| 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 | 29.6 | Very low | 27.6 | Very low | 238 Ų | 238 | 153.6 Ų | 153.6 | 100% | 1.172 | 85% | 0.849 | S | S | * | * | 0 | 100.8 | 0 | -94.3 | 156.6 | 131.3 | 0 | 0 | 109.5 | |||||
| 2 | T | 31.2 | Very low | 27.7 | Very low | 123 Ų | 123 | 156.8 Ų | 156.8 | 76% | 0.755 | 85% | 0.848 | S | S | * | * | trans | 37.2 | 113.3 | 140 | 50.8 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 3 | N | 30.4 | Very low | 27.5 | Very low | 148 Ų | 148 | 156.5 Ų | 156.5 | 79% | 0.791 | 86% | 0.855 | S | S | * | * | 82.8 | 128.2 | 115.6 | -91.7 | -16.3 | 0 | 0 | 0 | 125.1 | |||||
| 4 | C | 29.4 | Very low | 27.3 | Very low | 106 Ų | 106 | 155.1 Ų | 155.1 | 72% | 0.716 | 85% | 0.846 | S | S | * | * | 96.3 | 108.1 | 126.7 | -78.4 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 5 | K | 30.3 | Very low | 27.1 | Very low | 211 Ų | 211 | 159.1 Ų | 159.1 | 92% | 0.917 | 84% | 0.844 | S | S | * | * | 159.4 | 128.8 | 110.3 | -92 | 175.1 | 175.7 | 173.8 | 0 | 108.1 | |||||
| 6 | G | 27.5 | Very low | 26.9 | Very low | 79 Ų | 79 | 160.8 Ų | 160.8 | 81% | 0.814 | 84% | 0.841 | S | S | * | * | cis | 112.2 | 96.7 | 13 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 7 | R | 24.6 | Very low | 26.9 | Very low | 242 Ų | 242 | 158.2 Ų | 158.2 | 91% | 0.913 | 83% | 0.834 | S | S | * | * | trans | 167.1 | 104.5 | 141.6 | -142.5 | 166.3 | -169.6 | 167.4 | 2.3 | 108.6 | ||||
| 8 | S | 25 | Very low | 26.8 | Very low | 100 Ų | 100 | 158.1 Ų | 158.1 | 70% | 0.699 | 83% | 0.828 | S | S | * | * | 58.8 | 106 | 73.3 | -173.9 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 9 | T | 24.8 | Very low | 26.7 | Very low | 145 Ų | 145 | 157 Ų | 157 | 89% | 0.89 | 82% | 0.823 | S | S | * | * | -164 | 124.8 | 118.7 | 15.4 | 0 | 0 | 0 | 0 | 111 | |||||
| 10 | I | 25.7 | Very low | 26.6 | Very low | 157 Ų | 157 | 160.8 Ų | 160.8 | 81% | 0.805 | 83% | 0.825 | S | S | * | * | trans | -107.2 | 132.9 | 169.7 | -69.3 | 168.3 | 0 | 0 | 0 | 106.1 | ||||
| 11 | T | 24.8 | Very low | 26.7 | Very low | 141 Ų | 141 | 161.6 Ų | 161.6 | 87% | 0.865 | 83% | 0.826 | S | S | * | * | trans | -160.7 | 135.4 | 135 | -8.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 12 | K | 29.8 | Very low | 26.4 | Very low | 192 Ų | 192 | 153.7 Ų | 153.7 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | trans | -66.1 | 151.7 | 179.7 | -71.9 | 170.5 | 170.2 | 174.2 | 0 | 112.6 | ||||
| 13 | T | 24.4 | Very low | 26.1 | Very low | 153 Ų | 153 | 158 Ų | 158 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | trans | -151.8 | 156.3 | 145.2 | -5.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 14 | N | 24.6 | Very low | 25.9 | Very low | 137 Ų | 137 | 157 Ų | 157 | 73% | 0.733 | 81% | 0.813 | S | S | * | * | trans | -110 | 145.2 | -155.3 | -161.7 | 4.6 | 0 | 0 | 0 | 110.2 | ||||
| 15 | R | 25.4 | Very low | 25.7 | Very low | 215 Ų | 215 | 158.9 Ų | 158.9 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | trans | 68.9 | 131.9 | 151.4 | -96.7 | 178.3 | -179.8 | 179.6 | 0.3 | 122.6 | ||||
| 16 | K | 23.7 | Very low | 25.4 | Very low | 185 Ų | 185 | 159 Ų | 159 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | 103.7 | 111.4 | 141.8 | -77.1 | -174.7 | 176.1 | -174.9 | 0 | 119.8 | ||||
| 17 | V | 27.1 | Very low | 25.3 | Very low | 118 Ų | 118 | 161 Ų | 161 | 72% | 0.715 | 81% | 0.808 | S | S | * | * | trans | 49.2 | 108.6 | 130.3 | -167.1 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 18 | H | 24.7 | Very low | 25.4 | Very low | 156 Ų | 156 | 154.4 Ų | 154.4 | 72% | 0.722 | 79% | 0.789 | S | S | * | * | -179.1 | 135.5 | 109.3 | -112 | -72.5 | 0 | 0 | 0 | 111 | |||||
| 19 | D | 25.5 | Very low | 25.3 | Very low | 137 Ų | 137 | 156.4 Ų | 156.4 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | trans | 40.8 | 113.3 | 150 | -57.3 | -24.5 | 0 | 0 | 0 | 121.7 | ||||
| 20 | R | 24.2 | Very low | 25.6 | Very low | 233 Ų | 233 | 157 Ų | 157 | 88% | 0.879 | 79% | 0.789 | S | S | * | * | trans | -144.6 | 105.5 | 140.6 | -135 | 178.8 | -168 | -171.2 | 3.7 | 110.8 | ||||
| 21 | E | 27.4 | Very low | 25.8 | Very low | 177 Ų | 177 | 155.4 Ų | 155.4 | 83% | 0.827 | 78% | 0.782 | S | S | * | * | trans | 27.9 | 111.7 | 140.3 | -67.1 | 171.6 | 153.2 | 0 | 0 | 117.8 | ||||
| 22 | G | 25 | Very low | 26.2 | Very low | 73 Ų | 73 | 155 Ų | 155 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | trans | -70.8 | 125.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V24 | G22-V24 PolarHBondContact O-N 3.17Š| ||
| 23 | F | 24.1 | Very low | 26.4 | Very low | 212 Ų | 212 | 153.4 Ų | 153.4 | 93% | 0.93 | 78% | 0.779 | S | S | * | * | trans | -67.1 | 108.8 | 152.4 | -112.3 | -101.3 | 0 | 0 | 0 | 108.2 | N25 | F23-N25 PolarHBondContact O-N 2.69Š| ||
| 24 | V | 26.4 | Very low | 26.9 | Very low | 127 Ų | 127 | 153.3 Ų | 153.3 | 77% | 0.77 | 77% | 0.768 | S | S | * | * | trans | -81.1 | 112.1 | 171.5 | 175.9 | 0 | 0 | 0 | 0 | 108.2 | G22 W26 | G22-V24 PolarHBondContact O-N 3.17Å; V24-W26 PolarHBondContact O-N 3.29Å | ||
| 25 | N | 24.2 | Very low | 27.5 | Very low | 147 Ų | 147 | 150.9 Ų | 150.9 | 79% | 0.786 | 76% | 0.762 | S | S | * | * | trans | -78.3 | 114.7 | 173.8 | -147.3 | 4.1 | 0 | 0 | 0 | 108.5 | F23 T27 | F23-N25 PolarHBondContact O-N 2.69Å; N25-T27 PolarHBondContact O-N 3.29Å; N25-T27 VanDerWaalsContact O-N 3.16Å | ||
| 26 | W | 24.3 | Very low | 27.9 | Very low | 212 Ų | 212 | 146.3 Ų | 146.3 | 80% | 0.803 | 75% | 0.753 | S | S | * | * | trans | -86.1 | 80.6 | -177.4 | -148.2 | 68.4 | 0 | 0 | 0 | 109.8 | V24 I28 | V24-W26 PolarHBondContact O-N 3.29Å; W26-I28 HydrophobicContact CD2-CD1 3.9Å; W26-I28 HydrophobicContact CD2-CG1 3.98Å; W26-I28 HydrophobicContact CE3-CD1 4.13Å; W26-I28 HydrophobicContact CE3-CG1 4.27Å; W26-I28 HydrophobicContact CG-CG1 4.49Å; W26-I28 HydrophobicContact CH2-CD1 3.5Å; W26-I28 VanDerWaalsContact CH2-CD1 3.5Å; W26-I28 HydrophobicContact CH2-CG1 4.48Å; W26-I28 HydrophobicContact CZ2-CD1 3.2Å; W26-I28 HydrophobicContact CZ2-CG1 4.2Å; W26-I28 HydrophobicContact CZ3-CD1 3.94Å; W26-I28 HydrophobicContact CZ3-CG1 4.5Å | ||
| 27 | T | 25 | Very low | 28.5 | Very low | 122 Ų | 122 | 145.6 Ų | 145.6 | 75% | 0.748 | 75% | 0.75 | S | S | * | * | trans | -101.2 | 88.4 | 166.2 | -46.7 | 0 | 0 | 0 | 0 | 107.7 | N25 N29 | N25-T27 PolarHBondContact O-N 3.29Å; N25-T27 VanDerWaalsContact O-N 3.16Å; T27-N29 PolarHBondContact O-N 3.28Å | ||
| 28 | I | 27.6 | Very low | 28.9 | Very low | 103 Ų | 103 | 145.5 Ų | 145.5 | 53% | 0.528 | 74% | 0.74 | S | S | . | * | trans | -73.9 | 118.4 | 171.9 | -69.6 | -172.7 | 0 | 0 | 0 | 108.9 | W26 L30 | W26-I28 HydrophobicContact CD2-CD1 3.9Å; W26-I28 HydrophobicContact CD2-CG1 3.98Å; W26-I28 HydrophobicContact CE3-CD1 4.13Å; W26-I28 HydrophobicContact CE3-CG1 4.27Å; W26-I28 HydrophobicContact CG-CG1 4.49Å; W26-I28 HydrophobicContact CH2-CD1 3.5Å; W26-I28 VanDerWaalsContact CH2-CD1 3.5Å; W26-I28 HydrophobicContact CH2-CG1 4.48Å; W26-I28 HydrophobicContact CZ2-CD1 3.2Å; W26-I28 HydrophobicContact CZ2-CG1 4.2Å; W26-I28 HydrophobicContact CZ3-CD1 3.94Å; W26-I28 HydrophobicContact CZ3-CG1 4.5Å; I28-L30 PolarHBondContact O-N 2.8Å; I28-L30 VanDerWaalsContact O-N 3.12Å | ||
| 29 | N | 23.8 | Very low | 29.5 | Very low | 143 Ų | 143 | 141.3 Ų | 141.3 | 77% | 0.765 | 72% | 0.723 | S | S | * | * | trans | -64.9 | 98.5 | 172 | -155.2 | -13.9 | 0 | 0 | 0 | 108.8 | T27 N31 | T27-N29 PolarHBondContact O-N 3.28Å; N29-N31 PolarHBondContact O-N 3.35Å | ||
| 30 | L | 30.6 | Very low | 29.8 | Very low | 156 Ų | 156 | 139.6 Ų | 139.6 | 82% | 0.817 | 71% | 0.714 | S | S | * | * | trans | -83.3 | 82.2 | 176.3 | -156.6 | 94.3 | 0 | 0 | 0 | 108.6 | I28 | I28-L30 PolarHBondContact O-N 2.8Å; I28-L30 VanDerWaalsContact O-N 3.12Å | ||
| 31 | N | 29 | Very low | 30.3 | Very low | 125 Ų | 125 | 131.6 Ų | 131.6 | 67% | 0.668 | 69% | 0.688 | S | S | * | * | trans | -150.5 | 122 | 165.9 | -91.9 | -34.9 | 0 | 0 | 0 | 112.9 | N29 | N29-N31 PolarHBondContact O-N 3.35Š| ||
| 32 | T | 33.9 | Very low | 30.6 | Very low | 132 Ų | 132 | 125.1 Ų | 125.1 | 81% | 0.81 | 66% | 0.659 | S | S | * | * | S | Bend | trans | 70.8 | 34.7 | 142.2 | 58.2 | 0 | 0 | 0 | 0 | 121.3 | ||
| 33 | I | 33.7 | Very low | 31 | Very low | 158 Ų | 158 | 126.2 Ų | 126.2 | 81% | 0.81 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -142.7 | 80.8 | 161.9 | -51.9 | 177.5 | 0 | 0 | 0 | 111.1 | ||
| 34 | Q | 34.2 | Very low | 31.4 | Very low | 152 Ų | 152 | 119.6 Ų | 119.6 | 71% | 0.71 | 63% | 0.627 | S | S | * | * | S | Bend | trans | 178.2 | 1.1 | 149 | -115.2 | 178.4 | -64.6 | 0 | 0 | 115.4 | D36 F38 | Q34-D36 PolarHBondContact O-N 3.08Å; Q34-F38 PolarHBondContact O-N 2.89Å |
| 35 | S | 38.7 | Very low | 31.9 | Very low | 86 Ų | 86 | 114.8 Ų | 114.8 | 60% | 0.601 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -61.3 | -42.5 | 180 | -168.7 | 0 | 0 | 0 | 0 | 112.3 | K37 F38 L39 | S35-K37 PolarHBondContact O-N 2.86Å; S35-F38 PolarHBondContact O-N 3.42Å; S35-L39 WeakPolarHBondContact O-CB 3.33Å; S35-L39 PolarHBondContact O-N 2.98Å |
| 36 | D | 32.7 | Very low | 32.5 | Very low | 119 Ų | 119 | 109.6 Ų | 109.6 | 64% | 0.636 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -73.3 | -30.7 | -173.7 | -63.1 | -24.3 | 0 | 0 | 0 | 113.5 | Q34 N40 | Q34-D36 PolarHBondContact O-N 3.08Å; D36-N40 WeakPolarHBondContact O-CB 3.42Å; D36-N40 PolarHBondContact O-N 3.37Å; D36-N40 PolarHBondContact O-ND2 3.49Å |
| 37 | K | 36.4 | Very low | 32.8 | Very low | 169 Ų | 169 | 103.3 Ų | 103.3 | 74% | 0.735 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -73.9 | -36.5 | 174.2 | -86.7 | -178.7 | 178.1 | 177.9 | 0 | 111.8 | S35 L41 | S35-K37 PolarHBondContact O-N 2.86Å; K37-L41 VanDerWaalsContact O-CB 3.29Å; K37-L41 WeakPolarHBondContact O-CB 3.41Å; K37-L41 PolarHBondContact O-N 3.29Å |
| 38 | F | 36.6 | Very low | 33.2 | Very low | 116 Ų | 116 | 100.7 Ų | 100.7 | 51% | 0.509 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -71.3 | -40 | 175.8 | -176.5 | -105.2 | 0 | 0 | 0 | 111.7 | Q34 S35 L41 L42 | Q34-F38 PolarHBondContact O-N 2.89Å; S35-F38 PolarHBondContact O-N 3.42Å; F38-L41 WeakPolarHBondContact O-CB 3.43Å; F38-L41 PolarHBondContact O-N 3.11Å; F38-L42 HydrophobicContact CD1-CD1 3.82Å; F38-L42 HydrophobicContact CE1-CD1 3.48Å; F38-L42 VanDerWaalsContact CE1-CD1 3.48Å; F38-L42 HydrophobicContact CE1-CG 4.43Å; F38-L42 HydrophobicContact CZ-CD1 4.04Å; F38-L42 PolarHBondContact O-N 3.2Å |
| 39 | L | 36.4 | Very low | 33.5 | Very low | 69 Ų | 69 | 97.9 Ų | 97.9 | 36% | 0.361 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.7 | -39.9 | 174.5 | -158.1 | 77.8 | 0 | 0 | 0 | 111.5 | S35 L41 L42 L43 | S35-L39 WeakPolarHBondContact O-CB 3.33Å; S35-L39 PolarHBondContact O-N 2.98Å; L39-L41 VanDerWaalsContact C-N 3.31Å; L39-L42 WeakPolarHBondContact O-CB 3.38Å; L39-L42 PolarHBondContact O-N 2.9Å; L39-L43 HydrophobicContact CG-CD1 4.31Å; L39-L43 WeakPolarHBondContact O-CB 3.16Å; L39-L43 WeakPolarHBondContact O-CD1 3.48Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.34Å; L39-L43 PolarHBondContact O-N 2.75Å |
| 40 | N | 32.7 | Very low | 33.9 | Very low | 101 Ų | 101 | 98.5 Ų | 98.5 | 54% | 0.54 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -68.9 | -28.9 | 172 | -77.1 | -46.1 | 0 | 0 | 0 | 112.8 | D36 S44 | D36-N40 WeakPolarHBondContact O-CB 3.42Å; D36-N40 PolarHBondContact O-N 3.37Å; D36-N40 PolarHBondContact O-ND2 3.49Å; N40-S44 WeakPolarHBondContact O-CB 3.29Å; N40-S44 PolarHBondContact O-N 3.39Å; N40-S44 PolarHBondContact O-OG 3.46Å |
| 41 | L | 34.5 | Very low | 33.8 | Very low | 65 Ų | 65 | 97 Ų | 97 | 34% | 0.34 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.2 | -44.3 | 170.9 | -160.6 | 84.9 | 0 | 0 | 0 | 110.3 | K37 F38 L39 S44 M45 L161 | K37-L41 VanDerWaalsContact O-CB 3.29Å; K37-L41 WeakPolarHBondContact O-CB 3.41Å; K37-L41 PolarHBondContact O-N 3.29Å; F38-L41 WeakPolarHBondContact O-CB 3.43Å; F38-L41 PolarHBondContact O-N 3.11Å; L39-L41 VanDerWaalsContact C-N 3.31Å; L41-S44 PolarHBondContact O-N 3.14Å; L41-S44 PolarHBondContact O-OG 2.83Å; L41-M45 HydrophobicContact CD2-CE 4.29Å; L41-M45 HydrophobicContact CG-CE 4.44Å; L41-M45 WeakPolarHBondContact O-CG 3.48Å; L41-M45 PolarHBondContact O-N 3.2Å; L41-L161 HydrophobicContact CD1-CD2 3.86Å; L41-L161 HydrophobicContact CD2-CD2 4.14Å; L41-L161 HydrophobicContact CG-CD2 4.37Å |
| 42 | L | 32.5 | Very low | 34.1 | Very low | 40 Ų | 40 | 95.2 Ų | 95.2 | 21% | 0.209 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -64.3 | -38.7 | 174.3 | -80.1 | 164.3 | 0 | 0 | 0 | 112.8 | F38 L39 S44 M45 | F38-L42 HydrophobicContact CD1-CD1 3.82Å; F38-L42 HydrophobicContact CE1-CD1 3.48Å; F38-L42 VanDerWaalsContact CE1-CD1 3.48Å; F38-L42 HydrophobicContact CE1-CG 4.43Å; F38-L42 HydrophobicContact CZ-CD1 4.04Å; F38-L42 PolarHBondContact O-N 3.2Å; L39-L42 WeakPolarHBondContact O-CB 3.38Å; L39-L42 PolarHBondContact O-N 2.9Å; L42-S44 VanDerWaalsContact C-N 3.34Å; L42-M45 HydrophobicContact CD2-SD 4.13Å; L42-M45 VanDerWaalsContact O-CB 3.3Å; L42-M45 WeakPolarHBondContact O-CB 3.41Å; L42-M45 PolarHBondContact O-N 3.24Å |
| 43 | L | 33.2 | Very low | 34 | Very low | 96 Ų | 96 | 91.7 Ų | 91.7 | 50% | 0.503 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -71.8 | -26.7 | 175.6 | -75.3 | 160.4 | 0 | 0 | 0 | 112.7 | L39 M45 V46 | L39-L43 HydrophobicContact CG-CD1 4.31Å; L39-L43 WeakPolarHBondContact O-CB 3.16Å; L39-L43 WeakPolarHBondContact O-CD1 3.48Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.34Å; L39-L43 PolarHBondContact O-N 2.75Å; L43-M45 VanDerWaalsContact C-N 3.27Å; L43-V46 VanDerWaalsContact O-CG2 3.31Å; L43-V46 WeakPolarHBondContact O-CG2 3.41Å |
| 44 | S | 32.2 | Very low | 33.9 | Very low | 73 Ų | 73 | 90.3 Ų | 90.3 | 51% | 0.51 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.3 | 2.4 | 170.9 | 64.2 | 0 | 0 | 0 | 0 | 113.6 | N40 L41 L42 V46 Q162 | N40-S44 WeakPolarHBondContact O-CB 3.29Å; N40-S44 PolarHBondContact O-N 3.39Å; N40-S44 PolarHBondContact O-OG 3.46Å; L41-S44 PolarHBondContact O-N 3.14Å; L41-S44 PolarHBondContact O-OG 2.83Å; L42-S44 VanDerWaalsContact C-N 3.34Å; S44-V46 PolarHBondContact O-N 3.34Å; S44-Q162 PolarHBondContact O-NE2 3.01Å |
| 45 | M | 37.8 | Very low | 33.8 | Very low | 26 Ų | 26 | 87.7 Ų | 87.7 | 13% | 0.128 | 46% | 0.456 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.7 | 11 | 169.1 | -52.2 | -160 | 163.9 | 0 | 0 | 113.8 | L41 L42 L43 Q162 | L41-M45 HydrophobicContact CD2-CE 4.29Å; L41-M45 HydrophobicContact CG-CE 4.44Å; L41-M45 WeakPolarHBondContact O-CG 3.48Å; L41-M45 PolarHBondContact O-N 3.2Å; L42-M45 HydrophobicContact CD2-SD 4.13Å; L42-M45 VanDerWaalsContact O-CB 3.3Å; L42-M45 WeakPolarHBondContact O-CB 3.41Å; L42-M45 PolarHBondContact O-N 3.24Å; L43-M45 VanDerWaalsContact C-N 3.27Å; M45-Q162 HydrophobicContact CB-CG 4.05Å; M45-Q162 HydrophobicContact CE-CG 4.44Å; M45-Q162 HydrophobicContact CG-CG 3.85Å; M45-Q162 HydrophobicContact SD-CB 4.41Å; M45-Q162 HydrophobicContact SD-CG 4.28Å |
| 46 | V | 36.6 | Very low | 33.7 | Very low | 39 Ų | 39 | 89.4 Ų | 89.4 | 24% | 0.236 | 45% | 0.454 | C | S | . | . | S | Bend | trans | -79.5 | 132.8 | 174.7 | 173.6 | 0 | 0 | 0 | 0 | 109.3 | L43 S44 V48 | L43-V46 VanDerWaalsContact O-CG2 3.31Å; L43-V46 WeakPolarHBondContact O-CG2 3.41Å; S44-V46 PolarHBondContact O-N 3.34Å; V46-V48 PolarHBondContact O-N 3.47Å |
| 47 | P | 31.7 | Very low | 33.7 | Very low | 79 Ų | 79 | 92.5 Ų | 92.5 | 51% | 0.513 | 46% | 0.457 | S | S | . | . | trans | -62.6 | 112.5 | 157.6 | 5.7 | 3.2 | 0 | 0 | 0 | 107.1 | V49 Y50 | P47-V49 PolarHBondContact O-N 3.4Å; P47-Y50 PolarHBondContact O-N 3.2Å | ||
| 48 | V | 33.3 | Very low | 33.4 | Very low | 67 Ų | 67 | 89.9 Ų | 89.9 | 41% | 0.406 | 45% | 0.447 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.2 | -11.9 | -176.4 | 172.1 | 0 | 0 | 0 | 0 | 114 | V46 Y50 I52 P152 | V46-V48 PolarHBondContact O-N 3.47Å; V48-Y50 PolarHBondContact O-N 2.86Å; V48-I52 HydrophobicContact CG1-CD1 3.78Å; V48-I52 HydrophobicContact CG1-CG1 4.27Å; V48-I52 WeakPolarHBondContact O-CG1 3.06Å; V48-P152 HydrophobicContact CB-CG 3.77Å; V48-P152 HydrophobicContact CG1-CG 3.87Å; V48-P152 HydrophobicContact CG2-CG 4.4Å |
| 49 | V | 32.7 | Very low | 33.5 | Very low | 45 Ų | 45 | 91.3 Ų | 91.3 | 27% | 0.273 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -67 | -33.4 | -177.2 | -174.1 | 0 | 0 | 0 | 0 | 113.6 | P47 Q151 | P47-V49 PolarHBondContact O-N 3.4Å; V49-Q151 HydrophobicContact CG2-CG 3.77Å |
| 50 | Y | 31.9 | Very low | 33.6 | Very low | 156 Ų | 156 | 96 Ų | 96 | 61% | 0.612 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -83.3 | -30.8 | -177.5 | -114.6 | -90.5 | 0 | 0 | 0 | 113.7 | P47 V48 N53 | P47-Y50 PolarHBondContact O-N 3.2Å; V48-Y50 PolarHBondContact O-N 2.86Å; Y50-N53 PolarHBondContact O-N 3.24Å |
| 51 | Q | 29.7 | Very low | 33.8 | Very low | 124 Ų | 124 | 95.2 Ų | 95.2 | 58% | 0.579 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -74.1 | -33.4 | -178.1 | -150.6 | 160.3 | -1.4 | 0 | 0 | 111.5 | N53 Q54 D55 | Q51-N53 VanDerWaalsContact C-N 3.3Å; Q51-N53 PolarHBondContact O-N 3.37Å; Q51-Q54 PolarHBondContact O-N 3.43Å; Q51-D55 PolarHBondContact O-N 3.33Å; Q51-D55 VanDerWaalsContact O-N 3.1Å |
| 52 | I | 33.9 | Very low | 33.8 | Very low | 87 Ų | 87 | 96.7 Ų | 96.7 | 45% | 0.446 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.7 | -37.4 | 172.2 | -67.7 | 171.9 | 0 | 0 | 0 | 111.2 | V48 Q54 D55 E56 | V48-I52 HydrophobicContact CG1-CD1 3.78Å; V48-I52 HydrophobicContact CG1-CG1 4.27Å; V48-I52 WeakPolarHBondContact O-CG1 3.06Å; I52-Q54 PolarHBondContact O-N 3.3Å; I52-D55 PolarHBondContact O-N 3Å; I52-E56 HydrophobicContact CG2-CG 3.97Å; I52-E56 WeakPolarHBondContact O-CB 3.38Å; I52-E56 WeakPolarHBondContact O-CG 3.46Å; I52-E56 PolarHBondContact O-N 3.31Å |
| 53 | N | 33.6 | Very low | 33.9 | Very low | 58 Ų | 58 | 96.3 Ų | 96.3 | 31% | 0.31 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.4 | -31.2 | -179.8 | -102.2 | -15.7 | 0 | 0 | 0 | 113.4 | Y50 Q51 R57 | Y50-N53 PolarHBondContact O-N 3.24Å; Q51-N53 VanDerWaalsContact C-N 3.3Å; Q51-N53 PolarHBondContact O-N 3.37Å; N53-R57 WeakPolarHBondContact O-CB 3.35Å; N53-R57 WeakPolarHBondContact O-CG 3.49Å; N53-R57 PolarHBondContact O-N 2.97Å |
| 54 | Q | 30.3 | Very low | 34.1 | Very low | 130 Ų | 130 | 97.2 Ų | 97.2 | 61% | 0.607 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -78.9 | -41.2 | 174.4 | -75.4 | -157.8 | -14.7 | 0 | 0 | 112.1 | Q51 I52 E56 R57 H58 | Q51-Q54 PolarHBondContact O-N 3.43Å; I52-Q54 PolarHBondContact O-N 3.3Å; Q54-E56 VanDerWaalsContact C-N 3.34Å; Q54-E56 PolarHBondContact O-N 2.97Å; Q54-R57 PolarHBondContact O-N 3.44Å; Q54-H58 WeakPolarHBondContact O-CB 3.2Å; Q54-H58 PolarHBondContact O-CD2 3.27Å; Q54-H58 VanDerWaalsContact O-CD2 3.28Å; Q54-H58 PolarHBondContact O-N 3.01Å |
| 55 | D | 32.2 | Very low | 34 | Very low | 97 Ų | 97 | 104 Ų | 104 | 52% | 0.519 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.6 | -36.9 | 175.7 | -95.9 | -6.1 | 0 | 0 | 0 | 112.1 | Q51 I52 K59 | Q51-D55 PolarHBondContact O-N 3.33Å; Q51-D55 VanDerWaalsContact O-N 3.1Å; I52-D55 PolarHBondContact O-N 3Å; D55-K59 VanDerWaalsContact O-CB 3.26Å; D55-K59 WeakPolarHBondContact O-CB 3.42Å; D55-K59 VanDerWaalsContact O-CG 3.25Å; D55-K59 WeakPolarHBondContact O-CG 3.5Å; D55-K59 PolarHBondContact O-N 3.45Å |
| 56 | E | 36.1 | Very low | 33.7 | Very low | 121 Ų | 121 | 110.1 Ų | 110.1 | 57% | 0.565 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67 | -41.5 | 173.1 | -76.6 | -93.2 | 134 | 0 | 0 | 111.6 | I52 Q54 K59 K60 | I52-E56 HydrophobicContact CG2-CG 3.97Å; I52-E56 WeakPolarHBondContact O-CB 3.38Å; I52-E56 WeakPolarHBondContact O-CG 3.46Å; I52-E56 PolarHBondContact O-N 3.31Å; Q54-E56 VanDerWaalsContact C-N 3.34Å; Q54-E56 PolarHBondContact O-N 2.97Å; E56-K59 PolarHBondContact O-N 3.41Å; E56-K60 WeakPolarHBondContact O-CB 3.49Å; E56-K60 PolarHBondContact O-N 2.93Å |
| 57 | R | 33.2 | Very low | 33.4 | Very low | 185 Ų | 185 | 116 Ų | 116 | 70% | 0.698 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.9 | -42.8 | 173.6 | -83 | -166.9 | -146.4 | -163.3 | 5.9 | 112.3 | N53 Q54 K59 K60 V61 | N53-R57 WeakPolarHBondContact O-CB 3.35Å; N53-R57 WeakPolarHBondContact O-CG 3.49Å; N53-R57 PolarHBondContact O-N 2.97Å; Q54-R57 PolarHBondContact O-N 3.44Å; R57-K59 VanDerWaalsContact C-N 3.35Å; R57-K60 PolarHBondContact O-N 3.22Å; R57-V61 WeakPolarHBondContact O-CB 3.35Å; R57-V61 VanDerWaalsContact O-CG2 3.28Å; R57-V61 WeakPolarHBondContact O-CG2 3.47Å; R57-V61 PolarHBondContact O-N 3.43Å |
| 58 | H | 31.3 | Very low | 33.5 | Very low | 113 Ų | 113 | 115.3 Ų | 115.3 | 52% | 0.523 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67 | -35.6 | 177.3 | -85.8 | -67.2 | 0 | 0 | 0 | 112 | Q54 N62 | Q54-H58 WeakPolarHBondContact O-CB 3.2Å; Q54-H58 PolarHBondContact O-CD2 3.27Å; Q54-H58 VanDerWaalsContact O-CD2 3.28Å; Q54-H58 PolarHBondContact O-N 3.01Å; H58-N62 VanDerWaalsContact O-CB 3.3Å; H58-N62 WeakPolarHBondContact O-CB 3.49Å; H58-N62 PolarHBondContact O-N 2.94Å |
| 59 | K | 38 | Very low | 33.5 | Very low | 147 Ų | 147 | 119.7 Ų | 119.7 | 64% | 0.639 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -69.6 | -36.8 | 171.6 | -77.3 | 176.4 | -177.5 | 175.2 | 0 | 112.8 | D55 E56 R57 G63 | D55-K59 VanDerWaalsContact O-CB 3.26Å; D55-K59 WeakPolarHBondContact O-CB 3.42Å; D55-K59 VanDerWaalsContact O-CG 3.25Å; D55-K59 WeakPolarHBondContact O-CG 3.5Å; D55-K59 PolarHBondContact O-N 3.45Å; E56-K59 PolarHBondContact O-N 3.41Å; R57-K59 VanDerWaalsContact C-N 3.35Å; K59-G63 PolarHBondContact O-N 2.98Å |
| 60 | K | 38.7 | Very low | 33.1 | Very low | 166 Ų | 166 | 127.1 Ų | 127.1 | 72% | 0.722 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -68.9 | -38.9 | 175.1 | -126.9 | 174.1 | -178.5 | 179.7 | 0 | 112.1 | E56 R57 V64 | E56-K60 WeakPolarHBondContact O-CB 3.49Å; E56-K60 PolarHBondContact O-N 2.93Å; R57-K60 PolarHBondContact O-N 3.22Å; K60-V64 WeakPolarHBondContact O-CG2 3.3Å; K60-V64 PolarHBondContact O-N 2.71Å |
| 61 | V | 36.3 | Very low | 33.2 | Very low | 85 Ų | 85 | 125.2 Ų | 125.2 | 52% | 0.515 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -70.9 | -39.9 | 176.5 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | R57 W65 | R57-V61 WeakPolarHBondContact O-CB 3.35Å; R57-V61 VanDerWaalsContact O-CG2 3.28Å; R57-V61 WeakPolarHBondContact O-CG2 3.47Å; R57-V61 PolarHBondContact O-N 3.43Å; V61-W65 VanDerWaalsContact O-CD1 3.31Å |
| 62 | N | 35.3 | Very low | 32.9 | Very low | 96 Ų | 96 | 124.5 Ų | 124.5 | 51% | 0.513 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -77.6 | -30.5 | 177.4 | -71.7 | -12.6 | 0 | 0 | 0 | 113.5 | H58 W65 Q66 | H58-N62 VanDerWaalsContact O-CB 3.3Å; H58-N62 WeakPolarHBondContact O-CB 3.49Å; H58-N62 PolarHBondContact O-N 2.94Å; N62-W65 PolarHBondContact O-N 3.07Å; N62-Q66 PolarHBondContact O-N 3.5Å |
| 63 | G | 34.2 | Very low | 32.3 | Very low | 32 Ų | 32 | 123.7 Ų | 123.7 | 33% | 0.33 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -67 | -35.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | K59 W65 Q66 | K59-G63 PolarHBondContact O-N 2.98Å; G63-W65 PolarHBondContact O-N 2.99Å; G63-Q66 PolarHBondContact O-N 3.29Å |
| 64 | V | 37.2 | Very low | 31.9 | Very low | 115 Ų | 115 | 129.1 Ų | 129.1 | 70% | 0.697 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -68.4 | -21.1 | 176.7 | 171.4 | 0 | 0 | 0 | 0 | 112.6 | K60 | K60-V64 WeakPolarHBondContact O-CG2 3.3Å; K60-V64 PolarHBondContact O-N 2.71Å |
| 65 | W | 31.2 | Very low | 31.6 | Very low | 216 Ų | 216 | 128.7 Ų | 128.7 | 82% | 0.818 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.6 | -3 | 176.3 | -77.2 | 91.9 | 0 | 0 | 0 | 114.3 | V61 N62 G63 | V61-W65 VanDerWaalsContact O-CD1 3.31Å; N62-W65 PolarHBondContact O-N 3.07Å; G63-W65 PolarHBondContact O-N 2.99Å |
| 66 | Q | 30.2 | Very low | 31.1 | Very low | 155 Ų | 155 | 132.4 Ų | 132.4 | 72% | 0.724 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | -11.5 | -176.2 | -117.3 | 159.7 | -8.5 | 0 | 0 | 115.1 | N62 G63 G68 | N62-Q66 PolarHBondContact O-N 3.5Å; G63-Q66 PolarHBondContact O-N 3.29Å; Q66-G68 PolarHBondContact O-N 3.49Å |
| 67 | D | 31.6 | Very low | 30.5 | Very low | 161 Ų | 161 | 133.1 Ų | 133.1 | 86% | 0.861 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | 9.9 | 172.7 | -78.7 | -22.4 | 0 | 0 | 0 | 114.1 | ||
| 68 | G | 33.2 | Very low | 30 | Very low | 66 Ų | 66 | 130 Ų | 130 | 68% | 0.68 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.1 | -7.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | Q66 | Q66-G68 PolarHBondContact O-N 3.49Š|
| 69 | L | 33.4 | Very low | 29.5 | Very low | 158 Ų | 158 | 135 Ų | 135 | 83% | 0.827 | 72% | 0.72 | S | S | * | * | trans | -151.7 | 98 | -169.8 | -89 | 149.2 | 0 | 0 | 0 | 112.2 | ||||
| 70 | Q | 24.3 | Very low | 28.8 | Very low | 201 Ų | 201 | 132.5 Ų | 132.5 | 94% | 0.939 | 72% | 0.721 | S | S | * | * | trans | -157.9 | 149.8 | 140.1 | -108.5 | 174.4 | 41.4 | 0 | 0 | 112.6 | ||||
| 71 | P | 32.5 | Very low | 28.1 | Very low | 117 Ų | 117 | 131.2 Ų | 131.2 | 76% | 0.76 | 72% | 0.722 | S | S | * | * | trans | -112.2 | 179 | -156.3 | 41.5 | -31 | 0 | 0 | 0 | 114.7 | ||||
| 72 | A | 23.7 | Very low | 27.5 | Very low | 109 Ų | 109 | 135 Ų | 135 | 90% | 0.901 | 74% | 0.735 | S | S | * | * | trans | 88.9 | 137.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 73 | G | 23 | Very low | 27 | Very low | 69 Ų | 69 | 138.1 Ų | 138.1 | 71% | 0.711 | 75% | 0.746 | S | S | * | * | cis | 161.8 | 141.3 | 3.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 74 | H | 24.9 | Very low | 26.6 | Very low | 172 Ų | 172 | 143.6 Ų | 143.6 | 80% | 0.796 | 76% | 0.764 | S | S | * | * | trans | 82.5 | 109 | 156.9 | -73.9 | 3.6 | 0 | 0 | 0 | 122.4 | ||||
| 75 | N | 22.6 | Very low | 25.9 | Very low | 121 Ų | 121 | 147.1 Ų | 147.1 | 65% | 0.647 | 77% | 0.773 | S | S | * | * | 102.9 | 114.6 | 111.5 | -75.5 | -6.8 | 0 | 0 | 0 | 121.9 | |||||
| 76 | F | 23.1 | Very low | 25.4 | Very low | 175 Ų | 175 | 145.2 Ų | 145.2 | 77% | 0.768 | 77% | 0.767 | S | S | * | * | trans | 81 | 103.6 | 131 | -92 | -99.7 | 0 | 0 | 0 | 121.5 | ||||
| 77 | N | 21.8 | Very low | 25.1 | Very low | 137 Ų | 137 | 146.1 Ų | 146.1 | 73% | 0.733 | 77% | 0.771 | S | S | * | * | 104.6 | 143.8 | 108 | -123.7 | 10.4 | 0 | 0 | 0 | 121.9 | |||||
| 78 | V | 23.5 | Very low | 24.7 | Very low | 119 Ų | 119 | 144.9 Ų | 144.9 | 72% | 0.721 | 76% | 0.76 | S | S | * | * | trans | 100.5 | 90.7 | 156.2 | -161.6 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 79 | R | 22 | Very low | 24.2 | Very low | 218 Ų | 218 | 150.4 Ų | 150.4 | 82% | 0.823 | 77% | 0.765 | S | S | * | * | 23.7 | 128 | 121.6 | -151.6 | -172.5 | -178.9 | 148.9 | 0.1 | 120.3 | |||||
| 80 | S | 22.8 | Very low | 23.8 | Very low | 95 Ų | 95 | 148.2 Ų | 148.2 | 66% | 0.664 | 76% | 0.763 | S | S | * | * | 157.1 | 123.7 | 107.7 | -62.1 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 81 | D | 23.5 | Very low | 23.7 | Very low | 138 Ų | 138 | 146.4 Ų | 146.4 | 74% | 0.738 | 76% | 0.755 | S | S | * | * | trans | 35.8 | 136.5 | 136.9 | -67.4 | -30.7 | 0 | 0 | 0 | 123.7 | ||||
| 82 | Q | 24.2 | Very low | 23.5 | Very low | 166 Ų | 166 | 147 Ų | 147 | 78% | 0.776 | 76% | 0.759 | S | S | * | * | 131.2 | 135.1 | 113.7 | -109.3 | 173.2 | 14.8 | 0 | 0 | 118.8 | |||||
| 83 | H | 24.4 | Very low | 23.5 | Very low | 161 Ų | 161 | 146.3 Ų | 146.3 | 75% | 0.745 | 74% | 0.743 | S | S | * | * | trans | 94.5 | 110.8 | 146.1 | -89 | -78.5 | 0 | 0 | 0 | 123 | ||||
| 84 | M | 24.7 | Very low | 23.6 | Very low | 146 Ų | 146 | 151.1 Ų | 151.1 | 72% | 0.719 | 75% | 0.745 | S | S | * | * | trans | -69.2 | 149 | 148.9 | -85.7 | -158.8 | 135 | 0 | 0 | 111.6 | Y86 | M84-Y86 HydrophobicContact CE-CE2 4.14Å; M84-Y86 HydrophobicContact SD-CE2 4.25Å | ||
| 85 | E | 23.1 | Very low | 23.7 | Very low | 189 Ų | 189 | 151.6 Ų | 151.6 | 88% | 0.883 | 75% | 0.747 | S | S | * | * | trans | -162.8 | 154.5 | 131.4 | -125.2 | 170.3 | 173.3 | 0 | 0 | 113.8 | ||||
| 86 | Y | 21.7 | Very low | 23.9 | Very low | 176 Ų | 176 | 149.1 Ų | 149.1 | 69% | 0.69 | 75% | 0.75 | S | S | * | * | trans | -91.4 | 167.1 | -166.3 | -88.4 | -104.4 | 0 | 0 | 0 | 114.5 | M84 | M84-Y86 HydrophobicContact CE-CE2 4.14Å; M84-Y86 HydrophobicContact SD-CE2 4.25Å | ||
| 87 | H | 24.1 | Very low | 23.9 | Very low | 175 Ų | 175 | 145.8 Ų | 145.8 | 81% | 0.81 | 75% | 0.749 | S | S | * | * | trans | 157.6 | 158 | 131.8 | -84 | -66.5 | 0 | 0 | 0 | 110.4 | ||||
| 88 | H | 22.5 | Very low | 24.1 | Very low | 135 Ų | 135 | 146.6 Ų | 146.6 | 63% | 0.625 | 75% | 0.753 | S | S | * | * | cis | -175.6 | 143 | -48.4 | -136 | -51.9 | 0 | 0 | 0 | 105.9 | ||||
| 89 | F | 22.6 | Very low | 24.2 | Very low | 182 Ų | 182 | 144 Ų | 144 | 80% | 0.798 | 75% | 0.75 | S | S | * | * | trans | 62 | 138.9 | 160.2 | -79.1 | -74.7 | 0 | 0 | 0 | 119.2 | ||||
| 90 | S | 24.3 | Very low | 24.4 | Very low | 111 Ų | 111 | 143.2 Ų | 143.2 | 78% | 0.776 | 76% | 0.755 | S | S | * | * | cis | -171.9 | 152.1 | 48.3 | 23.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 91 | E | 23.7 | Very low | 24.5 | Very low | 163 Ų | 163 | 144 Ų | 144 | 76% | 0.762 | 76% | 0.761 | S | S | * | * | trans | -66.3 | 170 | 168.1 | -78.8 | 179.8 | 148.2 | 0 | 0 | 113.3 | ||||
| 92 | P | 28.6 | Very low | 25 | Very low | 131 Ų | 131 | 143 Ų | 143 | 85% | 0.851 | 76% | 0.762 | S | S | * | * | -136.1 | 173.3 | 102 | 35.6 | -21.6 | 0 | 0 | 0 | 114.9 | |||||
| 93 | T | 23.2 | Very low | 25 | Very low | 94 Ų | 94 | 140.4 Ų | 140.4 | 58% | 0.577 | 76% | 0.762 | S | S | * | * | trans | -115.7 | 164.3 | -147.7 | -26.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 94 | F | 25.5 | Very low | 25 | Very low | 170 Ų | 170 | 137.9 Ų | 137.9 | 75% | 0.746 | 76% | 0.762 | S | S | * | * | trans | 114.7 | 134.5 | 135.7 | -95.7 | -71.8 | 0 | 0 | 0 | 123.2 | ||||
| 95 | H | 27.1 | Very low | 24.9 | Very low | 182 Ų | 182 | 137.3 Ų | 137.3 | 84% | 0.843 | 77% | 0.771 | S | S | * | * | trans | 81.5 | 123.8 | 162.6 | -66.5 | -64.8 | 0 | 0 | 0 | 118.6 | ||||
| 96 | G | 24.9 | Very low | 24.9 | Very low | 68 Ų | 68 | 133.8 Ų | 133.8 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | cis | 167 | 131 | -0.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 97 | S | 24.4 | Very low | 25.6 | Very low | 106 Ų | 106 | 131 Ų | 131 | 74% | 0.741 | 77% | 0.771 | S | S | * | * | trans | 47 | 114.3 | 144.7 | -139.4 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 98 | N | 26.1 | Very low | 25.5 | Very low | 154 Ų | 154 | 132.2 Ų | 132.2 | 82% | 0.824 | 77% | 0.774 | S | S | * | * | 178.1 | 127 | 95.9 | -94.4 | -12.8 | 0 | 0 | 0 | 110.5 | |||||
| 99 | G | 24.5 | Very low | 25.6 | Very low | 63 Ų | 63 | 137 Ų | 137 | 65% | 0.649 | 79% | 0.788 | S | S | * | * | trans | -84 | 167.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 100 | H | 27.3 | Very low | 25.8 | Very low | 202 Ų | 202 | 136 Ų | 136 | 94% | 0.935 | 79% | 0.791 | S | S | * | * | trans | -172.6 | 125.8 | 136.1 | -89.8 | -57.6 | 0 | 0 | 0 | 109.7 | ||||
| 101 | S | 24 | Very low | 25.8 | Very low | 112 Ų | 112 | 134 Ų | 134 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | trans | -125.4 | 147.7 | 151.3 | 47.9 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 102 | P | 34.4 | Very low | 25.9 | Very low | 118 Ų | 118 | 136 Ų | 136 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | -153.9 | 178.2 | 69.6 | 37.9 | -15.5 | 0 | 0 | 0 | 117.2 | |||||
| 103 | S | 24.7 | Very low | 25.7 | Very low | 111 Ų | 111 | 135.1 Ų | 135.1 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | 103.4 | 115.1 | 148.3 | 75.9 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 104 | S | 23.2 | Very low | 25.6 | Very low | 108 Ų | 108 | 135.5 Ų | 135.5 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | trans | 0.5 | 130 | 152.1 | 61.3 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 105 | C | 23.1 | Very low | 25.6 | Very low | 134 Ų | 134 | 138.2 Ų | 138.2 | 91% | 0.905 | 80% | 0.804 | S | S | * | * | -176.1 | 135.3 | 116.5 | -99.8 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 106 | S | 23.8 | Very low | 25.4 | Very low | 115 Ų | 115 | 136.3 Ų | 136.3 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | trans | -92.1 | -173.3 | -179.2 | 45.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 107 | P | 35.4 | Very low | 25.4 | Very low | 116 Ų | 116 | 142.9 Ų | 142.9 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | -120.1 | 145.5 | -74.3 | 35 | -20.7 | 0 | 0 | 0 | 111.4 | |||||
| 108 | K | 22.4 | Very low | 25.5 | Very low | 201 Ų | 201 | 143.8 Ų | 143.8 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | trans | -145.5 | 128.3 | 165.2 | -94.8 | -175.1 | -178.6 | 174.6 | 0 | 112.1 | D110 | K108-D110 PolarHBondContact O-N 3.17Š| ||
| 109 | Y | 25.6 | Very low | 25.5 | Very low | 236 Ų | 236 | 143.1 Ų | 143.1 | 93% | 0.925 | 81% | 0.807 | S | S | * | * | trans | -35.6 | 116.1 | 174.1 | -73 | -97.3 | 0 | 0 | 0 | 115.2 | ||||
| 110 | D | 25.4 | Very low | 25.7 | Very low | 162 Ų | 162 | 143.4 Ų | 143.4 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | trans | -86.1 | 140.6 | 152.3 | -68.5 | -39.3 | 0 | 0 | 0 | 107.7 | K108 | K108-D110 PolarHBondContact O-N 3.17Š| ||
| 111 | G | 24.2 | Very low | 26 | Very low | 67 Ų | 67 | 142.7 Ų | 142.7 | 69% | 0.691 | 81% | 0.809 | S | S | * | * | cis | 116 | 67.4 | 27 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 112 | F | 26.5 | Very low | 26.5 | Very low | 205 Ų | 205 | 144 Ų | 144 | 90% | 0.899 | 81% | 0.807 | S | S | * | * | trans | 8.7 | 107.9 | 152.3 | -129.1 | -99.6 | 0 | 0 | 0 | 117.1 | ||||
| 113 | S | 24.1 | Very low | 26.5 | Very low | 113 Ų | 113 | 141 Ų | 141 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | trans | -169.6 | 142.9 | 142.2 | 48.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 114 | S | 22.1 | Very low | 27.5 | Very low | 102 Ų | 102 | 136.3 Ų | 136.3 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | trans | 91.4 | 74.9 | 166.7 | -149.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 115 | Y | 24.8 | Very low | 28.5 | Very low | 227 Ų | 227 | 132.8 Ų | 132.8 | 89% | 0.89 | 73% | 0.731 | S | S | * | * | trans | -93.9 | 106.4 | 146.3 | -76.6 | -77.9 | 0 | 0 | 0 | 107.9 | Y117 | Y115-Y117 PolarHBondContact O-N 3.19Š| ||
| 116 | N | 22.7 | Very low | 29.3 | Very low | 143 Ų | 143 | 128.1 Ų | 128.1 | 77% | 0.765 | 70% | 0.698 | S | S | * | * | trans | -70.8 | 117.6 | 161.9 | -100.7 | -16.5 | 0 | 0 | 0 | 107.9 | C118 | N116-C118 PolarHBondContact O-N 3.17Š| ||
| 117 | Y | 25.6 | Very low | 30.2 | Very low | 206 Ų | 206 | 125.7 Ų | 125.7 | 81% | 0.808 | 68% | 0.676 | S | S | * | * | trans | -71.7 | 99.4 | 170.2 | -161.5 | -93.9 | 0 | 0 | 0 | 107.7 | Y115 D119 | Y115-Y117 PolarHBondContact O-N 3.19Å; Y117-D119 HydrophobicContact CD1-CB 4.22Å; Y117-D119 HydrophobicContact CE1-CB 4.14Å | ||
| 118 | C | 25.7 | Very low | 30.6 | Very low | 125 Ų | 125 | 121.6 Ų | 121.6 | 85% | 0.845 | 65% | 0.652 | S | S | * | * | trans | -93.6 | 108.2 | 163.7 | -76.2 | 0 | 0 | 0 | 0 | 108.1 | N116 | N116-C118 PolarHBondContact O-N 3.17Š| ||
| 119 | D | 26.8 | Very low | 31.5 | Very low | 140 Ų | 140 | 113 Ų | 113 | 75% | 0.749 | 62% | 0.616 | S | S | * | * | trans | -80.3 | 148 | 177.6 | -165.7 | 9.8 | 0 | 0 | 0 | 110.9 | Y117 | Y117-D119 HydrophobicContact CD1-CB 4.22Å; Y117-D119 HydrophobicContact CE1-CB 4.14Å | ||
| 120 | G | 28 | Very low | 32.2 | Very low | 69 Ų | 69 | 105.7 Ų | 105.7 | 71% | 0.711 | 59% | 0.592 | S | S | * | * | trans | 102.2 | 29.3 | 146.5 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 121 | M | 33.5 | Very low | 32.7 | Very low | 186 Ų | 186 | 103.5 Ų | 103.5 | 92% | 0.916 | 58% | 0.577 | S | S | * | * | trans | -129.6 | 106.4 | 161.9 | -125 | 160.5 | 155.2 | 0 | 0 | 108.2 | A123 | M121-A123 VanDerWaalsContact C-N 3.33Å; M121-A123 PolarHBondContact O-N 3.16Å | ||
| 122 | D | 34.3 | Very low | 33.2 | Very low | 140 Ų | 140 | 106.8 Ų | 106.8 | 75% | 0.749 | 57% | 0.574 | S | S | * | * | trans | -59.7 | 98.5 | 171.9 | -77.6 | -34.4 | 0 | 0 | 0 | 107.6 | S124 | D122-S124 PolarHBondContact O-N 3.31Š| ||
| 123 | A | 35.2 | Very low | 33.6 | Very low | 54 Ų | 54 | 102.4 Ų | 102.4 | 45% | 0.446 | 56% | 0.56 | S | S | . | * | trans | -57.8 | 125.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | M121 | M121-A123 VanDerWaalsContact C-N 3.33Å; M121-A123 PolarHBondContact O-N 3.16Å | ||
| 124 | S | 44.3 | Very low | 33.9 | Very low | 14 Ų | 14 | 103.3 Ų | 103.3 | 10% | 0.098 | 56% | 0.556 | C | S | . | * | trans | -62 | 151.2 | -179.7 | 78.6 | 0 | 0 | 0 | 0 | 110.5 | D122 T126 D127 A128 | D122-S124 PolarHBondContact O-N 3.31Å; S124-T126 PolarHBondContact O-N 3.48Å; S124-T126 PolarHBondContact OG-OG1 2.93Å; S124-D127 WeakPolarHBondContact CB-OD2 3.5Å; S124-D127 WeakPolarHBondContact O-CA 3.47Å; S124-D127 WeakPolarHBondContact O-CB 3.27Å; S124-D127 PolarHBondContact O-N 3.46Å; S124-D127 WeakPolarHBondContact OG-CB 3.49Å; S124-D127 PolarHBondContact OG-N 3.03Å; S124-D127 VanDerWaalsContact OG-N 3.09Å; S124-D127 PolarHBondContact OG-OD2 2.72Å; S124-A128 PolarHBondContact O-N 2.67Å | ||
| 125 | E | 45.1 | Very low | 34.2 | Very low | 33 Ų | 33 | 106.5 Ų | 106.5 | 15% | 0.154 | 56% | 0.564 | C | S | . | * | H | α-helix | trans | -57.1 | -35.4 | 179.5 | -70.5 | -176 | 177 | 0 | 0 | 112.1 | M129 R217 V376 S536 | E125-M129 PolarHBondContact O-N 3.4Å; E125-R217 IonicContact OE1-NH2 2.91Å; E125-R217 PolarHBondContact OE1-NH2 3.27Å; E125-R217 IonicContact OE2-CZ 3.22Å; E125-R217 IonicContact OE2-NE 3.07Å; E125-R217 PolarHBondContact OE2-NE 3.25Å; E125-R217 IonicContact OE2-NH2 2.95Å; E125-R217 PolarHBondContact OE2-NH2 2.89Å; E125-V376 HydrophobicContact CG-CG2 4.14Å; E125-V376 WeakPolarHBondContact OE1-CG2 3.49Å; E125-S536 PolarHBondContact OE2-OG 3.25Å |
| 126 | T | 41 | Very low | 34.5 | Very low | 36 Ų | 36 | 100.7 Ų | 100.7 | 22% | 0.221 | 56% | 0.557 | C | S | . | * | H | α-helix | trans | -64.5 | -42.2 | 171.2 | 30.8 | 0 | 0 | 0 | 0 | 112.6 | S124 A128 M129 L130 | S124-T126 PolarHBondContact O-N 3.48Å; S124-T126 PolarHBondContact OG-OG1 2.93Å; T126-A128 VanDerWaalsContact C-N 3.34Å; T126-A128 PolarHBondContact O-N 3.38Å; T126-M129 PolarHBondContact O-N 3.08Å; T126-L130 VanDerWaalsContact O-CG 3.24Å; T126-L130 WeakPolarHBondContact O-CG 3.42Å; T126-L130 PolarHBondContact O-N 3.04Å; T126-L130 VanDerWaalsContact O-N 3.15Å |
| 127 | D | 42.7 | Very low | 34.7 | Very low | 64 Ų | 64 | 99.4 Ų | 99.4 | 34% | 0.342 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.9 | -35.8 | 179.1 | -67.1 | -36.7 | 0 | 0 | 0 | 111.9 | S124 M129 L130 Q131 | S124-D127 WeakPolarHBondContact CB-OD2 3.5Å; S124-D127 WeakPolarHBondContact O-CA 3.47Å; S124-D127 WeakPolarHBondContact O-CB 3.27Å; S124-D127 PolarHBondContact O-N 3.46Å; S124-D127 WeakPolarHBondContact OG-CB 3.49Å; S124-D127 PolarHBondContact OG-N 3.03Å; S124-D127 VanDerWaalsContact OG-N 3.09Å; S124-D127 PolarHBondContact OG-OD2 2.72Å; D127-M129 VanDerWaalsContact C-N 3.26Å; D127-M129 PolarHBondContact O-N 3.48Å; D127-L130 CarbonylContact O-C 3.36Å; D127-L130 PolarHBondContact O-N 2.85Å; D127-L130 VanDerWaalsContact O-N 3.11Å; D127-Q131 VanDerWaalsContact O-CB 3.28Å; D127-Q131 WeakPolarHBondContact O-CB 3.5Å; D127-Q131 WeakPolarHBondContact O-CG 3.37Å; D127-Q131 PolarHBondContact O-N 2.92Å |
| 128 | A | 42.6 | Very low | 34.9 | Very low | 30 Ų | 30 | 97.4 Ų | 97.4 | 25% | 0.248 | 56% | 0.562 | C | S | . | * | H | α-helix | trans | -65 | -29.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | S124 T126 | S124-A128 PolarHBondContact O-N 2.67Å; T126-A128 VanDerWaalsContact C-N 3.34Å; T126-A128 PolarHBondContact O-N 3.38Å |
| 129 | M | 41 | Very low | 35 | Very low | 22 Ų | 22 | 96.3 Ų | 96.3 | 11% | 0.108 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -77.2 | -25.9 | 173.3 | -68 | -172.1 | 69.4 | 0 | 0 | 112.7 | E125 T126 D127 A221 K226 L236 A372 | E125-M129 PolarHBondContact O-N 3.4Å; T126-M129 PolarHBondContact O-N 3.08Å; D127-M129 VanDerWaalsContact C-N 3.26Å; D127-M129 PolarHBondContact O-N 3.48Å; M129-A221 HydrophobicContact CE-CB 4.01Å; M129-K226 PolarHBondContact O-NZ 3.16Å; M129-L236 HydrophobicContact CE-CD1 4.14Å; M129-A372 HydrophobicContact CG-CB 4.17Å |
| 130 | L | 40.8 | Very low | 35 | Very low | 81 Ų | 81 | 96.8 Ų | 96.8 | 42% | 0.424 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -91 | -26.1 | -179.8 | -65 | 169.2 | 0 | 0 | 0 | 113.2 | T126 D127 E132 D133 I224 | T126-L130 VanDerWaalsContact O-CG 3.24Å; T126-L130 WeakPolarHBondContact O-CG 3.42Å; T126-L130 PolarHBondContact O-N 3.04Å; T126-L130 VanDerWaalsContact O-N 3.15Å; D127-L130 CarbonylContact O-C 3.36Å; D127-L130 PolarHBondContact O-N 2.85Å; D127-L130 VanDerWaalsContact O-N 3.11Å; L130-E132 VanDerWaalsContact C-N 3.3Å; L130-E132 PolarHBondContact O-N 3.38Å; L130-D133 PolarHBondContact O-N 3.04Å; L130-I224 HydrophobicContact CD2-CD1 3.94Å |
| 131 | Q | 35.4 | Very low | 35.1 | Very low | 117 Ų | 117 | 101.8 Ų | 101.8 | 55% | 0.547 | 56% | 0.563 | S | S | . | * | G | 310 helix | trans | -69.1 | -17.8 | -172.1 | -101.4 | -176.8 | 2.2 | 0 | 0 | 115.3 | D127 D133 N134 | D127-Q131 VanDerWaalsContact O-CB 3.28Å; D127-Q131 WeakPolarHBondContact O-CB 3.5Å; D127-Q131 WeakPolarHBondContact O-CG 3.37Å; D127-Q131 PolarHBondContact O-N 2.92Å; Q131-D133 PolarHBondContact O-N 3.29Å; Q131-N134 PolarHBondContact O-N 3.19Å |
| 132 | E | 34.8 | Very low | 34.9 | Very low | 136 Ų | 136 | 99.7 Ų | 99.7 | 64% | 0.636 | 56% | 0.556 | S | S | * | * | G | 310 helix | trans | -64.1 | -17.3 | 175.3 | -84.5 | 179.7 | 157.2 | 0 | 0 | 113.3 | L130 K226 | L130-E132 VanDerWaalsContact C-N 3.3Å; L130-E132 PolarHBondContact O-N 3.38Å; E132-K226 IonicContact OE2-NZ 3.58Å; E132-K226 PolarHBondContact OE2-NZ 3.26Å; E132-K226 VanDerWaalsContact OE2-NZ 3.07Å |
| 133 | D | 34.9 | Very low | 34.5 | Very low | 112 Ų | 112 | 100.2 Ų | 100.2 | 60% | 0.599 | 56% | 0.557 | S | S | * | * | G | 310 helix | trans | -94.7 | -7.5 | -177.5 | -72.7 | -27.3 | 0 | 0 | 0 | 114.5 | L130 Q131 L135 | L130-D133 PolarHBondContact O-N 3.04Å; Q131-D133 PolarHBondContact O-N 3.29Å; D133-L135 PolarHBondContact O-N 2.89Å |
| 134 | N | 29.8 | Very low | 34.4 | Very low | 133 Ų | 133 | 105.3 Ų | 105.3 | 71% | 0.711 | 58% | 0.575 | S | S | * | * | trans | -92.3 | 12.9 | -173 | -77.8 | -17.1 | 0 | 0 | 0 | 115.2 | Q131 S136 | Q131-N134 PolarHBondContact O-N 3.19Å; N134-S136 PolarHBondContact O-N 3.47Å | ||
| 135 | L | 29 | Very low | 33.7 | Very low | 169 Ų | 169 | 110.6 Ų | 110.6 | 89% | 0.885 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -97.3 | 38.6 | 178.2 | -113.9 | 131.1 | 0 | 0 | 0 | 113.1 | D133 | D133-L135 PolarHBondContact O-N 2.89Š|
| 136 | S | 31.3 | Very low | 33.2 | Very low | 105 Ų | 105 | 117.7 Ų | 117.7 | 73% | 0.734 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -171.7 | 83 | 160.2 | 58.3 | 0 | 0 | 0 | 0 | 112.9 | N134 | N134-S136 PolarHBondContact O-N 3.47Š|
| 137 | S | 27.6 | Very low | 32.5 | Very low | 115 Ų | 115 | 118.5 Ų | 118.5 | 80% | 0.804 | 66% | 0.655 | S | S | * | * | trans | -173.8 | 101.8 | 145.3 | 54.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 138 | D | 30.1 | Very low | 31.8 | Very low | 164 Ų | 164 | 120.8 Ų | 120.8 | 88% | 0.877 | 68% | 0.676 | S | S | * | * | trans | -90.2 | 113.8 | 166.2 | -158.1 | 12.1 | 0 | 0 | 0 | 107.4 | ||||
| 139 | S | 27.3 | Very low | 31.1 | Very low | 102 Ų | 102 | 128.6 Ų | 128.6 | 71% | 0.713 | 70% | 0.699 | S | S | * | * | trans | -176.9 | 109.9 | 157.5 | 22.6 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 140 | N | 26.9 | Very low | 30.5 | Very low | 150 Ų | 150 | 137 Ų | 137 | 80% | 0.802 | 74% | 0.735 | S | S | * | * | trans | 41.1 | 111.7 | 137.7 | -62.3 | -8.7 | 0 | 0 | 0 | 121.3 | ||||
| 141 | E | 30.2 | Very low | 30.4 | Very low | 174 Ų | 174 | 136.2 Ų | 136.2 | 81% | 0.813 | 73% | 0.729 | S | S | * | * | 42.3 | 131.2 | 128.8 | -70.6 | -175.3 | 165.3 | 0 | 0 | 122.4 | |||||
| 142 | D | 28.7 | Very low | 30.4 | Very low | 142 Ų | 142 | 133.6 Ų | 133.6 | 76% | 0.759 | 72% | 0.722 | S | S | * | * | trans | 70.2 | 87.2 | 145 | -61.9 | -12.5 | 0 | 0 | 0 | 120.3 | ||||
| 143 | I | 26.2 | Very low | 30.7 | Very low | 152 Ų | 152 | 137.1 Ų | 137.1 | 78% | 0.779 | 74% | 0.736 | S | S | * | * | trans | -138.2 | 110.9 | 142.5 | -57 | -178.6 | 0 | 0 | 0 | 109.6 | V145 | I143-V145 HydrophobicContact CG2-CG2 4.05Å; I143-V145 PolarHBondContact O-N 2.88Å; I143-V145 VanDerWaalsContact O-N 3.17Å | ||
| 144 | I | 33.6 | Very low | 31.7 | Very low | 160 Ų | 160 | 134.7 Ų | 134.7 | 82% | 0.821 | 72% | 0.721 | S | S | * | * | trans | -57.7 | 110.7 | 163.5 | -63.2 | 166.2 | 0 | 0 | 0 | 107.9 | ||||
| 145 | V | 29.7 | Very low | 33.9 | Very low | 125 Ų | 125 | 131.6 Ų | 131.6 | 76% | 0.758 | 71% | 0.709 | S | S | * | * | trans | -105.2 | 84.5 | 172.3 | -177.2 | 0 | 0 | 0 | 0 | 108.9 | I143 G147 | I143-V145 HydrophobicContact CG2-CG2 4.05Å; I143-V145 PolarHBondContact O-N 2.88Å; I143-V145 VanDerWaalsContact O-N 3.17Å; V145-G147 PolarHBondContact O-N 3.3Å | ||
| 146 | E | 33.1 | Very low | 35.8 | Very low | 183 Ų | 183 | 126 Ų | 126 | 86% | 0.855 | 68% | 0.684 | S | S | * | * | trans | -83.4 | 99.4 | 160 | -161.7 | 160.9 | -160.3 | 0 | 0 | 107.6 | ||||
| 147 | G | 25.9 | Very low | 37.7 | Very low | 52 Ų | 52 | 125.1 Ų | 125.1 | 54% | 0.536 | 68% | 0.678 | S | S | . | * | trans | -155.5 | 81.3 | -178 | 0 | 0 | 0 | 0 | 0 | 110.4 | V145 R149 | V145-G147 PolarHBondContact O-N 3.3Å; G147-R149 PolarHBondContact O-N 3.28Å | ||
| 148 | S | 28.1 | Very low | 40.1 | Very low | 113 Ų | 113 | 123.9 Ų | 123.9 | 79% | 0.79 | 66% | 0.661 | S | S | * | * | trans | -56.6 | 97.6 | 174 | -40.6 | 0 | 0 | 0 | 0 | 110.2 | K150 | S148-K150 VanDerWaalsContact C-N 3.33Å; S148-K150 PolarHBondContact O-N 3.32Å | ||
| 149 | R | 28.6 | Very low | 42.2 | Very low | 194 Ų | 194 | 116.4 Ų | 116.4 | 73% | 0.732 | 62% | 0.621 | S | S | * | * | trans | -65.4 | 91.4 | 169.8 | -85.7 | 179.6 | 169.9 | 172 | -4.3 | 108.7 | G147 Q151 | G147-R149 PolarHBondContact O-N 3.28Å; R149-Q151 PolarHBondContact O-N 3.3Å | ||
| 150 | K | 28.1 | Very low | 44.5 | Very low | 197 Ų | 197 | 113.2 Ų | 113.2 | 86% | 0.857 | 60% | 0.602 | S | S | * | * | trans | -66.9 | 112.2 | 171.1 | -78.5 | 177.6 | 177.5 | 170.6 | 0 | 109 | S148 | S148-K150 VanDerWaalsContact C-N 3.33Å; S148-K150 PolarHBondContact O-N 3.32Å | ||
| 151 | Q | 38.6 | Very low | 46.9 | Very low | 66 Ų | 66 | 109.9 Ų | 109.9 | 31% | 0.308 | 58% | 0.583 | S | S | . | * | trans | -58.2 | 146.4 | 164.7 | -77.2 | -157.7 | 6.8 | 0 | 0 | 110.3 | V49 R149 K153 | V49-Q151 HydrophobicContact CG2-CG 3.77Å; R149-Q151 PolarHBondContact O-N 3.3Å; Q151-K153 PolarHBondContact O-N 2.85Å | ||
| 152 | P | 36.6 | Very low | 49 | Very low | 61 Ų | 61 | 102.7 Ų | 102.7 | 40% | 0.396 | 55% | 0.55 | S | S | . | . | trans | -58.7 | 131.7 | 169.2 | 22.9 | -28.4 | 0 | 0 | 0 | 108.8 | V48 E154 | V48-P152 HydrophobicContact CB-CG 3.77Å; V48-P152 HydrophobicContact CG1-CG 3.87Å; V48-P152 HydrophobicContact CG2-CG 4.4Å; P152-E154 PolarHBondContact O-N 3.33Å | ||
| 153 | K | 41.5 | Very low | 51.4 | Low | 211 Ų | 211 | 96.3 Ų | 96.3 | 92% | 0.917 | 52% | 0.515 | S | S | * | . | trans | -60.9 | 98 | 175.3 | -74.8 | 178.6 | 177.2 | 176.9 | 0 | 108.6 | Q151 S155 | Q151-K153 PolarHBondContact O-N 2.85Å; K153-S155 PolarHBondContact O-N 2.82Å | ||
| 154 | E | 55.9 | Low | 54.2 | Low | 61 Ų | 61 | 92 Ų | 92 | 29% | 0.285 | 49% | 0.493 | S | S | . | . | trans | -62.9 | 125.8 | 168.5 | -70.3 | -168.7 | 164.4 | 0 | 0 | 108.7 | P152 S156 | P152-E154 PolarHBondContact O-N 3.33Å; E154-S156 PolarHBondContact O-N 2.93Å | ||
| 155 | S | 74.3 | Confident | 56.5 | Low | 67 Ų | 67 | 88 Ų | 88 | 47% | 0.469 | 48% | 0.477 | S | S | . | . | trans | -64.6 | 134.3 | 172.8 | 177.6 | 0 | 0 | 0 | 0 | 108.8 | K153 S157 I158 M159 | K153-S155 PolarHBondContact O-N 2.82Å; S155-S157 PolarHBondContact O-N 2.86Å; S155-I158 PolarHBondContact O-N 3.39Å; S155-M159 PolarHBondContact O-N 3.26Å | ||
| 156 | S | 70.6 | Confident | 59 | Low | 51 Ų | 51 | 83.7 Ų | 83.7 | 36% | 0.357 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -53.7 | -26.9 | 178.9 | -57.6 | 0 | 0 | 0 | 0 | 113 | E154 A160 | E154-S156 PolarHBondContact O-N 2.93Å; S156-A160 WeakPolarHBondContact O-CB 3.33Å; S156-A160 PolarHBondContact O-N 2.91Å |
| 157 | S | 70.3 | Confident | 61.5 | Low | 88 Ų | 88 | 75.4 Ų | 75.4 | 62% | 0.615 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -71 | -33.4 | 175.3 | -172.9 | 0 | 0 | 0 | 0 | 113.7 | S155 L161 | S155-S157 PolarHBondContact O-N 2.86Å; S157-L161 PolarHBondContact O-N 3.3Å |
| 158 | I | 77.6 | Confident | 64.6 | Low | 88 Ų | 88 | 74.8 Ų | 74.8 | 45% | 0.451 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -73.1 | -45.3 | 178.6 | -64.8 | 172.5 | 0 | 0 | 0 | 108.9 | S155 A160 L161 Q162 | S155-I158 PolarHBondContact O-N 3.39Å; I158-A160 VanDerWaalsContact C-N 3.31Å; I158-A160 PolarHBondContact O-N 2.61Å; I158-L161 PolarHBondContact O-N 2.99Å; I158-L161 VanDerWaalsContact O-N 3.16Å; I158-Q162 HydrophobicContact CG2-CG 4.4Å; I158-Q162 VanDerWaalsContact O-CG 3.31Å; I158-Q162 WeakPolarHBondContact O-CG 3.17Å; I158-Q162 PolarHBondContact O-N 3.46Å |
| 159 | M | 74.2 | Confident | 67.5 | Low | 7 Ų | 7 | 72.8 Ų | 72.8 | 3% | 0.034 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -59.2 | -42.2 | 175.2 | -176.8 | 168.4 | 66.1 | 0 | 0 | 112 | S155 L161 Q162 I163 R431 K467 S468 V471 | S155-M159 PolarHBondContact O-N 3.26Å; M159-L161 PolarHBondContact O-N 3.33Å; M159-Q162 PolarHBondContact O-N 3.26Å; M159-I163 HydrophobicContact CG-CD1 3.73Å; M159-I163 WeakPolarHBondContact O-CD1 3.28Å; M159-I163 VanDerWaalsContact O-CG1 3.26Å; M159-I163 WeakPolarHBondContact O-CG1 3.2Å; M159-I163 PolarHBondContact O-N 3.28Å; M159-R431 PolarHBondContact SD-NH1 3.32Å; M159-K467 HydrophobicContact CE-CB 4.23Å; M159-K467 WeakPolarHBondContact CE-O 3.23Å; M159-S468 VanDerWaalsContact CE-CA 3.48Å; M159-V471 HydrophobicContact CE-CB 3.91Å; M159-V471 HydrophobicContact CE-CG2 3.54Å |
| 160 | A | 75.8 | Confident | 70.3 | Confident | 36 Ų | 36 | 63.9 Ų | 63.9 | 30% | 0.298 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | S156 I158 Q162 I163 L164 V471 | S156-A160 WeakPolarHBondContact O-CB 3.33Å; S156-A160 PolarHBondContact O-N 2.91Å; I158-A160 VanDerWaalsContact C-N 3.31Å; I158-A160 PolarHBondContact O-N 2.61Å; A160-Q162 PolarHBondContact O-N 3.09Å; A160-I163 PolarHBondContact O-N 3.37Å; A160-L164 VanDerWaalsContact O-CB 3.27Å; A160-L164 WeakPolarHBondContact O-CB 3.5Å; A160-L164 PolarHBondContact O-N 3.11Å; A160-V471 HydrophobicContact CB-CG1 3.78Å |
| 161 | L | 78.3 | Confident | 73.3 | Confident | 80 Ų | 80 | 54.5 Ų | 54.5 | 42% | 0.419 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.7 | -37.5 | 179.7 | -170.7 | 67.8 | 0 | 0 | 0 | 112.4 | L41 S157 I158 M159 | L41-L161 HydrophobicContact CD1-CD2 3.86Å; L41-L161 HydrophobicContact CD2-CD2 4.14Å; L41-L161 HydrophobicContact CG-CD2 4.37Å; S157-L161 PolarHBondContact O-N 3.3Å; I158-L161 PolarHBondContact O-N 2.99Å; I158-L161 VanDerWaalsContact O-N 3.16Å; M159-L161 PolarHBondContact O-N 3.33Å |
| 162 | Q | 74.2 | Confident | 75.8 | Confident | 23 Ų | 23 | 55.3 Ų | 55.3 | 11% | 0.107 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.9 | -39.7 | 175.6 | -73.2 | 172.7 | -8.5 | 0 | 0 | 112.2 | S44 M45 I158 M159 A160 P166 | S44-Q162 PolarHBondContact O-NE2 3.01Å; M45-Q162 HydrophobicContact CB-CG 4.05Å; M45-Q162 HydrophobicContact CE-CG 4.44Å; M45-Q162 HydrophobicContact CG-CG 3.85Å; M45-Q162 HydrophobicContact SD-CB 4.41Å; M45-Q162 HydrophobicContact SD-CG 4.28Å; I158-Q162 HydrophobicContact CG2-CG 4.4Å; I158-Q162 VanDerWaalsContact O-CG 3.31Å; I158-Q162 WeakPolarHBondContact O-CG 3.17Å; I158-Q162 PolarHBondContact O-N 3.46Å; M159-Q162 PolarHBondContact O-N 3.26Å; A160-Q162 PolarHBondContact O-N 3.09Å; Q162-P166 WeakPolarHBondContact O-CD 3.43Å |
| 163 | I | 78.5 | Confident | 78.4 | Confident | 7 Ų | 7 | 52.5 Ų | 52.5 | 4% | 0.036 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -82.4 | -29.8 | -177.2 | -63 | 167.6 | 0 | 0 | 0 | 111.7 | M159 A160 V165 P166 F167 L472 L475 | M159-I163 HydrophobicContact CG-CD1 3.73Å; M159-I163 WeakPolarHBondContact O-CD1 3.28Å; M159-I163 VanDerWaalsContact O-CG1 3.26Å; M159-I163 WeakPolarHBondContact O-CG1 3.2Å; M159-I163 PolarHBondContact O-N 3.28Å; A160-I163 PolarHBondContact O-N 3.37Å; I163-V165 PolarHBondContact O-N 2.75Å; I163-P166 WeakPolarHBondContact O-CD 3.39Å; I163-F167 HydrophobicContact CG2-CB 4.44Å; I163-F167 WeakPolarHBondContact O-CB 3.26Å; I163-F167 PolarHBondContact O-N 3.15Å; I163-L472 HydrophobicContact CD1-CD2 3.8Å; I163-L472 HydrophobicContact CG2-CD2 3.79Å; I163-L475 HydrophobicContact CG2-CD2 3.99Å |
| 164 | L | 84.4 | Confident | 80.8 | Confident | 61 Ų | 61 | 42.5 Ų | 42.5 | 32% | 0.319 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -56.3 | -46.9 | -173.5 | 179.1 | 64.7 | 0 | 0 | 0 | 113.6 | A160 F167 L168 L475 | A160-L164 VanDerWaalsContact O-CB 3.27Å; A160-L164 WeakPolarHBondContact O-CB 3.5Å; A160-L164 PolarHBondContact O-N 3.11Å; L164-F167 PolarHBondContact O-N 3.22Å; L164-L168 HydrophobicContact CD1-CD1 3.93Å; L164-L168 HydrophobicContact CD1-CG 4.07Å; L164-L168 HydrophobicContact CG-CD1 4.06Å; L164-L168 WeakPolarHBondContact O-CB 3.42Å; L164-L168 WeakPolarHBondContact O-CG 3.25Å; L164-L168 PolarHBondContact O-N 3.4Å; L164-L475 HydrophobicContact CD1-CD1 3.66Å |
| 165 | V | 83.3 | Confident | 82.6 | Confident | 78 Ų | 78 | 39.7 Ų | 39.7 | 47% | 0.473 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -67.5 | -52.7 | -176.8 | 173.6 | 0 | 0 | 0 | 0 | 111.6 | I163 F167 L168 L169 | I163-V165 PolarHBondContact O-N 2.75Å; V165-F167 VanDerWaalsContact C-N 3.25Å; V165-F167 PolarHBondContact O-N 3.32Å; V165-L168 PolarHBondContact O-N 3.19Å; V165-L169 PolarHBondContact O-N 2.99Å |
| 166 | P | 81.5 | Confident | 83.5 | Confident | 33 Ų | 33 | 38.7 Ų | 38.7 | 21% | 0.214 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -47.9 | -46.8 | 169.1 | -35.6 | 39.9 | 0 | 0 | 0 | 114.3 | Q162 I163 L169 A170 P317 | Q162-P166 WeakPolarHBondContact O-CD 3.43Å; I163-P166 WeakPolarHBondContact O-CD 3.39Å; P166-L169 PolarHBondContact O-N 2.93Å; P166-A170 VanDerWaalsContact O-CB 3.32Å; P166-A170 WeakPolarHBondContact O-CB 3.28Å; P166-A170 PolarHBondContact O-N 3.18Å; P166-P317 HydrophobicContact CB-CB 4.17Å; P166-P317 HydrophobicContact CB-CG 3.66Å; P166-P317 HydrophobicContact CG-CG 3.87Å |
| 167 | F | 86.2 | Confident | 84.6 | Confident | 9 Ų | 9 | 36.3 Ų | 36.3 | 4% | 0.039 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.4 | -46.5 | -177.5 | 170 | -95.7 | 0 | 0 | 0 | 112.3 | I163 L164 V165 G171 I420 L424 L475 F483 | I163-F167 HydrophobicContact CG2-CB 4.44Å; I163-F167 WeakPolarHBondContact O-CB 3.26Å; I163-F167 PolarHBondContact O-N 3.15Å; L164-F167 PolarHBondContact O-N 3.22Å; V165-F167 VanDerWaalsContact C-N 3.25Å; V165-F167 PolarHBondContact O-N 3.32Å; F167-G171 PolarHBondContact O-N 3.26Å; F167-I420 HydrophobicContact CD2-CG2 4.47Å; F167-I420 HydrophobicContact CE2-CG2 3.53Å; F167-I420 HydrophobicContact CZ-CG2 4.11Å; F167-L424 HydrophobicContact CD2-CD2 3.63Å; F167-L424 HydrophobicContact CD2-CG 4.25Å; F167-L424 HydrophobicContact CE2-CD1 4.04Å; F167-L424 HydrophobicContact CE2-CD2 3.84Å; F167-L424 HydrophobicContact CE2-CG 4.09Å; F167-L475 HydrophobicContact CB-CD2 3.74Å; F167-L475 HydrophobicContact CD1-CD1 4.14Å; F167-L475 HydrophobicContact CD1-CD2 3.54Å; F167-L475 HydrophobicContact CD1-CG 3.72Å; F167-L475 HydrophobicContact CD2-CD2 3.74Å; F167-L475 HydrophobicContact CD2-CG 4.32Å; F167-L475 HydrophobicContact CE1-CD1 4.22Å; F167-L475 HydrophobicContact CE1-CD2 4.02Å; F167-L475 HydrophobicContact CE1-CG 3.7Å; F167-L475 HydrophobicContact CE2-CD2 4.17Å; F167-L475 HydrophobicContact CE2-CG 4.27Å; F167-L475 HydrophobicContact CG-CD2 3.38Å; F167-L475 HydrophobicContact CG-CG 4.04Å; F167-L475 HydrophobicContact CZ-CD2 4.3Å; F167-L475 HydrophobicContact CZ-CG 3.98Å; F167-F483 HydrophobicContact CD1-CZ 4.37Å; F167-F483 AromaticContact CE1-CE2 3.84Å; F167-F483 HydrophobicContact CE1-CE2 3.84Å; F167-F483 AromaticContact CE1-CZ 3.86Å; F167-F483 HydrophobicContact CE1-CZ 3.86Å; F167-F483 AromaticContact CZ-CE2 3.79Å; F167-F483 HydrophobicContact CZ-CE2 3.79Å; F167-F483 HydrophobicContact CZ-CZ 4.23Å |
| 168 | L | 90.2 | Very high | 85.6 | Confident | 40 Ų | 40 | 32.1 Ų | 32.1 | 21% | 0.209 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.3 | -43.2 | 177.2 | -72.4 | 175.1 | 0 | 0 | 0 | 111.4 | L164 V165 G171 F172 I482 F483 | L164-L168 HydrophobicContact CD1-CD1 3.93Å; L164-L168 HydrophobicContact CD1-CG 4.07Å; L164-L168 HydrophobicContact CG-CD1 4.06Å; L164-L168 WeakPolarHBondContact O-CB 3.42Å; L164-L168 WeakPolarHBondContact O-CG 3.25Å; L164-L168 PolarHBondContact O-N 3.4Å; V165-L168 PolarHBondContact O-N 3.19Å; L168-G171 PolarHBondContact O-N 3.25Å; L168-F172 HydrophobicContact CB-CE2 4.25Å; L168-F172 WeakPolarHBondContact O-CD2 3.5Å; L168-F172 PolarHBondContact O-N 3.26Å; L168-I482 HydrophobicContact CD2-CD1 3.98Å; L168-F483 HydrophobicContact CD2-CE1 4.16Å; L168-F483 HydrophobicContact CD2-CZ 4.13Å |
| 169 | L | 88.4 | Confident | 86.3 | Confident | 71 Ų | 71 | 28.7 Ų | 28.7 | 37% | 0.372 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -63.3 | -46 | 179.4 | -170.8 | 71.5 | 0 | 0 | 0 | 111.7 | V165 P166 G173 P317 I318 S321 | V165-L169 PolarHBondContact O-N 2.99Å; P166-L169 PolarHBondContact O-N 2.93Å; L169-G173 PolarHBondContact O-N 3.35Å; L169-P317 HydrophobicContact CD2-CB 3.81Å; L169-I318 HydrophobicContact CD2-CG1 4.17Å; L169-S321 VanDerWaalsContact O-CB 3.24Å; L169-S321 WeakPolarHBondContact O-CB 3.32Å; L169-S321 PolarHBondContact O-OG 2.97Å |
| 170 | A | 87.4 | Confident | 87.3 | Confident | 7 Ų | 7 | 30 Ų | 30 | 6% | 0.058 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.2 | -46.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111 | P166 F172 G173 T174 A320 | P166-A170 VanDerWaalsContact O-CB 3.32Å; P166-A170 WeakPolarHBondContact O-CB 3.28Å; P166-A170 PolarHBondContact O-N 3.18Å; A170-F172 PolarHBondContact O-N 2.81Å; A170-G173 WeakPolarHBondContact O-CA 3.43Å; A170-G173 PolarHBondContact O-N 3.03Å; A170-G173 VanDerWaalsContact O-N 3.1Å; A170-T174 WeakPolarHBondContact O-CG2 3.38Å; A170-T174 PolarHBondContact O-N 3.33Å; A170-A320 HydrophobicContact CB-CB 3.66Å |
| 171 | G | 91.1 | Very high | 88.1 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59 | -46.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | F167 L168 G173 T174 V175 | F167-G171 PolarHBondContact O-N 3.26Å; L168-G171 PolarHBondContact O-N 3.25Å; G171-G173 PolarHBondContact O-N 2.99Å; G171-T174 WeakPolarHBondContact CA-OG1 3.47Å; G171-T174 PolarHBondContact O-N 3.41Å; G171-T174 VanDerWaalsContact O-N 3.15Å; G171-T174 PolarHBondContact O-OG1 3.34Å; G171-V175 WeakPolarHBondContact O-CG2 3.33Å; G171-V175 PolarHBondContact O-N 3.19Å |
| 172 | F | 92.1 | Very high | 88.7 | Confident | 83 Ų | 83 | 25.1 Ų | 25.1 | 36% | 0.364 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -61.2 | -33.5 | 174.9 | -73 | -56.8 | 0 | 0 | 0 | 113.1 | L168 A170 S176 I482 T486 | L168-F172 HydrophobicContact CB-CE2 4.25Å; L168-F172 WeakPolarHBondContact O-CD2 3.5Å; L168-F172 PolarHBondContact O-N 3.26Å; A170-F172 PolarHBondContact O-N 2.81Å; F172-S176 WeakPolarHBondContact O-CB 3.24Å; F172-S176 PolarHBondContact O-N 3.35Å; F172-S176 PolarHBondContact O-OG 3.4Å; F172-I482 HydrophobicContact CE1-CG2 4.32Å; F172-I482 HydrophobicContact CZ-CG2 4.05Å; F172-T486 HydrophobicContact CD1-CG2 4.38Å; F172-T486 HydrophobicContact CE1-CG2 4.2Å |
| 173 | G | 91.4 | Very high | 89.5 | Confident | 2 Ų | 2 | 29 Ų | 29 | 2% | 0.021 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -64.9 | -45.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L169 A170 G171 V175 S176 A177 S321 | L169-G173 PolarHBondContact O-N 3.35Å; A170-G173 WeakPolarHBondContact O-CA 3.43Å; A170-G173 PolarHBondContact O-N 3.03Å; A170-G173 VanDerWaalsContact O-N 3.1Å; G171-G173 PolarHBondContact O-N 2.99Å; G173-V175 PolarHBondContact O-N 3.47Å; G173-S176 WeakPolarHBondContact O-CB 3.44Å; G173-S176 PolarHBondContact O-N 3.17Å; G173-A177 PolarHBondContact O-N 3.3Å; G173-S321 CarbonylContact C-O 3.58Å; G173-S321 WeakPolarHBondContact CA-O 3.4Å; G173-S321 WeakPolarHBondContact CA-OG 3.21Å; G173-S321 PolarHBondContact N-OG 3.44Å |
| 174 | T | 91.5 | Very high | 90.3 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -66 | -35.7 | 176 | 62.7 | 0 | 0 | 0 | 0 | 112.7 | A170 G171 A177 G178 | A170-T174 WeakPolarHBondContact O-CG2 3.38Å; A170-T174 PolarHBondContact O-N 3.33Å; G171-T174 WeakPolarHBondContact CA-OG1 3.47Å; G171-T174 PolarHBondContact O-N 3.41Å; G171-T174 VanDerWaalsContact O-N 3.15Å; G171-T174 PolarHBondContact O-OG1 3.34Å; T174-A177 WeakPolarHBondContact O-CB 3.18Å; T174-A177 PolarHBondContact O-N 3.45Å; T174-G178 PolarHBondContact O-N 3.21Å |
| 175 | V | 93.6 | Very high | 90.6 | Very high | 3 Ų | 3 | 26.4 Ų | 26.4 | 2% | 0.018 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -62.8 | -43.8 | 172.1 | 169.4 | 0 | 0 | 0 | 0 | 110.5 | G171 G173 A177 G178 M179 V416 F483 T486 I487 | G171-V175 WeakPolarHBondContact O-CG2 3.33Å; G171-V175 PolarHBondContact O-N 3.19Å; G173-V175 PolarHBondContact O-N 3.47Å; V175-A177 VanDerWaalsContact C-N 3.32Å; V175-A177 PolarHBondContact O-N 2.82Å; V175-G178 PolarHBondContact O-N 3.25Å; V175-M179 HydrophobicContact CG1-CE 3.39Å; V175-M179 HydrophobicContact CG1-SD 4.14Å; V175-M179 WeakPolarHBondContact O-CG 3.48Å; V175-M179 PolarHBondContact O-N 2.86Å; V175-V416 HydrophobicContact CB-CG2 4.28Å; V175-V416 HydrophobicContact CG2-CG1 4.27Å; V175-V416 HydrophobicContact CG2-CG2 3.71Å; V175-F483 HydrophobicContact CG2-CB 3.71Å; V175-F483 HydrophobicContact CG2-CD1 4.06Å; V175-F483 HydrophobicContact CG2-CG 4.05Å; V175-T486 HydrophobicContact CG1-CG2 4.26Å; V175-I487 HydrophobicContact CG1-CG1 3.8Å |
| 176 | S | 92.9 | Very high | 91 | Very high | 46 Ų | 46 | 26.2 Ų | 26.2 | 32% | 0.322 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -62.5 | -40.2 | 175.8 | -55.7 | 0 | 0 | 0 | 0 | 111.4 | F172 G173 M179 V180 | F172-S176 WeakPolarHBondContact O-CB 3.24Å; F172-S176 PolarHBondContact O-N 3.35Å; F172-S176 PolarHBondContact O-OG 3.4Å; G173-S176 WeakPolarHBondContact O-CB 3.44Å; G173-S176 PolarHBondContact O-N 3.17Å; S176-M179 PolarHBondContact O-N 2.9Å; S176-V180 WeakPolarHBondContact O-CG2 3.39Å; S176-V180 PolarHBondContact O-N 2.9Å |
| 177 | A | 92.9 | Very high | 91.6 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | G173 T174 V175 M179 V180 L181 D324 L325 P415 | G173-A177 PolarHBondContact O-N 3.3Å; T174-A177 WeakPolarHBondContact O-CB 3.18Å; T174-A177 PolarHBondContact O-N 3.45Å; V175-A177 VanDerWaalsContact C-N 3.32Å; V175-A177 PolarHBondContact O-N 2.82Å; A177-M179 VanDerWaalsContact C-N 3.33Å; A177-M179 PolarHBondContact O-N 3.46Å; A177-V180 PolarHBondContact O-N 2.86Å; A177-L181 PolarHBondContact O-N 3Å; A177-D324 HydrophobicContact CB-CB 3.92Å; A177-L325 HydrophobicContact CB-CB 4.43Å; A177-P415 HydrophobicContact CB-CB 4.24Å |
| 178 | G | 93.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -57.1 | -43.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | T174 V175 L181 D182 V412 | T174-G178 PolarHBondContact O-N 3.21Å; V175-G178 PolarHBondContact O-N 3.25Å; G178-L181 PolarHBondContact O-N 3.31Å; G178-D182 WeakPolarHBondContact O-CB 3.01Å; G178-D182 PolarHBondContact O-N 3.28Å; G178-V412 WeakPolarHBondContact CA-O 3.25Å |
| 179 | M | 91.5 | Very high | 92.1 | Very high | 16 Ų | 16 | 30.4 Ų | 30.4 | 8% | 0.079 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -66.6 | -41 | 176.4 | -69.5 | 165.6 | -179.3 | 0 | 0 | 112.7 | V175 S176 A177 L181 D182 I183 V412 I487 M490 | V175-M179 HydrophobicContact CG1-CE 3.39Å; V175-M179 HydrophobicContact CG1-SD 4.14Å; V175-M179 WeakPolarHBondContact O-CG 3.48Å; V175-M179 PolarHBondContact O-N 2.86Å; S176-M179 PolarHBondContact O-N 2.9Å; A177-M179 VanDerWaalsContact C-N 3.33Å; A177-M179 PolarHBondContact O-N 3.46Å; M179-L181 VanDerWaalsContact C-N 3.28Å; M179-L181 PolarHBondContact O-N 3.43Å; M179-D182 PolarHBondContact O-N 3.31Å; M179-I183 WeakPolarHBondContact O-CG1 3.29Å; M179-I183 PolarHBondContact O-N 3.34Å; M179-V412 HydrophobicContact CG-CG2 4.5Å; M179-I487 HydrophobicContact CE-CB 4.49Å; M179-I487 HydrophobicContact CE-CG1 4.13Å; M179-M490 HydrophobicContact CE-CB 3.62Å; M179-M490 HydrophobicContact CE-CE 3.93Å; M179-M490 HydrophobicContact CE-CG 3.9Å; M179-M490 HydrophobicContact CE-SD 3.29Å; M179-M490 WeakPolarHBondContact CE-SD 3.41Å; M179-M490 HydrophobicContact SD-CB 4.33Å; M179-M490 HydrophobicContact SD-CE 3.3Å; M179-M490 WeakPolarHBondContact SD-CE 3.41Å; M179-M490 HydrophobicContact SD-SD 3.47Å |
| 180 | V | 94 | Very high | 92.3 | Very high | 36 Ų | 36 | 27.1 Ų | 27.1 | 22% | 0.218 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61.9 | -42.9 | 173.6 | 176.1 | 0 | 0 | 0 | 0 | 109.5 | S176 A177 D182 I183 V184 L325 L328 A329 | S176-V180 WeakPolarHBondContact O-CG2 3.39Å; S176-V180 PolarHBondContact O-N 2.9Å; A177-V180 PolarHBondContact O-N 2.86Å; V180-D182 VanDerWaalsContact C-N 3.34Å; V180-D182 PolarHBondContact O-N 2.88Å; V180-I183 PolarHBondContact O-N 3.01Å; V180-V184 HydrophobicContact CG1-CG1 4.13Å; V180-V184 WeakPolarHBondContact O-CG1 3.3Å; V180-V184 WeakPolarHBondContact O-CG2 3.44Å; V180-V184 PolarHBondContact O-N 2.98Å; V180-L325 HydrophobicContact CB-CD1 4.4Å; V180-L325 HydrophobicContact CG2-CD1 3.51Å; V180-L328 HydrophobicContact CB-CD2 3.81Å; V180-L328 HydrophobicContact CG1-CD2 3.42Å; V180-L328 VanDerWaalsContact CG1-CD2 3.42Å; V180-A329 HydrophobicContact CG1-CB 4.46Å |
| 181 | L | 93.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 177.4 | -161.9 | 57.6 | 0 | 0 | 0 | 112.4 | A177 G178 M179 I183 V184 Q185 F190 F197 V200 L328 V411 P415 | A177-L181 PolarHBondContact O-N 3Å; G178-L181 PolarHBondContact O-N 3.31Å; M179-L181 VanDerWaalsContact C-N 3.28Å; M179-L181 PolarHBondContact O-N 3.43Å; L181-I183 VanDerWaalsContact C-N 3.3Å; L181-I183 PolarHBondContact O-N 3.36Å; L181-V184 HydrophobicContact CD1-CG2 4.03Å; L181-V184 PolarHBondContact O-N 3Å; L181-Q185 WeakPolarHBondContact O-CB 3.28Å; L181-Q185 WeakPolarHBondContact O-CG 3.32Å; L181-Q185 PolarHBondContact O-N 3.48Å; L181-F190 HydrophobicContact CD1-CE1 4.05Å; L181-F197 HydrophobicContact CD1-CE1 4.39Å; L181-V200 HydrophobicContact CD1-CG2 4.06Å; L181-V200 HydrophobicContact CD2-CG1 4.13Å; L181-L328 HydrophobicContact CB-CD1 3.82Å; L181-L328 HydrophobicContact CB-CD2 3.98Å; L181-L328 HydrophobicContact CB-CG 4.5Å; L181-L328 HydrophobicContact CD1-CD1 3.93Å; L181-L328 HydrophobicContact CD1-CD2 4.12Å; L181-L328 HydrophobicContact CD1-CG 4.23Å; L181-L328 HydrophobicContact CD2-CD1 4.16Å; L181-L328 HydrophobicContact CG-CD1 4.12Å; L181-V411 HydrophobicContact CB-CG1 3.86Å; L181-V411 HydrophobicContact CD1-CG1 4.49Å; L181-V411 HydrophobicContact CD2-CG1 3.56Å; L181-V411 HydrophobicContact CG-CG1 3.32Å; L181-P415 HydrophobicContact CD2-CG 3.97Å |
| 182 | D | 91.4 | Very high | 92.4 | Very high | 12 Ų | 12 | 36.4 Ų | 36.4 | 6% | 0.064 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.7 | -35 | 175.1 | -173.3 | 38.5 | 0 | 0 | 0 | 112.9 | G178 M179 V180 Q185 H186 V412 S492 G493 H494 | G178-D182 WeakPolarHBondContact O-CB 3.01Å; G178-D182 PolarHBondContact O-N 3.28Å; M179-D182 PolarHBondContact O-N 3.31Å; V180-D182 VanDerWaalsContact C-N 3.34Å; V180-D182 PolarHBondContact O-N 2.88Å; D182-Q185 WeakPolarHBondContact O-CG 3.27Å; D182-Q185 PolarHBondContact OD1-NE2 2.74Å; D182-H186 PolarHBondContact O-CE1 2.86Å; D182-H186 PolarHBondContact O-ND1 3.46Å; D182-V412 HydrophobicContact CB-CB 4.18Å; D182-V412 HydrophobicContact CB-CG2 4.35Å; D182-S492 PolarHBondContact OD2-OG 2.9Å; D182-G493 PolarHBondContact OD2-N 3.26Å; D182-H494 IonicContact OD1-CD2 3.6Å |
| 183 | I | 91.3 | Very high | 92.4 | Very high | 104 Ų | 104 | 32.5 Ų | 32.5 | 53% | 0.533 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -74.1 | -48 | 174.6 | -66.3 | 164 | 0 | 0 | 0 | 110.7 | M179 V180 L181 H186 | M179-I183 WeakPolarHBondContact O-CG1 3.29Å; M179-I183 PolarHBondContact O-N 3.34Å; V180-I183 PolarHBondContact O-N 3.01Å; L181-I183 VanDerWaalsContact C-N 3.3Å; L181-I183 PolarHBondContact O-N 3.36Å; I183-H186 PolarHBondContact O-N 3.33Å |
| 184 | V | 94 | Very high | 92.3 | Very high | 4 Ų | 4 | 33.6 Ų | 33.6 | 2% | 0.024 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -79.2 | -21.4 | -170.6 | -55.4 | 0 | 0 | 0 | 0 | 113.1 | V180 L181 H186 W187 F190 L328 A332 | V180-V184 HydrophobicContact CG1-CG1 4.13Å; V180-V184 WeakPolarHBondContact O-CG1 3.3Å; V180-V184 WeakPolarHBondContact O-CG2 3.44Å; V180-V184 PolarHBondContact O-N 2.98Å; L181-V184 HydrophobicContact CD1-CG2 4.03Å; L181-V184 PolarHBondContact O-N 3Å; V184-H186 PolarHBondContact O-N 3.41Å; V184-H186 VanDerWaalsContact O-N 3.08Å; V184-W187 HydrophobicContact CB-CD2 4.14Å; V184-W187 HydrophobicContact CB-CE3 4.34Å; V184-W187 HydrophobicContact CB-CG 4.42Å; V184-W187 HydrophobicContact CG1-CD2 4.14Å; V184-W187 HydrophobicContact CG1-CE3 4.24Å; V184-W187 HydrophobicContact CG1-CH2 4.13Å; V184-W187 HydrophobicContact CG1-CZ2 3.98Å; V184-W187 HydrophobicContact CG1-CZ3 4.24Å; V184-W187 VanDerWaalsContact O-CB 3.25Å; V184-W187 WeakPolarHBondContact O-CB 3.33Å; V184-W187 PolarHBondContact O-N 3.49Å; V184-F190 HydrophobicContact CB-CD2 4.17Å; V184-F190 HydrophobicContact CB-CE2 3.78Å; V184-F190 HydrophobicContact CB-CZ 4.22Å; V184-F190 HydrophobicContact CG2-CD2 4.24Å; V184-F190 HydrophobicContact CG2-CE1 4.08Å; V184-F190 HydrophobicContact CG2-CE2 3.64Å; V184-F190 HydrophobicContact CG2-CZ 3.54Å; V184-F190 WeakPolarHBondContact O-CD2 3.41Å; V184-F190 WeakPolarHBondContact O-CG 3.36Å; V184-L328 HydrophobicContact CG2-CD2 4.3Å; V184-A332 HydrophobicContact CB-CB 3.85Å; V184-A332 HydrophobicContact CG1-CB 3.52Å; V184-A332 HydrophobicContact CG2-CB 3.96Å |
| 185 | Q | 91.8 | Very high | 92.4 | Very high | 10 Ų | 10 | 34.7 Ų | 34.7 | 5% | 0.047 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57 | -25.3 | 173.3 | 59.1 | 168 | -24.4 | 0 | 0 | 112.7 | L181 D182 W187 F197 V408 V411 | L181-Q185 WeakPolarHBondContact O-CB 3.28Å; L181-Q185 WeakPolarHBondContact O-CG 3.32Å; L181-Q185 PolarHBondContact O-N 3.48Å; D182-Q185 WeakPolarHBondContact O-CG 3.27Å; D182-Q185 PolarHBondContact OD1-NE2 2.74Å; Q185-W187 VanDerWaalsContact C-N 3.34Å; Q185-F197 HydrophobicContact CB-CE1 3.99Å; Q185-F197 HydrophobicContact CB-CZ 3.64Å; Q185-V408 VanDerWaalsContact OE1-CG1 3.24Å; Q185-V411 HydrophobicContact CB-CG1 4.36Å; Q185-V411 HydrophobicContact CG-CG1 4.33Å |
| 186 | H | 90.8 | Very high | 92.4 | Very high | 75 Ų | 75 | 34.7 Ų | 34.7 | 35% | 0.347 | 18% | 0.175 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | -8 | 178.6 | -64.7 | 99.3 | 0 | 0 | 0 | 113.8 | D182 I183 V184 K191 H494 | D182-H186 PolarHBondContact O-CE1 2.86Å; D182-H186 PolarHBondContact O-ND1 3.46Å; I183-H186 PolarHBondContact O-N 3.33Å; V184-H186 PolarHBondContact O-N 3.41Å; V184-H186 VanDerWaalsContact O-N 3.08Å; H186-K191 VanDerWaalsContact O-CE 3.26Å; H186-K191 WeakPolarHBondContact O-CE 3.4Å; H186-K191 PolarHBondContact O-NZ 3.47Å; H186-H494 AromaticContact CE1-NE2 3.38Å; H186-H494 PolarHBondContact CE1-NE2 3.45Å; H186-H494 AromaticContact NE2-NE2 3.83Å |
| 187 | W | 94.4 | Very high | 92.5 | Very high | 77 Ų | 77 | 32.8 Ų | 32.8 | 29% | 0.292 | 16% | 0.161 | S | C | . | . | S | Bend | trans | -75.8 | 154.3 | -179.5 | -66 | 9.3 | 0 | 0 | 0 | 111.8 | V184 Q185 V189 F190 K191 A332 Q336 | V184-W187 HydrophobicContact CB-CD2 4.14Å; V184-W187 HydrophobicContact CB-CE3 4.34Å; V184-W187 HydrophobicContact CB-CG 4.42Å; V184-W187 HydrophobicContact CG1-CD2 4.14Å; V184-W187 HydrophobicContact CG1-CE3 4.24Å; V184-W187 HydrophobicContact CG1-CH2 4.13Å; V184-W187 HydrophobicContact CG1-CZ2 3.98Å; V184-W187 HydrophobicContact CG1-CZ3 4.24Å; V184-W187 VanDerWaalsContact O-CB 3.25Å; V184-W187 WeakPolarHBondContact O-CB 3.33Å; V184-W187 PolarHBondContact O-N 3.49Å; Q185-W187 VanDerWaalsContact C-N 3.34Å; W187-V189 VanDerWaalsContact C-N 3.26Å; W187-V189 PolarHBondContact O-N 2.81Å; W187-F190 HydrophobicContact CB-CD2 4.43Å; W187-F190 PolarHBondContact O-N 3.33Å; W187-F190 VanDerWaalsContact O-N 3.13Å; W187-K191 PolarHBondContact O-N 3.06Å; W187-A332 HydrophobicContact CZ3-CB 4.14Å; W187-Q336 HydrophobicContact CE3-CB 3.75Å; W187-Q336 HydrophobicContact CE3-CG 3.85Å; W187-Q336 HydrophobicContact CZ3-CB 3.9Å; W187-Q336 HydrophobicContact CZ3-CG 4.16Å |
| 188 | D | 93 | Very high | 92.5 | Very high | 93 Ų | 93 | 32.8 Ų | 32.8 | 50% | 0.497 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -59.4 | -35.3 | -173.8 | -62.2 | -43 | 0 | 0 | 0 | 113 | K191 N192 Y339 | D188-K191 PolarHBondContact O-N 3.07Å; D188-N192 VanDerWaalsContact O-CB 3.29Å; D188-N192 WeakPolarHBondContact O-CB 3.49Å; D188-N192 PolarHBondContact O-N 2.86Å; D188-N192 PolarHBondContact O-ND2 3.28Å; D188-Y339 HydrophobicContact CB-CD1 4.39Å; D188-Y339 HydrophobicContact CB-CE1 3.9Å |
| 189 | V | 94.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -66.7 | -40.1 | 178.6 | 68.8 | 0 | 0 | 0 | 0 | 112.1 | W187 K191 V193 V196 L277 Q336 Y339 | W187-V189 VanDerWaalsContact C-N 3.26Å; W187-V189 PolarHBondContact O-N 2.81Å; V189-K191 VanDerWaalsContact C-N 3.33Å; V189-K191 PolarHBondContact O-N 3.1Å; V189-V193 HydrophobicContact CG2-CB 4.39Å; V189-V193 HydrophobicContact CG2-CG2 4.26Å; V189-V193 CarbonylContact O-C 3.28Å; V189-V193 WeakPolarHBondContact O-CA 3.39Å; V189-V193 VanDerWaalsContact O-CB 3.23Å; V189-V193 WeakPolarHBondContact O-CB 3.37Å; V189-V193 PolarHBondContact O-N 2.98Å; V189-V196 HydrophobicContact CG2-CG2 4.49Å; V189-L277 HydrophobicContact CG2-CD2 4.35Å; V189-Q336 HydrophobicContact CG1-CB 4.11Å; V189-Y339 HydrophobicContact CB-CD1 4.26Å; V189-Y339 HydrophobicContact CB-CD2 4.42Å; V189-Y339 HydrophobicContact CB-CG 3.95Å; V189-Y339 HydrophobicContact CG2-CD2 4.13Å; V189-Y339 HydrophobicContact CG2-CG 3.98Å |
| 190 | F | 93 | Very high | 92.7 | Very high | 2 Ų | 2 | 32.2 Ų | 32.2 | 1% | 0.009 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -73.4 | -27.1 | 179.8 | -78 | -96.6 | 0 | 0 | 0 | 112.3 | L181 V184 W187 V196 F197 A332 | L181-F190 HydrophobicContact CD1-CE1 4.05Å; V184-F190 HydrophobicContact CB-CD2 4.17Å; V184-F190 HydrophobicContact CB-CE2 3.78Å; V184-F190 HydrophobicContact CB-CZ 4.22Å; V184-F190 HydrophobicContact CG2-CD2 4.24Å; V184-F190 HydrophobicContact CG2-CE1 4.08Å; V184-F190 HydrophobicContact CG2-CE2 3.64Å; V184-F190 HydrophobicContact CG2-CZ 3.54Å; V184-F190 WeakPolarHBondContact O-CD2 3.41Å; V184-F190 WeakPolarHBondContact O-CG 3.36Å; W187-F190 HydrophobicContact CB-CD2 4.43Å; W187-F190 PolarHBondContact O-N 3.33Å; W187-F190 VanDerWaalsContact O-N 3.13Å; F190-V196 HydrophobicContact CD1-CB 4.25Å; F190-V196 HydrophobicContact CD1-CG1 3.9Å; F190-V196 HydrophobicContact CE1-CB 4.21Å; F190-V196 HydrophobicContact CE1-CG1 3.38Å; F190-V196 HydrophobicContact CE2-CG1 4.32Å; F190-V196 HydrophobicContact CZ-CG1 3.61Å; F190-F197 HydrophobicContact CB-CE2 4.09Å; F190-F197 HydrophobicContact CB-CZ 4.08Å; F190-F197 HydrophobicContact CD1-CD1 4.32Å; F190-F197 HydrophobicContact CD1-CD2 4.47Å; F190-F197 AromaticContact CD1-CE1 3.88Å; F190-F197 HydrophobicContact CD1-CE1 3.88Å; F190-F197 HydrophobicContact CD1-CE2 4.03Å; F190-F197 AromaticContact CD1-CZ 3.71Å; F190-F197 HydrophobicContact CD1-CZ 3.71Å; F190-F197 HydrophobicContact CE1-CE1 4.45Å; F190-F197 HydrophobicContact CG-CZ 4.35Å; F190-F197 WeakPolarHBondContact O-CE2 3.44Å; F190-A332 HydrophobicContact CE2-CB 3.93Å; F190-A332 HydrophobicContact CZ-CB 4.18Å |
| 191 | K | 90.6 | Very high | 92.6 | Very high | 121 Ų | 121 | 30.7 Ų | 30.7 | 53% | 0.526 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -79.6 | -37.3 | 175.4 | -72.3 | 173.9 | 172.1 | 160.5 | 0 | 113.5 | H186 W187 D188 V189 | H186-K191 VanDerWaalsContact O-CE 3.26Å; H186-K191 WeakPolarHBondContact O-CE 3.4Å; H186-K191 PolarHBondContact O-NZ 3.47Å; W187-K191 PolarHBondContact O-N 3.06Å; D188-K191 PolarHBondContact O-N 3.07Å; V189-K191 VanDerWaalsContact C-N 3.33Å; V189-K191 PolarHBondContact O-N 3.1Å |
| 192 | N | 90.3 | Very high | 92.5 | Very high | 81 Ų | 81 | 30.8 Ų | 30.8 | 43% | 0.433 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -96.9 | -17.4 | -174.6 | -64.6 | -49.5 | 0 | 0 | 0 | 113.5 | D188 H274 Y339 | D188-N192 VanDerWaalsContact O-CB 3.29Å; D188-N192 WeakPolarHBondContact O-CB 3.49Å; D188-N192 PolarHBondContact O-N 2.86Å; D188-N192 PolarHBondContact O-ND2 3.28Å; N192-H274 PolarHBondContact O-CE1 3Å; N192-H274 VanDerWaalsContact O-CE1 3.25Å; N192-H274 PolarHBondContact O-ND1 3.49Å; N192-Y339 HydrophobicContact CB-CE2 4.18Å; N192-Y339 WeakPolarHBondContact CB-OH 3.38Å; N192-Y339 PolarHBondContact ND2-OH 2.89Å |
| 193 | V | 91.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.148 | C | C | . | . | trans | -130.4 | 72.7 | 178.5 | -165.4 | 0 | 0 | 0 | 0 | 107.6 | V189 E195 V196 H274 L277 L278 Y339 | V189-V193 HydrophobicContact CG2-CB 4.39Å; V189-V193 HydrophobicContact CG2-CG2 4.26Å; V189-V193 CarbonylContact O-C 3.28Å; V189-V193 WeakPolarHBondContact O-CA 3.39Å; V189-V193 VanDerWaalsContact O-CB 3.23Å; V189-V193 WeakPolarHBondContact O-CB 3.37Å; V189-V193 PolarHBondContact O-N 2.98Å; V193-E195 WeakPolarHBondContact CG1-OE2 3.22Å; V193-E195 PolarHBondContact O-N 3.28Å; V193-V196 HydrophobicContact CB-CG2 4.24Å; V193-V196 HydrophobicContact CG1-CG2 4.12Å; V193-V196 WeakPolarHBondContact O-CB 3.42Å; V193-V196 VanDerWaalsContact O-CG2 3.27Å; V193-V196 WeakPolarHBondContact O-CG2 3.3Å; V193-V196 PolarHBondContact O-N 2.95Å; V193-V196 VanDerWaalsContact O-N 3.15Å; V193-H274 HydrophobicContact CG1-CB 4.27Å; V193-L277 HydrophobicContact CG2-CD2 4.06Å; V193-L278 HydrophobicContact CG1-CD1 3.78Å; V193-L278 HydrophobicContact CG1-CD2 3.86Å; V193-L278 HydrophobicContact CG1-CG 3.75Å; V193-Y339 HydrophobicContact CG2-CD2 4.01Å; V193-Y339 HydrophobicContact CG2-CE2 3.96Å | ||
| 194 | T | 89.9 | Confident | 92.4 | Very high | 25 Ų | 25 | 26.5 Ų | 26.5 | 15% | 0.153 | 13% | 0.128 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.7 | -25.3 | -175 | 46.9 | 0 | 0 | 0 | 0 | 111.8 | V196 F197 E267 D399 | T194-V196 PolarHBondContact O-N 3.23Å; T194-F197 WeakPolarHBondContact O-CB 3.2Å; T194-F197 WeakPolarHBondContact O-CD2 3.43Å; T194-F197 PolarHBondContact O-N 3.44Å; T194-E267 PolarHBondContact OG1-OE1 2.95Å; T194-D399 VanDerWaalsContact CB-OD1 3.23Å; T194-D399 WeakPolarHBondContact CB-OD1 3.47Å |
| 195 | E | 92.8 | Very high | 91.8 | Very high | 24 Ų | 24 | 26.5 Ų | 26.5 | 11% | 0.112 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60.9 | -14.4 | 176.1 | -52.8 | 90.1 | 158 | 0 | 0 | 113.7 | V193 F197 I198 L199 L278 | V193-E195 WeakPolarHBondContact CG1-OE2 3.22Å; V193-E195 PolarHBondContact O-N 3.28Å; E195-F197 PolarHBondContact O-N 3.27Å; E195-I198 HydrophobicContact CB-CD1 4.34Å; E195-I198 HydrophobicContact CG-CD1 4.42Å; E195-I198 WeakPolarHBondContact O-CB 3.41Å; E195-I198 PolarHBondContact O-N 2.7Å; E195-I198 VanDerWaalsContact O-N 3.16Å; E195-L199 PolarHBondContact O-N 3.22Å; E195-L278 HydrophobicContact CB-CD1 3.64Å; E195-L278 HydrophobicContact CB-CD2 4.12Å; E195-L278 HydrophobicContact CG-CD1 4.2Å |
| 196 | V | 94.6 | Very high | 91.1 | Very high | 2 Ų | 2 | 26.7 Ų | 26.7 | 1% | 0.012 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61.2 | -33.6 | 169.1 | -178.7 | 0 | 0 | 0 | 0 | 111.1 | V189 F190 V193 T194 I198 L199 V200 L278 L331 | V189-V196 HydrophobicContact CG2-CG2 4.49Å; F190-V196 HydrophobicContact CD1-CB 4.25Å; F190-V196 HydrophobicContact CD1-CG1 3.9Å; F190-V196 HydrophobicContact CE1-CB 4.21Å; F190-V196 HydrophobicContact CE1-CG1 3.38Å; F190-V196 HydrophobicContact CE2-CG1 4.32Å; F190-V196 HydrophobicContact CZ-CG1 3.61Å; V193-V196 HydrophobicContact CB-CG2 4.24Å; V193-V196 HydrophobicContact CG1-CG2 4.12Å; V193-V196 WeakPolarHBondContact O-CB 3.42Å; V193-V196 VanDerWaalsContact O-CG2 3.27Å; V193-V196 WeakPolarHBondContact O-CG2 3.3Å; V193-V196 PolarHBondContact O-N 2.95Å; V193-V196 VanDerWaalsContact O-N 3.15Å; T194-V196 PolarHBondContact O-N 3.23Å; V196-I198 VanDerWaalsContact C-N 3.32Å; V196-I198 PolarHBondContact O-N 2.89Å; V196-L199 WeakPolarHBondContact O-CB 3.34Å; V196-L199 PolarHBondContact O-N 3.23Å; V196-V200 WeakPolarHBondContact O-CG2 3.39Å; V196-V200 PolarHBondContact O-N 2.76Å; V196-V200 VanDerWaalsContact O-N 3.14Å; V196-L278 HydrophobicContact CB-CD2 4.5Å; V196-L278 HydrophobicContact CG2-CD2 3.65Å; V196-L331 HydrophobicContact CG1-CD2 4.16Å; V196-L331 HydrophobicContact CG1-CG 4.37Å |
| 197 | F | 94 | Very high | 90 | Very high | 6 Ų | 6 | 23.9 Ų | 23.9 | 3% | 0.026 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -66.4 | -33.9 | 173.9 | -71.2 | -71.1 | 0 | 0 | 0 | 112.5 | L181 Q185 F190 T194 E195 L199 V200 P201 L398 D399 V402 V411 | L181-F197 HydrophobicContact CD1-CE1 4.39Å; Q185-F197 HydrophobicContact CB-CE1 3.99Å; Q185-F197 HydrophobicContact CB-CZ 3.64Å; F190-F197 HydrophobicContact CB-CE2 4.09Å; F190-F197 HydrophobicContact CB-CZ 4.08Å; F190-F197 HydrophobicContact CD1-CD1 4.32Å; F190-F197 HydrophobicContact CD1-CD2 4.47Å; F190-F197 AromaticContact CD1-CE1 3.88Å; F190-F197 HydrophobicContact CD1-CE1 3.88Å; F190-F197 HydrophobicContact CD1-CE2 4.03Å; F190-F197 AromaticContact CD1-CZ 3.71Å; F190-F197 HydrophobicContact CD1-CZ 3.71Å; F190-F197 HydrophobicContact CE1-CE1 4.45Å; F190-F197 HydrophobicContact CG-CZ 4.35Å; F190-F197 WeakPolarHBondContact O-CE2 3.44Å; T194-F197 WeakPolarHBondContact O-CB 3.2Å; T194-F197 WeakPolarHBondContact O-CD2 3.43Å; T194-F197 PolarHBondContact O-N 3.44Å; E195-F197 PolarHBondContact O-N 3.27Å; F197-L199 PolarHBondContact O-N 2.85Å; F197-V200 PolarHBondContact O-N 3.07Å; F197-P201 WeakPolarHBondContact O-CD 3.22Å; F197-L398 HydrophobicContact CB-CD2 4.49Å; F197-L398 HydrophobicContact CB-CG 4.49Å; F197-L398 HydrophobicContact CD1-CD2 4.28Å; F197-L398 HydrophobicContact CD1-CG 4.48Å; F197-D399 HydrophobicContact CB-CB 3.96Å; F197-V402 HydrophobicContact CE1-CG1 4.25Å; F197-V402 HydrophobicContact CE2-CG1 3.98Å; F197-V402 HydrophobicContact CZ-CG1 3.83Å; F197-V411 HydrophobicContact CE1-CG2 4.44Å |
| 198 | I | 93.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.1 | -37.1 | 173.9 | -51.2 | 179.4 | 0 | 0 | 0 | 110.7 | E195 V196 A259 L262 S392 L396 D399 | E195-I198 HydrophobicContact CB-CD1 4.34Å; E195-I198 HydrophobicContact CG-CD1 4.42Å; E195-I198 WeakPolarHBondContact O-CB 3.41Å; E195-I198 PolarHBondContact O-N 2.7Å; E195-I198 VanDerWaalsContact O-N 3.16Å; V196-I198 VanDerWaalsContact C-N 3.32Å; V196-I198 PolarHBondContact O-N 2.89Å; I198-A259 HydrophobicContact CB-CB 3.99Å; I198-A259 HydrophobicContact CG2-CB 3.96Å; I198-L262 HydrophobicContact CD1-CB 4.46Å; I198-L262 HydrophobicContact CG2-CB 4.45Å; I198-L262 HydrophobicContact CG2-CD1 4.33Å; I198-S392 WeakPolarHBondContact CG2-O 3.47Å; I198-L396 HydrophobicContact CD1-CD1 3.78Å; I198-L396 HydrophobicContact CG1-CD1 4.44Å; I198-D399 HydrophobicContact CD1-CB 4.37Å; I198-D399 HydrophobicContact CG1-CB 3.62Å |
| 199 | L | 93.4 | Very high | 87.3 | Confident | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -74.4 | -28.6 | -178.5 | -174.7 | 63.8 | 0 | 0 | 0 | 113.4 | E195 V196 F197 A202 L203 A255 S282 L331 | E195-L199 PolarHBondContact O-N 3.22Å; V196-L199 WeakPolarHBondContact O-CB 3.34Å; V196-L199 PolarHBondContact O-N 3.23Å; F197-L199 PolarHBondContact O-N 2.85Å; L199-A202 PolarHBondContact O-N 3.4Å; L199-L203 HydrophobicContact CD1-CD1 4.01Å; L199-L203 HydrophobicContact CD1-CD2 4.27Å; L199-L203 HydrophobicContact CD1-CG 3.76Å; L199-L203 HydrophobicContact CD2-CD1 3.85Å; L199-L203 HydrophobicContact CG-CD1 3.63Å; L199-L203 HydrophobicContact CG-CG 3.82Å; L199-L203 PolarHBondContact O-N 3.4Å; L199-A255 HydrophobicContact CD1-CB 3.67Å; L199-S282 WeakPolarHBondContact CD1-OG 3.43Å; L199-L331 HydrophobicContact CD2-CD1 3.82Å |
| 200 | V | 94.3 | Very high | 86.2 | Confident | 4 Ų | 4 | 17 Ų | 17 | 2% | 0.024 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -56.8 | -58.6 | -175.4 | 165.2 | 0 | 0 | 0 | 0 | 111.6 | L181 V196 F197 A202 L203 L204 L328 L331 | L181-V200 HydrophobicContact CD1-CG2 4.06Å; L181-V200 HydrophobicContact CD2-CG1 4.13Å; V196-V200 WeakPolarHBondContact O-CG2 3.39Å; V196-V200 PolarHBondContact O-N 2.76Å; V196-V200 VanDerWaalsContact O-N 3.14Å; F197-V200 PolarHBondContact O-N 3.07Å; V200-A202 VanDerWaalsContact C-N 3.3Å; V200-A202 PolarHBondContact O-N 2.91Å; V200-L203 PolarHBondContact O-N 3.28Å; V200-L204 HydrophobicContact CG1-CD1 3.86Å; V200-L204 HydrophobicContact CG1-CG 4.33Å; V200-L204 WeakPolarHBondContact O-CB 3.04Å; V200-L204 VanDerWaalsContact O-CG 3.26Å; V200-L204 WeakPolarHBondContact O-CG 3.34Å; V200-L204 PolarHBondContact O-N 2.89Å; V200-L328 HydrophobicContact CG1-CD1 4.04Å; V200-L331 HydrophobicContact CG2-CD2 3.75Å |
| 201 | P | 92.2 | Very high | 85.1 | Confident | 4 Ų | 4 | 17.3 Ų | 17.3 | 3% | 0.026 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -61.8 | -35.3 | 178.7 | -27.6 | 39.7 | 0 | 0 | 0 | 113.5 | F197 L204 G205 L398 D547 | F197-P201 WeakPolarHBondContact O-CD 3.22Å; P201-L204 PolarHBondContact O-N 2.74Å; P201-G205 PolarHBondContact O-N 3.42Å; P201-L398 HydrophobicContact CG-CD2 4.32Å; P201-D547 HydrophobicContact CB-CB 4.36Å |
| 202 | A | 92.2 | Very high | 84 | Confident | 2 Ų | 2 | 13.7 Ų | 13.7 | 2% | 0.017 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -63.5 | -43.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | L199 V200 L206 A255 M388 S392 | L199-A202 PolarHBondContact O-N 3.4Å; V200-A202 VanDerWaalsContact C-N 3.3Å; V200-A202 PolarHBondContact O-N 2.91Å; A202-L206 PolarHBondContact O-N 3.41Å; A202-A255 HydrophobicContact CB-CB 3.99Å; A202-M388 HydrophobicContact CB-CG 4.42Å; A202-S392 WeakPolarHBondContact CB-OG 3.43Å |
| 203 | L | 91.1 | Very high | 82.9 | Confident | 6 Ų | 6 | 11 Ų | 11 | 3% | 0.031 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -75.3 | -33.1 | 177.6 | -71 | -176.6 | 0 | 0 | 0 | 113 | L199 V200 L206 T285 A286 T327 L331 | L199-L203 HydrophobicContact CD1-CD1 4.01Å; L199-L203 HydrophobicContact CD1-CD2 4.27Å; L199-L203 HydrophobicContact CD1-CG 3.76Å; L199-L203 HydrophobicContact CD2-CD1 3.85Å; L199-L203 HydrophobicContact CG-CD1 3.63Å; L199-L203 HydrophobicContact CG-CG 3.82Å; L199-L203 PolarHBondContact O-N 3.4Å; V200-L203 PolarHBondContact O-N 3.28Å; L203-L206 VanDerWaalsContact O-CB 3.3Å; L203-L206 WeakPolarHBondContact O-CB 3.36Å; L203-T285 HydrophobicContact CD1-CG2 4.07Å; L203-A286 HydrophobicContact CD2-CB 4.15Å; L203-T327 HydrophobicContact CB-CG2 4.05Å; L203-L331 HydrophobicContact CD1-CD1 3.92Å; L203-L331 HydrophobicContact CD1-CD2 4.17Å |
| 204 | L | 89.4 | Confident | 81.9 | Confident | 20 Ų | 20 | 11.5 Ų | 11.5 | 11% | 0.105 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -69.3 | -42.5 | 173.5 | -66.4 | -174.4 | 0 | 0 | 0 | 111.2 | V200 P201 L206 K207 D324 T327 L328 | V200-L204 HydrophobicContact CG1-CD1 3.86Å; V200-L204 HydrophobicContact CG1-CG 4.33Å; V200-L204 WeakPolarHBondContact O-CB 3.04Å; V200-L204 VanDerWaalsContact O-CG 3.26Å; V200-L204 WeakPolarHBondContact O-CG 3.34Å; V200-L204 PolarHBondContact O-N 2.89Å; P201-L204 PolarHBondContact O-N 2.74Å; L204-L206 VanDerWaalsContact C-N 3.28Å; L204-L206 PolarHBondContact O-N 3.32Å; L204-K207 WeakPolarHBondContact O-CB 3.31Å; L204-K207 PolarHBondContact O-N 2.84Å; L204-K207 VanDerWaalsContact O-N 3.15Å; L204-D324 HydrophobicContact CD2-CB 3.79Å; L204-T327 HydrophobicContact CD2-CG2 4.33Å; L204-L328 HydrophobicContact CD1-CD1 4.33Å |
| 205 | G | 81.6 | Confident | 80.6 | Confident | 4 Ų | 4 | 10.8 Ų | 10.8 | 4% | 0.041 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -62.8 | -31.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | P201 K207 G208 N209 | P201-G205 PolarHBondContact O-N 3.42Å; G205-K207 PolarHBondContact O-N 2.96Å; G205-K207 VanDerWaalsContact O-N 3.09Å; G205-G208 PolarHBondContact O-N 3.5Å; G205-G208 VanDerWaalsContact O-N 3.11Å; G205-N209 PolarHBondContact O-OD1 3.25Å |
| 206 | L | 75.8 | Confident | 79.2 | Confident | 15 Ų | 15 | 12 Ų | 12 | 8% | 0.079 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -51.2 | -35.3 | 173.6 | -173.6 | 80.5 | 0 | 0 | 0 | 112.5 | A202 L203 L204 N209 L210 A248 V251 | A202-L206 PolarHBondContact O-N 3.41Å; L203-L206 VanDerWaalsContact O-CB 3.3Å; L203-L206 WeakPolarHBondContact O-CB 3.36Å; L204-L206 VanDerWaalsContact C-N 3.28Å; L204-L206 PolarHBondContact O-N 3.32Å; L206-N209 PolarHBondContact O-N 3.44Å; L206-L210 HydrophobicContact CD1-CD1 3.75Å; L206-L210 HydrophobicContact CD1-CG 4.21Å; L206-L210 HydrophobicContact CD2-CD1 4.12Å; L206-L210 HydrophobicContact CG-CD1 3.72Å; L206-L210 HydrophobicContact CG-CG 4.18Å; L206-L210 WeakPolarHBondContact O-CG 3.38Å; L206-L210 PolarHBondContact O-N 2.79Å; L206-A248 HydrophobicContact CD2-CB 3.9Å; L206-V251 HydrophobicContact CD1-CB 3.46Å; L206-V251 VanDerWaalsContact CD1-CB 3.46Å; L206-V251 HydrophobicContact CD1-CG1 3.32Å; L206-V251 HydrophobicContact CD1-CG2 4.06Å |
| 207 | K | 68.8 | Low | 77.9 | Confident | 15 Ų | 15 | 13 Ų | 13 | 7% | 0.065 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -61.2 | -50.1 | 179.6 | -177.1 | -162.5 | 169.3 | -177.1 | 0 | 112 | L204 G205 N209 L210 E211 A319 A320 D324 | L204-K207 WeakPolarHBondContact O-CB 3.31Å; L204-K207 PolarHBondContact O-N 2.84Å; L204-K207 VanDerWaalsContact O-N 3.15Å; G205-K207 PolarHBondContact O-N 2.96Å; G205-K207 VanDerWaalsContact O-N 3.09Å; K207-N209 PolarHBondContact O-N 3.17Å; K207-N209 VanDerWaalsContact O-N 3.15Å; K207-L210 PolarHBondContact O-N 2.81Å; K207-E211 HydrophobicContact CB-CG 4.43Å; K207-E211 VanDerWaalsContact CE-OE2 3.32Å; K207-E211 WeakPolarHBondContact CE-OE2 3.31Å; K207-E211 HydrophobicContact CG-CB 4.35Å; K207-E211 HydrophobicContact CG-CG 3.68Å; K207-E211 WeakPolarHBondContact CG-OE2 3.38Å; K207-E211 WeakPolarHBondContact O-CB 3.42Å; K207-E211 VanDerWaalsContact O-CG 3.28Å; K207-E211 WeakPolarHBondContact O-CG 3.48Å; K207-E211 PolarHBondContact O-N 3.01Å; K207-A319 WeakPolarHBondContact CE-O 3.35Å; K207-A319 PolarHBondContact NZ-O 2.93Å; K207-A320 VanDerWaalsContact NZ-C 3.26Å; K207-A320 VanDerWaalsContact NZ-CA 3.29Å; K207-A320 PolarHBondContact NZ-O 3.43Å; K207-D324 WeakPolarHBondContact CD-OD1 3.33Å; K207-D324 IonicContact NZ-OD1 2.73Å; K207-D324 PolarHBondContact NZ-OD1 3.35Å; K207-D324 IonicContact NZ-OD2 3.85Å |
| 208 | G | 61.5 | Low | 76.7 | Confident | 16 Ų | 16 | 12.9 Ų | 12.9 | 17% | 0.165 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -56.6 | -33.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | G205 M212 | G205-G208 PolarHBondContact O-N 3.5Å; G205-G208 VanDerWaalsContact O-N 3.11Å; G208-M212 VanDerWaalsContact O-CB 3.24Å; G208-M212 WeakPolarHBondContact O-CB 3.43Å |
| 209 | N | 67.8 | Low | 75 | Confident | 3 Ų | 3 | 13.1 Ų | 13.1 | 2% | 0.016 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -80.6 | -43.4 | -175.3 | -53.1 | -2.8 | 0 | 0 | 0 | 111.9 | G205 L206 K207 T213 A387 P540 T543 | G205-N209 PolarHBondContact O-OD1 3.25Å; L206-N209 PolarHBondContact O-N 3.44Å; K207-N209 PolarHBondContact O-N 3.17Å; K207-N209 VanDerWaalsContact O-N 3.15Å; N209-T213 WeakPolarHBondContact O-CB 3.41Å; N209-T213 PolarHBondContact O-OG1 3.02Å; N209-A387 VanDerWaalsContact ND2-CB 3.29Å; N209-A387 WeakPolarHBondContact ND2-CB 3.43Å; N209-P540 HydrophobicContact CB-CB 4.12Å; N209-P540 HydrophobicContact CB-CG 4.06Å; N209-P540 WeakPolarHBondContact OD1-CA 3.37Å; N209-P540 WeakPolarHBondContact OD1-CB 3.48Å; N209-T543 PolarHBondContact OD1-OG1 3.24Å |
| 210 | L | 71.1 | Confident | 73.6 | Confident | 7 Ų | 7 | 15 Ų | 15 | 4% | 0.037 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -95.6 | -35 | -171.7 | -58.6 | -172.1 | 0 | 0 | 0 | 113.4 | L206 K207 L214 K244 Q247 A248 V384 | L206-L210 HydrophobicContact CD1-CD1 3.75Å; L206-L210 HydrophobicContact CD1-CG 4.21Å; L206-L210 HydrophobicContact CD2-CD1 4.12Å; L206-L210 HydrophobicContact CG-CD1 3.72Å; L206-L210 HydrophobicContact CG-CG 4.18Å; L206-L210 WeakPolarHBondContact O-CG 3.38Å; L206-L210 PolarHBondContact O-N 2.79Å; K207-L210 PolarHBondContact O-N 2.81Å; L210-L214 VanDerWaalsContact O-CB 3.31Å; L210-L214 WeakPolarHBondContact O-CB 3.48Å; L210-L214 PolarHBondContact O-N 3.49Å; L210-K244 HydrophobicContact CB-CG 4.23Å; L210-K244 HydrophobicContact CD1-CG 4.49Å; L210-Q247 HydrophobicContact CD1-CB 3.84Å; L210-Q247 HydrophobicContact CD2-CB 3.66Å; L210-Q247 HydrophobicContact CD2-CG 4.3Å; L210-Q247 VanDerWaalsContact CD2-OE1 3.32Å; L210-Q247 HydrophobicContact CG-CB 4.44Å; L210-A248 HydrophobicContact CD1-CB 3.93Å; L210-V384 HydrophobicContact CD2-CG1 4.26Å; L210-V384 HydrophobicContact CD2-CG2 4.26Å |
| 211 | E | 71 | Confident | 72.1 | Confident | 9 Ų | 9 | 14.9 Ų | 14.9 | 4% | 0.042 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -76 | -41.7 | -178.1 | -58 | -155.5 | 139.6 | 0 | 0 | 112.2 | K207 T213 L214 A215 K244 Q293 | K207-E211 HydrophobicContact CB-CG 4.43Å; K207-E211 VanDerWaalsContact CE-OE2 3.32Å; K207-E211 WeakPolarHBondContact CE-OE2 3.31Å; K207-E211 HydrophobicContact CG-CB 4.35Å; K207-E211 HydrophobicContact CG-CG 3.68Å; K207-E211 WeakPolarHBondContact CG-OE2 3.38Å; K207-E211 WeakPolarHBondContact O-CB 3.42Å; K207-E211 VanDerWaalsContact O-CG 3.28Å; K207-E211 WeakPolarHBondContact O-CG 3.48Å; K207-E211 PolarHBondContact O-N 3.01Å; E211-T213 VanDerWaalsContact C-N 3.32Å; E211-L214 PolarHBondContact O-N 3.37Å; E211-A215 VanDerWaalsContact O-CB 3.26Å; E211-A215 WeakPolarHBondContact O-CB 3.33Å; E211-A215 PolarHBondContact O-N 2.86Å; E211-K244 IonicContact OE1-NZ 3.98Å; E211-K244 PolarHBondContact OE1-NZ 3.28Å; E211-Q293 WeakPolarHBondContact OE1-CB 3.24Å; E211-Q293 VanDerWaalsContact OE1-CD 3.26Å; E211-Q293 PolarHBondContact OE1-OE1 2.97Å; E211-Q293 VanDerWaalsContact OE1-OE1 3.05Å |
| 212 | M | 66.3 | Low | 70.7 | Confident | 45 Ų | 45 | 15.8 Ų | 15.8 | 22% | 0.222 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.5 | -41.3 | 178.9 | -166.9 | 161.2 | -61.7 | 0 | 0 | 110.9 | G208 A215 S216 A426 I539 | G208-M212 VanDerWaalsContact O-CB 3.24Å; G208-M212 WeakPolarHBondContact O-CB 3.43Å; M212-A215 PolarHBondContact O-N 2.72Å; M212-S216 WeakPolarHBondContact O-CB 3.08Å; M212-S216 PolarHBondContact O-N 3.27Å; M212-A426 HydrophobicContact CE-CB 3.51Å; M212-A426 HydrophobicContact SD-CB 3.91Å; M212-I539 HydrophobicContact CE-CG2 4.46Å; M212-I539 HydrophobicContact CG-CD1 4.15Å; M212-I539 HydrophobicContact SD-CB 4.42Å; M212-I539 HydrophobicContact SD-CD1 3.31Å; M212-I539 WeakPolarHBondContact SD-CD1 3.39Å; M212-I539 HydrophobicContact SD-CG1 4.11Å; M212-I539 HydrophobicContact SD-CG2 3.62Å |
| 213 | T | 67.4 | Low | 69.1 | Low | 24 Ų | 24 | 19.7 Ų | 19.7 | 15% | 0.147 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -63.2 | -44.5 | 174.8 | -55.5 | 0 | 0 | 0 | 0 | 111.7 | N209 E211 R217 | N209-T213 WeakPolarHBondContact O-CB 3.41Å; N209-T213 PolarHBondContact O-OG1 3.02Å; E211-T213 VanDerWaalsContact C-N 3.32Å; T213-R217 VanDerWaalsContact O-CG 3.31Å; T213-R217 WeakPolarHBondContact O-CG 3.48Å; T213-R217 PolarHBondContact O-N 2.99Å; T213-R217 VanDerWaalsContact O-N 3.08Å |
| 214 | L | 70.4 | Confident | 67.5 | Low | 11 Ų | 11 | 22.7 Ų | 22.7 | 6% | 0.058 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -61 | -46.5 | 174.2 | 174.6 | 68 | 0 | 0 | 0 | 111.7 | L210 E211 R217 L218 N240 K244 | L210-L214 VanDerWaalsContact O-CB 3.31Å; L210-L214 WeakPolarHBondContact O-CB 3.48Å; L210-L214 PolarHBondContact O-N 3.49Å; E211-L214 PolarHBondContact O-N 3.37Å; L214-R217 PolarHBondContact O-N 2.93Å; L214-L218 VanDerWaalsContact O-CB 3.31Å; L214-L218 WeakPolarHBondContact O-CB 3.28Å; L214-L218 PolarHBondContact O-N 3.47Å; L214-N240 HydrophobicContact CD1-CB 3.46Å; L214-N240 VanDerWaalsContact CD1-CB 3.46Å; L214-K244 HydrophobicContact CD2-CD 3.88Å |
| 215 | A | 64.2 | Low | 65.9 | Low | 10 Ų | 10 | 23.2 Ų | 23.2 | 8% | 0.083 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63 | -47 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111 | E211 M212 R217 L218 S219 M297 | E211-A215 VanDerWaalsContact O-CB 3.26Å; E211-A215 WeakPolarHBondContact O-CB 3.33Å; E211-A215 PolarHBondContact O-N 2.86Å; M212-A215 PolarHBondContact O-N 2.72Å; A215-R217 PolarHBondContact O-N 3.12Å; A215-L218 PolarHBondContact O-N 3.13Å; A215-S219 VanDerWaalsContact O-CB 3.22Å; A215-S219 WeakPolarHBondContact O-CB 3.45Å; A215-S219 PolarHBondContact O-N 3.1Å; A215-M297 HydrophobicContact CB-CE 3.97Å |
| 216 | S | 62.9 | Low | 64.5 | Low | 49 Ų | 49 | 25.7 Ų | 25.7 | 34% | 0.343 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -58 | -48.3 | 176.9 | 178.1 | 0 | 0 | 0 | 0 | 111.8 | M212 L218 S219 T220 | M212-S216 WeakPolarHBondContact O-CB 3.08Å; M212-S216 PolarHBondContact O-N 3.27Å; S216-L218 PolarHBondContact O-N 2.97Å; S216-S219 PolarHBondContact O-N 3.09Å; S216-T220 VanDerWaalsContact O-CB 3.31Å; S216-T220 WeakPolarHBondContact O-CB 3.46Å; S216-T220 PolarHBondContact O-N 3.48Å; S216-T220 PolarHBondContact O-OG1 3.07Å |
| 217 | R | 67.6 | Low | 63.5 | Low | 22 Ų | 22 | 25.5 Ų | 25.5 | 8% | 0.083 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.3 | -43.6 | 179 | -71.9 | 178 | -172.1 | 156.5 | 10.9 | 112.8 | E125 T213 L214 A215 A221 N240 | E125-R217 IonicContact OE1-NH2 2.91Å; E125-R217 PolarHBondContact OE1-NH2 3.27Å; E125-R217 IonicContact OE2-CZ 3.22Å; E125-R217 IonicContact OE2-NE 3.07Å; E125-R217 PolarHBondContact OE2-NE 3.25Å; E125-R217 IonicContact OE2-NH2 2.95Å; E125-R217 PolarHBondContact OE2-NH2 2.89Å; T213-R217 VanDerWaalsContact O-CG 3.31Å; T213-R217 WeakPolarHBondContact O-CG 3.48Å; T213-R217 PolarHBondContact O-N 2.99Å; T213-R217 VanDerWaalsContact O-N 3.08Å; L214-R217 PolarHBondContact O-N 2.93Å; A215-R217 PolarHBondContact O-N 3.12Å; R217-A221 WeakPolarHBondContact O-CB 3.3Å; R217-A221 PolarHBondContact O-N 3.48Å; R217-N240 WeakPolarHBondContact CD-OD1 3.38Å |
| 218 | L | 67.1 | Low | 63 | Low | 4 Ų | 4 | 31.6 Ų | 31.6 | 2% | 0.021 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -70.8 | -38.8 | -178.7 | -170.3 | 54.2 | 0 | 0 | 0 | 110.9 | L214 A215 S216 A221 V222 M227 L236 I237 I301 | L214-L218 VanDerWaalsContact O-CB 3.31Å; L214-L218 WeakPolarHBondContact O-CB 3.28Å; L214-L218 PolarHBondContact O-N 3.47Å; A215-L218 PolarHBondContact O-N 3.13Å; S216-L218 PolarHBondContact O-N 2.97Å; L218-A221 PolarHBondContact O-N 3.39Å; L218-V222 WeakPolarHBondContact O-CG2 3.35Å; L218-V222 PolarHBondContact O-N 3.28Å; L218-M227 HydrophobicContact CD1-CE 3.52Å; L218-M227 HydrophobicContact CG-CE 4.36Å; L218-L236 HydrophobicContact CD1-CD2 3.69Å; L218-I237 HydrophobicContact CD1-CD1 4.31Å; L218-I237 HydrophobicContact CD1-CG1 3.63Å; L218-I237 HydrophobicContact CD2-CG1 4.25Å; L218-I301 HydrophobicContact CB-CD1 4.36Å; L218-I301 HydrophobicContact CD2-CB 4.47Å; L218-I301 HydrophobicContact CD2-CD1 3.43Å; L218-I301 VanDerWaalsContact CD2-CD1 3.43Å; L218-I301 HydrophobicContact CD2-CG2 4.17Å; L218-I301 HydrophobicContact CG-CD1 4.04Å; L218-I301 HydrophobicContact CG-CG2 4.27Å |
| 219 | S | 59.6 | Low | 63.3 | Low | 6 Ų | 6 | 32.8 Ų | 32.8 | 4% | 0.042 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.9 | -46.4 | 174.6 | -178 | 0 | 0 | 0 | 0 | 112.3 | A215 S216 A221 V222 N223 D312 | A215-S219 VanDerWaalsContact O-CB 3.22Å; A215-S219 WeakPolarHBondContact O-CB 3.45Å; A215-S219 PolarHBondContact O-N 3.1Å; S216-S219 PolarHBondContact O-N 3.09Å; S219-A221 VanDerWaalsContact C-N 3.29Å; S219-A221 PolarHBondContact O-N 3.26Å; S219-V222 WeakPolarHBondContact O-CB 3.38Å; S219-V222 PolarHBondContact O-N 3.31Å; S219-N223 WeakPolarHBondContact O-CB 3.49Å; S219-N223 VanDerWaalsContact O-CG 3.29Å; S219-N223 PolarHBondContact O-N 3.3Å; S219-N223 PolarHBondContact O-ND2 3.4Å; S219-N223 PolarHBondContact OG-ND2 3.04Å; S219-D312 WeakPolarHBondContact CB-OD1 3.49Å; S219-D312 WeakPolarHBondContact CB-OD2 3.35Å; S219-D312 PolarHBondContact OG-OD1 3.04Å; S219-D312 PolarHBondContact OG-OD2 3.4Å |
| 220 | T | 62.6 | Low | 63.5 | Low | 38 Ų | 38 | 36.6 Ų | 36.6 | 23% | 0.233 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -58 | -43.6 | 176.5 | -59.5 | 0 | 0 | 0 | 0 | 110.9 | S216 V222 N223 I224 | S216-T220 VanDerWaalsContact O-CB 3.31Å; S216-T220 WeakPolarHBondContact O-CB 3.46Å; S216-T220 PolarHBondContact O-N 3.48Å; S216-T220 PolarHBondContact O-OG1 3.07Å; T220-V222 PolarHBondContact O-N 3.4Å; T220-N223 PolarHBondContact O-N 3.16Å; T220-I224 HydrophobicContact CG2-CD1 3.5Å; T220-I224 HydrophobicContact CG2-CG1 4.33Å; T220-I224 WeakPolarHBondContact O-CB 3.46Å; T220-I224 VanDerWaalsContact O-CG1 3.24Å; T220-I224 WeakPolarHBondContact O-CG1 3.37Å; T220-I224 PolarHBondContact O-N 3.41Å |
| 221 | A | 63.3 | Low | 63.7 | Low | 2 Ų | 2 | 41.6 Ų | 41.6 | 2% | 0.017 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64 | -37.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | M129 R217 L218 S219 L236 | M129-A221 HydrophobicContact CE-CB 4.01Å; R217-A221 WeakPolarHBondContact O-CB 3.3Å; R217-A221 PolarHBondContact O-N 3.48Å; L218-A221 PolarHBondContact O-N 3.39Å; S219-A221 VanDerWaalsContact C-N 3.29Å; S219-A221 PolarHBondContact O-N 3.26Å; A221-L236 HydrophobicContact CB-CD1 3.59Å; A221-L236 HydrophobicContact CB-CD2 4.03Å; A221-L236 HydrophobicContact CB-CG 4.5Å |
| 222 | V | 62.4 | Low | 63.9 | Low | 24 Ų | 24 | 46.7 Ų | 46.7 | 15% | 0.145 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.1 | -46.9 | 174.3 | 177.7 | 0 | 0 | 0 | 0 | 110.3 | L218 S219 T220 G225 M227 I301 | L218-V222 WeakPolarHBondContact O-CG2 3.35Å; L218-V222 PolarHBondContact O-N 3.28Å; S219-V222 WeakPolarHBondContact O-CB 3.38Å; S219-V222 PolarHBondContact O-N 3.31Å; T220-V222 PolarHBondContact O-N 3.4Å; V222-G225 PolarHBondContact O-N 3.18Å; V222-M227 HydrophobicContact CB-CE 4.32Å; V222-M227 HydrophobicContact CB-SD 3.97Å; V222-M227 HydrophobicContact CG1-SD 4.26Å; V222-M227 HydrophobicContact CG2-CE 3.23Å; V222-M227 HydrophobicContact CG2-CG 4.47Å; V222-M227 HydrophobicContact CG2-SD 3.35Å; V222-M227 WeakPolarHBondContact CG2-SD 3.26Å; V222-I301 HydrophobicContact CG2-CG2 4.32Å |
| 223 | N | 58.3 | Low | 64.4 | Low | 83 Ų | 83 | 46.1 Ų | 46.1 | 44% | 0.444 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -76 | -30.2 | -170.3 | -69.7 | -23.9 | 0 | 0 | 0 | 113.4 | S219 T220 G225 | S219-N223 WeakPolarHBondContact O-CB 3.49Å; S219-N223 VanDerWaalsContact O-CG 3.29Å; S219-N223 PolarHBondContact O-N 3.3Å; S219-N223 PolarHBondContact O-ND2 3.4Å; S219-N223 PolarHBondContact OG-ND2 3.04Å; T220-N223 PolarHBondContact O-N 3.16Å; N223-G225 PolarHBondContact O-N 2.73Å |
| 224 | I | 57.6 | Low | 65 | Low | 69 Ų | 69 | 51.7 Ų | 51.7 | 35% | 0.354 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | -12.6 | 176.6 | -66.8 | 172 | 0 | 0 | 0 | 111.8 | L130 T220 K226 | L130-I224 HydrophobicContact CD2-CD1 3.94Å; T220-I224 HydrophobicContact CG2-CD1 3.5Å; T220-I224 HydrophobicContact CG2-CG1 4.33Å; T220-I224 WeakPolarHBondContact O-CB 3.46Å; T220-I224 VanDerWaalsContact O-CG1 3.24Å; T220-I224 WeakPolarHBondContact O-CG1 3.37Å; T220-I224 PolarHBondContact O-N 3.41Å; I224-K226 VanDerWaalsContact C-N 3.3Å; I224-K226 HydrophobicContact CG2-CG 4.15Å |
| 225 | G | 55.5 | Low | 65.6 | Low | 32 Ų | 32 | 55.5 Ų | 55.5 | 33% | 0.33 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 82.1 | 4.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | V222 N223 M227 D228 | V222-G225 PolarHBondContact O-N 3.18Å; N223-G225 PolarHBondContact O-N 2.73Å; G225-M227 PolarHBondContact O-N 3.05Å; G225-D228 PolarHBondContact O-N 3.05Å |
| 226 | K | 52.8 | Low | 66.5 | Low | 56 Ų | 56 | 55.8 Ų | 55.8 | 24% | 0.243 | 30% | 0.298 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | 12 | 167.1 | -74.5 | -165.6 | 172.2 | -171.7 | 0 | 113.5 | M129 E132 I224 | M129-K226 PolarHBondContact O-NZ 3.16Å; E132-K226 IonicContact OE2-NZ 3.58Å; E132-K226 PolarHBondContact OE2-NZ 3.26Å; E132-K226 VanDerWaalsContact OE2-NZ 3.07Å; I224-K226 VanDerWaalsContact C-N 3.3Å; I224-K226 HydrophobicContact CG2-CG 4.15Å |
| 227 | M | 55.3 | Low | 67.5 | Low | 11 Ų | 11 | 53.8 Ų | 53.8 | 5% | 0.054 | 28% | 0.283 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.8 | 9.7 | -177.2 | -94.3 | -150 | 177.9 | 0 | 0 | 114.2 | L218 V222 G225 K233 | L218-M227 HydrophobicContact CD1-CE 3.52Å; L218-M227 HydrophobicContact CG-CE 4.36Å; V222-M227 HydrophobicContact CB-CE 4.32Å; V222-M227 HydrophobicContact CB-SD 3.97Å; V222-M227 HydrophobicContact CG1-SD 4.26Å; V222-M227 HydrophobicContact CG2-CE 3.23Å; V222-M227 HydrophobicContact CG2-CG 4.47Å; V222-M227 HydrophobicContact CG2-SD 3.35Å; V222-M227 WeakPolarHBondContact CG2-SD 3.26Å; G225-M227 PolarHBondContact O-N 3.05Å; M227-K233 HydrophobicContact CE-CD 4.08Å; M227-K233 HydrophobicContact CE-CG 3.94Å; M227-K233 HydrophobicContact CG-CB 4.38Å; M227-K233 HydrophobicContact CG-CD 4.19Å; M227-K233 HydrophobicContact CG-CG 4.18Å; M227-K233 HydrophobicContact SD-CD 3.77Å; M227-K233 HydrophobicContact SD-CG 4.14Å |
| 228 | D | 57.5 | Low | 68.5 | Low | 142 Ų | 142 | 56.6 Ų | 56.6 | 76% | 0.759 | 30% | 0.299 | S | S | * | . | S | Bend | trans | -77 | -27.1 | 179.6 | -69.5 | -19.3 | 0 | 0 | 0 | 112.2 | G225 | G225-D228 PolarHBondContact O-N 3.05Š|
| 229 | S | 68.7 | Low | 69.5 | Low | 41 Ų | 41 | 56.5 Ų | 56.5 | 29% | 0.287 | 30% | 0.299 | S | S | . | . | S | Bend | trans | -88.6 | 121.2 | 169.9 | 178.2 | 0 | 0 | 0 | 0 | 111.4 | I231 E232 K233 | S229-I231 PolarHBondContact O-N 3.38Å; S229-E232 PolarHBondContact O-N 3.07Å; S229-K233 WeakPolarHBondContact O-CB 3.42Å; S229-K233 PolarHBondContact O-N 3.32Å; S229-K233 VanDerWaalsContact O-N 3.14Å |
| 230 | P | 71 | Confident | 70.7 | Confident | 84 Ų | 84 | 56.5 Ų | 56.5 | 55% | 0.545 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -64.8 | -28.5 | 179.1 | 23.5 | -30.6 | 0 | 0 | 0 | 112.7 | W234 | P230-W234 PolarHBondContact O-N 3.13Å |
| 231 | I | 76.6 | Confident | 72 | Confident | 111 Ų | 111 | 56.3 Ų | 56.3 | 57% | 0.569 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -69.7 | -49.4 | 178.2 | -79.2 | 94 | 0 | 0 | 0 | 111 | S229 K233 W234 N235 | S229-I231 PolarHBondContact O-N 3.38Å; I231-K233 VanDerWaalsContact C-N 3.3Å; I231-K233 PolarHBondContact O-N 3.16Å; I231-W234 PolarHBondContact O-N 3.37Å; I231-N235 WeakPolarHBondContact O-CB 3.29Å; I231-N235 VanDerWaalsContact O-CG 3.24Å; I231-N235 PolarHBondContact O-N 2.83Å; I231-N235 PolarHBondContact O-ND2 2.94Å |
| 232 | E | 75 | Confident | 73.3 | Confident | 116 Ų | 116 | 56.8 Ų | 56.8 | 54% | 0.542 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | -179.4 | -72.4 | 170.4 | -174 | 0 | 0 | 111.2 | S229 W234 N235 L236 | S229-E232 PolarHBondContact O-N 3.07Å; E232-W234 PolarHBondContact O-N 3.29Å; E232-N235 PolarHBondContact O-N 3.46Å; E232-L236 WeakPolarHBondContact O-CB 3.37Å; E232-L236 PolarHBondContact O-N 3.31Å |
| 233 | K | 76 | Confident | 74.6 | Confident | 33 Ų | 33 | 55.7 Ų | 55.7 | 14% | 0.143 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -55.3 | -51.5 | 173.2 | 175.8 | 173.7 | 179.9 | -175.8 | 0 | 112.3 | M227 S229 I231 L236 I237 | M227-K233 HydrophobicContact CE-CD 4.08Å; M227-K233 HydrophobicContact CE-CG 3.94Å; M227-K233 HydrophobicContact CG-CB 4.38Å; M227-K233 HydrophobicContact CG-CD 4.19Å; M227-K233 HydrophobicContact CG-CG 4.18Å; M227-K233 HydrophobicContact SD-CD 3.77Å; M227-K233 HydrophobicContact SD-CG 4.14Å; S229-K233 WeakPolarHBondContact O-CB 3.42Å; S229-K233 PolarHBondContact O-N 3.32Å; S229-K233 VanDerWaalsContact O-N 3.14Å; I231-K233 VanDerWaalsContact C-N 3.3Å; I231-K233 PolarHBondContact O-N 3.16Å; K233-L236 PolarHBondContact O-N 2.82Å; K233-I237 HydrophobicContact CG-CD1 3.89Å; K233-I237 VanDerWaalsContact O-CG1 3.28Å; K233-I237 WeakPolarHBondContact O-CG1 3.4Å; K233-I237 PolarHBondContact O-N 3.48Å |
| 234 | W | 81.5 | Confident | 76.1 | Confident | 141 Ų | 141 | 52 Ų | 52 | 53% | 0.534 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -69 | -35.8 | -179.4 | -82.1 | 111.7 | 0 | 0 | 0 | 112 | P230 I231 E232 L236 I237 I238 | P230-W234 PolarHBondContact O-N 3.13Å; I231-W234 PolarHBondContact O-N 3.37Å; E232-W234 PolarHBondContact O-N 3.29Å; W234-L236 PolarHBondContact O-N 2.94Å; W234-I237 PolarHBondContact O-N 3.16Å; W234-I238 HydrophobicContact CB-CD1 4.5Å; W234-I238 VanDerWaalsContact O-CB 3.29Å; W234-I238 WeakPolarHBondContact O-CB 3.22Å; W234-I238 WeakPolarHBondContact O-CD1 3.31Å; W234-I238 WeakPolarHBondContact O-CG1 3.34Å; W234-I238 PolarHBondContact O-N 3.24Å |
| 235 | N | 83.1 | Confident | 77.7 | Confident | 92 Ų | 92 | 49.4 Ų | 49.4 | 49% | 0.492 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.4 | -42.7 | 175 | -72.7 | -14.4 | 0 | 0 | 0 | 111.9 | I231 E232 G239 | I231-N235 WeakPolarHBondContact O-CB 3.29Å; I231-N235 VanDerWaalsContact O-CG 3.24Å; I231-N235 PolarHBondContact O-N 2.83Å; I231-N235 PolarHBondContact O-ND2 2.94Å; E232-N235 PolarHBondContact O-N 3.46Å; N235-G239 PolarHBondContact O-N 3.18Å |
| 236 | L | 81.8 | Confident | 79.5 | Confident | 15 Ų | 15 | 48 Ų | 48 | 8% | 0.079 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.5 | -44.3 | 176.3 | -174.9 | 148.9 | 0 | 0 | 0 | 111.8 | M129 L218 A221 E232 K233 W234 N240 | M129-L236 HydrophobicContact CE-CD1 4.14Å; L218-L236 HydrophobicContact CD1-CD2 3.69Å; A221-L236 HydrophobicContact CB-CD1 3.59Å; A221-L236 HydrophobicContact CB-CD2 4.03Å; A221-L236 HydrophobicContact CB-CG 4.5Å; E232-L236 WeakPolarHBondContact O-CB 3.37Å; E232-L236 PolarHBondContact O-N 3.31Å; K233-L236 PolarHBondContact O-N 2.82Å; W234-L236 PolarHBondContact O-N 2.94Å; L236-N240 WeakPolarHBondContact O-CB 3.19Å; L236-N240 PolarHBondContact O-N 3.36Å; L236-N240 PolarHBondContact O-ND2 2.99Å |
| 237 | I | 83.7 | Confident | 81.4 | Confident | 7 Ų | 7 | 45.7 Ų | 45.7 | 4% | 0.036 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.4 | -48.4 | 177.5 | -70 | 167.5 | 0 | 0 | 0 | 110.6 | L218 K233 W234 G239 N240 L241 V298 | L218-I237 HydrophobicContact CD1-CD1 4.31Å; L218-I237 HydrophobicContact CD1-CG1 3.63Å; L218-I237 HydrophobicContact CD2-CG1 4.25Å; K233-I237 HydrophobicContact CG-CD1 3.89Å; K233-I237 VanDerWaalsContact O-CG1 3.28Å; K233-I237 WeakPolarHBondContact O-CG1 3.4Å; K233-I237 PolarHBondContact O-N 3.48Å; W234-I237 PolarHBondContact O-N 3.16Å; I237-G239 PolarHBondContact O-N 2.95Å; I237-N240 PolarHBondContact O-N 3.28Å; I237-L241 VanDerWaalsContact O-CB 3.28Å; I237-L241 WeakPolarHBondContact O-CB 3.34Å; I237-L241 PolarHBondContact O-N 3Å; I237-V298 HydrophobicContact CD1-CG1 4.39Å; I237-V298 HydrophobicContact CG2-CG1 4.15Å; I237-V298 HydrophobicContact CG2-CG2 3.67Å |
| 238 | I | 88.8 | Confident | 83.2 | Confident | 81 Ų | 81 | 45.2 Ų | 45.2 | 42% | 0.415 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -63.4 | -43.8 | -179.3 | -69.7 | 165.2 | 0 | 0 | 0 | 110.4 | W234 L241 A242 I366 | W234-I238 HydrophobicContact CB-CD1 4.5Å; W234-I238 VanDerWaalsContact O-CB 3.29Å; W234-I238 WeakPolarHBondContact O-CB 3.22Å; W234-I238 WeakPolarHBondContact O-CD1 3.31Å; W234-I238 WeakPolarHBondContact O-CG1 3.34Å; W234-I238 PolarHBondContact O-N 3.24Å; I238-L241 PolarHBondContact O-N 2.87Å; I238-A242 VanDerWaalsContact O-CB 3.26Å; I238-A242 WeakPolarHBondContact O-CB 3.11Å; I238-A242 PolarHBondContact O-N 3.39Å; I238-I366 HydrophobicContact CG2-CG2 3.7Å |
| 239 | G | 87.9 | Confident | 85 | Confident | 2 Ų | 2 | 38.5 Ų | 38.5 | 2% | 0.021 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.9 | -47.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | N235 I237 A242 L243 | N235-G239 PolarHBondContact O-N 3.18Å; I237-G239 PolarHBondContact O-N 2.95Å; G239-A242 PolarHBondContact O-N 3.4Å; G239-L243 WeakPolarHBondContact O-CB 3.29Å; G239-L243 PolarHBondContact O-N 3.25Å |
| 240 | N | 86.3 | Confident | 86.2 | Confident | 7 Ų | 7 | 38.6 Ų | 38.6 | 4% | 0.037 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -71.1 | -34.7 | -179.7 | -79.2 | -81.3 | 0 | 0 | 0 | 112.7 | L214 R217 L236 I237 L243 K244 T373 | L214-N240 HydrophobicContact CD1-CB 3.46Å; L214-N240 VanDerWaalsContact CD1-CB 3.46Å; R217-N240 WeakPolarHBondContact CD-OD1 3.38Å; L236-N240 WeakPolarHBondContact O-CB 3.19Å; L236-N240 PolarHBondContact O-N 3.36Å; L236-N240 PolarHBondContact O-ND2 2.99Å; I237-N240 PolarHBondContact O-N 3.28Å; N240-L243 PolarHBondContact O-N 2.87Å; N240-K244 WeakPolarHBondContact O-CB 3.42Å; N240-K244 PolarHBondContact O-N 2.98Å; N240-T373 HydrophobicContact CB-CG2 4.37Å |
| 241 | L | 88.4 | Confident | 87.2 | Confident | 34 Ų | 34 | 34.7 Ų | 34.7 | 18% | 0.178 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -67.6 | -39.8 | 174.2 | -173.9 | 61.9 | 0 | 0 | 0 | 111.2 | I237 I238 K244 Q245 | I237-L241 VanDerWaalsContact O-CB 3.28Å; I237-L241 WeakPolarHBondContact O-CB 3.34Å; I237-L241 PolarHBondContact O-N 3Å; I238-L241 PolarHBondContact O-N 2.87Å; L241-K244 PolarHBondContact O-N 2.89Å; L241-Q245 WeakPolarHBondContact O-CB 3.18Å; L241-Q245 VanDerWaalsContact O-CG 3.3Å; L241-Q245 WeakPolarHBondContact O-CG 3.24Å; L241-Q245 PolarHBondContact O-N 3.06Å |
| 242 | A | 91.9 | Very high | 88.1 | Confident | 11 Ų | 11 | 29.4 Ų | 29.4 | 9% | 0.091 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.9 | -41.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I238 G239 Q245 V246 I366 A367 | I238-A242 VanDerWaalsContact O-CB 3.26Å; I238-A242 WeakPolarHBondContact O-CB 3.11Å; I238-A242 PolarHBondContact O-N 3.39Å; G239-A242 PolarHBondContact O-N 3.4Å; A242-Q245 WeakPolarHBondContact O-CB 3.2Å; A242-Q245 PolarHBondContact O-N 3.2Å; A242-V246 WeakPolarHBondContact O-CG2 3.29Å; A242-V246 PolarHBondContact O-N 3.17Å; A242-I366 HydrophobicContact CB-CB 3.86Å; A242-I366 HydrophobicContact CB-CG2 3.57Å; A242-A367 HydrophobicContact CB-CB 4.2Å |
| 243 | L | 89.3 | Confident | 89.1 | Confident | 1 Ų | 1 | 27.6 Ų | 27.6 | 1% | 0.005 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62.6 | -47.9 | 174.3 | 178.5 | 64.8 | 0 | 0 | 0 | 111.7 | G239 N240 Q245 V246 Q247 A367 T373 V376 L377 | G239-L243 WeakPolarHBondContact O-CB 3.29Å; G239-L243 PolarHBondContact O-N 3.25Å; N240-L243 PolarHBondContact O-N 2.87Å; L243-Q245 PolarHBondContact O-N 3.01Å; L243-V246 PolarHBondContact O-N 3.26Å; L243-Q247 HydrophobicContact CD1-CG 4.29Å; L243-Q247 WeakPolarHBondContact O-CG 3.48Å; L243-Q247 PolarHBondContact O-N 3.33Å; L243-A367 HydrophobicContact CB-CB 4.04Å; L243-T373 HydrophobicContact CB-CG2 4.37Å; L243-T373 HydrophobicContact CD2-CG2 3.99Å; L243-V376 HydrophobicContact CD2-CB 3.77Å; L243-V376 HydrophobicContact CD2-CG1 3.77Å; L243-V376 HydrophobicContact CD2-CG2 4.37Å; L243-L377 HydrophobicContact CD1-CB 4.01Å; L243-L377 HydrophobicContact CD1-CD1 3.8Å |
| 244 | K | 89 | Confident | 90.1 | Very high | 6 Ų | 6 | 28.7 Ų | 28.7 | 3% | 0.026 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -53.9 | -42.4 | 174.2 | 179.7 | 177.1 | -177 | -168 | 0 | 110.5 | L210 E211 L214 N240 L241 A248 | L210-K244 HydrophobicContact CB-CG 4.23Å; L210-K244 HydrophobicContact CD1-CG 4.49Å; E211-K244 IonicContact OE1-NZ 3.98Å; E211-K244 PolarHBondContact OE1-NZ 3.28Å; L214-K244 HydrophobicContact CD2-CD 3.88Å; N240-K244 WeakPolarHBondContact O-CB 3.42Å; N240-K244 PolarHBondContact O-N 2.98Å; L241-K244 PolarHBondContact O-N 2.89Å; K244-A248 WeakPolarHBondContact O-CB 3.14Å; K244-A248 PolarHBondContact O-N 3.08Å |
| 245 | Q | 92.6 | Very high | 90.8 | Very high | 15 Ų | 15 | 22 Ų | 22 | 7% | 0.07 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -65.5 | -44.4 | 179.2 | -80 | -66 | 5.3 | 0 | 0 | 113.8 | L241 A242 L243 A248 T249 F287 S290 L291 | L241-Q245 WeakPolarHBondContact O-CB 3.18Å; L241-Q245 VanDerWaalsContact O-CG 3.3Å; L241-Q245 WeakPolarHBondContact O-CG 3.24Å; L241-Q245 PolarHBondContact O-N 3.06Å; A242-Q245 WeakPolarHBondContact O-CB 3.2Å; A242-Q245 PolarHBondContact O-N 3.2Å; L243-Q245 PolarHBondContact O-N 3.01Å; Q245-A248 PolarHBondContact O-N 3.46Å; Q245-T249 WeakPolarHBondContact O-CB 3.25Å; Q245-T249 PolarHBondContact O-N 3.47Å; Q245-T249 PolarHBondContact O-OG1 3.04Å; Q245-F287 PolarHBondContact NE2-O 2.91Å; Q245-F287 VanDerWaalsContact NE2-O 3.13Å; Q245-F287 PolarHBondContact OE1-O 3.21Å; Q245-S290 PolarHBondContact NE2-OG 2.92Å; Q245-S290 PolarHBondContact OE1-OG 2.98Å; Q245-L291 VanDerWaalsContact NE2-N 3.17Å |
| 246 | V | 93.1 | Very high | 91.4 | Very high | 1 Ų | 1 | 17.6 Ų | 17.6 | 1% | 0.006 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.5 | -49 | 176.6 | 170.8 | 0 | 0 | 0 | 0 | 110.2 | A242 L243 T249 V250 T360 I364 L377 W381 | A242-V246 WeakPolarHBondContact O-CG2 3.29Å; A242-V246 PolarHBondContact O-N 3.17Å; L243-V246 PolarHBondContact O-N 3.26Å; V246-T249 PolarHBondContact O-N 3.06Å; V246-V250 WeakPolarHBondContact O-CB 3.31Å; V246-V250 WeakPolarHBondContact O-CG2 3.43Å; V246-V250 PolarHBondContact O-N 3.34Å; V246-T360 HydrophobicContact CG1-CG2 4.13Å; V246-T360 HydrophobicContact CG2-CG2 4.37Å; V246-I364 HydrophobicContact CB-CG1 4.45Å; V246-I364 HydrophobicContact CG1-CD1 4.36Å; V246-I364 HydrophobicContact CG1-CG1 3.72Å; V246-I364 HydrophobicContact CG2-CG1 3.79Å; V246-I364 VanDerWaalsContact CG2-N 3.33Å; V246-L377 HydrophobicContact CG1-CD1 4.06Å; V246-W381 HydrophobicContact CG1-CH2 4.1Å; V246-W381 HydrophobicContact CG1-CZ2 4.32Å |
| 247 | Q | 91.9 | Very high | 92 | Very high | 9 Ų | 9 | 19.4 Ų | 19.4 | 4% | 0.042 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -62.7 | -45.3 | 179.3 | -69.7 | 179.3 | -53.1 | 0 | 0 | 111.3 | L210 L243 T249 V250 V251 W381 | L210-Q247 HydrophobicContact CD1-CB 3.84Å; L210-Q247 HydrophobicContact CD2-CB 3.66Å; L210-Q247 HydrophobicContact CD2-CG 4.3Å; L210-Q247 VanDerWaalsContact CD2-OE1 3.32Å; L210-Q247 HydrophobicContact CG-CB 4.44Å; L243-Q247 HydrophobicContact CD1-CG 4.29Å; L243-Q247 WeakPolarHBondContact O-CG 3.48Å; L243-Q247 PolarHBondContact O-N 3.33Å; Q247-T249 PolarHBondContact O-N 2.85Å; Q247-V250 PolarHBondContact O-N 2.95Å; Q247-V251 VanDerWaalsContact O-CB 3.25Å; Q247-V251 WeakPolarHBondContact O-CB 3.46Å; Q247-V251 WeakPolarHBondContact O-CG2 3.16Å; Q247-V251 PolarHBondContact O-N 3.36Å; Q247-W381 HydrophobicContact CG-CH2 4.33Å; Q247-W381 HydrophobicContact CG-CZ3 4.45Å |
| 248 | A | 92.9 | Very high | 92.5 | Very high | 0 Ų | 0 | 19.9 Ų | 19.9 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -61.1 | -44.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L206 L210 K244 Q245 G252 A286 S290 | L206-A248 HydrophobicContact CD2-CB 3.9Å; L210-A248 HydrophobicContact CD1-CB 3.93Å; K244-A248 WeakPolarHBondContact O-CB 3.14Å; K244-A248 PolarHBondContact O-N 3.08Å; Q245-A248 PolarHBondContact O-N 3.46Å; A248-G252 PolarHBondContact O-N 2.89Å; A248-A286 VanDerWaalsContact O-CB 3.29Å; A248-A286 WeakPolarHBondContact O-CB 3.24Å; A248-S290 WeakPolarHBondContact CB-OG 3.32Å |
| 249 | T | 94.6 | Very high | 92.7 | Very high | 1 Ų | 1 | 16 Ų | 16 | 1% | 0.006 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -65.1 | -48.2 | -179.6 | -54.9 | 0 | 0 | 0 | 0 | 111.9 | Q245 V246 Q247 G252 F253 V283 F287 L357 T360 | Q245-T249 WeakPolarHBondContact O-CB 3.25Å; Q245-T249 PolarHBondContact O-N 3.47Å; Q245-T249 PolarHBondContact O-OG1 3.04Å; V246-T249 PolarHBondContact O-N 3.06Å; Q247-T249 PolarHBondContact O-N 2.85Å; T249-G252 PolarHBondContact O-N 3.41Å; T249-F253 PolarHBondContact O-N 3.03Å; T249-V283 HydrophobicContact CG2-CG1 4.02Å; T249-F287 WeakPolarHBondContact OG1-CD2 3.49Å; T249-L357 HydrophobicContact CG2-CD2 4.2Å; T249-T360 WeakPolarHBondContact CG2-OG1 3.38Å |
| 250 | V | 94.4 | Very high | 93 | Very high | 43 Ų | 43 | 16.9 Ų | 16.9 | 26% | 0.261 | 9% | 0.093 | S | C | . | . | H | α-helix | trans | -65.3 | -44.9 | -179.6 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | V246 Q247 F253 L254 T360 W381 | V246-V250 WeakPolarHBondContact O-CB 3.31Å; V246-V250 WeakPolarHBondContact O-CG2 3.43Å; V246-V250 PolarHBondContact O-N 3.34Å; Q247-V250 PolarHBondContact O-N 2.95Å; V250-F253 PolarHBondContact O-N 3.49Å; V250-L254 HydrophobicContact CG1-CD1 4.09Å; V250-L254 HydrophobicContact CG1-CG 4.48Å; V250-L254 WeakPolarHBondContact O-CG 3.32Å; V250-L254 PolarHBondContact O-N 3.2Å; V250-T360 HydrophobicContact CG2-CG2 4.18Å; V250-W381 HydrophobicContact CB-CH2 3.88Å; V250-W381 HydrophobicContact CB-CZ3 3.75Å; V250-W381 HydrophobicContact CG1-CE3 4.42Å; V250-W381 HydrophobicContact CG1-CH2 3.95Å; V250-W381 HydrophobicContact CG1-CZ3 3.53Å; V250-W381 HydrophobicContact CG2-CH2 3.92Å; V250-W381 HydrophobicContact CG2-CZ3 4.3Å |
| 251 | V | 93.3 | Very high | 93.3 | Very high | 2 Ų | 2 | 20.9 Ų | 20.9 | 1% | 0.012 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -71.2 | -35.4 | -178.9 | -178.6 | 0 | 0 | 0 | 0 | 111 | L206 Q247 F253 L254 A255 V384 M388 | L206-V251 HydrophobicContact CD1-CB 3.46Å; L206-V251 VanDerWaalsContact CD1-CB 3.46Å; L206-V251 HydrophobicContact CD1-CG1 3.32Å; L206-V251 HydrophobicContact CD1-CG2 4.06Å; Q247-V251 VanDerWaalsContact O-CB 3.25Å; Q247-V251 WeakPolarHBondContact O-CB 3.46Å; Q247-V251 WeakPolarHBondContact O-CG2 3.16Å; Q247-V251 PolarHBondContact O-N 3.36Å; V251-F253 VanDerWaalsContact C-N 3.34Å; V251-F253 PolarHBondContact O-N 3.44Å; V251-L254 PolarHBondContact O-N 2.56Å; V251-A255 WeakPolarHBondContact O-CB 3.28Å; V251-A255 PolarHBondContact O-N 3.33Å; V251-V384 HydrophobicContact CB-CG1 4.49Å; V251-V384 HydrophobicContact CG1-CG1 4.41Å; V251-V384 HydrophobicContact CG2-CG1 3.44Å; V251-V384 VanDerWaalsContact CG2-CG1 3.44Å; V251-M388 HydrophobicContact CG1-CB 3.68Å; V251-M388 HydrophobicContact CG1-CG 3.64Å |
| 252 | G | 95.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.5 | -43.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A248 T249 A255 A256 S282 | A248-G252 PolarHBondContact O-N 2.89Å; T249-G252 PolarHBondContact O-N 3.41Å; G252-A255 PolarHBondContact O-N 2.87Å; G252-A256 PolarHBondContact O-N 3.05Å; G252-S282 VanDerWaalsContact C-OG 3.29Å; G252-S282 WeakPolarHBondContact O-CB 3.3Å; G252-S282 PolarHBondContact O-OG 3.49Å |
| 253 | F | 96.2 | Very high | 93.2 | Very high | 78 Ų | 78 | 20.4 Ų | 20.4 | 34% | 0.342 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -61.4 | -49.2 | 173.2 | -179.7 | -105.1 | 0 | 0 | 0 | 112 | T249 V250 V251 A255 A256 V257 V283 L357 | T249-F253 PolarHBondContact O-N 3.03Å; V250-F253 PolarHBondContact O-N 3.49Å; V251-F253 VanDerWaalsContact C-N 3.34Å; V251-F253 PolarHBondContact O-N 3.44Å; F253-A255 VanDerWaalsContact C-N 3.31Å; F253-A255 PolarHBondContact O-N 2.9Å; F253-A256 PolarHBondContact O-N 3.44Å; F253-V257 HydrophobicContact CD1-CG2 4.41Å; F253-V257 HydrophobicContact CE1-CG2 3.99Å; F253-V257 HydrophobicContact CE2-CG2 4.4Å; F253-V257 HydrophobicContact CZ-CG2 3.98Å; F253-V257 WeakPolarHBondContact O-CG2 3.26Å; F253-V257 PolarHBondContact O-N 2.82Å; F253-V283 HydrophobicContact CB-CG2 3.63Å; F253-V283 HydrophobicContact CD2-CG2 4.05Å; F253-V283 HydrophobicContact CG-CG2 4.35Å; F253-L357 HydrophobicContact CB-CD2 4.45Å; F253-L357 HydrophobicContact CD2-CD1 4.4Å; F253-L357 HydrophobicContact CD2-CD2 4.49Å |
| 254 | L | 95.8 | Very high | 93.1 | Very high | 56 Ų | 56 | 26.9 Ų | 26.9 | 29% | 0.293 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -63.7 | -35.6 | 178.9 | -68.5 | 176.3 | 0 | 0 | 0 | 112.5 | V250 V251 V257 A258 I385 M388 | V250-L254 HydrophobicContact CG1-CD1 4.09Å; V250-L254 HydrophobicContact CG1-CG 4.48Å; V250-L254 WeakPolarHBondContact O-CG 3.32Å; V250-L254 PolarHBondContact O-N 3.2Å; V251-L254 PolarHBondContact O-N 2.56Å; L254-V257 PolarHBondContact O-N 2.99Å; L254-A258 WeakPolarHBondContact O-CB 3.21Å; L254-A258 PolarHBondContact O-N 3.47Å; L254-I385 HydrophobicContact CD1-CD1 4.11Å; L254-I385 HydrophobicContact CD1-CG1 4.08Å; L254-M388 HydrophobicContact CB-CE 3.53Å |
| 255 | A | 95.4 | Very high | 92.8 | Very high | 1 Ų | 1 | 32.2 Ų | 32.2 | 1% | 0.008 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.4 | -39.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L199 A202 V251 G252 F253 A258 A259 M388 | L199-A255 HydrophobicContact CD1-CB 3.67Å; A202-A255 HydrophobicContact CB-CB 3.99Å; V251-A255 WeakPolarHBondContact O-CB 3.28Å; V251-A255 PolarHBondContact O-N 3.33Å; G252-A255 PolarHBondContact O-N 2.87Å; F253-A255 VanDerWaalsContact C-N 3.31Å; F253-A255 PolarHBondContact O-N 2.9Å; A255-A258 PolarHBondContact O-N 2.99Å; A255-A259 WeakPolarHBondContact O-CB 3.35Å; A255-A259 PolarHBondContact O-N 3.24Å; A255-M388 VanDerWaalsContact CA-SD 3.57Å; A255-M388 HydrophobicContact CB-CG 3.84Å; A255-M388 HydrophobicContact CB-SD 3.93Å |
| 256 | A | 95.9 | Very high | 92 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -66 | -42.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | G252 F253 A258 A259 V260 C279 | G252-A256 PolarHBondContact O-N 3.05Å; F253-A256 PolarHBondContact O-N 3.44Å; A256-A258 VanDerWaalsContact C-N 3.32Å; A256-A258 PolarHBondContact O-N 2.79Å; A256-A259 PolarHBondContact O-N 3.32Å; A256-V260 WeakPolarHBondContact O-CG2 3.42Å; A256-V260 PolarHBondContact O-N 2.94Å; A256-C279 HydrophobicContact CB-CB 4.35Å |
| 257 | V | 95.1 | Very high | 90.9 | Very high | 52 Ų | 52 | 39 Ų | 39 | 32% | 0.315 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.9 | -44.1 | 174.4 | 173.4 | 0 | 0 | 0 | 0 | 110.7 | F253 L254 V260 I261 | F253-V257 HydrophobicContact CD1-CG2 4.41Å; F253-V257 HydrophobicContact CE1-CG2 3.99Å; F253-V257 HydrophobicContact CE2-CG2 4.4Å; F253-V257 HydrophobicContact CZ-CG2 3.98Å; F253-V257 WeakPolarHBondContact O-CG2 3.26Å; F253-V257 PolarHBondContact O-N 2.82Å; L254-V257 PolarHBondContact O-N 2.99Å; V257-V260 PolarHBondContact O-N 3.39Å; V257-I261 HydrophobicContact CG1-CD1 3.82Å; V257-I261 VanDerWaalsContact O-CG1 3.28Å; V257-I261 WeakPolarHBondContact O-CG1 3.46Å; V257-I261 PolarHBondContact O-N 3.04Å |
| 258 | A | 94.3 | Very high | 89.8 | Confident | 17 Ų | 17 | 41 Ų | 41 | 14% | 0.14 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.5 | -44.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L254 A255 A256 V260 I261 L262 M388 | L254-A258 WeakPolarHBondContact O-CB 3.21Å; L254-A258 PolarHBondContact O-N 3.47Å; A255-A258 PolarHBondContact O-N 2.99Å; A256-A258 VanDerWaalsContact C-N 3.32Å; A256-A258 PolarHBondContact O-N 2.79Å; A258-V260 PolarHBondContact O-N 3.4Å; A258-I261 PolarHBondContact O-N 3.48Å; A258-L262 VanDerWaalsContact O-CB 3.26Å; A258-L262 WeakPolarHBondContact O-CB 3.22Å; A258-L262 VanDerWaalsContact O-CG 3.22Å; A258-L262 WeakPolarHBondContact O-CG 3.43Å; A258-L262 PolarHBondContact O-N 2.9Å; A258-M388 HydrophobicContact CB-SD 4.19Å |
| 259 | A | 93.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.6 | -43.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | I198 A255 A256 I261 L262 G263 | I198-A259 HydrophobicContact CB-CB 3.99Å; I198-A259 HydrophobicContact CG2-CB 3.96Å; A255-A259 WeakPolarHBondContact O-CB 3.35Å; A255-A259 PolarHBondContact O-N 3.24Å; A256-A259 PolarHBondContact O-N 3.32Å; A259-I261 PolarHBondContact O-N 2.9Å; A259-L262 PolarHBondContact O-N 2.93Å; A259-G263 PolarHBondContact O-N 3.48Å |
| 260 | V | 93.4 | Very high | 88.1 | Confident | 21 Ų | 21 | 54.5 Ų | 54.5 | 13% | 0.127 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.5 | -42.6 | 175.6 | 170.7 | 0 | 0 | 0 | 0 | 111.5 | A256 V257 A258 W264 Y270 L278 | A256-V260 WeakPolarHBondContact O-CG2 3.42Å; A256-V260 PolarHBondContact O-N 2.94Å; V257-V260 PolarHBondContact O-N 3.39Å; A258-V260 PolarHBondContact O-N 3.4Å; V260-W264 VanDerWaalsContact O-CB 3.31Å; V260-W264 WeakPolarHBondContact O-CB 3.27Å; V260-W264 PolarHBondContact O-N 3.06Å; V260-Y270 HydrophobicContact CG1-CE2 3.91Å; V260-L278 HydrophobicContact CG2-CB 4.46Å; V260-L278 HydrophobicContact CG2-CD1 3.96Å |
| 261 | I | 92.3 | Very high | 87.5 | Confident | 90 Ų | 90 | 59.1 Ų | 59.1 | 46% | 0.462 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -68 | -46.8 | 178.4 | -67.1 | 166.6 | 0 | 0 | 0 | 110.7 | V257 A258 A259 W264 I265 | V257-I261 HydrophobicContact CG1-CD1 3.82Å; V257-I261 VanDerWaalsContact O-CG1 3.28Å; V257-I261 WeakPolarHBondContact O-CG1 3.46Å; V257-I261 PolarHBondContact O-N 3.04Å; A258-I261 PolarHBondContact O-N 3.48Å; A259-I261 PolarHBondContact O-N 2.9Å; I261-W264 PolarHBondContact O-N 3.31Å; I261-I265 HydrophobicContact CG2-CD1 4.36Å; I261-I265 WeakPolarHBondContact O-CG1 3.41Å; I261-I265 PolarHBondContact O-N 3.4Å |
| 262 | L | 90.5 | Very high | 87.2 | Confident | 34 Ų | 34 | 65.1 Ų | 65.1 | 18% | 0.178 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -69.5 | -37.5 | -176.8 | -70.5 | 175.8 | 0 | 0 | 0 | 112.2 | I198 A258 A259 P266 L396 | I198-L262 HydrophobicContact CD1-CB 4.46Å; I198-L262 HydrophobicContact CG2-CB 4.45Å; I198-L262 HydrophobicContact CG2-CD1 4.33Å; A258-L262 VanDerWaalsContact O-CB 3.26Å; A258-L262 WeakPolarHBondContact O-CB 3.22Å; A258-L262 VanDerWaalsContact O-CG 3.22Å; A258-L262 WeakPolarHBondContact O-CG 3.43Å; A258-L262 PolarHBondContact O-N 2.9Å; A259-L262 PolarHBondContact O-N 2.93Å; L262-P266 WeakPolarHBondContact O-CD 3.41Å; L262-L396 HydrophobicContact CB-CD1 4.33Å; L262-L396 HydrophobicContact CB-CD2 4.31Å; L262-L396 HydrophobicContact CD2-CD2 4.32Å; L262-L396 WeakPolarHBondContact O-CD1 3.43Å |
| 263 | G | 87.3 | Confident | 86.8 | Confident | 1 Ų | 1 | 69 Ų | 69 | 1% | 0.01 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -71.3 | -31.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | A259 I265 P266 | A259-G263 PolarHBondContact O-N 3.48Å; G263-I265 VanDerWaalsContact C-N 3.35Å; G263-I265 PolarHBondContact O-N 3.45Å; G263-P266 WeakPolarHBondContact O-CD 3.08Å |
| 264 | W | 87.4 | Confident | 86.4 | Confident | 138 Ų | 138 | 65.8 Ų | 65.8 | 52% | 0.523 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -67.3 | -32.7 | 176.2 | 178 | 54.1 | 0 | 0 | 0 | 113.3 | V260 I261 G268 | V260-W264 VanDerWaalsContact O-CB 3.31Å; V260-W264 WeakPolarHBondContact O-CB 3.27Å; V260-W264 PolarHBondContact O-N 3.06Å; I261-W264 PolarHBondContact O-N 3.31Å; W264-G268 WeakPolarHBondContact O-CA 3.3Å; W264-G268 PolarHBondContact O-N 3.06Å |
| 265 | I | 83.1 | Confident | 86.2 | Confident | 118 Ų | 118 | 63.8 Ų | 63.8 | 61% | 0.605 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.3 | -48.8 | -174.5 | -70.2 | 162.5 | 0 | 0 | 0 | 112.6 | I261 G263 | I261-I265 HydrophobicContact CG2-CD1 4.36Å; I261-I265 WeakPolarHBondContact O-CG1 3.41Å; I261-I265 PolarHBondContact O-N 3.4Å; G263-I265 VanDerWaalsContact C-N 3.35Å; G263-I265 PolarHBondContact O-N 3.45Å |
| 266 | P | 75.9 | Confident | 86.1 | Confident | 81 Ų | 81 | 65.9 Ų | 65.9 | 53% | 0.526 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -78.2 | -42 | 178.3 | -15.2 | 29.2 | 0 | 0 | 0 | 113.9 | L262 G263 L396 | L262-P266 WeakPolarHBondContact O-CD 3.41Å; G263-P266 WeakPolarHBondContact O-CD 3.08Å; P266-L396 HydrophobicContact CG-CD1 4.11Å |
| 267 | E | 70 | Confident | 86.1 | Confident | 76 Ų | 76 | 66 Ų | 66 | 36% | 0.355 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -88.5 | -25.9 | -169.7 | -67.1 | -162.9 | -158.2 | 0 | 0 | 114.2 | T194 K269 | T194-E267 PolarHBondContact OG1-OE1 2.95Å; E267-K269 PolarHBondContact O-N 2.93Å |
| 268 | G | 69.8 | Low | 86.1 | Confident | 52 Ų | 52 | 63.6 Ų | 63.6 | 54% | 0.536 | 31% | 0.313 | S | S | . | . | trans | 65.5 | 2.2 | -179 | 0 | 0 | 0 | 0 | 0 | 115.5 | W264 | W264-G268 WeakPolarHBondContact O-CA 3.3Å; W264-G268 PolarHBondContact O-N 3.06Å | ||
| 269 | K | 73 | Confident | 86.1 | Confident | 153 Ų | 153 | 64 Ų | 64 | 67% | 0.665 | 31% | 0.314 | S | S | * | . | trans | -96.2 | 112.8 | 178.8 | -67.6 | 174.9 | -171.8 | 164 | 0 | 109.8 | E267 | E267-K269 PolarHBondContact O-N 2.93Š| ||
| 270 | Y | 78 | Confident | 86.3 | Confident | 131 Ų | 131 | 64.3 Ų | 64.3 | 51% | 0.514 | 32% | 0.316 | S | S | . | . | trans | -104.9 | 114.1 | 175.8 | -176.4 | -103.5 | 0 | 0 | 0 | 110.7 | V260 F272 S275 | V260-Y270 HydrophobicContact CG1-CE2 3.91Å; Y270-F272 HydrophobicContact CE1-CB 4.33Å; Y270-F272 HydrophobicContact CE1-CD2 4.34Å; Y270-S275 WeakPolarHBondContact CE2-OG 3.44Å | ||
| 271 | R | 82.2 | Confident | 86.4 | Confident | 141 Ų | 141 | 63.3 Ų | 63.3 | 53% | 0.532 | 31% | 0.311 | S | S | . | . | trans | -112.9 | 114.4 | 171.7 | -67.7 | -172.7 | 68.1 | 178.8 | -3.7 | 110 | D273 H274 S275 | R271-D273 VanDerWaalsContact C-N 3.33Å; R271-D273 PolarHBondContact O-N 3.43Å; R271-H274 HydrophobicContact CB-CB 4.12Å; R271-H274 VanDerWaalsContact CZ-NE2 3.34Å; R271-H274 PolarHBondContact NH1-CE1 2.97Å; R271-H274 PolarHBondContact NH1-NE2 2.91Å; R271-H274 PolarHBondContact O-N 3.42Å; R271-S275 PolarHBondContact O-N 3.29Å; R271-S275 VanDerWaalsContact O-N 3.1Å; R271-S275 PolarHBondContact O-OG 2.94Å; R271-S275 VanDerWaalsContact O-OG 3.07Å | ||
| 272 | F | 86.4 | Confident | 86.6 | Confident | 127 Ų | 127 | 59 Ų | 59 | 56% | 0.557 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -61.3 | -40.5 | -177.7 | -174.2 | -106.8 | 0 | 0 | 0 | 112.6 | Y270 H274 S275 I276 | Y270-F272 HydrophobicContact CE1-CB 4.33Å; Y270-F272 HydrophobicContact CE1-CD2 4.34Å; F272-H274 VanDerWaalsContact C-N 3.34Å; F272-H274 PolarHBondContact O-N 3.48Å; F272-S275 WeakPolarHBondContact O-CB 3.28Å; F272-S275 PolarHBondContact O-N 3.26Å; F272-S275 VanDerWaalsContact O-N 3.13Å; F272-I276 HydrophobicContact CD1-CD1 3.81Å; F272-I276 HydrophobicContact CE1-CD1 3.25Å; F272-I276 HydrophobicContact CE1-CG1 4.18Å; F272-I276 HydrophobicContact CE2-CD1 4.47Å; F272-I276 HydrophobicContact CZ-CD1 3.64Å; F272-I276 HydrophobicContact CZ-CG1 4.24Å; F272-I276 PolarHBondContact O-N 3.5Å |
| 273 | D | 86.1 | Confident | 86.9 | Confident | 81 Ų | 81 | 57.5 Ų | 57.5 | 43% | 0.433 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63.5 | -39.6 | 180 | -55.3 | -39.3 | 0 | 0 | 0 | 112.3 | R271 S275 I276 L277 L342 | R271-D273 VanDerWaalsContact C-N 3.33Å; R271-D273 PolarHBondContact O-N 3.43Å; D273-S275 VanDerWaalsContact C-N 3.34Å; D273-I276 PolarHBondContact O-N 3.35Å; D273-L277 WeakPolarHBondContact O-CB 3.49Å; D273-L277 PolarHBondContact O-N 3.5Å; D273-L342 HydrophobicContact CB-CD1 4.24Å; D273-L342 HydrophobicContact CB-CD2 4.17Å |
| 274 | H | 89.3 | Confident | 87.4 | Confident | 11 Ų | 11 | 57.5 Ų | 57.5 | 5% | 0.051 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -68.3 | -35.6 | 175.2 | -67.8 | -167.3 | 0 | 0 | 0 | 111.2 | N192 V193 R271 F272 L277 L278 | N192-H274 PolarHBondContact O-CE1 3Å; N192-H274 VanDerWaalsContact O-CE1 3.25Å; N192-H274 PolarHBondContact O-ND1 3.49Å; V193-H274 HydrophobicContact CG1-CB 4.27Å; R271-H274 HydrophobicContact CB-CB 4.12Å; R271-H274 VanDerWaalsContact CZ-NE2 3.34Å; R271-H274 PolarHBondContact NH1-CE1 2.97Å; R271-H274 PolarHBondContact NH1-NE2 2.91Å; R271-H274 PolarHBondContact O-N 3.42Å; F272-H274 VanDerWaalsContact C-N 3.34Å; F272-H274 PolarHBondContact O-N 3.48Å; H274-L277 WeakPolarHBondContact O-CB 3.3Å; H274-L277 PolarHBondContact O-N 3.48Å; H274-L278 WeakPolarHBondContact O-CB 3.48Å; H274-L278 WeakPolarHBondContact O-CD1 3.27Å; H274-L278 VanDerWaalsContact O-CG 3.29Å; H274-L278 WeakPolarHBondContact O-CG 3.31Å; H274-L278 PolarHBondContact O-N 2.93Å |
| 275 | S | 91.9 | Very high | 87.8 | Confident | 14 Ų | 14 | 50.9 Ų | 50.9 | 10% | 0.098 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 176.2 | -57.1 | 0 | 0 | 0 | 0 | 111.8 | Y270 R271 F272 D273 C279 | Y270-S275 WeakPolarHBondContact CE2-OG 3.44Å; R271-S275 PolarHBondContact O-N 3.29Å; R271-S275 VanDerWaalsContact O-N 3.1Å; R271-S275 PolarHBondContact O-OG 2.94Å; R271-S275 VanDerWaalsContact O-OG 3.07Å; F272-S275 WeakPolarHBondContact O-CB 3.28Å; F272-S275 PolarHBondContact O-N 3.26Å; F272-S275 VanDerWaalsContact O-N 3.13Å; D273-S275 VanDerWaalsContact C-N 3.34Å; S275-C279 WeakPolarHBondContact O-CB 3.44Å; S275-C279 PolarHBondContact O-N 3.3Å; S275-C279 PolarHBondContact O-SG 3.02Å; S275-C279 VanDerWaalsContact O-SG 3.34Å |
| 276 | I | 93.2 | Very high | 88.4 | Confident | 46 Ų | 46 | 45.4 Ų | 45.4 | 24% | 0.236 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.5 | -44.1 | 175.2 | -66.8 | 174.5 | 0 | 0 | 0 | 110.5 | F272 D273 L278 C279 S280 P350 | F272-I276 HydrophobicContact CD1-CD1 3.81Å; F272-I276 HydrophobicContact CE1-CD1 3.25Å; F272-I276 HydrophobicContact CE1-CG1 4.18Å; F272-I276 HydrophobicContact CE2-CD1 4.47Å; F272-I276 HydrophobicContact CZ-CD1 3.64Å; F272-I276 HydrophobicContact CZ-CG1 4.24Å; F272-I276 PolarHBondContact O-N 3.5Å; D273-I276 PolarHBondContact O-N 3.35Å; I276-L278 PolarHBondContact O-N 3.2Å; I276-C279 PolarHBondContact O-N 2.81Å; I276-S280 WeakPolarHBondContact O-CB 3.39Å; I276-S280 PolarHBondContact O-N 3.3Å; I276-S280 PolarHBondContact O-OG 3.45Å; I276-P350 HydrophobicContact CG2-CB 3.92Å; I276-P350 HydrophobicContact CG2-CG 4.32Å |
| 277 | L | 94.6 | Very high | 89.3 | Confident | 2 Ų | 2 | 43 Ų | 43 | 1% | 0.01 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -53.9 | -51.5 | 175 | 178.7 | 73.9 | 0 | 0 | 0 | 112.1 | V189 V193 D273 H274 S280 S281 L338 Y339 S349 | V189-L277 HydrophobicContact CG2-CD2 4.35Å; V193-L277 HydrophobicContact CG2-CD2 4.06Å; D273-L277 WeakPolarHBondContact O-CB 3.49Å; D273-L277 PolarHBondContact O-N 3.5Å; H274-L277 WeakPolarHBondContact O-CB 3.3Å; H274-L277 PolarHBondContact O-N 3.48Å; L277-S280 PolarHBondContact O-N 2.95Å; L277-S281 WeakPolarHBondContact O-CB 3.31Å; L277-S281 PolarHBondContact O-N 3.26Å; L277-S281 PolarHBondContact O-OG 3.26Å; L277-S281 VanDerWaalsContact O-OG 3.12Å; L277-L338 VanDerWaalsContact CD1-C 3.47Å; L277-L338 HydrophobicContact CD1-CB 3.23Å; L277-L338 HydrophobicContact CD1-CD1 4.4Å; L277-L338 HydrophobicContact CD1-CG 4.44Å; L277-Y339 HydrophobicContact CD2-CD2 3.76Å; L277-Y339 HydrophobicContact CD2-CG 4.43Å; L277-S349 WeakPolarHBondContact CA-OG 3.49Å |
| 278 | L | 94.7 | Very high | 90.5 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.005 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.3 | -45 | 178.7 | -76.8 | 159.5 | 0 | 0 | 0 | 112 | V193 E195 V196 V260 H274 I276 S281 S282 | V193-L278 HydrophobicContact CG1-CD1 3.78Å; V193-L278 HydrophobicContact CG1-CD2 3.86Å; V193-L278 HydrophobicContact CG1-CG 3.75Å; E195-L278 HydrophobicContact CB-CD1 3.64Å; E195-L278 HydrophobicContact CB-CD2 4.12Å; E195-L278 HydrophobicContact CG-CD1 4.2Å; V196-L278 HydrophobicContact CB-CD2 4.5Å; V196-L278 HydrophobicContact CG2-CD2 3.65Å; V260-L278 HydrophobicContact CG2-CB 4.46Å; V260-L278 HydrophobicContact CG2-CD1 3.96Å; H274-L278 WeakPolarHBondContact O-CB 3.48Å; H274-L278 WeakPolarHBondContact O-CD1 3.27Å; H274-L278 VanDerWaalsContact O-CG 3.29Å; H274-L278 WeakPolarHBondContact O-CG 3.31Å; H274-L278 PolarHBondContact O-N 2.93Å; I276-L278 PolarHBondContact O-N 3.2Å; L278-S281 PolarHBondContact O-OG 3.5Å; L278-S282 WeakPolarHBondContact O-CB 3.31Å; L278-S282 PolarHBondContact O-N 2.59Å |
| 279 | C | 95.9 | Very high | 91.6 | Very high | 26 Ų | 26 | 40 Ų | 40 | 18% | 0.176 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.8 | -48.6 | 176.7 | -75.6 | 0 | 0 | 0 | 0 | 111.8 | A256 S275 I276 V283 | A256-C279 HydrophobicContact CB-CB 4.35Å; S275-C279 WeakPolarHBondContact O-CB 3.44Å; S275-C279 PolarHBondContact O-N 3.3Å; S275-C279 PolarHBondContact O-SG 3.02Å; S275-C279 VanDerWaalsContact O-SG 3.34Å; I276-C279 PolarHBondContact O-N 2.81Å; C279-V283 WeakPolarHBondContact O-CB 3.27Å; C279-V283 VanDerWaalsContact O-CG2 3.27Å; C279-V283 WeakPolarHBondContact O-CG2 3.36Å; C279-V283 PolarHBondContact O-N 2.92Å |
| 280 | S | 96.4 | Very high | 92.4 | Very high | 6 Ų | 6 | 32.9 Ų | 32.9 | 4% | 0.042 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -69.6 | -41.2 | -178.1 | -68.2 | 0 | 0 | 0 | 0 | 112.8 | I276 L277 A284 S349 G353 | I276-S280 WeakPolarHBondContact O-CB 3.39Å; I276-S280 PolarHBondContact O-N 3.3Å; I276-S280 PolarHBondContact O-OG 3.45Å; L277-S280 PolarHBondContact O-N 2.95Å; S280-A284 WeakPolarHBondContact O-CB 3.12Å; S280-A284 PolarHBondContact O-N 2.88Å; S280-S349 WeakPolarHBondContact CB-O 3.26Å; S280-S349 WeakPolarHBondContact CB-OG 3.41Å; S280-S349 PolarHBondContact OG-O 3.34Å; S280-G353 WeakPolarHBondContact OG-CA 3.27Å; S280-G353 PolarHBondContact OG-N 3.33Å |
| 281 | S | 96.7 | Very high | 93 | Very high | 1 Ų | 1 | 29.8 Ų | 29.8 | 1% | 0.007 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -66 | -46.5 | 177 | 68.8 | 0 | 0 | 0 | 0 | 110.9 | L277 L278 V283 A284 T285 S335 | L277-S281 WeakPolarHBondContact O-CB 3.31Å; L277-S281 PolarHBondContact O-N 3.26Å; L277-S281 PolarHBondContact O-OG 3.26Å; L277-S281 VanDerWaalsContact O-OG 3.12Å; L278-S281 PolarHBondContact O-OG 3.5Å; S281-V283 PolarHBondContact O-N 3.07Å; S281-A284 PolarHBondContact O-N 3.21Å; S281-T285 WeakPolarHBondContact O-CB 3.13Å; S281-T285 PolarHBondContact O-N 3.34Å; S281-T285 PolarHBondContact O-OG1 3.08Å; S281-S335 WeakPolarHBondContact CB-OG 3.21Å; S281-S335 PolarHBondContact OG-OG 3.07Å |
| 282 | S | 97 | Very high | 93.5 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -58.3 | -49.9 | 177.3 | -176.1 | 0 | 0 | 0 | 0 | 112.5 | L199 G252 L278 T285 A286 | L199-S282 WeakPolarHBondContact CD1-OG 3.43Å; G252-S282 VanDerWaalsContact C-OG 3.29Å; G252-S282 WeakPolarHBondContact O-CB 3.3Å; G252-S282 PolarHBondContact O-OG 3.49Å; L278-S282 WeakPolarHBondContact O-CB 3.31Å; L278-S282 PolarHBondContact O-N 2.59Å; S282-T285 PolarHBondContact O-N 2.93Å; S282-A286 VanDerWaalsContact O-CB 3.26Å; S282-A286 WeakPolarHBondContact O-CB 3.25Å; S282-A286 PolarHBondContact O-N 3.4Å |
| 283 | V | 97 | Very high | 93.5 | Very high | 1 Ų | 1 | 21.2 Ų | 21.2 | 1% | 0.006 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.2 | -46.9 | -179.1 | 164.9 | 0 | 0 | 0 | 0 | 111.3 | T249 F253 C279 S281 A286 F287 F356 L357 | T249-V283 HydrophobicContact CG2-CG1 4.02Å; F253-V283 HydrophobicContact CB-CG2 3.63Å; F253-V283 HydrophobicContact CD2-CG2 4.05Å; F253-V283 HydrophobicContact CG-CG2 4.35Å; C279-V283 WeakPolarHBondContact O-CB 3.27Å; C279-V283 VanDerWaalsContact O-CG2 3.27Å; C279-V283 WeakPolarHBondContact O-CG2 3.36Å; C279-V283 PolarHBondContact O-N 2.92Å; S281-V283 PolarHBondContact O-N 3.07Å; V283-A286 PolarHBondContact O-N 3.35Å; V283-F287 WeakPolarHBondContact O-CB 3.39Å; V283-F287 PolarHBondContact O-N 3.4Å; V283-F356 HydrophobicContact CG1-CB 3.57Å; V283-L357 HydrophobicContact CG1-CD2 4.27Å; V283-L357 HydrophobicContact CG1-CG 4.2Å; V283-L357 HydrophobicContact CG2-CD2 4.27Å |
| 284 | A | 97 | Very high | 93.5 | Very high | 1 Ų | 1 | 17.3 Ų | 17.3 | 1% | 0.008 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -63.3 | -43.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | S280 S281 F287 I288 I334 V352 F356 | S280-A284 WeakPolarHBondContact O-CB 3.12Å; S280-A284 PolarHBondContact O-N 2.88Å; S281-A284 PolarHBondContact O-N 3.21Å; A284-F287 PolarHBondContact O-N 3.16Å; A284-I288 WeakPolarHBondContact O-CB 3.14Å; A284-I288 VanDerWaalsContact O-CG1 3.26Å; A284-I288 WeakPolarHBondContact O-CG1 3.36Å; A284-I288 PolarHBondContact O-N 3.19Å; A284-I334 HydrophobicContact CB-CD1 4Å; A284-I334 HydrophobicContact CB-CG2 4.1Å; A284-V352 HydrophobicContact CB-CG1 3.96Å; A284-F356 HydrophobicContact CB-CD2 3.49Å; A284-F356 VanDerWaalsContact CB-CD2 3.49Å; A284-F356 HydrophobicContact CB-CE2 3.44Å; A284-F356 VanDerWaalsContact CB-CE2 3.44Å; A284-F356 HydrophobicContact CB-CG 4.41Å; A284-F356 HydrophobicContact CB-CZ 4.33Å |
| 285 | T | 96.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -62.3 | -51.1 | 176 | -68.7 | 0 | 0 | 0 | 0 | 111.5 | L203 S281 S282 F287 I288 A289 T327 I330 L331 | L203-T285 HydrophobicContact CD1-CG2 4.07Å; S281-T285 WeakPolarHBondContact O-CB 3.13Å; S281-T285 PolarHBondContact O-N 3.34Å; S281-T285 PolarHBondContact O-OG1 3.08Å; S282-T285 PolarHBondContact O-N 2.93Å; T285-F287 VanDerWaalsContact C-N 3.26Å; T285-F287 PolarHBondContact O-N 3.36Å; T285-I288 PolarHBondContact O-N 3.46Å; T285-A289 WeakPolarHBondContact O-CB 3.31Å; T285-A289 PolarHBondContact O-N 3.14Å; T285-T327 HydrophobicContact CG2-CG2 4.28Å; T285-I330 HydrophobicContact CG2-CB 4.42Å; T285-I330 HydrophobicContact CG2-CG2 4.07Å; T285-L331 HydrophobicContact CG2-CB 3.78Å; T285-L331 HydrophobicContact CG2-CD1 4.14Å; T285-L331 WeakPolarHBondContact OG1-CA 3.24Å |
| 286 | A | 94.7 | Very high | 93.2 | Very high | 2 Ų | 2 | 23.6 Ų | 23.6 | 2% | 0.017 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.5 | -40 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L203 A248 S282 V283 S290 | L203-A286 HydrophobicContact CD2-CB 4.15Å; A248-A286 VanDerWaalsContact O-CB 3.29Å; A248-A286 WeakPolarHBondContact O-CB 3.24Å; S282-A286 VanDerWaalsContact O-CB 3.26Å; S282-A286 WeakPolarHBondContact O-CB 3.25Å; S282-A286 PolarHBondContact O-N 3.4Å; V283-A286 PolarHBondContact O-N 3.35Å; A286-S290 WeakPolarHBondContact O-CB 3.49Å; A286-S290 PolarHBondContact O-N 2.93Å; A286-S290 VanDerWaalsContact O-N 3.12Å; A286-S290 PolarHBondContact O-OG 3.16Å |
| 287 | F | 94.6 | Very high | 92.7 | Very high | 32 Ų | 32 | 21.6 Ų | 21.6 | 14% | 0.14 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -66.6 | -53.2 | 176 | -172.6 | -80.6 | 0 | 0 | 0 | 112.6 | Q245 T249 V283 A284 T285 S290 L291 F356 L359 | Q245-F287 PolarHBondContact NE2-O 2.91Å; Q245-F287 VanDerWaalsContact NE2-O 3.13Å; Q245-F287 PolarHBondContact OE1-O 3.21Å; T249-F287 WeakPolarHBondContact OG1-CD2 3.49Å; V283-F287 WeakPolarHBondContact O-CB 3.39Å; V283-F287 PolarHBondContact O-N 3.4Å; A284-F287 PolarHBondContact O-N 3.16Å; T285-F287 VanDerWaalsContact C-N 3.26Å; T285-F287 PolarHBondContact O-N 3.36Å; F287-S290 PolarHBondContact O-OG 3.3Å; F287-S290 VanDerWaalsContact O-OG 3.1Å; F287-L291 HydrophobicContact CE1-CD2 4.4Å; F287-L291 WeakPolarHBondContact O-CB 3.47Å; F287-L291 PolarHBondContact O-N 3.01Å; F287-F356 HydrophobicContact CB-CD1 3.77Å; F287-F356 HydrophobicContact CB-CE1 4.22Å; F287-F356 HydrophobicContact CB-CG 4.4Å; F287-F356 AromaticContact CD1-CD1 3.48Å; F287-F356 HydrophobicContact CD1-CD1 3.48Å; F287-F356 VanDerWaalsContact CD1-CD1 3.48Å; F287-F356 AromaticContact CD1-CE1 3.4Å; F287-F356 HydrophobicContact CD1-CE1 3.4Å; F287-F356 VanDerWaalsContact CD1-CE1 3.4Å; F287-F356 HydrophobicContact CD2-CD1 4.03Å; F287-F356 HydrophobicContact CE1-CD1 4.05Å; F287-F356 AromaticContact CE1-CE1 3.92Å; F287-F356 HydrophobicContact CE1-CE1 3.92Å; F287-F356 AromaticContact CG-CD1 3.47Å; F287-F356 HydrophobicContact CG-CD1 3.47Å; F287-F356 VanDerWaalsContact CG-CD1 3.47Å; F287-F356 AromaticContact CG-CE1 3.89Å; F287-F356 HydrophobicContact CG-CE1 3.89Å; F287-F356 HydrophobicContact CG-CG 4.46Å; F287-L359 HydrophobicContact CE1-CD1 4.25Å; F287-L359 HydrophobicContact CE2-CB 4.08Å; F287-L359 HydrophobicContact CE2-CD1 4.06Å; F287-L359 HydrophobicContact CZ-CB 4.44Å; F287-L359 HydrophobicContact CZ-CD1 3.7Å |
| 288 | I | 95.1 | Very high | 92.1 | Very high | 64 Ų | 64 | 22.4 Ų | 22.4 | 33% | 0.328 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -69.3 | -45 | -174.9 | -64.5 | 165.8 | 0 | 0 | 0 | 110.8 | A284 T285 L291 L292 I330 I334 F356 | A284-I288 WeakPolarHBondContact O-CB 3.14Å; A284-I288 VanDerWaalsContact O-CG1 3.26Å; A284-I288 WeakPolarHBondContact O-CG1 3.36Å; A284-I288 PolarHBondContact O-N 3.19Å; T285-I288 PolarHBondContact O-N 3.46Å; I288-L291 WeakPolarHBondContact O-CB 3.44Å; I288-L291 PolarHBondContact O-N 2.68Å; I288-L292 WeakPolarHBondContact O-CB 3.46Å; I288-L292 PolarHBondContact O-N 3.44Å; I288-I330 HydrophobicContact CB-CG2 4.37Å; I288-I330 HydrophobicContact CG2-CD1 4.02Å; I288-I330 HydrophobicContact CG2-CG2 4.39Å; I288-I334 HydrophobicContact CD1-CD1 3.69Å; I288-F356 HydrophobicContact CD1-CE1 4.41Å; I288-F356 HydrophobicContact CD1-CE2 4.38Å; I288-F356 HydrophobicContact CD1-CZ 3.74Å; I288-F356 HydrophobicContact CG1-CE1 4.08Å; I288-F356 HydrophobicContact CG1-CZ 3.91Å |
| 289 | A | 92.8 | Very high | 91.6 | Very high | 1 Ų | 1 | 24.4 Ų | 24.4 | 1% | 0.008 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.4 | -47.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | T285 L291 L292 Q293 I326 T327 I330 | T285-A289 WeakPolarHBondContact O-CB 3.31Å; T285-A289 PolarHBondContact O-N 3.14Å; A289-L291 VanDerWaalsContact C-N 3.3Å; A289-L291 PolarHBondContact O-N 2.87Å; A289-L292 PolarHBondContact O-N 2.69Å; A289-Q293 VanDerWaalsContact O-CB 3.3Å; A289-Q293 WeakPolarHBondContact O-CB 3.47Å; A289-Q293 WeakPolarHBondContact O-CG 3.38Å; A289-Q293 PolarHBondContact O-N 3.39Å; A289-Q293 PolarHBondContact O-OE1 3.45Å; A289-I326 HydrophobicContact CB-CG2 4.49Å; A289-T327 HydrophobicContact CB-CG2 4.26Å; A289-I330 HydrophobicContact CB-CD1 3.98Å |
| 290 | S | 91 | Very high | 90.9 | Very high | 3 Ų | 3 | 24.3 Ų | 24.3 | 2% | 0.021 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65.4 | -32.6 | 178.8 | 69.8 | 0 | 0 | 0 | 0 | 112.8 | Q245 A248 A286 F287 G294 | Q245-S290 PolarHBondContact NE2-OG 2.92Å; Q245-S290 PolarHBondContact OE1-OG 2.98Å; A248-S290 WeakPolarHBondContact CB-OG 3.32Å; A286-S290 WeakPolarHBondContact O-CB 3.49Å; A286-S290 PolarHBondContact O-N 2.93Å; A286-S290 VanDerWaalsContact O-N 3.12Å; A286-S290 PolarHBondContact O-OG 3.16Å; F287-S290 PolarHBondContact O-OG 3.3Å; F287-S290 VanDerWaalsContact O-OG 3.1Å; S290-G294 PolarHBondContact O-N 3.44Å |
| 291 | L | 90.8 | Very high | 90 | Very high | 65 Ų | 65 | 24.4 Ų | 24.4 | 34% | 0.34 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -63.5 | -53.8 | 173.3 | -168.8 | 56.7 | 0 | 0 | 0 | 110.8 | Q245 F287 I288 A289 G294 I295 | Q245-L291 VanDerWaalsContact NE2-N 3.17Å; F287-L291 HydrophobicContact CE1-CD2 4.4Å; F287-L291 WeakPolarHBondContact O-CB 3.47Å; F287-L291 PolarHBondContact O-N 3.01Å; I288-L291 WeakPolarHBondContact O-CB 3.44Å; I288-L291 PolarHBondContact O-N 2.68Å; A289-L291 VanDerWaalsContact C-N 3.3Å; A289-L291 PolarHBondContact O-N 2.87Å; L291-G294 PolarHBondContact O-N 2.92Å; L291-I295 HydrophobicContact CD1-CD1 4.35Å; L291-I295 HydrophobicContact CG-CD1 4.05Å; L291-I295 WeakPolarHBondContact O-CG1 3.49Å; L291-I295 PolarHBondContact O-N 3.43Å |
| 292 | L | 91.1 | Very high | 89.1 | Confident | 75 Ų | 75 | 27 Ų | 27 | 39% | 0.393 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -62.6 | -46.9 | -175.7 | -178.7 | 57.7 | 0 | 0 | 0 | 110.6 | I288 A289 G294 I295 I296 I326 I330 | I288-L292 WeakPolarHBondContact O-CB 3.46Å; I288-L292 PolarHBondContact O-N 3.44Å; A289-L292 PolarHBondContact O-N 2.69Å; L292-G294 VanDerWaalsContact C-N 3.34Å; L292-G294 PolarHBondContact O-N 2.92Å; L292-I295 PolarHBondContact O-N 3.49Å; L292-I296 HydrophobicContact CD1-CD1 4.32Å; L292-I296 HydrophobicContact CG-CD1 4.12Å; L292-I296 VanDerWaalsContact O-CG1 3.29Å; L292-I296 WeakPolarHBondContact O-CG1 3.04Å; L292-I296 PolarHBondContact O-N 3.02Å; L292-I326 HydrophobicContact CD2-CD1 4.45Å; L292-I326 HydrophobicContact CD2-CG2 3.83Å; L292-I326 HydrophobicContact CG-CG2 4.43Å; L292-I330 HydrophobicContact CD2-CD1 4.3Å |
| 293 | Q | 87.4 | Confident | 88.3 | Confident | 13 Ų | 13 | 28.6 Ų | 28.6 | 6% | 0.061 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.8 | -42 | 174 | -70.4 | 163 | -15.7 | 0 | 0 | 112.2 | E211 A289 I295 I296 M297 G323 I326 T327 | E211-Q293 WeakPolarHBondContact OE1-CB 3.24Å; E211-Q293 VanDerWaalsContact OE1-CD 3.26Å; E211-Q293 PolarHBondContact OE1-OE1 2.97Å; E211-Q293 VanDerWaalsContact OE1-OE1 3.05Å; A289-Q293 VanDerWaalsContact O-CB 3.3Å; A289-Q293 WeakPolarHBondContact O-CB 3.47Å; A289-Q293 WeakPolarHBondContact O-CG 3.38Å; A289-Q293 PolarHBondContact O-N 3.39Å; A289-Q293 PolarHBondContact O-OE1 3.45Å; Q293-I295 PolarHBondContact O-N 3.48Å; Q293-I296 PolarHBondContact O-N 3.38Å; Q293-M297 WeakPolarHBondContact O-CB 3.45Å; Q293-M297 VanDerWaalsContact O-CG 3.32Å; Q293-M297 WeakPolarHBondContact O-CG 3.4Å; Q293-M297 PolarHBondContact O-N 3.05Å; Q293-G323 VanDerWaalsContact NE2-CA 3.33Å; Q293-G323 PolarHBondContact NE2-O 3.5Å; Q293-I326 HydrophobicContact CG-CG2 4.42Å; Q293-T327 PolarHBondContact NE2-OG1 3.16Å |
| 294 | G | 86.9 | Confident | 87.3 | Confident | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.6 | -42.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | S290 L291 L292 M297 V298 | S290-G294 PolarHBondContact O-N 3.44Å; L291-G294 PolarHBondContact O-N 2.92Å; L292-G294 VanDerWaalsContact C-N 3.34Å; L292-G294 PolarHBondContact O-N 2.92Å; G294-M297 PolarHBondContact O-N 3.46Å; G294-V298 WeakPolarHBondContact O-CG2 3.31Å; G294-V298 PolarHBondContact O-N 3.3Å |
| 295 | I | 87.8 | Confident | 86.2 | Confident | 99 Ų | 99 | 33.1 Ų | 33.1 | 51% | 0.508 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64 | -45.7 | 175.5 | -67.5 | 165.8 | 0 | 0 | 0 | 110.8 | L291 L292 Q293 M297 V298 G299 | L291-I295 HydrophobicContact CD1-CD1 4.35Å; L291-I295 HydrophobicContact CG-CD1 4.05Å; L291-I295 WeakPolarHBondContact O-CG1 3.49Å; L291-I295 PolarHBondContact O-N 3.43Å; L292-I295 PolarHBondContact O-N 3.49Å; Q293-I295 PolarHBondContact O-N 3.48Å; I295-M297 VanDerWaalsContact C-N 3.33Å; I295-M297 PolarHBondContact O-N 3.12Å; I295-V298 PolarHBondContact O-N 3.09Å; I295-G299 PolarHBondContact O-N 3.15Å |
| 296 | I | 86.6 | Confident | 85.3 | Confident | 57 Ų | 57 | 42.3 Ų | 42.3 | 29% | 0.292 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -58.7 | -47.4 | 176.6 | -68.9 | 166.1 | 0 | 0 | 0 | 109.8 | L292 Q293 G299 V300 I318 I326 | L292-I296 HydrophobicContact CD1-CD1 4.32Å; L292-I296 HydrophobicContact CG-CD1 4.12Å; L292-I296 VanDerWaalsContact O-CG1 3.29Å; L292-I296 WeakPolarHBondContact O-CG1 3.04Å; L292-I296 PolarHBondContact O-N 3.02Å; Q293-I296 PolarHBondContact O-N 3.38Å; I296-G299 PolarHBondContact O-N 2.98Å; I296-V300 HydrophobicContact CG2-CG2 4.36Å; I296-V300 WeakPolarHBondContact O-CG2 3.41Å; I296-V300 PolarHBondContact O-N 2.67Å; I296-I318 HydrophobicContact CG2-CG2 4.31Å; I296-I326 HydrophobicContact CD1-CD1 3.58Å |
| 297 | M | 82.5 | Confident | 84.5 | Confident | 4 Ų | 4 | 46.7 Ų | 46.7 | 2% | 0.02 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.8 | -48.1 | 179.8 | -78.6 | -61 | -76.6 | 0 | 0 | 112.8 | A215 Q293 G294 I295 G299 V300 I301 A315 A319 | A215-M297 HydrophobicContact CB-CE 3.97Å; Q293-M297 WeakPolarHBondContact O-CB 3.45Å; Q293-M297 VanDerWaalsContact O-CG 3.32Å; Q293-M297 WeakPolarHBondContact O-CG 3.4Å; Q293-M297 PolarHBondContact O-N 3.05Å; G294-M297 PolarHBondContact O-N 3.46Å; I295-M297 VanDerWaalsContact C-N 3.33Å; I295-M297 PolarHBondContact O-N 3.12Å; M297-G299 VanDerWaalsContact C-N 3.28Å; M297-G299 PolarHBondContact O-N 3.34Å; M297-V300 PolarHBondContact O-N 3.43Å; M297-I301 HydrophobicContact CE-CD1 4.45Å; M297-I301 WeakPolarHBondContact O-CB 3.44Å; M297-I301 VanDerWaalsContact O-CG1 3.24Å; M297-I301 WeakPolarHBondContact O-CG1 3.43Å; M297-I301 PolarHBondContact O-N 2.93Å; M297-A315 HydrophobicContact CE-CB 3.74Å; M297-A315 HydrophobicContact SD-CB 4.13Å; M297-A319 HydrophobicContact CE-CB 4.03Å; M297-A319 HydrophobicContact CG-CB 4.44Å; M297-A319 HydrophobicContact SD-CB 3.46Å; M297-A319 WeakPolarHBondContact SD-CB 3.3Å |
| 298 | V | 82.1 | Confident | 83.3 | Confident | 19 Ų | 19 | 48.2 Ų | 48.2 | 12% | 0.115 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.6 | -42 | 175.4 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | I237 G294 I295 I301 V302 | I237-V298 HydrophobicContact CD1-CG1 4.39Å; I237-V298 HydrophobicContact CG2-CG1 4.15Å; I237-V298 HydrophobicContact CG2-CG2 3.67Å; G294-V298 WeakPolarHBondContact O-CG2 3.31Å; G294-V298 PolarHBondContact O-N 3.3Å; I295-V298 PolarHBondContact O-N 3.09Å; V298-I301 PolarHBondContact O-N 3.24Å; V298-V302 HydrophobicContact CG1-CG2 4.19Å; V298-V302 WeakPolarHBondContact O-CB 3.46Å; V298-V302 VanDerWaalsContact O-CG2 3.27Å; V298-V302 WeakPolarHBondContact O-CG2 3.46Å; V298-V302 PolarHBondContact O-N 3.11Å |
| 299 | G | 83.7 | Confident | 82.1 | Confident | 44 Ų | 44 | 47.6 Ų | 47.6 | 45% | 0.454 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -59.2 | -46.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | I295 I296 M297 G303 | I295-G299 PolarHBondContact O-N 3.15Å; I296-G299 PolarHBondContact O-N 2.98Å; M297-G299 VanDerWaalsContact C-N 3.28Å; M297-G299 PolarHBondContact O-N 3.34Å; G299-G303 PolarHBondContact O-N 3.33Å |
| 300 | V | 82 | Confident | 80.9 | Confident | 24 Ų | 24 | 50.4 Ų | 50.4 | 15% | 0.145 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.2 | -47 | 176.2 | 175.9 | 0 | 0 | 0 | 0 | 110.6 | I296 M297 V302 G303 S304 V314 A315 I318 | I296-V300 HydrophobicContact CG2-CG2 4.36Å; I296-V300 WeakPolarHBondContact O-CG2 3.41Å; I296-V300 PolarHBondContact O-N 2.67Å; M297-V300 PolarHBondContact O-N 3.43Å; V300-V302 PolarHBondContact O-N 2.82Å; V300-G303 PolarHBondContact O-N 2.85Å; V300-S304 VanDerWaalsContact O-CB 3.29Å; V300-S304 WeakPolarHBondContact O-CB 3.49Å; V300-S304 PolarHBondContact O-N 3.05Å; V300-S304 PolarHBondContact O-OG 3.14Å; V300-V314 HydrophobicContact CG1-CB 4.18Å; V300-V314 HydrophobicContact CG1-CG1 3.79Å; V300-A315 HydrophobicContact CB-CB 4.45Å; V300-A315 HydrophobicContact CG1-CB 3.84Å; V300-I318 HydrophobicContact CG1-CD1 4.22Å; V300-I318 HydrophobicContact CG2-CD1 4.03Å; V300-I318 HydrophobicContact CG2-CG2 4.1Å |
| 301 | I | 77.4 | Confident | 79.6 | Confident | 7 Ų | 7 | 50.7 Ų | 50.7 | 4% | 0.036 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.2 | -46.2 | -178 | -68.4 | 167 | 0 | 0 | 0 | 111.4 | L218 V222 M297 V298 K305 P311 A315 | L218-I301 HydrophobicContact CB-CD1 4.36Å; L218-I301 HydrophobicContact CD2-CB 4.47Å; L218-I301 HydrophobicContact CD2-CD1 3.43Å; L218-I301 VanDerWaalsContact CD2-CD1 3.43Å; L218-I301 HydrophobicContact CD2-CG2 4.17Å; L218-I301 HydrophobicContact CG-CD1 4.04Å; L218-I301 HydrophobicContact CG-CG2 4.27Å; V222-I301 HydrophobicContact CG2-CG2 4.32Å; M297-I301 HydrophobicContact CE-CD1 4.45Å; M297-I301 WeakPolarHBondContact O-CB 3.44Å; M297-I301 VanDerWaalsContact O-CG1 3.24Å; M297-I301 WeakPolarHBondContact O-CG1 3.43Å; M297-I301 PolarHBondContact O-N 2.93Å; V298-I301 PolarHBondContact O-N 3.24Å; I301-K305 PolarHBondContact O-N 3.34Å; I301-P311 HydrophobicContact CB-CB 4.15Å; I301-P311 HydrophobicContact CG1-CB 4.03Å; I301-P311 HydrophobicContact CG2-CB 3.94Å; I301-P311 HydrophobicContact CG2-CG 4.42Å; I301-A315 HydrophobicContact CG1-CB 3.9Å |
| 302 | V | 78 | Confident | 78.3 | Confident | 56 Ų | 56 | 49.7 Ų | 49.7 | 34% | 0.339 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67.3 | -39.8 | 178.1 | 175.4 | 0 | 0 | 0 | 0 | 111.2 | V298 V300 K305 K306 | V298-V302 HydrophobicContact CG1-CG2 4.19Å; V298-V302 WeakPolarHBondContact O-CB 3.46Å; V298-V302 VanDerWaalsContact O-CG2 3.27Å; V298-V302 WeakPolarHBondContact O-CG2 3.46Å; V298-V302 PolarHBondContact O-N 3.11Å; V300-V302 PolarHBondContact O-N 2.82Å; V302-K305 PolarHBondContact O-N 3.31Å; V302-K306 PolarHBondContact O-N 3.5Å; V302-K306 VanDerWaalsContact O-N 3.11Å |
| 303 | G | 79.8 | Confident | 77.1 | Confident | 33 Ų | 33 | 48.6 Ų | 48.6 | 34% | 0.34 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.4 | -43.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113 | G299 V300 K306 T307 | G299-G303 PolarHBondContact O-N 3.33Å; V300-G303 PolarHBondContact O-N 2.85Å; G303-K306 PolarHBondContact O-N 2.9Å; G303-T307 PolarHBondContact O-N 2.98Å; G303-T307 VanDerWaalsContact O-N 3.08Å; G303-T307 PolarHBondContact O-OG1 3.48Å |
| 304 | S | 76.2 | Confident | 76.4 | Confident | 7 Ų | 7 | 50 Ų | 50 | 5% | 0.049 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.3 | -45.1 | 175.1 | -65.5 | 0 | 0 | 0 | 0 | 111.2 | V300 K306 T307 G308 I309 | V300-S304 VanDerWaalsContact O-CB 3.29Å; V300-S304 WeakPolarHBondContact O-CB 3.49Å; V300-S304 PolarHBondContact O-N 3.05Å; V300-S304 PolarHBondContact O-OG 3.14Å; S304-K306 VanDerWaalsContact C-N 3.3Å; S304-K306 PolarHBondContact O-N 3.43Å; S304-T307 WeakPolarHBondContact CA-OG1 3.41Å; S304-T307 CarbonylContact O-C 3.55Å; S304-T307 PolarHBondContact O-N 3.42Å; S304-T307 VanDerWaalsContact O-N 3.11Å; S304-T307 PolarHBondContact O-OG1 2.98Å; S304-G308 PolarHBondContact O-N 2.95Å; S304-I309 CarbonylContact C-O 3.54Å; S304-I309 VanDerWaalsContact C-O 3.26Å; S304-I309 WeakPolarHBondContact CB-O 3.45Å; S304-I309 PolarHBondContact O-N 2.87Å; S304-I309 VanDerWaalsContact O-O 3.06Å |
| 305 | K | 73.1 | Confident | 75.8 | Confident | 91 Ų | 91 | 50 Ų | 50 | 40% | 0.396 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -58.1 | -41 | 174.2 | -172.2 | 176.8 | -177.4 | 173.7 | 0 | 112.2 | I301 V302 T307 G308 | I301-K305 PolarHBondContact O-N 3.34Å; V302-K305 PolarHBondContact O-N 3.31Å; K305-T307 VanDerWaalsContact C-N 3.29Å; K305-T307 PolarHBondContact O-N 2.91Å; K305-G308 PolarHBondContact O-N 3.2Å |
| 306 | K | 78 | Confident | 75 | Confident | 193 Ų | 193 | 48 Ų | 48 | 84% | 0.839 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -68.7 | -27.9 | 179.5 | -168.2 | 177.1 | 179.1 | -179.1 | 0 | 113 | V302 G303 S304 | V302-K306 PolarHBondContact O-N 3.5Å; V302-K306 VanDerWaalsContact O-N 3.11Å; G303-K306 PolarHBondContact O-N 2.9Å; S304-K306 VanDerWaalsContact C-N 3.3Å; S304-K306 PolarHBondContact O-N 3.43Å |
| 307 | T | 76.6 | Confident | 74.4 | Confident | 94 Ų | 94 | 45.8 Ų | 45.8 | 58% | 0.577 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -94.3 | -1.8 | 179.4 | 52 | 0 | 0 | 0 | 0 | 113.3 | G303 S304 K305 I309 | G303-T307 PolarHBondContact O-N 2.98Å; G303-T307 VanDerWaalsContact O-N 3.08Å; G303-T307 PolarHBondContact O-OG1 3.48Å; S304-T307 WeakPolarHBondContact CA-OG1 3.41Å; S304-T307 CarbonylContact O-C 3.55Å; S304-T307 PolarHBondContact O-N 3.42Å; S304-T307 VanDerWaalsContact O-N 3.11Å; S304-T307 PolarHBondContact O-OG1 2.98Å; K305-T307 VanDerWaalsContact C-N 3.29Å; K305-T307 PolarHBondContact O-N 2.91Å; T307-I309 PolarHBondContact O-N 2.92Å |
| 308 | G | 70.6 | Confident | 74.2 | Confident | 64 Ų | 64 | 47.4 Ų | 47.4 | 66% | 0.66 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.5 | 9.9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114 | S304 K305 | S304-G308 PolarHBondContact O-N 2.95Å; K305-G308 PolarHBondContact O-N 3.2Å |
| 309 | I | 70.6 | Confident | 74 | Confident | 51 Ų | 51 | 47 Ų | 47 | 26% | 0.262 | 28% | 0.284 | S | S | . | . | trans | -86.6 | 138.7 | 175.8 | -57.4 | 174.1 | 0 | 0 | 0 | 107.9 | S304 T307 P311 V314 | S304-I309 CarbonylContact C-O 3.54Å; S304-I309 VanDerWaalsContact C-O 3.26Å; S304-I309 WeakPolarHBondContact CB-O 3.45Å; S304-I309 PolarHBondContact O-N 2.87Å; S304-I309 VanDerWaalsContact O-O 3.06Å; T307-I309 PolarHBondContact O-N 2.92Å; I309-P311 WeakPolarHBondContact O-CD 3.34Å; I309-V314 HydrophobicContact CG2-CG2 3.62Å | ||
| 310 | N | 65.8 | Low | 73.7 | Confident | 59 Ų | 59 | 45.5 Ų | 45.5 | 32% | 0.316 | 27% | 0.266 | S | S | . | . | trans | -60.4 | 121.4 | 174.7 | -174.7 | -29.6 | 0 | 0 | 0 | 109.3 | D312 N313 | N310-D312 PolarHBondContact O-N 2.85Å; N310-D312 WeakPolarHBondContact OD1-CB 3.28Å; N310-D312 PolarHBondContact OD1-N 3.1Å; N310-N313 PolarHBondContact O-N 3.33Å | ||
| 311 | P | 64.1 | Low | 73.6 | Confident | 9 Ų | 9 | 44.9 Ų | 44.9 | 6% | 0.058 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.8 | -32.2 | -179.3 | 22.9 | -33.8 | 0 | 0 | 0 | 113.3 | I301 I309 N313 V314 A315 | I301-P311 HydrophobicContact CB-CB 4.15Å; I301-P311 HydrophobicContact CG1-CB 4.03Å; I301-P311 HydrophobicContact CG2-CB 3.94Å; I301-P311 HydrophobicContact CG2-CG 4.42Å; I309-P311 WeakPolarHBondContact O-CD 3.34Å; P311-N313 VanDerWaalsContact C-N 3.28Å; P311-N313 PolarHBondContact O-N 2.85Å; P311-V314 PolarHBondContact O-N 3.42Å; P311-A315 WeakPolarHBondContact O-CA 3.45Å; P311-A315 WeakPolarHBondContact O-CB 3.22Å; P311-A315 PolarHBondContact O-N 3.48Å |
| 312 | D | 63.8 | Low | 73.9 | Confident | 45 Ų | 45 | 49.3 Ų | 49.3 | 24% | 0.241 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -67.9 | -31.4 | -176.6 | -63.1 | -20.1 | 0 | 0 | 0 | 112.8 | S219 N310 V314 T316 | S219-D312 WeakPolarHBondContact CB-OD1 3.49Å; S219-D312 WeakPolarHBondContact CB-OD2 3.35Å; S219-D312 PolarHBondContact OG-OD1 3.04Å; S219-D312 PolarHBondContact OG-OD2 3.4Å; N310-D312 PolarHBondContact O-N 2.85Å; N310-D312 WeakPolarHBondContact OD1-CB 3.28Å; N310-D312 PolarHBondContact OD1-N 3.1Å; D312-V314 PolarHBondContact O-N 2.99Å; D312-T316 WeakPolarHBondContact O-CB 3.28Å; D312-T316 PolarHBondContact O-N 2.97Å; D312-T316 PolarHBondContact O-OG1 3.18Å |
| 313 | N | 66.8 | Low | 74.3 | Confident | 52 Ų | 52 | 46.7 Ų | 46.7 | 28% | 0.278 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -71.8 | -17.6 | -179.3 | -66.5 | -4.6 | 0 | 0 | 0 | 112.5 | N310 P311 | N310-N313 PolarHBondContact O-N 3.33Å; P311-N313 VanDerWaalsContact C-N 3.28Å; P311-N313 PolarHBondContact O-N 2.85Å |
| 314 | V | 71.4 | Confident | 74.7 | Confident | 41 Ų | 41 | 45.6 Ų | 45.6 | 25% | 0.248 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -118.7 | -40.8 | -174.5 | -175.5 | 0 | 0 | 0 | 0 | 111.2 | V300 I309 P311 D312 P317 I318 | V300-V314 HydrophobicContact CG1-CB 4.18Å; V300-V314 HydrophobicContact CG1-CG1 3.79Å; I309-V314 HydrophobicContact CG2-CG2 3.62Å; P311-V314 PolarHBondContact O-N 3.42Å; D312-V314 PolarHBondContact O-N 2.99Å; V314-P317 WeakPolarHBondContact O-CD 3.26Å; V314-I318 HydrophobicContact CG1-CD1 3.55Å; V314-I318 HydrophobicContact CG1-CG1 4.43Å; V314-I318 VanDerWaalsContact O-CB 3.31Å; V314-I318 WeakPolarHBondContact O-CB 3.31Å; V314-I318 WeakPolarHBondContact O-CD1 3.45Å; V314-I318 WeakPolarHBondContact O-CG1 3.31Å; V314-I318 PolarHBondContact O-N 3.45Å |
| 315 | A | 74.3 | Confident | 75.4 | Confident | 1 Ų | 1 | 47.2 Ų | 47.2 | 1% | 0.008 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -67.2 | -46.5 | -179 | 0 | 0 | 0 | 0 | 0 | 111.3 | M297 V300 I301 P311 I318 A319 | M297-A315 HydrophobicContact CE-CB 3.74Å; M297-A315 HydrophobicContact SD-CB 4.13Å; V300-A315 HydrophobicContact CB-CB 4.45Å; V300-A315 HydrophobicContact CG1-CB 3.84Å; I301-A315 HydrophobicContact CG1-CB 3.9Å; P311-A315 WeakPolarHBondContact O-CA 3.45Å; P311-A315 WeakPolarHBondContact O-CB 3.22Å; P311-A315 PolarHBondContact O-N 3.48Å; A315-I318 PolarHBondContact O-N 3.1Å; A315-A319 VanDerWaalsContact O-CB 3.25Å; A315-A319 WeakPolarHBondContact O-CB 3.39Å; A315-A319 PolarHBondContact O-N 3.26Å |
| 316 | T | 71.8 | Confident | 76.3 | Confident | 57 Ų | 57 | 44 Ų | 44 | 35% | 0.35 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.8 | -48.1 | -177.5 | -43.2 | 0 | 0 | 0 | 0 | 112.3 | D312 A320 | D312-T316 WeakPolarHBondContact O-CB 3.28Å; D312-T316 PolarHBondContact O-N 2.97Å; D312-T316 PolarHBondContact O-OG1 3.18Å; T316-A320 VanDerWaalsContact O-CB 3.3Å; T316-A320 WeakPolarHBondContact O-CB 3.18Å; T316-A320 PolarHBondContact O-N 3.46Å |
| 317 | P | 73.2 | Confident | 77 | Confident | 11 Ų | 11 | 35.2 Ų | 35.2 | 7% | 0.071 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -68.4 | -36.1 | 177.7 | -23.3 | 37.5 | 0 | 0 | 0 | 113.8 | P166 L169 V314 A320 S321 | P166-P317 HydrophobicContact CB-CB 4.17Å; P166-P317 HydrophobicContact CB-CG 3.66Å; P166-P317 HydrophobicContact CG-CG 3.87Å; L169-P317 HydrophobicContact CD2-CB 3.81Å; V314-P317 WeakPolarHBondContact O-CD 3.26Å; P317-A320 PolarHBondContact O-N 2.9Å; P317-S321 VanDerWaalsContact O-CB 3.26Å; P317-S321 WeakPolarHBondContact O-CB 3.33Å; P317-S321 PolarHBondContact O-N 3.01Å |
| 318 | I | 79 | Confident | 77.9 | Confident | 37 Ų | 37 | 30.8 Ų | 30.8 | 19% | 0.19 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -68.9 | -42.3 | 177.9 | -70.1 | 177.7 | 0 | 0 | 0 | 110.5 | L169 I296 V300 V314 A315 S321 F322 | L169-I318 HydrophobicContact CD2-CG1 4.17Å; I296-I318 HydrophobicContact CG2-CG2 4.31Å; V300-I318 HydrophobicContact CG1-CD1 4.22Å; V300-I318 HydrophobicContact CG2-CD1 4.03Å; V300-I318 HydrophobicContact CG2-CG2 4.1Å; V314-I318 HydrophobicContact CG1-CD1 3.55Å; V314-I318 HydrophobicContact CG1-CG1 4.43Å; V314-I318 VanDerWaalsContact O-CB 3.31Å; V314-I318 WeakPolarHBondContact O-CB 3.31Å; V314-I318 WeakPolarHBondContact O-CD1 3.45Å; V314-I318 WeakPolarHBondContact O-CG1 3.31Å; V314-I318 PolarHBondContact O-N 3.45Å; A315-I318 PolarHBondContact O-N 3.1Å; I318-S321 PolarHBondContact O-N 2.82Å; I318-F322 HydrophobicContact CG2-CD2 3.81Å; I318-F322 HydrophobicContact CG2-CE2 4.3Å; I318-F322 PolarHBondContact O-N 3.4Å |
| 319 | A | 78.2 | Confident | 79 | Confident | 12 Ų | 12 | 29.2 Ų | 29.2 | 10% | 0.099 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -56.1 | -53.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110 | K207 M297 A315 S321 G323 | K207-A319 WeakPolarHBondContact CE-O 3.35Å; K207-A319 PolarHBondContact NZ-O 2.93Å; M297-A319 HydrophobicContact CE-CB 4.03Å; M297-A319 HydrophobicContact CG-CB 4.44Å; M297-A319 HydrophobicContact SD-CB 3.46Å; M297-A319 WeakPolarHBondContact SD-CB 3.3Å; A315-A319 VanDerWaalsContact O-CB 3.25Å; A315-A319 WeakPolarHBondContact O-CB 3.39Å; A315-A319 PolarHBondContact O-N 3.26Å; A319-S321 VanDerWaalsContact C-N 3.27Å; A319-S321 PolarHBondContact O-N 3.32Å; A319-G323 WeakPolarHBondContact O-CA 3.16Å; A319-G323 PolarHBondContact O-N 3.14Å |
| 320 | A | 77.1 | Confident | 80.3 | Confident | 11 Ų | 11 | 28.1 Ų | 28.1 | 9% | 0.091 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -57.3 | -39.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A170 K207 T316 P317 | A170-A320 HydrophobicContact CB-CB 3.66Å; K207-A320 VanDerWaalsContact NZ-C 3.26Å; K207-A320 VanDerWaalsContact NZ-CA 3.29Å; K207-A320 PolarHBondContact NZ-O 3.43Å; T316-A320 VanDerWaalsContact O-CB 3.3Å; T316-A320 WeakPolarHBondContact O-CB 3.18Å; T316-A320 PolarHBondContact O-N 3.46Å; P317-A320 PolarHBondContact O-N 2.9Å |
| 321 | S | 79.3 | Confident | 81.7 | Confident | 11 Ų | 11 | 25.4 Ų | 25.4 | 8% | 0.077 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -75.6 | -52.5 | -178.7 | -167.9 | 0 | 0 | 0 | 0 | 113.5 | L169 G173 P317 I318 A319 | L169-S321 VanDerWaalsContact O-CB 3.24Å; L169-S321 WeakPolarHBondContact O-CB 3.32Å; L169-S321 PolarHBondContact O-OG 2.97Å; G173-S321 CarbonylContact C-O 3.58Å; G173-S321 WeakPolarHBondContact CA-O 3.4Å; G173-S321 WeakPolarHBondContact CA-OG 3.21Å; G173-S321 PolarHBondContact N-OG 3.44Å; P317-S321 VanDerWaalsContact O-CB 3.26Å; P317-S321 WeakPolarHBondContact O-CB 3.33Å; P317-S321 PolarHBondContact O-N 3.01Å; I318-S321 PolarHBondContact O-N 2.82Å; A319-S321 VanDerWaalsContact C-N 3.27Å; A319-S321 PolarHBondContact O-N 3.32Å |
| 322 | F | 84 | Confident | 83.3 | Confident | 100 Ų | 100 | 25 Ų | 25 | 44% | 0.439 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -85.5 | -25.2 | -172.4 | -75.8 | -80.9 | 0 | 0 | 0 | 113.6 | I318 D324 L325 I326 | I318-F322 HydrophobicContact CG2-CD2 3.81Å; I318-F322 HydrophobicContact CG2-CE2 4.3Å; I318-F322 PolarHBondContact O-N 3.4Å; F322-D324 PolarHBondContact O-N 2.75Å; F322-L325 PolarHBondContact O-N 2.93Å; F322-I326 HydrophobicContact CB-CD1 3.97Å; F322-I326 WeakPolarHBondContact O-CB 3.46Å; F322-I326 VanDerWaalsContact O-CG1 3.23Å; F322-I326 WeakPolarHBondContact O-CG1 3.29Å; F322-I326 PolarHBondContact O-N 3.31Å |
| 323 | G | 86.9 | Confident | 84.8 | Confident | 2 Ų | 2 | 31.9 Ų | 31.9 | 2% | 0.021 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.9 | -45 | -172.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q293 A319 I326 T327 | Q293-G323 VanDerWaalsContact NE2-CA 3.33Å; Q293-G323 PolarHBondContact NE2-O 3.5Å; A319-G323 WeakPolarHBondContact O-CA 3.16Å; A319-G323 PolarHBondContact O-N 3.14Å; G323-I326 PolarHBondContact O-N 3.21Å; G323-T327 WeakPolarHBondContact O-CB 3.13Å; G323-T327 PolarHBondContact O-N 3.26Å; G323-T327 PolarHBondContact O-OG1 2.94Å |
| 324 | D | 88.3 | Confident | 86.3 | Confident | 9 Ų | 9 | 30.9 Ų | 30.9 | 5% | 0.048 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -71.6 | -44.2 | -175.4 | -61.8 | 0.8 | 0 | 0 | 0 | 110.4 | A177 L204 K207 F322 I326 T327 L328 | A177-D324 HydrophobicContact CB-CB 3.92Å; L204-D324 HydrophobicContact CD2-CB 3.79Å; K207-D324 WeakPolarHBondContact CD-OD1 3.33Å; K207-D324 IonicContact NZ-OD1 2.73Å; K207-D324 PolarHBondContact NZ-OD1 3.35Å; K207-D324 IonicContact NZ-OD2 3.85Å; F322-D324 PolarHBondContact O-N 2.75Å; D324-I326 PolarHBondContact O-N 3.22Å; D324-T327 PolarHBondContact O-N 3.41Å; D324-L328 VanDerWaalsContact O-CB 3.25Å; D324-L328 WeakPolarHBondContact O-CB 3.35Å; D324-L328 PolarHBondContact O-N 2.84Å |
| 325 | L | 91.1 | Very high | 87.4 | Confident | 42 Ų | 42 | 28.9 Ų | 28.9 | 22% | 0.22 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -57 | -49.2 | 175.6 | 176.5 | 61.7 | 0 | 0 | 0 | 111.6 | A177 V180 F322 A329 | A177-L325 HydrophobicContact CB-CB 4.43Å; V180-L325 HydrophobicContact CB-CD1 4.4Å; V180-L325 HydrophobicContact CG2-CD1 3.51Å; F322-L325 PolarHBondContact O-N 2.93Å; L325-A329 WeakPolarHBondContact O-CB 3.47Å; L325-A329 PolarHBondContact O-N 3.21Å |
| 326 | I | 92.3 | Very high | 88.5 | Confident | 23 Ų | 23 | 30.5 Ų | 30.5 | 12% | 0.118 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.1 | -47.7 | -179.9 | -72.9 | 170.7 | 0 | 0 | 0 | 110.7 | A289 L292 Q293 I296 F322 G323 D324 L328 A329 I330 | A289-I326 HydrophobicContact CB-CG2 4.49Å; L292-I326 HydrophobicContact CD2-CD1 4.45Å; L292-I326 HydrophobicContact CD2-CG2 3.83Å; L292-I326 HydrophobicContact CG-CG2 4.43Å; Q293-I326 HydrophobicContact CG-CG2 4.42Å; I296-I326 HydrophobicContact CD1-CD1 3.58Å; F322-I326 HydrophobicContact CB-CD1 3.97Å; F322-I326 WeakPolarHBondContact O-CB 3.46Å; F322-I326 VanDerWaalsContact O-CG1 3.23Å; F322-I326 WeakPolarHBondContact O-CG1 3.29Å; F322-I326 PolarHBondContact O-N 3.31Å; G323-I326 PolarHBondContact O-N 3.21Å; D324-I326 PolarHBondContact O-N 3.22Å; I326-L328 PolarHBondContact O-N 3.04Å; I326-A329 PolarHBondContact O-N 2.87Å; I326-I330 HydrophobicContact CG2-CD1 3.57Å; I326-I330 HydrophobicContact CG2-CG1 4.46Å; I326-I330 WeakPolarHBondContact O-CB 3.29Å; I326-I330 VanDerWaalsContact O-CG1 3.24Å; I326-I330 WeakPolarHBondContact O-CG1 3.24Å; I326-I330 PolarHBondContact O-N 3.33Å |
| 327 | T | 92.8 | Very high | 89.6 | Confident | 8 Ų | 8 | 29.5 Ų | 29.5 | 5% | 0.049 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.3 | -47.3 | -176.9 | -53 | 0 | 0 | 0 | 0 | 110.9 | L203 L204 T285 A289 Q293 G323 D324 I330 L331 | L203-T327 HydrophobicContact CB-CG2 4.05Å; L204-T327 HydrophobicContact CD2-CG2 4.33Å; T285-T327 HydrophobicContact CG2-CG2 4.28Å; A289-T327 HydrophobicContact CB-CG2 4.26Å; Q293-T327 PolarHBondContact NE2-OG1 3.16Å; G323-T327 WeakPolarHBondContact O-CB 3.13Å; G323-T327 PolarHBondContact O-N 3.26Å; G323-T327 PolarHBondContact O-OG1 2.94Å; D324-T327 PolarHBondContact O-N 3.41Å; T327-I330 PolarHBondContact O-N 2.92Å; T327-L331 WeakPolarHBondContact O-CB 3.41Å; T327-L331 PolarHBondContact O-N 2.96Å |
| 328 | L | 93.9 | Very high | 90.6 | Very high | 2 Ų | 2 | 29.7 Ų | 29.7 | 1% | 0.01 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.9 | -41.8 | -178.1 | -164.4 | 147.7 | 0 | 0 | 0 | 112 | V180 L181 V184 V200 L204 D324 I326 L331 A332 | V180-L328 HydrophobicContact CB-CD2 3.81Å; V180-L328 HydrophobicContact CG1-CD2 3.42Å; V180-L328 VanDerWaalsContact CG1-CD2 3.42Å; L181-L328 HydrophobicContact CB-CD1 3.82Å; L181-L328 HydrophobicContact CB-CD2 3.98Å; L181-L328 HydrophobicContact CB-CG 4.5Å; L181-L328 HydrophobicContact CD1-CD1 3.93Å; L181-L328 HydrophobicContact CD1-CD2 4.12Å; L181-L328 HydrophobicContact CD1-CG 4.23Å; L181-L328 HydrophobicContact CD2-CD1 4.16Å; L181-L328 HydrophobicContact CG-CD1 4.12Å; V184-L328 HydrophobicContact CG2-CD2 4.3Å; V200-L328 HydrophobicContact CG1-CD1 4.04Å; L204-L328 HydrophobicContact CD1-CD1 4.33Å; D324-L328 VanDerWaalsContact O-CB 3.25Å; D324-L328 WeakPolarHBondContact O-CB 3.35Å; D324-L328 PolarHBondContact O-N 2.84Å; I326-L328 PolarHBondContact O-N 3.04Å; L328-L331 WeakPolarHBondContact O-CB 3.3Å; L328-L331 PolarHBondContact O-N 2.94Å; L328-A332 WeakPolarHBondContact O-CB 3.46Å; L328-A332 PolarHBondContact O-N 3.24Å |
| 329 | A | 95.3 | Very high | 91.4 | Very high | 30 Ų | 30 | 30 Ų | 30 | 25% | 0.248 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.3 | -45.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V180 L325 I326 A332 W333 | V180-A329 HydrophobicContact CG1-CB 4.46Å; L325-A329 WeakPolarHBondContact O-CB 3.47Å; L325-A329 PolarHBondContact O-N 3.21Å; I326-A329 PolarHBondContact O-N 2.87Å; A329-A332 PolarHBondContact O-N 3.05Å; A329-W333 VanDerWaalsContact O-CD1 3.31Å; A329-W333 PolarHBondContact O-N 3.36Å |
| 330 | I | 96.6 | Very high | 92 | Very high | 28 Ų | 28 | 33.7 Ų | 33.7 | 14% | 0.144 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.1 | -42.2 | 177 | -68.6 | 168.9 | 0 | 0 | 0 | 110.6 | T285 I288 A289 L292 I326 T327 A332 W333 I334 | T285-I330 HydrophobicContact CG2-CB 4.42Å; T285-I330 HydrophobicContact CG2-CG2 4.07Å; I288-I330 HydrophobicContact CB-CG2 4.37Å; I288-I330 HydrophobicContact CG2-CD1 4.02Å; I288-I330 HydrophobicContact CG2-CG2 4.39Å; A289-I330 HydrophobicContact CB-CD1 3.98Å; L292-I330 HydrophobicContact CD2-CD1 4.3Å; I326-I330 HydrophobicContact CG2-CD1 3.57Å; I326-I330 HydrophobicContact CG2-CG1 4.46Å; I326-I330 WeakPolarHBondContact O-CB 3.29Å; I326-I330 VanDerWaalsContact O-CG1 3.24Å; I326-I330 WeakPolarHBondContact O-CG1 3.24Å; I326-I330 PolarHBondContact O-N 3.33Å; T327-I330 PolarHBondContact O-N 2.92Å; I330-A332 PolarHBondContact O-N 3.31Å; I330-W333 PolarHBondContact O-N 3.41Å; I330-I334 HydrophobicContact CG2-CD1 3.47Å; I330-I334 VanDerWaalsContact CG2-CD1 3.47Å; I330-I334 HydrophobicContact CG2-CG1 4.11Å; I330-I334 WeakPolarHBondContact O-CB 3.48Å; I330-I334 WeakPolarHBondContact O-CG1 3.17Å; I330-I334 PolarHBondContact O-N 3.08Å |
| 331 | L | 96.2 | Very high | 92.7 | Very high | 2 Ų | 2 | 35.2 Ų | 35.2 | 1% | 0.01 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -54.7 | -51.4 | 175 | -175.6 | 60.5 | 0 | 0 | 0 | 111.7 | V196 L199 V200 L203 T285 T327 L328 S335 | V196-L331 HydrophobicContact CG1-CD2 4.16Å; V196-L331 HydrophobicContact CG1-CG 4.37Å; L199-L331 HydrophobicContact CD2-CD1 3.82Å; V200-L331 HydrophobicContact CG2-CD2 3.75Å; L203-L331 HydrophobicContact CD1-CD1 3.92Å; L203-L331 HydrophobicContact CD1-CD2 4.17Å; T285-L331 HydrophobicContact CG2-CB 3.78Å; T285-L331 HydrophobicContact CG2-CD1 4.14Å; T285-L331 WeakPolarHBondContact OG1-CA 3.24Å; T327-L331 WeakPolarHBondContact O-CB 3.41Å; T327-L331 PolarHBondContact O-N 2.96Å; L328-L331 WeakPolarHBondContact O-CB 3.3Å; L328-L331 PolarHBondContact O-N 2.94Å; L331-S335 WeakPolarHBondContact O-CB 3.37Å; L331-S335 PolarHBondContact O-N 3.44Å; L331-S335 PolarHBondContact O-OG 2.86Å |
| 332 | A | 96.3 | Very high | 93 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.4 | -46.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | V184 W187 F190 L328 A329 I330 Q336 | V184-A332 HydrophobicContact CB-CB 3.85Å; V184-A332 HydrophobicContact CG1-CB 3.52Å; V184-A332 HydrophobicContact CG2-CB 3.96Å; W187-A332 HydrophobicContact CZ3-CB 4.14Å; F190-A332 HydrophobicContact CE2-CB 3.93Å; F190-A332 HydrophobicContact CZ-CB 4.18Å; L328-A332 WeakPolarHBondContact O-CB 3.46Å; L328-A332 PolarHBondContact O-N 3.24Å; A329-A332 PolarHBondContact O-N 3.05Å; I330-A332 PolarHBondContact O-N 3.31Å; A332-Q336 WeakPolarHBondContact O-CB 3.05Å; A332-Q336 PolarHBondContact O-N 3.42Å |
| 333 | W | 96.8 | Very high | 92.9 | Very high | 190 Ų | 190 | 39.9 Ų | 39.9 | 72% | 0.72 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -64.3 | -47.1 | -179.9 | -91.1 | 81.6 | 0 | 0 | 0 | 113.1 | A329 I330 G337 | A329-W333 VanDerWaalsContact O-CD1 3.31Å; A329-W333 PolarHBondContact O-N 3.36Å; I330-W333 PolarHBondContact O-N 3.41Å; W333-G337 PolarHBondContact O-N 3.08Å |
| 334 | I | 96.9 | Very high | 92.8 | Very high | 31 Ų | 31 | 44.4 Ų | 44.4 | 16% | 0.159 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -67.3 | -45.2 | 179.8 | -67.1 | 179.1 | 0 | 0 | 0 | 110.2 | A284 I288 I330 Q336 G337 L338 | A284-I334 HydrophobicContact CB-CD1 4Å; A284-I334 HydrophobicContact CB-CG2 4.1Å; I288-I334 HydrophobicContact CD1-CD1 3.69Å; I330-I334 HydrophobicContact CG2-CD1 3.47Å; I330-I334 VanDerWaalsContact CG2-CD1 3.47Å; I330-I334 HydrophobicContact CG2-CG1 4.11Å; I330-I334 WeakPolarHBondContact O-CB 3.48Å; I330-I334 WeakPolarHBondContact O-CG1 3.17Å; I330-I334 PolarHBondContact O-N 3.08Å; I334-Q336 PolarHBondContact O-N 3.15Å; I334-G337 PolarHBondContact O-N 3.29Å; I334-L338 HydrophobicContact CG2-CD1 3.85Å; I334-L338 HydrophobicContact CG2-CG 4.22Å; I334-L338 WeakPolarHBondContact O-CB 3.41Å; I334-L338 WeakPolarHBondContact O-CG 3.3Å; I334-L338 PolarHBondContact O-N 2.9Å |
| 335 | S | 96.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.9 | -46.1 | -179.9 | -56.3 | 0 | 0 | 0 | 0 | 111 | S281 L331 Y339 | S281-S335 WeakPolarHBondContact CB-OG 3.21Å; S281-S335 PolarHBondContact OG-OG 3.07Å; L331-S335 WeakPolarHBondContact O-CB 3.37Å; L331-S335 PolarHBondContact O-N 3.44Å; L331-S335 PolarHBondContact O-OG 2.86Å; S335-Y339 WeakPolarHBondContact O-CB 3.42Å; S335-Y339 PolarHBondContact O-N 3.36Å |
| 336 | Q | 96 | Very high | 92.6 | Very high | 35 Ų | 35 | 56 Ų | 56 | 16% | 0.164 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65 | -42.5 | 177.4 | -176.7 | 61.7 | 40.8 | 0 | 0 | 112.3 | W187 V189 A332 I334 Y339 T340 | W187-Q336 HydrophobicContact CE3-CB 3.75Å; W187-Q336 HydrophobicContact CE3-CG 3.85Å; W187-Q336 HydrophobicContact CZ3-CB 3.9Å; W187-Q336 HydrophobicContact CZ3-CG 4.16Å; V189-Q336 HydrophobicContact CG1-CB 4.11Å; A332-Q336 WeakPolarHBondContact O-CB 3.05Å; A332-Q336 PolarHBondContact O-N 3.42Å; I334-Q336 PolarHBondContact O-N 3.15Å; Q336-Y339 PolarHBondContact O-N 3.28Å; Q336-T340 PolarHBondContact NE2-OG1 2.79Å; Q336-T340 WeakPolarHBondContact O-CB 3.32Å; Q336-T340 PolarHBondContact O-N 2.91Å; Q336-T340 PolarHBondContact O-OG1 3.27Å |
| 337 | G | 94.8 | Very high | 92.5 | Very high | 36 Ų | 36 | 60.6 Ų | 60.6 | 37% | 0.371 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -61.6 | -49.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | W333 I334 Y339 T340 C341 | W333-G337 PolarHBondContact O-N 3.08Å; I334-G337 PolarHBondContact O-N 3.29Å; G337-Y339 VanDerWaalsContact C-N 3.35Å; G337-Y339 PolarHBondContact O-N 3.25Å; G337-T340 PolarHBondContact O-N 2.82Å; G337-C341 PolarHBondContact O-N 3.32Å; G337-C341 VanDerWaalsContact O-N 3.16Å; G337-C341 PolarHBondContact O-SG 3.35Å; G337-C341 VanDerWaalsContact O-SG 3.37Å |
| 338 | L | 95 | Very high | 92.5 | Very high | 14 Ų | 14 | 62 Ų | 62 | 7% | 0.073 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.6 | -35.7 | 177.3 | -66.9 | -179.4 | 0 | 0 | 0 | 112.3 | L277 I334 C341 L342 V348 V352 | L277-L338 VanDerWaalsContact CD1-C 3.47Å; L277-L338 HydrophobicContact CD1-CB 3.23Å; L277-L338 HydrophobicContact CD1-CD1 4.4Å; L277-L338 HydrophobicContact CD1-CG 4.44Å; I334-L338 HydrophobicContact CG2-CD1 3.85Å; I334-L338 HydrophobicContact CG2-CG 4.22Å; I334-L338 WeakPolarHBondContact O-CB 3.41Å; I334-L338 WeakPolarHBondContact O-CG 3.3Å; I334-L338 PolarHBondContact O-N 2.9Å; L338-C341 PolarHBondContact O-N 3.04Å; L338-L342 PolarHBondContact O-N 3.45Å; L338-L342 VanDerWaalsContact O-N 3.08Å; L338-V348 HydrophobicContact CD2-CG1 4.05Å; L338-V352 HydrophobicContact CD1-CG1 4.49Å; L338-V352 HydrophobicContact CD2-CB 4.38Å; L338-V352 HydrophobicContact CD2-CG2 4.09Å |
| 339 | Y | 94.6 | Very high | 92.4 | Very high | 44 Ų | 44 | 62.1 Ų | 62.1 | 17% | 0.173 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -63.5 | -44.8 | 176.1 | -177.5 | -100.3 | 0 | 0 | 0 | 111.4 | D188 V189 N192 V193 L277 S335 Q336 G337 C341 L342 | D188-Y339 HydrophobicContact CB-CD1 4.39Å; D188-Y339 HydrophobicContact CB-CE1 3.9Å; V189-Y339 HydrophobicContact CB-CD1 4.26Å; V189-Y339 HydrophobicContact CB-CD2 4.42Å; V189-Y339 HydrophobicContact CB-CG 3.95Å; V189-Y339 HydrophobicContact CG2-CD2 4.13Å; V189-Y339 HydrophobicContact CG2-CG 3.98Å; N192-Y339 HydrophobicContact CB-CE2 4.18Å; N192-Y339 WeakPolarHBondContact CB-OH 3.38Å; N192-Y339 PolarHBondContact ND2-OH 2.89Å; V193-Y339 HydrophobicContact CG2-CD2 4.01Å; V193-Y339 HydrophobicContact CG2-CE2 3.96Å; L277-Y339 HydrophobicContact CD2-CD2 3.76Å; L277-Y339 HydrophobicContact CD2-CG 4.43Å; S335-Y339 WeakPolarHBondContact O-CB 3.42Å; S335-Y339 PolarHBondContact O-N 3.36Å; Q336-Y339 PolarHBondContact O-N 3.28Å; G337-Y339 VanDerWaalsContact C-N 3.35Å; G337-Y339 PolarHBondContact O-N 3.25Å; Y339-C341 PolarHBondContact O-N 3.4Å; Y339-L342 WeakPolarHBondContact O-CB 3.15Å; Y339-L342 PolarHBondContact O-N 3.42Å |
| 340 | T | 92.6 | Very high | 92.4 | Very high | 90 Ų | 90 | 63.2 Ų | 63.2 | 55% | 0.552 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -62.8 | -33.5 | 177 | -51.2 | 0 | 0 | 0 | 0 | 111.5 | Q336 G337 L342 | Q336-T340 PolarHBondContact NE2-OG1 2.79Å; Q336-T340 WeakPolarHBondContact O-CB 3.32Å; Q336-T340 PolarHBondContact O-N 2.91Å; Q336-T340 PolarHBondContact O-OG1 3.27Å; G337-T340 PolarHBondContact O-N 2.82Å; T340-L342 VanDerWaalsContact C-N 3.33Å |
| 341 | C | 90.3 | Very high | 92.3 | Very high | 43 Ų | 43 | 67.1 Ų | 67.1 | 29% | 0.291 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -78.5 | -13.1 | 175.2 | -66.3 | 0 | 0 | 0 | 0 | 113.9 | G337 L338 Y339 E343 T344 Y345 | G337-C341 PolarHBondContact O-N 3.32Å; G337-C341 VanDerWaalsContact O-N 3.16Å; G337-C341 PolarHBondContact O-SG 3.35Å; G337-C341 VanDerWaalsContact O-SG 3.37Å; L338-C341 PolarHBondContact O-N 3.04Å; Y339-C341 PolarHBondContact O-N 3.4Å; C341-E343 PolarHBondContact O-N 2.8Å; C341-T344 PolarHBondContact O-N 3.44Å; C341-Y345 CarbonylContact O-C 3.55Å; C341-Y345 VanDerWaalsContact O-C 3.28Å; C341-Y345 WeakPolarHBondContact O-CA 3.44Å; C341-Y345 PolarHBondContact O-N 3.25Å |
| 342 | L | 87.3 | Confident | 92.3 | Very high | 25 Ų | 25 | 68.6 Ų | 68.6 | 13% | 0.131 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.5 | -43.2 | -170.1 | -167.9 | 68.8 | 0 | 0 | 0 | 112.4 | D273 L338 Y339 T340 | D273-L342 HydrophobicContact CB-CD1 4.24Å; D273-L342 HydrophobicContact CB-CD2 4.17Å; L338-L342 PolarHBondContact O-N 3.45Å; L338-L342 VanDerWaalsContact O-N 3.08Å; Y339-L342 WeakPolarHBondContact O-CB 3.15Å; Y339-L342 PolarHBondContact O-N 3.42Å; T340-L342 VanDerWaalsContact C-N 3.33Å |
| 343 | E | 81 | Confident | 92.3 | Very high | 183 Ų | 183 | 68.9 Ų | 68.9 | 86% | 0.855 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.3 | -35.2 | -177.9 | -64.4 | -168.9 | 165.7 | 0 | 0 | 113.1 | C341 | C341-E343 PolarHBondContact O-N 2.8Š|
| 344 | T | 85 | Confident | 92.2 | Very high | 98 Ų | 98 | 62.5 Ų | 62.5 | 60% | 0.601 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.7 | -37.7 | -175.6 | -54.2 | 0 | 0 | 0 | 0 | 112.5 | C341 | C341-T344 PolarHBondContact O-N 3.44Š|
| 345 | Y | 88.4 | Confident | 92.2 | Very high | 120 Ų | 120 | 66.5 Ų | 66.5 | 47% | 0.471 | 35% | 0.345 | S | S | . | . | trans | -135.8 | 67 | -171.7 | -56 | -70.6 | 0 | 0 | 0 | 111.4 | C341 Y347 V348 | C341-Y345 CarbonylContact O-C 3.55Å; C341-Y345 VanDerWaalsContact O-C 3.28Å; C341-Y345 WeakPolarHBondContact O-CA 3.44Å; C341-Y345 PolarHBondContact O-N 3.25Å; Y345-Y347 HydrophobicContact CD1-CE1 4Å; Y345-Y347 WeakPolarHBondContact CD1-OH 3.29Å; Y345-Y347 PolarHBondContact O-N 3.49Å; Y345-V348 HydrophobicContact CG-CG2 4.43Å; Y345-V348 WeakPolarHBondContact O-CB 3.19Å; Y345-V348 PolarHBondContact O-N 3Å | ||
| 346 | Y | 86.3 | Confident | 92.1 | Very high | 174 Ų | 174 | 67.6 Ų | 67.6 | 68% | 0.682 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.2 | -26.8 | -177.5 | 69.8 | -91.6 | 0 | 0 | 0 | 114.6 | V348 P350 | Y346-V348 VanDerWaalsContact C-N 3.35Å; Y346-P350 WeakPolarHBondContact O-CD 3.45Å |
| 347 | Y | 90.3 | Very high | 92.1 | Very high | 120 Ų | 120 | 69.2 Ų | 69.2 | 47% | 0.471 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | -14.5 | 179.7 | 64.1 | -94.7 | 0 | 0 | 0 | 114.2 | Y345 P350 L351 | Y345-Y347 HydrophobicContact CD1-CE1 4Å; Y345-Y347 WeakPolarHBondContact CD1-OH 3.29Å; Y345-Y347 PolarHBondContact O-N 3.49Å; Y347-P350 WeakPolarHBondContact O-CD 3.3Å; Y347-P350 WeakPolarHBondContact O-CG 3.31Å; Y347-L351 VanDerWaalsContact O-CB 3.25Å; Y347-L351 WeakPolarHBondContact O-CB 3.42Å; Y347-L351 PolarHBondContact O-N 3.38Å |
| 348 | V | 93.1 | Very high | 92.1 | Very high | 38 Ų | 38 | 70.9 Ų | 70.9 | 23% | 0.23 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -67.1 | -46.6 | -177.2 | 169.9 | 0 | 0 | 0 | 0 | 111 | L338 Y345 Y346 L351 V352 | L338-V348 HydrophobicContact CD2-CG1 4.05Å; Y345-V348 HydrophobicContact CG-CG2 4.43Å; Y345-V348 WeakPolarHBondContact O-CB 3.19Å; Y345-V348 PolarHBondContact O-N 3Å; Y346-V348 VanDerWaalsContact C-N 3.35Å; V348-L351 PolarHBondContact O-N 3.38Å; V348-V352 HydrophobicContact CG1-CG2 4.36Å; V348-V352 WeakPolarHBondContact O-CG2 3.33Å; V348-V352 PolarHBondContact O-N 3.31Å |
| 349 | S | 92.7 | Very high | 92 | Very high | 4 Ų | 4 | 72.3 Ų | 72.3 | 3% | 0.028 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -56.5 | -56 | 179 | -178.2 | 0 | 0 | 0 | 0 | 112.8 | L277 S280 L351 V352 G353 | L277-S349 WeakPolarHBondContact CA-OG 3.49Å; S280-S349 WeakPolarHBondContact CB-O 3.26Å; S280-S349 WeakPolarHBondContact CB-OG 3.41Å; S280-S349 PolarHBondContact OG-O 3.34Å; S349-L351 VanDerWaalsContact C-N 3.27Å; S349-L351 PolarHBondContact O-N 3.36Å; S349-V352 PolarHBondContact O-N 3.47Å; S349-G353 PolarHBondContact O-N 2.83Å; S349-G353 VanDerWaalsContact O-N 3.09Å |
| 350 | P | 94 | Very high | 91.9 | Very high | 53 Ų | 53 | 70.9 Ų | 70.9 | 34% | 0.344 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.1 | -30.3 | 178.6 | 24.1 | -32.6 | 0 | 0 | 0 | 112.9 | I276 Y346 Y347 G353 A354 | I276-P350 HydrophobicContact CG2-CB 3.92Å; I276-P350 HydrophobicContact CG2-CG 4.32Å; Y346-P350 WeakPolarHBondContact O-CD 3.45Å; Y347-P350 WeakPolarHBondContact O-CD 3.3Å; Y347-P350 WeakPolarHBondContact O-CG 3.31Å; P350-G353 PolarHBondContact O-N 3.48Å; P350-A354 WeakPolarHBondContact O-CB 3.4Å; P350-A354 PolarHBondContact O-N 3.22Å |
| 351 | L | 95.4 | Very high | 92 | Very high | 109 Ų | 109 | 70.1 Ų | 70.1 | 57% | 0.571 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -67.1 | -41.1 | 176.3 | -173.4 | 146.7 | 0 | 0 | 0 | 112 | Y347 V348 S349 A354 F355 | Y347-L351 VanDerWaalsContact O-CB 3.25Å; Y347-L351 WeakPolarHBondContact O-CB 3.42Å; Y347-L351 PolarHBondContact O-N 3.38Å; V348-L351 PolarHBondContact O-N 3.38Å; S349-L351 VanDerWaalsContact C-N 3.27Å; S349-L351 PolarHBondContact O-N 3.36Å; L351-A354 PolarHBondContact O-N 3.32Å; L351-F355 VanDerWaalsContact O-CB 3.32Å; L351-F355 WeakPolarHBondContact O-CB 3.49Å; L351-F355 PolarHBondContact O-N 3.48Å |
| 352 | V | 95.8 | Very high | 92.1 | Very high | 34 Ų | 34 | 73.4 Ų | 73.4 | 21% | 0.206 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -63.7 | -47.1 | 174.8 | 169.7 | 0 | 0 | 0 | 0 | 110.8 | A284 L338 V348 S349 F355 F356 | A284-V352 HydrophobicContact CB-CG1 3.96Å; L338-V352 HydrophobicContact CD1-CG1 4.49Å; L338-V352 HydrophobicContact CD2-CB 4.38Å; L338-V352 HydrophobicContact CD2-CG2 4.09Å; V348-V352 HydrophobicContact CG1-CG2 4.36Å; V348-V352 WeakPolarHBondContact O-CG2 3.33Å; V348-V352 PolarHBondContact O-N 3.31Å; S349-V352 PolarHBondContact O-N 3.47Å; V352-F355 PolarHBondContact O-N 3.02Å; V352-F356 HydrophobicContact CG1-CD2 3.98Å; V352-F356 HydrophobicContact CG1-CE2 3.92Å; V352-F356 VanDerWaalsContact O-CD2 3.31Å; V352-F356 WeakPolarHBondContact O-CD2 3.49Å; V352-F356 PolarHBondContact O-N 3.47Å |
| 353 | G | 95.1 | Very high | 92.3 | Very high | 5 Ų | 5 | 72.7 Ų | 72.7 | 5% | 0.052 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -59.8 | -47.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | S280 S349 P350 F355 F356 L357 | S280-G353 WeakPolarHBondContact OG-CA 3.27Å; S280-G353 PolarHBondContact OG-N 3.33Å; S349-G353 PolarHBondContact O-N 2.83Å; S349-G353 VanDerWaalsContact O-N 3.09Å; P350-G353 PolarHBondContact O-N 3.48Å; G353-F355 VanDerWaalsContact C-N 3.34Å; G353-F355 PolarHBondContact O-N 2.94Å; G353-F356 PolarHBondContact O-N 3.41Å; G353-L357 WeakPolarHBondContact O-CB 3.5Å; G353-L357 WeakPolarHBondContact O-CG 3.44Å; G353-L357 PolarHBondContact O-N 3.02Å |
| 354 | A | 95.7 | Very high | 92.9 | Very high | 57 Ų | 57 | 67.4 Ų | 67.4 | 47% | 0.471 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.8 | -39.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | P350 L351 A358 | P350-A354 WeakPolarHBondContact O-CB 3.4Å; P350-A354 PolarHBondContact O-N 3.22Å; L351-A354 PolarHBondContact O-N 3.32Å; A354-A358 WeakPolarHBondContact O-CB 3.22Å; A354-A358 PolarHBondContact O-N 3.41Å |
| 355 | F | 96.4 | Very high | 93.3 | Very high | 114 Ų | 114 | 67.1 Ų | 67.1 | 50% | 0.5 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -59.2 | -52.1 | 177.1 | 170.8 | -100.5 | 0 | 0 | 0 | 111.7 | L351 V352 G353 A358 L359 | L351-F355 VanDerWaalsContact O-CB 3.32Å; L351-F355 WeakPolarHBondContact O-CB 3.49Å; L351-F355 PolarHBondContact O-N 3.48Å; V352-F355 PolarHBondContact O-N 3.02Å; G353-F355 VanDerWaalsContact C-N 3.34Å; G353-F355 PolarHBondContact O-N 2.94Å; F355-A358 PolarHBondContact O-N 3.29Å; F355-L359 HydrophobicContact CE1-CD1 3.91Å; F355-L359 HydrophobicContact CZ-CD1 3.97Å; F355-L359 PolarHBondContact O-N 2.92Å |
| 356 | F | 95.5 | Very high | 93.5 | Very high | 24 Ų | 24 | 64.1 Ų | 64.1 | 11% | 0.105 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -69.4 | -37.6 | -178.5 | -76.5 | -68.2 | 0 | 0 | 0 | 112.8 | V283 A284 F287 I288 V352 G353 A358 L359 | V283-F356 HydrophobicContact CG1-CB 3.57Å; A284-F356 HydrophobicContact CB-CD2 3.49Å; A284-F356 VanDerWaalsContact CB-CD2 3.49Å; A284-F356 HydrophobicContact CB-CE2 3.44Å; A284-F356 VanDerWaalsContact CB-CE2 3.44Å; A284-F356 HydrophobicContact CB-CG 4.41Å; A284-F356 HydrophobicContact CB-CZ 4.33Å; F287-F356 HydrophobicContact CB-CD1 3.77Å; F287-F356 HydrophobicContact CB-CE1 4.22Å; F287-F356 HydrophobicContact CB-CG 4.4Å; F287-F356 AromaticContact CD1-CD1 3.48Å; F287-F356 HydrophobicContact CD1-CD1 3.48Å; F287-F356 VanDerWaalsContact CD1-CD1 3.48Å; F287-F356 AromaticContact CD1-CE1 3.4Å; F287-F356 HydrophobicContact CD1-CE1 3.4Å; F287-F356 VanDerWaalsContact CD1-CE1 3.4Å; F287-F356 HydrophobicContact CD2-CD1 4.03Å; F287-F356 HydrophobicContact CE1-CD1 4.05Å; F287-F356 AromaticContact CE1-CE1 3.92Å; F287-F356 HydrophobicContact CE1-CE1 3.92Å; F287-F356 AromaticContact CG-CD1 3.47Å; F287-F356 HydrophobicContact CG-CD1 3.47Å; F287-F356 VanDerWaalsContact CG-CD1 3.47Å; F287-F356 AromaticContact CG-CE1 3.89Å; F287-F356 HydrophobicContact CG-CE1 3.89Å; F287-F356 HydrophobicContact CG-CG 4.46Å; I288-F356 HydrophobicContact CD1-CE1 4.41Å; I288-F356 HydrophobicContact CD1-CE2 4.38Å; I288-F356 HydrophobicContact CD1-CZ 3.74Å; I288-F356 HydrophobicContact CG1-CE1 4.08Å; I288-F356 HydrophobicContact CG1-CZ 3.91Å; V352-F356 HydrophobicContact CG1-CD2 3.98Å; V352-F356 HydrophobicContact CG1-CE2 3.92Å; V352-F356 VanDerWaalsContact O-CD2 3.31Å; V352-F356 WeakPolarHBondContact O-CD2 3.49Å; V352-F356 PolarHBondContact O-N 3.47Å; G353-F356 PolarHBondContact O-N 3.41Å; F356-A358 VanDerWaalsContact C-N 3.29Å; F356-A358 PolarHBondContact O-N 3.06Å; F356-L359 HydrophobicContact CD1-CD1 4.27Å; F356-L359 PolarHBondContact O-N 3.04Å |
| 357 | L | 95.1 | Very high | 93.6 | Very high | 69 Ų | 69 | 55.8 Ų | 55.8 | 36% | 0.361 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.1 | -35.6 | 172.4 | -71.7 | 173.4 | 0 | 0 | 0 | 112.1 | T249 F253 V283 G353 L359 T360 P361 | T249-L357 HydrophobicContact CG2-CD2 4.2Å; F253-L357 HydrophobicContact CB-CD2 4.45Å; F253-L357 HydrophobicContact CD2-CD1 4.4Å; F253-L357 HydrophobicContact CD2-CD2 4.49Å; V283-L357 HydrophobicContact CG1-CD2 4.27Å; V283-L357 HydrophobicContact CG1-CG 4.2Å; V283-L357 HydrophobicContact CG2-CD2 4.27Å; G353-L357 WeakPolarHBondContact O-CB 3.5Å; G353-L357 WeakPolarHBondContact O-CG 3.44Å; G353-L357 PolarHBondContact O-N 3.02Å; L357-L359 PolarHBondContact O-N 3.28Å; L357-T360 WeakPolarHBondContact O-CB 3.37Å; L357-T360 PolarHBondContact O-N 3.36Å; L357-T360 VanDerWaalsContact O-N 3.15Å; L357-T360 PolarHBondContact O-OG1 2.85Å; L357-T360 VanDerWaalsContact O-OG1 3.13Å; L357-P361 WeakPolarHBondContact O-CD 3.29Å |
| 358 | A | 95.3 | Very high | 93.6 | Very high | 70 Ų | 70 | 51.9 Ų | 51.9 | 58% | 0.579 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -68.8 | -18.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | A354 F355 F356 P361 | A354-A358 WeakPolarHBondContact O-CB 3.22Å; A354-A358 PolarHBondContact O-N 3.41Å; F355-A358 PolarHBondContact O-N 3.29Å; F356-A358 VanDerWaalsContact C-N 3.29Å; F356-A358 PolarHBondContact O-N 3.06Å; A358-P361 WeakPolarHBondContact O-CD 3.22Å |
| 359 | L | 93.2 | Very high | 93.4 | Very high | 44 Ų | 44 | 58.1 Ų | 58.1 | 23% | 0.23 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -79.6 | -19.7 | 173 | -61.7 | 178.6 | 0 | 0 | 0 | 112.6 | F287 F355 F356 L357 M362 G363 | F287-L359 HydrophobicContact CE1-CD1 4.25Å; F287-L359 HydrophobicContact CE2-CB 4.08Å; F287-L359 HydrophobicContact CE2-CD1 4.06Å; F287-L359 HydrophobicContact CZ-CB 4.44Å; F287-L359 HydrophobicContact CZ-CD1 3.7Å; F355-L359 HydrophobicContact CE1-CD1 3.91Å; F355-L359 HydrophobicContact CZ-CD1 3.97Å; F355-L359 PolarHBondContact O-N 2.92Å; F356-L359 HydrophobicContact CD1-CD1 4.27Å; F356-L359 PolarHBondContact O-N 3.04Å; L357-L359 PolarHBondContact O-N 3.28Å; L359-M362 HydrophobicContact CD2-CE 4.24Å; L359-M362 WeakPolarHBondContact O-CB 3.5Å; L359-M362 PolarHBondContact O-N 2.76Å; L359-G363 PolarHBondContact O-N 3.42Å |
| 360 | T | 92.8 | Very high | 92.8 | Very high | 14 Ų | 14 | 60.2 Ų | 60.2 | 9% | 0.086 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.2 | -45.3 | -177.4 | -48.1 | 0 | 0 | 0 | 0 | 113.7 | V246 T249 V250 L357 M362 G363 I364 | V246-T360 HydrophobicContact CG1-CG2 4.13Å; V246-T360 HydrophobicContact CG2-CG2 4.37Å; T249-T360 WeakPolarHBondContact CG2-OG1 3.38Å; V250-T360 HydrophobicContact CG2-CG2 4.18Å; L357-T360 WeakPolarHBondContact O-CB 3.37Å; L357-T360 PolarHBondContact O-N 3.36Å; L357-T360 VanDerWaalsContact O-N 3.15Å; L357-T360 PolarHBondContact O-OG1 2.85Å; L357-T360 VanDerWaalsContact O-OG1 3.13Å; T360-M362 VanDerWaalsContact C-N 3.26Å; T360-M362 PolarHBondContact O-N 3.34Å; T360-G363 WeakPolarHBondContact O-CA 3.26Å; T360-G363 PolarHBondContact O-N 2.83Å; T360-I364 HydrophobicContact CG2-CD1 4.22Å; T360-I364 WeakPolarHBondContact O-CG1 3.35Å; T360-I364 PolarHBondContact O-N 2.83Å |
| 361 | P | 93.7 | Very high | 92.1 | Very high | 75 Ų | 75 | 61 Ų | 61 | 49% | 0.487 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -58.8 | -36.5 | 177.3 | -24.6 | 34.8 | 0 | 0 | 0 | 113.3 | L357 A358 I364 V365 | L357-P361 WeakPolarHBondContact O-CD 3.29Å; A358-P361 WeakPolarHBondContact O-CD 3.22Å; P361-I364 WeakPolarHBondContact O-CB 3.39Å; P361-I364 PolarHBondContact O-N 2.72Å; P361-V365 WeakPolarHBondContact O-CG2 3.28Å; P361-V365 PolarHBondContact O-N 2.82Å |
| 362 | M | 91.9 | Very high | 91 | Very high | 111 Ų | 111 | 56.5 Ų | 56.5 | 55% | 0.547 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 174.7 | -177.8 | -178 | 66.3 | 0 | 0 | 110.8 | L359 T360 I364 V365 I366 | L359-M362 HydrophobicContact CD2-CE 4.24Å; L359-M362 WeakPolarHBondContact O-CB 3.5Å; L359-M362 PolarHBondContact O-N 2.76Å; T360-M362 VanDerWaalsContact C-N 3.26Å; T360-M362 PolarHBondContact O-N 3.34Å; M362-I364 VanDerWaalsContact C-N 3.34Å; M362-I364 PolarHBondContact O-N 2.9Å; M362-V365 PolarHBondContact O-N 3.43Å; M362-I366 HydrophobicContact CG-CD1 4.02Å; M362-I366 VanDerWaalsContact O-CG1 3.31Å; M362-I366 WeakPolarHBondContact O-CG1 3.34Å; M362-I366 PolarHBondContact O-N 3.4Å |
| 363 | G | 91.3 | Very high | 90.4 | Very high | 10 Ų | 10 | 54.9 Ų | 54.9 | 10% | 0.103 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60 | -41.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L359 T360 I366 A367 | L359-G363 PolarHBondContact O-N 3.42Å; T360-G363 WeakPolarHBondContact O-CA 3.26Å; T360-G363 PolarHBondContact O-N 2.83Å; G363-I366 PolarHBondContact O-N 2.95Å; G363-A367 VanDerWaalsContact O-CB 3.3Å; G363-A367 WeakPolarHBondContact O-CB 3.45Å; G363-A367 PolarHBondContact O-N 2.85Å |
| 364 | I | 93.2 | Very high | 89.9 | Confident | 73 Ų | 73 | 61.3 Ų | 61.3 | 37% | 0.374 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60 | -48.2 | 176.6 | -72.4 | 169.8 | 0 | 0 | 0 | 110.4 | V246 T360 P361 M362 I366 A367 A368 L377 | V246-I364 HydrophobicContact CB-CG1 4.45Å; V246-I364 HydrophobicContact CG1-CD1 4.36Å; V246-I364 HydrophobicContact CG1-CG1 3.72Å; V246-I364 HydrophobicContact CG2-CG1 3.79Å; V246-I364 VanDerWaalsContact CG2-N 3.33Å; T360-I364 HydrophobicContact CG2-CD1 4.22Å; T360-I364 WeakPolarHBondContact O-CG1 3.35Å; T360-I364 PolarHBondContact O-N 2.83Å; P361-I364 WeakPolarHBondContact O-CB 3.39Å; P361-I364 PolarHBondContact O-N 2.72Å; M362-I364 VanDerWaalsContact C-N 3.34Å; M362-I364 PolarHBondContact O-N 2.9Å; I364-I366 VanDerWaalsContact C-N 3.32Å; I364-I366 PolarHBondContact O-N 3.46Å; I364-A367 PolarHBondContact O-N 2.95Å; I364-A368 VanDerWaalsContact O-CB 3.25Å; I364-A368 WeakPolarHBondContact O-CB 3.48Å; I364-A368 PolarHBondContact O-N 3.19Å; I364-L377 HydrophobicContact CG2-CD2 4.21Å |
| 365 | V | 94.2 | Very high | 89.3 | Confident | 91 Ų | 91 | 61.3 Ų | 61.3 | 55% | 0.552 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -62.5 | -39.8 | 179.4 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | P361 M362 K369 | P361-V365 WeakPolarHBondContact O-CG2 3.28Å; P361-V365 PolarHBondContact O-N 2.82Å; M362-V365 PolarHBondContact O-N 3.43Å; V365-K369 WeakPolarHBondContact O-CG 3.33Å |
| 366 | I | 91.9 | Very high | 88.4 | Confident | 57 Ų | 57 | 56 Ų | 56 | 29% | 0.292 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -69.1 | -45.4 | 178.1 | -64.7 | 165.9 | 0 | 0 | 0 | 110.8 | I238 A242 M362 G363 I364 A368 K369 | I238-I366 HydrophobicContact CG2-CG2 3.7Å; A242-I366 HydrophobicContact CB-CB 3.86Å; A242-I366 HydrophobicContact CB-CG2 3.57Å; M362-I366 HydrophobicContact CG-CD1 4.02Å; M362-I366 VanDerWaalsContact O-CG1 3.31Å; M362-I366 WeakPolarHBondContact O-CG1 3.34Å; M362-I366 PolarHBondContact O-N 3.4Å; G363-I366 PolarHBondContact O-N 2.95Å; I364-I366 VanDerWaalsContact C-N 3.32Å; I364-I366 PolarHBondContact O-N 3.46Å; I366-A368 VanDerWaalsContact C-N 3.33Å; I366-A368 PolarHBondContact O-N 2.97Å; I366-K369 PolarHBondContact O-N 2.74Å |
| 367 | A | 88.9 | Confident | 88 | Confident | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.5 | -34.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A242 L243 G363 I364 K369 T373 L377 | A242-A367 HydrophobicContact CB-CB 4.2Å; L243-A367 HydrophobicContact CB-CB 4.04Å; G363-A367 VanDerWaalsContact O-CB 3.3Å; G363-A367 WeakPolarHBondContact O-CB 3.45Å; G363-A367 PolarHBondContact O-N 2.85Å; I364-A367 PolarHBondContact O-N 2.95Å; A367-K369 VanDerWaalsContact C-N 3.25Å; A367-K369 PolarHBondContact O-N 3.27Å; A367-T373 WeakPolarHBondContact O-CB 3.47Å; A367-T373 PolarHBondContact O-OG1 3.21Å; A367-L377 HydrophobicContact CB-CD2 4.47Å |
| 368 | A | 90 | Very high | 87.4 | Confident | 38 Ų | 38 | 59.6 Ų | 59.6 | 31% | 0.314 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -72.4 | -14.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114 | I364 I366 L377 | I364-A368 VanDerWaalsContact O-CB 3.25Å; I364-A368 WeakPolarHBondContact O-CB 3.48Å; I364-A368 PolarHBondContact O-N 3.19Å; I366-A368 VanDerWaalsContact C-N 3.33Å; I366-A368 PolarHBondContact O-N 2.97Å; A368-L377 HydrophobicContact CB-CD2 4.29Å |
| 369 | K | 88.6 | Confident | 86.6 | Confident | 169 Ų | 169 | 59.2 Ų | 59.2 | 74% | 0.735 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.9 | -31.3 | 180 | -77.2 | 178.1 | 179.8 | -175.8 | 0 | 113.4 | V365 I366 A367 | V365-K369 WeakPolarHBondContact O-CG 3.33Å; I366-K369 PolarHBondContact O-N 2.74Å; A367-K369 VanDerWaalsContact C-N 3.25Å; A367-K369 PolarHBondContact O-N 3.27Å |
| 370 | H | 81.1 | Confident | 86 | Confident | 47 Ų | 47 | 57.5 Ų | 57.5 | 22% | 0.218 | 31% | 0.308 | C | S | . | . | S | Bend | trans | -97.4 | 130.9 | -179.2 | -174 | -70.2 | 0 | 0 | 0 | 109.8 | A372 T373 R374 | H370-A372 PolarHBondContact ND1-N 3.41Å; H370-A372 PolarHBondContact O-N 2.94Å; H370-T373 WeakPolarHBondContact CB-OG1 3.46Å; H370-T373 PolarHBondContact O-N 2.87Å; H370-T373 PolarHBondContact O-OG1 3.26Å; H370-R374 WeakPolarHBondContact O-CB 3.36Å; H370-R374 PolarHBondContact O-N 3.45Å |
| 371 | P | 78.4 | Confident | 85.7 | Confident | 69 Ų | 69 | 59.6 Ų | 59.6 | 45% | 0.448 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -59.8 | -44.6 | -171.8 | 20.9 | -32 | 0 | 0 | 0 | 112.6 | T373 R374 T375 | P371-T373 PolarHBondContact O-N 2.83Å; P371-R374 WeakPolarHBondContact O-CB 3.31Å; P371-R374 PolarHBondContact O-N 2.99Å; P371-T375 PolarHBondContact O-N 2.89Å; P371-T375 VanDerWaalsContact O-N 3.16Å; P371-T375 PolarHBondContact O-OG1 3.27Å |
| 372 | A | 74.1 | Confident | 85.5 | Confident | 15 Ų | 15 | 60.5 Ų | 60.5 | 12% | 0.124 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -58.8 | -44.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | M129 H370 V376 | M129-A372 HydrophobicContact CG-CB 4.17Å; H370-A372 PolarHBondContact ND1-N 3.41Å; H370-A372 PolarHBondContact O-N 2.94Å; A372-V376 VanDerWaalsContact O-CG2 3.22Å; A372-V376 WeakPolarHBondContact O-CG2 2.97Å |
| 373 | T | 82.2 | Confident | 85.3 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -76.3 | -26.9 | -179.5 | 47.6 | 0 | 0 | 0 | 0 | 112.4 | N240 L243 A367 H370 P371 V376 L377 | N240-T373 HydrophobicContact CB-CG2 4.37Å; L243-T373 HydrophobicContact CB-CG2 4.37Å; L243-T373 HydrophobicContact CD2-CG2 3.99Å; A367-T373 WeakPolarHBondContact O-CB 3.47Å; A367-T373 PolarHBondContact O-OG1 3.21Å; H370-T373 WeakPolarHBondContact CB-OG1 3.46Å; H370-T373 PolarHBondContact O-N 2.87Å; H370-T373 PolarHBondContact O-OG1 3.26Å; P371-T373 PolarHBondContact O-N 2.83Å; T373-V376 PolarHBondContact O-N 3.31Å; T373-L377 VanDerWaalsContact O-CB 3.31Å; T373-L377 WeakPolarHBondContact O-CB 3.45Å; T373-L377 PolarHBondContact O-N 3.2Å |
| 374 | R | 85.6 | Confident | 85.2 | Confident | 141 Ų | 141 | 55.2 Ų | 55.2 | 53% | 0.532 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.8 | -44.5 | 173.4 | -168.9 | -177.3 | 82.9 | -176.9 | 5.8 | 111.6 | H370 P371 V376 L377 H378 | H370-R374 WeakPolarHBondContact O-CB 3.36Å; H370-R374 PolarHBondContact O-N 3.45Å; P371-R374 WeakPolarHBondContact O-CB 3.31Å; P371-R374 PolarHBondContact O-N 2.99Å; R374-V376 VanDerWaalsContact C-N 3.33Å; R374-V376 PolarHBondContact O-N 2.92Å; R374-L377 WeakPolarHBondContact O-CB 3.3Å; R374-L377 PolarHBondContact O-N 3.45Å; R374-H378 PolarHBondContact O-CD2 3.41Å; R374-H378 VanDerWaalsContact O-CD2 3.26Å; R374-H378 PolarHBondContact O-N 3.33Å |
| 375 | T | 81.1 | Confident | 85.1 | Confident | 56 Ų | 56 | 54.1 Ų | 54.1 | 34% | 0.344 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -57.8 | -49.4 | 177.9 | -56.8 | 0 | 0 | 0 | 0 | 110.7 | P371 L377 H378 S379 | P371-T375 PolarHBondContact O-N 2.89Å; P371-T375 VanDerWaalsContact O-N 3.16Å; P371-T375 PolarHBondContact O-OG1 3.27Å; T375-L377 VanDerWaalsContact C-N 3.31Å; T375-L377 PolarHBondContact O-N 3.21Å; T375-H378 PolarHBondContact O-N 2.95Å; T375-S379 PolarHBondContact O-N 2.88Å; T375-S379 PolarHBondContact O-OG 3.22Å; T375-S379 VanDerWaalsContact O-OG 3.07Å |
| 376 | V | 79.5 | Confident | 85 | Confident | 2 Ų | 2 | 52.4 Ų | 52.4 | 1% | 0.012 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.5 | -37.5 | -179.1 | -174.2 | 0 | 0 | 0 | 0 | 111.6 | E125 L243 A372 T373 R374 H378 S379 G380 | E125-V376 HydrophobicContact CG-CG2 4.14Å; E125-V376 WeakPolarHBondContact OE1-CG2 3.49Å; L243-V376 HydrophobicContact CD2-CB 3.77Å; L243-V376 HydrophobicContact CD2-CG1 3.77Å; L243-V376 HydrophobicContact CD2-CG2 4.37Å; A372-V376 VanDerWaalsContact O-CG2 3.22Å; A372-V376 WeakPolarHBondContact O-CG2 2.97Å; T373-V376 PolarHBondContact O-N 3.31Å; R374-V376 VanDerWaalsContact C-N 3.33Å; R374-V376 PolarHBondContact O-N 2.92Å; V376-H378 PolarHBondContact O-N 3.32Å; V376-H378 VanDerWaalsContact O-N 3.16Å; V376-S379 PolarHBondContact O-N 3.43Å; V376-G380 WeakPolarHBondContact O-CA 3.49Å; V376-G380 PolarHBondContact O-N 3.5Å |
| 377 | L | 85.4 | Confident | 85 | Confident | 20 Ų | 20 | 49.7 Ų | 49.7 | 11% | 0.105 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.5 | -21.6 | 177.1 | -172.5 | 64.4 | 0 | 0 | 0 | 112.4 | L243 V246 I364 A367 A368 T373 R374 T375 W381 | L243-L377 HydrophobicContact CD1-CB 4.01Å; L243-L377 HydrophobicContact CD1-CD1 3.8Å; V246-L377 HydrophobicContact CG1-CD1 4.06Å; I364-L377 HydrophobicContact CG2-CD2 4.21Å; A367-L377 HydrophobicContact CB-CD2 4.47Å; A368-L377 HydrophobicContact CB-CD2 4.29Å; T373-L377 VanDerWaalsContact O-CB 3.31Å; T373-L377 WeakPolarHBondContact O-CB 3.45Å; T373-L377 PolarHBondContact O-N 3.2Å; R374-L377 WeakPolarHBondContact O-CB 3.3Å; R374-L377 PolarHBondContact O-N 3.45Å; T375-L377 VanDerWaalsContact C-N 3.31Å; T375-L377 PolarHBondContact O-N 3.21Å; L377-W381 HydrophobicContact CD1-CZ2 4.14Å; L377-W381 PolarHBondContact O-NE1 2.85Å |
| 378 | H | 82.6 | Confident | 85.2 | Confident | 149 Ų | 149 | 50.1 Ų | 50.1 | 69% | 0.69 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -95.2 | -42.9 | 174.8 | -74.5 | -69.7 | 0 | 0 | 0 | 113 | R374 T375 V376 | R374-H378 PolarHBondContact O-CD2 3.41Å; R374-H378 VanDerWaalsContact O-CD2 3.26Å; R374-H378 PolarHBondContact O-N 3.33Å; T375-H378 PolarHBondContact O-N 2.95Å; V376-H378 PolarHBondContact O-N 3.32Å; V376-H378 VanDerWaalsContact O-N 3.16Å |
| 379 | S | 78.9 | Confident | 85.3 | Confident | 62 Ų | 62 | 52.4 Ų | 52.4 | 43% | 0.434 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -99.9 | -19.4 | -171.2 | 58.1 | 0 | 0 | 0 | 0 | 115.3 | T375 V376 W381 | T375-S379 PolarHBondContact O-N 2.88Å; T375-S379 PolarHBondContact O-OG 3.22Å; T375-S379 VanDerWaalsContact O-OG 3.07Å; V376-S379 PolarHBondContact O-N 3.43Å; S379-W381 VanDerWaalsContact C-N 3.31Å; S379-W381 PolarHBondContact O-N 2.87Å |
| 380 | G | 80.4 | Confident | 85.6 | Confident | 8 Ų | 8 | 46 Ų | 46 | 8% | 0.082 | 24% | 0.237 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | 5.8 | -169.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | V376 V384 | V376-G380 WeakPolarHBondContact O-CA 3.49Å; V376-G380 PolarHBondContact O-N 3.5Å; G380-V384 VanDerWaalsContact O-CG2 3.31Å; G380-V384 WeakPolarHBondContact O-CG2 3.34Å |
| 381 | W | 87.7 | Confident | 86.3 | Confident | 58 Ų | 58 | 43.8 Ų | 43.8 | 22% | 0.22 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -82.1 | -35.7 | -173.9 | -65.7 | 100.2 | 0 | 0 | 0 | 114.1 | V246 Q247 V250 L377 S379 V384 I385 | V246-W381 HydrophobicContact CG1-CH2 4.1Å; V246-W381 HydrophobicContact CG1-CZ2 4.32Å; Q247-W381 HydrophobicContact CG-CH2 4.33Å; Q247-W381 HydrophobicContact CG-CZ3 4.45Å; V250-W381 HydrophobicContact CB-CH2 3.88Å; V250-W381 HydrophobicContact CB-CZ3 3.75Å; V250-W381 HydrophobicContact CG1-CE3 4.42Å; V250-W381 HydrophobicContact CG1-CH2 3.95Å; V250-W381 HydrophobicContact CG1-CZ3 3.53Å; V250-W381 HydrophobicContact CG2-CH2 3.92Å; V250-W381 HydrophobicContact CG2-CZ3 4.3Å; L377-W381 HydrophobicContact CD1-CZ2 4.14Å; L377-W381 PolarHBondContact O-NE1 2.85Å; S379-W381 VanDerWaalsContact C-N 3.31Å; S379-W381 PolarHBondContact O-N 2.87Å; W381-V384 PolarHBondContact O-N 2.93Å; W381-I385 HydrophobicContact CB-CD1 4.03Å; W381-I385 HydrophobicContact CE3-CD1 4.16Å; W381-I385 HydrophobicContact CE3-CG1 4.42Å; W381-I385 WeakPolarHBondContact O-CB 3.21Å; W381-I385 WeakPolarHBondContact O-CG1 3.25Å; W381-I385 PolarHBondContact O-N 3.43Å |
| 382 | E | 88.6 | Confident | 87 | Confident | 94 Ų | 94 | 40.6 Ų | 40.6 | 44% | 0.439 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -51.5 | -54.8 | -178.6 | -178.8 | -164.6 | 159 | 0 | 0 | 112.1 | T386 K532 | E382-T386 VanDerWaalsContact O-CB 3.26Å; E382-T386 WeakPolarHBondContact O-CB 3.29Å; E382-T386 PolarHBondContact O-N 2.68Å; E382-T386 PolarHBondContact O-OG1 2.81Å; E382-K532 IonicContact OE1-NZ 3.53Å; E382-K532 IonicContact OE2-NZ 3.29Å; E382-K532 PolarHBondContact OE2-NZ 3.32Å |
| 383 | P | 87.8 | Confident | 88 | Confident | 3 Ų | 3 | 43.3 Ų | 43.3 | 2% | 0.019 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -68.7 | -37.9 | -177.6 | 26.3 | -34.1 | 0 | 0 | 0 | 113 | A387 S536 F537 P540 Y541 | P383-A387 WeakPolarHBondContact O-CB 3.26Å; P383-A387 PolarHBondContact O-N 3.44Å; P383-S536 WeakPolarHBondContact CB-O 3.4Å; P383-S536 VanDerWaalsContact CG-O 3.29Å; P383-S536 WeakPolarHBondContact CG-O 3.41Å; P383-F537 HydrophobicContact CB-CD1 4.01Å; P383-F537 HydrophobicContact CB-CE1 4.49Å; P383-F537 HydrophobicContact CB-CG 4.44Å; P383-F537 HydrophobicContact CG-CD1 4.05Å; P383-F537 HydrophobicContact CG-CE1 4.11Å; P383-F537 HydrophobicContact CG-CG 4.45Å; P383-P540 HydrophobicContact CB-CB 4.25Å; P383-P540 HydrophobicContact CB-CG 4.25Å; P383-Y541 WeakPolarHBondContact CA-OH 3.4Å; P383-Y541 HydrophobicContact CB-CE1 4.12Å; P383-Y541 WeakPolarHBondContact O-CE1 3.24Å |
| 384 | V | 88.3 | Confident | 88.6 | Confident | 7 Ų | 7 | 43.3 Ų | 43.3 | 4% | 0.042 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -70.8 | -44.8 | -175.6 | -176.5 | 0 | 0 | 0 | 0 | 111.7 | L210 V251 G380 W381 M388 | L210-V384 HydrophobicContact CD2-CG1 4.26Å; L210-V384 HydrophobicContact CD2-CG2 4.26Å; V251-V384 HydrophobicContact CB-CG1 4.49Å; V251-V384 HydrophobicContact CG1-CG1 4.41Å; V251-V384 HydrophobicContact CG2-CG1 3.44Å; V251-V384 VanDerWaalsContact CG2-CG1 3.44Å; G380-V384 VanDerWaalsContact O-CG2 3.31Å; G380-V384 WeakPolarHBondContact O-CG2 3.34Å; W381-V384 PolarHBondContact O-N 2.93Å; V384-M388 WeakPolarHBondContact O-CB 3.42Å; V384-M388 PolarHBondContact O-N 3.27Å; V384-M388 VanDerWaalsContact O-N 3.07Å |
| 385 | I | 91.6 | Very high | 89 | Confident | 50 Ų | 50 | 36.6 Ų | 36.6 | 26% | 0.256 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -69.6 | -44.1 | -179.6 | -65.4 | 173.7 | 0 | 0 | 0 | 110.4 | L254 W381 A387 M388 I389 | L254-I385 HydrophobicContact CD1-CD1 4.11Å; L254-I385 HydrophobicContact CD1-CG1 4.08Å; W381-I385 HydrophobicContact CB-CD1 4.03Å; W381-I385 HydrophobicContact CE3-CD1 4.16Å; W381-I385 HydrophobicContact CE3-CG1 4.42Å; W381-I385 WeakPolarHBondContact O-CB 3.21Å; W381-I385 WeakPolarHBondContact O-CG1 3.25Å; W381-I385 PolarHBondContact O-N 3.43Å; I385-A387 PolarHBondContact O-N 3.11Å; I385-M388 HydrophobicContact CG2-CE 4.47Å; I385-M388 PolarHBondContact O-N 2.99Å; I385-I389 HydrophobicContact CG2-CD1 4.18Å; I385-I389 WeakPolarHBondContact O-CG1 3.49Å; I385-I389 PolarHBondContact O-N 2.98Å; I385-I389 VanDerWaalsContact O-N 3.08Å |
| 386 | T | 91.6 | Very high | 89.7 | Confident | 56 Ų | 56 | 35.5 Ų | 35.5 | 34% | 0.344 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -65.4 | -41.3 | -179.5 | -56.7 | 0 | 0 | 0 | 0 | 111.1 | E382 I389 I390 Y541 | E382-T386 VanDerWaalsContact O-CB 3.26Å; E382-T386 WeakPolarHBondContact O-CB 3.29Å; E382-T386 PolarHBondContact O-N 2.68Å; E382-T386 PolarHBondContact O-OG1 2.81Å; T386-I389 PolarHBondContact O-N 3.02Å; T386-I390 HydrophobicContact CG2-CD1 4.21Å; T386-I390 WeakPolarHBondContact O-CG1 3.35Å; T386-I390 PolarHBondContact O-N 2.93Å; T386-I390 VanDerWaalsContact O-N 3.13Å; T386-Y541 HydrophobicContact CG2-CD1 4.44Å; T386-Y541 HydrophobicContact CG2-CE1 3.74Å |
| 387 | A | 91.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -59.6 | -45.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112 | N209 P383 I385 I389 I390 S391 P540 Y541 A544 | N209-A387 VanDerWaalsContact ND2-CB 3.29Å; N209-A387 WeakPolarHBondContact ND2-CB 3.43Å; P383-A387 WeakPolarHBondContact O-CB 3.26Å; P383-A387 PolarHBondContact O-N 3.44Å; I385-A387 PolarHBondContact O-N 3.11Å; A387-I389 VanDerWaalsContact C-N 3.31Å; A387-I389 PolarHBondContact O-N 3.15Å; A387-I390 PolarHBondContact O-N 3.18Å; A387-I390 VanDerWaalsContact O-N 3.16Å; A387-S391 PolarHBondContact O-N 3.02Å; A387-S391 PolarHBondContact O-OG 2.93Å; A387-P540 HydrophobicContact CB-CB 3.89Å; A387-P540 WeakPolarHBondContact CB-O 3.42Å; A387-Y541 HydrophobicContact CB-CD1 4.33Å; A387-A544 HydrophobicContact CB-CB 3.84Å; A387-A544 WeakPolarHBondContact O-CB 3.46Å |
| 388 | M | 93.3 | Very high | 90.8 | Very high | 8 Ų | 8 | 36.7 Ų | 36.7 | 4% | 0.039 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -57.9 | -42.2 | 177.3 | 174.9 | -80.3 | -64.4 | 0 | 0 | 112.3 | A202 V251 L254 A255 A258 V384 I385 S391 S392 | A202-M388 HydrophobicContact CB-CG 4.42Å; V251-M388 HydrophobicContact CG1-CB 3.68Å; V251-M388 HydrophobicContact CG1-CG 3.64Å; L254-M388 HydrophobicContact CB-CE 3.53Å; A255-M388 VanDerWaalsContact CA-SD 3.57Å; A255-M388 HydrophobicContact CB-CG 3.84Å; A255-M388 HydrophobicContact CB-SD 3.93Å; A258-M388 HydrophobicContact CB-SD 4.19Å; V384-M388 WeakPolarHBondContact O-CB 3.42Å; V384-M388 PolarHBondContact O-N 3.27Å; V384-M388 VanDerWaalsContact O-N 3.07Å; I385-M388 HydrophobicContact CG2-CE 4.47Å; I385-M388 PolarHBondContact O-N 2.99Å; M388-S391 PolarHBondContact O-N 3.43Å; M388-S392 WeakPolarHBondContact O-CB 3.48Å; M388-S392 PolarHBondContact O-N 3.43Å; M388-S392 PolarHBondContact O-OG 3.07Å |
| 389 | I | 93.6 | Very high | 91.3 | Very high | 86 Ų | 86 | 29.8 Ų | 29.8 | 44% | 0.441 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -62.8 | -44.7 | 177.6 | -66.8 | 168.3 | 0 | 0 | 0 | 110.6 | I385 T386 A387 S392 I393 | I385-I389 HydrophobicContact CG2-CD1 4.18Å; I385-I389 WeakPolarHBondContact O-CG1 3.49Å; I385-I389 PolarHBondContact O-N 2.98Å; I385-I389 VanDerWaalsContact O-N 3.08Å; T386-I389 PolarHBondContact O-N 3.02Å; A387-I389 VanDerWaalsContact C-N 3.31Å; A387-I389 PolarHBondContact O-N 3.15Å; I389-S392 WeakPolarHBondContact O-CB 3.37Å; I389-S392 PolarHBondContact O-N 2.91Å; I389-I393 WeakPolarHBondContact O-CG1 3.29Å; I389-I393 PolarHBondContact O-N 3.05Å |
| 390 | I | 94.8 | Very high | 91.8 | Very high | 35 Ų | 35 | 30.8 Ų | 30.8 | 18% | 0.179 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.3 | -47.7 | 178.6 | -64.8 | 167.1 | 0 | 0 | 0 | 110.7 | T386 A387 S392 I393 G394 A544 L545 L548 | T386-I390 HydrophobicContact CG2-CD1 4.21Å; T386-I390 WeakPolarHBondContact O-CG1 3.35Å; T386-I390 PolarHBondContact O-N 2.93Å; T386-I390 VanDerWaalsContact O-N 3.13Å; A387-I390 PolarHBondContact O-N 3.18Å; A387-I390 VanDerWaalsContact O-N 3.16Å; I390-S392 VanDerWaalsContact C-N 3.27Å; I390-S392 PolarHBondContact O-N 2.92Å; I390-I393 WeakPolarHBondContact O-CB 3.28Å; I390-I393 PolarHBondContact O-N 2.93Å; I390-I393 VanDerWaalsContact O-N 3.16Å; I390-G394 PolarHBondContact O-N 2.73Å; I390-A544 HydrophobicContact CB-CB 3.9Å; I390-A544 HydrophobicContact CG2-CB 3.93Å; I390-L545 HydrophobicContact CG2-CD2 4.22Å; I390-L548 HydrophobicContact CG2-CB 4.2Å; I390-L548 HydrophobicContact CG2-CD2 4.07Å |
| 391 | S | 94 | Very high | 92.2 | Very high | 1 Ų | 1 | 30.7 Ų | 30.7 | 1% | 0.007 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -62.1 | -34.8 | 176.6 | -65.9 | 0 | 0 | 0 | 0 | 112.1 | A387 M388 I393 G394 G395 A544 D547 | A387-S391 PolarHBondContact O-N 3.02Å; A387-S391 PolarHBondContact O-OG 2.93Å; M388-S391 PolarHBondContact O-N 3.43Å; S391-I393 VanDerWaalsContact C-N 3.29Å; S391-I393 PolarHBondContact O-N 3.46Å; S391-G394 WeakPolarHBondContact O-CA 3.4Å; S391-G394 PolarHBondContact O-N 3.07Å; S391-G395 PolarHBondContact O-N 3.25Å; S391-A544 VanDerWaalsContact OG-CA 3.31Å; S391-A544 WeakPolarHBondContact OG-CA 3.21Å; S391-A544 WeakPolarHBondContact OG-CB 3.46Å; S391-D547 WeakPolarHBondContact CB-OD2 3.3Å; S391-D547 PolarHBondContact OG-OD2 3.32Å |
| 392 | S | 94.6 | Very high | 92.2 | Very high | 1 Ų | 1 | 28.9 Ų | 28.9 | 1% | 0.007 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.1 | -33.1 | 176.6 | -57.5 | 0 | 0 | 0 | 0 | 112.4 | I198 A202 M388 I389 I390 G394 G395 L396 | I198-S392 WeakPolarHBondContact CG2-O 3.47Å; A202-S392 WeakPolarHBondContact CB-OG 3.43Å; M388-S392 WeakPolarHBondContact O-CB 3.48Å; M388-S392 PolarHBondContact O-N 3.43Å; M388-S392 PolarHBondContact O-OG 3.07Å; I389-S392 WeakPolarHBondContact O-CB 3.37Å; I389-S392 PolarHBondContact O-N 2.91Å; I390-S392 VanDerWaalsContact C-N 3.27Å; I390-S392 PolarHBondContact O-N 2.92Å; S392-G394 VanDerWaalsContact C-N 3.33Å; S392-G395 WeakPolarHBondContact O-CA 3.23Å; S392-G395 PolarHBondContact O-N 2.89Å; S392-L396 PolarHBondContact O-N 2.91Å |
| 393 | I | 95 | Very high | 92.1 | Very high | 72 Ų | 72 | 27.6 Ų | 27.6 | 37% | 0.369 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -65.5 | -40 | 172.2 | -60.1 | 167.4 | 0 | 0 | 0 | 110.2 | I389 I390 S391 G395 L396 I397 L548 | I389-I393 WeakPolarHBondContact O-CG1 3.29Å; I389-I393 PolarHBondContact O-N 3.05Å; I390-I393 WeakPolarHBondContact O-CB 3.28Å; I390-I393 PolarHBondContact O-N 2.93Å; I390-I393 VanDerWaalsContact O-N 3.16Å; S391-I393 VanDerWaalsContact C-N 3.29Å; S391-I393 PolarHBondContact O-N 3.46Å; I393-G395 VanDerWaalsContact C-N 3.29Å; I393-G395 PolarHBondContact O-N 3.11Å; I393-L396 WeakPolarHBondContact O-CB 3.15Å; I393-L396 PolarHBondContact O-N 3.33Å; I393-I397 WeakPolarHBondContact O-CG1 3.26Å; I393-I397 PolarHBondContact O-N 3.22Å; I393-I397 VanDerWaalsContact O-N 3.14Å; I393-L548 HydrophobicContact CB-CD1 4.11Å; I393-L548 HydrophobicContact CG2-CD1 3.69Å |
| 394 | G | 93.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.6 | -42.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | I390 S391 S392 L396 I397 L398 T551 | I390-G394 PolarHBondContact O-N 2.73Å; S391-G394 WeakPolarHBondContact O-CA 3.4Å; S391-G394 PolarHBondContact O-N 3.07Å; S392-G394 VanDerWaalsContact C-N 3.33Å; G394-L396 PolarHBondContact O-N 3.35Å; G394-I397 PolarHBondContact O-N 3.41Å; G394-L398 PolarHBondContact O-N 2.91Å; G394-T551 WeakPolarHBondContact O-CG2 3.37Å |
| 395 | G | 94.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.8 | -40.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | S391 S392 I393 I397 L398 D399 | S391-G395 PolarHBondContact O-N 3.25Å; S392-G395 WeakPolarHBondContact O-CA 3.23Å; S392-G395 PolarHBondContact O-N 2.89Å; I393-G395 VanDerWaalsContact C-N 3.29Å; I393-G395 PolarHBondContact O-N 3.11Å; G395-I397 VanDerWaalsContact C-N 3.31Å; G395-I397 PolarHBondContact O-N 3.3Å; G395-L398 WeakPolarHBondContact O-CB 3.49Å; G395-L398 PolarHBondContact O-N 3.27Å; G395-D399 WeakPolarHBondContact O-CB 3.37Å; G395-D399 PolarHBondContact O-N 2.7Å |
| 396 | L | 94.9 | Very high | 90.9 | Very high | 33 Ų | 33 | 34.7 Ų | 34.7 | 17% | 0.173 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.7 | -38.3 | 175.7 | -178.3 | 65.4 | 0 | 0 | 0 | 112.2 | I198 L262 P266 S392 I393 G394 T400 | I198-L396 HydrophobicContact CD1-CD1 3.78Å; I198-L396 HydrophobicContact CG1-CD1 4.44Å; L262-L396 HydrophobicContact CB-CD1 4.33Å; L262-L396 HydrophobicContact CB-CD2 4.31Å; L262-L396 HydrophobicContact CD2-CD2 4.32Å; L262-L396 WeakPolarHBondContact O-CD1 3.43Å; P266-L396 HydrophobicContact CG-CD1 4.11Å; S392-L396 PolarHBondContact O-N 2.91Å; I393-L396 WeakPolarHBondContact O-CB 3.15Å; I393-L396 PolarHBondContact O-N 3.33Å; G394-L396 PolarHBondContact O-N 3.35Å; L396-T400 WeakPolarHBondContact O-CB 3.1Å; L396-T400 PolarHBondContact O-N 3.44Å; L396-T400 PolarHBondContact O-OG1 2.94Å |
| 397 | I | 94.9 | Very high | 90.4 | Very high | 48 Ų | 48 | 32.1 Ų | 32.1 | 25% | 0.246 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -65.5 | -43.3 | 174.7 | -62.5 | 172.6 | 0 | 0 | 0 | 110.2 | I393 G394 G395 T400 T401 L548 T551 A552 A555 | I393-I397 WeakPolarHBondContact O-CG1 3.26Å; I393-I397 PolarHBondContact O-N 3.22Å; I393-I397 VanDerWaalsContact O-N 3.14Å; G394-I397 PolarHBondContact O-N 3.41Å; G395-I397 VanDerWaalsContact C-N 3.31Å; G395-I397 PolarHBondContact O-N 3.3Å; I397-T400 PolarHBondContact O-N 3.23Å; I397-T401 WeakPolarHBondContact O-CB 3.01Å; I397-T401 PolarHBondContact O-N 3.21Å; I397-T401 PolarHBondContact O-OG1 3.29Å; I397-L548 HydrophobicContact CD1-CD1 3.79Å; I397-T551 HydrophobicContact CB-CG2 4.23Å; I397-T551 HydrophobicContact CG2-CG2 4.12Å; I397-A552 HydrophobicContact CD1-CB 3.84Å; I397-A555 HydrophobicContact CG2-CB 4Å |
| 398 | L | 93.8 | Very high | 90 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.3 | -52.9 | 176.1 | -179.9 | 61.5 | 0 | 0 | 0 | 110.6 | F197 P201 G394 G395 T400 T401 V402 I410 T414 T551 | F197-L398 HydrophobicContact CB-CD2 4.49Å; F197-L398 HydrophobicContact CB-CG 4.49Å; F197-L398 HydrophobicContact CD1-CD2 4.28Å; F197-L398 HydrophobicContact CD1-CG 4.48Å; P201-L398 HydrophobicContact CG-CD2 4.32Å; G394-L398 PolarHBondContact O-N 2.91Å; G395-L398 WeakPolarHBondContact O-CB 3.49Å; G395-L398 PolarHBondContact O-N 3.27Å; L398-T400 PolarHBondContact O-N 3.47Å; L398-T401 PolarHBondContact O-N 3.31Å; L398-T401 VanDerWaalsContact O-N 3.11Å; L398-V402 HydrophobicContact CD1-CG2 3.78Å; L398-V402 HydrophobicContact CG-CG2 4.2Å; L398-V402 VanDerWaalsContact O-CG2 3.24Å; L398-V402 WeakPolarHBondContact O-CG2 3.32Å; L398-V402 PolarHBondContact O-N 2.92Å; L398-I410 HydrophobicContact CD1-CG2 4.14Å; L398-T414 HydrophobicContact CD1-CG2 4.12Å; L398-T414 HydrophobicContact CD2-CG2 4.16Å; L398-T551 HydrophobicContact CB-CG2 3.8Å |
| 399 | D | 92.6 | Very high | 89.4 | Confident | 4 Ų | 4 | 33.5 Ų | 33.5 | 2% | 0.021 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -53.5 | -50.5 | 178.6 | 176.7 | 51.8 | 0 | 0 | 0 | 112.8 | T194 F197 I198 G395 T401 V402 S403 | T194-D399 VanDerWaalsContact CB-OD1 3.23Å; T194-D399 WeakPolarHBondContact CB-OD1 3.47Å; F197-D399 HydrophobicContact CB-CB 3.96Å; I198-D399 HydrophobicContact CD1-CB 4.37Å; I198-D399 HydrophobicContact CG1-CB 3.62Å; G395-D399 WeakPolarHBondContact O-CB 3.37Å; G395-D399 PolarHBondContact O-N 2.7Å; D399-T401 VanDerWaalsContact C-N 3.28Å; D399-T401 PolarHBondContact O-N 3.46Å; D399-V402 PolarHBondContact O-N 3.38Å; D399-S403 WeakPolarHBondContact O-CB 3.28Å; D399-S403 PolarHBondContact O-N 3.44Å; D399-S403 VanDerWaalsContact O-N 3.08Å; D399-S403 PolarHBondContact O-OG 2.72Å |
| 400 | T | 89.9 | Confident | 89.1 | Confident | 82 Ų | 82 | 29.4 Ų | 29.4 | 50% | 0.503 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -62.3 | -36.6 | 178.3 | -54.7 | 0 | 0 | 0 | 0 | 111.9 | L396 I397 L398 | L396-T400 WeakPolarHBondContact O-CB 3.1Å; L396-T400 PolarHBondContact O-N 3.44Å; L396-T400 PolarHBondContact O-OG1 2.94Å; I397-T400 PolarHBondContact O-N 3.23Å; L398-T400 PolarHBondContact O-N 3.47Å |
| 401 | T | 89.8 | Confident | 88.8 | Confident | 7 Ų | 7 | 27.7 Ų | 27.7 | 4% | 0.043 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -75.3 | -42.5 | -178.3 | -51.9 | 0 | 0 | 0 | 0 | 111.6 | I397 L398 D399 S403 D404 L407 I410 A555 | I397-T401 WeakPolarHBondContact O-CB 3.01Å; I397-T401 PolarHBondContact O-N 3.21Å; I397-T401 PolarHBondContact O-OG1 3.29Å; L398-T401 PolarHBondContact O-N 3.31Å; L398-T401 VanDerWaalsContact O-N 3.11Å; D399-T401 VanDerWaalsContact C-N 3.28Å; D399-T401 PolarHBondContact O-N 3.46Å; T401-S403 PolarHBondContact O-N 3.26Å; T401-D404 PolarHBondContact O-N 2.99Å; T401-D404 VanDerWaalsContact O-N 3.13Å; T401-L407 HydrophobicContact CG2-CB 3.74Å; T401-L407 HydrophobicContact CG2-CD1 3.85Å; T401-L407 HydrophobicContact CG2-CG 4.43Å; T401-I410 HydrophobicContact CG2-CD1 3.7Å; T401-I410 HydrophobicContact CG2-CG2 4.1Å; T401-A555 HydrophobicContact CG2-CB 4.13Å; T401-A555 WeakPolarHBondContact OG1-CB 3.14Å |
| 402 | V | 87.7 | Confident | 88.7 | Confident | 19 Ų | 19 | 27.7 Ų | 27.7 | 12% | 0.115 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.1 | -26.1 | 179.3 | 175.8 | 0 | 0 | 0 | 0 | 112 | F197 L398 D399 D404 I410 V411 | F197-V402 HydrophobicContact CE1-CG1 4.25Å; F197-V402 HydrophobicContact CE2-CG1 3.98Å; F197-V402 HydrophobicContact CZ-CG1 3.83Å; L398-V402 HydrophobicContact CD1-CG2 3.78Å; L398-V402 HydrophobicContact CG-CG2 4.2Å; L398-V402 VanDerWaalsContact O-CG2 3.24Å; L398-V402 WeakPolarHBondContact O-CG2 3.32Å; L398-V402 PolarHBondContact O-N 2.92Å; D399-V402 PolarHBondContact O-N 3.38Å; V402-D404 PolarHBondContact O-N 3.1Å; V402-I410 HydrophobicContact CG2-CG2 3.73Å; V402-V411 HydrophobicContact CB-CG2 4.29Å; V402-V411 HydrophobicContact CG1-CG2 4.02Å; V402-V411 HydrophobicContact CG2-CG2 3.21Å |
| 403 | S | 85.4 | Confident | 88.6 | Confident | 68 Ų | 68 | 27.8 Ų | 27.8 | 48% | 0.476 | 16% | 0.163 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -20.2 | 173 | -65.1 | 0 | 0 | 0 | 0 | 113.5 | D399 T401 P405 | D399-S403 WeakPolarHBondContact O-CB 3.28Å; D399-S403 PolarHBondContact O-N 3.44Å; D399-S403 VanDerWaalsContact O-N 3.08Å; D399-S403 PolarHBondContact O-OG 2.72Å; T401-S403 PolarHBondContact O-N 3.26Å; S403-P405 WeakPolarHBondContact O-CD 3.46Å |
| 404 | D | 84.3 | Confident | 88.5 | Confident | 50 Ų | 50 | 24.5 Ų | 24.5 | 27% | 0.267 | 15% | 0.146 | S | C | . | . | S | Bend | trans | -85.6 | 117.2 | 169.9 | -170.9 | -24.6 | 0 | 0 | 0 | 110.1 | T401 V402 N406 L407 | T401-D404 PolarHBondContact O-N 2.99Å; T401-D404 VanDerWaalsContact O-N 3.13Å; V402-D404 PolarHBondContact O-N 3.1Å; D404-N406 PolarHBondContact O-N 3.47Å; D404-N406 WeakPolarHBondContact OD1-CB 3.43Å; D404-N406 PolarHBondContact OD1-N 2.88Å; D404-N406 PolarHBondContact OD1-ND2 3.47Å; D404-L407 HydrophobicContact CB-CB 4.36Å; D404-L407 HydrophobicContact CB-CD1 3.9Å; D404-L407 HydrophobicContact CB-CG 4.07Å; D404-L407 PolarHBondContact O-N 3.3Å |
| 405 | P | 78.9 | Confident | 88.5 | Confident | 85 Ų | 85 | 24.7 Ų | 24.7 | 55% | 0.552 | 15% | 0.147 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -54.9 | -25.1 | 178.9 | -25.5 | 34.4 | 0 | 0 | 0 | 114.3 | S403 L407 | S403-P405 WeakPolarHBondContact O-CD 3.46Å; P405-L407 VanDerWaalsContact C-N 3.3Å |
| 406 | N | 78.8 | Confident | 88.4 | Confident | 74 Ų | 74 | 24.7 Ų | 24.7 | 40% | 0.396 | 15% | 0.147 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | -10.9 | -179.5 | -56.1 | -75.8 | 0 | 0 | 0 | 113.4 | D404 | D404-N406 PolarHBondContact O-N 3.47Å; D404-N406 WeakPolarHBondContact OD1-CB 3.43Å; D404-N406 PolarHBondContact OD1-N 2.88Å; D404-N406 PolarHBondContact OD1-ND2 3.47Å |
| 407 | L | 82.9 | Confident | 88.4 | Confident | 2 Ų | 2 | 23.1 Ų | 23.1 | 1% | 0.01 | 14% | 0.139 | C | C | . | . | S | Bend | trans | -121.3 | 8.4 | -172.7 | -49.8 | 173.2 | 0 | 0 | 0 | 112.4 | T401 D404 P405 G409 I410 F558 H559 W562 | T401-L407 HydrophobicContact CG2-CB 3.74Å; T401-L407 HydrophobicContact CG2-CD1 3.85Å; T401-L407 HydrophobicContact CG2-CG 4.43Å; D404-L407 HydrophobicContact CB-CB 4.36Å; D404-L407 HydrophobicContact CB-CD1 3.9Å; D404-L407 HydrophobicContact CB-CG 4.07Å; D404-L407 PolarHBondContact O-N 3.3Å; P405-L407 VanDerWaalsContact C-N 3.3Å; L407-G409 PolarHBondContact O-N 2.81Å; L407-G409 VanDerWaalsContact O-N 3.11Å; L407-I410 VanDerWaalsContact O-CB 3.3Å; L407-I410 WeakPolarHBondContact O-CB 3.39Å; L407-I410 WeakPolarHBondContact O-CG2 3Å; L407-I410 PolarHBondContact O-N 2.92Å; L407-F558 HydrophobicContact CD2-CB 4.03Å; L407-H559 WeakPolarHBondContact CD1-CE1 3.34Å; L407-W562 HydrophobicContact CD2-CB 4.37Å |
| 408 | V | 81.6 | Confident | 88.3 | Confident | 32 Ų | 32 | 21.1 Ų | 21.1 | 19% | 0.194 | 13% | 0.129 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -56 | -28.9 | -179.7 | 177 | 0 | 0 | 0 | 0 | 112.6 | Q185 I410 V411 | Q185-V408 VanDerWaalsContact OE1-CG1 3.24Å; V408-I410 PolarHBondContact O-N 3.32Å; V408-V411 WeakPolarHBondContact O-CG2 3.32Å; V408-V411 PolarHBondContact O-N 2.8Å |
| 409 | G | 82.7 | Confident | 88.1 | Confident | 4 Ų | 4 | 21.6 Ų | 21.6 | 4% | 0.041 | 13% | 0.134 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -15.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | L407 V411 Y413 G493 | L407-G409 PolarHBondContact O-N 2.81Å; L407-G409 VanDerWaalsContact O-N 3.11Å; G409-V411 PolarHBondContact O-N 3.47Å; G409-Y413 WeakPolarHBondContact O-CD2 3.47Å; G409-Y413 WeakPolarHBondContact O-CE2 3.27Å; G409-G493 WeakPolarHBondContact CA-O 2.91Å |
| 410 | I | 87.3 | Confident | 87.9 | Confident | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.7 | -28.1 | 177.6 | -165.4 | 169.2 | 0 | 0 | 0 | 113.5 | L398 T401 V402 L407 V408 V412 Y413 T414 L554 A555 F558 | L398-I410 HydrophobicContact CD1-CG2 4.14Å; T401-I410 HydrophobicContact CG2-CD1 3.7Å; T401-I410 HydrophobicContact CG2-CG2 4.1Å; V402-I410 HydrophobicContact CG2-CG2 3.73Å; L407-I410 VanDerWaalsContact O-CB 3.3Å; L407-I410 WeakPolarHBondContact O-CB 3.39Å; L407-I410 WeakPolarHBondContact O-CG2 3Å; L407-I410 PolarHBondContact O-N 2.92Å; V408-I410 PolarHBondContact O-N 3.32Å; I410-V412 PolarHBondContact O-N 3.21Å; I410-Y413 PolarHBondContact O-N 2.94Å; I410-Y413 VanDerWaalsContact O-N 3.16Å; I410-T414 PolarHBondContact O-N 3.31Å; I410-T414 VanDerWaalsContact O-N 3.11Å; I410-T414 PolarHBondContact O-OG1 2.59Å; I410-L554 HydrophobicContact CD1-CB 4.35Å; I410-L554 HydrophobicContact CD1-CD2 4.15Å; I410-L554 HydrophobicContact CD1-CG 4Å; I410-L554 HydrophobicContact CG1-CD2 3.51Å; I410-L554 HydrophobicContact CG1-CG 3.73Å; I410-A555 HydrophobicContact CD1-CB 3.89Å; I410-F558 HydrophobicContact CB-CD2 4.35Å; I410-F558 HydrophobicContact CB-CE2 4.3Å; I410-F558 HydrophobicContact CB-CG 4.5Å; I410-F558 HydrophobicContact CB-CZ 4.39Å; I410-F558 HydrophobicContact CG1-CD2 4.22Å; I410-F558 HydrophobicContact CG1-CE2 4.29Å |
| 411 | V | 88.1 | Confident | 88 | Confident | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.9 | -43.2 | -168.2 | 175.2 | 0 | 0 | 0 | 0 | 112.5 | L181 Q185 F197 V402 V408 G409 Y413 T414 P415 | L181-V411 HydrophobicContact CB-CG1 3.86Å; L181-V411 HydrophobicContact CD1-CG1 4.49Å; L181-V411 HydrophobicContact CD2-CG1 3.56Å; L181-V411 HydrophobicContact CG-CG1 3.32Å; Q185-V411 HydrophobicContact CB-CG1 4.36Å; Q185-V411 HydrophobicContact CG-CG1 4.33Å; F197-V411 HydrophobicContact CE1-CG2 4.44Å; V402-V411 HydrophobicContact CB-CG2 4.29Å; V402-V411 HydrophobicContact CG1-CG2 4.02Å; V402-V411 HydrophobicContact CG2-CG2 3.21Å; V408-V411 WeakPolarHBondContact O-CG2 3.32Å; V408-V411 PolarHBondContact O-N 2.8Å; G409-V411 PolarHBondContact O-N 3.47Å; V411-Y413 PolarHBondContact O-N 3.06Å; V411-T414 PolarHBondContact O-N 3.2Å; V411-P415 WeakPolarHBondContact O-CD 3.46Å |
| 412 | V | 91 | Very high | 88 | Confident | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -65 | -31.5 | -179.7 | 73.1 | 0 | 0 | 0 | 0 | 112.1 | G178 M179 D182 I410 I487 S492 | G178-V412 WeakPolarHBondContact CA-O 3.25Å; M179-V412 HydrophobicContact CG-CG2 4.5Å; D182-V412 HydrophobicContact CB-CB 4.18Å; D182-V412 HydrophobicContact CB-CG2 4.35Å; I410-V412 PolarHBondContact O-N 3.21Å; V412-I487 HydrophobicContact CG1-CG2 4.21Å; V412-I487 HydrophobicContact CG2-CD1 4.4Å; V412-I487 HydrophobicContact CG2-CG1 4.43Å; V412-I487 HydrophobicContact CG2-CG2 3.93Å; V412-S492 WeakPolarHBondContact CG2-OG 3.46Å |
| 413 | Y | 92.8 | Very high | 87.9 | Confident | 3 Ų | 3 | 18.3 Ų | 18.3 | 1% | 0.012 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -89.1 | -19.9 | -173.8 | -60.7 | -67.3 | 0 | 0 | 0 | 113.1 | G409 I410 V411 V416 I417 L484 I487 T495 F501 Y505 F558 | G409-Y413 WeakPolarHBondContact O-CD2 3.47Å; G409-Y413 WeakPolarHBondContact O-CE2 3.27Å; I410-Y413 PolarHBondContact O-N 2.94Å; I410-Y413 VanDerWaalsContact O-N 3.16Å; V411-Y413 PolarHBondContact O-N 3.06Å; Y413-V416 WeakPolarHBondContact O-CB 3.24Å; Y413-V416 PolarHBondContact O-N 3.31Å; Y413-I417 PolarHBondContact O-N 3.11Å; Y413-L484 HydrophobicContact CD1-CD2 3.77Å; Y413-L484 HydrophobicContact CE1-CD2 3.41Å; Y413-L484 VanDerWaalsContact CE1-CD2 3.41Å; Y413-I487 HydrophobicContact CD1-CD1 3.75Å; Y413-I487 HydrophobicContact CE1-CD1 3.72Å; Y413-I487 HydrophobicContact CE1-CG2 4.18Å; Y413-T495 HydrophobicContact CE2-CG2 4.33Å; Y413-T495 VanDerWaalsContact CE2-OG1 3.3Å; Y413-T495 WeakPolarHBondContact CE2-OG1 3.4Å; Y413-T495 PolarHBondContact OH-OG1 3.4Å; Y413-F501 HydrophobicContact CD2-CZ 4.05Å; Y413-F501 HydrophobicContact CE1-CE1 4.21Å; Y413-F501 HydrophobicContact CE1-CZ 4.07Å; Y413-F501 HydrophobicContact CE2-CE1 4.34Å; Y413-F501 HydrophobicContact CE2-CE2 4.25Å; Y413-F501 AromaticContact CE2-CZ 3.53Å; Y413-F501 HydrophobicContact CE2-CZ 3.53Å; Y413-F501 AromaticContact CZ-CE1 3.88Å; Y413-F501 AromaticContact CZ-CZ 3.54Å; Y413-Y505 HydrophobicContact CD1-CE2 4.09Å; Y413-Y505 HydrophobicContact CG-CE2 4.23Å; Y413-F558 HydrophobicContact CD2-CE2 4.1Å; Y413-F558 AromaticContact CD2-CZ 3.77Å; Y413-F558 HydrophobicContact CD2-CZ 3.77Å; Y413-F558 AromaticContact CE2-CZ 3.96Å; Y413-F558 HydrophobicContact CE2-CZ 3.96Å |
| 414 | T | 93.2 | Very high | 88 | Confident | 3 Ų | 3 | 15.2 Ų | 15.2 | 2% | 0.018 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -64.1 | -50.8 | -175.5 | -62.2 | 0 | 0 | 0 | 0 | 112.3 | L398 I410 V411 V416 I417 N418 T551 | L398-T414 HydrophobicContact CD1-CG2 4.12Å; L398-T414 HydrophobicContact CD2-CG2 4.16Å; I410-T414 PolarHBondContact O-N 3.31Å; I410-T414 VanDerWaalsContact O-N 3.11Å; I410-T414 PolarHBondContact O-OG1 2.59Å; V411-T414 PolarHBondContact O-N 3.2Å; T414-V416 PolarHBondContact O-N 3.46Å; T414-I417 PolarHBondContact O-N 2.88Å; T414-N418 WeakPolarHBondContact CG2-ND2 3.46Å; T414-N418 VanDerWaalsContact O-CB 3.29Å; T414-N418 WeakPolarHBondContact O-CB 3.46Å; T414-N418 VanDerWaalsContact O-CG 3.29Å; T414-N418 PolarHBondContact O-N 2.94Å; T414-T551 HydrophobicContact CG2-CG2 4.28Å |
| 415 | P | 92.9 | Very high | 88.2 | Confident | 4 Ų | 4 | 12.9 Ų | 12.9 | 3% | 0.026 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -60.3 | -31.5 | 175.4 | -28.3 | 39.8 | 0 | 0 | 0 | 113.3 | A177 L181 V411 G419 | A177-P415 HydrophobicContact CB-CB 4.24Å; L181-P415 HydrophobicContact CD2-CG 3.97Å; V411-P415 WeakPolarHBondContact O-CD 3.46Å; P415-G419 WeakPolarHBondContact O-CA 3.31Å; P415-G419 PolarHBondContact O-N 3.29Å |
| 416 | V | 93.4 | Very high | 88.5 | Confident | 0 Ų | 0 | 8.9 Ų | 8.9 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -69.2 | -51.4 | 178.8 | -179.2 | 0 | 0 | 0 | 0 | 110.7 | V175 Y413 T414 I420 F483 I487 | V175-V416 HydrophobicContact CB-CG2 4.28Å; V175-V416 HydrophobicContact CG2-CG1 4.27Å; V175-V416 HydrophobicContact CG2-CG2 3.71Å; Y413-V416 WeakPolarHBondContact O-CB 3.24Å; Y413-V416 PolarHBondContact O-N 3.31Å; T414-V416 PolarHBondContact O-N 3.46Å; V416-I420 HydrophobicContact CG1-CD1 3.5Å; V416-I420 VanDerWaalsContact O-CB 3.24Å; V416-I420 WeakPolarHBondContact O-CB 3.48Å; V416-I420 VanDerWaalsContact O-CD1 3.31Å; V416-I420 WeakPolarHBondContact O-CD1 3.21Å; V416-I420 WeakPolarHBondContact O-CG1 3.49Å; V416-I420 PolarHBondContact O-N 3.3Å; V416-F483 HydrophobicContact CG1-CB 4.15Å; V416-F483 HydrophobicContact CG1-CD2 4.48Å; V416-I487 HydrophobicContact CG2-CD1 4.24Å |
| 417 | I | 93.8 | Very high | 88.6 | Confident | 0 Ų | 0 | 7.5 Ų | 7.5 | 0% | 0 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -68.1 | -41.5 | -177 | -140.6 | -168.4 | 0 | 0 | 0 | 111.4 | Y413 T414 G421 Y505 A508 A509 Q512 L554 | Y413-I417 PolarHBondContact O-N 3.11Å; T414-I417 PolarHBondContact O-N 2.88Å; I417-G421 PolarHBondContact O-N 3.19Å; I417-G421 VanDerWaalsContact O-N 3.14Å; I417-Y505 HydrophobicContact CD1-CE2 4.49Å; I417-Y505 HydrophobicContact CG1-CE2 4.46Å; I417-A508 HydrophobicContact CD1-CB 4.36Å; I417-A509 HydrophobicContact CD1-CB 4.29Å; I417-A509 HydrophobicContact CG1-CB 4.15Å; I417-Q512 VanDerWaalsContact CG1-OE1 3.24Å; I417-Q512 PolarHBondContact O-NE2 3.35Å; I417-Q512 VanDerWaalsContact O-NE2 3.1Å; I417-Q512 PolarHBondContact O-OE1 3.32Å; I417-L554 HydrophobicContact CD1-CB 4.3Å; I417-L554 HydrophobicContact CD1-CD1 4.42Å; I417-L554 HydrophobicContact CG2-CD2 4.2Å |
| 418 | N | 92.9 | Very high | 88.7 | Confident | 7 Ų | 7 | 7.5 Ų | 7.5 | 4% | 0.037 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -71.5 | -50.6 | 179.6 | -68 | -4 | 0 | 0 | 0 | 111 | T414 I420 G421 G422 D547 G550 T551 | T414-N418 WeakPolarHBondContact CG2-ND2 3.46Å; T414-N418 VanDerWaalsContact O-CB 3.29Å; T414-N418 WeakPolarHBondContact O-CB 3.46Å; T414-N418 VanDerWaalsContact O-CG 3.29Å; T414-N418 PolarHBondContact O-N 2.94Å; N418-I420 PolarHBondContact O-N 3.27Å; N418-G421 PolarHBondContact O-N 3.35Å; N418-G422 PolarHBondContact O-N 2.89Å; N418-D547 PolarHBondContact ND2-O 2.87Å; N418-D547 PolarHBondContact OD1-O 2.87Å; N418-G550 WeakPolarHBondContact OD1-CA 3.38Å; N418-T551 PolarHBondContact ND2-OG1 2.9Å; N418-T551 PolarHBondContact OD1-N 3.22Å |
| 419 | G | 89.5 | Confident | 88.9 | Confident | 9 Ų | 9 | 6 Ų | 6 | 9% | 0.093 | 4% | 0.036 | C | C | . | . | H | α-helix | trans | -64.1 | -43 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | P415 N423 | P415-G419 WeakPolarHBondContact O-CA 3.31Å; P415-G419 PolarHBondContact O-N 3.29Å; G419-N423 VanDerWaalsContact O-CB 3.24Å; G419-N423 WeakPolarHBondContact O-CB 3.24Å; G419-N423 PolarHBondContact O-N 3.37Å; G419-N423 PolarHBondContact O-ND2 3.01Å |
| 420 | I | 89.7 | Confident | 88.7 | Confident | 3 Ų | 3 | 7.7 Ų | 7.7 | 2% | 0.015 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -67.6 | -48.5 | 177.3 | -65.7 | 165.2 | 0 | 0 | 0 | 110.9 | F167 V416 N418 G422 N423 L424 F483 | F167-I420 HydrophobicContact CD2-CG2 4.47Å; F167-I420 HydrophobicContact CE2-CG2 3.53Å; F167-I420 HydrophobicContact CZ-CG2 4.11Å; V416-I420 HydrophobicContact CG1-CD1 3.5Å; V416-I420 VanDerWaalsContact O-CB 3.24Å; V416-I420 WeakPolarHBondContact O-CB 3.48Å; V416-I420 VanDerWaalsContact O-CD1 3.31Å; V416-I420 WeakPolarHBondContact O-CD1 3.21Å; V416-I420 WeakPolarHBondContact O-CG1 3.49Å; V416-I420 PolarHBondContact O-N 3.3Å; N418-I420 PolarHBondContact O-N 3.27Å; I420-G422 PolarHBondContact O-N 3.03Å; I420-N423 PolarHBondContact O-N 3.01Å; I420-L424 HydrophobicContact CG2-CD1 3.94Å; I420-L424 HydrophobicContact CG2-CG 4.2Å; I420-L424 WeakPolarHBondContact O-CB 3.26Å; I420-L424 VanDerWaalsContact O-CG 3.3Å; I420-L424 WeakPolarHBondContact O-CG 3.32Å; I420-L424 PolarHBondContact O-N 2.99Å; I420-F483 HydrophobicContact CD1-CD2 3.17Å; I420-F483 HydrophobicContact CD1-CE2 3.28Å; I420-F483 HydrophobicContact CD1-CG 4.19Å; I420-F483 HydrophobicContact CD1-CZ 4.35Å; I420-F483 HydrophobicContact CG1-CD2 4.42Å; I420-F483 HydrophobicContact CG1-CE2 4.15Å |
| 421 | G | 90.9 | Very high | 88.2 | Confident | 1 Ų | 1 | 11.1 Ų | 11.1 | 1% | 0.01 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -58.1 | -47.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I417 N418 L424 V425 | I417-G421 PolarHBondContact O-N 3.19Å; I417-G421 VanDerWaalsContact O-N 3.14Å; N418-G421 PolarHBondContact O-N 3.35Å; G421-L424 PolarHBondContact O-N 3.43Å; G421-V425 WeakPolarHBondContact O-CG1 3.31Å; G421-V425 PolarHBondContact O-N 3.08Å |
| 422 | G | 89.4 | Confident | 87.9 | Confident | 5 Ų | 5 | 11.1 Ų | 11.1 | 5% | 0.052 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -60.6 | -44.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | N418 I420 V425 A426 | N418-G422 PolarHBondContact O-N 2.89Å; I420-G422 PolarHBondContact O-N 3.03Å; G422-V425 VanDerWaalsContact O-CG1 3.28Å; G422-V425 WeakPolarHBondContact O-CG1 3.44Å; G422-A426 VanDerWaalsContact O-CB 3.26Å; G422-A426 WeakPolarHBondContact O-CB 3.48Å; G422-A426 PolarHBondContact O-N 3.01Å |
| 423 | N | 86 | Confident | 87.3 | Confident | 35 Ų | 35 | 11.1 Ų | 11.1 | 19% | 0.187 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -66.7 | -42.8 | 178.6 | -71.4 | -31.4 | 0 | 0 | 0 | 112.2 | G419 I420 A426 I427 | G419-N423 VanDerWaalsContact O-CB 3.24Å; G419-N423 WeakPolarHBondContact O-CB 3.24Å; G419-N423 PolarHBondContact O-N 3.37Å; G419-N423 PolarHBondContact O-ND2 3.01Å; I420-N423 PolarHBondContact O-N 3.01Å; N423-A426 PolarHBondContact O-N 3.39Å; N423-I427 VanDerWaalsContact O-CG1 3.3Å; N423-I427 WeakPolarHBondContact O-CG1 3.3Å; N423-I427 PolarHBondContact O-N 2.97Å |
| 424 | L | 87.6 | Confident | 86.5 | Confident | 2 Ų | 2 | 14.2 Ų | 14.2 | 1% | 0.01 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -62.4 | -46.6 | 178.7 | -74.6 | -179.2 | 0 | 0 | 0 | 111.8 | F167 I420 G421 A426 I427 Q428 L472 V476 V513 | F167-L424 HydrophobicContact CD2-CD2 3.63Å; F167-L424 HydrophobicContact CD2-CG 4.25Å; F167-L424 HydrophobicContact CE2-CD1 4.04Å; F167-L424 HydrophobicContact CE2-CD2 3.84Å; F167-L424 HydrophobicContact CE2-CG 4.09Å; I420-L424 HydrophobicContact CG2-CD1 3.94Å; I420-L424 HydrophobicContact CG2-CG 4.2Å; I420-L424 WeakPolarHBondContact O-CB 3.26Å; I420-L424 VanDerWaalsContact O-CG 3.3Å; I420-L424 WeakPolarHBondContact O-CG 3.32Å; I420-L424 PolarHBondContact O-N 2.99Å; G421-L424 PolarHBondContact O-N 3.43Å; L424-A426 VanDerWaalsContact C-N 3.33Å; L424-I427 PolarHBondContact O-N 3.11Å; L424-Q428 PolarHBondContact O-N 3.33Å; L424-Q428 VanDerWaalsContact O-N 3.1Å; L424-L472 HydrophobicContact CD2-CB 4.48Å; L424-L472 HydrophobicContact CD2-CD2 3.92Å; L424-V476 HydrophobicContact CD1-CG2 3.94Å; L424-V513 HydrophobicContact CD1-CG1 4.01Å; L424-V513 HydrophobicContact CD1-CG2 4.07Å |
| 425 | V | 89.4 | Confident | 85.7 | Confident | 1 Ų | 1 | 17 Ų | 17 | 1% | 0.006 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -69 | -34.6 | -178.8 | 73.4 | 0 | 0 | 0 | 0 | 111.6 | G421 G422 Q428 A429 L516 A520 L542 | G421-V425 WeakPolarHBondContact O-CG1 3.31Å; G421-V425 PolarHBondContact O-N 3.08Å; G422-V425 VanDerWaalsContact O-CG1 3.28Å; G422-V425 WeakPolarHBondContact O-CG1 3.44Å; V425-Q428 PolarHBondContact O-N 3.49Å; V425-A429 WeakPolarHBondContact O-CB 3.14Å; V425-A429 PolarHBondContact O-N 3.21Å; V425-L516 HydrophobicContact CB-CB 4.02Å; V425-L516 HydrophobicContact CB-CD1 4.49Å; V425-L516 HydrophobicContact CG1-CD1 4.33Å; V425-L516 HydrophobicContact CG2-CB 3.84Å; V425-L516 WeakPolarHBondContact CG2-O 3.29Å; V425-A520 HydrophobicContact CG2-CB 3.62Å; V425-L542 HydrophobicContact CB-CB 4.43Å; V425-L542 HydrophobicContact CG1-CB 3.69Å; V425-L542 HydrophobicContact CG2-CB 3.84Å; V425-L542 HydrophobicContact CG2-CD1 3.96Å; V425-L542 HydrophobicContact CG2-CD2 3.87Å; V425-L542 HydrophobicContact CG2-CG 4.03Å |
| 426 | A | 84.8 | Confident | 84.9 | Confident | 1 Ų | 1 | 16.8 Ų | 16.8 | 1% | 0.008 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -66.4 | -40.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | M212 G422 N423 L424 Q428 A429 S430 I539 T543 | M212-A426 HydrophobicContact CE-CB 3.51Å; M212-A426 HydrophobicContact SD-CB 3.91Å; G422-A426 VanDerWaalsContact O-CB 3.26Å; G422-A426 WeakPolarHBondContact O-CB 3.48Å; G422-A426 PolarHBondContact O-N 3.01Å; N423-A426 PolarHBondContact O-N 3.39Å; L424-A426 VanDerWaalsContact C-N 3.33Å; A426-Q428 VanDerWaalsContact C-N 3.31Å; A426-Q428 PolarHBondContact O-N 2.84Å; A426-A429 PolarHBondContact O-N 3.5Å; A426-S430 WeakPolarHBondContact O-CB 3.29Å; A426-S430 PolarHBondContact O-N 3.34Å; A426-I539 HydrophobicContact CB-CG2 3.99Å; A426-T543 HydrophobicContact CB-CG2 4.36Å |
| 427 | I | 80.1 | Confident | 83.9 | Confident | 46 Ų | 46 | 20.1 Ų | 20.1 | 24% | 0.236 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -59 | -44.6 | 172.2 | -69.3 | 165.4 | 0 | 0 | 0 | 110.6 | N423 L424 R431 | N423-I427 VanDerWaalsContact O-CG1 3.3Å; N423-I427 WeakPolarHBondContact O-CG1 3.3Å; N423-I427 PolarHBondContact O-N 2.97Å; L424-I427 PolarHBondContact O-N 3.11Å; I427-R431 WeakPolarHBondContact O-CB 3.37Å; I427-R431 VanDerWaalsContact O-CG 3.3Å; I427-R431 WeakPolarHBondContact O-CG 3.29Å; I427-R431 PolarHBondContact O-N 3.39Å; I427-R431 VanDerWaalsContact O-N 3.09Å |
| 428 | Q | 85.5 | Confident | 82.9 | Confident | 1 Ų | 1 | 24.6 Ų | 24.6 | 1% | 0.005 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -65 | -45.1 | 178.3 | -175.5 | 66.3 | 8.6 | 0 | 0 | 111.8 | L424 V425 A426 S430 R431 I432 N465 S468 L472 L517 | L424-Q428 PolarHBondContact O-N 3.33Å; L424-Q428 VanDerWaalsContact O-N 3.1Å; V425-Q428 PolarHBondContact O-N 3.49Å; A426-Q428 VanDerWaalsContact C-N 3.31Å; A426-Q428 PolarHBondContact O-N 2.84Å; Q428-S430 PolarHBondContact O-N 3.42Å; Q428-R431 PolarHBondContact O-N 3.01Å; Q428-I432 HydrophobicContact CG-CD1 3.98Å; Q428-I432 WeakPolarHBondContact O-CG1 3.27Å; Q428-I432 PolarHBondContact O-N 3.15Å; Q428-N465 PolarHBondContact NE2-O 2.71Å; Q428-S468 VanDerWaalsContact OE1-CB 3.22Å; Q428-S468 PolarHBondContact OE1-OG 2.94Å; Q428-L472 HydrophobicContact CB-CD1 3.79Å; Q428-L472 HydrophobicContact CG-CD1 4.5Å; Q428-L517 HydrophobicContact CB-CD2 3.58Å; Q428-L517 HydrophobicContact CG-CD2 3.75Å |
| 429 | A | 85.4 | Confident | 81.8 | Confident | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -60.4 | -47.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | V425 A426 R431 I432 S433 V524 I539 L542 | V425-A429 WeakPolarHBondContact O-CB 3.14Å; V425-A429 PolarHBondContact O-N 3.21Å; A426-A429 PolarHBondContact O-N 3.5Å; A429-R431 VanDerWaalsContact C-N 3.34Å; A429-R431 PolarHBondContact O-N 3.04Å; A429-I432 PolarHBondContact O-N 3.45Å; A429-S433 WeakPolarHBondContact O-CB 3.32Å; A429-S433 PolarHBondContact O-N 2.95Å; A429-V524 HydrophobicContact CB-CG2 3.95Å; A429-I539 HydrophobicContact CB-CG1 3.89Å; A429-L542 HydrophobicContact CB-CD1 3.63Å |
| 430 | S | 78.9 | Confident | 80.8 | Confident | 40 Ų | 40 | 28.4 Ų | 28.4 | 28% | 0.28 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -62.3 | -38.2 | 177.2 | 178.4 | 0 | 0 | 0 | 0 | 112.6 | A426 Q428 S433 T434 D535 | A426-S430 WeakPolarHBondContact O-CB 3.29Å; A426-S430 PolarHBondContact O-N 3.34Å; Q428-S430 PolarHBondContact O-N 3.42Å; S430-S433 PolarHBondContact O-N 3.17Å; S430-T434 WeakPolarHBondContact O-CB 3.37Å; S430-T434 PolarHBondContact O-N 3.49Å; S430-T434 PolarHBondContact O-OG1 3.13Å; S430-D535 WeakPolarHBondContact CA-OD1 3.26Å |
| 431 | R | 78 | Confident | 80.1 | Confident | 73 Ų | 73 | 33.1 Ų | 33.1 | 28% | 0.275 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -65 | -43.2 | 175 | -77.1 | 175.3 | 170.6 | -132.1 | -9.3 | 112.6 | M159 I427 Q428 A429 Y435 S468 | M159-R431 PolarHBondContact SD-NH1 3.32Å; I427-R431 WeakPolarHBondContact O-CB 3.37Å; I427-R431 VanDerWaalsContact O-CG 3.3Å; I427-R431 WeakPolarHBondContact O-CG 3.29Å; I427-R431 PolarHBondContact O-N 3.39Å; I427-R431 VanDerWaalsContact O-N 3.09Å; Q428-R431 PolarHBondContact O-N 3.01Å; A429-R431 VanDerWaalsContact C-N 3.34Å; A429-R431 PolarHBondContact O-N 3.04Å; R431-Y435 WeakPolarHBondContact O-CB 3.36Å; R431-Y435 PolarHBondContact O-N 3.02Å; R431-S468 PolarHBondContact NH1-OG 2.88Å |
| 432 | I | 81.3 | Confident | 79.2 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.5 | -44.3 | 176.8 | -61 | 168.1 | 0 | 0 | 0 | 110 | Q428 A429 Y435 L436 N465 D521 V524 | Q428-I432 HydrophobicContact CG-CD1 3.98Å; Q428-I432 WeakPolarHBondContact O-CG1 3.27Å; Q428-I432 PolarHBondContact O-N 3.15Å; A429-I432 PolarHBondContact O-N 3.45Å; I432-Y435 WeakPolarHBondContact O-CB 3.01Å; I432-Y435 PolarHBondContact O-N 3.03Å; I432-L436 HydrophobicContact CG2-CD1 4.19Å; I432-L436 WeakPolarHBondContact O-CG 3.43Å; I432-L436 PolarHBondContact O-N 3.2Å; I432-N465 HydrophobicContact CG1-CB 4.15Å; I432-D521 HydrophobicContact CD1-CB 4.46Å; I432-V524 HydrophobicContact CB-CB 4.5Å; I432-V524 HydrophobicContact CB-CG1 3.93Å; I432-V524 HydrophobicContact CG2-CB 4.12Å; I432-V524 HydrophobicContact CG2-CG1 3.46Å; I432-V524 VanDerWaalsContact CG2-CG1 3.46Å |
| 433 | S | 78.9 | Confident | 78.2 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -57.2 | -50.8 | 176.1 | -173.8 | 0 | 0 | 0 | 0 | 111.5 | A429 S430 Y435 L436 H437 D535 | A429-S433 WeakPolarHBondContact O-CB 3.32Å; A429-S433 PolarHBondContact O-N 2.95Å; S430-S433 PolarHBondContact O-N 3.17Å; S433-Y435 VanDerWaalsContact C-N 3.28Å; S433-Y435 PolarHBondContact O-N 2.92Å; S433-L436 WeakPolarHBondContact O-CB 3.41Å; S433-L436 PolarHBondContact O-N 3.25Å; S433-L436 VanDerWaalsContact O-N 3.07Å; S433-H437 PolarHBondContact O-CD2 3.21Å; S433-H437 PolarHBondContact O-N 3.16Å; S433-D535 WeakPolarHBondContact CB-OD1 3.03Å; S433-D535 PolarHBondContact OG-OD1 3.34Å; S433-D535 PolarHBondContact OG-OD2 3.27Å |
| 434 | T | 75.1 | Confident | 77.5 | Confident | 67 Ų | 67 | 41.8 Ų | 41.8 | 41% | 0.411 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -58.7 | -41.1 | 176.9 | -58.2 | 0 | 0 | 0 | 0 | 111.7 | S430 L436 H437 L438 | S430-T434 WeakPolarHBondContact O-CB 3.37Å; S430-T434 PolarHBondContact O-N 3.49Å; S430-T434 PolarHBondContact O-OG1 3.13Å; T434-L436 VanDerWaalsContact C-N 3.35Å; T434-L436 PolarHBondContact O-N 3.2Å; T434-H437 PolarHBondContact O-N 3.42Å; T434-L438 HydrophobicContact CG2-CD1 4.07Å; T434-L438 VanDerWaalsContact O-CG 3.28Å; T434-L438 WeakPolarHBondContact O-CG 3.42Å; T434-L438 PolarHBondContact O-N 3.05Å; T434-L438 VanDerWaalsContact O-N 3.16Å |
| 435 | Y | 76.3 | Confident | 76.5 | Confident | 61 Ų | 61 | 43 Ų | 43 | 24% | 0.239 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.2 | -43.5 | 176.2 | 175.6 | -94.4 | 0 | 0 | 0 | 111.9 | R431 I432 S433 L438 H439 | R431-Y435 WeakPolarHBondContact O-CB 3.36Å; R431-Y435 PolarHBondContact O-N 3.02Å; I432-Y435 WeakPolarHBondContact O-CB 3.01Å; I432-Y435 PolarHBondContact O-N 3.03Å; S433-Y435 VanDerWaalsContact C-N 3.28Å; S433-Y435 PolarHBondContact O-N 2.92Å; Y435-L438 PolarHBondContact O-N 3.47Å; Y435-H439 AromaticContact CD2-CE1 3.61Å; Y435-H439 AromaticContact CD2-ND1 3.52Å; Y435-H439 AromaticContact CE2-CE1 3.5Å; Y435-H439 VanDerWaalsContact CE2-CE1 3.5Å; Y435-H439 WeakPolarHBondContact CE2-CE1 3.19Å; Y435-H439 AromaticContact CE2-CG 3.97Å; Y435-H439 AromaticContact CE2-ND1 3.49Å; Y435-H439 WeakPolarHBondContact CE2-ND1 3.39Å; Y435-H439 AromaticContact CE2-NE2 3.96Å; Y435-H439 AromaticContact CZ-ND1 3.99Å; Y435-H439 PolarHBondContact O-N 2.99Å; Y435-H439 PolarHBondContact O-ND1 3.47Å |
| 436 | L | 76.5 | Confident | 75.2 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.4 | -45.8 | 178.1 | -69.8 | 169.4 | 0 | 0 | 0 | 111.7 | I432 S433 T434 L438 H439 S440 P446 V524 W528 | I432-L436 HydrophobicContact CG2-CD1 4.19Å; I432-L436 WeakPolarHBondContact O-CG 3.43Å; I432-L436 PolarHBondContact O-N 3.2Å; S433-L436 WeakPolarHBondContact O-CB 3.41Å; S433-L436 PolarHBondContact O-N 3.25Å; S433-L436 VanDerWaalsContact O-N 3.07Å; T434-L436 VanDerWaalsContact C-N 3.35Å; T434-L436 PolarHBondContact O-N 3.2Å; L436-L438 PolarHBondContact O-N 2.64Å; L436-L438 VanDerWaalsContact O-N 3.17Å; L436-H439 PolarHBondContact O-N 3.32Å; L436-H439 VanDerWaalsContact O-N 3.17Å; L436-S440 WeakPolarHBondContact O-CA 3.41Å; L436-S440 PolarHBondContact O-N 3.46Å; L436-S440 VanDerWaalsContact O-O 3.05Å; L436-P446 HydrophobicContact CD2-CG 4.15Å; L436-V524 HydrophobicContact CD1-CG1 3.83Å; L436-W528 HydrophobicContact CB-CD2 3.75Å; L436-W528 HydrophobicContact CB-CE3 3.9Å; L436-W528 HydrophobicContact CB-CG 4.36Å; L436-W528 HydrophobicContact CB-CH2 4.08Å; L436-W528 HydrophobicContact CB-CZ2 3.93Å; L436-W528 HydrophobicContact CB-CZ3 4.05Å; L436-W528 HydrophobicContact CD1-CB 3.91Å; L436-W528 HydrophobicContact CD1-CD2 3.93Å; L436-W528 HydrophobicContact CD1-CE3 4.2Å; L436-W528 HydrophobicContact CD1-CG 3.79Å; L436-W528 HydrophobicContact CG-CD2 4.34Å; L436-W528 HydrophobicContact CG-CG 4.47Å |
| 437 | H | 72.9 | Confident | 73.8 | Confident | 70 Ų | 70 | 51.2 Ų | 51.2 | 32% | 0.324 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -57.3 | -30.2 | 174.7 | -83.6 | -74.3 | 0 | 0 | 0 | 113.8 | S433 T434 W528 D533 | S433-H437 PolarHBondContact O-CD2 3.21Å; S433-H437 PolarHBondContact O-N 3.16Å; T434-H437 PolarHBondContact O-N 3.42Å; H437-W528 HydrophobicContact CB-CH2 4.2Å; H437-W528 AromaticContact CD2-CH2 3.89Å; H437-W528 AromaticContact CD2-CZ3 3.57Å; H437-W528 AromaticContact CE1-CH2 3.75Å; H437-W528 AromaticContact CE1-CZ3 3.63Å; H437-W528 AromaticContact CG-CH2 3.59Å; H437-W528 AromaticContact CG-CZ3 3.78Å; H437-W528 AromaticContact ND1-CH2 3.49Å; H437-W528 WeakPolarHBondContact ND1-CH2 3.19Å; H437-W528 AromaticContact ND1-CZ3 3.81Å; H437-W528 AromaticContact NE2-CH2 3.98Å; H437-W528 AromaticContact NE2-CZ3 3.47Å; H437-W528 WeakPolarHBondContact NE2-CZ3 3.48Å; H437-D533 IonicContact NE2-OD1 2.99Å |
| 438 | L | 70.9 | Confident | 72.7 | Confident | 95 Ų | 95 | 56.8 Ų | 56.8 | 50% | 0.497 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -85.4 | -23.6 | -180 | -70.6 | 173.1 | 0 | 0 | 0 | 114.2 | T434 Y435 L436 | T434-L438 HydrophobicContact CG2-CD1 4.07Å; T434-L438 VanDerWaalsContact O-CG 3.28Å; T434-L438 WeakPolarHBondContact O-CG 3.42Å; T434-L438 PolarHBondContact O-N 3.05Å; T434-L438 VanDerWaalsContact O-N 3.16Å; Y435-L438 PolarHBondContact O-N 3.47Å; L436-L438 PolarHBondContact O-N 2.64Å; L436-L438 VanDerWaalsContact O-N 3.17Å |
| 439 | H | 71.2 | Confident | 71.3 | Confident | 75 Ų | 75 | 57.1 Ų | 57.1 | 35% | 0.347 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -124.7 | -6.1 | -168.7 | -62 | 85.2 | 0 | 0 | 0 | 114.2 | Y435 L436 | Y435-H439 AromaticContact CD2-CE1 3.61Å; Y435-H439 AromaticContact CD2-ND1 3.52Å; Y435-H439 AromaticContact CE2-CE1 3.5Å; Y435-H439 VanDerWaalsContact CE2-CE1 3.5Å; Y435-H439 WeakPolarHBondContact CE2-CE1 3.19Å; Y435-H439 AromaticContact CE2-CG 3.97Å; Y435-H439 AromaticContact CE2-ND1 3.49Å; Y435-H439 WeakPolarHBondContact CE2-ND1 3.39Å; Y435-H439 AromaticContact CE2-NE2 3.96Å; Y435-H439 AromaticContact CZ-ND1 3.99Å; Y435-H439 PolarHBondContact O-N 2.99Å; Y435-H439 PolarHBondContact O-ND1 3.47Å; L436-H439 PolarHBondContact O-N 3.32Å; L436-H439 VanDerWaalsContact O-N 3.17Å |
| 440 | S | 68.9 | Low | 69.8 | Low | 21 Ų | 21 | 62.9 Ų | 62.9 | 15% | 0.147 | 32% | 0.322 | C | S | . | . | S | Bend | trans | -146.9 | 153 | -174.6 | -59.6 | 0 | 0 | 0 | 0 | 110.2 | L436 P446 W528 | L436-S440 WeakPolarHBondContact O-CA 3.41Å; L436-S440 PolarHBondContact O-N 3.46Å; L436-S440 VanDerWaalsContact O-O 3.05Å; S440-P446 VanDerWaalsContact OG-CD 3.29Å; S440-P446 WeakPolarHBondContact OG-CD 3.37Å; S440-P446 WeakPolarHBondContact OG-CG 3.39Å; S440-W528 WeakPolarHBondContact O-CZ2 3.27Å |
| 441 | I | 73.2 | Confident | 68.9 | Low | 102 Ų | 102 | 63.3 Ų | 63.3 | 52% | 0.523 | 33% | 0.332 | S | S | . | . | trans | -85 | 144.6 | 169.8 | 46 | 169 | 0 | 0 | 0 | 109.7 | G443 E444 W528 | I441-G443 PolarHBondContact O-N 2.8Å; I441-E444 HydrophobicContact CD1-CB 4.45Å; I441-E444 HydrophobicContact CD1-CG 3.91Å; I441-E444 HydrophobicContact CG1-CB 3.95Å; I441-E444 HydrophobicContact CG1-CG 3.95Å; I441-E444 PolarHBondContact O-N 3.39Å; I441-E444 VanDerWaalsContact O-N 3.11Å; I441-W528 PolarHBondContact O-NE1 3.46Å; I441-W528 VanDerWaalsContact O-NE1 3.14Å | ||
| 442 | P | 74 | Confident | 67.8 | Low | 62 Ų | 62 | 64.8 Ų | 64.8 | 40% | 0.403 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.9 | 133.9 | 173.9 | -27.1 | 34.9 | 0 | 0 | 0 | 111.3 | E444 W528 | P442-E444 PolarHBondContact O-N 3.39Å; P442-W528 HydrophobicContact CB-CZ2 4.45Å; P442-W528 HydrophobicContact CG-CH2 4.11Å; P442-W528 HydrophobicContact CG-CZ2 4.11Å |
| 443 | G | 67.3 | Low | 67 | Low | 34 Ų | 34 | 67.8 Ų | 67.8 | 35% | 0.351 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.3 | -22.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | I441 W528 | I441-G443 PolarHBondContact O-N 2.8Å; G443-W528 WeakPolarHBondContact CA-O 3.44Å; G443-W528 PolarHBondContact N-O 2.97Å |
| 444 | E | 71.7 | Confident | 66.5 | Low | 127 Ų | 127 | 73.8 Ų | 73.8 | 59% | 0.593 | 39% | 0.388 | S | S | * | . | P | Polyproline II helix | trans | -103.7 | 127.1 | 173.4 | -60.2 | -163.7 | 160.1 | 0 | 0 | 111.3 | I441 P442 W528 | I441-E444 HydrophobicContact CD1-CB 4.45Å; I441-E444 HydrophobicContact CD1-CG 3.91Å; I441-E444 HydrophobicContact CG1-CB 3.95Å; I441-E444 HydrophobicContact CG1-CG 3.95Å; I441-E444 PolarHBondContact O-N 3.39Å; I441-E444 VanDerWaalsContact O-N 3.11Å; P442-E444 PolarHBondContact O-N 3.39Å; E444-W528 PolarHBondContact O-NE1 2.86Å |
| 445 | L | 66.6 | Low | 66.1 | Low | 26 Ų | 26 | 72.5 Ų | 72.5 | 14% | 0.136 | 38% | 0.381 | C | S | . | . | P | Polyproline II helix | trans | -84.3 | 136.9 | 170.7 | -77.8 | 113.4 | 0 | 0 | 0 | 110.1 | A449 K450 Y453 H525 K529 | L445-A449 HydrophobicContact CB-CB 4.32Å; L445-A449 HydrophobicContact CD2-CB 3.76Å; L445-K450 HydrophobicContact CB-CG 4.27Å; L445-K450 WeakPolarHBondContact O-CE 3.31Å; L445-Y453 WeakPolarHBondContact CD2-OH 3.45Å; L445-H525 HydrophobicContact CD2-CB 4.04Å; L445-K529 HydrophobicContact CD1-CB 3.71Å; L445-K529 HydrophobicContact CD1-CD 3.66Å; L445-K529 HydrophobicContact CD1-CG 3.56Å |
| 446 | P | 62.2 | Low | 65.5 | Low | 29 Ų | 29 | 73.2 Ų | 73.2 | 19% | 0.188 | 39% | 0.393 | C | S | . | . | P | Polyproline II helix | trans | -57.7 | 146.5 | 169.8 | 19.5 | -23.7 | 0 | 0 | 0 | 109.7 | L436 S440 E448 A449 K450 | L436-P446 HydrophobicContact CD2-CG 4.15Å; S440-P446 VanDerWaalsContact OG-CD 3.29Å; S440-P446 WeakPolarHBondContact OG-CD 3.37Å; S440-P446 WeakPolarHBondContact OG-CG 3.39Å; P446-E448 PolarHBondContact O-N 3.42Å; P446-E448 VanDerWaalsContact O-N 3.08Å; P446-A449 HydrophobicContact CG-CB 3.78Å; P446-A449 WeakPolarHBondContact O-CA 3.34Å; P446-A449 WeakPolarHBondContact O-CB 3.41Å; P446-A449 PolarHBondContact O-N 3.49Å; P446-K450 PolarHBondContact O-N 3.08Å |
| 447 | E | 54 | Low | 65.2 | Low | 147 Ų | 147 | 75.8 Ų | 75.8 | 69% | 0.687 | 40% | 0.403 | S | S | * | . | G | 310 helix | trans | -50.2 | -36.8 | -179.4 | -77 | -80.9 | 126.3 | 0 | 0 | 112 | A449 K450 | E447-A449 VanDerWaalsContact C-N 3.28Å; E447-A449 PolarHBondContact O-N 3.42Å; E447-K450 PolarHBondContact O-N 3.33Å; E447-K450 IonicContact OE1-NZ 2.69Å; E447-K450 PolarHBondContact OE1-NZ 3.49Å |
| 448 | E | 56.8 | Low | 65.1 | Low | 163 Ų | 163 | 72.5 Ų | 72.5 | 76% | 0.762 | 39% | 0.388 | S | S | * | . | G | 310 helix | trans | -67.7 | -22.9 | 177.2 | -60.7 | 179.6 | 177.2 | 0 | 0 | 114 | P446 R457 | P446-E448 PolarHBondContact O-N 3.42Å; P446-E448 VanDerWaalsContact O-N 3.08Å; E448-R457 PolarHBondContact O-NH2 3.45Å |
| 449 | A | 57.6 | Low | 65.3 | Low | 7 Ų | 7 | 68.6 Ų | 68.6 | 6% | 0.058 | 37% | 0.367 | C | S | . | . | G | 310 helix | trans | -91.1 | -16.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L445 P446 E447 G451 R457 | L445-A449 HydrophobicContact CB-CB 4.32Å; L445-A449 HydrophobicContact CD2-CB 3.76Å; P446-A449 HydrophobicContact CG-CB 3.78Å; P446-A449 WeakPolarHBondContact O-CA 3.34Å; P446-A449 WeakPolarHBondContact O-CB 3.41Å; P446-A449 PolarHBondContact O-N 3.49Å; E447-A449 VanDerWaalsContact C-N 3.28Å; E447-A449 PolarHBondContact O-N 3.42Å; A449-G451 PolarHBondContact O-N 3.36Å; A449-R457 PolarHBondContact O-NH1 3.1Å; A449-R457 PolarHBondContact O-NH2 3.12Å |
| 450 | K | 54.3 | Low | 65.2 | Low | 122 Ų | 122 | 74 Ų | 74 | 53% | 0.53 | 39% | 0.385 | S | S | . | . | trans | -68.2 | 118.1 | 175.5 | -63.7 | 179.2 | -174 | 172.6 | 0 | 110.8 | L445 P446 E447 | L445-K450 HydrophobicContact CB-CG 4.27Å; L445-K450 WeakPolarHBondContact O-CE 3.31Å; P446-K450 PolarHBondContact O-N 3.08Å; E447-K450 PolarHBondContact O-N 3.33Å; E447-K450 IonicContact OE1-NZ 2.69Å; E447-K450 PolarHBondContact OE1-NZ 3.49Å | ||
| 451 | G | 58.9 | Low | 65 | Low | 49 Ų | 49 | 74 Ų | 74 | 51% | 0.505 | 39% | 0.39 | S | S | . | . | S | Bend | trans | 153.9 | 176.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A449 R457 | A449-G451 PolarHBondContact O-N 3.36Å; G451-R457 PolarHBondContact O-NH1 2.7Å |
| 452 | C | 55.6 | Low | 64.4 | Low | 103 Ų | 103 | 76 Ų | 76 | 70% | 0.696 | 41% | 0.406 | S | S | * | . | trans | -67.5 | 142.2 | 174.5 | -74.3 | 0 | 0 | 0 | 0 | 111.4 | Y454 R457 | C452-Y454 HydrophobicContact CB-CD1 4.17Å; C452-Y454 HydrophobicContact CB-CE1 4.45Å; C452-Y454 WeakPolarHBondContact O-CD1 3.33Å; C452-R457 PolarHBondContact O-NH1 3.41Å | ||
| 453 | Y | 65.2 | Low | 64.2 | Low | 63 Ų | 63 | 74.7 Ų | 74.7 | 25% | 0.247 | 40% | 0.404 | C | S | . | . | trans | -94.1 | 111 | 175.6 | -63.9 | -91 | 0 | 0 | 0 | 108.7 | L445 W522 H525 | L445-Y453 WeakPolarHBondContact CD2-OH 3.45Å; Y453-W522 HydrophobicContact CD1-CB 4.33Å; Y453-W522 AromaticContact CD2-CD1 3.7Å; Y453-W522 HydrophobicContact CG-CB 4.3Å; Y453-W522 AromaticContact CG-CD1 3.76Å; Y453-W522 HydrophobicContact CG-CG 4.45Å; Y453-H525 HydrophobicContact CE1-CB 3.96Å; Y453-H525 AromaticContact CE1-ND1 3.99Å; Y453-H525 WeakPolarHBondContact OH-CB 3.34Å | ||
| 454 | Y | 67.9 | Low | 64.3 | Low | 126 Ų | 126 | 76.8 Ų | 76.8 | 49% | 0.494 | 41% | 0.41 | S | S | . | . | trans | -133.8 | 150.3 | 174.2 | 49.7 | -92.8 | 0 | 0 | 0 | 109.2 | C452 C456 R457 | C452-Y454 HydrophobicContact CB-CD1 4.17Å; C452-Y454 HydrophobicContact CB-CE1 4.45Å; C452-Y454 WeakPolarHBondContact O-CD1 3.33Å; Y454-C456 HydrophobicContact CD2-CB 3.77Å; Y454-C456 HydrophobicContact CE2-CB 3.95Å; Y454-C456 PolarHBondContact O-N 2.94Å; Y454-R457 HydrophobicContact CD2-CB 4.05Å; Y454-R457 HydrophobicContact CE2-CB 3.8Å; Y454-R457 WeakPolarHBondContact O-CB 3.34Å; Y454-R457 PolarHBondContact O-N 3.14Å | ||
| 455 | P | 66.6 | Low | 64.5 | Low | 41 Ų | 41 | 71.7 Ų | 71.7 | 27% | 0.266 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -52.7 | -35.3 | -173.3 | -27.3 | 33 | 0 | 0 | 0 | 113.6 | R457 T458 Y459 F514 W518 | P455-R457 PolarHBondContact O-N 3.19Å; P455-T458 PolarHBondContact O-N 3.13Å; P455-Y459 VanDerWaalsContact O-CD2 3.3Å; P455-Y459 WeakPolarHBondContact O-CD2 3.27Å; P455-Y459 PolarHBondContact O-N 2.84Å; P455-Y459 VanDerWaalsContact O-N 3.08Å; P455-F514 HydrophobicContact CB-CZ 4.03Å; P455-W518 HydrophobicContact CB-CG 4.45Å; P455-W518 HydrophobicContact CG-CD2 3.93Å; P455-W518 HydrophobicContact CG-CE3 4.48Å; P455-W518 HydrophobicContact CG-CG 4.14Å; P455-W518 HydrophobicContact CG-CZ2 4.26Å |
| 456 | C | 63.8 | Low | 65.2 | Low | 75 Ų | 75 | 71.7 Ų | 71.7 | 51% | 0.507 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.4 | -26.8 | 179.8 | -55.3 | 0 | 0 | 0 | 0 | 113.5 | Y454 Y460 | Y454-C456 HydrophobicContact CD2-CB 3.77Å; Y454-C456 HydrophobicContact CE2-CB 3.95Å; Y454-C456 PolarHBondContact O-N 2.94Å; C456-Y460 HydrophobicContact CB-CD2 4.07Å; C456-Y460 WeakPolarHBondContact O-CA 3.4Å; C456-Y460 VanDerWaalsContact O-CB 3.27Å; C456-Y460 WeakPolarHBondContact O-CB 3.43Å; C456-Y460 WeakPolarHBondContact O-CD2 3.5Å; C456-Y460 PolarHBondContact O-N 3Å |
| 457 | R | 70.4 | Confident | 66.1 | Low | 54 Ų | 54 | 74.1 Ų | 74.1 | 20% | 0.204 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -72.8 | -43.8 | 176.4 | -173.8 | 178.6 | 177.9 | -164.3 | -1.8 | 111.4 | E448 A449 G451 C452 Y454 P455 Y459 G461 N466 | E448-R457 PolarHBondContact O-NH2 3.45Å; A449-R457 PolarHBondContact O-NH1 3.1Å; A449-R457 PolarHBondContact O-NH2 3.12Å; G451-R457 PolarHBondContact O-NH1 2.7Å; C452-R457 PolarHBondContact O-NH1 3.41Å; Y454-R457 HydrophobicContact CD2-CB 4.05Å; Y454-R457 HydrophobicContact CE2-CB 3.8Å; Y454-R457 WeakPolarHBondContact O-CB 3.34Å; Y454-R457 PolarHBondContact O-N 3.14Å; P455-R457 PolarHBondContact O-N 3.19Å; R457-Y459 VanDerWaalsContact C-N 3.34Å; R457-Y459 PolarHBondContact O-N 2.99Å; R457-G461 PolarHBondContact O-N 3.33Å; R457-N466 PolarHBondContact O-ND2 3.36Å |
| 458 | T | 70 | Confident | 67.4 | Low | 2 Ų | 2 | 67.2 Ų | 67.2 | 1% | 0.012 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -62.6 | -41 | 178 | -49 | 0 | 0 | 0 | 0 | 111.2 | P455 N466 D521 | P455-T458 PolarHBondContact O-N 3.13Å; T458-N466 WeakPolarHBondContact O-CA 3.36Å; T458-N466 WeakPolarHBondContact O-CB 3.48Å; T458-D521 HydrophobicContact CG2-CB 3.69Å; T458-D521 PolarHBondContact OG1-OD2 2.94Å |
| 459 | Y | 74.3 | Confident | 68.7 | Low | 13 Ų | 13 | 59.4 Ų | 59.4 | 5% | 0.051 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -97.1 | -23.4 | -174.4 | -71 | -71.3 | 0 | 0 | 0 | 116.3 | P455 R457 A469 Q470 L473 F514 L517 | P455-Y459 VanDerWaalsContact O-CD2 3.3Å; P455-Y459 WeakPolarHBondContact O-CD2 3.27Å; P455-Y459 PolarHBondContact O-N 2.84Å; P455-Y459 VanDerWaalsContact O-N 3.08Å; R457-Y459 VanDerWaalsContact C-N 3.34Å; R457-Y459 PolarHBondContact O-N 2.99Å; Y459-A469 HydrophobicContact CE1-CB 4.25Å; Y459-Q470 PolarHBondContact O-NE2 2.83Å; Y459-L473 HydrophobicContact CD1-CD2 4.26Å; Y459-L473 HydrophobicContact CE1-CB 4.42Å; Y459-L473 HydrophobicContact CE1-CD2 3.79Å; Y459-F514 HydrophobicContact CD2-CD2 4.15Å; Y459-F514 AromaticContact CD2-CE2 3.52Å; Y459-F514 HydrophobicContact CD2-CE2 3.52Å; Y459-F514 HydrophobicContact CD2-CZ 4.15Å; Y459-F514 HydrophobicContact CE1-CD2 4.35Å; Y459-F514 AromaticContact CE2-CD2 3.45Å; Y459-F514 HydrophobicContact CE2-CD2 3.45Å; Y459-F514 VanDerWaalsContact CE2-CD2 3.45Å; Y459-F514 AromaticContact CE2-CE2 3.22Å; Y459-F514 HydrophobicContact CE2-CE2 3.22Å; Y459-F514 HydrophobicContact CE2-CG 4.26Å; Y459-F514 AromaticContact CE2-CZ 3.86Å; Y459-F514 HydrophobicContact CE2-CZ 3.86Å; Y459-F514 HydrophobicContact CG-CE2 4.34Å; Y459-F514 AromaticContact CZ-CD2 3.56Å; Y459-F514 AromaticContact CZ-CE2 3.82Å; Y459-F514 VanDerWaalsContact OH-CA 3.27Å; Y459-F514 WeakPolarHBondContact OH-CA 3.19Å; Y459-F514 PolarHBondContact OH-O 2.95Å; Y459-L517 HydrophobicContact CE1-CD1 4.46Å; Y459-L517 VanDerWaalsContact OH-CB 3.32Å; Y459-L517 WeakPolarHBondContact OH-CB 3.43Å |
| 460 | Y | 69.8 | Low | 70.1 | Confident | 187 Ų | 187 | 62.1 Ų | 62.1 | 73% | 0.733 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -113.6 | -0.8 | -173.8 | -64.4 | -89 | 0 | 0 | 0 | 115 | C456 | C456-Y460 HydrophobicContact CB-CD2 4.07Å; C456-Y460 WeakPolarHBondContact O-CA 3.4Å; C456-Y460 VanDerWaalsContact O-CB 3.27Å; C456-Y460 WeakPolarHBondContact O-CB 3.43Å; C456-Y460 WeakPolarHBondContact O-CD2 3.5Å; C456-Y460 PolarHBondContact O-N 3Å |
| 461 | G | 65.4 | Low | 71.6 | Confident | 23 Ų | 23 | 57.2 Ų | 57.2 | 24% | 0.237 | 32% | 0.318 | C | S | . | . | S | Bend | trans | -77.4 | 166.6 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | R457 N466 | R457-G461 PolarHBondContact O-N 3.33Å; G461-N466 VanDerWaalsContact C-ND2 3.33Å; G461-N466 WeakPolarHBondContact CA-ND2 3.12Å; G461-N466 PolarHBondContact N-ND2 2.75Å; G461-N466 WeakPolarHBondContact O-CB 3.3Å |
| 462 | T | 59.8 | Low | 73 | Confident | 142 Ų | 142 | 54.9 Ų | 54.9 | 87% | 0.871 | 29% | 0.294 | S | S | * | . | S | Bend | trans | -89.7 | -1.8 | -173.6 | 50.8 | 0 | 0 | 0 | 0 | 114.3 | ||
| 463 | G | 69.3 | Low | 74.7 | Confident | 35 Ų | 35 | 51.7 Ų | 51.7 | 36% | 0.361 | 27% | 0.27 | S | S | . | . | S | Bend | trans | -71.6 | 158.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | N465 N466 K467 | G463-N465 VanDerWaalsContact C-N 3.29Å; G463-N465 PolarHBondContact O-N 3.26Å; G463-N466 WeakPolarHBondContact O-CB 3.45Å; G463-N466 PolarHBondContact O-N 2.88Å; G463-N466 VanDerWaalsContact O-N 3.16Å; G463-K467 PolarHBondContact O-N 3.13Å |
| 464 | V | 69.9 | Low | 75.9 | Confident | 78 Ų | 78 | 54.9 Ų | 54.9 | 47% | 0.473 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.9 | -39.9 | 179.7 | -177.5 | 0 | 0 | 0 | 0 | 111.3 | N466 K467 S468 | V464-N466 VanDerWaalsContact C-N 3.31Å; V464-N466 PolarHBondContact O-N 2.81Å; V464-K467 PolarHBondContact O-N 3.01Å; V464-S468 PolarHBondContact O-N 2.86Å |
| 465 | N | 76.3 | Confident | 77 | Confident | 20 Ų | 20 | 49.8 Ų | 49.8 | 11% | 0.107 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 177.6 | -63.5 | -22.5 | 0 | 0 | 0 | 112.2 | Q428 I432 G463 S468 A469 | Q428-N465 PolarHBondContact NE2-O 2.71Å; I432-N465 HydrophobicContact CG1-CB 4.15Å; G463-N465 VanDerWaalsContact C-N 3.29Å; G463-N465 PolarHBondContact O-N 3.26Å; N465-S468 WeakPolarHBondContact O-CB 3.26Å; N465-S468 PolarHBondContact O-N 3.37Å; N465-A469 PolarHBondContact O-N 2.89Å |
| 466 | N | 81.4 | Confident | 78.3 | Confident | 26 Ų | 26 | 47.8 Ų | 47.8 | 14% | 0.139 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -72 | -39.4 | 179 | -56.6 | 7.9 | 0 | 0 | 0 | 110.6 | R457 T458 G461 G463 V464 S468 A469 Q470 | R457-N466 PolarHBondContact O-ND2 3.36Å; T458-N466 WeakPolarHBondContact O-CA 3.36Å; T458-N466 WeakPolarHBondContact O-CB 3.48Å; G461-N466 VanDerWaalsContact C-ND2 3.33Å; G461-N466 WeakPolarHBondContact CA-ND2 3.12Å; G461-N466 PolarHBondContact N-ND2 2.75Å; G461-N466 WeakPolarHBondContact O-CB 3.3Å; G463-N466 WeakPolarHBondContact O-CB 3.45Å; G463-N466 PolarHBondContact O-N 2.88Å; G463-N466 VanDerWaalsContact O-N 3.16Å; V464-N466 VanDerWaalsContact C-N 3.31Å; V464-N466 PolarHBondContact O-N 2.81Å; N466-S468 VanDerWaalsContact C-N 3.32Å; N466-A469 PolarHBondContact O-N 3.29Å; N466-Q470 WeakPolarHBondContact O-CG 3.49Å; N466-Q470 PolarHBondContact O-N 3.47Å |
| 467 | K | 80.6 | Confident | 79.8 | Confident | 80 Ų | 80 | 47.9 Ų | 47.9 | 35% | 0.348 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.6 | -38.8 | 171.6 | -68 | -55.6 | -174.7 | -178.9 | 0 | 112.1 | M159 G463 V464 Q470 V471 | M159-K467 HydrophobicContact CE-CB 4.23Å; M159-K467 WeakPolarHBondContact CE-O 3.23Å; G463-K467 PolarHBondContact O-N 3.13Å; V464-K467 PolarHBondContact O-N 3.01Å; K467-Q470 VanDerWaalsContact CD-OE1 3.29Å; K467-Q470 VanDerWaalsContact NZ-OE1 3.13Å; K467-Q470 PolarHBondContact O-N 3.31Å; K467-V471 WeakPolarHBondContact O-CG2 3.13Å; K467-V471 PolarHBondContact O-N 3.37Å |
| 468 | S | 81.6 | Confident | 80.9 | Confident | 2 Ų | 2 | 48.1 Ų | 48.1 | 1% | 0.014 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.9 | -51.5 | 173.7 | -173.6 | 0 | 0 | 0 | 0 | 110.7 | M159 Q428 R431 V464 N465 N466 Q470 V471 L472 | M159-S468 VanDerWaalsContact CE-CA 3.48Å; Q428-S468 VanDerWaalsContact OE1-CB 3.22Å; Q428-S468 PolarHBondContact OE1-OG 2.94Å; R431-S468 PolarHBondContact NH1-OG 2.88Å; V464-S468 PolarHBondContact O-N 2.86Å; N465-S468 WeakPolarHBondContact O-CB 3.26Å; N465-S468 PolarHBondContact O-N 3.37Å; N466-S468 VanDerWaalsContact C-N 3.32Å; S468-Q470 VanDerWaalsContact C-N 3.33Å; S468-Q470 PolarHBondContact O-N 2.92Å; S468-V471 PolarHBondContact O-N 3.35Å; S468-V471 VanDerWaalsContact O-N 3.12Å; S468-L472 WeakPolarHBondContact O-CG 3.41Å; S468-L472 PolarHBondContact O-N 2.96Å |
| 469 | A | 84.3 | Confident | 82.1 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.4 | -40.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y459 N465 N466 L473 | Y459-A469 HydrophobicContact CE1-CB 4.25Å; N465-A469 PolarHBondContact O-N 2.89Å; N466-A469 PolarHBondContact O-N 3.29Å; A469-L473 WeakPolarHBondContact O-CB 3.44Å; A469-L473 PolarHBondContact O-N 3.31Å |
| 470 | Q | 87.4 | Confident | 83 | Confident | 63 Ų | 63 | 47.6 Ų | 47.6 | 29% | 0.294 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.1 | -45.9 | 174.6 | -73.5 | 176.2 | -4.9 | 0 | 0 | 112.3 | Y459 N466 K467 S468 L473 L474 | Y459-Q470 PolarHBondContact O-NE2 2.83Å; N466-Q470 WeakPolarHBondContact O-CG 3.49Å; N466-Q470 PolarHBondContact O-N 3.47Å; K467-Q470 VanDerWaalsContact CD-OE1 3.29Å; K467-Q470 VanDerWaalsContact NZ-OE1 3.13Å; K467-Q470 PolarHBondContact O-N 3.31Å; S468-Q470 VanDerWaalsContact C-N 3.33Å; S468-Q470 PolarHBondContact O-N 2.92Å; Q470-L473 PolarHBondContact O-N 2.97Å; Q470-L474 WeakPolarHBondContact O-CB 3.41Å; Q470-L474 PolarHBondContact O-N 3.32Å |
| 471 | V | 86.1 | Confident | 84.2 | Confident | 19 Ų | 19 | 41.2 Ų | 41.2 | 12% | 0.115 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66.4 | -42.7 | -180 | 169.1 | 0 | 0 | 0 | 0 | 111 | M159 A160 K467 S468 L474 L475 | M159-V471 HydrophobicContact CE-CB 3.91Å; M159-V471 HydrophobicContact CE-CG2 3.54Å; A160-V471 HydrophobicContact CB-CG1 3.78Å; K467-V471 WeakPolarHBondContact O-CG2 3.13Å; K467-V471 PolarHBondContact O-N 3.37Å; S468-V471 PolarHBondContact O-N 3.35Å; S468-V471 VanDerWaalsContact O-N 3.12Å; V471-L474 PolarHBondContact O-N 3.21Å; V471-L475 PolarHBondContact O-N 3.39Å |
| 472 | L | 87 | Confident | 85.6 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.5 | -43.8 | 177.2 | -65.1 | -177 | 0 | 0 | 0 | 111.5 | I163 L424 Q428 S468 L474 L475 V476 L517 | I163-L472 HydrophobicContact CD1-CD2 3.8Å; I163-L472 HydrophobicContact CG2-CD2 3.79Å; L424-L472 HydrophobicContact CD2-CB 4.48Å; L424-L472 HydrophobicContact CD2-CD2 3.92Å; Q428-L472 HydrophobicContact CB-CD1 3.79Å; Q428-L472 HydrophobicContact CG-CD1 4.5Å; S468-L472 WeakPolarHBondContact O-CG 3.41Å; S468-L472 PolarHBondContact O-N 2.96Å; L472-L474 PolarHBondContact O-N 3.46Å; L472-L475 PolarHBondContact O-N 3.17Å; L472-V476 WeakPolarHBondContact O-CG2 3.37Å; L472-V476 PolarHBondContact O-N 2.85Å; L472-L517 HydrophobicContact CB-CD1 4.23Å; L472-L517 HydrophobicContact CD1-CD2 4.04Å |
| 473 | L | 91.2 | Very high | 87.3 | Confident | 37 Ų | 37 | 36.9 Ų | 36.9 | 19% | 0.194 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.4 | -39.7 | 176.5 | -173.1 | 66.4 | 0 | 0 | 0 | 112 | Y459 A469 Q470 L475 V476 L510 V513 F514 L517 | Y459-L473 HydrophobicContact CD1-CD2 4.26Å; Y459-L473 HydrophobicContact CE1-CB 4.42Å; Y459-L473 HydrophobicContact CE1-CD2 3.79Å; A469-L473 WeakPolarHBondContact O-CB 3.44Å; A469-L473 PolarHBondContact O-N 3.31Å; Q470-L473 PolarHBondContact O-N 2.97Å; L473-L475 VanDerWaalsContact C-N 3.26Å; L473-L475 PolarHBondContact O-N 3.02Å; L473-V476 WeakPolarHBondContact O-CB 3.45Å; L473-V476 WeakPolarHBondContact O-CG2 3.41Å; L473-V476 PolarHBondContact O-N 3.11Å; L473-L510 HydrophobicContact CD1-CD2 4.09Å; L473-V513 HydrophobicContact CD1-CG1 4.33Å; L473-F514 HydrophobicContact CD1-CB 4.18Å; L473-F514 HydrophobicContact CD2-CD2 4.17Å; L473-L517 HydrophobicContact CB-CD1 4.4Å |
| 474 | L | 91.7 | Very high | 88.4 | Confident | 130 Ų | 130 | 35.3 Ų | 35.3 | 68% | 0.681 | 19% | 0.187 | S | C | * | . | H | α-helix | trans | -65.5 | -30.4 | 177.2 | -175.7 | 142.2 | 0 | 0 | 0 | 112.4 | Q470 V471 L472 V476 P478 | Q470-L474 WeakPolarHBondContact O-CB 3.41Å; Q470-L474 PolarHBondContact O-N 3.32Å; V471-L474 PolarHBondContact O-N 3.21Å; L472-L474 PolarHBondContact O-N 3.46Å; L474-V476 VanDerWaalsContact C-N 3.3Å; L474-V476 PolarHBondContact O-N 3.32Å; L474-P478 WeakPolarHBondContact O-CD 3.17Å |
| 475 | L | 90.3 | Very high | 89.4 | Confident | 18 Ų | 18 | 37.8 Ų | 37.8 | 9% | 0.094 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -73 | -21.6 | 179.2 | -169.8 | 63 | 0 | 0 | 0 | 113.2 | I163 L164 F167 V471 L472 L473 I477 P478 G479 | I163-L475 HydrophobicContact CG2-CD2 3.99Å; L164-L475 HydrophobicContact CD1-CD1 3.66Å; F167-L475 HydrophobicContact CB-CD2 3.74Å; F167-L475 HydrophobicContact CD1-CD1 4.14Å; F167-L475 HydrophobicContact CD1-CD2 3.54Å; F167-L475 HydrophobicContact CD1-CG 3.72Å; F167-L475 HydrophobicContact CD2-CD2 3.74Å; F167-L475 HydrophobicContact CD2-CG 4.32Å; F167-L475 HydrophobicContact CE1-CD1 4.22Å; F167-L475 HydrophobicContact CE1-CD2 4.02Å; F167-L475 HydrophobicContact CE1-CG 3.7Å; F167-L475 HydrophobicContact CE2-CD2 4.17Å; F167-L475 HydrophobicContact CE2-CG 4.27Å; F167-L475 HydrophobicContact CG-CD2 3.38Å; F167-L475 HydrophobicContact CG-CG 4.04Å; F167-L475 HydrophobicContact CZ-CD2 4.3Å; F167-L475 HydrophobicContact CZ-CG 3.98Å; V471-L475 PolarHBondContact O-N 3.39Å; L472-L475 PolarHBondContact O-N 3.17Å; L473-L475 VanDerWaalsContact C-N 3.26Å; L473-L475 PolarHBondContact O-N 3.02Å; L475-I477 PolarHBondContact O-N 3.16Å; L475-P478 WeakPolarHBondContact O-CD 3.3Å; L475-G479 PolarHBondContact O-N 3.07Å |
| 476 | V | 93.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -57.3 | -51.8 | -179.2 | 178.9 | 0 | 0 | 0 | 0 | 111.1 | L424 L472 L473 L474 G479 H480 A509 L510 V513 | L424-V476 HydrophobicContact CD1-CG2 3.94Å; L472-V476 WeakPolarHBondContact O-CG2 3.37Å; L472-V476 PolarHBondContact O-N 2.85Å; L473-V476 WeakPolarHBondContact O-CB 3.45Å; L473-V476 WeakPolarHBondContact O-CG2 3.41Å; L473-V476 PolarHBondContact O-N 3.11Å; L474-V476 VanDerWaalsContact C-N 3.3Å; L474-V476 PolarHBondContact O-N 3.32Å; V476-G479 PolarHBondContact O-N 3.46Å; V476-H480 VanDerWaalsContact CG1-CD2 3.49Å; V476-H480 WeakPolarHBondContact CG1-CD2 3.08Å; V476-H480 VanDerWaalsContact O-CB 3.32Å; V476-H480 WeakPolarHBondContact O-CB 3.35Å; V476-H480 PolarHBondContact O-CD2 2.9Å; V476-H480 PolarHBondContact O-N 3.38Å; V476-A509 HydrophobicContact CG1-CB 4.18Å; V476-L510 HydrophobicContact CB-CD2 3.98Å; V476-L510 HydrophobicContact CG1-CD2 3.93Å; V476-L510 HydrophobicContact CG1-CG 4.22Å; V476-V513 HydrophobicContact CG2-CB 3.9Å; V476-V513 HydrophobicContact CG2-CG1 3.71Å; V476-V513 HydrophobicContact CG2-CG2 3.89Å |
| 477 | I | 94.4 | Very high | 90.5 | Very high | 76 Ų | 76 | 37 Ų | 37 | 39% | 0.39 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -60.3 | -59.7 | -175.8 | -55.4 | 180 | 0 | 0 | 0 | 112.4 | L475 G479 L481 L510 | L475-I477 PolarHBondContact O-N 3.16Å; I477-G479 VanDerWaalsContact C-N 3.27Å; I477-G479 PolarHBondContact O-N 3.4Å; I477-L481 HydrophobicContact CG2-CD1 4.08Å; I477-L481 WeakPolarHBondContact O-CB 3.39Å; I477-L481 VanDerWaalsContact O-CG 3.31Å; I477-L481 WeakPolarHBondContact O-CG 3.09Å; I477-L481 PolarHBondContact O-N 2.85Å; I477-L481 VanDerWaalsContact O-N 3.08Å; I477-L510 HydrophobicContact CD1-CD1 3.95Å; I477-L510 HydrophobicContact CD1-CD2 4.31Å; I477-L510 HydrophobicContact CG1-CD1 3.91Å; I477-L510 HydrophobicContact CG1-CD2 3.84Å; I477-L510 HydrophobicContact CG1-CG 4.15Å |
| 478 | P | 94.8 | Very high | 90.7 | Very high | 60 Ų | 60 | 38 Ų | 38 | 39% | 0.39 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64.2 | -34.3 | -179.1 | 26.5 | -34.6 | 0 | 0 | 0 | 112 | L474 L475 I482 | L474-P478 WeakPolarHBondContact O-CD 3.17Å; L475-P478 WeakPolarHBondContact O-CD 3.3Å; P478-I482 WeakPolarHBondContact O-CD1 3.45Å; P478-I482 VanDerWaalsContact O-CG1 3.3Å; P478-I482 WeakPolarHBondContact O-CG1 3.24Å; P478-I482 PolarHBondContact O-N 3.46Å; P478-I482 VanDerWaalsContact O-N 3.15Å |
| 479 | G | 93.9 | Very high | 91 | Very high | 2 Ų | 2 | 44.5 Ų | 44.5 | 2% | 0.021 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62.3 | -58.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L475 V476 I477 L481 I482 F483 | L475-G479 PolarHBondContact O-N 3.07Å; V476-G479 PolarHBondContact O-N 3.46Å; I477-G479 VanDerWaalsContact C-N 3.27Å; I477-G479 PolarHBondContact O-N 3.4Å; G479-L481 PolarHBondContact O-N 3.18Å; G479-I482 WeakPolarHBondContact O-CB 3.3Å; G479-I482 PolarHBondContact O-N 2.88Å; G479-F483 VanDerWaalsContact C-CD2 3.43Å; G479-F483 WeakPolarHBondContact O-CD2 3.23Å; G479-F483 WeakPolarHBondContact O-CE2 3.33Å; G479-F483 VanDerWaalsContact O-CG 3.27Å; G479-F483 WeakPolarHBondContact O-CG 3.5Å; G479-F483 PolarHBondContact O-N 2.93Å |
| 480 | H | 94.9 | Very high | 90.9 | Very high | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.005 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.8 | -33.8 | 179.9 | -82.3 | -88.7 | 0 | 0 | 0 | 112.4 | V476 F483 L484 Y505 L506 | V476-H480 VanDerWaalsContact CG1-CD2 3.49Å; V476-H480 WeakPolarHBondContact CG1-CD2 3.08Å; V476-H480 VanDerWaalsContact O-CB 3.32Å; V476-H480 WeakPolarHBondContact O-CB 3.35Å; V476-H480 PolarHBondContact O-CD2 2.9Å; V476-H480 PolarHBondContact O-N 3.38Å; H480-F483 PolarHBondContact O-N 3.49Å; H480-L484 WeakPolarHBondContact O-CB 3.35Å; H480-L484 VanDerWaalsContact O-CG 3.3Å; H480-L484 WeakPolarHBondContact O-CG 3.14Å; H480-L484 PolarHBondContact O-N 3.49Å; H480-Y505 HydrophobicContact CB-CE1 3.98Å; H480-Y505 AromaticContact ND1-CE1 3.44Å; H480-Y505 WeakPolarHBondContact ND1-CE1 3.32Å; H480-Y505 AromaticContact ND1-CZ 3.6Å; H480-Y505 PolarHBondContact ND1-OH 3.46Å; H480-L506 HydrophobicContact CB-CD2 3.68Å |
| 481 | L | 95.1 | Very high | 90.4 | Very high | 53 Ų | 53 | 56.5 Ų | 56.5 | 28% | 0.277 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.1 | -48 | 171.1 | -77.9 | 172.5 | 0 | 0 | 0 | 112.1 | I477 G479 F483 L484 Y485 I502 L506 | I477-L481 HydrophobicContact CG2-CD1 4.08Å; I477-L481 WeakPolarHBondContact O-CB 3.39Å; I477-L481 VanDerWaalsContact O-CG 3.31Å; I477-L481 WeakPolarHBondContact O-CG 3.09Å; I477-L481 PolarHBondContact O-N 2.85Å; I477-L481 VanDerWaalsContact O-N 3.08Å; G479-L481 PolarHBondContact O-N 3.18Å; L481-F483 VanDerWaalsContact C-N 3.28Å; L481-F483 PolarHBondContact O-N 2.9Å; L481-L484 PolarHBondContact O-N 2.88Å; L481-Y485 HydrophobicContact CD2-CE2 4.45Å; L481-Y485 WeakPolarHBondContact O-CD2 3.29Å; L481-Y485 PolarHBondContact O-N 3.21Å; L481-I502 HydrophobicContact CD2-CG2 3.88Å; L481-L506 HydrophobicContact CD2-CD1 3.86Å; L481-L506 HydrophobicContact CG-CD1 4.11Å; L481-L506 HydrophobicContact CG-CD2 4.33Å |
| 482 | I | 95 | Very high | 89.4 | Confident | 74 Ų | 74 | 56.5 Ų | 56.5 | 38% | 0.379 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.3 | -44.1 | 176.6 | -69 | 164 | 0 | 0 | 0 | 110.5 | L168 F172 P478 G479 Y485 T486 | L168-I482 HydrophobicContact CD2-CD1 3.98Å; F172-I482 HydrophobicContact CE1-CG2 4.32Å; F172-I482 HydrophobicContact CZ-CG2 4.05Å; P478-I482 WeakPolarHBondContact O-CD1 3.45Å; P478-I482 VanDerWaalsContact O-CG1 3.3Å; P478-I482 WeakPolarHBondContact O-CG1 3.24Å; P478-I482 PolarHBondContact O-N 3.46Å; P478-I482 VanDerWaalsContact O-N 3.15Å; G479-I482 WeakPolarHBondContact O-CB 3.3Å; G479-I482 PolarHBondContact O-N 2.88Å; I482-Y485 PolarHBondContact O-N 2.94Å; I482-T486 WeakPolarHBondContact O-CB 3.44Å; I482-T486 PolarHBondContact O-N 3.45Å; I482-T486 PolarHBondContact O-OG1 3.29Å |
| 483 | F | 93.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 56.5 Ų | 56.5 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -67.3 | -43.7 | -179.2 | -55.1 | -40.1 | 0 | 0 | 0 | 112.4 | F167 L168 V175 V416 I420 G479 H480 L481 T486 I487 | F167-F483 HydrophobicContact CD1-CZ 4.37Å; F167-F483 AromaticContact CE1-CE2 3.84Å; F167-F483 HydrophobicContact CE1-CE2 3.84Å; F167-F483 AromaticContact CE1-CZ 3.86Å; F167-F483 HydrophobicContact CE1-CZ 3.86Å; F167-F483 AromaticContact CZ-CE2 3.79Å; F167-F483 HydrophobicContact CZ-CE2 3.79Å; F167-F483 HydrophobicContact CZ-CZ 4.23Å; L168-F483 HydrophobicContact CD2-CE1 4.16Å; L168-F483 HydrophobicContact CD2-CZ 4.13Å; V175-F483 HydrophobicContact CG2-CB 3.71Å; V175-F483 HydrophobicContact CG2-CD1 4.06Å; V175-F483 HydrophobicContact CG2-CG 4.05Å; V416-F483 HydrophobicContact CG1-CB 4.15Å; V416-F483 HydrophobicContact CG1-CD2 4.48Å; I420-F483 HydrophobicContact CD1-CD2 3.17Å; I420-F483 HydrophobicContact CD1-CE2 3.28Å; I420-F483 HydrophobicContact CD1-CG 4.19Å; I420-F483 HydrophobicContact CD1-CZ 4.35Å; I420-F483 HydrophobicContact CG1-CD2 4.42Å; I420-F483 HydrophobicContact CG1-CE2 4.15Å; G479-F483 VanDerWaalsContact C-CD2 3.43Å; G479-F483 WeakPolarHBondContact O-CD2 3.23Å; G479-F483 WeakPolarHBondContact O-CE2 3.33Å; G479-F483 VanDerWaalsContact O-CG 3.27Å; G479-F483 WeakPolarHBondContact O-CG 3.5Å; G479-F483 PolarHBondContact O-N 2.93Å; H480-F483 PolarHBondContact O-N 3.49Å; L481-F483 VanDerWaalsContact C-N 3.28Å; L481-F483 PolarHBondContact O-N 2.9Å; F483-T486 WeakPolarHBondContact O-CB 3.14Å; F483-T486 PolarHBondContact O-N 3.21Å; F483-I487 WeakPolarHBondContact O-CG1 3.3Å; F483-I487 PolarHBondContact O-N 2.96Å |
| 484 | L | 92.6 | Very high | 86.9 | Confident | 2 Ų | 2 | 59.6 Ų | 59.6 | 1% | 0.01 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.1 | -47.8 | 174.1 | -76.6 | -176.9 | 0 | 0 | 0 | 112.1 | Y413 H480 L481 T486 I487 H488 L497 F501 I502 Y505 | Y413-L484 HydrophobicContact CD1-CD2 3.77Å; Y413-L484 HydrophobicContact CE1-CD2 3.41Å; Y413-L484 VanDerWaalsContact CE1-CD2 3.41Å; H480-L484 WeakPolarHBondContact O-CB 3.35Å; H480-L484 VanDerWaalsContact O-CG 3.3Å; H480-L484 WeakPolarHBondContact O-CG 3.14Å; H480-L484 PolarHBondContact O-N 3.49Å; L481-L484 PolarHBondContact O-N 2.88Å; L484-T486 VanDerWaalsContact C-N 3.27Å; L484-T486 PolarHBondContact O-N 3.15Å; L484-I487 PolarHBondContact O-N 2.75Å; L484-H488 PolarHBondContact O-N 2.89Å; L484-L497 HydrophobicContact CB-CD2 4.35Å; L484-L497 HydrophobicContact CD2-CD2 4.45Å; L484-F501 HydrophobicContact CD2-CE1 4.06Å; L484-I502 HydrophobicContact CD1-CG1 4.3Å; L484-I502 HydrophobicContact CD1-CG2 4.38Å; L484-Y505 HydrophobicContact CD1-CD1 3.5Å; L484-Y505 VanDerWaalsContact CD1-CD1 3.5Å; L484-Y505 HydrophobicContact CD1-CE1 3.91Å; L484-Y505 HydrophobicContact CD1-CG 4.21Å; L484-Y505 HydrophobicContact CD2-CD1 3.82Å; L484-Y505 HydrophobicContact CD2-CD2 4.4Å; L484-Y505 HydrophobicContact CD2-CE1 3.7Å; L484-Y505 HydrophobicContact CD2-CE2 4.36Å; L484-Y505 HydrophobicContact CD2-CG 4.14Å; L484-Y505 HydrophobicContact CG-CD1 3.84Å; L484-Y505 HydrophobicContact CG-CE1 3.72Å |
| 485 | Y | 91 | Very high | 85.7 | Confident | 131 Ų | 131 | 54.1 Ų | 54.1 | 51% | 0.514 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.4 | -35.4 | 177.2 | -83.6 | -65.5 | 0 | 0 | 0 | 112 | L481 I482 H488 L489 L497 | L481-Y485 HydrophobicContact CD2-CE2 4.45Å; L481-Y485 WeakPolarHBondContact O-CD2 3.29Å; L481-Y485 PolarHBondContact O-N 3.21Å; I482-Y485 PolarHBondContact O-N 2.94Å; Y485-H488 PolarHBondContact O-N 3.48Å; Y485-L489 WeakPolarHBondContact O-CB 3.16Å; Y485-L489 VanDerWaalsContact O-CG 3.26Å; Y485-L489 WeakPolarHBondContact O-CG 3.41Å; Y485-L489 PolarHBondContact O-N 3.48Å; Y485-L497 HydrophobicContact CD1-CD1 4.36Å |
| 486 | T | 91 | Very high | 84.8 | Confident | 30 Ų | 30 | 55.6 Ų | 55.6 | 18% | 0.184 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 175.3 | -56.9 | 0 | 0 | 0 | 0 | 111.2 | F172 V175 I482 F483 L484 H488 L489 M490 | F172-T486 HydrophobicContact CD1-CG2 4.38Å; F172-T486 HydrophobicContact CE1-CG2 4.2Å; V175-T486 HydrophobicContact CG1-CG2 4.26Å; I482-T486 WeakPolarHBondContact O-CB 3.44Å; I482-T486 PolarHBondContact O-N 3.45Å; I482-T486 PolarHBondContact O-OG1 3.29Å; F483-T486 WeakPolarHBondContact O-CB 3.14Å; F483-T486 PolarHBondContact O-N 3.21Å; L484-T486 VanDerWaalsContact C-N 3.27Å; L484-T486 PolarHBondContact O-N 3.15Å; T486-H488 VanDerWaalsContact C-N 3.31Å; T486-H488 PolarHBondContact O-N 2.85Å; T486-L489 PolarHBondContact O-N 2.97Å; T486-M490 HydrophobicContact CG2-SD 4.2Å; T486-M490 WeakPolarHBondContact O-CG 3.22Å; T486-M490 PolarHBondContact O-N 3.2Å |
| 487 | I | 89.2 | Confident | 84.1 | Confident | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -57.8 | -45.7 | 176 | -67.9 | 165.5 | 0 | 0 | 0 | 110.7 | V175 M179 V412 Y413 V416 F483 L484 M490 K491 S492 | V175-I487 HydrophobicContact CG1-CG1 3.8Å; M179-I487 HydrophobicContact CE-CB 4.49Å; M179-I487 HydrophobicContact CE-CG1 4.13Å; V412-I487 HydrophobicContact CG1-CG2 4.21Å; V412-I487 HydrophobicContact CG2-CD1 4.4Å; V412-I487 HydrophobicContact CG2-CG1 4.43Å; V412-I487 HydrophobicContact CG2-CG2 3.93Å; Y413-I487 HydrophobicContact CD1-CD1 3.75Å; Y413-I487 HydrophobicContact CE1-CD1 3.72Å; Y413-I487 HydrophobicContact CE1-CG2 4.18Å; V416-I487 HydrophobicContact CG2-CD1 4.24Å; F483-I487 WeakPolarHBondContact O-CG1 3.3Å; F483-I487 PolarHBondContact O-N 2.96Å; L484-I487 PolarHBondContact O-N 2.75Å; I487-M490 CarbonylContact O-C 3.26Å; I487-M490 PolarHBondContact O-N 2.86Å; I487-K491 PolarHBondContact O-N 3.42Å; I487-S492 VanDerWaalsContact CG2-O 3.29Å; I487-S492 WeakPolarHBondContact CG2-O 3.16Å; I487-S492 PolarHBondContact O-N 3.04Å |
| 488 | H | 86.6 | Confident | 83.7 | Confident | 99 Ų | 99 | 54.7 Ų | 54.7 | 46% | 0.458 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -65.7 | -42.6 | 178.8 | 179.2 | 73.2 | 0 | 0 | 0 | 113.6 | L484 Y485 T486 M490 K491 L497 | L484-H488 PolarHBondContact O-N 2.89Å; Y485-H488 PolarHBondContact O-N 3.48Å; T486-H488 VanDerWaalsContact C-N 3.31Å; T486-H488 PolarHBondContact O-N 2.85Å; H488-M490 PolarHBondContact O-N 2.85Å; H488-K491 PolarHBondContact O-N 2.79Å; H488-L497 HydrophobicContact CB-CD1 3.24Å; H488-L497 HydrophobicContact CB-CG 3.88Å |
| 489 | L | 86.6 | Confident | 83.4 | Confident | 139 Ų | 139 | 57.1 Ų | 57.1 | 73% | 0.728 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -61.1 | -32.1 | 175.5 | -74.6 | 173.1 | 0 | 0 | 0 | 112.2 | Y485 T486 K491 | Y485-L489 WeakPolarHBondContact O-CB 3.16Å; Y485-L489 VanDerWaalsContact O-CG 3.26Å; Y485-L489 WeakPolarHBondContact O-CG 3.41Å; Y485-L489 PolarHBondContact O-N 3.48Å; T486-L489 PolarHBondContact O-N 2.97Å; L489-K491 VanDerWaalsContact C-N 3.26Å; L489-K491 PolarHBondContact O-N 3.39Å |
| 490 | M | 83.3 | Confident | 83.2 | Confident | 116 Ų | 116 | 61.1 Ų | 61.1 | 57% | 0.571 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | 2.6 | 177.2 | -67.3 | -172.6 | 65 | 0 | 0 | 113.5 | M179 T486 I487 H488 S492 | M179-M490 HydrophobicContact CE-CB 3.62Å; M179-M490 HydrophobicContact CE-CE 3.93Å; M179-M490 HydrophobicContact CE-CG 3.9Å; M179-M490 HydrophobicContact CE-SD 3.29Å; M179-M490 WeakPolarHBondContact CE-SD 3.41Å; M179-M490 HydrophobicContact SD-CB 4.33Å; M179-M490 HydrophobicContact SD-CE 3.3Å; M179-M490 WeakPolarHBondContact SD-CE 3.41Å; M179-M490 HydrophobicContact SD-SD 3.47Å; T486-M490 HydrophobicContact CG2-SD 4.2Å; T486-M490 WeakPolarHBondContact O-CG 3.22Å; T486-M490 PolarHBondContact O-N 3.2Å; I487-M490 CarbonylContact O-C 3.26Å; I487-M490 PolarHBondContact O-N 2.86Å; H488-M490 PolarHBondContact O-N 2.85Å; M490-S492 PolarHBondContact O-N 3.41Å |
| 491 | K | 75.3 | Confident | 83 | Confident | 200 Ų | 200 | 61.3 Ų | 61.3 | 87% | 0.87 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 37.2 | 179.9 | -58.9 | -175.6 | 176.1 | -173.8 | 0 | 113.7 | I487 H488 L489 | I487-K491 PolarHBondContact O-N 3.42Å; H488-K491 PolarHBondContact O-N 2.79Å; L489-K491 VanDerWaalsContact C-N 3.26Å; L489-K491 PolarHBondContact O-N 3.39Å |
| 492 | S | 65.2 | Low | 82.9 | Confident | 18 Ų | 18 | 60.1 Ų | 60.1 | 13% | 0.126 | 31% | 0.305 | C | S | . | . | trans | -107 | 152.8 | 178.1 | 177.6 | 0 | 0 | 0 | 0 | 110.2 | D182 V412 I487 M490 | D182-S492 PolarHBondContact OD2-OG 2.9Å; V412-S492 WeakPolarHBondContact CG2-OG 3.46Å; I487-S492 VanDerWaalsContact CG2-O 3.29Å; I487-S492 WeakPolarHBondContact CG2-O 3.16Å; I487-S492 PolarHBondContact O-N 3.04Å; M490-S492 PolarHBondContact O-N 3.41Å | ||
| 493 | G | 60.2 | Low | 82.8 | Confident | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 31% | 0.31 | C | S | . | . | S | Bend | trans | 109.3 | -9.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | D182 G409 T495 | D182-G493 PolarHBondContact OD2-N 3.26Å; G409-G493 WeakPolarHBondContact CA-O 2.91Å; G493-T495 PolarHBondContact O-N 3.39Å; G493-T495 PolarHBondContact O-OG1 3.07Å |
| 494 | H | 65.8 | Low | 82.9 | Confident | 103 Ų | 103 | 60.6 Ų | 60.6 | 48% | 0.477 | 32% | 0.317 | S | S | . | . | S | Bend | trans | 52.2 | 8.7 | -177.6 | -61.2 | -82 | 0 | 0 | 0 | 115.4 | D182 H186 | D182-H494 IonicContact OD1-CD2 3.6Å; H186-H494 AromaticContact CE1-NE2 3.38Å; H186-H494 PolarHBondContact CE1-NE2 3.45Å; H186-H494 AromaticContact NE2-NE2 3.83Å |
| 495 | T | 66.6 | Low | 83 | Confident | 14 Ų | 14 | 60.7 Ų | 60.7 | 9% | 0.086 | 32% | 0.317 | C | S | . | . | trans | -111.9 | 135.9 | -176.4 | 31.4 | 0 | 0 | 0 | 0 | 110.7 | Y413 G493 F501 F558 D568 | Y413-T495 HydrophobicContact CE2-CG2 4.33Å; Y413-T495 VanDerWaalsContact CE2-OG1 3.3Å; Y413-T495 WeakPolarHBondContact CE2-OG1 3.4Å; Y413-T495 PolarHBondContact OH-OG1 3.4Å; G493-T495 PolarHBondContact O-N 3.39Å; G493-T495 PolarHBondContact O-OG1 3.07Å; T495-F501 HydrophobicContact CG2-CE2 4.46Å; T495-F558 HydrophobicContact CG2-CE1 3.71Å; T495-F558 HydrophobicContact CG2-CZ 4.03Å; T495-D568 VanDerWaalsContact CA-OD1 3.29Å; T495-D568 WeakPolarHBondContact CA-OD1 3.46Å; T495-D568 WeakPolarHBondContact CB-OD1 3.35Å; T495-D568 WeakPolarHBondContact CG2-OD1 3.36Å; T495-D568 WeakPolarHBondContact CG2-OD2 3.47Å | ||
| 496 | S | 71.2 | Confident | 83.2 | Confident | 50 Ų | 50 | 55.4 Ų | 55.4 | 35% | 0.35 | 30% | 0.298 | S | S | . | . | trans | -80.1 | 131.9 | 172.9 | 67.9 | 0 | 0 | 0 | 0 | 110.4 | T498 D568 | S496-T498 PolarHBondContact O-N 3.31Å; S496-T498 WeakPolarHBondContact OG-CG2 3.33Å; S496-D568 PolarHBondContact N-OD1 3.4Å | ||
| 497 | L | 80.6 | Confident | 83.5 | Confident | 33 Ų | 33 | 60.5 Ų | 60.5 | 17% | 0.173 | 32% | 0.318 | C | S | . | . | trans | -74.3 | 76.1 | 175.4 | -82.5 | -171.8 | 0 | 0 | 0 | 110.7 | L484 Y485 H488 F501 I502 | L484-L497 HydrophobicContact CB-CD2 4.35Å; L484-L497 HydrophobicContact CD2-CD2 4.45Å; Y485-L497 HydrophobicContact CD1-CD1 4.36Å; H488-L497 HydrophobicContact CB-CD1 3.24Å; H488-L497 HydrophobicContact CB-CG 3.88Å; L497-F501 HydrophobicContact CD2-CD1 3.84Å; L497-F501 HydrophobicContact CD2-CE1 3.92Å; L497-I502 HydrophobicContact CB-CD1 4.46Å; L497-I502 HydrophobicContact CD2-CG1 4.11Å | ||
| 498 | T | 86.2 | Confident | 83.8 | Confident | 24 Ų | 24 | 60.8 Ų | 60.8 | 15% | 0.147 | 32% | 0.32 | C | S | . | . | trans | -76.3 | 153.5 | 171.8 | 74.8 | 0 | 0 | 0 | 0 | 110.3 | S496 I500 F501 I502 D566 | S496-T498 PolarHBondContact O-N 3.31Å; S496-T498 WeakPolarHBondContact OG-CG2 3.33Å; T498-I500 PolarHBondContact O-N 3.42Å; T498-I500 PolarHBondContact OG1-N 3.13Å; T498-F501 PolarHBondContact O-N 2.9Å; T498-F501 VanDerWaalsContact OG1-CB 3.29Å; T498-F501 WeakPolarHBondContact OG1-CB 3.17Å; T498-F501 PolarHBondContact OG1-N 3.43Å; T498-I502 WeakPolarHBondContact O-CG1 3.41Å; T498-I502 PolarHBondContact O-N 3.1Å; T498-D566 WeakPolarHBondContact CG2-OD1 3.42Å; T498-D566 PolarHBondContact OG1-OD2 3.45Å | ||
| 499 | P | 87.9 | Confident | 84.3 | Confident | 111 Ų | 111 | 56.1 Ų | 56.1 | 72% | 0.721 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -58.1 | -29.5 | 173 | -25.3 | 35 | 0 | 0 | 0 | 113.2 | A503 | P499-A503 WeakPolarHBondContact O-CB 3.29Å; P499-A503 PolarHBondContact O-N 3.03Å; P499-A503 VanDerWaalsContact O-N 3.08Å |
| 500 | I | 89.5 | Confident | 84.8 | Confident | 85 Ų | 85 | 51.8 Ų | 51.8 | 44% | 0.436 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -72.8 | -47.7 | 178.9 | -56.8 | 174.9 | 0 | 0 | 0 | 109.8 | T498 I502 A503 V504 L561 I564 | T498-I500 PolarHBondContact O-N 3.42Å; T498-I500 PolarHBondContact OG1-N 3.13Å; I500-I502 VanDerWaalsContact C-N 3.33Å; I500-I502 PolarHBondContact O-N 2.86Å; I500-A503 PolarHBondContact O-N 3.49Å; I500-A503 VanDerWaalsContact O-N 3.16Å; I500-V504 HydrophobicContact CG2-CG2 4.47Å; I500-V504 WeakPolarHBondContact O-CG2 3.48Å; I500-V504 PolarHBondContact O-N 3.05Å; I500-L561 HydrophobicContact CG2-CD2 3.78Å; I500-I564 HydrophobicContact CG2-CD1 3.68Å |
| 501 | F | 90.1 | Very high | 85.4 | Confident | 6 Ų | 6 | 49.2 Ų | 49.2 | 3% | 0.026 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -53.6 | -50.2 | 172.6 | 176 | -91.6 | 0 | 0 | 0 | 111.3 | Y413 L484 T495 L497 T498 A503 V504 Y505 F558 L561 | Y413-F501 HydrophobicContact CD2-CZ 4.05Å; Y413-F501 HydrophobicContact CE1-CE1 4.21Å; Y413-F501 HydrophobicContact CE1-CZ 4.07Å; Y413-F501 HydrophobicContact CE2-CE1 4.34Å; Y413-F501 HydrophobicContact CE2-CE2 4.25Å; Y413-F501 AromaticContact CE2-CZ 3.53Å; Y413-F501 HydrophobicContact CE2-CZ 3.53Å; Y413-F501 AromaticContact CZ-CE1 3.88Å; Y413-F501 AromaticContact CZ-CZ 3.54Å; L484-F501 HydrophobicContact CD2-CE1 4.06Å; T495-F501 HydrophobicContact CG2-CE2 4.46Å; L497-F501 HydrophobicContact CD2-CD1 3.84Å; L497-F501 HydrophobicContact CD2-CE1 3.92Å; T498-F501 PolarHBondContact O-N 2.9Å; T498-F501 VanDerWaalsContact OG1-CB 3.29Å; T498-F501 WeakPolarHBondContact OG1-CB 3.17Å; T498-F501 PolarHBondContact OG1-N 3.43Å; F501-A503 VanDerWaalsContact C-N 3.3Å; F501-A503 PolarHBondContact O-N 3.26Å; F501-V504 PolarHBondContact O-N 3.34Å; F501-Y505 HydrophobicContact CZ-CD2 4.48Å; F501-Y505 VanDerWaalsContact O-CB 3.3Å; F501-Y505 WeakPolarHBondContact O-CB 3.29Å; F501-Y505 PolarHBondContact O-N 2.87Å; F501-F558 HydrophobicContact CE2-CE1 4.28Å; F501-F558 AromaticContact CE2-CE2 3.83Å; F501-F558 HydrophobicContact CE2-CE2 3.83Å; F501-F558 AromaticContact CE2-CZ 3.6Å; F501-F558 HydrophobicContact CE2-CZ 3.6Å; F501-F558 HydrophobicContact CZ-CE2 4.35Å; F501-F558 HydrophobicContact CZ-CZ 4.18Å; F501-L561 HydrophobicContact CB-CD1 4.48Å; F501-L561 HydrophobicContact CD2-CD1 3.57Å; F501-L561 HydrophobicContact CE2-CD1 4.21Å; F501-L561 HydrophobicContact CG-CD1 4.44Å |
| 502 | I | 92.6 | Very high | 86.4 | Confident | 28 Ų | 28 | 39.8 Ų | 39.8 | 14% | 0.144 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.4 | -44.3 | 179.2 | -66.3 | 168 | 0 | 0 | 0 | 110.6 | L481 L484 L497 T498 I500 L506 | L481-I502 HydrophobicContact CD2-CG2 3.88Å; L484-I502 HydrophobicContact CD1-CG1 4.3Å; L484-I502 HydrophobicContact CD1-CG2 4.38Å; L497-I502 HydrophobicContact CB-CD1 4.46Å; L497-I502 HydrophobicContact CD2-CG1 4.11Å; T498-I502 WeakPolarHBondContact O-CG1 3.41Å; T498-I502 PolarHBondContact O-N 3.1Å; I500-I502 VanDerWaalsContact C-N 3.33Å; I500-I502 PolarHBondContact O-N 2.86Å; I502-L506 HydrophobicContact CG2-CD1 3.72Å; I502-L506 HydrophobicContact CG2-CG 4.25Å; I502-L506 VanDerWaalsContact O-CB 3.29Å; I502-L506 WeakPolarHBondContact O-CB 3.37Å; I502-L506 WeakPolarHBondContact O-CG 3.4Å; I502-L506 PolarHBondContact O-N 3.48Å |
| 503 | A | 94.6 | Very high | 87.9 | Confident | 60 Ų | 60 | 39 Ų | 39 | 50% | 0.496 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -64 | -45 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | P499 I500 F501 F507 | P499-A503 WeakPolarHBondContact O-CB 3.29Å; P499-A503 PolarHBondContact O-N 3.03Å; P499-A503 VanDerWaalsContact O-N 3.08Å; I500-A503 PolarHBondContact O-N 3.49Å; I500-A503 VanDerWaalsContact O-N 3.16Å; F501-A503 VanDerWaalsContact C-N 3.3Å; F501-A503 PolarHBondContact O-N 3.26Å; A503-F507 VanDerWaalsContact O-CB 3.31Å; A503-F507 WeakPolarHBondContact O-CB 3.43Å; A503-F507 PolarHBondContact O-N 3.46Å |
| 504 | V | 94.2 | Very high | 89.5 | Confident | 24 Ų | 24 | 42.4 Ų | 42.4 | 15% | 0.145 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -66.2 | -45.5 | 179 | 173.1 | 0 | 0 | 0 | 0 | 111 | I500 F501 F507 A508 F560 L561 | I500-V504 HydrophobicContact CG2-CG2 4.47Å; I500-V504 WeakPolarHBondContact O-CG2 3.48Å; I500-V504 PolarHBondContact O-N 3.05Å; F501-V504 PolarHBondContact O-N 3.34Å; V504-F507 PolarHBondContact O-N 3.33Å; V504-A508 PolarHBondContact O-N 3.41Å; V504-F560 HydrophobicContact CG1-CD1 4.48Å; V504-F560 HydrophobicContact CG2-CD1 3.89Å; V504-F560 HydrophobicContact CG2-CE1 3.95Å; V504-L561 HydrophobicContact CB-CD1 4.37Å; V504-L561 HydrophobicContact CB-CD2 4.27Å; V504-L561 HydrophobicContact CB-CG 4.34Å; V504-L561 HydrophobicContact CG1-CD1 4.24Å; V504-L561 HydrophobicContact CG1-CG 4.24Å; V504-L561 HydrophobicContact CG2-CD2 3.92Å; V504-L561 HydrophobicContact CG2-CG 4.29Å |
| 505 | Y | 94.7 | Very high | 90.8 | Very high | 3 Ų | 3 | 39.1 Ų | 39.1 | 1% | 0.012 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.3 | -47.6 | 177.4 | 176.7 | -90.7 | 0 | 0 | 0 | 111.9 | Y413 I417 H480 L484 F501 F507 A508 A509 L554 | Y413-Y505 HydrophobicContact CD1-CE2 4.09Å; Y413-Y505 HydrophobicContact CG-CE2 4.23Å; I417-Y505 HydrophobicContact CD1-CE2 4.49Å; I417-Y505 HydrophobicContact CG1-CE2 4.46Å; H480-Y505 HydrophobicContact CB-CE1 3.98Å; H480-Y505 AromaticContact ND1-CE1 3.44Å; H480-Y505 WeakPolarHBondContact ND1-CE1 3.32Å; H480-Y505 AromaticContact ND1-CZ 3.6Å; H480-Y505 PolarHBondContact ND1-OH 3.46Å; L484-Y505 HydrophobicContact CD1-CD1 3.5Å; L484-Y505 VanDerWaalsContact CD1-CD1 3.5Å; L484-Y505 HydrophobicContact CD1-CE1 3.91Å; L484-Y505 HydrophobicContact CD1-CG 4.21Å; L484-Y505 HydrophobicContact CD2-CD1 3.82Å; L484-Y505 HydrophobicContact CD2-CD2 4.4Å; L484-Y505 HydrophobicContact CD2-CE1 3.7Å; L484-Y505 HydrophobicContact CD2-CE2 4.36Å; L484-Y505 HydrophobicContact CD2-CG 4.14Å; L484-Y505 HydrophobicContact CG-CD1 3.84Å; L484-Y505 HydrophobicContact CG-CE1 3.72Å; F501-Y505 HydrophobicContact CZ-CD2 4.48Å; F501-Y505 VanDerWaalsContact O-CB 3.3Å; F501-Y505 WeakPolarHBondContact O-CB 3.29Å; F501-Y505 PolarHBondContact O-N 2.87Å; Y505-F507 VanDerWaalsContact C-N 3.29Å; Y505-F507 PolarHBondContact O-N 3.23Å; Y505-A508 PolarHBondContact O-N 2.91Å; Y505-A509 PolarHBondContact O-N 3.03Å; Y505-L554 HydrophobicContact CD2-CD1 3.69Å; Y505-L554 HydrophobicContact CE2-CD1 3.96Å |
| 506 | L | 96.4 | Very high | 92.1 | Very high | 21 Ų | 21 | 38.5 Ų | 38.5 | 11% | 0.11 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64 | -36.6 | 178 | -72.5 | 175.7 | 0 | 0 | 0 | 111.8 | H480 L481 I502 L510 | H480-L506 HydrophobicContact CB-CD2 3.68Å; L481-L506 HydrophobicContact CD2-CD1 3.86Å; L481-L506 HydrophobicContact CG-CD1 4.11Å; L481-L506 HydrophobicContact CG-CD2 4.33Å; I502-L506 HydrophobicContact CG2-CD1 3.72Å; I502-L506 HydrophobicContact CG2-CG 4.25Å; I502-L506 VanDerWaalsContact O-CB 3.29Å; I502-L506 WeakPolarHBondContact O-CB 3.37Å; I502-L506 WeakPolarHBondContact O-CG 3.4Å; I502-L506 PolarHBondContact O-N 3.48Å; L506-L510 VanDerWaalsContact O-CB 3.28Å; L506-L510 WeakPolarHBondContact O-CB 3.45Å; L506-L510 VanDerWaalsContact O-CG 3.27Å; L506-L510 WeakPolarHBondContact O-CG 3.26Å; L506-L510 PolarHBondContact O-N 3.02Å |
| 507 | F | 96.4 | Very high | 93.1 | Very high | 137 Ų | 137 | 36.1 Ų | 36.1 | 60% | 0.601 | 20% | 0.199 | S | C | * | . | H | α-helix | trans | -63.2 | -45.5 | 174.2 | 179.4 | -100.9 | 0 | 0 | 0 | 111.6 | A503 V504 Y505 L510 L511 | A503-F507 VanDerWaalsContact O-CB 3.31Å; A503-F507 WeakPolarHBondContact O-CB 3.43Å; A503-F507 PolarHBondContact O-N 3.46Å; V504-F507 PolarHBondContact O-N 3.33Å; Y505-F507 VanDerWaalsContact C-N 3.29Å; Y505-F507 PolarHBondContact O-N 3.23Å; F507-L510 PolarHBondContact O-N 2.63Å; F507-L511 HydrophobicContact CE1-CD2 4.14Å; F507-L511 HydrophobicContact CZ-CD2 4.38Å; F507-L511 VanDerWaalsContact O-CB 3.27Å; F507-L511 WeakPolarHBondContact O-CB 3.36Å; F507-L511 PolarHBondContact O-N 3.41Å |
| 508 | A | 96.8 | Very high | 93.6 | Very high | 6 Ų | 6 | 38.9 Ų | 38.9 | 5% | 0.05 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.2 | -48.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I417 V504 Y505 L510 L511 Q512 L553 | I417-A508 HydrophobicContact CD1-CB 4.36Å; V504-A508 PolarHBondContact O-N 3.41Å; Y505-A508 PolarHBondContact O-N 2.91Å; A508-L510 PolarHBondContact O-N 3.36Å; A508-L511 PolarHBondContact O-N 3.42Å; A508-Q512 WeakPolarHBondContact O-CB 3.2Å; A508-Q512 PolarHBondContact O-N 3.18Å; A508-L553 HydrophobicContact CB-CB 4.14Å |
| 509 | A | 96.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.6 | -42.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | I417 V476 Y505 Q512 V513 | I417-A509 HydrophobicContact CD1-CB 4.29Å; I417-A509 HydrophobicContact CG1-CB 4.15Å; V476-A509 HydrophobicContact CG1-CB 4.18Å; Y505-A509 PolarHBondContact O-N 3.03Å; A509-Q512 PolarHBondContact O-N 3.19Å; A509-V513 WeakPolarHBondContact O-CG2 3.4Å; A509-V513 PolarHBondContact O-N 2.9Å |
| 510 | L | 96.3 | Very high | 94 | Very high | 48 Ų | 48 | 34.1 Ų | 34.1 | 25% | 0.251 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -62.8 | -45.4 | 175.2 | -80.5 | 171 | 0 | 0 | 0 | 111.9 | L473 V476 I477 L506 F507 A508 Q512 F514 | L473-L510 HydrophobicContact CD1-CD2 4.09Å; V476-L510 HydrophobicContact CB-CD2 3.98Å; V476-L510 HydrophobicContact CG1-CD2 3.93Å; V476-L510 HydrophobicContact CG1-CG 4.22Å; I477-L510 HydrophobicContact CD1-CD1 3.95Å; I477-L510 HydrophobicContact CD1-CD2 4.31Å; I477-L510 HydrophobicContact CG1-CD1 3.91Å; I477-L510 HydrophobicContact CG1-CD2 3.84Å; I477-L510 HydrophobicContact CG1-CG 4.15Å; L506-L510 VanDerWaalsContact O-CB 3.28Å; L506-L510 WeakPolarHBondContact O-CB 3.45Å; L506-L510 VanDerWaalsContact O-CG 3.27Å; L506-L510 WeakPolarHBondContact O-CG 3.26Å; L506-L510 PolarHBondContact O-N 3.02Å; F507-L510 PolarHBondContact O-N 2.63Å; A508-L510 PolarHBondContact O-N 3.36Å; L510-Q512 VanDerWaalsContact C-N 3.35Å; L510-F514 WeakPolarHBondContact O-CB 3.21Å; L510-F514 PolarHBondContact O-N 3.21Å |
| 511 | L | 96.4 | Very high | 93.9 | Very high | 63 Ų | 63 | 30.6 Ų | 30.6 | 33% | 0.33 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -64.6 | -40.3 | -180 | -177.8 | 59.1 | 0 | 0 | 0 | 111.6 | F507 A508 T515 L553 | F507-L511 HydrophobicContact CE1-CD2 4.14Å; F507-L511 HydrophobicContact CZ-CD2 4.38Å; F507-L511 VanDerWaalsContact O-CB 3.27Å; F507-L511 WeakPolarHBondContact O-CB 3.36Å; F507-L511 PolarHBondContact O-N 3.41Å; A508-L511 PolarHBondContact O-N 3.42Å; L511-T515 WeakPolarHBondContact O-CB 3.47Å; L511-T515 PolarHBondContact O-N 3.24Å; L511-T515 PolarHBondContact O-OG1 2.83Å; L511-L553 HydrophobicContact CB-CD1 4.36Å; L511-L553 HydrophobicContact CD2-CD1 4.49Å; L511-L553 HydrophobicContact CD2-CD2 3.68Å; L511-L553 HydrophobicContact CG-CD1 4.26Å; L511-L553 HydrophobicContact CG-CD2 4.32Å |
| 512 | Q | 96.8 | Very high | 93.8 | Very high | 1 Ų | 1 | 35.7 Ų | 35.7 | 1% | 0.005 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.1 | -58.4 | 174.9 | -174.4 | -165.9 | -10.6 | 0 | 0 | 110.7 | I417 A508 A509 L510 F514 T515 L516 G546 L549 L553 | I417-Q512 VanDerWaalsContact CG1-OE1 3.24Å; I417-Q512 PolarHBondContact O-NE2 3.35Å; I417-Q512 VanDerWaalsContact O-NE2 3.1Å; I417-Q512 PolarHBondContact O-OE1 3.32Å; A508-Q512 WeakPolarHBondContact O-CB 3.2Å; A508-Q512 PolarHBondContact O-N 3.18Å; A509-Q512 PolarHBondContact O-N 3.19Å; L510-Q512 VanDerWaalsContact C-N 3.35Å; Q512-F514 VanDerWaalsContact C-N 3.3Å; Q512-F514 PolarHBondContact O-N 2.93Å; Q512-T515 PolarHBondContact O-N 3.12Å; Q512-T515 VanDerWaalsContact O-N 3.17Å; Q512-L516 HydrophobicContact CG-CD1 3.96Å; Q512-L516 HydrophobicContact CG-CG 4.48Å; Q512-L516 WeakPolarHBondContact O-CB 3.42Å; Q512-L516 VanDerWaalsContact O-CG 3.32Å; Q512-L516 WeakPolarHBondContact O-CG 3.4Å; Q512-L516 PolarHBondContact O-N 3.42Å; Q512-G546 PolarHBondContact NE2-O 3.23Å; Q512-L549 HydrophobicContact CG-CB 4.17Å; Q512-L553 HydrophobicContact CB-CD1 3.72Å; Q512-L553 HydrophobicContact CG-CD1 4.46Å |
| 513 | V | 95.4 | Very high | 93.7 | Very high | 2 Ų | 2 | 34.9 Ų | 34.9 | 1% | 0.012 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -63.7 | -37.8 | -176.9 | 175.9 | 0 | 0 | 0 | 0 | 111.3 | L424 L473 V476 A509 T515 L516 L517 | L424-V513 HydrophobicContact CD1-CG1 4.01Å; L424-V513 HydrophobicContact CD1-CG2 4.07Å; L473-V513 HydrophobicContact CD1-CG1 4.33Å; V476-V513 HydrophobicContact CG2-CB 3.9Å; V476-V513 HydrophobicContact CG2-CG1 3.71Å; V476-V513 HydrophobicContact CG2-CG2 3.89Å; A509-V513 WeakPolarHBondContact O-CG2 3.4Å; A509-V513 PolarHBondContact O-N 2.9Å; V513-T515 PolarHBondContact O-N 3.35Å; V513-L516 PolarHBondContact O-N 2.82Å; V513-L517 HydrophobicContact CG1-CD1 3.74Å; V513-L517 HydrophobicContact CG1-CG 4.07Å; V513-L517 WeakPolarHBondContact O-CB 3.4Å; V513-L517 VanDerWaalsContact O-CG 3.28Å; V513-L517 WeakPolarHBondContact O-CG 3.41Å; V513-L517 PolarHBondContact O-N 3.15Å |
| 514 | F | 94.4 | Very high | 93.3 | Very high | 72 Ų | 72 | 32 Ų | 32 | 32% | 0.316 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -58.1 | -48.6 | 174.4 | 177 | -92.5 | 0 | 0 | 0 | 111.7 | P455 Y459 L473 L510 Q512 W518 | P455-F514 HydrophobicContact CB-CZ 4.03Å; Y459-F514 HydrophobicContact CD2-CD2 4.15Å; Y459-F514 AromaticContact CD2-CE2 3.52Å; Y459-F514 HydrophobicContact CD2-CE2 3.52Å; Y459-F514 HydrophobicContact CD2-CZ 4.15Å; Y459-F514 HydrophobicContact CE1-CD2 4.35Å; Y459-F514 AromaticContact CE2-CD2 3.45Å; Y459-F514 HydrophobicContact CE2-CD2 3.45Å; Y459-F514 VanDerWaalsContact CE2-CD2 3.45Å; Y459-F514 AromaticContact CE2-CE2 3.22Å; Y459-F514 HydrophobicContact CE2-CE2 3.22Å; Y459-F514 HydrophobicContact CE2-CG 4.26Å; Y459-F514 AromaticContact CE2-CZ 3.86Å; Y459-F514 HydrophobicContact CE2-CZ 3.86Å; Y459-F514 HydrophobicContact CG-CE2 4.34Å; Y459-F514 AromaticContact CZ-CD2 3.56Å; Y459-F514 AromaticContact CZ-CE2 3.82Å; Y459-F514 VanDerWaalsContact OH-CA 3.27Å; Y459-F514 WeakPolarHBondContact OH-CA 3.19Å; Y459-F514 PolarHBondContact OH-O 2.95Å; L473-F514 HydrophobicContact CD1-CB 4.18Å; L473-F514 HydrophobicContact CD2-CD2 4.17Å; L510-F514 WeakPolarHBondContact O-CB 3.21Å; L510-F514 PolarHBondContact O-N 3.21Å; Q512-F514 VanDerWaalsContact C-N 3.3Å; Q512-F514 PolarHBondContact O-N 2.93Å; F514-W518 PolarHBondContact O-N 2.71Å |
| 515 | T | 94.3 | Very high | 93 | Very high | 33 Ų | 33 | 31.6 Ų | 31.6 | 20% | 0.202 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.5 | -43.2 | 179.9 | -55.1 | 0 | 0 | 0 | 0 | 111.1 | L511 Q512 V513 W518 I519 L549 | L511-T515 WeakPolarHBondContact O-CB 3.47Å; L511-T515 PolarHBondContact O-N 3.24Å; L511-T515 PolarHBondContact O-OG1 2.83Å; Q512-T515 PolarHBondContact O-N 3.12Å; Q512-T515 VanDerWaalsContact O-N 3.17Å; V513-T515 PolarHBondContact O-N 3.35Å; T515-W518 PolarHBondContact O-N 2.94Å; T515-I519 HydrophobicContact CG2-CD1 3.83Å; T515-I519 VanDerWaalsContact O-CG1 3.29Å; T515-I519 WeakPolarHBondContact O-CG1 3.48Å; T515-I519 PolarHBondContact O-N 2.91Å; T515-L549 HydrophobicContact CG2-CD1 3.96Å |
| 516 | L | 94.2 | Very high | 92.6 | Very high | 1 Ų | 1 | 34.3 Ų | 34.3 | 1% | 0.005 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.6 | -46.5 | -179.7 | -74 | 175.5 | 0 | 0 | 0 | 113.3 | V425 Q512 V513 W518 I519 A520 L545 L549 | V425-L516 HydrophobicContact CB-CB 4.02Å; V425-L516 HydrophobicContact CB-CD1 4.49Å; V425-L516 HydrophobicContact CG1-CD1 4.33Å; V425-L516 HydrophobicContact CG2-CB 3.84Å; V425-L516 WeakPolarHBondContact CG2-O 3.29Å; Q512-L516 HydrophobicContact CG-CD1 3.96Å; Q512-L516 HydrophobicContact CG-CG 4.48Å; Q512-L516 WeakPolarHBondContact O-CB 3.42Å; Q512-L516 VanDerWaalsContact O-CG 3.32Å; Q512-L516 WeakPolarHBondContact O-CG 3.4Å; Q512-L516 PolarHBondContact O-N 3.42Å; V513-L516 PolarHBondContact O-N 2.82Å; L516-W518 VanDerWaalsContact C-N 3.29Å; L516-W518 PolarHBondContact O-N 3.02Å; L516-I519 PolarHBondContact O-N 2.96Å; L516-A520 WeakPolarHBondContact O-CB 3.41Å; L516-A520 PolarHBondContact O-N 2.96Å; L516-L545 HydrophobicContact CD2-CB 4.01Å; L516-L549 HydrophobicContact CD2-CD1 4.13Å; L516-L549 HydrophobicContact CG-CD1 4.49Å |
| 517 | L | 92.1 | Very high | 92.1 | Very high | 1 Ų | 1 | 34.1 Ų | 34.1 | 1% | 0.005 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.5 | -34.6 | 179.6 | -69 | 174 | 0 | 0 | 0 | 111.8 | Q428 Y459 L472 L473 V513 A520 D521 | Q428-L517 HydrophobicContact CB-CD2 3.58Å; Q428-L517 HydrophobicContact CG-CD2 3.75Å; Y459-L517 HydrophobicContact CE1-CD1 4.46Å; Y459-L517 VanDerWaalsContact OH-CB 3.32Å; Y459-L517 WeakPolarHBondContact OH-CB 3.43Å; L472-L517 HydrophobicContact CB-CD1 4.23Å; L472-L517 HydrophobicContact CD1-CD2 4.04Å; L473-L517 HydrophobicContact CB-CD1 4.4Å; V513-L517 HydrophobicContact CG1-CD1 3.74Å; V513-L517 HydrophobicContact CG1-CG 4.07Å; V513-L517 WeakPolarHBondContact O-CB 3.4Å; V513-L517 VanDerWaalsContact O-CG 3.28Å; V513-L517 WeakPolarHBondContact O-CG 3.41Å; V513-L517 PolarHBondContact O-N 3.15Å; L517-A520 PolarHBondContact O-N 3.42Å; L517-D521 PolarHBondContact O-N 3.35Å |
| 518 | W | 90.2 | Very high | 91.5 | Very high | 91 Ų | 91 | 27.7 Ų | 27.7 | 35% | 0.345 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -65.5 | -46.2 | 172.4 | 170.4 | 46.1 | 0 | 0 | 0 | 112.1 | P455 F514 T515 L516 A520 D521 W522 | P455-W518 HydrophobicContact CB-CG 4.45Å; P455-W518 HydrophobicContact CG-CD2 3.93Å; P455-W518 HydrophobicContact CG-CE3 4.48Å; P455-W518 HydrophobicContact CG-CG 4.14Å; P455-W518 HydrophobicContact CG-CZ2 4.26Å; F514-W518 PolarHBondContact O-N 2.71Å; T515-W518 PolarHBondContact O-N 2.94Å; L516-W518 VanDerWaalsContact C-N 3.29Å; L516-W518 PolarHBondContact O-N 3.02Å; W518-A520 VanDerWaalsContact C-N 3.28Å; W518-A520 PolarHBondContact O-N 2.91Å; W518-D521 PolarHBondContact O-N 2.8Å; W518-W522 PolarHBondContact O-N 3.34Å |
| 519 | I | 91.7 | Very high | 91 | Very high | 34 Ų | 34 | 34 Ų | 34 | 17% | 0.174 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.2 | -37.1 | 176.4 | -66 | 169.1 | 0 | 0 | 0 | 110.6 | T515 L516 W522 M523 L542 L545 | T515-I519 HydrophobicContact CG2-CD1 3.83Å; T515-I519 VanDerWaalsContact O-CG1 3.29Å; T515-I519 WeakPolarHBondContact O-CG1 3.48Å; T515-I519 PolarHBondContact O-N 2.91Å; L516-I519 PolarHBondContact O-N 2.96Å; I519-W522 PolarHBondContact O-N 2.98Å; I519-M523 WeakPolarHBondContact O-CB 3.23Å; I519-M523 PolarHBondContact O-N 3.49Å; I519-L542 HydrophobicContact CB-CD2 4.19Å; I519-L542 HydrophobicContact CG2-CD2 3.8Å; I519-L545 HydrophobicContact CD1-CD1 4.45Å; I519-L545 HydrophobicContact CG2-CD1 4.06Å |
| 520 | A | 90.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.8 | -46.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V425 L516 L517 W518 W522 M523 V524 L542 | V425-A520 HydrophobicContact CG2-CB 3.62Å; L516-A520 WeakPolarHBondContact O-CB 3.41Å; L516-A520 PolarHBondContact O-N 2.96Å; L517-A520 PolarHBondContact O-N 3.42Å; W518-A520 VanDerWaalsContact C-N 3.28Å; W518-A520 PolarHBondContact O-N 2.91Å; A520-W522 VanDerWaalsContact C-N 3.34Å; A520-W522 PolarHBondContact O-N 2.97Å; A520-M523 PolarHBondContact O-N 2.96Å; A520-V524 WeakPolarHBondContact O-CB 3.16Å; A520-V524 VanDerWaalsContact O-CG2 3.3Å; A520-V524 WeakPolarHBondContact O-CG2 3.36Å; A520-V524 PolarHBondContact O-N 3.5Å; A520-L542 HydrophobicContact CB-CD1 3.56Å; A520-L542 HydrophobicContact CB-CD2 3.86Å; A520-L542 HydrophobicContact CB-CG 4.33Å |
| 521 | D | 87.9 | Confident | 89.5 | Confident | 12 Ų | 12 | 39.2 Ų | 39.2 | 6% | 0.064 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -59.2 | -45.9 | 177.2 | -174.7 | 43.4 | 0 | 0 | 0 | 111.3 | I432 T458 L517 W518 H525 | I432-D521 HydrophobicContact CD1-CB 4.46Å; T458-D521 HydrophobicContact CG2-CB 3.69Å; T458-D521 PolarHBondContact OG1-OD2 2.94Å; L517-D521 PolarHBondContact O-N 3.35Å; W518-D521 PolarHBondContact O-N 2.8Å; D521-H525 PolarHBondContact O-ND1 2.86Å; D521-H525 IonicContact OD1-CE1 3.38Å; D521-H525 PolarHBondContact OD1-CE1 3.43Å; D521-H525 VanDerWaalsContact OD1-CE1 3.29Å; D521-H525 IonicContact OD1-ND1 2.7Å |
| 522 | W | 88.3 | Confident | 88.7 | Confident | 112 Ų | 112 | 38.5 Ų | 38.5 | 42% | 0.424 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -65.1 | -48.3 | 175.8 | 169.9 | 73.3 | 0 | 0 | 0 | 112.8 | Y453 W518 I519 A520 H526 | Y453-W522 HydrophobicContact CD1-CB 4.33Å; Y453-W522 AromaticContact CD2-CD1 3.7Å; Y453-W522 HydrophobicContact CG-CB 4.3Å; Y453-W522 AromaticContact CG-CD1 3.76Å; Y453-W522 HydrophobicContact CG-CG 4.45Å; W518-W522 PolarHBondContact O-N 3.34Å; I519-W522 PolarHBondContact O-N 2.98Å; A520-W522 VanDerWaalsContact C-N 3.34Å; A520-W522 PolarHBondContact O-N 2.97Å; W522-H526 WeakPolarHBondContact O-CB 3.34Å; W522-H526 PolarHBondContact O-N 3.33Å |
| 523 | M | 89.3 | Confident | 87.7 | Confident | 11 Ų | 11 | 39.3 Ų | 39.3 | 5% | 0.054 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -71.5 | -39.9 | -169.1 | -172.3 | 157.9 | 62.4 | 0 | 0 | 112.8 | I519 A520 H525 H526 F527 S538 Y541 L542 | I519-M523 WeakPolarHBondContact O-CB 3.23Å; I519-M523 PolarHBondContact O-N 3.49Å; A520-M523 PolarHBondContact O-N 2.96Å; M523-H525 PolarHBondContact O-N 2.78Å; M523-H526 PolarHBondContact O-N 2.88Å; M523-F527 HydrophobicContact CG-CD2 3.55Å; M523-F527 HydrophobicContact CG-CE2 3.42Å; M523-F527 VanDerWaalsContact CG-CE2 3.42Å; M523-F527 WeakPolarHBondContact O-CD2 3.18Å; M523-F527 PolarHBondContact O-N 3.42Å; M523-F527 HydrophobicContact SD-CD2 4.49Å; M523-F527 HydrophobicContact SD-CE2 3.81Å; M523-S538 WeakPolarHBondContact CE-O 3.46Å; M523-Y541 HydrophobicContact SD-CD2 3.96Å; M523-Y541 HydrophobicContact SD-CG 4.42Å; M523-L542 HydrophobicContact CE-CB 4.39Å; M523-L542 HydrophobicContact CE-CD1 3.92Å; M523-L542 HydrophobicContact CE-CD2 3.46Å; M523-L542 VanDerWaalsContact CE-CD2 3.46Å; M523-L542 HydrophobicContact CE-CG 3.27Å |
| 524 | V | 87.4 | Confident | 87 | Confident | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.9 | -47.7 | 177.3 | 168.2 | 0 | 0 | 0 | 0 | 110.7 | A429 I432 L436 A520 H526 F527 W528 P534 | A429-V524 HydrophobicContact CB-CG2 3.95Å; I432-V524 HydrophobicContact CB-CB 4.5Å; I432-V524 HydrophobicContact CB-CG1 3.93Å; I432-V524 HydrophobicContact CG2-CB 4.12Å; I432-V524 HydrophobicContact CG2-CG1 3.46Å; I432-V524 VanDerWaalsContact CG2-CG1 3.46Å; L436-V524 HydrophobicContact CD1-CG1 3.83Å; A520-V524 WeakPolarHBondContact O-CB 3.16Å; A520-V524 VanDerWaalsContact O-CG2 3.3Å; A520-V524 WeakPolarHBondContact O-CG2 3.36Å; A520-V524 PolarHBondContact O-N 3.5Å; V524-H526 VanDerWaalsContact C-N 3.31Å; V524-H526 PolarHBondContact O-N 3.44Å; V524-F527 PolarHBondContact O-N 3.32Å; V524-W528 WeakPolarHBondContact O-CB 3.34Å; V524-W528 PolarHBondContact O-N 3.25Å; V524-P534 HydrophobicContact CB-CB 4.2Å; V524-P534 HydrophobicContact CG1-CB 3.69Å; V524-P534 HydrophobicContact CG1-CG 3.98Å; V524-P534 HydrophobicContact CG2-CB 4.22Å |
| 525 | H | 86.4 | Confident | 86.1 | Confident | 15 Ų | 15 | 36.9 Ų | 36.9 | 7% | 0.069 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -66.8 | -32.9 | 177.3 | -69.7 | 98.3 | 0 | 0 | 0 | 112.8 | L445 Y453 D521 M523 K529 | L445-H525 HydrophobicContact CD2-CB 4.04Å; Y453-H525 HydrophobicContact CE1-CB 3.96Å; Y453-H525 AromaticContact CE1-ND1 3.99Å; Y453-H525 WeakPolarHBondContact OH-CB 3.34Å; D521-H525 PolarHBondContact O-ND1 2.86Å; D521-H525 IonicContact OD1-CE1 3.38Å; D521-H525 PolarHBondContact OD1-CE1 3.43Å; D521-H525 VanDerWaalsContact OD1-CE1 3.29Å; D521-H525 IonicContact OD1-ND1 2.7Å; M523-H525 PolarHBondContact O-N 2.78Å; H525-K529 WeakPolarHBondContact O-CB 3.49Å; H525-K529 PolarHBondContact O-N 2.92Å |
| 526 | H | 86.5 | Confident | 85.3 | Confident | 60 Ų | 60 | 36 Ų | 36 | 28% | 0.278 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -66.9 | -44.2 | 176 | 178.3 | 78.8 | 0 | 0 | 0 | 112.4 | W522 M523 V524 K529 K530 | W522-H526 WeakPolarHBondContact O-CB 3.34Å; W522-H526 PolarHBondContact O-N 3.33Å; M523-H526 PolarHBondContact O-N 2.88Å; V524-H526 VanDerWaalsContact C-N 3.31Å; V524-H526 PolarHBondContact O-N 3.44Å; H526-K529 PolarHBondContact O-N 3.18Å; H526-K530 WeakPolarHBondContact NE2-CE 3.35Å; H526-K530 PolarHBondContact NE2-NZ 2.65Å; H526-K530 PolarHBondContact O-N 3.47Å |
| 527 | F | 86.3 | Confident | 84.9 | Confident | 17 Ų | 17 | 37.3 Ų | 37.3 | 8% | 0.075 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -68.1 | -39.5 | 175 | -80.1 | -63.4 | 0 | 0 | 0 | 111.9 | M523 V524 K529 K530 G531 K532 F537 S538 Y541 | M523-F527 HydrophobicContact CG-CD2 3.55Å; M523-F527 HydrophobicContact CG-CE2 3.42Å; M523-F527 VanDerWaalsContact CG-CE2 3.42Å; M523-F527 WeakPolarHBondContact O-CD2 3.18Å; M523-F527 PolarHBondContact O-N 3.42Å; M523-F527 HydrophobicContact SD-CD2 4.49Å; M523-F527 HydrophobicContact SD-CE2 3.81Å; V524-F527 PolarHBondContact O-N 3.32Å; F527-K529 VanDerWaalsContact C-N 3.32Å; F527-K529 PolarHBondContact O-N 3.29Å; F527-K530 CarbonylContact O-C 3.53Å; F527-K530 WeakPolarHBondContact O-CA 3.15Å; F527-K530 WeakPolarHBondContact O-CB 3.49Å; F527-K530 PolarHBondContact O-N 2.8Å; F527-G531 PolarHBondContact O-N 2.9Å; F527-K532 CarbonylContact C-O 3.59Å; F527-K532 HydrophobicContact CB-CB 4.28Å; F527-K532 HydrophobicContact CD1-CB 3.95Å; F527-K532 HydrophobicContact CD1-CD 3.83Å; F527-K532 HydrophobicContact CD1-CG 4.43Å; F527-K532 HydrophobicContact CE1-CD 4.07Å; F527-K532 PolarHBondContact O-N 3.48Å; F527-F537 HydrophobicContact CD1-CB 3.99Å; F527-F537 HydrophobicContact CD1-CG 4.29Å; F527-F537 HydrophobicContact CD2-CB 4.07Å; F527-F537 HydrophobicContact CE1-CB 4.06Å; F527-F537 HydrophobicContact CE1-CD1 4.12Å; F527-F537 HydrophobicContact CE1-CG 4.28Å; F527-F537 HydrophobicContact CE2-CB 4.13Å; F527-F537 HydrophobicContact CG-CB 4.02Å; F527-F537 HydrophobicContact CZ-CB 4.16Å; F527-S538 WeakPolarHBondContact CD2-OG 3.33Å; F527-Y541 AromaticContact CE2-CD2 3.91Å; F527-Y541 HydrophobicContact CE2-CD2 3.91Å; F527-Y541 HydrophobicContact CE2-CE2 4.07Å; F527-Y541 AromaticContact CZ-CD2 3.99Å; F527-Y541 HydrophobicContact CZ-CD2 3.99Å; F527-Y541 AromaticContact CZ-CE2 3.67Å; F527-Y541 HydrophobicContact CZ-CE2 3.67Å |
| 528 | W | 84.4 | Confident | 84.7 | Confident | 3 Ų | 3 | 37.2 Ų | 37.2 | 1% | 0.011 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -56.5 | -44.9 | 173.2 | -167.8 | -95.3 | 0 | 0 | 0 | 112.5 | L436 H437 S440 I441 P442 G443 E444 V524 K530 G531 P534 | L436-W528 HydrophobicContact CB-CD2 3.75Å; L436-W528 HydrophobicContact CB-CE3 3.9Å; L436-W528 HydrophobicContact CB-CG 4.36Å; L436-W528 HydrophobicContact CB-CH2 4.08Å; L436-W528 HydrophobicContact CB-CZ2 3.93Å; L436-W528 HydrophobicContact CB-CZ3 4.05Å; L436-W528 HydrophobicContact CD1-CB 3.91Å; L436-W528 HydrophobicContact CD1-CD2 3.93Å; L436-W528 HydrophobicContact CD1-CE3 4.2Å; L436-W528 HydrophobicContact CD1-CG 3.79Å; L436-W528 HydrophobicContact CG-CD2 4.34Å; L436-W528 HydrophobicContact CG-CG 4.47Å; H437-W528 HydrophobicContact CB-CH2 4.2Å; H437-W528 AromaticContact CD2-CH2 3.89Å; H437-W528 AromaticContact CD2-CZ3 3.57Å; H437-W528 AromaticContact CE1-CH2 3.75Å; H437-W528 AromaticContact CE1-CZ3 3.63Å; H437-W528 AromaticContact CG-CH2 3.59Å; H437-W528 AromaticContact CG-CZ3 3.78Å; H437-W528 AromaticContact ND1-CH2 3.49Å; H437-W528 WeakPolarHBondContact ND1-CH2 3.19Å; H437-W528 AromaticContact ND1-CZ3 3.81Å; H437-W528 AromaticContact NE2-CH2 3.98Å; H437-W528 AromaticContact NE2-CZ3 3.47Å; H437-W528 WeakPolarHBondContact NE2-CZ3 3.48Å; S440-W528 WeakPolarHBondContact O-CZ2 3.27Å; I441-W528 PolarHBondContact O-NE1 3.46Å; I441-W528 VanDerWaalsContact O-NE1 3.14Å; P442-W528 HydrophobicContact CB-CZ2 4.45Å; P442-W528 HydrophobicContact CG-CH2 4.11Å; P442-W528 HydrophobicContact CG-CZ2 4.11Å; G443-W528 WeakPolarHBondContact CA-O 3.44Å; G443-W528 PolarHBondContact N-O 2.97Å; E444-W528 PolarHBondContact O-NE1 2.86Å; V524-W528 WeakPolarHBondContact O-CB 3.34Å; V524-W528 PolarHBondContact O-N 3.25Å; W528-K530 PolarHBondContact O-N 2.97Å; W528-G531 PolarHBondContact O-N 2.99Å; W528-P534 HydrophobicContact CB-CG 4.28Å; W528-P534 HydrophobicContact CE3-CG 3.67Å; W528-P534 HydrophobicContact CZ3-CG 4.42Å |
| 529 | K | 85.1 | Confident | 84.5 | Confident | 139 Ų | 139 | 33.1 Ų | 33.1 | 60% | 0.604 | 16% | 0.156 | S | C | * | . | H | α-helix | trans | -59.7 | -31.1 | 176.2 | -167.7 | 177.6 | -179.6 | 179.8 | 0 | 112.9 | L445 H525 H526 F527 G531 | L445-K529 HydrophobicContact CD1-CB 3.71Å; L445-K529 HydrophobicContact CD1-CD 3.66Å; L445-K529 HydrophobicContact CD1-CG 3.56Å; H525-K529 WeakPolarHBondContact O-CB 3.49Å; H525-K529 PolarHBondContact O-N 2.92Å; H526-K529 PolarHBondContact O-N 3.18Å; F527-K529 VanDerWaalsContact C-N 3.32Å; F527-K529 PolarHBondContact O-N 3.29Å; K529-G531 VanDerWaalsContact C-N 3.26Å |
| 530 | K | 83.9 | Confident | 84.4 | Confident | 129 Ų | 129 | 31.6 Ų | 31.6 | 56% | 0.561 | 15% | 0.148 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | 2.9 | 177.9 | -69.3 | -176.8 | 175.2 | -172.1 | 0 | 113 | H526 F527 W528 K532 | H526-K530 WeakPolarHBondContact NE2-CE 3.35Å; H526-K530 PolarHBondContact NE2-NZ 2.65Å; H526-K530 PolarHBondContact O-N 3.47Å; F527-K530 CarbonylContact O-C 3.53Å; F527-K530 WeakPolarHBondContact O-CA 3.15Å; F527-K530 WeakPolarHBondContact O-CB 3.49Å; F527-K530 PolarHBondContact O-N 2.8Å; W528-K530 PolarHBondContact O-N 2.97Å; K530-K532 HydrophobicContact CB-CG 4.43Å; K530-K532 PolarHBondContact O-N 2.97Å |
| 531 | G | 77.9 | Confident | 84.4 | Confident | 27 Ų | 27 | 32.7 Ų | 32.7 | 28% | 0.278 | 15% | 0.152 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 68.9 | 13 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | F527 W528 K529 | F527-G531 PolarHBondContact O-N 2.9Å; W528-G531 PolarHBondContact O-N 2.99Å; K529-G531 VanDerWaalsContact C-N 3.26Å |
| 532 | K | 79.3 | Confident | 84.6 | Confident | 48 Ų | 48 | 32.1 Ų | 32.1 | 21% | 0.209 | 15% | 0.149 | C | C | . | . | trans | -90.7 | 138.4 | 176.1 | -68.9 | -169.5 | 170.9 | -163.9 | 0 | 109.4 | E382 F527 K530 P534 F537 | E382-K532 IonicContact OE1-NZ 3.53Å; E382-K532 IonicContact OE2-NZ 3.29Å; E382-K532 PolarHBondContact OE2-NZ 3.32Å; F527-K532 CarbonylContact C-O 3.59Å; F527-K532 HydrophobicContact CB-CB 4.28Å; F527-K532 HydrophobicContact CD1-CB 3.95Å; F527-K532 HydrophobicContact CD1-CD 3.83Å; F527-K532 HydrophobicContact CD1-CG 4.43Å; F527-K532 HydrophobicContact CE1-CD 4.07Å; F527-K532 PolarHBondContact O-N 3.48Å; K530-K532 HydrophobicContact CB-CG 4.43Å; K530-K532 PolarHBondContact O-N 2.97Å; K532-P534 WeakPolarHBondContact O-CD 3.33Å; K532-F537 HydrophobicContact CB-CD2 4.06Å; K532-F537 HydrophobicContact CB-CE2 4.19Å; K532-F537 HydrophobicContact CD-CD1 4.19Å; K532-F537 HydrophobicContact CD-CD2 4.33Å; K532-F537 HydrophobicContact CD-CE1 3.94Å; K532-F537 HydrophobicContact CD-CE2 4.09Å; K532-F537 HydrophobicContact CD-CG 4.39Å; K532-F537 HydrophobicContact CD-CZ 3.89Å; K532-F537 HydrophobicContact CG-CE2 4.37Å | ||
| 533 | D | 77.1 | Confident | 84.8 | Confident | 18 Ų | 18 | 27.2 Ų | 27.2 | 10% | 0.096 | 13% | 0.132 | C | C | . | . | trans | -61.6 | 114.3 | 175.1 | -175.9 | -11.8 | 0 | 0 | 0 | 110.3 | H437 D535 S536 F537 | H437-D533 IonicContact NE2-OD1 2.99Å; D533-D535 PolarHBondContact O-N 2.9Å; D533-D535 PolarHBondContact OD1-N 3.27Å; D533-S536 PolarHBondContact O-N 3.29Å; D533-F537 WeakPolarHBondContact O-CD2 3.08Å; D533-F537 PolarHBondContact O-N 3.29Å | ||
| 534 | P | 79.8 | Confident | 85 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.6 | -24.9 | -179.5 | -21 | 33.4 | 0 | 0 | 0 | 113.8 | V524 W528 K532 S538 | V524-P534 HydrophobicContact CB-CB 4.2Å; V524-P534 HydrophobicContact CG1-CB 3.69Å; V524-P534 HydrophobicContact CG1-CG 3.98Å; V524-P534 HydrophobicContact CG2-CB 4.22Å; W528-P534 HydrophobicContact CB-CG 4.28Å; W528-P534 HydrophobicContact CE3-CG 3.67Å; W528-P534 HydrophobicContact CZ3-CG 4.42Å; K532-P534 WeakPolarHBondContact O-CD 3.33Å; P534-S538 WeakPolarHBondContact O-CA 3.41Å; P534-S538 WeakPolarHBondContact O-CB 3.49Å; P534-S538 PolarHBondContact O-N 3.49Å; P534-S538 PolarHBondContact O-OG 3.29Å |
| 535 | D | 76.2 | Confident | 85.3 | Confident | 24 Ų | 24 | 28.6 Ų | 28.6 | 13% | 0.128 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -71.8 | -37.3 | -179.5 | -71.4 | -21.6 | 0 | 0 | 0 | 111.1 | S430 S433 D533 I539 | S430-D535 WeakPolarHBondContact CA-OD1 3.26Å; S433-D535 WeakPolarHBondContact CB-OD1 3.03Å; S433-D535 PolarHBondContact OG-OD1 3.34Å; S433-D535 PolarHBondContact OG-OD2 3.27Å; D533-D535 PolarHBondContact O-N 2.9Å; D533-D535 PolarHBondContact OD1-N 3.27Å; D535-I539 HydrophobicContact CB-CD1 4.15Å |
| 536 | S | 77.4 | Confident | 85.7 | Confident | 15 Ų | 15 | 27.9 Ų | 27.9 | 11% | 0.105 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -79.2 | -22.5 | 178.8 | -64.1 | 0 | 0 | 0 | 0 | 113.9 | E125 P383 D533 | E125-S536 PolarHBondContact OE2-OG 3.25Å; P383-S536 WeakPolarHBondContact CB-O 3.4Å; P383-S536 VanDerWaalsContact CG-O 3.29Å; P383-S536 WeakPolarHBondContact CG-O 3.41Å; D533-S536 PolarHBondContact O-N 3.29Å |
| 537 | F | 84.1 | Confident | 86 | Confident | 27 Ų | 27 | 25.6 Ų | 25.6 | 12% | 0.118 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -109.9 | -46.5 | -177.9 | -74.9 | -94.4 | 0 | 0 | 0 | 114.1 | P383 F527 K532 D533 Y541 | P383-F537 HydrophobicContact CB-CD1 4.01Å; P383-F537 HydrophobicContact CB-CE1 4.49Å; P383-F537 HydrophobicContact CB-CG 4.44Å; P383-F537 HydrophobicContact CG-CD1 4.05Å; P383-F537 HydrophobicContact CG-CE1 4.11Å; P383-F537 HydrophobicContact CG-CG 4.45Å; F527-F537 HydrophobicContact CD1-CB 3.99Å; F527-F537 HydrophobicContact CD1-CG 4.29Å; F527-F537 HydrophobicContact CD2-CB 4.07Å; F527-F537 HydrophobicContact CE1-CB 4.06Å; F527-F537 HydrophobicContact CE1-CD1 4.12Å; F527-F537 HydrophobicContact CE1-CG 4.28Å; F527-F537 HydrophobicContact CE2-CB 4.13Å; F527-F537 HydrophobicContact CG-CB 4.02Å; F527-F537 HydrophobicContact CZ-CB 4.16Å; K532-F537 HydrophobicContact CB-CD2 4.06Å; K532-F537 HydrophobicContact CB-CE2 4.19Å; K532-F537 HydrophobicContact CD-CD1 4.19Å; K532-F537 HydrophobicContact CD-CD2 4.33Å; K532-F537 HydrophobicContact CD-CE1 3.94Å; K532-F537 HydrophobicContact CD-CE2 4.09Å; K532-F537 HydrophobicContact CD-CG 4.39Å; K532-F537 HydrophobicContact CD-CZ 3.89Å; K532-F537 HydrophobicContact CG-CE2 4.37Å; D533-F537 WeakPolarHBondContact O-CD2 3.08Å; D533-F537 PolarHBondContact O-N 3.29Å; F537-Y541 VanDerWaalsContact O-CD2 3.22Å; F537-Y541 WeakPolarHBondContact O-CD2 3.25Å |
| 538 | S | 88 | Confident | 86.5 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -74.8 | -43.1 | -171.5 | -46.8 | 0 | 0 | 0 | 0 | 111.7 | M523 F527 P534 Y541 L542 | M523-S538 WeakPolarHBondContact CE-O 3.46Å; F527-S538 WeakPolarHBondContact CD2-OG 3.33Å; P534-S538 WeakPolarHBondContact O-CA 3.41Å; P534-S538 WeakPolarHBondContact O-CB 3.49Å; P534-S538 PolarHBondContact O-N 3.49Å; P534-S538 PolarHBondContact O-OG 3.29Å; S538-Y541 PolarHBondContact O-N 3.01Å; S538-L542 WeakPolarHBondContact O-CB 3.37Å; S538-L542 WeakPolarHBondContact O-CD1 3.38Å; S538-L542 WeakPolarHBondContact O-CG 3.1Å; S538-L542 PolarHBondContact O-N 3.32Å |
| 539 | I | 86.7 | Confident | 87.1 | Confident | 4 Ų | 4 | 28.7 Ų | 28.7 | 2% | 0.021 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -58.1 | -50.9 | -178 | -68.4 | 167.8 | 0 | 0 | 0 | 110.8 | M212 A426 A429 D535 Y541 L542 T543 | M212-I539 HydrophobicContact CE-CG2 4.46Å; M212-I539 HydrophobicContact CG-CD1 4.15Å; M212-I539 HydrophobicContact SD-CB 4.42Å; M212-I539 HydrophobicContact SD-CD1 3.31Å; M212-I539 WeakPolarHBondContact SD-CD1 3.39Å; M212-I539 HydrophobicContact SD-CG1 4.11Å; M212-I539 HydrophobicContact SD-CG2 3.62Å; A426-I539 HydrophobicContact CB-CG2 3.99Å; A429-I539 HydrophobicContact CB-CG1 3.89Å; D535-I539 HydrophobicContact CB-CD1 4.15Å; I539-Y541 VanDerWaalsContact C-N 3.28Å; I539-Y541 PolarHBondContact O-N 3.07Å; I539-L542 PolarHBondContact O-N 3.12Å; I539-L542 VanDerWaalsContact O-N 3.17Å; I539-T543 HydrophobicContact CG2-CG2 4.33Å; I539-T543 WeakPolarHBondContact O-CG2 3.19Å; I539-T543 PolarHBondContact O-N 3.19Å; I539-T543 PolarHBondContact O-OG1 3.19Å |
| 540 | P | 89.1 | Confident | 87.6 | Confident | 2 Ų | 2 | 22 Ų | 22 | 1% | 0.013 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -56.6 | -38.6 | 177.3 | -29.8 | 37 | 0 | 0 | 0 | 115.2 | N209 P383 A387 T543 A544 | N209-P540 HydrophobicContact CB-CB 4.12Å; N209-P540 HydrophobicContact CB-CG 4.06Å; N209-P540 WeakPolarHBondContact OD1-CA 3.37Å; N209-P540 WeakPolarHBondContact OD1-CB 3.48Å; P383-P540 HydrophobicContact CB-CB 4.25Å; P383-P540 HydrophobicContact CB-CG 4.25Å; A387-P540 HydrophobicContact CB-CB 3.89Å; A387-P540 WeakPolarHBondContact CB-O 3.42Å; P540-T543 PolarHBondContact O-OG1 3.29Å; P540-A544 WeakPolarHBondContact O-CB 3.35Å; P540-A544 PolarHBondContact O-N 3.49Å |
| 541 | Y | 91.6 | Very high | 88.1 | Confident | 23 Ų | 23 | 15.9 Ų | 15.9 | 9% | 0.09 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -72.9 | -38.2 | 178.6 | -65.5 | -20.6 | 0 | 0 | 0 | 112.3 | P383 T386 A387 M523 F527 F537 S538 I539 L545 | P383-Y541 WeakPolarHBondContact CA-OH 3.4Å; P383-Y541 HydrophobicContact CB-CE1 4.12Å; P383-Y541 WeakPolarHBondContact O-CE1 3.24Å; T386-Y541 HydrophobicContact CG2-CD1 4.44Å; T386-Y541 HydrophobicContact CG2-CE1 3.74Å; A387-Y541 HydrophobicContact CB-CD1 4.33Å; M523-Y541 HydrophobicContact SD-CD2 3.96Å; M523-Y541 HydrophobicContact SD-CG 4.42Å; F527-Y541 AromaticContact CE2-CD2 3.91Å; F527-Y541 HydrophobicContact CE2-CD2 3.91Å; F527-Y541 HydrophobicContact CE2-CE2 4.07Å; F527-Y541 AromaticContact CZ-CD2 3.99Å; F527-Y541 HydrophobicContact CZ-CD2 3.99Å; F527-Y541 AromaticContact CZ-CE2 3.67Å; F527-Y541 HydrophobicContact CZ-CE2 3.67Å; F537-Y541 VanDerWaalsContact O-CD2 3.22Å; F537-Y541 WeakPolarHBondContact O-CD2 3.25Å; S538-Y541 PolarHBondContact O-N 3.01Å; I539-Y541 VanDerWaalsContact C-N 3.28Å; I539-Y541 PolarHBondContact O-N 3.07Å; Y541-L545 VanDerWaalsContact O-CB 3.29Å; Y541-L545 WeakPolarHBondContact O-CB 3.48Å; Y541-L545 WeakPolarHBondContact O-CG 3.29Å; Y541-L545 PolarHBondContact O-N 3.25Å |
| 542 | L | 92.1 | Very high | 89 | Confident | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -69.7 | -40.5 | 179.7 | -68.9 | 161.5 | 0 | 0 | 0 | 112 | V425 A429 I519 A520 M523 S538 I539 G546 | V425-L542 HydrophobicContact CB-CB 4.43Å; V425-L542 HydrophobicContact CG1-CB 3.69Å; V425-L542 HydrophobicContact CG2-CB 3.84Å; V425-L542 HydrophobicContact CG2-CD1 3.96Å; V425-L542 HydrophobicContact CG2-CD2 3.87Å; V425-L542 HydrophobicContact CG2-CG 4.03Å; A429-L542 HydrophobicContact CB-CD1 3.63Å; I519-L542 HydrophobicContact CB-CD2 4.19Å; I519-L542 HydrophobicContact CG2-CD2 3.8Å; A520-L542 HydrophobicContact CB-CD1 3.56Å; A520-L542 HydrophobicContact CB-CD2 3.86Å; A520-L542 HydrophobicContact CB-CG 4.33Å; M523-L542 HydrophobicContact CE-CB 4.39Å; M523-L542 HydrophobicContact CE-CD1 3.92Å; M523-L542 HydrophobicContact CE-CD2 3.46Å; M523-L542 VanDerWaalsContact CE-CD2 3.46Å; M523-L542 HydrophobicContact CE-CG 3.27Å; S538-L542 WeakPolarHBondContact O-CB 3.37Å; S538-L542 WeakPolarHBondContact O-CD1 3.38Å; S538-L542 WeakPolarHBondContact O-CG 3.1Å; S538-L542 PolarHBondContact O-N 3.32Å; I539-L542 PolarHBondContact O-N 3.12Å; I539-L542 VanDerWaalsContact O-N 3.17Å; L542-G546 PolarHBondContact O-N 3.49Å |
| 543 | T | 91.4 | Very high | 89.9 | Confident | 9 Ų | 9 | 14.8 Ų | 14.8 | 6% | 0.055 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -64.6 | -45.7 | 176 | 50.5 | 0 | 0 | 0 | 0 | 110.7 | N209 A426 I539 P540 G546 D547 | N209-T543 PolarHBondContact OD1-OG1 3.24Å; A426-T543 HydrophobicContact CB-CG2 4.36Å; I539-T543 HydrophobicContact CG2-CG2 4.33Å; I539-T543 WeakPolarHBondContact O-CG2 3.19Å; I539-T543 PolarHBondContact O-N 3.19Å; I539-T543 PolarHBondContact O-OG1 3.19Å; P540-T543 PolarHBondContact O-OG1 3.29Å; T543-G546 CarbonylContact O-C 3.53Å; T543-G546 VanDerWaalsContact O-CA 3.28Å; T543-G546 WeakPolarHBondContact O-CA 3.37Å; T543-G546 PolarHBondContact O-N 3.01Å; T543-D547 PolarHBondContact O-N 2.95Å |
| 544 | A | 93.4 | Very high | 90.7 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -66.2 | -39.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | A387 I390 S391 P540 G546 D547 L548 | A387-A544 HydrophobicContact CB-CB 3.84Å; A387-A544 WeakPolarHBondContact O-CB 3.46Å; I390-A544 HydrophobicContact CB-CB 3.9Å; I390-A544 HydrophobicContact CG2-CB 3.93Å; S391-A544 VanDerWaalsContact OG-CA 3.31Å; S391-A544 WeakPolarHBondContact OG-CA 3.21Å; S391-A544 WeakPolarHBondContact OG-CB 3.46Å; P540-A544 WeakPolarHBondContact O-CB 3.35Å; P540-A544 PolarHBondContact O-N 3.49Å; A544-G546 PolarHBondContact O-N 3.09Å; A544-D547 PolarHBondContact O-N 3.4Å; A544-L548 PolarHBondContact O-N 3.42Å |
| 545 | L | 94.9 | Very high | 91.3 | Very high | 41 Ų | 41 | 14.4 Ų | 14.4 | 22% | 0.215 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -62.1 | -32.9 | 169.4 | -74.9 | 173.1 | 0 | 0 | 0 | 111.3 | I390 L516 I519 Y541 L549 | I390-L545 HydrophobicContact CG2-CD2 4.22Å; L516-L545 HydrophobicContact CD2-CB 4.01Å; I519-L545 HydrophobicContact CD1-CD1 4.45Å; I519-L545 HydrophobicContact CG2-CD1 4.06Å; Y541-L545 VanDerWaalsContact O-CB 3.29Å; Y541-L545 WeakPolarHBondContact O-CB 3.48Å; Y541-L545 WeakPolarHBondContact O-CG 3.29Å; Y541-L545 PolarHBondContact O-N 3.25Å; L545-L549 VanDerWaalsContact O-CB 3.24Å; L545-L549 WeakPolarHBondContact O-CB 3.3Å; L545-L549 VanDerWaalsContact O-CG 3.25Å; L545-L549 WeakPolarHBondContact O-CG 3.37Å; L545-L549 PolarHBondContact O-N 3.45Å |
| 546 | G | 94.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 18.7 Ų | 18.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -63.4 | -44.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q512 L542 T543 A544 G550 | Q512-G546 PolarHBondContact NE2-O 3.23Å; L542-G546 PolarHBondContact O-N 3.49Å; T543-G546 CarbonylContact O-C 3.53Å; T543-G546 VanDerWaalsContact O-CA 3.28Å; T543-G546 WeakPolarHBondContact O-CA 3.37Å; T543-G546 PolarHBondContact O-N 3.01Å; A544-G546 PolarHBondContact O-N 3.09Å; G546-G550 WeakPolarHBondContact O-CA 3.16Å; G546-G550 PolarHBondContact O-N 3.13Å |
| 547 | D | 93.9 | Very high | 92.9 | Very high | 12 Ų | 12 | 18.5 Ų | 18.5 | 6% | 0.064 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -61.3 | -46.6 | 175.4 | -63.2 | -28.1 | 0 | 0 | 0 | 111.7 | P201 S391 N418 T543 A544 T551 | P201-D547 HydrophobicContact CB-CB 4.36Å; S391-D547 WeakPolarHBondContact CB-OD2 3.3Å; S391-D547 PolarHBondContact OG-OD2 3.32Å; N418-D547 PolarHBondContact ND2-O 2.87Å; N418-D547 PolarHBondContact OD1-O 2.87Å; T543-D547 PolarHBondContact O-N 2.95Å; A544-D547 PolarHBondContact O-N 3.4Å; D547-T551 WeakPolarHBondContact O-CB 3.38Å; D547-T551 PolarHBondContact O-N 2.97Å; D547-T551 VanDerWaalsContact O-N 3.12Å; D547-T551 PolarHBondContact O-OG1 3.5Å |
| 548 | L | 95.8 | Very high | 93.2 | Very high | 37 Ų | 37 | 17.5 Ų | 17.5 | 19% | 0.194 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -65 | -54.2 | -180 | 175.2 | 61 | 0 | 0 | 0 | 111.7 | I390 I393 I397 A544 A552 | I390-L548 HydrophobicContact CG2-CB 4.2Å; I390-L548 HydrophobicContact CG2-CD2 4.07Å; I393-L548 HydrophobicContact CB-CD1 4.11Å; I393-L548 HydrophobicContact CG2-CD1 3.69Å; I397-L548 HydrophobicContact CD1-CD1 3.79Å; A544-L548 PolarHBondContact O-N 3.42Å; L548-A552 VanDerWaalsContact O-CB 3.22Å; L548-A552 WeakPolarHBondContact O-CB 3.4Å; L548-A552 PolarHBondContact O-N 3.49Å |
| 549 | L | 96.9 | Very high | 93.3 | Very high | 47 Ų | 47 | 21.5 Ų | 21.5 | 25% | 0.246 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -65.8 | -41.1 | -177.7 | -70.1 | 175.5 | 0 | 0 | 0 | 111.5 | Q512 T515 L516 L545 A552 L553 | Q512-L549 HydrophobicContact CG-CB 4.17Å; T515-L549 HydrophobicContact CG2-CD1 3.96Å; L516-L549 HydrophobicContact CD2-CD1 4.13Å; L516-L549 HydrophobicContact CG-CD1 4.49Å; L545-L549 VanDerWaalsContact O-CB 3.24Å; L545-L549 WeakPolarHBondContact O-CB 3.3Å; L545-L549 VanDerWaalsContact O-CG 3.25Å; L545-L549 WeakPolarHBondContact O-CG 3.37Å; L545-L549 PolarHBondContact O-N 3.45Å; L549-A552 PolarHBondContact O-N 2.93Å; L549-L553 WeakPolarHBondContact O-CB 3.31Å; L549-L553 WeakPolarHBondContact O-CD1 3.38Å; L549-L553 WeakPolarHBondContact O-CG 3.32Å; L549-L553 PolarHBondContact O-N 3.17Å |
| 550 | G | 95.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -62 | -50.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | N418 G546 A552 L554 | N418-G550 WeakPolarHBondContact OD1-CA 3.38Å; G546-G550 WeakPolarHBondContact O-CA 3.16Å; G546-G550 PolarHBondContact O-N 3.13Å; G550-A552 PolarHBondContact O-N 3.35Å; G550-L554 WeakPolarHBondContact O-CB 3.29Å; G550-L554 PolarHBondContact O-N 2.93Å |
| 551 | T | 95.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -63.1 | -43.9 | 177.9 | -46.5 | 0 | 0 | 0 | 0 | 111.8 | G394 I397 L398 T414 N418 D547 L554 A555 | G394-T551 WeakPolarHBondContact O-CG2 3.37Å; I397-T551 HydrophobicContact CB-CG2 4.23Å; I397-T551 HydrophobicContact CG2-CG2 4.12Å; L398-T551 HydrophobicContact CB-CG2 3.8Å; T414-T551 HydrophobicContact CG2-CG2 4.28Å; N418-T551 PolarHBondContact ND2-OG1 2.9Å; N418-T551 PolarHBondContact OD1-N 3.22Å; D547-T551 WeakPolarHBondContact O-CB 3.38Å; D547-T551 PolarHBondContact O-N 2.97Å; D547-T551 VanDerWaalsContact O-N 3.12Å; D547-T551 PolarHBondContact O-OG1 3.5Å; T551-L554 PolarHBondContact O-N 3.39Å; T551-A555 WeakPolarHBondContact O-CB 3.39Å; T551-A555 PolarHBondContact O-N 3.08Å |
| 552 | A | 96.6 | Very high | 93 | Very high | 23 Ų | 23 | 31.3 Ų | 31.3 | 19% | 0.19 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.1 | -46.6 | -180 | 0 | 0 | 0 | 0 | 0 | 113 | I397 L548 L549 G550 L554 A555 M556 | I397-A552 HydrophobicContact CD1-CB 3.84Å; L548-A552 VanDerWaalsContact O-CB 3.22Å; L548-A552 WeakPolarHBondContact O-CB 3.4Å; L548-A552 PolarHBondContact O-N 3.49Å; L549-A552 PolarHBondContact O-N 2.93Å; G550-A552 PolarHBondContact O-N 3.35Å; A552-L554 VanDerWaalsContact C-N 3.32Å; A552-A555 PolarHBondContact O-N 3.46Å; A552-M556 WeakPolarHBondContact O-CG 3.41Å; A552-M556 PolarHBondContact O-N 3.38Å |
| 553 | L | 97 | Very high | 92.7 | Very high | 29 Ų | 29 | 37.4 Ų | 37.4 | 15% | 0.152 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.2 | -39.2 | 178.7 | -72.2 | 170 | 0 | 0 | 0 | 111.3 | A508 L511 Q512 L549 M556 G557 | A508-L553 HydrophobicContact CB-CB 4.14Å; L511-L553 HydrophobicContact CB-CD1 4.36Å; L511-L553 HydrophobicContact CD2-CD1 4.49Å; L511-L553 HydrophobicContact CD2-CD2 3.68Å; L511-L553 HydrophobicContact CG-CD1 4.26Å; L511-L553 HydrophobicContact CG-CD2 4.32Å; Q512-L553 HydrophobicContact CB-CD1 3.72Å; Q512-L553 HydrophobicContact CG-CD1 4.46Å; L549-L553 WeakPolarHBondContact O-CB 3.31Å; L549-L553 WeakPolarHBondContact O-CD1 3.38Å; L549-L553 WeakPolarHBondContact O-CG 3.32Å; L549-L553 PolarHBondContact O-N 3.17Å; L553-M556 HydrophobicContact CD2-CE 3.71Å; L553-M556 HydrophobicContact CG-CE 4.41Å; L553-G557 PolarHBondContact O-N 2.92Å |
| 554 | L | 94.6 | Very high | 92.5 | Very high | 3 Ų | 3 | 40.9 Ų | 40.9 | 2% | 0.016 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.5 | -46.7 | 176.3 | -172.2 | 65.4 | 0 | 0 | 0 | 111.3 | I410 I417 Y505 G550 T551 A552 M556 G557 F558 | I410-L554 HydrophobicContact CD1-CB 4.35Å; I410-L554 HydrophobicContact CD1-CD2 4.15Å; I410-L554 HydrophobicContact CD1-CG 4Å; I410-L554 HydrophobicContact CG1-CD2 3.51Å; I410-L554 HydrophobicContact CG1-CG 3.73Å; I417-L554 HydrophobicContact CD1-CB 4.3Å; I417-L554 HydrophobicContact CD1-CD1 4.42Å; I417-L554 HydrophobicContact CG2-CD2 4.2Å; Y505-L554 HydrophobicContact CD2-CD1 3.69Å; Y505-L554 HydrophobicContact CE2-CD1 3.96Å; G550-L554 WeakPolarHBondContact O-CB 3.29Å; G550-L554 PolarHBondContact O-N 2.93Å; T551-L554 PolarHBondContact O-N 3.39Å; A552-L554 VanDerWaalsContact C-N 3.32Å; L554-M556 PolarHBondContact O-N 3.41Å; L554-G557 WeakPolarHBondContact O-CA 3.16Å; L554-G557 PolarHBondContact O-N 3.46Å; L554-G557 VanDerWaalsContact O-N 3.07Å; L554-F558 HydrophobicContact CD1-CD2 4.01Å; L554-F558 HydrophobicContact CD1-CE2 3.79Å; L554-F558 HydrophobicContact CG-CD2 4.09Å; L554-F558 HydrophobicContact CG-CE2 4.1Å; L554-F558 WeakPolarHBondContact O-CD2 3.34Å; L554-F558 PolarHBondContact O-N 2.93Å |
| 555 | A | 93.6 | Very high | 91.6 | Very high | 6 Ų | 6 | 43 Ų | 43 | 5% | 0.05 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.9 | -44.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | I397 T401 I410 T551 A552 G557 F558 H559 | I397-A555 HydrophobicContact CG2-CB 4Å; T401-A555 HydrophobicContact CG2-CB 4.13Å; T401-A555 WeakPolarHBondContact OG1-CB 3.14Å; I410-A555 HydrophobicContact CD1-CB 3.89Å; T551-A555 WeakPolarHBondContact O-CB 3.39Å; T551-A555 PolarHBondContact O-N 3.08Å; A552-A555 PolarHBondContact O-N 3.46Å; A555-G557 VanDerWaalsContact C-N 3.31Å; A555-G557 PolarHBondContact O-N 2.88Å; A555-F558 PolarHBondContact O-N 3.06Å; A555-H559 PolarHBondContact O-CD2 3.01Å; A555-H559 VanDerWaalsContact O-CD2 3.25Å; A555-H559 PolarHBondContact O-N 3.16Å |
| 556 | M | 93.9 | Very high | 90.4 | Very high | 115 Ų | 115 | 43 Ų | 43 | 57% | 0.567 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -62.1 | -38.3 | 173.8 | -73.4 | -172 | -65.9 | 0 | 0 | 112.5 | A552 L553 L554 H559 F560 | A552-M556 WeakPolarHBondContact O-CG 3.41Å; A552-M556 PolarHBondContact O-N 3.38Å; L553-M556 HydrophobicContact CD2-CE 3.71Å; L553-M556 HydrophobicContact CG-CE 4.41Å; L554-M556 PolarHBondContact O-N 3.41Å; M556-H559 PolarHBondContact O-N 2.91Å; M556-F560 WeakPolarHBondContact O-CB 3.41Å; M556-F560 PolarHBondContact O-N 3.06Å |
| 557 | G | 92.1 | Very high | 88.9 | Confident | 11 Ų | 11 | 52 Ų | 52 | 11% | 0.113 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L553 L554 A555 F560 L561 | L553-G557 PolarHBondContact O-N 2.92Å; L554-G557 WeakPolarHBondContact O-CA 3.16Å; L554-G557 PolarHBondContact O-N 3.46Å; L554-G557 VanDerWaalsContact O-N 3.07Å; A555-G557 VanDerWaalsContact C-N 3.31Å; A555-G557 PolarHBondContact O-N 2.88Å; G557-F560 WeakPolarHBondContact O-CB 3.26Å; G557-F560 PolarHBondContact O-N 3.08Å; G557-L561 VanDerWaalsContact O-CG 3.29Å; G557-L561 WeakPolarHBondContact O-CG 3.21Å; G557-L561 PolarHBondContact O-N 3.33Å |
| 558 | F | 89.9 | Confident | 87 | Confident | 6 Ų | 6 | 53.1 Ų | 53.1 | 3% | 0.026 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.1 | -44 | 176 | -92.1 | -98.7 | 0 | 0 | 0 | 112.3 | L407 I410 Y413 T495 F501 L554 A555 F560 L561 W562 | L407-F558 HydrophobicContact CD2-CB 4.03Å; I410-F558 HydrophobicContact CB-CD2 4.35Å; I410-F558 HydrophobicContact CB-CE2 4.3Å; I410-F558 HydrophobicContact CB-CG 4.5Å; I410-F558 HydrophobicContact CB-CZ 4.39Å; I410-F558 HydrophobicContact CG1-CD2 4.22Å; I410-F558 HydrophobicContact CG1-CE2 4.29Å; Y413-F558 HydrophobicContact CD2-CE2 4.1Å; Y413-F558 AromaticContact CD2-CZ 3.77Å; Y413-F558 HydrophobicContact CD2-CZ 3.77Å; Y413-F558 AromaticContact CE2-CZ 3.96Å; Y413-F558 HydrophobicContact CE2-CZ 3.96Å; T495-F558 HydrophobicContact CG2-CE1 3.71Å; T495-F558 HydrophobicContact CG2-CZ 4.03Å; F501-F558 HydrophobicContact CE2-CE1 4.28Å; F501-F558 AromaticContact CE2-CE2 3.83Å; F501-F558 HydrophobicContact CE2-CE2 3.83Å; F501-F558 AromaticContact CE2-CZ 3.6Å; F501-F558 HydrophobicContact CE2-CZ 3.6Å; F501-F558 HydrophobicContact CZ-CE2 4.35Å; F501-F558 HydrophobicContact CZ-CZ 4.18Å; L554-F558 HydrophobicContact CD1-CD2 4.01Å; L554-F558 HydrophobicContact CD1-CE2 3.79Å; L554-F558 HydrophobicContact CG-CD2 4.09Å; L554-F558 HydrophobicContact CG-CE2 4.1Å; L554-F558 WeakPolarHBondContact O-CD2 3.34Å; L554-F558 PolarHBondContact O-N 2.93Å; A555-F558 PolarHBondContact O-N 3.06Å; F558-F560 VanDerWaalsContact C-N 3.3Å; F558-F560 PolarHBondContact O-N 2.98Å; F558-L561 PolarHBondContact O-N 2.94Å; F558-W562 WeakPolarHBondContact O-CB 3.25Å; F558-W562 PolarHBondContact O-N 3.49Å |
| 559 | H | 89.8 | Confident | 84.6 | Confident | 84 Ų | 84 | 54.5 Ų | 54.5 | 39% | 0.389 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.8 | -40.8 | 172.4 | -82.3 | -62.1 | 0 | 0 | 0 | 112.4 | L407 A555 M556 W562 L563 | L407-H559 WeakPolarHBondContact CD1-CE1 3.34Å; A555-H559 PolarHBondContact O-CD2 3.01Å; A555-H559 VanDerWaalsContact O-CD2 3.25Å; A555-H559 PolarHBondContact O-N 3.16Å; M556-H559 PolarHBondContact O-N 2.91Å; H559-W562 PolarHBondContact O-N 2.96Å; H559-L563 VanDerWaalsContact O-CG 3.3Å; H559-L563 WeakPolarHBondContact O-CG 3.15Å; H559-L563 PolarHBondContact O-N 2.98Å |
| 560 | F | 90.4 | Very high | 82.1 | Confident | 106 Ų | 106 | 58.5 Ų | 58.5 | 47% | 0.465 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.2 | -45.8 | 176.4 | 173.6 | -101.6 | 0 | 0 | 0 | 112 | V504 M556 G557 F558 W562 L563 I564 | V504-F560 HydrophobicContact CG1-CD1 4.48Å; V504-F560 HydrophobicContact CG2-CD1 3.89Å; V504-F560 HydrophobicContact CG2-CE1 3.95Å; M556-F560 WeakPolarHBondContact O-CB 3.41Å; M556-F560 PolarHBondContact O-N 3.06Å; G557-F560 WeakPolarHBondContact O-CB 3.26Å; G557-F560 PolarHBondContact O-N 3.08Å; F558-F560 VanDerWaalsContact C-N 3.3Å; F558-F560 PolarHBondContact O-N 2.98Å; F560-W562 VanDerWaalsContact C-N 3.31Å; F560-W562 PolarHBondContact O-N 3.31Å; F560-L563 PolarHBondContact O-N 3.28Å; F560-I564 HydrophobicContact CD1-CD1 4.28Å; F560-I564 HydrophobicContact CD2-CG2 4.45Å; F560-I564 HydrophobicContact CE1-CD1 3.8Å; F560-I564 HydrophobicContact CE1-CG2 4.34Å; F560-I564 HydrophobicContact CE2-CG2 3.93Å; F560-I564 HydrophobicContact CZ-CD1 4.27Å; F560-I564 HydrophobicContact CZ-CG2 3.87Å; F560-I564 WeakPolarHBondContact O-CG1 3.25Å; F560-I564 PolarHBondContact O-N 3.16Å; F560-I564 VanDerWaalsContact O-N 3.1Å |
| 561 | L | 87.8 | Confident | 79.4 | Confident | 11 Ų | 11 | 63 Ų | 63 | 6% | 0.058 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.4 | -42.7 | 176.5 | -72.3 | 163.6 | 0 | 0 | 0 | 111.8 | I500 F501 V504 G557 F558 L563 I564 G565 D566 | I500-L561 HydrophobicContact CG2-CD2 3.78Å; F501-L561 HydrophobicContact CB-CD1 4.48Å; F501-L561 HydrophobicContact CD2-CD1 3.57Å; F501-L561 HydrophobicContact CE2-CD1 4.21Å; F501-L561 HydrophobicContact CG-CD1 4.44Å; V504-L561 HydrophobicContact CB-CD1 4.37Å; V504-L561 HydrophobicContact CB-CD2 4.27Å; V504-L561 HydrophobicContact CB-CG 4.34Å; V504-L561 HydrophobicContact CG1-CD1 4.24Å; V504-L561 HydrophobicContact CG1-CG 4.24Å; V504-L561 HydrophobicContact CG2-CD2 3.92Å; V504-L561 HydrophobicContact CG2-CG 4.29Å; G557-L561 VanDerWaalsContact O-CG 3.29Å; G557-L561 WeakPolarHBondContact O-CG 3.21Å; G557-L561 PolarHBondContact O-N 3.33Å; F558-L561 PolarHBondContact O-N 2.94Å; L561-L563 PolarHBondContact O-N 3.37Å; L561-I564 HydrophobicContact CD2-CD1 4.28Å; L561-I564 WeakPolarHBondContact O-CG1 3.1Å; L561-I564 PolarHBondContact O-N 2.76Å; L561-G565 PolarHBondContact O-N 3.4Å; L561-D566 HydrophobicContact CD2-CB 4.31Å; L561-D566 PolarHBondContact O-N 3.38Å |
| 562 | W | 84.1 | Confident | 76.6 | Confident | 118 Ų | 118 | 66 Ų | 66 | 45% | 0.447 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.7 | -43.6 | 174.8 | -177.3 | 84.9 | 0 | 0 | 0 | 112.2 | L407 F558 H559 F560 I564 G565 | L407-W562 HydrophobicContact CD2-CB 4.37Å; F558-W562 WeakPolarHBondContact O-CB 3.25Å; F558-W562 PolarHBondContact O-N 3.49Å; H559-W562 PolarHBondContact O-N 2.96Å; F560-W562 VanDerWaalsContact C-N 3.31Å; F560-W562 PolarHBondContact O-N 3.31Å; W562-I564 PolarHBondContact O-N 2.84Å; W562-G565 PolarHBondContact O-N 2.9Å |
| 563 | L | 86.6 | Confident | 73.5 | Confident | 128 Ų | 128 | 76.5 Ų | 76.5 | 67% | 0.67 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -64.9 | -36.1 | 179.2 | -73.9 | 171.6 | 0 | 0 | 0 | 113.5 | H559 F560 L561 G565 | H559-L563 VanDerWaalsContact O-CG 3.3Å; H559-L563 WeakPolarHBondContact O-CG 3.15Å; H559-L563 PolarHBondContact O-N 2.98Å; F560-L563 PolarHBondContact O-N 3.28Å; L561-L563 PolarHBondContact O-N 3.37Å; L563-G565 PolarHBondContact O-N 3.39Å |
| 564 | I | 86.9 | Confident | 72.3 | Confident | 81 Ų | 81 | 78.9 Ų | 78.9 | 42% | 0.415 | 44% | 0.435 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | -0.5 | 179.2 | 63.9 | 176.3 | 0 | 0 | 0 | 113.2 | I500 F560 L561 W562 D566 | I500-I564 HydrophobicContact CG2-CD1 3.68Å; F560-I564 HydrophobicContact CD1-CD1 4.28Å; F560-I564 HydrophobicContact CD2-CG2 4.45Å; F560-I564 HydrophobicContact CE1-CD1 3.8Å; F560-I564 HydrophobicContact CE1-CG2 4.34Å; F560-I564 HydrophobicContact CE2-CG2 3.93Å; F560-I564 HydrophobicContact CZ-CD1 4.27Å; F560-I564 HydrophobicContact CZ-CG2 3.87Å; F560-I564 WeakPolarHBondContact O-CG1 3.25Å; F560-I564 PolarHBondContact O-N 3.16Å; F560-I564 VanDerWaalsContact O-N 3.1Å; L561-I564 HydrophobicContact CD2-CD1 4.28Å; L561-I564 WeakPolarHBondContact O-CG1 3.1Å; L561-I564 PolarHBondContact O-N 2.76Å; W562-I564 PolarHBondContact O-N 2.84Å; I564-D566 VanDerWaalsContact C-N 3.32Å; I564-D566 HydrophobicContact CG1-CB 4.33Å |
| 565 | G | 74.2 | Confident | 71.1 | Confident | 46 Ų | 46 | 82.8 Ų | 82.8 | 47% | 0.474 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 77.3 | 16 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | L561 W562 L563 R567 | L561-G565 PolarHBondContact O-N 3.4Å; W562-G565 PolarHBondContact O-N 2.9Å; L563-G565 PolarHBondContact O-N 3.39Å; G565-R567 PolarHBondContact O-N 3.5Å |
| 566 | D | 69.7 | Low | 69.9 | Low | 39 Ų | 39 | 87.1 Ų | 87.1 | 21% | 0.209 | 48% | 0.48 | C | S | . | . | trans | -75.6 | 67.1 | 162.6 | -161.8 | 26.7 | 0 | 0 | 0 | 107.3 | T498 L561 I564 D568 | T498-D566 WeakPolarHBondContact CG2-OD1 3.42Å; T498-D566 PolarHBondContact OG1-OD2 3.45Å; L561-D566 HydrophobicContact CD2-CB 4.31Å; L561-D566 PolarHBondContact O-N 3.38Å; I564-D566 VanDerWaalsContact C-N 3.32Å; I564-D566 HydrophobicContact CG1-CB 4.33Å; D566-D568 PolarHBondContact O-N 2.77Å | ||
| 567 | R | 61.9 | Low | 68.5 | Low | 191 Ų | 191 | 85.5 Ų | 85.5 | 72% | 0.721 | 48% | 0.475 | S | S | * | . | trans | -70.5 | 125.2 | -177.9 | -65.9 | -179.7 | 177.4 | 173.8 | -1.3 | 106.7 | G565 G569 | G565-R567 PolarHBondContact O-N 3.5Å; R567-G569 PolarHBondContact O-N 3.34Å | ||
| 568 | D | 54.8 | Low | 67 | Low | 35 Ų | 35 | 90.1 Ų | 90.1 | 19% | 0.187 | 50% | 0.497 | C | S | . | . | trans | -49.6 | 110.3 | 167.1 | -79.2 | -42.7 | 0 | 0 | 0 | 108.7 | T495 S496 D566 D570 V571 | T495-D568 VanDerWaalsContact CA-OD1 3.29Å; T495-D568 WeakPolarHBondContact CA-OD1 3.46Å; T495-D568 WeakPolarHBondContact CB-OD1 3.35Å; T495-D568 WeakPolarHBondContact CG2-OD1 3.36Å; T495-D568 WeakPolarHBondContact CG2-OD2 3.47Å; S496-D568 PolarHBondContact N-OD1 3.4Å; D566-D568 PolarHBondContact O-N 2.77Å; D568-D570 PolarHBondContact O-N 3.4Å; D568-V571 HydrophobicContact CB-CG2 4.39Å | ||
| 569 | G | 44.6 | Very low | 65.4 | Low | 65 Ų | 65 | 95.7 Ų | 95.7 | 67% | 0.67 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | 20.4 | -170 | 0 | 0 | 0 | 0 | 0 | 114.7 | R567 | R567-G569 PolarHBondContact O-N 3.34Š|
| 570 | D | 44.4 | Very low | 63.7 | Low | 131 Ų | 131 | 96.6 Ų | 96.6 | 70% | 0.701 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -141.2 | 23.7 | -174 | -105.1 | -12.1 | 0 | 0 | 0 | 114.1 | D568 | D568-D570 PolarHBondContact O-N 3.4Š|
| 571 | V | 38.8 | Very low | 61.7 | Low | 96 Ų | 96 | 95.8 Ų | 95.8 | 58% | 0.582 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -102 | 64.3 | 164.4 | -145.7 | 0 | 0 | 0 | 0 | 109.7 | D568 | D568-V571 HydrophobicContact CB-CG2 4.39Š|
| 572 | G | 37.2 | Very low | 59.5 | Low | 63 Ų | 63 | 102.9 Ų | 102.9 | 65% | 0.649 | 59% | 0.585 | S | S | * | * | trans | 146.3 | 77.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 573 | D | 30.7 | Very low | 57.2 | Low | 242 Ų | 242 | 101.5 Ų | 101.5 | 100% | 1.294 | 60% | 0.597 | S | S | * | * | trans | -154.6 | 0 | 135.5 | -90.6 | -24.7 | 0 | 0 | 0 | 110.4 |
Retrieved 573 of 573 residues in 712.8 ms
(Link to these results)