-I219 HydrophobicContact CD1-CD1 4.39Å; L215-I219 HydrophobicContact CG-CD1 3.94Å; L215-I219 VanDerWaalsContact O-CG1 3.25Å; L215-I219 WeakPolarHBondContact O-CG1 3.47Å; L215-I219 PolarHBondContact O-N 2.91Å |
| 216 | V | 72.2 | Confident | 69.1 | Low | 73 Ų | 73 | 65.3 Ų | 65.3 | 44% | 0.442 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.8 | -46.7 | 177.7 | 171 | 0 | 0 | 0 | 0 | 110.6 | I212 I214 C218 I219 I220 | I212-V216 HydrophobicContact CG2-CG2 4.24Å; I212-V216 WeakPolarHBondContact O-CG2 3.46Å; I212-V216 PolarHBondContact O-N 3.36Å; I214-V216 PolarHBondContact O-N 3.35Å; V216-C218 VanDerWaalsContact C-N 3.35Å; V216-C218 PolarHBondContact O-N 3.07Å; V216-I219 PolarHBondContact O-N 3.33Å; V216-I220 HydrophobicContact CG1-CD1 3.75Å; V216-I220 HydrophobicContact CG1-CG1 4.49Å; V216-I220 VanDerWaalsContact O-CG1 3.27Å; V216-I220 WeakPolarHBondContact O-CG1 3.29Å; V216-I220 PolarHBondContact O-N 2.85Å |
| 217 | I | 64.1 | Low | 68 | Low | 36 Ų | 36 | 69 Ų | 69 | 19% | 0.185 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -67.5 | -37.5 | 178.5 | -61.6 | 168.5 | 0 | 0 | 0 | 110.7 | S213 I214 L215 I220 S221 Y298 | S213-I217 WeakPolarHBondContact O-CB 3.33Å; S213-I217 WeakPolarHBondContact O-CD1 3.35Å; S213-I217 WeakPolarHBondContact O-CG1 3.24Å; S213-I217 PolarHBondContact O-N 2.88Å; I214-I217 PolarHBondContact O-N 3.49Å; L215-I217 PolarHBondContact O-N 3.33Å; I217-I220 PolarHBondContact O-N 2.95Å; I217-S221 WeakPolarHBondContact O-CB 3.43Å; I217-S221 PolarHBondContact O-N 3.33Å; I217-S221 PolarHBondContact O-OG 3.37Å; I217-Y298 HydrophobicContact CB-CE1 4.46Å; I217-Y298 HydrophobicContact CB-CE2 4.47Å; I217-Y298 HydrophobicContact CG2-CD1 3.71Å; I217-Y298 HydrophobicContact CG2-CE1 3.39Å; I217-Y298 HydrophobicContact CG2-CE2 4.18Å; I217-Y298 HydrophobicContact CG2-CG 4.32Å |
| 218 | C | 65.6 | Low | 67 | Low | 22 Ų | 22 | 67 Ų | 67 | 15% | 0.149 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -56.9 | -49.1 | 170.4 | -76.7 | 0 | 0 | 0 | 0 | 112 | I214 L215 V216 S221 I222 Y298 L299 | I214-C218 WeakPolarHBondContact O-CB 3.36Å; I214-C218 PolarHBondContact O-N 3.33Å; I214-C218 PolarHBondContact O-SG 3.44Å; L215-C218 WeakPolarHBondContact O-CB 3.47Å; L215-C218 PolarHBondContact O-N 2.99Å; V216-C218 VanDerWaalsContact C-N 3.35Å; V216-C218 PolarHBondContact O-N 3.07Å; C218-S221 PolarHBondContact O-N 3.04Å; C218-I222 HydrophobicContact CB-CD1 4.46Å; C218-I222 VanDerWaalsContact O-CB 3.29Å; C218-I222 WeakPolarHBondContact O-CB 3.23Å; C218-I222 WeakPolarHBondContact O-CD1 3.2Å; C218-I222 WeakPolarHBondContact O-CG1 3.36Å; C218-I222 PolarHBondContact O-N 3.41Å; C218-Y298 WeakPolarHBondContact CA-OH 3.26Å; C218-Y298 PolarHBondContact N-OH 3.47Å; C218-Y298 PolarHBondContact SG-OH 2.84Å; C218-L299 VanDerWaalsContact SG-CD2 3.57Å |
| 219 | I | 70.4 | Confident | 65.9 | Low | 90 Ų | 90 | 67.7 Ų | 67.7 | 46% | 0.462 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.4 | -46.5 | -179.4 | -67.7 | 164.6 | 0 | 0 | 0 | 109.7 | L215 V216 S221 I222 V223 | L215-I219 HydrophobicContact CD1-CD1 4.39Å; L215-I219 HydrophobicContact CG-CD1 3.94Å; L215-I219 VanDerWaalsContact O-CG1 3.25Å; L215-I219 WeakPolarHBondContact O-CG1 3.47Å; L215-I219 PolarHBondContact O-N 2.91Å; V216-I219 PolarHBondContact O-N 3.33Å; I219-S221 VanDerWaalsContact C-N 3.34Å; I219-S221 PolarHBondContact O-N 3.34Å; I219-I222 PolarHBondContact O-N 3.07Å; I219-V223 HydrophobicContact CG2-CG2 4.23Å; I219-V223 VanDerWaalsContact O-CB 3.31Å; I219-V223 WeakPolarHBondContact O-CB 3.39Å; I219-V223 WeakPolarHBondContact O-CG2 3.35Å; I219-V223 PolarHBondContact O-N 3.08Å |
| 220 | I | 66.7 | Low | 65 | Low | 83 Ų | 83 | 72.1 Ų | 72.1 | 43% | 0.426 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.1 | -46.4 | 175.8 | -66 | 166.4 | 0 | 0 | 0 | 110.5 | V216 I217 I222 V223 E224 | V216-I220 HydrophobicContact CG1-CD1 3.75Å; V216-I220 HydrophobicContact CG1-CG1 4.49Å; V216-I220 VanDerWaalsContact O-CG1 3.27Å; V216-I220 WeakPolarHBondContact O-CG1 3.29Å; V216-I220 PolarHBondContact O-N 2.85Å; I217-I220 PolarHBondContact O-N 2.95Å; I220-I222 PolarHBondContact O-N 3.37Å; I220-V223 PolarHBondContact O-N 3.18Å; I220-E224 HydrophobicContact CG2-CG 4.33Å; I220-E224 VanDerWaalsContact O-CB 3.31Å; I220-E224 WeakPolarHBondContact O-CB 3.31Å; I220-E224 WeakPolarHBondContact O-CG 3.37Å; I220-E224 PolarHBondContact O-N 3.42Å |
| 221 | S | 60.1 | Low | 64.7 | Low | 26 Ų | 26 | 74.5 Ų | 74.5 | 18% | 0.182 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -64.8 | -37.7 | 179.6 | -57.5 | 0 | 0 | 0 | 0 | 112.6 | I217 C218 I219 I225 Y298 | I217-S221 WeakPolarHBondContact O-CB 3.43Å; I217-S221 PolarHBondContact O-N 3.33Å; I217-S221 PolarHBondContact O-OG 3.37Å; C218-S221 PolarHBondContact O-N 3.04Å; I219-S221 VanDerWaalsContact C-N 3.34Å; I219-S221 PolarHBondContact O-N 3.34Å; S221-I225 CarbonylContact O-C 3.54Å; S221-I225 WeakPolarHBondContact O-CA 3.33Å; S221-I225 PolarHBondContact O-N 3.5Å; S221-Y298 PolarHBondContact OG-OH 3.22Å |
| 222 | I | 65.2 | Low | 64.5 | Low | 94 Ų | 94 | 69.9 Ų | 69.9 | 48% | 0.482 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -70.5 | -40.9 | 177.1 | -70.7 | 163.3 | 0 | 0 | 0 | 110.5 | C218 I219 I220 L229 | C218-I222 HydrophobicContact CB-CD1 4.46Å; C218-I222 VanDerWaalsContact O-CB 3.29Å; C218-I222 WeakPolarHBondContact O-CB 3.23Å; C218-I222 WeakPolarHBondContact O-CD1 3.2Å; C218-I222 WeakPolarHBondContact O-CG1 3.36Å; C218-I222 PolarHBondContact O-N 3.41Å; I219-I222 PolarHBondContact O-N 3.07Å; I220-I222 PolarHBondContact O-N 3.37Å; I222-L229 HydrophobicContact CG1-CD1 4.39Å |
| 223 | V | 65.6 | Low | 64 | Low | 116 Ų | 116 | 70.1 Ų | 70.1 | 70% | 0.703 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -72.4 | -39.5 | 179.9 | 171 | 0 | 0 | 0 | 0 | 111.4 | I219 I220 | I219-V223 HydrophobicContact CG2-CG2 4.23Å; I219-V223 VanDerWaalsContact O-CB 3.31Å; I219-V223 WeakPolarHBondContact O-CB 3.39Å; I219-V223 WeakPolarHBondContact O-CG2 3.35Å; I219-V223 PolarHBondContact O-N 3.08Å; I220-V223 PolarHBondContact O-N 3.18Å |
| 224 | E | 60.3 | Low | 64.7 | Low | 147 Ų | 147 | 70.1 Ų | 70.1 | 69% | 0.687 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -77.4 | -32.7 | 177.6 | -75.7 | -176.3 | 151.6 | 0 | 0 | 112.2 | I220 | I220-E224 HydrophobicContact CG2-CG 4.33Å; I220-E224 VanDerWaalsContact O-CB 3.31Å; I220-E224 WeakPolarHBondContact O-CB 3.31Å; I220-E224 WeakPolarHBondContact O-CG 3.37Å; I220-E224 PolarHBondContact O-N 3.42Å |
| 225 | I | 55.2 | Low | 65.6 | Low | 68 Ų | 68 | 74.2 Ų | 74.2 | 35% | 0.349 | 43% | 0.43 | S | S | . | . | trans | -150.3 | 86.5 | -172.2 | -41 | 174.2 | 0 | 0 | 0 | 113.1 | S221 S227 S228 | S221-I225 CarbonylContact O-C 3.54Å; S221-I225 WeakPolarHBondContact O-CA 3.33Å; S221-I225 PolarHBondContact O-N 3.5Å; I225-S227 WeakPolarHBondContact CG2-OG 3.38Å; I225-S227 PolarHBondContact O-N 3.29Å; I225-S227 VanDerWaalsContact O-N 3.11Å; I225-S228 WeakPolarHBondContact CD1-OG 3.47Å; I225-S228 VanDerWaalsContact CG2-N 3.27Å; I225-S228 WeakPolarHBondContact CG2-OG 3.5Å; I225-S228 PolarHBondContact O-N 3.02Å; I225-S228 VanDerWaalsContact O-N 3.16Å | ||
| 226 | G | 53.4 | Low | 66.4 | Low | 68 Ų | 68 | 71.1 Ų | 71.1 | 70% | 0.701 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | -17.5 | 165.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 227 | S | 54.1 | Low | 67.2 | Low | 80 Ų | 80 | 68 Ų | 68 | 56% | 0.559 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.3 | -12 | 176.5 | 50.7 | 0 | 0 | 0 | 0 | 115.2 | I225 L230 | I225-S227 WeakPolarHBondContact CG2-OG 3.38Å; I225-S227 PolarHBondContact O-N 3.29Å; I225-S227 VanDerWaalsContact O-N 3.11Å; S227-L230 WeakPolarHBondContact O-CB 3.47Å |
| 228 | S | 57.3 | Low | 68.6 | Low | 22 Ų | 22 | 69.8 Ų | 69.8 | 15% | 0.154 | 41% | 0.406 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | -19 | -177.7 | -85.9 | 0 | 0 | 0 | 0 | 113.5 | I225 L230 T231 | I225-S228 WeakPolarHBondContact CD1-OG 3.47Å; I225-S228 VanDerWaalsContact CG2-N 3.27Å; I225-S228 WeakPolarHBondContact CG2-OG 3.5Å; I225-S228 PolarHBondContact O-N 3.02Å; I225-S228 VanDerWaalsContact O-N 3.16Å; S228-L230 PolarHBondContact O-N 3.45Å; S228-T231 WeakPolarHBondContact O-CB 3.48Å; S228-T231 PolarHBondContact O-N 2.96Å; S228-T231 PolarHBondContact O-OG1 3.01Å |
| 229 | L | 56.5 | Low | 70 | Confident | 86 Ų | 86 | 70.2 Ų | 70.2 | 45% | 0.45 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.6 | -31.2 | 169.6 | -73.9 | -178.4 | 0 | 0 | 0 | 111.8 | I222 T231 M232 L233 L299 | I222-L229 HydrophobicContact CG1-CD1 4.39Å; L229-T231 PolarHBondContact O-N 3.36Å; L229-M232 PolarHBondContact O-N 3.32Å; L229-L233 PolarHBondContact O-N 2.86Å; L229-L299 HydrophobicContact CD2-CD1 3.85Å |
| 230 | L | 60.5 | Low | 71.1 | Confident | 125 Ų | 125 | 66 Ų | 66 | 65% | 0.654 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -63.5 | -27.3 | 172.8 | -66.8 | 173 | 0 | 0 | 0 | 112.4 | S227 S228 M232 L233 S234 | S227-L230 WeakPolarHBondContact O-CB 3.47Å; S228-L230 PolarHBondContact O-N 3.45Å; L230-M232 VanDerWaalsContact C-N 3.34Å; L230-M232 PolarHBondContact O-N 3.24Å; L230-L233 CarbonylContact O-C 3.49Å; L230-L233 PolarHBondContact O-N 3.15Å; L230-S234 PolarHBondContact O-N 3.45Å |
| 231 | T | 66 | Low | 72.4 | Confident | 61 Ų | 61 | 62 Ų | 62 | 37% | 0.374 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -68 | -34 | 176.3 | 67.9 | 0 | 0 | 0 | 0 | 112 | S228 L229 L233 S234 L237 P296 | S228-T231 WeakPolarHBondContact O-CB 3.48Å; S228-T231 PolarHBondContact O-N 2.96Å; S228-T231 PolarHBondContact O-OG1 3.01Å; L229-T231 PolarHBondContact O-N 3.36Å; T231-L233 VanDerWaalsContact C-N 3.3Å; T231-S234 WeakPolarHBondContact O-CB 3.3Å; T231-S234 PolarHBondContact O-N 2.83Å; T231-S234 VanDerWaalsContact O-N 3.17Å; T231-S234 PolarHBondContact O-OG 2.95Å; T231-L237 WeakPolarHBondContact O-CD1 3.26Å; T231-P296 WeakPolarHBondContact OG1-CG 3.43Å |
| 232 | M | 68 | Low | 74.1 | Confident | 12 Ų | 12 | 63 Ų | 63 | 6% | 0.059 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -71 | -26.9 | 172.7 | -64.5 | -58.9 | 93.5 | 0 | 0 | 112.7 | L229 L230 S234 L237 P296 M297 L299 | L229-M232 PolarHBondContact O-N 3.32Å; L230-M232 VanDerWaalsContact C-N 3.34Å; L230-M232 PolarHBondContact O-N 3.24Å; M232-S234 PolarHBondContact O-N 3.4Å; M232-L237 HydrophobicContact CE-CD1 3.84Å; M232-P296 HydrophobicContact CE-CB 3.78Å; M232-P296 HydrophobicContact CE-CG 3.68Å; M232-P296 HydrophobicContact CG-CB 4.04Å; M232-P296 HydrophobicContact SD-CB 4.14Å; M232-M297 HydrophobicContact CE-CG 4.15Å; M232-M297 HydrophobicContact CE-SD 3.46Å; M232-M297 WeakPolarHBondContact CE-SD 3.37Å; M232-M297 HydrophobicContact SD-SD 4.07Å; M232-L299 HydrophobicContact CG-CB 4.32Å; M232-L299 HydrophobicContact CG-CD1 4.37Å; M232-L299 HydrophobicContact SD-CB 4.37Å |
| 233 | L | 70.4 | Confident | 75.6 | Confident | 108 Ų | 108 | 61.3 Ų | 61.3 | 57% | 0.565 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | 9.7 | 171.8 | -99.1 | 69.9 | 0 | 0 | 0 | 113.1 | L229 L230 T231 M238 | L229-L233 PolarHBondContact O-N 2.86Å; L230-L233 CarbonylContact O-C 3.49Å; L230-L233 PolarHBondContact O-N 3.15Å; T231-L233 VanDerWaalsContact C-N 3.3Å; L233-M238 HydrophobicContact CB-SD 4.47Å; L233-M238 HydrophobicContact CG-SD 4.23Å |
| 234 | S | 84.2 | Confident | 77 | Confident | 32 Ų | 32 | 55.9 Ų | 55.9 | 22% | 0.224 | 33% | 0.332 | C | S | . | . | trans | -60.8 | 138 | 177.3 | 62.7 | 0 | 0 | 0 | 0 | 110.3 | L230 T231 M232 P236 L237 M238 | L230-S234 PolarHBondContact O-N 3.45Å; T231-S234 WeakPolarHBondContact O-CB 3.3Å; T231-S234 PolarHBondContact O-N 2.83Å; T231-S234 VanDerWaalsContact O-N 3.17Å; T231-S234 PolarHBondContact O-OG 2.95Å; M232-S234 PolarHBondContact O-N 3.4Å; S234-P236 VanDerWaalsContact C-N 3.34Å; S234-L237 PolarHBondContact O-N 2.84Å; S234-L237 VanDerWaalsContact O-N 3.07Å; S234-L237 WeakPolarHBondContact OG-CD1 2.96Å; S234-L237 VanDerWaalsContact OG-CG 3.28Å; S234-L237 WeakPolarHBondContact OG-CG 3.28Å; S234-M238 PolarHBondContact O-N 3.39Å | ||
| 235 | P | 88.1 | Confident | 78.7 | Confident | 105 Ų | 105 | 48.9 Ų | 48.9 | 68% | 0.682 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -48.4 | -43.3 | -179.8 | -28.3 | 34.2 | 0 | 0 | 0 | 115.3 | A239 | P235-A239 VanDerWaalsContact O-CB 3.29Å; P235-A239 WeakPolarHBondContact O-CB 3.39Å; P235-A239 PolarHBondContact O-N 2.83Å |
| 236 | P | 90.2 | Very high | 80.6 | Confident | 39 Ų | 39 | 49.4 Ų | 49.4 | 25% | 0.253 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -67.4 | -37.7 | 179.4 | 26.1 | -35.1 | 0 | 0 | 0 | 112.9 | F100 L102 S234 A239 I240 | F100-P236 HydrophobicContact CB-CB 4.19Å; F100-P236 HydrophobicContact CD1-CB 3.67Å; F100-P236 HydrophobicContact CE1-CB 4.36Å; F100-P236 HydrophobicContact CG-CB 4.15Å; L102-P236 HydrophobicContact CD2-CB 4.1Å; L102-P236 HydrophobicContact CD2-CG 4.43Å; S234-P236 VanDerWaalsContact C-N 3.34Å; P236-A239 PolarHBondContact O-N 3.29Å; P236-I240 VanDerWaalsContact O-CG1 3.23Å; P236-I240 WeakPolarHBondContact O-CG1 3.42Å; P236-I240 PolarHBondContact O-N 3.27Å |
| 237 | L | 90.3 | Very high | 82.7 | Confident | 9 Ų | 9 | 48 Ų | 48 | 5% | 0.047 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -69.4 | -41.1 | 178 | -67.7 | -176.3 | 0 | 0 | 0 | 111.8 | L102 T106 I110 T231 M232 S234 I240 A241 M297 F300 | L102-L237 HydrophobicContact CD1-CD2 4.39Å; T106-L237 HydrophobicContact CG2-CD2 3.62Å; I110-L237 HydrophobicContact CD1-CD2 4.05Å; T231-L237 WeakPolarHBondContact O-CD1 3.26Å; M232-L237 HydrophobicContact CE-CD1 3.84Å; S234-L237 PolarHBondContact O-N 2.84Å; S234-L237 VanDerWaalsContact O-N 3.07Å; S234-L237 WeakPolarHBondContact OG-CD1 2.96Å; S234-L237 VanDerWaalsContact OG-CG 3.28Å; S234-L237 WeakPolarHBondContact OG-CG 3.28Å; L237-I240 PolarHBondContact O-N 3.1Å; L237-A241 WeakPolarHBondContact O-CB 3.28Å; L237-A241 PolarHBondContact O-N 3.02Å; L237-M297 HydrophobicContact CD1-SD 3.89Å; L237-M297 HydrophobicContact CD2-CE 4.31Å; L237-M297 HydrophobicContact CD2-SD 4.44Å; L237-F300 HydrophobicContact CB-CE2 4.31Å; L237-F300 HydrophobicContact CD2-CD2 4.42Å; L237-F300 HydrophobicContact CD2-CE2 4.27Å |
| 238 | M | 92.4 | Very high | 84.6 | Confident | 73 Ų | 73 | 44.2 Ų | 44.2 | 36% | 0.36 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 173.9 | -71.6 | -168.9 | 65.5 | 0 | 0 | 111.7 | L233 S234 I240 A241 V242 F307 | L233-M238 HydrophobicContact CB-SD 4.47Å; L233-M238 HydrophobicContact CG-SD 4.23Å; S234-M238 PolarHBondContact O-N 3.39Å; M238-I240 VanDerWaalsContact C-N 3.31Å; M238-I240 PolarHBondContact O-N 3.09Å; M238-A241 PolarHBondContact O-N 3.04Å; M238-V242 WeakPolarHBondContact O-CG2 3.22Å; M238-V242 PolarHBondContact O-N 3.34Å; M238-V242 VanDerWaalsContact O-N 3.08Å; M238-F307 HydrophobicContact CE-CZ 3.99Å |
| 239 | A | 94.3 | Very high | 86.5 | Confident | 31 Ų | 31 | 43.5 Ų | 43.5 | 26% | 0.256 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -58.9 | -43.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | F100 P235 P236 V242 L243 | F100-A239 HydrophobicContact CE1-CB 4.06Å; F100-A239 HydrophobicContact CE2-CB 4.45Å; F100-A239 HydrophobicContact CZ-CB 3.71Å; P235-A239 VanDerWaalsContact O-CB 3.29Å; P235-A239 WeakPolarHBondContact O-CB 3.39Å; P235-A239 PolarHBondContact O-N 2.83Å; P236-A239 PolarHBondContact O-N 3.29Å; A239-V242 PolarHBondContact O-N 2.91Å; A239-L243 VanDerWaalsContact O-CB 3.22Å; A239-L243 WeakPolarHBondContact O-CB 3.45Å; A239-L243 WeakPolarHBondContact O-CG 3.42Å; A239-L243 PolarHBondContact O-N 3Å |
| 240 | I | 94.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.9 | -39.8 | 177.6 | -67.3 | 172.9 | 0 | 0 | 0 | 111.8 | L96 F100 L102 I110 P236 L237 M238 V242 L243 L244 F300 | L96-I240 HydrophobicContact CB-CD1 4.37Å; L96-I240 HydrophobicContact CB-CG1 4.16Å; L96-I240 HydrophobicContact CD1-CG2 4.22Å; F100-I240 HydrophobicContact CB-CD1 4.21Å; F100-I240 HydrophobicContact CD2-CD1 3.76Å; F100-I240 HydrophobicContact CD2-CG1 3.65Å; F100-I240 HydrophobicContact CE2-CD1 4.49Å; F100-I240 HydrophobicContact CE2-CG1 3.89Å; F100-I240 HydrophobicContact CG-CD1 4.17Å; F100-I240 HydrophobicContact CG-CG1 4.38Å; L102-I240 HydrophobicContact CD1-CD1 3.47Å; L102-I240 VanDerWaalsContact CD1-CD1 3.47Å; L102-I240 HydrophobicContact CG-CD1 4.33Å; I110-I240 HydrophobicContact CD1-CD1 3.93Å; I110-I240 HydrophobicContact CD1-CG2 4.18Å; I110-I240 HydrophobicContact CG1-CG2 4.38Å; I110-I240 HydrophobicContact CG2-CG2 3.87Å; P236-I240 VanDerWaalsContact O-CG1 3.23Å; P236-I240 WeakPolarHBondContact O-CG1 3.42Å; P236-I240 PolarHBondContact O-N 3.27Å; L237-I240 PolarHBondContact O-N 3.1Å; M238-I240 VanDerWaalsContact C-N 3.31Å; M238-I240 PolarHBondContact O-N 3.09Å; I240-V242 PolarHBondContact O-N 3.25Å; I240-L243 PolarHBondContact O-N 3.02Å; I240-L244 WeakPolarHBondContact O-CB 3.44Å; I240-L244 PolarHBondContact O-N 3.43Å; I240-F300 HydrophobicContact CG2-CZ 4.06Å |
| 241 | A | 93.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.9 | -29.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L237 M238 P245 F300 V303 F307 | L237-A241 WeakPolarHBondContact O-CB 3.28Å; L237-A241 PolarHBondContact O-N 3.02Å; M238-A241 PolarHBondContact O-N 3.04Å; A241-P245 WeakPolarHBondContact O-CD 3.45Å; A241-P245 WeakPolarHBondContact O-CG 3.49Å; A241-F300 HydrophobicContact CB-CE2 4.22Å; A241-F300 HydrophobicContact CB-CZ 4.37Å; A241-V303 HydrophobicContact CB-CG1 3.94Å; A241-F307 HydrophobicContact CB-CD2 3.63Å; A241-F307 HydrophobicContact CB-CE2 4.11Å; A241-F307 HydrophobicContact CB-CG 4.49Å; A241-F307 WeakPolarHBondContact O-CB 3.39Å |
| 242 | V | 95.9 | Very high | 91.3 | Very high | 48 Ų | 48 | 37.6 Ų | 37.6 | 29% | 0.291 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -82.6 | -47.8 | 171.8 | 172.9 | 0 | 0 | 0 | 0 | 111.4 | M238 A239 I240 L244 P245 L246 F307 E311 | M238-V242 WeakPolarHBondContact O-CG2 3.22Å; M238-V242 PolarHBondContact O-N 3.34Å; M238-V242 VanDerWaalsContact O-N 3.08Å; A239-V242 PolarHBondContact O-N 2.91Å; I240-V242 PolarHBondContact O-N 3.25Å; V242-L244 PolarHBondContact O-N 2.9Å; V242-P245 WeakPolarHBondContact O-CD 3.35Å; V242-L246 WeakPolarHBondContact O-CB 3.41Å; V242-L246 PolarHBondContact O-N 3.33Å; V242-F307 HydrophobicContact CG2-CD1 3.4Å; V242-F307 VanDerWaalsContact CG2-CD1 3.4Å; V242-F307 HydrophobicContact CG2-CD2 4.28Å; V242-F307 HydrophobicContact CG2-CE1 3.49Å; V242-F307 VanDerWaalsContact CG2-CE1 3.49Å; V242-F307 HydrophobicContact CG2-CE2 4.35Å; V242-F307 HydrophobicContact CG2-CG 3.82Å; V242-F307 HydrophobicContact CG2-CZ 3.98Å; V242-E311 WeakPolarHBondContact CA-OE1 3.04Å; V242-E311 WeakPolarHBondContact CG1-OE1 3.12Å |
| 243 | L | 96.5 | Very high | 92.5 | Very high | 58 Ų | 58 | 41 Ų | 41 | 30% | 0.304 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -68.8 | -37.3 | -173.1 | -72.7 | 171.2 | 0 | 0 | 0 | 112.5 | L96 F100 A239 I240 L246 I247 | L96-L243 HydrophobicContact CD1-CB 4.14Å; L96-L243 HydrophobicContact CD2-CB 4.21Å; L96-L243 HydrophobicContact CD2-CD1 3.96Å; F100-L243 HydrophobicContact CE2-CD1 4.15Å; F100-L243 HydrophobicContact CZ-CD1 4.26Å; A239-L243 VanDerWaalsContact O-CB 3.22Å; A239-L243 WeakPolarHBondContact O-CB 3.45Å; A239-L243 WeakPolarHBondContact O-CG 3.42Å; A239-L243 PolarHBondContact O-N 3Å; I240-L243 PolarHBondContact O-N 3.02Å; L243-L246 PolarHBondContact O-N 3.46Å; L243-I247 HydrophobicContact CB-CD1 4.13Å; L243-I247 WeakPolarHBondContact O-CB 3.31Å; L243-I247 WeakPolarHBondContact O-CD1 3.26Å; L243-I247 WeakPolarHBondContact O-CG1 3.13Å; L243-I247 PolarHBondContact O-N 3.26Å |
| 244 | L | 95.4 | Very high | 93.6 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.005 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.6 | -51.7 | -174.2 | -173.7 | 73.7 | 0 | 0 | 0 | 112.1 | M89 T92 A93 L96 I240 V242 G248 L304 | M89-L244 HydrophobicContact CE-CG 4.22Å; T92-L244 HydrophobicContact CG2-CD1 3.8Å; A93-L244 HydrophobicContact CB-CD1 4Å; L96-L244 HydrophobicContact CD1-CB 4.14Å; L96-L244 HydrophobicContact CD1-CD1 4.13Å; I240-L244 WeakPolarHBondContact O-CB 3.44Å; I240-L244 PolarHBondContact O-N 3.43Å; V242-L244 PolarHBondContact O-N 2.9Å; L244-G248 PolarHBondContact O-N 3.32Å; L244-G248 VanDerWaalsContact O-N 3.11Å; L244-L304 HydrophobicContact CB-CD1 4.19Å; L244-L304 HydrophobicContact CD2-CD1 3.98Å; L244-L304 HydrophobicContact CD2-CD2 4.15Å |
| 245 | P | 95.3 | Very high | 94 | Very high | 1 Ų | 1 | 39.8 Ų | 39.8 | 1% | 0.006 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -66.3 | -41.5 | 175 | -17.3 | 32.5 | 0 | 0 | 0 | 112 | A241 V242 I247 G248 Y249 L304 Q308 | A241-P245 WeakPolarHBondContact O-CD 3.45Å; A241-P245 WeakPolarHBondContact O-CG 3.49Å; V242-P245 WeakPolarHBondContact O-CD 3.35Å; P245-I247 PolarHBondContact O-N 2.75Å; P245-G248 CarbonylContact O-C 3.48Å; P245-G248 WeakPolarHBondContact O-CA 3.16Å; P245-G248 PolarHBondContact O-N 3.3Å; P245-Y249 HydrophobicContact CB-CD2 4.46Å; P245-Y249 HydrophobicContact CB-CE2 3.91Å; P245-Y249 WeakPolarHBondContact O-CD2 3.49Å; P245-Y249 PolarHBondContact O-N 3.29Å; P245-L304 HydrophobicContact CG-CD1 3.63Å; P245-L304 HydrophobicContact CG-CG 4.41Å; P245-Q308 HydrophobicContact CB-CB 4.07Å; P245-Q308 HydrophobicContact CB-CG 4.32Å; P245-Q308 HydrophobicContact CG-CB 3.99Å |
| 246 | L | 96.1 | Very high | 94.1 | Very high | 79 Ų | 79 | 34.8 Ų | 34.8 | 41% | 0.414 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -59.4 | -47.1 | -179.2 | -175.5 | 64.6 | 0 | 0 | 0 | 112.5 | V242 L243 G248 Y249 A250 E311 | V242-L246 WeakPolarHBondContact O-CB 3.41Å; V242-L246 PolarHBondContact O-N 3.33Å; L243-L246 PolarHBondContact O-N 3.46Å; L246-G248 VanDerWaalsContact C-N 3.3Å; L246-Y249 PolarHBondContact O-N 2.96Å; L246-A250 WeakPolarHBondContact O-CB 3.44Å; L246-A250 PolarHBondContact O-N 3.16Å; L246-E311 VanDerWaalsContact CA-OE2 3.32Å; L246-E311 WeakPolarHBondContact CA-OE2 3.41Å; L246-E311 WeakPolarHBondContact CB-OE2 3.28Å; L246-E311 PolarHBondContact N-OE2 3.28Å |
| 247 | I | 96.3 | Very high | 94.2 | Very high | 39 Ų | 39 | 40.1 Ų | 40.1 | 20% | 0.2 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.6 | -42.1 | 175 | -68.7 | 168.7 | 0 | 0 | 0 | 109.4 | T92 L96 L243 P245 Y249 A250 F251 | T92-I247 HydrophobicContact CG2-CB 3.94Å; T92-I247 HydrophobicContact CG2-CD1 3.7Å; T92-I247 HydrophobicContact CG2-CG1 4.44Å; T92-I247 HydrophobicContact CG2-CG2 3.58Å; L96-I247 HydrophobicContact CD1-CD1 4.45Å; L96-I247 HydrophobicContact CD2-CD1 4.46Å; L243-I247 HydrophobicContact CB-CD1 4.13Å; L243-I247 WeakPolarHBondContact O-CB 3.31Å; L243-I247 WeakPolarHBondContact O-CD1 3.26Å; L243-I247 WeakPolarHBondContact O-CG1 3.13Å; L243-I247 PolarHBondContact O-N 3.26Å; P245-I247 PolarHBondContact O-N 2.75Å; I247-Y249 PolarHBondContact O-N 2.64Å; I247-A250 PolarHBondContact O-N 2.81Å; I247-F251 HydrophobicContact CB-CD2 4.48Å; I247-F251 HydrophobicContact CG2-CD2 3.41Å; I247-F251 VanDerWaalsContact CG2-CD2 3.41Å; I247-F251 HydrophobicContact CG2-CE2 3.69Å; I247-F251 HydrophobicContact CG2-CG 4.43Å; I247-F251 WeakPolarHBondContact O-CB 3.2Å; I247-F251 WeakPolarHBondContact O-CD2 3.32Å; I247-F251 PolarHBondContact O-N 3.38Å |
| 248 | G | 95.2 | Very high | 94.3 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.9 | -48.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | M89 L244 P245 L246 G252 T273 | M89-G248 WeakPolarHBondContact SD-CA 3.43Å; L244-G248 PolarHBondContact O-N 3.32Å; L244-G248 VanDerWaalsContact O-N 3.11Å; P245-G248 CarbonylContact O-C 3.48Å; P245-G248 WeakPolarHBondContact O-CA 3.16Å; P245-G248 PolarHBondContact O-N 3.3Å; L246-G248 VanDerWaalsContact C-N 3.3Å; G248-G252 WeakPolarHBondContact O-CA 3.29Å; G248-G252 PolarHBondContact O-N 3.2Å; G248-T273 WeakPolarHBondContact O-CB 3.33Å; G248-T273 WeakPolarHBondContact O-CG2 3.36Å |
| 249 | Y | 95.6 | Very high | 94.2 | Very high | 7 Ų | 7 | 45.7 Ų | 45.7 | 3% | 0.027 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.7 | -46.9 | 176 | -63.6 | -50.5 | 0 | 0 | 0 | 111.7 | P245 L246 I247 Y253 A270 M271 C275 Q308 E311 L315 | P245-Y249 HydrophobicContact CB-CD2 4.46Å; P245-Y249 HydrophobicContact CB-CE2 3.91Å; P245-Y249 WeakPolarHBondContact O-CD2 3.49Å; P245-Y249 PolarHBondContact O-N 3.29Å; L246-Y249 PolarHBondContact O-N 2.96Å; I247-Y249 PolarHBondContact O-N 2.64Å; Y249-Y253 PolarHBondContact O-N 3.22Å; Y249-Y253 VanDerWaalsContact O-N 3.1Å; Y249-A270 VanDerWaalsContact CD1-O 3.29Å; Y249-A270 WeakPolarHBondContact CD1-O 3.28Å; Y249-A270 WeakPolarHBondContact O-CB 3.34Å; Y249-M271 HydrophobicContact CD1-SD 4.34Å; Y249-M271 HydrophobicContact CE1-SD 4.09Å; Y249-C275 HydrophobicContact CE1-CB 4.5Å; Y249-Q308 VanDerWaalsContact OH-CG 3.24Å; Y249-Q308 WeakPolarHBondContact OH-CG 3.2Å; Y249-Q308 PolarHBondContact OH-O 3.02Å; Y249-E311 HydrophobicContact CD2-CB 4.39Å; Y249-E311 HydrophobicContact CE2-CB 3.92Å; Y249-L315 HydrophobicContact CD1-CD1 4.34Å; Y249-L315 HydrophobicContact CD2-CD1 3.86Å; Y249-L315 HydrophobicContact CE2-CD1 4.5Å; Y249-L315 HydrophobicContact CG-CD1 3.79Å |
| 250 | A | 95.8 | Very high | 94 | Very high | 46 Ų | 46 | 54.9 Ų | 54.9 | 38% | 0.38 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.3 | -52.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L246 I247 G252 Y253 I254 | L246-A250 WeakPolarHBondContact O-CB 3.44Å; L246-A250 PolarHBondContact O-N 3.16Å; I247-A250 PolarHBondContact O-N 2.81Å; A250-G252 PolarHBondContact O-N 3.44Å; A250-Y253 PolarHBondContact O-N 3.24Å; A250-I254 VanDerWaalsContact O-CG1 3.28Å; A250-I254 WeakPolarHBondContact O-CG1 3.28Å; A250-I254 PolarHBondContact O-N 3.41Å |
| 251 | F | 94.4 | Very high | 93.7 | Very high | 102 Ų | 102 | 55.7 Ų | 55.7 | 45% | 0.447 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -68.6 | -34.9 | -179.8 | -85.2 | -93.1 | 0 | 0 | 0 | 112.3 | I88 I247 Y253 I254 I255 | I88-F251 HydrophobicContact CD1-CB 3.94Å; I88-F251 HydrophobicContact CG2-CB 3.7Å; I88-F251 HydrophobicContact CG2-CD1 4.41Å; I88-F251 HydrophobicContact CG2-CG 4.03Å; I247-F251 HydrophobicContact CB-CD2 4.48Å; I247-F251 HydrophobicContact CG2-CD2 3.41Å; I247-F251 VanDerWaalsContact CG2-CD2 3.41Å; I247-F251 HydrophobicContact CG2-CE2 3.69Å; I247-F251 HydrophobicContact CG2-CG 4.43Å; I247-F251 WeakPolarHBondContact O-CB 3.2Å; I247-F251 WeakPolarHBondContact O-CD2 3.32Å; I247-F251 PolarHBondContact O-N 3.38Å; F251-Y253 VanDerWaalsContact C-N 3.27Å; F251-Y253 PolarHBondContact O-N 2.91Å; F251-I254 PolarHBondContact O-N 2.81Å; F251-I255 WeakPolarHBondContact O-CB 3.4Å; F251-I255 VanDerWaalsContact O-CG2 3.3Å; F251-I255 WeakPolarHBondContact O-CG2 3.37Å; F251-I255 PolarHBondContact O-N 3.17Å |
| 252 | G | 93.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.6 | -40.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112 | G248 A250 I255 S256 V269 | G248-G252 WeakPolarHBondContact O-CA 3.29Å; G248-G252 PolarHBondContact O-N 3.2Å; A250-G252 PolarHBondContact O-N 3.44Å; G252-I255 WeakPolarHBondContact O-CG2 3.43Å; G252-S256 WeakPolarHBondContact O-CB 3.48Å; G252-S256 PolarHBondContact O-N 2.95Å; G252-S256 PolarHBondContact O-OG 2.88Å; G252-V269 VanDerWaalsContact O-CG1 3.31Å; G252-V269 WeakPolarHBondContact O-CG1 3.26Å |
| 253 | Y | 93.9 | Very high | 93.4 | Very high | 84 Ų | 84 | 61.9 Ų | 61.9 | 33% | 0.329 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -69.5 | -44.2 | 173.8 | -166.6 | -90.8 | 0 | 0 | 0 | 112.6 | Y249 A250 F251 S256 W257 Q263 R266 R267 A270 | Y249-Y253 PolarHBondContact O-N 3.22Å; Y249-Y253 VanDerWaalsContact O-N 3.1Å; A250-Y253 PolarHBondContact O-N 3.24Å; F251-Y253 VanDerWaalsContact C-N 3.27Å; F251-Y253 PolarHBondContact O-N 2.91Å; Y253-S256 WeakPolarHBondContact CA-OG 3.32Å; Y253-S256 PolarHBondContact O-OG 3.02Å; Y253-W257 WeakPolarHBondContact O-CB 3.41Å; Y253-W257 PolarHBondContact O-N 2.92Å; Y253-Q263 PolarHBondContact OH-OE1 2.97Å; Y253-R266 HydrophobicContact CD2-CB 3.94Å; Y253-R266 HydrophobicContact CE2-CB 3.69Å; Y253-R267 HydrophobicContact CE2-CG 4.33Å; Y253-A270 HydrophobicContact CD2-CB 4.35Å |
| 254 | I | 94.1 | Very high | 93.2 | Very high | 87 Ų | 87 | 61.4 Ų | 61.4 | 45% | 0.446 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.1 | -46.7 | -178.7 | -68 | 163.4 | 0 | 0 | 0 | 110.8 | A250 F251 S256 W257 V258 | A250-I254 VanDerWaalsContact O-CG1 3.28Å; A250-I254 WeakPolarHBondContact O-CG1 3.28Å; A250-I254 PolarHBondContact O-N 3.41Å; F251-I254 PolarHBondContact O-N 2.81Å; I254-S256 PolarHBondContact O-N 3.16Å; I254-W257 WeakPolarHBondContact O-CB 3.19Å; I254-W257 PolarHBondContact O-N 2.07Å; I254-W257 VanDerWaalsContact O-N 3.16Å; I254-V258 WeakPolarHBondContact O-CG2 3.49Å; I254-V258 PolarHBondContact O-N 3.33Å |
| 255 | I | 92 | Very high | 93 | Very high | 26 Ų | 26 | 63.2 Ų | 63.2 | 13% | 0.133 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.7 | -42.8 | -177.9 | -158.5 | 160.7 | 0 | 0 | 0 | 110.7 | I80 L83 I88 F251 G252 W257 V258 F259 V269 | I80-I255 HydrophobicContact CG2-CG2 4.16Å; L83-I255 HydrophobicContact CD2-CD1 3.53Å; L83-I255 HydrophobicContact CD2-CG1 4.48Å; L83-I255 HydrophobicContact CG-CD1 3.73Å; I88-I255 HydrophobicContact CD1-CB 4.38Å; I88-I255 HydrophobicContact CD1-CD1 3.75Å; I88-I255 HydrophobicContact CD1-CG2 4.29Å; F251-I255 WeakPolarHBondContact O-CB 3.4Å; F251-I255 VanDerWaalsContact O-CG2 3.3Å; F251-I255 WeakPolarHBondContact O-CG2 3.37Å; F251-I255 PolarHBondContact O-N 3.17Å; G252-I255 WeakPolarHBondContact O-CG2 3.43Å; I255-W257 PolarHBondContact O-N 3.32Å; I255-V258 PolarHBondContact O-N 2.75Å; I255-V258 VanDerWaalsContact O-N 3.12Å; I255-F259 HydrophobicContact CD1-CE2 4.29Å; I255-F259 HydrophobicContact CG1-CD2 3.87Å; I255-F259 HydrophobicContact CG1-CE2 3.72Å; I255-F259 VanDerWaalsContact O-CD2 3.24Å; I255-F259 WeakPolarHBondContact O-CD2 3.17Å; I255-F259 PolarHBondContact O-N 3.11Å; I255-V269 HydrophobicContact CG2-CG1 4.38Å |
| 256 | S | 91.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.4 | -29.7 | 176 | 57.4 | 0 | 0 | 0 | 0 | 112.7 | G252 Y253 I254 R260 L261 R266 | G252-S256 WeakPolarHBondContact O-CB 3.48Å; G252-S256 PolarHBondContact O-N 2.95Å; G252-S256 PolarHBondContact O-OG 2.88Å; Y253-S256 WeakPolarHBondContact CA-OG 3.32Å; Y253-S256 PolarHBondContact O-OG 3.02Å; I254-S256 PolarHBondContact O-N 3.16Å; S256-R260 PolarHBondContact O-N 2.89Å; S256-L261 VanDerWaalsContact O-CD1 3.28Å; S256-L261 WeakPolarHBondContact O-CD1 3.36Å; S256-L261 PolarHBondContact O-N 3.22Å; S256-L261 VanDerWaalsContact O-N 3.08Å; S256-R266 VanDerWaalsContact OG-CA 3.31Å; S256-R266 WeakPolarHBondContact OG-CA 3.43Å; S256-R266 WeakPolarHBondContact OG-CB 3.2Å |
| 257 | W | 92.2 | Very high | 92.8 | Very high | 152 Ų | 152 | 62.9 Ų | 62.9 | 58% | 0.576 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -66.4 | -45.7 | 169.4 | 175.4 | 86 | 0 | 0 | 0 | 112.5 | Y253 I254 I255 F259 R260 | Y253-W257 WeakPolarHBondContact O-CB 3.41Å; Y253-W257 PolarHBondContact O-N 2.92Å; I254-W257 WeakPolarHBondContact O-CB 3.19Å; I254-W257 PolarHBondContact O-N 2.07Å; I254-W257 VanDerWaalsContact O-N 3.16Å; I255-W257 PolarHBondContact O-N 3.32Å; W257-F259 VanDerWaalsContact C-N 3.31Å; W257-F259 PolarHBondContact O-N 3.22Å; W257-R260 WeakPolarHBondContact O-CA 3.46Å; W257-R260 PolarHBondContact O-N 3.18Å |
| 258 | V | 92.3 | Very high | 92.7 | Very high | 88 Ų | 88 | 61 Ų | 61 | 53% | 0.533 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -59.1 | -41.8 | 176.8 | 172 | 0 | 0 | 0 | 0 | 111.4 | I254 I255 R260 | I254-V258 WeakPolarHBondContact O-CG2 3.49Å; I254-V258 PolarHBondContact O-N 3.33Å; I255-V258 PolarHBondContact O-N 2.75Å; I255-V258 VanDerWaalsContact O-N 3.12Å; V258-R260 PolarHBondContact O-N 2.88Å |
| 259 | F | 89.1 | Confident | 92.6 | Very high | 111 Ų | 111 | 61 Ų | 61 | 49% | 0.487 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77 | 5.6 | 175.7 | -77.2 | -78.8 | 0 | 0 | 0 | 114.2 | I80 L83 I255 W257 L261 | I80-F259 HydrophobicContact CD1-CB 3.41Å; I80-F259 VanDerWaalsContact CD1-CB 3.41Å; I80-F259 HydrophobicContact CD1-CD1 4.15Å; I80-F259 HydrophobicContact CD1-CD2 3.94Å; I80-F259 HydrophobicContact CD1-CG 3.58Å; I80-F259 HydrophobicContact CG1-CB 4.23Å; I80-F259 HydrophobicContact CG1-CD1 4.27Å; I80-F259 HydrophobicContact CG1-CD2 3.8Å; I80-F259 HydrophobicContact CG1-CE2 4.24Å; I80-F259 HydrophobicContact CG1-CG 3.84Å; L83-F259 HydrophobicContact CD2-CE2 4.02Å; L83-F259 HydrophobicContact CD2-CZ 4.18Å; I255-F259 HydrophobicContact CD1-CE2 4.29Å; I255-F259 HydrophobicContact CG1-CD2 3.87Å; I255-F259 HydrophobicContact CG1-CE2 3.72Å; I255-F259 VanDerWaalsContact O-CD2 3.24Å; I255-F259 WeakPolarHBondContact O-CD2 3.17Å; I255-F259 PolarHBondContact O-N 3.11Å; W257-F259 VanDerWaalsContact C-N 3.31Å; W257-F259 PolarHBondContact O-N 3.22Å; F259-L261 VanDerWaalsContact C-N 3.32Å; F259-L261 HydrophobicContact CB-CD1 3.88Å; F259-L261 PolarHBondContact O-N 2.94Å |
| 260 | R | 89.8 | Confident | 92.5 | Very high | 223 Ų | 223 | 61.1 Ų | 61.1 | 84% | 0.842 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.5 | 34.3 | 174.9 | -53.5 | -177.4 | 179.3 | -174.4 | -0.8 | 114.3 | S256 W257 V258 | S256-R260 PolarHBondContact O-N 2.89Å; W257-R260 WeakPolarHBondContact O-CA 3.46Å; W257-R260 PolarHBondContact O-N 3.18Å; V258-R260 PolarHBondContact O-N 2.88Å |
| 261 | L | 89.4 | Confident | 92.5 | Very high | 17 Ų | 17 | 59 Ų | 59 | 9% | 0.089 | 27% | 0.271 | C | S | . | . | trans | -66.3 | 163.7 | 170.9 | -68.5 | 106.8 | 0 | 0 | 0 | 111.6 | I80 L135 S256 F259 E265 R266 | I80-L261 HydrophobicContact CD1-CD1 3.22Å; I80-L261 HydrophobicContact CD1-CD2 4.41Å; I80-L261 HydrophobicContact CD1-CG 4.23Å; L135-L261 HydrophobicContact CD2-CD2 4.31Å; S256-L261 VanDerWaalsContact O-CD1 3.28Å; S256-L261 WeakPolarHBondContact O-CD1 3.36Å; S256-L261 PolarHBondContact O-N 3.22Å; S256-L261 VanDerWaalsContact O-N 3.08Å; F259-L261 VanDerWaalsContact C-N 3.32Å; F259-L261 HydrophobicContact CB-CD1 3.88Å; F259-L261 PolarHBondContact O-N 2.94Å; L261-E265 HydrophobicContact CB-CB 3.78Å; L261-E265 HydrophobicContact CD2-CB 3.67Å; L261-E265 HydrophobicContact CD2-CG 4.22Å; L261-E265 HydrophobicContact CG-CB 4.34Å; L261-R266 HydrophobicContact CB-CG 4.19Å; L261-R266 PolarHBondContact O-NE 3.32Å; L261-R266 PolarHBondContact O-NH2 2.93Å | ||
| 262 | T | 91.5 | Very high | 92.4 | Very high | 78 Ų | 78 | 54.2 Ų | 54.2 | 48% | 0.479 | 25% | 0.25 | S | C | . | . | trans | -69.5 | 162.2 | 174.4 | 65.6 | 0 | 0 | 0 | 0 | 111.8 | E265 R266 | T262-E265 WeakPolarHBondContact CB-OE2 3.32Å; T262-E265 WeakPolarHBondContact CG2-OE2 3.25Å; T262-E265 PolarHBondContact N-OE2 3.07Å; T262-E265 PolarHBondContact O-N 2.94Å; T262-E265 VanDerWaalsContact O-N 3.16Å; T262-E265 WeakPolarHBondContact OG1-CG 3.46Å; T262-E265 PolarHBondContact OG1-OE2 3.45Å; T262-R266 WeakPolarHBondContact O-CG 3.29Å; T262-R266 PolarHBondContact O-N 3.43Å | ||
| 263 | Q | 92.1 | Very high | 92.3 | Very high | 100 Ų | 100 | 54.2 Ų | 54.2 | 47% | 0.467 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -58.4 | -40.9 | -179.8 | -73.1 | -70 | 3.2 | 0 | 0 | 114.4 | Y253 R267 | Y253-Q263 PolarHBondContact OH-OE1 2.97Å; Q263-R267 WeakPolarHBondContact O-CG 3.44Å; Q263-R267 PolarHBondContact O-N 3.45Å; Q263-R267 PolarHBondContact O-NE 3.26Å |
| 264 | P | 91.8 | Very high | 92.2 | Very high | 48 Ų | 48 | 50.2 Ų | 50.2 | 31% | 0.312 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -60.1 | -45.3 | 171 | -22 | 33.4 | 0 | 0 | 0 | 113.2 | G131 D132 R267 T268 | G131-P264 WeakPolarHBondContact CA-O 3.28Å; D132-P264 PolarHBondContact N-O 2.82Å; P264-R267 VanDerWaalsContact CA-NH2 3.28Å; P264-R267 PolarHBondContact O-N 2.88Å; P264-T268 PolarHBondContact O-N 3.04Å; P264-T268 PolarHBondContact O-OG1 3.49Å |
| 265 | E | 91.2 | Very high | 92.2 | Very high | 39 Ų | 39 | 46.1 Ų | 46.1 | 18% | 0.182 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66.5 | -39.5 | -179.2 | -67.9 | 170 | 135.9 | 0 | 0 | 112.2 | D132 L135 L261 T262 R267 T268 V269 | D132-E265 HydrophobicContact CB-CG 4.22Å; L135-E265 HydrophobicContact CD2-CB 3.7Å; L135-E265 HydrophobicContact CD2-CG 3.8Å; L261-E265 HydrophobicContact CB-CB 3.78Å; L261-E265 HydrophobicContact CD2-CB 3.67Å; L261-E265 HydrophobicContact CD2-CG 4.22Å; L261-E265 HydrophobicContact CG-CB 4.34Å; T262-E265 WeakPolarHBondContact CB-OE2 3.32Å; T262-E265 WeakPolarHBondContact CG2-OE2 3.25Å; T262-E265 PolarHBondContact N-OE2 3.07Å; T262-E265 PolarHBondContact O-N 2.94Å; T262-E265 VanDerWaalsContact O-N 3.16Å; T262-E265 WeakPolarHBondContact OG1-CG 3.46Å; T262-E265 PolarHBondContact OG1-OE2 3.45Å; E265-R267 VanDerWaalsContact C-N 3.34Å; E265-R267 PolarHBondContact O-N 3.14Å; E265-T268 WeakPolarHBondContact O-CB 3.4Å; E265-T268 PolarHBondContact O-N 3.17Å; E265-V269 WeakPolarHBondContact O-CG2 3.33Å; E265-V269 PolarHBondContact O-N 3.19Å |
| 266 | R | 93.2 | Very high | 92.2 | Very high | 39 Ų | 39 | 45.1 Ų | 45.1 | 15% | 0.147 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60.2 | -42.9 | 176.1 | -68.2 | 175.2 | -165.8 | 166.1 | 1.5 | 112.7 | Y253 S256 L261 T262 T268 V269 A270 | Y253-R266 HydrophobicContact CD2-CB 3.94Å; Y253-R266 HydrophobicContact CE2-CB 3.69Å; S256-R266 VanDerWaalsContact OG-CA 3.31Å; S256-R266 WeakPolarHBondContact OG-CA 3.43Å; S256-R266 WeakPolarHBondContact OG-CB 3.2Å; L261-R266 HydrophobicContact CB-CG 4.19Å; L261-R266 PolarHBondContact O-NE 3.32Å; L261-R266 PolarHBondContact O-NH2 2.93Å; T262-R266 WeakPolarHBondContact O-CG 3.29Å; T262-R266 PolarHBondContact O-N 3.43Å; R266-T268 VanDerWaalsContact C-N 3.32Å; R266-V269 PolarHBondContact O-N 3.03Å; R266-A270 WeakPolarHBondContact O-CB 3.39Å; R266-A270 PolarHBondContact O-N 3.47Å |
| 267 | R | 94.1 | Very high | 92.1 | Very high | 35 Ų | 35 | 46.4 Ų | 46.4 | 13% | 0.132 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.1 | -38.6 | 176.3 | -70.3 | 175 | -69.5 | 169 | 2 | 111.3 | I129 K130 Y253 Q263 P264 E265 M271 | I129-R267 HydrophobicContact CG2-CB 3.88Å; I129-R267 PolarHBondContact O-NH1 3.44Å; K130-R267 PolarHBondContact O-NH1 3.03Å; K130-R267 PolarHBondContact O-NH2 3.2Å; Y253-R267 HydrophobicContact CE2-CG 4.33Å; Q263-R267 WeakPolarHBondContact O-CG 3.44Å; Q263-R267 PolarHBondContact O-N 3.45Å; Q263-R267 PolarHBondContact O-NE 3.26Å; P264-R267 VanDerWaalsContact CA-NH2 3.28Å; P264-R267 PolarHBondContact O-N 2.88Å; E265-R267 VanDerWaalsContact C-N 3.34Å; E265-R267 PolarHBondContact O-N 3.14Å; R267-M271 WeakPolarHBondContact O-CG 3.45Å; R267-M271 PolarHBondContact O-N 3.37Å |
| 268 | T | 93.3 | Very high | 91.8 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61 | -51.5 | 172.6 | -63.1 | 0 | 0 | 0 | 0 | 111.5 | A126 D132 L135 M139 P264 E265 R266 A270 M271 E272 | A126-T268 HydrophobicContact CB-CG2 4.34Å; D132-T268 WeakPolarHBondContact CA-OG1 3.34Å; D132-T268 PolarHBondContact N-OG1 3.3Å; D132-T268 VanDerWaalsContact O-CG2 3.26Å; D132-T268 WeakPolarHBondContact O-CG2 3.41Å; D132-T268 PolarHBondContact O-OG1 3.42Å; L135-T268 HydrophobicContact CB-CG2 4.09Å; L135-T268 HydrophobicContact CD2-CG2 4.23Å; L135-T268 HydrophobicContact CG-CG2 4.06Å; M139-T268 HydrophobicContact SD-CG2 4.41Å; P264-T268 PolarHBondContact O-N 3.04Å; P264-T268 PolarHBondContact O-OG1 3.49Å; E265-T268 WeakPolarHBondContact O-CB 3.4Å; E265-T268 PolarHBondContact O-N 3.17Å; R266-T268 VanDerWaalsContact C-N 3.32Å; T268-A270 VanDerWaalsContact C-N 3.27Å; T268-A270 PolarHBondContact O-N 3.27Å; T268-M271 PolarHBondContact O-N 3.39Å; T268-E272 WeakPolarHBondContact O-CB 3.42Å; T268-E272 PolarHBondContact O-N 2.76Å |
| 269 | V | 93.3 | Very high | 91.2 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61 | -38.9 | -178.9 | 176.4 | 0 | 0 | 0 | 0 | 111.3 | I80 L135 M139 G252 I255 E265 R266 T273 | I80-V269 HydrophobicContact CG2-CG1 3.87Å; I80-V269 HydrophobicContact CG2-CG2 4.33Å; L135-V269 HydrophobicContact CD2-CG2 4.21Å; M139-V269 HydrophobicContact CE-CB 4.16Å; M139-V269 HydrophobicContact CE-CG1 3.98Å; M139-V269 HydrophobicContact CE-CG2 3.86Å; M139-V269 HydrophobicContact SD-CB 4.49Å; M139-V269 HydrophobicContact SD-CG2 3.81Å; G252-V269 VanDerWaalsContact O-CG1 3.31Å; G252-V269 WeakPolarHBondContact O-CG1 3.26Å; I255-V269 HydrophobicContact CG2-CG1 4.38Å; E265-V269 WeakPolarHBondContact O-CG2 3.33Å; E265-V269 PolarHBondContact O-N 3.19Å; R266-V269 PolarHBondContact O-N 3.03Å; V269-T273 WeakPolarHBondContact O-CB 3.38Å; V269-T273 PolarHBondContact O-N 3.07Å; V269-T273 PolarHBondContact O-OG1 3.31Å |
| 270 | A | 94.7 | Very high | 90.6 | Very high | 8 Ų | 8 | 34.8 Ų | 34.8 | 7% | 0.066 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -57.9 | -56.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y249 Y253 R266 T268 E272 T273 G274 | Y249-A270 VanDerWaalsContact CD1-O 3.29Å; Y249-A270 WeakPolarHBondContact CD1-O 3.28Å; Y249-A270 WeakPolarHBondContact O-CB 3.34Å; Y253-A270 HydrophobicContact CD2-CB 4.35Å; R266-A270 WeakPolarHBondContact O-CB 3.39Å; R266-A270 PolarHBondContact O-N 3.47Å; T268-A270 VanDerWaalsContact C-N 3.27Å; T268-A270 PolarHBondContact O-N 3.27Å; A270-E272 VanDerWaalsContact C-N 3.29Å; A270-E272 PolarHBondContact O-N 2.82Å; A270-T273 PolarHBondContact O-N 3.37Å; A270-G274 PolarHBondContact O-N 3.43Å; A270-G274 VanDerWaalsContact O-N 3.09Å |
| 271 | M | 94.3 | Very high | 90.4 | Very high | 3 Ų | 3 | 24.2 Ų | 24.2 | 2% | 0.015 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -59.7 | -39.9 | -179.6 | -70.2 | -62.1 | 166.9 | 0 | 0 | 112.2 | L125 I129 Y249 R267 T268 C275 A312 L315 I316 | L125-M271 HydrophobicContact CB-CB 4.36Å; L125-M271 HydrophobicContact CB-CG 4.22Å; L125-M271 HydrophobicContact CB-SD 3.92Å; I129-M271 HydrophobicContact CB-CE 4.33Å; I129-M271 HydrophobicContact CD1-CE 3.5Å; I129-M271 HydrophobicContact CG1-CE 4.48Å; I129-M271 HydrophobicContact CG2-CE 4.25Å; I129-M271 HydrophobicContact CG2-CG 4.15Å; Y249-M271 HydrophobicContact CD1-SD 4.34Å; Y249-M271 HydrophobicContact CE1-SD 4.09Å; R267-M271 WeakPolarHBondContact O-CG 3.45Å; R267-M271 PolarHBondContact O-N 3.37Å; T268-M271 PolarHBondContact O-N 3.39Å; M271-C275 WeakPolarHBondContact O-CB 3.44Å; M271-C275 PolarHBondContact O-N 3.47Å; M271-A312 HydrophobicContact SD-CB 4.42Å; M271-L315 HydrophobicContact CE-CB 3.95Å; M271-L315 HydrophobicContact CE-CD1 4.17Å; M271-I316 HydrophobicContact CE-CG1 4.42Å |
| 272 | E | 92.5 | Very high | 90 | Very high | 1 Ų | 1 | 23.6 Ų | 23.6 | 1% | 0.005 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64.5 | -44 | 177.8 | -168.6 | 68.5 | -161.8 | 0 | 0 | 112.2 | Q85 S122 S136 M139 T140 T268 A270 | Q85-E272 PolarHBondContact OE1-O 3.45Å; S122-E272 WeakPolarHBondContact CB-OE2 3.45Å; S122-E272 PolarHBondContact OG-OE2 3.46Å; S136-E272 PolarHBondContact OG-OE2 2.95Å; M139-E272 HydrophobicContact CB-CG 3.65Å; M139-E272 HydrophobicContact CE-CB 3.96Å; M139-E272 HydrophobicContact CE-CG 3.83Å; M139-E272 HydrophobicContact SD-CB 4.22Å; M139-E272 HydrophobicContact SD-CG 4.15Å; T140-E272 WeakPolarHBondContact CA-OE1 3.34Å; T140-E272 VanDerWaalsContact CB-OE1 3.29Å; T140-E272 WeakPolarHBondContact CB-OE1 3.23Å; T140-E272 PolarHBondContact N-OE1 3.29Å; T140-E272 VanDerWaalsContact OG1-CD 3.22Å; T140-E272 PolarHBondContact OG1-OE1 2.88Å; T140-E272 PolarHBondContact OG1-OE2 3.28Å; T140-E272 VanDerWaalsContact OG1-OE2 3.13Å; T268-E272 WeakPolarHBondContact O-CB 3.42Å; T268-E272 PolarHBondContact O-N 2.76Å; A270-E272 VanDerWaalsContact C-N 3.29Å; A270-E272 PolarHBondContact O-N 2.82Å |
| 273 | T | 93.2 | Very high | 89.1 | Confident | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -71 | -44.1 | -175.1 | -54.4 | 0 | 0 | 0 | 0 | 111.8 | S84 M89 G248 V269 A270 Q276 | S84-T273 VanDerWaalsContact CB-OG1 3.24Å; S84-T273 WeakPolarHBondContact CB-OG1 3.36Å; S84-T273 PolarHBondContact OG-OG1 3.25Å; M89-T273 WeakPolarHBondContact CE-O 3.16Å; M89-T273 HydrophobicContact CG-CG2 3.87Å; M89-T273 WeakPolarHBondContact CG-O 3.48Å; M89-T273 HydrophobicContact SD-CG2 4.24Å; G248-T273 WeakPolarHBondContact O-CB 3.33Å; G248-T273 WeakPolarHBondContact O-CG2 3.36Å; V269-T273 WeakPolarHBondContact O-CB 3.38Å; V269-T273 PolarHBondContact O-N 3.07Å; V269-T273 PolarHBondContact O-OG1 3.31Å; A270-T273 PolarHBondContact O-N 3.37Å; T273-Q276 PolarHBondContact O-NE2 3.37Å |
| 274 | G | 91.7 | Very high | 88.4 | Confident | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -78.2 | -22.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | A270 Q276 Q308 | A270-G274 PolarHBondContact O-N 3.43Å; A270-G274 VanDerWaalsContact O-N 3.09Å; G274-Q276 PolarHBondContact O-N 2.93Å; G274-Q308 PolarHBondContact O-OE1 2.87Å |
| 275 | C | 92.8 | Very high | 87.7 | Confident | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 6% | 0.062 | C | C | . | . | trans | -92.2 | 91.8 | -178.7 | -171.2 | 0 | 0 | 0 | 0 | 111.7 | G118 G119 S122 L125 Y249 M271 Q308 | G118-C275 WeakPolarHBondContact CA-O 3.32Å; G119-C275 PolarHBondContact N-O 3.38Å; S122-C275 PolarHBondContact N-SG 3.11Å; S122-C275 VanDerWaalsContact N-SG 3.37Å; L125-C275 HydrophobicContact CD1-CB 4.27Å; Y249-C275 HydrophobicContact CE1-CB 4.5Å; M271-C275 WeakPolarHBondContact O-CB 3.44Å; M271-C275 PolarHBondContact O-N 3.47Å; C275-Q308 VanDerWaalsContact CA-CD 3.48Å; C275-Q308 PolarHBondContact SG-NE2 2.88Å | ||
| 276 | Q | 91.6 | Very high | 86.8 | Confident | 5 Ų | 5 | 12.6 Ų | 12.6 | 2% | 0.023 | 6% | 0.06 | C | C | . | . | B | Isolated β-bridge | trans | -77.4 | 154.5 | 178.8 | -65.5 | -63.8 | -24.5 | 0 | 0 | 112.8 | Q85 M89 C116 P117 T273 G274 I278 Q308 | Q85-Q276 VanDerWaalsContact NE2-CD 3.28Å; M89-Q276 HydrophobicContact CE-CG 3.69Å; C116-Q276 PolarHBondContact O-OE1 3.27Å; P117-Q276 PolarHBondContact O-OE1 3.22Å; T273-Q276 PolarHBondContact O-NE2 3.37Å; G274-Q276 PolarHBondContact O-N 2.93Å; Q276-I278 HydrophobicContact CB-CD1 4.44Å; Q276-I278 PolarHBondContact O-N 3.32Å; Q276-Q308 VanDerWaalsContact N-CD 3.32Å; Q276-Q308 PolarHBondContact O-NE2 3.48Å; Q276-Q308 VanDerWaalsContact O-NE2 3.16Å |
| 277 | N | 89.3 | Confident | 85.6 | Confident | 27 Ų | 27 | 12.4 Ų | 12.4 | 14% | 0.144 | 6% | 0.063 | C | C | . | . | trans | -75.7 | 88.4 | 171.5 | -168.2 | -28.2 | 0 | 0 | 0 | 111.1 | P117 Q279 L280 C281 | P117-N277 HydrophobicContact CG-CB 4.38Å; P117-N277 WeakPolarHBondContact O-CB 3.5Å; P117-N277 PolarHBondContact O-N 3.22Å; N277-Q279 VanDerWaalsContact C-N 3.27Å; N277-Q279 PolarHBondContact O-N 3.46Å; N277-Q279 PolarHBondContact OD1-N 3.3Å; N277-L280 HydrophobicContact CB-CB 3.94Å; N277-L280 PolarHBondContact O-N 3.08Å; N277-L280 PolarHBondContact OD1-N 3.02Å; N277-C281 PolarHBondContact O-N 3.36Å | ||
| 278 | I | 87.3 | Confident | 84.4 | Confident | 31 Ų | 31 | 11.9 Ų | 11.9 | 16% | 0.159 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -59.8 | -37.5 | -179.1 | -56.9 | -53.9 | 0 | 0 | 0 | 112.4 | Q276 C281 A282 P301 L304 | Q276-I278 HydrophobicContact CB-CD1 4.44Å; Q276-I278 PolarHBondContact O-N 3.32Å; I278-C281 PolarHBondContact O-N 3.17Å; I278-A282 WeakPolarHBondContact O-CB 3.37Å; I278-A282 PolarHBondContact O-N 3Å; I278-P301 HydrophobicContact CG2-CB 4.2Å; I278-P301 WeakPolarHBondContact CG2-O 3.27Å; I278-L304 HydrophobicContact CD1-CB 4.49Å; I278-L304 HydrophobicContact CD1-CD2 4.14Å; I278-L304 HydrophobicContact CD1-CG 4.29Å |
| 279 | Q | 78.3 | Confident | 83.3 | Confident | 64 Ų | 64 | 13 Ų | 13 | 30% | 0.299 | 7% | 0.071 | S | C | . | . | H | α-helix | trans | -63.3 | -45 | 177.6 | -177.6 | -177.9 | -23.3 | 0 | 0 | 110.7 | L210 N277 T283 | L210-Q279 HydrophobicContact CD2-CG 4.07Å; N277-Q279 VanDerWaalsContact C-N 3.27Å; N277-Q279 PolarHBondContact O-N 3.46Å; N277-Q279 PolarHBondContact OD1-N 3.3Å; Q279-T283 WeakPolarHBondContact O-CB 3.48Å; Q279-T283 PolarHBondContact O-N 2.92Å; Q279-T283 PolarHBondContact O-OG1 3.48Å |
| 280 | L | 78.3 | Confident | 82 | Confident | 13 Ų | 13 | 16.7 Ų | 16.7 | 7% | 0.068 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -61.4 | -48.3 | 173.9 | 178 | 69.3 | 0 | 0 | 0 | 111 | L59 C116 P117 M151 N277 A282 T283 V284 | L59-L280 HydrophobicContact CD1-CB 4.11Å; L59-L280 HydrophobicContact CD1-CD1 3.41Å; L59-L280 VanDerWaalsContact CD1-CD1 3.41Å; L59-L280 HydrophobicContact CD1-CG 4.35Å; L59-L280 HydrophobicContact CD2-CD1 3.11Å; L59-L280 HydrophobicContact CG-CD1 3.73Å; C116-L280 HydrophobicContact CB-CD2 4.41Å; P117-L280 HydrophobicContact CG-CD2 3.67Å; M151-L280 HydrophobicContact SD-CD2 4.07Å; N277-L280 HydrophobicContact CB-CB 3.94Å; N277-L280 PolarHBondContact O-N 3.08Å; N277-L280 PolarHBondContact OD1-N 3.02Å; L280-A282 PolarHBondContact O-N 3.06Å; L280-T283 PolarHBondContact O-N 3.11Å; L280-V284 HydrophobicContact CD1-CG2 3.78Å; L280-V284 HydrophobicContact CG-CG2 4.15Å; L280-V284 WeakPolarHBondContact O-CG2 3.11Å; L280-V284 PolarHBondContact O-N 2.57Å |
| 281 | C | 84.7 | Confident | 80.6 | Confident | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -56.8 | -50.9 | -179.5 | -173.1 | 0 | 0 | 0 | 0 | 110.7 | C113 C116 N277 I278 T283 V284 V285 P301 | C113-C281 WeakPolarHBondContact CA-SG 3.36Å; C113-C281 HydrophobicContact CB-CB 4.24Å; C113-C281 WeakPolarHBondContact CB-SG 3.27Å; C113-C281 PolarHBondContact N-SG 3.32Å; C113-C281 VanDerWaalsContact N-SG 3.41Å; C113-C281 WeakPolarHBondContact SG-CB 3.31Å; C113-C281 CovalentContact SG-SG 2.07Å; C113-C281 PolarHBondContact SG-SG 3.1Å; C116-C281 VanDerWaalsContact SG-CA 3.55Å; C116-C281 VanDerWaalsContact SG-CB 3.54Å; N277-C281 PolarHBondContact O-N 3.36Å; I278-C281 PolarHBondContact O-N 3.17Å; C281-T283 VanDerWaalsContact C-N 3.32Å; C281-T283 PolarHBondContact O-N 3.24Å; C281-V284 PolarHBondContact O-N 2.99Å; C281-V285 VanDerWaalsContact O-CG2 3.29Å; C281-V285 WeakPolarHBondContact O-CG2 3.38Å; C281-V285 PolarHBondContact O-N 3.5Å; C281-P301 HydrophobicContact CB-CB 4.13Å; C281-P301 HydrophobicContact CB-CG 4.3Å |
| 282 | A | 80.3 | Confident | 79.1 | Confident | 4 Ų | 4 | 23.6 Ų | 23.6 | 3% | 0.033 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.1 | -41.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | I278 L280 K286 P301 | I278-A282 WeakPolarHBondContact O-CB 3.37Å; I278-A282 PolarHBondContact O-N 3Å; L280-A282 PolarHBondContact O-N 3.06Å; A282-K286 VanDerWaalsContact O-CG 3.31Å; A282-K286 WeakPolarHBondContact O-CG 3.4Å; A282-K286 PolarHBondContact O-N 3.19Å; A282-P301 HydrophobicContact CB-CB 4.08Å; A282-P301 HydrophobicContact CB-CG 4.32Å |
| 283 | T | 74.3 | Confident | 77.8 | Confident | 2 Ų | 2 | 27.5 Ų | 27.5 | 1% | 0.012 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.5 | -50.2 | 174.7 | -77.4 | 0 | 0 | 0 | 0 | 111.5 | V55 M56 L59 L210 Q279 L280 C281 K286 V287 | V55-T283 HydrophobicContact CG1-CG2 3.34Å; M56-T283 HydrophobicContact CE-CG2 3.44Å; M56-T283 VanDerWaalsContact CE-CG2 3.44Å; M56-T283 HydrophobicContact SD-CG2 3.89Å; L59-T283 HydrophobicContact CD2-CG2 4.25Å; L210-T283 WeakPolarHBondContact CD2-OG1 3.33Å; Q279-T283 WeakPolarHBondContact O-CB 3.48Å; Q279-T283 PolarHBondContact O-N 2.92Å; Q279-T283 PolarHBondContact O-OG1 3.48Å; L280-T283 PolarHBondContact O-N 3.11Å; C281-T283 VanDerWaalsContact C-N 3.32Å; C281-T283 PolarHBondContact O-N 3.24Å; T283-K286 PolarHBondContact O-N 2.97Å; T283-V287 WeakPolarHBondContact O-CB 3.29Å; T283-V287 VanDerWaalsContact O-CG2 3.28Å; T283-V287 WeakPolarHBondContact O-CG2 3.31Å; T283-V287 PolarHBondContact O-N 3.47Å |
| 284 | V | 75.4 | Confident | 76.6 | Confident | 4 Ų | 4 | 28 Ų | 28 | 2% | 0.024 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.2 | -42.5 | -177.1 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | M56 I112 M151 L280 C281 K286 V287 A288 | M56-V284 HydrophobicContact CE-CG2 4.35Å; I112-V284 HydrophobicContact CD1-CG1 4.22Å; I112-V284 HydrophobicContact CG1-CG1 4.38Å; I112-V284 HydrophobicContact CG2-CB 3.94Å; I112-V284 HydrophobicContact CG2-CG1 3.77Å; M151-V284 HydrophobicContact CE-CB 4.06Å; M151-V284 HydrophobicContact CE-CG1 3.87Å; M151-V284 HydrophobicContact CE-CG2 3.92Å; M151-V284 HydrophobicContact SD-CG2 4.29Å; L280-V284 HydrophobicContact CD1-CG2 3.78Å; L280-V284 HydrophobicContact CG-CG2 4.15Å; L280-V284 WeakPolarHBondContact O-CG2 3.11Å; L280-V284 PolarHBondContact O-N 2.57Å; C281-V284 PolarHBondContact O-N 2.99Å; V284-K286 PolarHBondContact O-N 3.31Å; V284-V287 PolarHBondContact O-N 3.19Å; V284-A288 WeakPolarHBondContact O-CB 3.38Å; V284-A288 PolarHBondContact O-N 3.33Å |
| 285 | V | 77.9 | Confident | 75.8 | Confident | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.4 | -47.9 | 178.1 | 170 | 0 | 0 | 0 | 0 | 111.5 | V109 I112 C281 V287 F289 I294 P301 | V109-V285 HydrophobicContact CG1-CG1 4.28Å; V109-V285 HydrophobicContact CG1-CG2 3.9Å; V109-V285 HydrophobicContact CG2-CG1 4.02Å; V109-V285 HydrophobicContact CG2-CG2 4.42Å; I112-V285 HydrophobicContact CB-CG2 4.27Å; I112-V285 HydrophobicContact CD1-CG2 4.17Å; I112-V285 HydrophobicContact CG2-CG2 3.84Å; C281-V285 VanDerWaalsContact O-CG2 3.29Å; C281-V285 WeakPolarHBondContact O-CG2 3.38Å; C281-V285 PolarHBondContact O-N 3.5Å; V285-V287 PolarHBondContact O-N 3.45Å; V285-F289 WeakPolarHBondContact O-CD2 3.36Å; V285-F289 PolarHBondContact O-N 3.06Å; V285-I294 HydrophobicContact CG1-CD1 3.83Å; V285-P301 HydrophobicContact CG2-CG 4.34Å |
| 286 | K | 73 | Confident | 75 | Confident | 29 Ų | 29 | 30.6 Ų | 30.6 | 13% | 0.126 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.8 | -30.2 | 179.8 | -78.9 | 177.6 | 169.1 | -170.9 | 0 | 114.1 | L210 I214 A282 T283 V284 | L210-K286 HydrophobicContact CD1-CD 3.76Å; L210-K286 PolarHBondContact O-NZ 3.21Å; I214-K286 VanDerWaalsContact CA-NZ 3.31Å; A282-K286 VanDerWaalsContact O-CG 3.31Å; A282-K286 WeakPolarHBondContact O-CG 3.4Å; A282-K286 PolarHBondContact O-N 3.19Å; T283-K286 PolarHBondContact O-N 2.97Å; V284-K286 PolarHBondContact O-N 3.31Å |
| 287 | V | 67.9 | Low | 74.5 | Confident | 34 Ų | 34 | 30.8 Ų | 30.8 | 21% | 0.206 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -90.6 | -41.2 | -172.7 | 153.2 | 0 | 0 | 0 | 0 | 111.3 | L52 M56 I181 T283 V284 V285 F289 | L52-V287 HydrophobicContact CB-CG2 4.45Å; L52-V287 HydrophobicContact CD1-CB 3.68Å; L52-V287 HydrophobicContact CD1-CG1 3.01Å; L52-V287 HydrophobicContact CD1-CG2 3.33Å; L52-V287 HydrophobicContact CD2-CG1 4.4Å; L52-V287 HydrophobicContact CG-CG1 4.29Å; L52-V287 HydrophobicContact CG-CG2 4.49Å; M56-V287 HydrophobicContact CE-CB 3.64Å; M56-V287 HydrophobicContact CE-CG1 3.52Å; M56-V287 HydrophobicContact CE-CG2 3.71Å; I181-V287 HydrophobicContact CD1-CG1 3.61Å; I181-V287 HydrophobicContact CG1-CG1 3.49Å; I181-V287 VanDerWaalsContact CG1-CG1 3.49Å; T283-V287 WeakPolarHBondContact O-CB 3.29Å; T283-V287 VanDerWaalsContact O-CG2 3.28Å; T283-V287 WeakPolarHBondContact O-CG2 3.31Å; T283-V287 PolarHBondContact O-N 3.47Å; V284-V287 PolarHBondContact O-N 3.19Å; V285-V287 PolarHBondContact O-N 3.45Å; V287-F289 PolarHBondContact O-N 2.99Å |
| 288 | A | 69.4 | Low | 74 | Confident | 25 Ų | 25 | 29.8 Ų | 29.8 | 21% | 0.207 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -69.6 | -23.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112 | I181 V284 | I181-A288 HydrophobicContact CD1-CB 4.46Å; V284-A288 WeakPolarHBondContact O-CB 3.38Å; V284-A288 PolarHBondContact O-N 3.33Å |
| 289 | F | 69.6 | Low | 73.6 | Confident | 24 Ų | 24 | 29.4 Ų | 29.4 | 11% | 0.105 | 19% | 0.189 | C | C | . | . | S | Bend | trans | -128.6 | 137.2 | -173.7 | -60.7 | -75.1 | 0 | 0 | 0 | 113.4 | V108 I112 V285 V287 V293 I294 | V108-F289 HydrophobicContact CB-CZ 4.04Å; V108-F289 HydrophobicContact CG1-CE2 4.04Å; V108-F289 HydrophobicContact CG1-CZ 3.49Å; V108-F289 VanDerWaalsContact CG1-CZ 3.49Å; I112-F289 HydrophobicContact CD1-CD2 4.46Å; I112-F289 HydrophobicContact CD1-CE2 3.58Å; I112-F289 HydrophobicContact CD1-CZ 4.43Å; V285-F289 WeakPolarHBondContact O-CD2 3.36Å; V285-F289 PolarHBondContact O-N 3.06Å; V287-F289 PolarHBondContact O-N 2.99Å; F289-V293 HydrophobicContact CD1-CG1 4.48Å; F289-I294 HydrophobicContact CB-CB 4.2Å; F289-I294 HydrophobicContact CB-CD1 3.97Å; F289-I294 HydrophobicContact CB-CG1 3.83Å; F289-I294 HydrophobicContact CB-CG2 3.36Å; F289-I294 HydrophobicContact CD1-CG2 4.11Å; F289-I294 HydrophobicContact CD2-CG2 3.73Å; F289-I294 HydrophobicContact CG-CG2 3.45Å; F289-I294 VanDerWaalsContact CG-CG2 3.45Å |
| 290 | P | 65.8 | Low | 74 | Confident | 76 Ų | 76 | 26.5 Ų | 26.5 | 49% | 0.494 | 18% | 0.176 | S | C | . | . | trans | -59.5 | 141.6 | 166.1 | -19.1 | 30.9 | 0 | 0 | 0 | 110.5 | A292 V293 I294 | P290-A292 PolarHBondContact O-N 3.35Å; P290-A292 VanDerWaalsContact O-N 3.08Å; P290-V293 HydrophobicContact CB-CG2 4.18Å; P290-V293 HydrophobicContact CG-CG2 4.09Å; P290-V293 PolarHBondContact O-N 3.26Å; P290-I294 WeakPolarHBondContact O-CG1 3.47Å; P290-I294 PolarHBondContact O-N 3.44Å | ||
| 291 | P | 64.1 | Low | 74.6 | Confident | 57 Ų | 57 | 25.9 Ų | 25.9 | 37% | 0.37 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -52.3 | -35.3 | 178.7 | -28.1 | 34.8 | 0 | 0 | 0 | 113.6 | M48 V293 G295 | M48-P291 HydrophobicContact CE-CG 3.77Å; P291-V293 VanDerWaalsContact C-N 3.26Å; P291-V293 PolarHBondContact O-N 3.49Å; P291-G295 PolarHBondContact O-N 3.43Å |
| 292 | A | 63.1 | Low | 74.6 | Confident | 100 Ų | 100 | 29.9 Ų | 29.9 | 83% | 0.826 | 19% | 0.193 | S | C | * | . | H | α-helix | trans | -64.5 | -24.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | P290 | P290-A292 PolarHBondContact O-N 3.35Å; P290-A292 VanDerWaalsContact O-N 3.08Å |
| 293 | V | 66.1 | Low | 75 | Confident | 83 Ų | 83 | 31.5 Ų | 31.5 | 50% | 0.503 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -89.2 | -41.3 | -176.8 | 177.2 | 0 | 0 | 0 | 0 | 111.6 | F289 P290 P291 | F289-V293 HydrophobicContact CD1-CG1 4.48Å; P290-V293 HydrophobicContact CB-CG2 4.18Å; P290-V293 HydrophobicContact CG-CG2 4.09Å; P290-V293 PolarHBondContact O-N 3.26Å; P291-V293 VanDerWaalsContact C-N 3.26Å; P291-V293 PolarHBondContact O-N 3.49Å |
| 294 | I | 68.5 | Low | 75.9 | Confident | 10 Ų | 10 | 31.5 Ų | 31.5 | 5% | 0.051 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -91.1 | -20.8 | -176.7 | 46.1 | 161.9 | 0 | 0 | 0 | 113.3 | V109 V285 F289 P290 M297 | V109-I294 HydrophobicContact CG2-CG2 3.96Å; V285-I294 HydrophobicContact CG1-CD1 3.83Å; F289-I294 HydrophobicContact CB-CB 4.2Å; F289-I294 HydrophobicContact CB-CD1 3.97Å; F289-I294 HydrophobicContact CB-CG1 3.83Å; F289-I294 HydrophobicContact CB-CG2 3.36Å; F289-I294 HydrophobicContact CD1-CG2 4.11Å; F289-I294 HydrophobicContact CD2-CG2 3.73Å; F289-I294 HydrophobicContact CG-CG2 3.45Å; F289-I294 VanDerWaalsContact CG-CG2 3.45Å; P290-I294 WeakPolarHBondContact O-CG1 3.47Å; P290-I294 PolarHBondContact O-N 3.44Å; I294-M297 HydrophobicContact CB-CB 4.42Å; I294-M297 VanDerWaalsContact O-CB 3.27Å; I294-M297 WeakPolarHBondContact O-CB 3.14Å; I294-M297 PolarHBondContact O-N 3.48Å |
| 295 | G | 74.4 | Confident | 76.6 | Confident | 28 Ų | 28 | 31.8 Ų | 31.8 | 29% | 0.289 | 21% | 0.207 | S | C | . | . | G | 310 helix | trans | 48.2 | -130.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | P291 M297 Y298 | P291-G295 PolarHBondContact O-N 3.43Å; G295-M297 PolarHBondContact O-N 2.9Å; G295-M297 VanDerWaalsContact O-N 3.1Å; G295-Y298 WeakPolarHBondContact O-CD1 3.24Å |
| 296 | P | 75.8 | Confident | 77.2 | Confident | 26 Ų | 26 | 38.8 Ų | 38.8 | 17% | 0.169 | 24% | 0.237 | C | C | . | . | G | 310 helix | trans | -67 | -11 | -177.1 | 27.9 | -34.7 | 0 | 0 | 0 | 114.9 | T231 M232 Y298 L299 | T231-P296 WeakPolarHBondContact OG1-CG 3.43Å; M232-P296 HydrophobicContact CE-CB 3.78Å; M232-P296 HydrophobicContact CE-CG 3.68Å; M232-P296 HydrophobicContact CG-CB 4.04Å; M232-P296 HydrophobicContact SD-CB 4.14Å; P296-Y298 PolarHBondContact O-N 2.88Å; P296-L299 WeakPolarHBondContact O-CB 3.47Å; P296-L299 PolarHBondContact O-N 2.98Å |
| 297 | M | 80.6 | Confident | 78.1 | Confident | 10 Ų | 10 | 39.3 Ų | 39.3 | 5% | 0.049 | 24% | 0.24 | C | C | . | . | G | 310 helix | trans | -64.3 | -14 | -175.8 | -71.9 | -63 | -59.7 | 0 | 0 | 114.5 | T106 V109 M232 L237 I294 G295 L299 F300 | T106-M297 HydrophobicContact CG2-CE 3.58Å; T106-M297 HydrophobicContact CG2-SD 3.91Å; V109-M297 HydrophobicContact CB-CE 3.94Å; V109-M297 HydrophobicContact CG1-CB 4.32Å; V109-M297 HydrophobicContact CG1-CE 3.76Å; V109-M297 HydrophobicContact CG2-CB 4.09Å; M232-M297 HydrophobicContact CE-CG 4.15Å; M232-M297 HydrophobicContact CE-SD 3.46Å; M232-M297 WeakPolarHBondContact CE-SD 3.37Å; M232-M297 HydrophobicContact SD-SD 4.07Å; L237-M297 HydrophobicContact CD1-SD 3.89Å; L237-M297 HydrophobicContact CD2-CE 4.31Å; L237-M297 HydrophobicContact CD2-SD 4.44Å; I294-M297 HydrophobicContact CB-CB 4.42Å; I294-M297 VanDerWaalsContact O-CB 3.27Å; I294-M297 WeakPolarHBondContact O-CB 3.14Å; I294-M297 PolarHBondContact O-N 3.48Å; G295-M297 PolarHBondContact O-N 2.9Å; G295-M297 VanDerWaalsContact O-N 3.1Å; M297-L299 PolarHBondContact O-N 3.48Å; M297-F300 HydrophobicContact CE-CB 3.81Å; M297-F300 HydrophobicContact CE-CD2 4.2Å; M297-F300 HydrophobicContact CE-CG 3.92Å; M297-F300 WeakPolarHBondContact O-CB 3.38Å; M297-F300 PolarHBondContact O-N 2.92Å; M297-F300 VanDerWaalsContact O-N 3.11Å |
| 298 | Y | 78.7 | Confident | 79.4 | Confident | 6 Ų | 6 | 37.8 Ų | 37.8 | 2% | 0.024 | 23% | 0.23 | C | C | . | . | G | 310 helix | trans | -62.7 | -18 | 170.4 | 75.9 | -90.7 | 0 | 0 | 0 | 112.8 | I217 C218 S221 G295 P296 P301 | I217-Y298 HydrophobicContact CB-CE1 4.46Å; I217-Y298 HydrophobicContact CB-CE2 4.47Å; I217-Y298 HydrophobicContact CG2-CD1 3.71Å; I217-Y298 HydrophobicContact CG2-CE1 3.39Å; I217-Y298 HydrophobicContact CG2-CE2 4.18Å; I217-Y298 HydrophobicContact CG2-CG 4.32Å; C218-Y298 WeakPolarHBondContact CA-OH 3.26Å; C218-Y298 PolarHBondContact N-OH 3.47Å; C218-Y298 PolarHBondContact SG-OH 2.84Å; S221-Y298 PolarHBondContact OG-OH 3.22Å; G295-Y298 WeakPolarHBondContact O-CD1 3.24Å; P296-Y298 PolarHBondContact O-N 2.88Å; Y298-P301 WeakPolarHBondContact O-CD 3.48Å |
| 299 | L | 80 | Confident | 80.6 | Confident | 23 Ų | 23 | 40 Ų | 40 | 12% | 0.12 | 24% | 0.241 | C | C | . | . | G | 310 helix | trans | -81.6 | -21.4 | 175.9 | -66.5 | 175.2 | 0 | 0 | 0 | 113.1 | C218 L229 M232 P296 M297 P301 L302 V303 | C218-L299 VanDerWaalsContact SG-CD2 3.57Å; L229-L299 HydrophobicContact CD2-CD1 3.85Å; M232-L299 HydrophobicContact CG-CB 4.32Å; M232-L299 HydrophobicContact CG-CD1 4.37Å; M232-L299 HydrophobicContact SD-CB 4.37Å; P296-L299 WeakPolarHBondContact O-CB 3.47Å; P296-L299 PolarHBondContact O-N 2.98Å; M297-L299 PolarHBondContact O-N 3.48Å; L299-P301 VanDerWaalsContact C-CD 3.44Å; L299-P301 VanDerWaalsContact C-N 3.35Å; L299-L302 HydrophobicContact CD2-CD1 4.2Å; L299-L302 WeakPolarHBondContact O-CB 3.5Å; L299-L302 PolarHBondContact O-N 2.95Å; L299-V303 PolarHBondContact O-N 3.38Å |
| 300 | F | 86.9 | Confident | 81.7 | Confident | 2 Ų | 2 | 41 Ų | 41 | 1% | 0.009 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -54.8 | -41.5 | -175.7 | -176.9 | -95.7 | 0 | 0 | 0 | 113.7 | V109 I110 L237 I240 A241 M297 L302 V303 L304 | V109-F300 HydrophobicContact CG1-CB 4.27Å; V109-F300 HydrophobicContact CG1-CD1 4.32Å; I110-F300 HydrophobicContact CD1-CZ 4.4Å; I110-F300 HydrophobicContact CG1-CD1 4.17Å; I110-F300 HydrophobicContact CG1-CE1 3.64Å; I110-F300 HydrophobicContact CG1-CE2 4.42Å; I110-F300 HydrophobicContact CG1-CZ 3.79Å; L237-F300 HydrophobicContact CB-CE2 4.31Å; L237-F300 HydrophobicContact CD2-CD2 4.42Å; L237-F300 HydrophobicContact CD2-CE2 4.27Å; I240-F300 HydrophobicContact CG2-CZ 4.06Å; A241-F300 HydrophobicContact CB-CE2 4.22Å; A241-F300 HydrophobicContact CB-CZ 4.37Å; M297-F300 HydrophobicContact CE-CB 3.81Å; M297-F300 HydrophobicContact CE-CD2 4.2Å; M297-F300 HydrophobicContact CE-CG 3.92Å; M297-F300 WeakPolarHBondContact O-CB 3.38Å; M297-F300 PolarHBondContact O-N 2.92Å; M297-F300 VanDerWaalsContact O-N 3.11Å; F300-L302 PolarHBondContact O-N 2.9Å; F300-V303 PolarHBondContact O-N 3.5Å; F300-V303 VanDerWaalsContact O-N 3.11Å; F300-L304 HydrophobicContact CE1-CB 4.41Å; F300-L304 WeakPolarHBondContact O-CB 3.3Å; F300-L304 PolarHBondContact O-N 3.38Å |
| 301 | P | 89.3 | Confident | 83.2 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57 | -34.1 | 174.5 | -25.3 | 35.2 | 0 | 0 | 0 | 113.6 | I278 C281 A282 V285 Y298 L299 G305 | I278-P301 HydrophobicContact CG2-CB 4.2Å; I278-P301 WeakPolarHBondContact CG2-O 3.27Å; C281-P301 HydrophobicContact CB-CB 4.13Å; C281-P301 HydrophobicContact CB-CG 4.3Å; A282-P301 HydrophobicContact CB-CB 4.08Å; A282-P301 HydrophobicContact CB-CG 4.32Å; V285-P301 HydrophobicContact CG2-CG 4.34Å; Y298-P301 WeakPolarHBondContact O-CD 3.48Å; L299-P301 VanDerWaalsContact C-CD 3.44Å; L299-P301 VanDerWaalsContact C-N 3.35Å; P301-G305 PolarHBondContact O-N 2.97Å |
| 302 | L | 85.9 | Confident | 84.6 | Confident | 85 Ų | 85 | 35.7 Ų | 35.7 | 45% | 0.445 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -71.1 | -40.9 | 177 | -61.3 | 176.9 | 0 | 0 | 0 | 111.6 | L299 F300 G305 F306 | L299-L302 HydrophobicContact CD2-CD1 4.2Å; L299-L302 WeakPolarHBondContact O-CB 3.5Å; L299-L302 PolarHBondContact O-N 2.95Å; F300-L302 PolarHBondContact O-N 2.9Å; L302-G305 PolarHBondContact O-N 3.13Å; L302-F306 PolarHBondContact O-N 3.47Å |
| 303 | V | 89 | Confident | 86.1 | Confident | 38 Ų | 38 | 33.2 Ų | 33.2 | 23% | 0.23 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -61.9 | -46.8 | 174.8 | 179.6 | 0 | 0 | 0 | 0 | 110.1 | A241 L299 F300 G305 F306 F307 | A241-V303 HydrophobicContact CB-CG1 3.94Å; L299-V303 PolarHBondContact O-N 3.38Å; F300-V303 PolarHBondContact O-N 3.5Å; F300-V303 VanDerWaalsContact O-N 3.11Å; V303-G305 VanDerWaalsContact C-N 3.32Å; V303-G305 PolarHBondContact O-N 2.86Å; V303-F306 WeakPolarHBondContact O-CB 3.09Å; V303-F306 PolarHBondContact O-N 3.38Å; V303-F307 HydrophobicContact CG1-CD2 3.98Å; V303-F307 HydrophobicContact CG1-CE2 3.83Å; V303-F307 VanDerWaalsContact O-CD2 3.32Å; V303-F307 WeakPolarHBondContact O-CD2 3.38Å; V303-F307 PolarHBondContact O-N 3.39Å |
| 304 | L | 91.9 | Very high | 87.5 | Confident | 1 Ų | 1 | 34.2 Ų | 34.2 | 1% | 0.005 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -57.3 | -45.7 | 173.8 | -176.2 | 71.3 | 0 | 0 | 0 | 111.3 | C113 L244 P245 I278 F300 F306 F307 Q308 | C113-L304 HydrophobicContact CB-CD2 3.63Å; L244-L304 HydrophobicContact CB-CD1 4.19Å; L244-L304 HydrophobicContact CD2-CD1 3.98Å; L244-L304 HydrophobicContact CD2-CD2 4.15Å; P245-L304 HydrophobicContact CG-CD1 3.63Å; P245-L304 HydrophobicContact CG-CG 4.41Å; I278-L304 HydrophobicContact CD1-CB 4.49Å; I278-L304 HydrophobicContact CD1-CD2 4.14Å; I278-L304 HydrophobicContact CD1-CG 4.29Å; F300-L304 HydrophobicContact CE1-CB 4.41Å; F300-L304 WeakPolarHBondContact O-CB 3.3Å; F300-L304 PolarHBondContact O-N 3.38Å; L304-F306 VanDerWaalsContact C-N 3.32Å; L304-F306 PolarHBondContact O-N 3.48Å; L304-F307 PolarHBondContact O-N 3.17Å; L304-Q308 WeakPolarHBondContact O-CB 3.49Å; L304-Q308 PolarHBondContact O-N 3.06Å |
| 305 | G | 90.5 | Very high | 88.7 | Confident | 11 Ų | 11 | 36.6 Ų | 36.6 | 11% | 0.113 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.3 | -39 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | P301 L302 V303 V309 | P301-G305 PolarHBondContact O-N 2.97Å; L302-G305 PolarHBondContact O-N 3.13Å; V303-G305 VanDerWaalsContact C-N 3.32Å; V303-G305 PolarHBondContact O-N 2.86Å; G305-V309 VanDerWaalsContact O-CG2 3.25Å; G305-V309 WeakPolarHBondContact O-CG2 3.3Å; G305-V309 PolarHBondContact O-N 3.44Å; G305-V309 VanDerWaalsContact O-N 3.07Å |
| 306 | F | 89.9 | Confident | 89.7 | Confident | 146 Ų | 146 | 36.2 Ų | 36.2 | 64% | 0.64 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -61.4 | -51.4 | 175.4 | 174.4 | -94.3 | 0 | 0 | 0 | 111.6 | L302 V303 L304 V309 A310 | L302-F306 PolarHBondContact O-N 3.47Å; V303-F306 WeakPolarHBondContact O-CB 3.09Å; V303-F306 PolarHBondContact O-N 3.38Å; L304-F306 VanDerWaalsContact C-N 3.32Å; L304-F306 PolarHBondContact O-N 3.48Å; F306-V309 PolarHBondContact O-N 3.06Å; F306-A310 WeakPolarHBondContact O-CB 3.38Å; F306-A310 PolarHBondContact O-N 3.32Å |
| 307 | F | 93.8 | Very high | 90.5 | Very high | 40 Ų | 40 | 38.9 Ų | 38.9 | 18% | 0.175 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.8 | -41.4 | 179.3 | -76.7 | -68.7 | 0 | 0 | 0 | 112.3 | M238 A241 V242 V303 L304 V309 A310 E311 | M238-F307 HydrophobicContact CE-CZ 3.99Å; A241-F307 HydrophobicContact CB-CD2 3.63Å; A241-F307 HydrophobicContact CB-CE2 4.11Å; A241-F307 HydrophobicContact CB-CG 4.49Å; A241-F307 WeakPolarHBondContact O-CB 3.39Å; V242-F307 HydrophobicContact CG2-CD1 3.4Å; V242-F307 VanDerWaalsContact CG2-CD1 3.4Å; V242-F307 HydrophobicContact CG2-CD2 4.28Å; V242-F307 HydrophobicContact CG2-CE1 3.49Å; V242-F307 VanDerWaalsContact CG2-CE1 3.49Å; V242-F307 HydrophobicContact CG2-CE2 4.35Å; V242-F307 HydrophobicContact CG2-CG 3.82Å; V242-F307 HydrophobicContact CG2-CZ 3.98Å; V303-F307 HydrophobicContact CG1-CD2 3.98Å; V303-F307 HydrophobicContact CG1-CE2 3.83Å; V303-F307 VanDerWaalsContact O-CD2 3.32Å; V303-F307 WeakPolarHBondContact O-CD2 3.38Å; V303-F307 PolarHBondContact O-N 3.39Å; L304-F307 PolarHBondContact O-N 3.17Å; F307-V309 VanDerWaalsContact C-N 3.31Å; F307-V309 PolarHBondContact O-N 2.97Å; F307-A310 PolarHBondContact O-N 3.45Å; F307-E311 WeakPolarHBondContact O-CB 3.42Å; F307-E311 WeakPolarHBondContact O-CG 3.33Å; F307-E311 PolarHBondContact O-N 3.35Å |
| 308 | Q | 94.9 | Very high | 91.2 | Very high | 2 Ų | 2 | 43.1 Ų | 43.1 | 1% | 0.009 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -54.1 | -45.6 | 174.4 | 178.8 | -179.4 | -61 | 0 | 0 | 112.3 | P245 Y249 G274 C275 Q276 L304 A312 | P245-Q308 HydrophobicContact CB-CB 4.07Å; P245-Q308 HydrophobicContact CB-CG 4.32Å; P245-Q308 HydrophobicContact CG-CB 3.99Å; Y249-Q308 VanDerWaalsContact OH-CG 3.24Å; Y249-Q308 WeakPolarHBondContact OH-CG 3.2Å; Y249-Q308 PolarHBondContact OH-O 3.02Å; G274-Q308 PolarHBondContact O-OE1 2.87Å; C275-Q308 VanDerWaalsContact CA-CD 3.48Å; C275-Q308 PolarHBondContact SG-NE2 2.88Å; Q276-Q308 VanDerWaalsContact N-CD 3.32Å; Q276-Q308 PolarHBondContact O-NE2 3.48Å; Q276-Q308 VanDerWaalsContact O-NE2 3.16Å; L304-Q308 WeakPolarHBondContact O-CB 3.49Å; L304-Q308 PolarHBondContact O-N 3.06Å; Q308-A312 VanDerWaalsContact O-CB 3.31Å; Q308-A312 WeakPolarHBondContact O-CB 3.4Å; Q308-A312 PolarHBondContact O-N 2.7Å; Q308-A312 VanDerWaalsContact O-N 3.08Å |
| 309 | V | 93.3 | Very high | 91.8 | Very high | 71 Ų | 71 | 44.6 Ų | 44.6 | 43% | 0.43 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -68.8 | -44.7 | 177.2 | 171.9 | 0 | 0 | 0 | 0 | 111.2 | L121 G305 F306 F307 E311 A312 A313 | L121-V309 HydrophobicContact CD2-CG2 3.63Å; G305-V309 VanDerWaalsContact O-CG2 3.25Å; G305-V309 WeakPolarHBondContact O-CG2 3.3Å; G305-V309 PolarHBondContact O-N 3.44Å; G305-V309 VanDerWaalsContact O-N 3.07Å; F306-V309 PolarHBondContact O-N 3.06Å; F307-V309 VanDerWaalsContact C-N 3.31Å; F307-V309 PolarHBondContact O-N 2.97Å; V309-E311 PolarHBondContact O-N 2.97Å; V309-A312 PolarHBondContact O-N 3.27Å; V309-A313 WeakPolarHBondContact O-CB 3.49Å; V309-A313 PolarHBondContact O-N 2.84Å |
| 310 | A | 93.8 | Very high | 92.4 | Very high | 46 Ų | 46 | 50.9 Ų | 50.9 | 38% | 0.38 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.9 | -45.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | F306 F307 A313 L314 | F306-A310 WeakPolarHBondContact O-CB 3.38Å; F306-A310 PolarHBondContact O-N 3.32Å; F307-A310 PolarHBondContact O-N 3.45Å; A310-A313 PolarHBondContact O-N 3.17Å; A310-L314 PolarHBondContact O-N 2.89Å |
| 311 | E | 96 | Very high | 92.6 | Very high | 21 Ų | 21 | 53.7 Ų | 53.7 | 10% | 0.098 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -66.4 | -42.7 | 176.8 | -72.5 | 173.4 | -163.3 | 0 | 0 | 112.1 | V242 L246 Y249 F307 V309 A313 L314 L315 | V242-E311 WeakPolarHBondContact CA-OE1 3.04Å; V242-E311 WeakPolarHBondContact CG1-OE1 3.12Å; L246-E311 VanDerWaalsContact CA-OE2 3.32Å; L246-E311 WeakPolarHBondContact CA-OE2 3.41Å; L246-E311 WeakPolarHBondContact CB-OE2 3.28Å; L246-E311 PolarHBondContact N-OE2 3.28Å; Y249-E311 HydrophobicContact CD2-CB 4.39Å; Y249-E311 HydrophobicContact CE2-CB 3.92Å; F307-E311 WeakPolarHBondContact O-CB 3.42Å; F307-E311 WeakPolarHBondContact O-CG 3.33Å; F307-E311 PolarHBondContact O-N 3.35Å; V309-E311 PolarHBondContact O-N 2.97Å; E311-A313 VanDerWaalsContact C-N 3.31Å; E311-A313 PolarHBondContact O-N 3.49Å; E311-L314 WeakPolarHBondContact O-CB 3.48Å; E311-L314 PolarHBondContact O-N 3.31Å; E311-L315 WeakPolarHBondContact O-CG 3.22Å; E311-L315 PolarHBondContact O-N 3.19Å |
| 312 | A | 94.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -60.8 | -42.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | L125 M271 Q308 V309 L314 L315 I316 | L125-A312 HydrophobicContact CD1-CB 3.55Å; L125-A312 HydrophobicContact CD2-CB 3.79Å; L125-A312 HydrophobicContact CG-CB 4.23Å; M271-A312 HydrophobicContact SD-CB 4.42Å; Q308-A312 VanDerWaalsContact O-CB 3.31Å; Q308-A312 WeakPolarHBondContact O-CB 3.4Å; Q308-A312 PolarHBondContact O-N 2.7Å; Q308-A312 VanDerWaalsContact O-N 3.08Å; V309-A312 PolarHBondContact O-N 3.27Å; A312-L314 VanDerWaalsContact C-N 3.34Å; A312-L314 PolarHBondContact O-N 2.8Å; A312-L315 PolarHBondContact O-N 3.06Å; A312-I316 WeakPolarHBondContact O-CB 3.2Å; A312-I316 WeakPolarHBondContact O-CD1 3.29Å; A312-I316 WeakPolarHBondContact O-CG1 3.31Å; A312-I316 PolarHBondContact O-N 3.41Å |
| 313 | A | 94.3 | Very high | 92.7 | Very high | 49 Ų | 49 | 59.9 Ų | 59.9 | 41% | 0.405 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61 | -43.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | V309 A310 E311 I316 V317 | V309-A313 WeakPolarHBondContact O-CB 3.49Å; V309-A313 PolarHBondContact O-N 2.84Å; A310-A313 PolarHBondContact O-N 3.17Å; E311-A313 VanDerWaalsContact C-N 3.31Å; E311-A313 PolarHBondContact O-N 3.49Å; A313-I316 PolarHBondContact O-N 3.32Å; A313-V317 WeakPolarHBondContact O-CG2 3.34Å; A313-V317 PolarHBondContact O-N 2.77Å |
| 314 | L | 95.6 | Very high | 92.6 | Very high | 104 Ų | 104 | 64.3 Ų | 64.3 | 55% | 0.545 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.3 | -48.4 | 174.9 | -179.9 | 64.4 | 0 | 0 | 0 | 111.6 | A310 E311 A312 I316 V317 L318 | A310-L314 PolarHBondContact O-N 2.89Å; E311-L314 WeakPolarHBondContact O-CB 3.48Å; E311-L314 PolarHBondContact O-N 3.31Å; A312-L314 VanDerWaalsContact C-N 3.34Å; A312-L314 PolarHBondContact O-N 2.8Å; L314-I316 VanDerWaalsContact C-N 3.31Å; L314-I316 PolarHBondContact O-N 3.44Å; L314-V317 PolarHBondContact O-N 3.16Å; L314-L318 HydrophobicContact CD1-CD1 4.4Å; L314-L318 HydrophobicContact CD1-CG 4.37Å; L314-L318 HydrophobicContact CG-CD1 4.14Å; L314-L318 WeakPolarHBondContact O-CB 3.5Å; L314-L318 VanDerWaalsContact O-CG 3.32Å; L314-L318 WeakPolarHBondContact O-CG 3.47Å; L314-L318 PolarHBondContact O-N 3.31Å |
| 315 | L | 94.7 | Very high | 92.4 | Very high | 59 Ų | 59 | 70.8 Ų | 70.8 | 31% | 0.309 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59.9 | -40.2 | 177 | -71 | 174.5 | 0 | 0 | 0 | 112.1 | Y249 M271 E311 A312 F319 | Y249-L315 HydrophobicContact CD1-CD1 4.34Å; Y249-L315 HydrophobicContact CD2-CD1 3.86Å; Y249-L315 HydrophobicContact CE2-CD1 4.5Å; Y249-L315 HydrophobicContact CG-CD1 3.79Å; M271-L315 HydrophobicContact CE-CB 3.95Å; M271-L315 HydrophobicContact CE-CD1 4.17Å; E311-L315 WeakPolarHBondContact O-CG 3.22Å; E311-L315 PolarHBondContact O-N 3.19Å; A312-L315 PolarHBondContact O-N 3.06Å; L315-F319 VanDerWaalsContact O-CB 3.3Å; L315-F319 WeakPolarHBondContact O-CB 3.35Å; L315-F319 PolarHBondContact O-N 3.46Å |
| 316 | I | 93.9 | Very high | 92 | Very high | 21 Ų | 21 | 73.3 Ų | 73.3 | 11% | 0.108 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.9 | -44.5 | 176.1 | -70 | 160.6 | 0 | 0 | 0 | 110.9 | L125 A128 I129 M271 A312 A313 L314 F319 R320 | L125-I316 HydrophobicContact CD2-CD1 3.73Å; A128-I316 HydrophobicContact CB-CD1 3.65Å; A128-I316 HydrophobicContact CB-CG1 4.14Å; A128-I316 HydrophobicContact CB-CG2 4.26Å; I129-I316 HydrophobicContact CB-CG1 4.31Å; M271-I316 HydrophobicContact CE-CG1 4.42Å; A312-I316 WeakPolarHBondContact O-CB 3.2Å; A312-I316 WeakPolarHBondContact O-CD1 3.29Å; A312-I316 WeakPolarHBondContact O-CG1 3.31Å; A312-I316 PolarHBondContact O-N 3.41Å; A313-I316 PolarHBondContact O-N 3.32Å; L314-I316 VanDerWaalsContact C-N 3.31Å; L314-I316 PolarHBondContact O-N 3.44Å; I316-F319 PolarHBondContact O-N 2.9Å; I316-R320 HydrophobicContact CG2-CG 4.45Å; I316-R320 WeakPolarHBondContact O-CB 3.21Å; I316-R320 WeakPolarHBondContact O-CG 3.48Å; I316-R320 PolarHBondContact O-N 2.88Å |
| 317 | V | 94 | Very high | 91.2 | Very high | 81 Ų | 81 | 69 Ų | 69 | 49% | 0.491 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.3 | -49.2 | 177.8 | 169.8 | 0 | 0 | 0 | 0 | 110.4 | A313 L314 F319 R320 C321 | A313-V317 WeakPolarHBondContact O-CG2 3.34Å; A313-V317 PolarHBondContact O-N 2.77Å; L314-V317 PolarHBondContact O-N 3.16Å; V317-F319 VanDerWaalsContact C-N 3.3Å; V317-F319 PolarHBondContact O-N 3.36Å; V317-R320 PolarHBondContact O-N 3.46Å; V317-R320 VanDerWaalsContact O-N 3.13Å; V317-C321 WeakPolarHBondContact O-CB 3.38Å; V317-C321 PolarHBondContact O-N 2.99Å; V317-C321 PolarHBondContact O-SG 2.87Å; V317-C321 VanDerWaalsContact O-SG 3.33Å |
| 318 | L | 93.7 | Very high | 89.7 | Confident | 100 Ų | 100 | 72.6 Ų | 72.6 | 52% | 0.524 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -57.2 | -44.8 | 177.1 | -70.7 | 174.2 | 0 | 0 | 0 | 111.5 | L314 C321 Y322 | L314-L318 HydrophobicContact CD1-CD1 4.4Å; L314-L318 HydrophobicContact CD1-CG 4.37Å; L314-L318 HydrophobicContact CG-CD1 4.14Å; L314-L318 WeakPolarHBondContact O-CB 3.5Å; L314-L318 VanDerWaalsContact O-CG 3.32Å; L314-L318 WeakPolarHBondContact O-CG 3.47Å; L314-L318 PolarHBondContact O-N 3.31Å; L318-C321 PolarHBondContact O-N 3.24Å; L318-Y322 WeakPolarHBondContact O-CB 3.14Å; L318-Y322 PolarHBondContact O-N 2.94Å |
| 319 | F | 92.7 | Very high | 87.7 | Confident | 36 Ų | 36 | 74.9 Ų | 74.9 | 16% | 0.158 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.8 | -44.9 | 175.8 | 170.8 | -100.6 | 0 | 0 | 0 | 112.3 | I129 K130 L315 I316 V317 Y322 H323 | I129-F319 HydrophobicContact CB-CD1 4.4Å; I129-F319 HydrophobicContact CD1-CB 3.89Å; I129-F319 HydrophobicContact CD1-CG 4.12Å; I129-F319 HydrophobicContact CG1-CB 3.67Å; I129-F319 HydrophobicContact CG1-CD1 3.53Å; I129-F319 HydrophobicContact CG1-CD2 4.07Å; I129-F319 HydrophobicContact CG1-CE1 4.24Å; I129-F319 HydrophobicContact CG1-CG 3.44Å; I129-F319 VanDerWaalsContact CG1-CG 3.44Å; I129-F319 WeakPolarHBondContact O-CE1 3.33Å; K130-F319 HydrophobicContact CB-CE1 4.32Å; K130-F319 HydrophobicContact CB-CZ 4.36Å; K130-F319 HydrophobicContact CD-CE1 4.22Å; K130-F319 HydrophobicContact CD-CZ 4.28Å; K130-F319 HydrophobicContact CG-CE1 4.11Å; K130-F319 HydrophobicContact CG-CZ 4.45Å; L315-F319 VanDerWaalsContact O-CB 3.3Å; L315-F319 WeakPolarHBondContact O-CB 3.35Å; L315-F319 PolarHBondContact O-N 3.46Å; I316-F319 PolarHBondContact O-N 2.9Å; V317-F319 VanDerWaalsContact C-N 3.3Å; V317-F319 PolarHBondContact O-N 3.36Å; F319-Y322 PolarHBondContact O-N 3.01Å; F319-H323 HydrophobicContact CZ-CB 4.35Å; F319-H323 AromaticContact CZ-CD2 3.95Å; F319-H323 VanDerWaalsContact O-CB 3.28Å; F319-H323 WeakPolarHBondContact O-CB 3.1Å; F319-H323 PolarHBondContact O-N 3.49Å |
| 320 | R | 91.4 | Very high | 85.7 | Confident | 156 Ų | 156 | 79.3 Ų | 79.3 | 59% | 0.589 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -65.7 | -42 | 179.4 | -76.5 | -175.5 | 176.5 | -157.7 | 0.2 | 111.9 | I316 V317 H323 W324 | I316-R320 HydrophobicContact CG2-CG 4.45Å; I316-R320 WeakPolarHBondContact O-CB 3.21Å; I316-R320 WeakPolarHBondContact O-CG 3.48Å; I316-R320 PolarHBondContact O-N 2.88Å; V317-R320 PolarHBondContact O-N 3.46Å; V317-R320 VanDerWaalsContact O-N 3.13Å; R320-H323 PolarHBondContact O-N 3.49Å; R320-W324 VanDerWaalsContact O-CB 3.23Å; R320-W324 WeakPolarHBondContact O-CB 3.45Å; R320-W324 PolarHBondContact O-N 3.14Å |
| 321 | C | 91.7 | Very high | 83.7 | Confident | 60 Ų | 60 | 83.4 Ų | 83.4 | 41% | 0.405 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -59.5 | -53.1 | 173.5 | -70.4 | 0 | 0 | 0 | 0 | 110.5 | V317 L318 H323 W324 F325 | V317-C321 WeakPolarHBondContact O-CB 3.38Å; V317-C321 PolarHBondContact O-N 2.99Å; V317-C321 PolarHBondContact O-SG 2.87Å; V317-C321 VanDerWaalsContact O-SG 3.33Å; L318-C321 PolarHBondContact O-N 3.24Å; C321-H323 PolarHBondContact O-N 3.34Å; C321-W324 PolarHBondContact O-N 2.91Å; C321-F325 WeakPolarHBondContact O-CD2 3.25Å; C321-F325 PolarHBondContact O-N 3.44Å |
| 322 | Y | 90.6 | Very high | 81.3 | Confident | 158 Ų | 158 | 87.6 Ų | 87.6 | 62% | 0.62 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -55.7 | -49 | 178.3 | 173.5 | -98.1 | 0 | 0 | 0 | 112.1 | L318 F319 W324 F325 T326 | L318-Y322 WeakPolarHBondContact O-CB 3.14Å; L318-Y322 PolarHBondContact O-N 2.94Å; F319-Y322 PolarHBondContact O-N 3.01Å; Y322-W324 PolarHBondContact O-N 3.29Å; Y322-F325 PolarHBondContact O-N 3.21Å; Y322-T326 HydrophobicContact CE1-CG2 4.29Å; Y322-T326 HydrophobicContact CE2-CG2 3.98Å; Y322-T326 PolarHBondContact O-N 2.77Å; Y322-T326 PolarHBondContact O-OG1 3.3Å |
| 323 | H | 86.9 | Confident | 79 | Confident | 57 Ų | 57 | 96.4 Ų | 96.4 | 26% | 0.264 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.2 | -45.8 | 178.7 | -175.2 | -61.5 | 0 | 0 | 0 | 111 | K130 F319 R320 C321 F325 T326 T327 | K130-H323 PolarHBondContact NZ-CE1 2.87Å; K130-H323 VanDerWaalsContact NZ-CE1 3.32Å; K130-H323 PolarHBondContact NZ-NE2 2.72Å; F319-H323 HydrophobicContact CZ-CB 4.35Å; F319-H323 AromaticContact CZ-CD2 3.95Å; F319-H323 VanDerWaalsContact O-CB 3.28Å; F319-H323 WeakPolarHBondContact O-CB 3.1Å; F319-H323 PolarHBondContact O-N 3.49Å; R320-H323 PolarHBondContact O-N 3.49Å; C321-H323 PolarHBondContact O-N 3.34Å; H323-F325 PolarHBondContact O-N 3.3Å; H323-T326 WeakPolarHBondContact CA-OG1 3.48Å; H323-T326 PolarHBondContact O-N 3.45Å; H323-T326 PolarHBondContact O-OG1 3.44Å; H323-T327 PolarHBondContact ND1-OG1 3.5Å; H323-T327 PolarHBondContact O-N 2.8Å; H323-T327 PolarHBondContact O-OG1 2.86Å |
| 324 | W | 87.4 | Confident | 76.3 | Confident | 131 Ų | 131 | 101.4 Ų | 101.4 | 50% | 0.496 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.7 | -46.4 | -179.9 | -178 | 84.8 | 0 | 0 | 0 | 112.1 | R320 C321 Y322 T327 K328 | R320-W324 VanDerWaalsContact O-CB 3.23Å; R320-W324 WeakPolarHBondContact O-CB 3.45Å; R320-W324 PolarHBondContact O-N 3.14Å; C321-W324 PolarHBondContact O-N 2.91Å; Y322-W324 PolarHBondContact O-N 3.29Å; W324-T327 PolarHBondContact O-OG1 2.91Å; W324-K328 HydrophobicContact CD2-CD 4.32Å; W324-K328 HydrophobicContact CH2-CD 3.99Å; W324-K328 HydrophobicContact CZ2-CD 3.74Å; W324-K328 HydrophobicContact CZ3-CD 4.36Å; W324-K328 PolarHBondContact O-N 2.8Å; W324-K328 VanDerWaalsContact O-N 3.1Å |
| 325 | F | 86.6 | Confident | 73.8 | Confident | 137 Ų | 137 | 101 Ų | 101 | 60% | 0.601 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.3 | -40.8 | 177.2 | -77.2 | -69.7 | 0 | 0 | 0 | 112.9 | C321 Y322 H323 G329 | C321-F325 WeakPolarHBondContact O-CD2 3.25Å; C321-F325 PolarHBondContact O-N 3.44Å; Y322-F325 PolarHBondContact O-N 3.21Å; H323-F325 PolarHBondContact O-N 3.3Å; F325-G329 PolarHBondContact O-N 3.25Å |
| 326 | T | 81.8 | Confident | 71.2 | Confident | 64 Ų | 64 | 103.2 Ų | 103.2 | 39% | 0.393 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -73.5 | -32.1 | -179.6 | 36.2 | 0 | 0 | 0 | 0 | 113.6 | Y322 H323 | Y322-T326 HydrophobicContact CE1-CG2 4.29Å; Y322-T326 HydrophobicContact CE2-CG2 3.98Å; Y322-T326 PolarHBondContact O-N 2.77Å; Y322-T326 PolarHBondContact O-OG1 3.3Å; H323-T326 WeakPolarHBondContact CA-OG1 3.48Å; H323-T326 PolarHBondContact O-N 3.45Å; H323-T326 PolarHBondContact O-OG1 3.44Å |
| 327 | T | 73.3 | Confident | 69.1 | Low | 57 Ų | 57 | 104.4 Ų | 104.4 | 35% | 0.35 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -73.9 | -39.6 | 172.7 | 32.6 | 0 | 0 | 0 | 0 | 112.9 | H323 W324 G329 K330 D331 | H323-T327 PolarHBondContact ND1-OG1 3.5Å; H323-T327 PolarHBondContact O-N 2.8Å; H323-T327 PolarHBondContact O-OG1 2.86Å; W324-T327 PolarHBondContact O-OG1 2.91Å; T327-G329 VanDerWaalsContact C-N 3.26Å; T327-G329 PolarHBondContact O-N 3.42Å; T327-K330 PolarHBondContact O-N 3.5Å; T327-K330 VanDerWaalsContact O-N 3.08Å; T327-D331 PolarHBondContact O-N 2.92Å |
| 328 | K | 62.1 | Low | 67 | Low | 114 Ų | 114 | 105.1 Ų | 105.1 | 50% | 0.496 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.6 | -35.9 | 175.7 | -92.4 | -169.6 | 168.1 | -169.3 | 0 | 113 | W324 K330 D331 S332 | W324-K328 HydrophobicContact CD2-CD 4.32Å; W324-K328 HydrophobicContact CH2-CD 3.99Å; W324-K328 HydrophobicContact CZ2-CD 3.74Å; W324-K328 HydrophobicContact CZ3-CD 4.36Å; W324-K328 PolarHBondContact O-N 2.8Å; W324-K328 VanDerWaalsContact O-N 3.1Å; K328-K330 VanDerWaalsContact C-N 3.3Å; K328-K330 PolarHBondContact O-N 2.85Å; K328-D331 PolarHBondContact O-N 3.11Å; K328-S332 PolarHBondContact O-N 2.96Å; K328-S332 PolarHBondContact O-OG 3.22Å |
| 329 | G | 53.8 | Low | 65 | Low | 50 Ų | 50 | 108.5 Ų | 108.5 | 52% | 0.515 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.1 | -24.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | F325 T327 | F325-G329 PolarHBondContact O-N 3.25Å; T327-G329 VanDerWaalsContact C-N 3.26Å; T327-G329 PolarHBondContact O-N 3.42Å |
| 330 | K | 50.7 | Low | 63.1 | Low | 164 Ų | 164 | 113.7 Ų | 113.7 | 71% | 0.713 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -81.4 | -32 | 176.7 | -82.7 | -176.8 | 173.6 | -178.3 | 0 | 113 | T327 K328 S332 Y333 | T327-K330 PolarHBondContact O-N 3.5Å; T327-K330 VanDerWaalsContact O-N 3.08Å; K328-K330 VanDerWaalsContact C-N 3.3Å; K328-K330 PolarHBondContact O-N 2.85Å; K330-S332 VanDerWaalsContact C-N 3.31Å; K330-Y333 PolarHBondContact O-N 3.27Å |
| 331 | D | 52.3 | Low | 61.2 | Low | 132 Ų | 132 | 112.6 Ų | 112.6 | 71% | 0.706 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -76 | -20.3 | 176.9 | -64.2 | -27.1 | 0 | 0 | 0 | 112.5 | T327 K328 | T327-D331 PolarHBondContact O-N 2.92Å; K328-D331 PolarHBondContact O-N 3.11Å |
| 332 | S | 45.7 | Very low | 59.5 | Low | 109 Ų | 109 | 115 Ų | 115 | 76% | 0.762 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | -4.5 | 174.4 | -65.1 | 0 | 0 | 0 | 0 | 114.9 | K328 K330 | K328-S332 PolarHBondContact O-N 2.96Å; K328-S332 PolarHBondContact O-OG 3.22Å; K330-S332 VanDerWaalsContact C-N 3.31Å |
| 333 | Y | 44.8 | Very low | 57.8 | Low | 186 Ų | 186 | 114.4 Ų | 114.4 | 73% | 0.729 | 58% | 0.58 | S | S | * | * | trans | -128 | 63.1 | 174.6 | -155.3 | -91.9 | 0 | 0 | 0 | 110.3 | K330 | K330-Y333 PolarHBondContact O-N 3.27Š| ||
| 334 | Q | 38.9 | Very low | 56.3 | Low | 153 Ų | 153 | 118.7 Ų | 118.7 | 72% | 0.715 | 60% | 0.601 | S | S | * | * | trans | -89.3 | 110 | 149.3 | -79.5 | -78.2 | -37.6 | 0 | 0 | 105.8 | T336 | Q334-T336 PolarHBondContact O-N 2.7Š| ||
| 335 | P | 42 | Very low | 55 | Low | 97 Ų | 97 | 118 Ų | 118 | 63% | 0.63 | 61% | 0.605 | S | S | * | * | trans | -63.4 | 96 | 161.5 | 26.4 | -28.5 | 0 | 0 | 0 | 105.7 | S337 | P335-S337 PolarHBondContact O-N 2.97Š| ||
| 336 | T | 40.7 | Very low | 53.5 | Low | 105 Ų | 105 | 115.8 Ų | 115.8 | 64% | 0.644 | 61% | 0.607 | S | S | * | * | trans | -46.1 | 103.1 | 169.9 | -11.1 | 0 | 0 | 0 | 0 | 107.5 | Q334 T338 | Q334-T336 PolarHBondContact O-N 2.7Å; T336-T338 PolarHBondContact O-N 3.23Å; T336-T338 PolarHBondContact O-OG1 3.47Å | ||
| 337 | S | 49.2 | Very low | 52.4 | Low | 46 Ų | 46 | 119.9 Ų | 119.9 | 32% | 0.322 | 62% | 0.622 | S | S | . | * | S | Bend | trans | 17.3 | 45.8 | 139.2 | 69 | 0 | 0 | 0 | 0 | 117 | P335 K341 | P335-S337 PolarHBondContact O-N 2.97Å; S337-K341 WeakPolarHBondContact O-CB 3.38Å; S337-K341 WeakPolarHBondContact O-CG 3.43Å; S337-K341 PolarHBondContact O-N 2.8Å |
| 338 | T | 50.7 | Low | 51.5 | Low | 95 Ų | 95 | 120.3 Ų | 120.3 | 58% | 0.583 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -81.3 | -32.2 | 176.4 | -56.7 | 0 | 0 | 0 | 0 | 108.1 | T336 L342 | T336-T338 PolarHBondContact O-N 3.23Å; T336-T338 PolarHBondContact O-OG1 3.47Å; T338-L342 HydrophobicContact CG2-CD1 3.94Å; T338-L342 VanDerWaalsContact O-CB 3.31Å; T338-L342 WeakPolarHBondContact O-CB 3.33Å; T338-L342 WeakPolarHBondContact O-CD1 3.14Å; T338-L342 VanDerWaalsContact O-CG 3.29Å; T338-L342 WeakPolarHBondContact O-CG 3.29Å; T338-L342 PolarHBondContact O-N 3.48Å |
| 339 | E | 51.9 | Low | 51.2 | Low | 171 Ų | 171 | 120.7 Ų | 120.7 | 80% | 0.799 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -72.3 | -36.2 | 172.9 | -76.2 | -174.7 | 144.2 | 0 | 0 | 113.8 | K343 | E339-K343 PolarHBondContact O-N 3.47Å; E339-K343 VanDerWaalsContact O-N 3.16Å |
| 340 | E | 52.7 | Low | 50.7 | Low | 145 Ų | 145 | 126 Ų | 126 | 68% | 0.678 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -71.3 | -40.4 | 174.4 | -87.8 | 178.2 | 160.5 | 0 | 0 | 111.9 | L342 K343 E344 | E340-L342 PolarHBondContact O-N 3.14Å; E340-K343 PolarHBondContact O-N 2.89Å; E340-E344 PolarHBondContact O-N 3.3Å; E340-E344 VanDerWaalsContact O-N 3.15Å |
| 341 | K | 51.8 | Low | 50.7 | Low | 134 Ų | 134 | 124.2 Ų | 124.2 | 58% | 0.583 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -67.4 | -33 | 174.9 | -76.8 | -172.7 | 174.7 | -173.6 | 0 | 113.2 | S337 I345 | S337-K341 WeakPolarHBondContact O-CB 3.38Å; S337-K341 WeakPolarHBondContact O-CG 3.43Å; S337-K341 PolarHBondContact O-N 2.8Å; K341-I345 VanDerWaalsContact O-CD1 3.3Å; K341-I345 WeakPolarHBondContact O-CD1 3.17Å; K341-I345 WeakPolarHBondContact O-CG1 3.36Å; K341-I345 PolarHBondContact O-N 3.39Å |
| 342 | L | 55.3 | Low | 50.6 | Low | 111 Ų | 111 | 123.7 Ų | 123.7 | 58% | 0.581 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -72.8 | -31.6 | 176.1 | -82 | 161.2 | 0 | 0 | 0 | 112.6 | T338 E340 S346 | T338-L342 HydrophobicContact CG2-CD1 3.94Å; T338-L342 VanDerWaalsContact O-CB 3.31Å; T338-L342 WeakPolarHBondContact O-CB 3.33Å; T338-L342 WeakPolarHBondContact O-CD1 3.14Å; T338-L342 VanDerWaalsContact O-CG 3.29Å; T338-L342 WeakPolarHBondContact O-CG 3.29Å; T338-L342 PolarHBondContact O-N 3.48Å; E340-L342 PolarHBondContact O-N 3.14Å; L342-S346 WeakPolarHBondContact O-CB 3.31Å; L342-S346 PolarHBondContact O-N 3.28Å; L342-S346 VanDerWaalsContact O-N 3.08Å |
| 343 | K | 55.1 | Low | 50.8 | Low | 144 Ų | 144 | 124.6 Ų | 124.6 | 63% | 0.626 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -70.2 | -42.5 | 173.7 | -86.5 | -176.4 | 173.4 | -178.6 | 0 | 112.7 | E339 E340 I345 S346 E347 | E339-K343 PolarHBondContact O-N 3.47Å; E339-K343 VanDerWaalsContact O-N 3.16Å; E340-K343 PolarHBondContact O-N 2.89Å; K343-I345 VanDerWaalsContact C-N 3.31Å; K343-I345 PolarHBondContact O-N 3.33Å; K343-S346 PolarHBondContact O-N 3.12Å; K343-E347 WeakPolarHBondContact O-CB 3.27Å; K343-E347 PolarHBondContact O-N 2.87Å |
| 344 | E | 54.9 | Low | 51.2 | Low | 148 Ų | 148 | 120.9 Ų | 120.9 | 69% | 0.692 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -64.8 | -33.5 | 176.2 | -76.4 | -175.3 | 157.8 | 0 | 0 | 112.8 | E340 G348 | E340-E344 PolarHBondContact O-N 3.3Å; E340-E344 VanDerWaalsContact O-N 3.15Å; E344-G348 PolarHBondContact O-N 2.78Å; E344-G348 VanDerWaalsContact O-N 3.11Å |
| 345 | I | 60 | Low | 52 | Low | 116 Ų | 116 | 118.9 Ų | 118.9 | 60% | 0.595 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -73.6 | -34.6 | 175.7 | -64.4 | 165.7 | 0 | 0 | 0 | 111.3 | K341 K343 T349 | K341-I345 VanDerWaalsContact O-CD1 3.3Å; K341-I345 WeakPolarHBondContact O-CD1 3.17Å; K341-I345 WeakPolarHBondContact O-CG1 3.36Å; K341-I345 PolarHBondContact O-N 3.39Å; K343-I345 VanDerWaalsContact C-N 3.31Å; K343-I345 PolarHBondContact O-N 3.33Å; I345-T349 PolarHBondContact O-OG1 3.35Å |
| 346 | S | 55.3 | Low | 52.6 | Low | 90 Ų | 90 | 120.4 Ų | 120.4 | 63% | 0.629 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -69.4 | -34.9 | 175.4 | 174.3 | 0 | 0 | 0 | 0 | 113 | L342 K343 | L342-S346 WeakPolarHBondContact O-CB 3.31Å; L342-S346 PolarHBondContact O-N 3.28Å; L342-S346 VanDerWaalsContact O-N 3.08Å; K343-S346 PolarHBondContact O-N 3.12Å |
| 347 | E | 59.8 | Low | 53.5 | Low | 151 Ų | 151 | 121.5 Ų | 121.5 | 71% | 0.706 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -90.6 | -16.1 | -177.1 | -70.2 | 179 | 174.1 | 0 | 0 | 113.1 | K343 | K343-E347 WeakPolarHBondContact O-CB 3.27Å; K343-E347 PolarHBondContact O-N 2.87Å |
| 348 | G | 54.8 | Low | 53.8 | Low | 66 Ų | 66 | 127.3 Ų | 127.3 | 68% | 0.68 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | 4 | 177 | 0 | 0 | 0 | 0 | 0 | 116 | E344 | E344-G348 PolarHBondContact O-N 2.78Å; E344-G348 VanDerWaalsContact O-N 3.11Å |
| 349 | T | 54.9 | Low | 54.1 | Low | 122 Ų | 122 | 130 Ų | 130 | 75% | 0.748 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.6 | 28.1 | -177 | -25.7 | 0 | 0 | 0 | 0 | 113.8 | I345 | I345-T349 PolarHBondContact O-OG1 3.35Š|
| 350 | A | 42.5 | Very low | 54.3 | Low | 162 Ų | 162 | 126.3 Ų | 126.3 | 100% | 1.339 | 71% | 0.714 | S | S | * | * | trans | -112.7 | 0 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 |
Retrieved 350 of 350 residues in 206.3 ms
(Link to these results)