| 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 | 47.2 | Very low | 37.6 | Very low | 159 Ų | 159 | 103.5 Ų | 103.5 | 78% | 0.783 | 53% | 0.528 | S | S | * | . | 0 | -8 | 0 | -151.8 | 167 | -171.1 | 0 | 0 | 113 | V391 | M1-V391 WeakPolarHBondContact O-CG2 3.15Å; M1-V391 PolarHBondContact O-N 2.92Å | |||
| 2 | Y | 42.3 | Very low | 36.7 | Very low | 103 Ų | 103 | 108.8 Ų | 108.8 | 40% | 0.404 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.9 | 150.5 | 171 | -64 | -92.3 | 0 | 0 | 0 | 109.1 | Y388 V389 H390 A397 P398 | Y2-Y388 VanDerWaalsContact CB-CD1 3.47Å; Y2-V389 WeakPolarHBondContact CA-O 3.29Å; Y2-H390 HydrophobicContact CD1-CB 4.22Å; Y2-H390 HydrophobicContact CE1-CB 3.92Å; Y2-H390 AromaticContact CE1-CD2 3.98Å; Y2-H390 AromaticContact CZ-CD2 3.94Å; Y2-A397 HydrophobicContact CE1-CB 4.37Å; Y2-P398 HydrophobicContact CE1-CG 4.3Å |
| 3 | Q | 39.9 | Very low | 36 | Very low | 99 Ų | 99 | 112.7 Ų | 112.7 | 46% | 0.463 | 57% | 0.569 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -120.1 | 137.1 | 177.7 | -120.9 | 171.1 | -21.7 | 0 | 0 | 109.7 | V389 V391 | Q3-V389 PolarHBondContact N-O 3.16Å; Q3-V389 VanDerWaalsContact N-O 3.17Å; Q3-V389 PolarHBondContact O-N 3.15Å; Q3-V391 HydrophobicContact CB-CG2 4.11Å; Q3-V391 HydrophobicContact CG-CG2 4.48Å |
| 4 | H | 40.4 | Very low | 35.3 | Very low | 64 Ų | 64 | 115.3 Ų | 115.3 | 30% | 0.296 | 58% | 0.578 | S | S | . | * | trans | -78.8 | 127.2 | 172.2 | -171.6 | -83.3 | 0 | 0 | 0 | 109.1 | S387 Y388 | H4-S387 PolarHBondContact CD2-OG 2.97Å; H4-S387 PolarHBondContact NE2-OG 2.77Å; H4-Y388 HydrophobicContact CB-CE1 4.38Å | ||
| 5 | V | 49.6 | Very low | 35.1 | Very low | 9 Ų | 9 | 114.1 Ų | 114.1 | 6% | 0.055 | 59% | 0.593 | C | S | . | * | trans | -90.5 | 110.5 | 173.6 | 178.1 | 0 | 0 | 0 | 0 | 106.9 | V69 F374 | V5-V69 HydrophobicContact CG2-CB 4.32Å; V5-F374 HydrophobicContact CB-CE2 4.18Å; V5-F374 HydrophobicContact CB-CZ 4.05Å; V5-F374 HydrophobicContact CG1-CZ 4.2Å; V5-F374 HydrophobicContact CG2-CE2 4.01Å; V5-F374 HydrophobicContact CG2-CZ 3.94Å | ||
| 6 | Q | 32.5 | Very low | 34.5 | Very low | 137 Ų | 137 | 115.4 Ų | 115.4 | 64% | 0.64 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 144 | 177.5 | -72.9 | -87.7 | -27.2 | 0 | 0 | 110.3 | ||
| 7 | P | 36.8 | Very low | 34.3 | Very low | 51 Ų | 51 | 112.6 Ų | 112.6 | 33% | 0.331 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -59.4 | 146 | 172 | 23.8 | -30.6 | 0 | 0 | 0 | 110.4 | N9 R378 | P7-N9 PolarHBondContact O-N 2.97Å; P7-R378 HydrophobicContact CB-CG 4.24Å |
| 8 | N | 36.7 | Very low | 33.9 | Very low | 114 Ų | 114 | 116.1 Ų | 116.1 | 61% | 0.61 | 62% | 0.618 | S | S | * | * | P | Polyproline II helix | trans | -68 | 119.5 | 179.6 | -152.9 | 18.6 | 0 | 0 | 0 | 107.5 | T10 | N8-T10 PolarHBondContact O-N 3.44Å; N8-T10 PolarHBondContact O-OG1 3.18Å |
| 9 | N | 28.6 | Very low | 33.5 | Very low | 159 Ų | 159 | 117.7 Ų | 117.7 | 85% | 0.85 | 63% | 0.627 | S | S | * | * | trans | -76.1 | 67.1 | 173.3 | -135.4 | 18.6 | 0 | 0 | 0 | 108.1 | P7 N11 | P7-N9 PolarHBondContact O-N 2.97Å; N9-N11 PolarHBondContact O-N 2.99Å | ||
| 10 | T | 32.3 | Very low | 33.1 | Very low | 94 Ų | 94 | 118.4 Ų | 118.4 | 58% | 0.577 | 64% | 0.636 | S | S | * | * | trans | -68.5 | 114.7 | 165.1 | 1 | 0 | 0 | 0 | 0 | 105.9 | N8 H12 | N8-T10 PolarHBondContact O-N 3.44Å; N8-T10 PolarHBondContact O-OG1 3.18Å; T10-H12 VanDerWaalsContact C-N 3.33Å; T10-H12 PolarHBondContact O-N 3.31Å | ||
| 11 | N | 27.5 | Very low | 32.9 | Very low | 150 Ų | 150 | 118.4 Ų | 118.4 | 80% | 0.802 | 64% | 0.642 | S | S | * | * | trans | -48.8 | 95.3 | 175.1 | -76.4 | -29.3 | 0 | 0 | 0 | 110.3 | N9 I13 | N9-N11 PolarHBondContact O-N 2.99Å; N11-I13 VanDerWaalsContact C-N 3.33Å; N11-I13 PolarHBondContact O-N 3.3Å | ||
| 12 | H | 26.9 | Very low | 31.8 | Very low | 167 Ų | 167 | 116.9 Ų | 116.9 | 77% | 0.773 | 64% | 0.642 | S | S | * | * | trans | -64.4 | 102.2 | 156.5 | -79.2 | -75.1 | 0 | 0 | 0 | 105.7 | T10 H14 | T10-H12 VanDerWaalsContact C-N 3.33Å; T10-H12 PolarHBondContact O-N 3.31Å; H12-H14 PolarHBondContact O-N 2.92Å | ||
| 13 | I | 27.8 | Very low | 31 | Very low | 159 Ų | 159 | 121.3 Ų | 121.3 | 82% | 0.815 | 66% | 0.663 | S | S | * | * | trans | -64.6 | 90 | 167.4 | -60.7 | 175.8 | 0 | 0 | 0 | 105.9 | N11 A15 | N11-I13 VanDerWaalsContact C-N 3.33Å; N11-I13 PolarHBondContact O-N 3.3Å; I13-A15 PolarHBondContact O-N 3.3Å; I13-A15 VanDerWaalsContact O-N 3.12Å | ||
| 14 | H | 25.9 | Very low | 30.3 | Very low | 149 Ų | 149 | 122.4 Ų | 122.4 | 69% | 0.69 | 68% | 0.677 | S | S | * | * | trans | -63.8 | 105.7 | 161.5 | -97.6 | -86.1 | 0 | 0 | 0 | 107 | H12 N16 | H12-H14 PolarHBondContact O-N 2.92Å; H14-N16 PolarHBondContact O-N 3.13Å | ||
| 15 | A | 31.7 | Very low | 29.6 | Very low | 98 Ų | 98 | 125.6 Ų | 125.6 | 81% | 0.81 | 70% | 0.701 | S | S | * | * | trans | -68.2 | 79.8 | 162 | 0 | 0 | 0 | 0 | 0 | 108.4 | I13 | I13-A15 PolarHBondContact O-N 3.3Å; I13-A15 VanDerWaalsContact O-N 3.12Å | ||
| 16 | N | 25.9 | Very low | 28.4 | Very low | 134 Ų | 134 | 129.5 Ų | 129.5 | 72% | 0.717 | 73% | 0.729 | S | S | * | * | trans | -95.2 | 112.8 | 165.3 | -87.3 | -4.2 | 0 | 0 | 0 | 108.2 | H14 | H14-N16 PolarHBondContact O-N 3.13Š| ||
| 17 | G | 31.8 | Very low | 28.1 | Very low | 68 Ų | 68 | 130.7 Ų | 130.7 | 70% | 0.701 | 74% | 0.739 | S | S | * | * | trans | -62.3 | 135.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 18 | H | 26.9 | Very low | 27.6 | Very low | 175 Ų | 175 | 131.4 Ų | 131.4 | 81% | 0.81 | 76% | 0.756 | S | S | * | * | trans | -147.7 | 114.1 | 153.4 | -95.3 | -50.5 | 0 | 0 | 0 | 110.4 | ||||
| 19 | N | 26.5 | Very low | 27.2 | Very low | 147 Ų | 147 | 132.3 Ų | 132.3 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | trans | 39.8 | 101 | 140.6 | -64.4 | -13.5 | 0 | 0 | 0 | 118.3 | ||||
| 20 | V | 25.3 | Very low | 27 | Very low | 132 Ų | 132 | 132.8 Ų | 132.8 | 80% | 0.8 | 77% | 0.765 | S | S | * | * | trans | -62.8 | 136.2 | 152.3 | 177 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 21 | P | 27.7 | Very low | 26.6 | Very low | 119 Ų | 119 | 133.5 Ų | 133.5 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | trans | -110.6 | 124.6 | 141.7 | 26 | -11.6 | 0 | 0 | 0 | 109.6 | ||||
| 22 | T | 25.9 | Very low | 26.5 | Very low | 126 Ų | 126 | 130.5 Ų | 130.5 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | trans | -53.2 | 138.6 | 167 | 30.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 23 | K | 25.3 | Very low | 26.5 | Very low | 196 Ų | 196 | 130.5 Ų | 130.5 | 85% | 0.852 | 78% | 0.775 | S | S | * | * | trans | -162.5 | 98.1 | 140.1 | -107 | 170.7 | -171 | -174.6 | 0 | 111 | ||||
| 24 | T | 24.2 | Very low | 26.3 | Very low | 123 Ų | 123 | 126.4 Ų | 126.4 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | trans | 13.8 | 122.2 | 132.1 | 16.1 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 25 | T | 26 | Very low | 26.3 | Very low | 130 Ų | 130 | 124.3 Ų | 124.3 | 80% | 0.798 | 77% | 0.774 | S | S | * | * | 167.6 | 102.2 | 115.1 | 23.3 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 26 | S | 23.9 | Very low | 26.1 | Very low | 92 Ų | 92 | 128.2 Ų | 128.2 | 64% | 0.643 | 78% | 0.78 | S | S | * | * | 71.3 | 124.5 | 89.9 | 83.3 | 0 | 0 | 0 | 0 | 115 | |||||
| 27 | N | 26.4 | Very low | 26.1 | Very low | 161 Ų | 161 | 124.9 Ų | 124.9 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | trans | 89.5 | 115.7 | 152.5 | -61.2 | -7.8 | 0 | 0 | 0 | 118.7 | ||||
| 28 | G | 26.7 | Very low | 25.8 | Very low | 67 Ų | 67 | 127.9 Ų | 127.9 | 69% | 0.691 | 78% | 0.782 | S | S | * | * | 133.3 | 85.1 | 117.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 29 | T | 27.1 | Very low | 25.8 | Very low | 133 Ų | 133 | 128.7 Ų | 128.7 | 82% | 0.816 | 79% | 0.786 | S | S | * | * | 62 | 107.2 | 123.5 | -34.8 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 30 | M | 24.6 | Very low | 25.7 | Very low | 169 Ų | 169 | 125.1 Ų | 125.1 | 83% | 0.833 | 78% | 0.784 | S | S | * | * | 45.7 | 129.6 | 126.9 | -82.5 | -176.6 | 156.6 | 0 | 0 | 123 | |||||
| 31 | C | 24.5 | Very low | 26.7 | Very low | 108 Ų | 108 | 124.8 Ų | 124.8 | 73% | 0.73 | 79% | 0.785 | S | S | * | * | 81.3 | 115.8 | 125.6 | -68.1 | 0 | 0 | 0 | 0 | 122.1 | |||||
| 32 | A | 26.3 | Very low | 26.7 | Very low | 87 Ų | 87 | 128.7 Ų | 128.7 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | 84.9 | 122.9 | 114.4 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 33 | N | 26.1 | Very low | 26.9 | Very low | 168 Ų | 168 | 127.1 Ų | 127.1 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | trans | 72.7 | 132.4 | 131.4 | -82.7 | 0.9 | 0 | 0 | 0 | 123.6 | ||||
| 34 | G | 24.8 | Very low | 27.3 | Very low | 72 Ų | 72 | 123.5 Ų | 123.5 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | trans | 82.2 | 146.4 | 142.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 35 | S | 25.5 | Very low | 27.4 | Very low | 106 Ų | 106 | 126.1 Ų | 126.1 | 74% | 0.741 | 79% | 0.792 | S | S | * | * | cis | 174.6 | 145.6 | 1.2 | 36.5 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 36 | L | 26 | Very low | 27.5 | Very low | 180 Ų | 180 | 125.4 Ų | 125.4 | 94% | 0.942 | 79% | 0.788 | S | S | * | * | trans | 51.5 | 138.5 | 148.4 | -86.2 | 86.4 | 0 | 0 | 0 | 122.9 | ||||
| 37 | G | 26.1 | Very low | 27.5 | Very low | 63 Ų | 63 | 128 Ų | 128 | 65% | 0.649 | 80% | 0.795 | S | S | * | * | trans | 141.7 | 82.7 | 152.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 38 | T | 27 | Very low | 27.6 | Very low | 131 Ų | 131 | 126 Ų | 126 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | 49.3 | 112.9 | 98.4 | 55.4 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 39 | E | 26.6 | Very low | 27.6 | Very low | 192 Ų | 192 | 128.8 Ų | 128.8 | 90% | 0.897 | 80% | 0.803 | S | S | * | * | 157.9 | 122.2 | 126.7 | -85.4 | 177.5 | 175.5 | 0 | 0 | 109.8 | |||||
| 40 | G | 24.1 | Very low | 27.6 | Very low | 73 Ų | 73 | 126.1 Ų | 126.1 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | trans | -93.1 | -152.7 | 159.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 41 | P | 45.6 | Very low | 28 | Very low | 125 Ų | 125 | 125.6 Ų | 125.6 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | cis | -125.2 | 158.6 | -35.9 | 36.5 | -23.1 | 0 | 0 | 0 | 110.2 | ||||
| 42 | E | 27.2 | Very low | 28.2 | Very low | 201 Ų | 201 | 124.1 Ų | 124.1 | 94% | 0.939 | 81% | 0.811 | S | S | * | * | trans | -157.2 | 120.1 | 160.9 | -120.1 | 168 | -164.6 | 0 | 0 | 112.1 | ||||
| 43 | A | 30.3 | Very low | 28.3 | Very low | 92 Ų | 92 | 131.9 Ų | 131.9 | 76% | 0.76 | 82% | 0.821 | S | S | * | * | trans | -112.8 | 154.7 | 160.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 44 | P | 34.5 | Very low | 28.5 | Very low | 121 Ų | 121 | 132.4 Ų | 132.4 | 79% | 0.786 | 82% | 0.821 | S | S | * | * | -137.4 | 138.9 | 129.5 | 26.7 | -8.8 | 0 | 0 | 0 | 114.3 | |||||
| 45 | E | 26.9 | Very low | 28.7 | Very low | 177 Ų | 177 | 140.4 Ų | 140.4 | 83% | 0.827 | 83% | 0.829 | S | S | * | * | trans | 2.1 | 146.9 | 131.7 | -75.2 | 178.9 | 175.5 | 0 | 0 | 117.9 | ||||
| 46 | T | 27.2 | Very low | 28.8 | Very low | 115 Ų | 115 | 145.1 Ų | 145.1 | 71% | 0.706 | 84% | 0.836 | S | S | * | * | cis | -174.6 | 160 | 36.6 | 17.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 47 | D | 25 | Very low | 29 | Very low | 147 Ų | 147 | 142.3 Ų | 142.3 | 79% | 0.786 | 83% | 0.828 | S | S | * | * | trans | 54.8 | 123 | 146.7 | -71.4 | -11.9 | 0 | 0 | 0 | 124.7 | ||||
| 48 | S | 27.8 | Very low | 29.3 | Very low | 120 Ų | 120 | 147.6 Ų | 147.6 | 84% | 0.839 | 84% | 0.841 | S | S | * | * | 171.4 | 145.1 | 98.6 | 49.8 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 49 | S | 26.1 | Very low | 29.4 | Very low | 125 Ų | 125 | 150.1 Ų | 150.1 | 87% | 0.874 | 84% | 0.843 | S | S | * | * | trans | -70.8 | 137.3 | -179.5 | 51.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 50 | G | 28.4 | Very low | 29.5 | Very low | 77 Ų | 77 | 152.7 Ų | 152.7 | 79% | 0.794 | 85% | 0.845 | S | S | * | * | trans | -159 | 106.4 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | G52 | G50-G52 PolarHBondContact O-N 3.02Š| ||
| 51 | T | 31.6 | Very low | 29.9 | Very low | 157 Ų | 157 | 157.2 Ų | 157.2 | 96% | 0.963 | 85% | 0.852 | S | S | * | * | trans | -64.2 | 121.2 | 175.2 | 41.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 52 | G | 28.7 | Very low | 29.3 | Very low | 77 Ų | 77 | 154.3 Ų | 154.3 | 79% | 0.794 | 85% | 0.845 | S | S | * | * | trans | -147.3 | 110.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | G50 | G50-G52 PolarHBondContact O-N 3.02Š| ||
| 53 | R | 29.6 | Very low | 29.3 | Very low | 250 Ų | 250 | 149.8 Ų | 149.8 | 94% | 0.943 | 84% | 0.835 | S | S | * | * | trans | -76.9 | 139.1 | 179.1 | -154.6 | 176.5 | -169.7 | -179.9 | 2.5 | 109.7 | ||||
| 54 | M | 29.2 | Very low | 29.4 | Very low | 179 Ų | 179 | 151.7 Ų | 151.7 | 88% | 0.882 | 84% | 0.838 | S | S | * | * | trans | 83.5 | 105.5 | 157.3 | -115.1 | 176.6 | 159.8 | 0 | 0 | 119.8 | ||||
| 55 | R | 28.8 | Very low | 29.4 | Very low | 241 Ų | 241 | 152.8 Ų | 152.8 | 91% | 0.909 | 83% | 0.832 | S | S | * | * | -177.7 | 108.3 | 111 | -96.7 | 174.3 | 179 | -176.8 | 0.4 | 109.6 | |||||
| 56 | K | 29 | Very low | 29.7 | Very low | 204 Ų | 204 | 151.3 Ų | 151.3 | 89% | 0.887 | 83% | 0.83 | S | S | * | * | trans | -68.5 | 136.7 | 164.3 | -81.2 | -178.2 | 174.6 | -178.6 | 0 | 108.1 | L58 | K56-L58 PolarHBondContact O-N 3.42Š| ||
| 57 | P | 29 | Very low | 30.1 | Very low | 121 Ų | 121 | 153 Ų | 153 | 79% | 0.786 | 83% | 0.829 | S | S | * | * | trans | -64.4 | 133 | 170.5 | -10.9 | 25.9 | 0 | 0 | 0 | 108.6 | E59 | P57-E59 PolarHBondContact O-N 3.19Š| ||
| 58 | L | 32 | Very low | 31.3 | Very low | 174 Ų | 174 | 149.1 Ų | 149.1 | 91% | 0.911 | 81% | 0.811 | S | S | * | * | trans | -56.7 | 106.7 | 168.9 | -82.5 | 145.8 | 0 | 0 | 0 | 108.6 | K56 R60 | K56-L58 PolarHBondContact O-N 3.42Å; L58-R60 PolarHBondContact O-N 3.48Å; L58-R60 VanDerWaalsContact O-N 3.16Å | ||
| 59 | E | 30.8 | Very low | 32.5 | Very low | 185 Ų | 185 | 145.4 Ų | 145.4 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | trans | -59.1 | 115.9 | 161 | -84.6 | -176.3 | 130.3 | 0 | 0 | 107.9 | P57 N61 | P57-E59 PolarHBondContact O-N 3.19Å; E59-N61 VanDerWaalsContact C-N 3.28Å; E59-N61 PolarHBondContact O-N 2.9Å | ||
| 60 | R | 28.2 | Very low | 34.1 | Very low | 246 Ų | 246 | 145.7 Ų | 145.7 | 93% | 0.928 | 77% | 0.771 | S | S | * | * | trans | -65.9 | 89.1 | 170.6 | -177.5 | 179.1 | 179.4 | -178.5 | -0.3 | 108.3 | L58 G62 | L58-R60 PolarHBondContact O-N 3.48Å; L58-R60 VanDerWaalsContact O-N 3.16Å; R60-G62 PolarHBondContact O-N 3.11Å | ||
| 61 | N | 31.5 | Very low | 35.9 | Very low | 168 Ų | 168 | 143.9 Ų | 143.9 | 90% | 0.898 | 74% | 0.742 | S | S | * | * | trans | -63.7 | 121.4 | 163.8 | -112.3 | -9.1 | 0 | 0 | 0 | 108.9 | E59 | E59-N61 VanDerWaalsContact C-N 3.28Å; E59-N61 PolarHBondContact O-N 2.9Å | ||
| 62 | G | 33 | Very low | 37.9 | Very low | 64 Ų | 64 | 141.3 Ų | 141.3 | 66% | 0.66 | 72% | 0.719 | S | S | * | * | trans | 151 | 45.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | R60 | R60-G62 PolarHBondContact O-N 3.11Š| ||
| 63 | S | 28.3 | Very low | 40.3 | Very low | 106 Ų | 106 | 144.3 Ų | 144.3 | 74% | 0.741 | 71% | 0.707 | S | S | * | * | trans | -94.5 | 99.6 | 147.4 | 53 | 0 | 0 | 0 | 0 | 107 | Q65 | S63-Q65 PolarHBondContact O-N 3.46Š| ||
| 64 | T | 32.7 | Very low | 42.6 | Very low | 132 Ų | 132 | 137.6 Ų | 137.6 | 81% | 0.81 | 68% | 0.681 | S | S | * | * | trans | -59.5 | 90.5 | 163.2 | -28.5 | 0 | 0 | 0 | 0 | 106.2 | N66 | T64-N66 PolarHBondContact O-N 3.48Š| ||
| 65 | Q | 33.6 | Very low | 45.2 | Very low | 144 Ų | 144 | 129.4 Ų | 129.4 | 67% | 0.673 | 64% | 0.641 | S | S | * | * | trans | -61.1 | 109.1 | 166 | -80.1 | -167.8 | -3.5 | 0 | 0 | 105.6 | S63 H67 | S63-Q65 PolarHBondContact O-N 3.46Å; Q65-H67 PolarHBondContact O-N 3.49Å | ||
| 66 | N | 32.7 | Very low | 48 | Very low | 145 Ų | 145 | 119 Ų | 119 | 78% | 0.775 | 61% | 0.609 | S | S | * | * | trans | -55.5 | 93.6 | 160.7 | -81.5 | -22.5 | 0 | 0 | 0 | 106.3 | T64 V68 | T64-N66 PolarHBondContact O-N 3.48Å; N66-V68 PolarHBondContact O-N 3.37Å | ||
| 67 | H | 36.6 | Very low | 50.9 | Low | 150 Ų | 150 | 112 Ų | 112 | 69% | 0.694 | 58% | 0.581 | S | S | * | * | trans | -67.7 | 83.5 | 170.5 | -102.4 | -60.7 | 0 | 0 | 0 | 106.9 | Q65 V69 | Q65-H67 PolarHBondContact O-N 3.49Å; H67-V69 PolarHBondContact O-N 2.84Å; H67-V69 VanDerWaalsContact O-N 3.08Å | ||
| 68 | V | 49.9 | Very low | 53.8 | Low | 66 Ų | 66 | 113.2 Ų | 113.2 | 40% | 0.4 | 57% | 0.574 | S | S | . | * | trans | -62.3 | 110.8 | 165 | -174.6 | 0 | 0 | 0 | 0 | 105.2 | N66 H70 | N66-V68 PolarHBondContact O-N 3.37Å; V68-H70 PolarHBondContact O-CD2 3.13Å; V68-H70 PolarHBondContact O-N 3.31Å; V68-H70 VanDerWaalsContact O-N 3.11Å | ||
| 69 | V | 53.8 | Low | 56.5 | Low | 43 Ų | 43 | 106.1 Ų | 106.1 | 26% | 0.261 | 54% | 0.539 | S | S | . | . | trans | -70.1 | 108.7 | -179.5 | 177.4 | 0 | 0 | 0 | 0 | 107.2 | V5 H67 L394 | V5-V69 HydrophobicContact CG2-CB 4.32Å; H67-V69 PolarHBondContact O-N 2.84Å; H67-V69 VanDerWaalsContact O-N 3.08Å; V69-L394 HydrophobicContact CG1-CD2 3.7Å | ||
| 70 | H | 58.9 | Low | 59.3 | Low | 131 Ų | 131 | 97.4 Ų | 97.4 | 61% | 0.606 | 50% | 0.499 | S | S | * | . | P | Polyproline II helix | trans | -95.1 | 145.4 | 173.3 | -70.6 | -78.7 | 0 | 0 | 0 | 110.5 | V68 E72 | V68-H70 PolarHBondContact O-CD2 3.13Å; V68-H70 PolarHBondContact O-N 3.31Å; V68-H70 VanDerWaalsContact O-N 3.11Å; H70-E72 PolarHBondContact O-N 3.22Å |
| 71 | L | 66.6 | Low | 62.4 | Low | 38 Ų | 38 | 86.9 Ų | 86.9 | 20% | 0.199 | 46% | 0.462 | C | S | . | . | P | Polyproline II helix | trans | -64.2 | 131.7 | 169.3 | -75.2 | 158.4 | 0 | 0 | 0 | 109.3 | E289 F374 | L71-E289 HydrophobicContact CB-CG 3.92Å; L71-E289 HydrophobicContact CD2-CG 4.48Å; L71-F374 HydrophobicContact CD1-CD1 4.37Å; L71-F374 HydrophobicContact CD1-CE1 4.08Å |
| 72 | E | 72.6 | Confident | 65.2 | Low | 103 Ų | 103 | 79.2 Ų | 79.2 | 48% | 0.481 | 42% | 0.422 | S | S | . | . | P | Polyproline II helix | trans | -79 | 136.6 | -179 | -76.1 | -172.5 | -159.9 | 0 | 0 | 112.3 | H70 R74 | H70-E72 PolarHBondContact O-N 3.22Å; E72-R74 HydrophobicContact CB-CG 3.99Å; E72-R74 VanDerWaalsContact CD-NH2 3.3Å; E72-R74 PolarHBondContact O-N 3.26Å; E72-R74 IonicContact OE1-NH2 3.45Å; E72-R74 PolarHBondContact OE1-NH2 3.5Å; E72-R74 IonicContact OE2-CZ 3.09Å; E72-R74 IonicContact OE2-NE 2.73Å; E72-R74 PolarHBondContact OE2-NE 2.78Å; E72-R74 IonicContact OE2-NH2 2.65Å; E72-R74 PolarHBondContact OE2-NH2 3.08Å |
| 73 | R | 79.8 | Confident | 67.9 | Low | 140 Ų | 140 | 76.2 Ų | 76.2 | 53% | 0.528 | 39% | 0.391 | S | S | . | . | trans | -71.2 | 87.2 | 175.7 | -71.8 | -179.6 | 179.9 | 176.6 | 0.5 | 112.4 | E288 E289 K291 | R73-E288 VanDerWaalsContact CG-O 3.23Å; R73-E288 WeakPolarHBondContact CG-O 2.88Å; R73-E289 CarbonylContact C-O 3.51Å; R73-E289 WeakPolarHBondContact CA-O 3.42Å; R73-K291 HydrophobicContact CB-CG 4.4Å; R73-K291 VanDerWaalsContact O-CE 3.26Å; R73-K291 WeakPolarHBondContact O-CE 3.48Å; R73-K291 WeakPolarHBondContact O-CG 3.46Å | ||
| 74 | R | 77.8 | Confident | 71 | Confident | 110 Ų | 110 | 71.1 Ų | 71.1 | 42% | 0.415 | 36% | 0.355 | S | S | . | . | trans | -108.2 | -17.8 | -175.1 | -66.8 | -178.4 | 174.4 | -157.2 | 3.1 | 114.3 | E72 N216 E289 | E72-R74 HydrophobicContact CB-CG 3.99Å; E72-R74 VanDerWaalsContact CD-NH2 3.3Å; E72-R74 PolarHBondContact O-N 3.26Å; E72-R74 IonicContact OE1-NH2 3.45Å; E72-R74 PolarHBondContact OE1-NH2 3.5Å; E72-R74 IonicContact OE2-CZ 3.09Å; E72-R74 IonicContact OE2-NE 2.73Å; E72-R74 PolarHBondContact OE2-NE 2.78Å; E72-R74 IonicContact OE2-NH2 2.65Å; E72-R74 PolarHBondContact OE2-NH2 3.08Å; R74-N216 PolarHBondContact NH1-ND2 3.01Å; R74-N216 VanDerWaalsContact NH1-ND2 3.14Å; R74-N216 PolarHBondContact NH1-OD1 2.66Å; R74-E289 PolarHBondContact N-O 2.78Å | ||
| 75 | L | 83 | Confident | 73.8 | Confident | 6 Ų | 6 | 64.9 Ų | 64.9 | 3% | 0.031 | 32% | 0.317 | C | S | . | . | B | Isolated β-bridge | trans | -86.9 | 114.7 | -173.8 | -56.5 | 174.4 | 0 | 0 | 0 | 111.5 | M219 V286 E289 I290 K291 | L75-M219 HydrophobicContact CD2-CE 3.51Å; L75-M219 HydrophobicContact CD2-CG 3.81Å; L75-M219 HydrophobicContact CD2-SD 3.73Å; L75-V286 HydrophobicContact CD1-CB 3.92Å; L75-V286 HydrophobicContact CD1-CG2 3.84Å; L75-E289 WeakPolarHBondContact CB-O 3.49Å; L75-E289 HydrophobicContact CD1-CB 3.77Å; L75-E289 HydrophobicContact CG-CB 4.07Å; L75-E289 PolarHBondContact N-O 2.86Å; L75-I290 HydrophobicContact CB-CG1 4.36Å; L75-I290 HydrophobicContact CD1-CG1 4.43Å; L75-K291 WeakPolarHBondContact O-CB 3.49Å; L75-K291 PolarHBondContact O-N 3.47Å |
| 76 | G | 88.4 | Confident | 76.5 | Confident | 23 Ų | 23 | 58 Ų | 58 | 24% | 0.237 | 29% | 0.285 | C | S | . | . | trans | -84.6 | 178.4 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | F78 S79 G80 | G76-F78 PolarHBondContact O-N 2.93Å; G76-S79 PolarHBondContact O-N 2.85Å; G76-G80 PolarHBondContact O-N 2.96Å | ||
| 77 | L | 90.1 | Very high | 79.3 | Confident | 57 Ų | 57 | 51.3 Ų | 51.3 | 30% | 0.298 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -56.8 | -45.7 | 177.8 | 179.3 | 64.4 | 0 | 0 | 0 | 112.6 | S79 G80 V81 N296 R299 | L77-S79 PolarHBondContact O-N 3.47Å; L77-G80 PolarHBondContact O-N 3.28Å; L77-G80 VanDerWaalsContact O-N 3.15Å; L77-V81 HydrophobicContact CD1-CG2 4.42Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.4Å; L77-N296 HydrophobicContact CD1-CB 4.48Å; L77-R299 HydrophobicContact CD1-CB 3.73Å |
| 78 | F | 89.6 | Confident | 81.9 | Confident | 147 Ų | 147 | 44.3 Ų | 44.3 | 65% | 0.645 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -60.9 | -46.3 | 179.5 | -179.7 | -96.2 | 0 | 0 | 0 | 111.9 | G76 G80 V81 A82 | G76-F78 PolarHBondContact O-N 2.93Å; F78-G80 VanDerWaalsContact C-N 3.28Å; F78-G80 PolarHBondContact O-N 2.79Å; F78-V81 PolarHBondContact O-N 3.31Å; F78-A82 WeakPolarHBondContact O-CB 3.21Å; F78-A82 PolarHBondContact O-N 2.87Å |
| 79 | S | 88.2 | Confident | 83.9 | Confident | 24 Ų | 24 | 41.2 Ų | 41.2 | 17% | 0.168 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.3 | -31.3 | 176 | -56.1 | 0 | 0 | 0 | 0 | 112.4 | G76 L77 L83 N223 | G76-S79 PolarHBondContact O-N 2.85Å; L77-S79 PolarHBondContact O-N 3.47Å; S79-L83 VanDerWaalsContact O-CB 3.27Å; S79-L83 WeakPolarHBondContact O-CB 3.18Å; S79-L83 PolarHBondContact O-N 2.92Å; S79-N223 PolarHBondContact OG-ND2 3.39Å |
| 80 | G | 90.6 | Very high | 85.4 | Confident | 3 Ų | 3 | 39.2 Ų | 39.2 | 3% | 0.031 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.9 | -47.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G76 L77 F78 A82 L83 I84 | G76-G80 PolarHBondContact O-N 2.96Å; L77-G80 PolarHBondContact O-N 3.28Å; L77-G80 VanDerWaalsContact O-N 3.15Å; F78-G80 VanDerWaalsContact C-N 3.28Å; F78-G80 PolarHBondContact O-N 2.79Å; G80-A82 VanDerWaalsContact C-N 3.33Å; G80-L83 PolarHBondContact O-N 3.28Å; G80-I84 PolarHBondContact O-N 3.32Å |
| 81 | V | 92.3 | Very high | 86.4 | Confident | 24 Ų | 24 | 33.2 Ų | 33.2 | 15% | 0.145 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61 | -45.2 | 172.4 | 175.7 | 0 | 0 | 0 | 0 | 110.3 | L77 F78 L83 I84 V85 I303 | L77-V81 HydrophobicContact CD1-CG2 4.42Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.4Å; F78-V81 PolarHBondContact O-N 3.31Å; V81-L83 VanDerWaalsContact C-N 3.29Å; V81-L83 PolarHBondContact O-N 3.3Å; V81-I84 PolarHBondContact O-N 3.02Å; V81-V85 HydrophobicContact CG1-CG2 3.99Å; V81-V85 WeakPolarHBondContact O-CB 3.43Å; V81-V85 VanDerWaalsContact O-CG2 3.28Å; V81-V85 WeakPolarHBondContact O-CG2 3.41Å; V81-V85 PolarHBondContact O-N 2.9Å; V81-I303 HydrophobicContact CG1-CG2 4.13Å; V81-I303 HydrophobicContact CG2-CB 4.21Å; V81-I303 HydrophobicContact CG2-CG2 4.17Å |
| 82 | A | 90.7 | Very high | 87.2 | Confident | 7 Ų | 7 | 31.5 Ų | 31.5 | 6% | 0.058 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.5 | -33.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F78 G80 G86 N223 T226 | F78-A82 WeakPolarHBondContact O-CB 3.21Å; F78-A82 PolarHBondContact O-N 2.87Å; G80-A82 VanDerWaalsContact C-N 3.33Å; A82-G86 WeakPolarHBondContact O-CA 3.37Å; A82-G86 PolarHBondContact O-N 3.39Å; A82-N223 WeakPolarHBondContact CB-OD1 3.32Å; A82-T226 HydrophobicContact CB-CG2 4.18Å; A82-T226 WeakPolarHBondContact O-CG2 3.22Å; A82-T226 PolarHBondContact O-OG1 3.2Å |
| 83 | L | 90 | Very high | 87.9 | Confident | 1 Ų | 1 | 26.6 Ų | 26.6 | 1% | 0.005 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -68.1 | -47.9 | 173.3 | -173.1 | 66.6 | 0 | 0 | 0 | 110.9 | S79 G80 V81 G86 T87 Q222 L283 V286 | S79-L83 VanDerWaalsContact O-CB 3.27Å; S79-L83 WeakPolarHBondContact O-CB 3.18Å; S79-L83 PolarHBondContact O-N 2.92Å; G80-L83 PolarHBondContact O-N 3.28Å; V81-L83 VanDerWaalsContact C-N 3.29Å; V81-L83 PolarHBondContact O-N 3.3Å; L83-G86 CarbonylContact O-C 3.39Å; L83-G86 WeakPolarHBondContact O-CA 3.46Å; L83-G86 PolarHBondContact O-N 2.93Å; L83-T87 HydrophobicContact CD1-CG2 4.26Å; L83-T87 WeakPolarHBondContact O-CG2 3.5Å; L83-T87 PolarHBondContact O-N 3.14Å; L83-T87 PolarHBondContact O-OG1 2.9Å; L83-Q222 HydrophobicContact CD1-CG 4.06Å; L83-L283 HydrophobicContact CD2-CD1 3.97Å; L83-V286 HydrophobicContact CD2-CG1 4.4Å; L83-V286 HydrophobicContact CD2-CG2 3.74Å |
| 84 | I | 92.6 | Very high | 88 | Confident | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.2 | -56.2 | 178.7 | -75.1 | -178.9 | 0 | 0 | 0 | 111.4 | G80 V81 G86 T87 M88 L283 I301 I305 | G80-I84 PolarHBondContact O-N 3.32Å; V81-I84 PolarHBondContact O-N 3.02Å; I84-G86 PolarHBondContact O-N 3.14Å; I84-T87 PolarHBondContact O-N 3.36Å; I84-T87 PolarHBondContact O-OG1 3.47Å; I84-M88 HydrophobicContact CG2-CE 3.19Å; I84-M88 HydrophobicContact CG2-SD 4.3Å; I84-M88 WeakPolarHBondContact O-CB 3.35Å; I84-M88 WeakPolarHBondContact O-CG 3.28Å; I84-M88 PolarHBondContact O-N 3.49Å; I84-L283 HydrophobicContact CD1-CB 3.94Å; I84-L283 HydrophobicContact CD1-CD2 3.44Å; I84-L283 VanDerWaalsContact CD1-CD2 3.44Å; I84-L283 HydrophobicContact CD1-CG 4.28Å; I84-L283 HydrophobicContact CG1-CB 3.78Å; I84-L283 HydrophobicContact CG1-CD2 3.94Å; I84-L283 HydrophobicContact CG1-CG 4.37Å; I84-I301 HydrophobicContact CD1-CB 4.4Å; I84-I301 HydrophobicContact CD1-CG1 3.61Å; I84-I305 HydrophobicContact CG2-CG1 4.31Å |
| 85 | V | 93.3 | Very high | 87.9 | Confident | 1 Ų | 1 | 16.6 Ų | 16.6 | 1% | 0.006 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -61.8 | -39.2 | 177.9 | 176.8 | 0 | 0 | 0 | 0 | 109.3 | V81 I89 T226 K229 L230 L307 V308 | V81-V85 HydrophobicContact CG1-CG2 3.99Å; V81-V85 WeakPolarHBondContact O-CB 3.43Å; V81-V85 VanDerWaalsContact O-CG2 3.28Å; V81-V85 WeakPolarHBondContact O-CG2 3.41Å; V81-V85 PolarHBondContact O-N 2.9Å; V85-I89 HydrophobicContact CG1-CD1 3.7Å; V85-I89 HydrophobicContact CG1-CG1 4.26Å; V85-I89 WeakPolarHBondContact O-CB 3.47Å; V85-I89 PolarHBondContact O-N 2.95Å; V85-T226 HydrophobicContact CB-CG2 4.17Å; V85-T226 HydrophobicContact CG1-CG2 4.04Å; V85-K229 WeakPolarHBondContact O-CE 3.39Å; V85-K229 PolarHBondContact O-NZ 3.28Å; V85-L230 HydrophobicContact CG1-CD1 4.41Å; V85-L230 HydrophobicContact CG1-CD2 3.97Å; V85-L230 HydrophobicContact CG1-CG 4.35Å; V85-L307 HydrophobicContact CG2-CD2 4.09Å; V85-V308 HydrophobicContact CB-CG2 4.35Å; V85-V308 HydrophobicContact CG1-CG2 4.17Å; V85-V308 HydrophobicContact CG2-CG2 4.17Å |
| 86 | G | 90.2 | Very high | 88.1 | Confident | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -51.8 | -46.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | A82 L83 I84 T226 K229 S361 | A82-G86 WeakPolarHBondContact O-CA 3.37Å; A82-G86 PolarHBondContact O-N 3.39Å; L83-G86 CarbonylContact O-C 3.39Å; L83-G86 WeakPolarHBondContact O-CA 3.46Å; L83-G86 PolarHBondContact O-N 2.93Å; I84-G86 PolarHBondContact O-N 3.14Å; G86-T226 VanDerWaalsContact CA-OG1 3.3Å; G86-T226 WeakPolarHBondContact CA-OG1 3.29Å; G86-K229 PolarHBondContact O-NZ 3.28Å; G86-S361 WeakPolarHBondContact O-CA 3.47Å |
| 87 | T | 90.6 | Very high | 87.9 | Confident | 3 Ų | 3 | 15.3 Ų | 15.3 | 2% | 0.018 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -85.7 | -41.3 | -178.3 | 50.1 | 0 | 0 | 0 | 0 | 111.7 | L83 I84 G279 N282 S361 | L83-T87 HydrophobicContact CD1-CG2 4.26Å; L83-T87 WeakPolarHBondContact O-CG2 3.5Å; L83-T87 PolarHBondContact O-N 3.14Å; L83-T87 PolarHBondContact O-OG1 2.9Å; I84-T87 PolarHBondContact O-N 3.36Å; I84-T87 PolarHBondContact O-OG1 3.47Å; T87-G279 PolarHBondContact OG1-O 3.05Å; T87-N282 WeakPolarHBondContact CB-ND2 3.47Å; T87-N282 HydrophobicContact CG2-CB 4.32Å; T87-N282 WeakPolarHBondContact CG2-ND2 3.21Å; T87-S361 PolarHBondContact O-OG 3.1Å |
| 88 | M | 92 | Very high | 87.7 | Confident | 4 Ų | 4 | 13 Ų | 13 | 2% | 0.02 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -68.3 | -51.7 | -177.5 | -68.1 | -171.3 | -59.3 | 0 | 0 | 112.7 | I84 G90 D278 W280 I305 V308 Y312 | I84-M88 HydrophobicContact CG2-CE 3.19Å; I84-M88 HydrophobicContact CG2-SD 4.3Å; I84-M88 WeakPolarHBondContact O-CB 3.35Å; I84-M88 WeakPolarHBondContact O-CG 3.28Å; I84-M88 PolarHBondContact O-N 3.49Å; M88-G90 VanDerWaalsContact C-N 3.27Å; M88-G90 PolarHBondContact O-N 2.95Å; M88-D278 WeakPolarHBondContact CA-O 3.49Å; M88-W280 HydrophobicContact SD-CB 3.77Å; M88-I305 HydrophobicContact CE-CB 4.29Å; M88-I305 HydrophobicContact CE-CG1 3.73Å; M88-I305 HydrophobicContact SD-CG1 4.03Å; M88-V308 HydrophobicContact CB-CG1 4.17Å; M88-V308 HydrophobicContact CB-CG2 4.3Å; M88-V308 HydrophobicContact CE-CB 3.9Å; M88-V308 HydrophobicContact CE-CG1 4.37Å; M88-V308 HydrophobicContact CE-CG2 3.53Å; M88-Y312 PolarHBondContact O-OH 3.32Å |
| 89 | I | 91.4 | Very high | 87.3 | Confident | 0 Ų | 0 | 6.3 Ų | 6.3 | 0% | 0 | 4% | 0.042 | C | C | . | . | S | Bend | trans | -72.5 | 87.1 | 175 | -52.9 | -179.8 | 0 | 0 | 0 | 108.3 | V85 I93 K229 L230 V233 V308 Y312 S357 | V85-I89 HydrophobicContact CG1-CD1 3.7Å; V85-I89 HydrophobicContact CG1-CG1 4.26Å; V85-I89 WeakPolarHBondContact O-CB 3.47Å; V85-I89 PolarHBondContact O-N 2.95Å; I89-I93 HydrophobicContact CG2-CG2 4.45Å; I89-K229 HydrophobicContact CB-CD 4.28Å; I89-K229 HydrophobicContact CG2-CD 4.25Å; I89-K229 PolarHBondContact O-NZ 2.73Å; I89-L230 HydrophobicContact CD1-CD2 4.08Å; I89-V233 HydrophobicContact CG2-CG2 4.42Å; I89-V308 HydrophobicContact CD1-CG2 4Å; I89-V308 HydrophobicContact CG1-CB 4.42Å; I89-V308 HydrophobicContact CG1-CG1 3.99Å; I89-V308 HydrophobicContact CG1-CG2 3.72Å; I89-Y312 WeakPolarHBondContact CA-OH 3.32Å; I89-Y312 HydrophobicContact CB-CE1 4.45Å; I89-Y312 HydrophobicContact CG1-CE1 3.94Å; I89-Y312 HydrophobicContact CG2-CE1 4.43Å; I89-S357 PolarHBondContact O-OG 2.72Å; I89-S357 VanDerWaalsContact O-OG 3.07Å |
| 90 | G | 85.6 | Confident | 87.3 | Confident | 2 Ų | 2 | 5.1 Ų | 5.1 | 2% | 0.021 | 3% | 0.034 | C | C | . | . | S | Bend | trans | -127.1 | -138.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | M88 G92 F94 | M88-G90 VanDerWaalsContact C-N 3.27Å; M88-G90 PolarHBondContact O-N 2.95Å; G90-G92 VanDerWaalsContact C-N 3.29Å; G90-G92 PolarHBondContact O-N 3.03Å; G90-F94 VanDerWaalsContact O-CD2 3.25Å; G90-F94 WeakPolarHBondContact O-CD2 3.12Å; G90-F94 VanDerWaalsContact O-CE2 3.28Å; G90-F94 WeakPolarHBondContact O-CE2 3.45Å |
| 91 | S | 79.1 | Confident | 87.1 | Confident | 4 Ų | 4 | 5.3 Ų | 5.3 | 3% | 0.028 | 3% | 0.034 | C | C | . | . | S | Bend | trans | -68.8 | -27.4 | 176.4 | 50.9 | 0 | 0 | 0 | 0 | 113.1 | I93 F94 V95 S176 | S91-I93 PolarHBondContact O-N 3.37Å; S91-F94 PolarHBondContact O-N 3.36Å; S91-F94 VanDerWaalsContact O-N 3.08Å; S91-V95 PolarHBondContact O-N 2.92Å; S91-S176 VanDerWaalsContact CB-CB 3.44Å; S91-S176 WeakPolarHBondContact CB-OG 3.39Å |
| 92 | G | 83.5 | Confident | 86.9 | Confident | 3 Ų | 3 | 5.8 Ų | 5.8 | 3% | 0.031 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -58.3 | -43.1 | -172.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | G90 F94 V95 S96 | G90-G92 VanDerWaalsContact C-N 3.29Å; G90-G92 PolarHBondContact O-N 3.03Å; G92-F94 PolarHBondContact O-N 2.73Å; G92-V95 PolarHBondContact O-N 3.1Å; G92-S96 WeakPolarHBondContact O-CA 3.49Å; G92-S96 WeakPolarHBondContact O-CB 3.3Å; G92-S96 PolarHBondContact O-N 3.32Å; G92-S96 PolarHBondContact O-OG 3.09Å; G92-S96 VanDerWaalsContact O-OG 3.06Å |
| 93 | I | 87 | Confident | 86.7 | Confident | 0 Ų | 0 | 8 Ų | 8 | 0% | 0 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -67.1 | -19.3 | 179.6 | -168.4 | 53.2 | 0 | 0 | 0 | 114 | I89 S91 P97 W114 Y312 I315 | I89-I93 HydrophobicContact CG2-CG2 4.45Å; S91-I93 PolarHBondContact O-N 3.37Å; I93-P97 WeakPolarHBondContact O-CD 3.44Å; I93-P97 WeakPolarHBondContact O-CG 3.36Å; I93-W114 HydrophobicContact CD1-CH2 3.8Å; I93-W114 HydrophobicContact CD1-CZ2 4.21Å; I93-W114 HydrophobicContact CD1-CZ3 4.27Å; I93-Y312 HydrophobicContact CB-CD1 4Å; I93-Y312 HydrophobicContact CB-CE1 3.51Å; I93-Y312 HydrophobicContact CD1-CD1 3.54Å; I93-Y312 HydrophobicContact CD1-CD2 4.28Å; I93-Y312 HydrophobicContact CD1-CE1 3.99Å; I93-Y312 HydrophobicContact CD1-CG 3.68Å; I93-Y312 HydrophobicContact CG1-CD1 3.57Å; I93-Y312 HydrophobicContact CG1-CE1 3.65Å; I93-Y312 HydrophobicContact CG1-CG 4.24Å; I93-Y312 HydrophobicContact CG2-CE1 4.06Å; I93-I315 HydrophobicContact CD1-CG2 4.29Å; I93-I315 HydrophobicContact CG1-CD1 3.86Å; I93-I315 HydrophobicContact CG1-CG2 4.1Å |
| 94 | F | 81.6 | Confident | 86.6 | Confident | 16 Ų | 16 | 8.1 Ų | 8.1 | 7% | 0.07 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -92.1 | -19.4 | 179.7 | -54 | -60.5 | 0 | 0 | 0 | 112.7 | G90 S91 G92 Y180 A335 V354 | G90-F94 VanDerWaalsContact O-CD2 3.25Å; G90-F94 WeakPolarHBondContact O-CD2 3.12Å; G90-F94 VanDerWaalsContact O-CE2 3.28Å; G90-F94 WeakPolarHBondContact O-CE2 3.45Å; S91-F94 PolarHBondContact O-N 3.36Å; S91-F94 VanDerWaalsContact O-N 3.08Å; G92-F94 PolarHBondContact O-N 2.73Å; F94-Y180 HydrophobicContact CB-CE2 4.4Å; F94-Y180 WeakPolarHBondContact CB-OH 3.33Å; F94-Y180 PolarHBondContact O-OH 3.49Å; F94-A335 HydrophobicContact CD1-CB 3.68Å; F94-A335 HydrophobicContact CE1-CB 4.2Å; F94-V354 HydrophobicContact CD1-CG2 3.82Å; F94-V354 HydrophobicContact CD2-CB 4.29Å; F94-V354 HydrophobicContact CD2-CG1 3.61Å; F94-V354 HydrophobicContact CD2-CG2 4.05Å; F94-V354 HydrophobicContact CE1-CG2 3.75Å; F94-V354 HydrophobicContact CE2-CB 4.2Å; F94-V354 HydrophobicContact CE2-CG1 3.92Å; F94-V354 HydrophobicContact CE2-CG2 3.98Å; F94-V354 HydrophobicContact CG-CG1 4.04Å; F94-V354 HydrophobicContact CG-CG2 3.95Å; F94-V354 HydrophobicContact CZ-CB 4.43Å; F94-V354 HydrophobicContact CZ-CG2 3.82Å |
| 95 | V | 76.9 | Confident | 86.2 | Confident | 24 Ų | 24 | 9.9 Ų | 9.9 | 15% | 0.145 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -108 | -44.8 | -177.1 | 175.5 | 0 | 0 | 0 | 0 | 111.8 | S91 G92 L431 | S91-V95 PolarHBondContact O-N 2.92Å; G92-V95 PolarHBondContact O-N 3.1Å; V95-L431 HydrophobicContact CG1-CD2 3.51Å; V95-L431 HydrophobicContact CG1-CG 4.36Å |
| 96 | S | 85.8 | Confident | 85.9 | Confident | 2 Ų | 2 | 10.1 Ų | 10.1 | 1% | 0.014 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -62.7 | -30 | -173.8 | -64.7 | 0 | 0 | 0 | 0 | 115.8 | G92 S98 G99 L100 T272 | G92-S96 WeakPolarHBondContact O-CA 3.49Å; G92-S96 WeakPolarHBondContact O-CB 3.3Å; G92-S96 PolarHBondContact O-N 3.32Å; G92-S96 PolarHBondContact O-OG 3.09Å; G92-S96 VanDerWaalsContact O-OG 3.06Å; S96-S98 PolarHBondContact O-N 3.19Å; S96-G99 PolarHBondContact O-N 3.49Å; S96-L100 WeakPolarHBondContact O-CB 3.43Å; S96-L100 PolarHBondContact O-N 3.2Å; S96-T272 WeakPolarHBondContact CB-O 3.37Å; S96-T272 PolarHBondContact OG-O 3.06Å |
| 97 | P | 85.8 | Confident | 85.9 | Confident | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -57.9 | -43.6 | 179.8 | -28.9 | 36.8 | 0 | 0 | 0 | 114.1 | I93 L101 W114 Y319 M328 | I93-P97 WeakPolarHBondContact O-CD 3.44Å; I93-P97 WeakPolarHBondContact O-CG 3.36Å; P97-L101 PolarHBondContact O-N 3.01Å; P97-L101 VanDerWaalsContact O-N 3.12Å; P97-W114 HydrophobicContact CG-CZ2 4.11Å; P97-Y319 HydrophobicContact CB-CD2 4.46Å; P97-Y319 HydrophobicContact CG-CD2 4.36Å; P97-Y319 HydrophobicContact CG-CE2 4.16Å; P97-M328 HydrophobicContact CB-CE 4.19Å; P97-M328 HydrophobicContact CB-SD 3.94Å |
| 98 | S | 84.5 | Confident | 85.9 | Confident | 8 Ų | 8 | 10.8 Ų | 10.8 | 6% | 0.056 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -63.9 | -52 | 175.4 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | S96 L100 L101 V102 M328 I329 | S96-S98 PolarHBondContact O-N 3.19Å; S98-L100 VanDerWaalsContact C-N 3.27Å; S98-L100 PolarHBondContact O-N 3.17Å; S98-L101 PolarHBondContact O-N 3.11Å; S98-L101 VanDerWaalsContact O-N 3.16Å; S98-V102 WeakPolarHBondContact O-CG2 3.36Å; S98-V102 PolarHBondContact O-N 3.47Å; S98-M328 WeakPolarHBondContact CB-O 3.44Å; S98-M328 PolarHBondContact OG-O 3.27Å; S98-I329 WeakPolarHBondContact OG-CA 3.49Å; S98-I329 PolarHBondContact OG-O 3.06Å |
| 99 | G | 82.9 | Confident | 85.8 | Confident | 6 Ų | 6 | 12 Ų | 12 | 6% | 0.062 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -60.3 | -32.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | S96 R103 | S96-G99 PolarHBondContact O-N 3.49Å; G99-R103 WeakPolarHBondContact O-CD 3.38Å; G99-R103 VanDerWaalsContact O-CG 3.24Å; G99-R103 WeakPolarHBondContact O-CG 3.48Å; G99-R103 PolarHBondContact O-N 3.37Å |
| 100 | L | 87.2 | Confident | 85.8 | Confident | 0 Ų | 0 | 12.2 Ų | 12.2 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -72.1 | -45.4 | 176.2 | -144.8 | 73.4 | 0 | 0 | 0 | 111.2 | S96 S98 V102 R103 T104 S110 I113 W114 A269 T272 | S96-L100 WeakPolarHBondContact O-CB 3.43Å; S96-L100 PolarHBondContact O-N 3.2Å; S98-L100 VanDerWaalsContact C-N 3.27Å; S98-L100 PolarHBondContact O-N 3.17Å; L100-V102 PolarHBondContact O-N 3.43Å; L100-R103 PolarHBondContact O-N 2.89Å; L100-T104 WeakPolarHBondContact O-CG2 3.48Å; L100-T104 PolarHBondContact O-N 3.25Å; L100-T104 PolarHBondContact O-OG1 3.43Å; L100-T104 VanDerWaalsContact O-OG1 3.08Å; L100-S110 WeakPolarHBondContact CD2-O 3.48Å; L100-S110 WeakPolarHBondContact CD2-OG 3.26Å; L100-I113 HydrophobicContact CD1-CG2 4.06Å; L100-I113 HydrophobicContact CD2-CB 4.2Å; L100-I113 HydrophobicContact CD2-CG2 4.09Å; L100-I113 HydrophobicContact CG-CG2 4.46Å; L100-W114 HydrophobicContact CD2-CD2 4.16Å; L100-W114 HydrophobicContact CD2-CG 3.77Å; L100-W114 VanDerWaalsContact CD2-NE1 3.3Å; L100-A269 HydrophobicContact CD1-CB 3.79Å; L100-A269 WeakPolarHBondContact CD1-O 3.42Å; L100-A269 HydrophobicContact CG-CB 4.43Å; L100-T272 HydrophobicContact CD1-CG2 4.44Å |
| 101 | L | 87 | Confident | 86.1 | Confident | 6 Ų | 6 | 13.9 Ų | 13.9 | 3% | 0.031 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -61.4 | -42.3 | 177.3 | -84.3 | -166.9 | 0 | 0 | 0 | 113.1 | P97 S98 R103 T104 G105 V107 P325 M328 I329 | P97-L101 PolarHBondContact O-N 3.01Å; P97-L101 VanDerWaalsContact O-N 3.12Å; S98-L101 PolarHBondContact O-N 3.11Å; S98-L101 VanDerWaalsContact O-N 3.16Å; L101-R103 PolarHBondContact O-N 3.21Å; L101-T104 PolarHBondContact O-N 3.06Å; L101-G105 PolarHBondContact O-N 2.98Å; L101-V107 HydrophobicContact CD2-CB 4.49Å; L101-V107 HydrophobicContact CD2-CG2 4.02Å; L101-P325 HydrophobicContact CD1-CB 4Å; L101-M328 HydrophobicContact CD1-CB 4.45Å; L101-M328 HydrophobicContact CD1-CE 3.07Å; L101-M328 HydrophobicContact CG-CE 3.69Å; L101-I329 HydrophobicContact CB-CD1 4.25Å; L101-I329 HydrophobicContact CB-CG1 4.11Å; L101-I329 HydrophobicContact CD1-CG1 4.5Å |
| 102 | V | 86.8 | Confident | 86.8 | Confident | 35 Ų | 35 | 18.3 Ų | 18.3 | 21% | 0.212 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -57.1 | -41 | 177.4 | 170.7 | 0 | 0 | 0 | 0 | 111 | S98 L100 I329 G433 | S98-V102 WeakPolarHBondContact O-CG2 3.36Å; S98-V102 PolarHBondContact O-N 3.47Å; L100-V102 PolarHBondContact O-N 3.43Å; V102-I329 HydrophobicContact CG2-CB 4.23Å; V102-I329 HydrophobicContact CG2-CD1 4.2Å; V102-I329 HydrophobicContact CG2-CG1 3.85Å; V102-I329 HydrophobicContact CG2-CG2 3.5Å; V102-I329 VanDerWaalsContact CG2-CG2 3.5Å; V102-G433 WeakPolarHBondContact CG1-O 3.27Å |
| 103 | R | 86.4 | Confident | 87.2 | Confident | 54 Ų | 54 | 18.4 Ų | 18.4 | 20% | 0.204 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -80.4 | -35.6 | -176.7 | -65.3 | 172.9 | -172 | -71.6 | -1.3 | 112.8 | G99 L100 L101 T268 A269 T272 A429 | G99-R103 WeakPolarHBondContact O-CD 3.38Å; G99-R103 VanDerWaalsContact O-CG 3.24Å; G99-R103 WeakPolarHBondContact O-CG 3.48Å; G99-R103 PolarHBondContact O-N 3.37Å; L100-R103 PolarHBondContact O-N 2.89Å; L101-R103 PolarHBondContact O-N 3.21Å; R103-T268 VanDerWaalsContact CD-C 3.48Å; R103-T268 WeakPolarHBondContact CD-O 3.36Å; R103-T268 PolarHBondContact NH1-OG1 2.96Å; R103-A269 HydrophobicContact CB-CB 4.02Å; R103-T272 PolarHBondContact NE-OG1 3.37Å; R103-T272 VanDerWaalsContact NE-OG1 3.1Å; R103-A429 PolarHBondContact NH2-O 3.46Å |
| 104 | T | 87.7 | Confident | 87.6 | Confident | 2 Ų | 2 | 18.5 Ų | 18.5 | 1% | 0.012 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -85.2 | -25.8 | -178.2 | 60.9 | 0 | 0 | 0 | 0 | 113.2 | L100 L101 S106 V109 S110 I113 A269 | L100-T104 WeakPolarHBondContact O-CG2 3.48Å; L100-T104 PolarHBondContact O-N 3.25Å; L100-T104 PolarHBondContact O-OG1 3.43Å; L100-T104 VanDerWaalsContact O-OG1 3.08Å; L101-T104 PolarHBondContact O-N 3.06Å; T104-S106 PolarHBondContact O-N 3.21Å; T104-S106 PolarHBondContact OG1-O 3.44Å; T104-V109 HydrophobicContact CG2-CB 4.45Å; T104-V109 HydrophobicContact CG2-CG1 3.95Å; T104-S110 WeakPolarHBondContact OG1-CB 3.33Å; T104-I113 HydrophobicContact CG2-CD1 3.57Å; T104-A269 HydrophobicContact CG2-CB 4.12Å |
| 105 | G | 84.3 | Confident | 88.2 | Confident | 38 Ų | 38 | 21.9 Ų | 21.9 | 39% | 0.392 | 13% | 0.126 | S | C | . | . | S | Bend | trans | 64.1 | -2.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | L101 G258 | L101-G105 PolarHBondContact O-N 2.98Å; G105-G258 WeakPolarHBondContact O-CA 3.46Å |
| 106 | S | 88.7 | Confident | 89.1 | Confident | 6 Ų | 6 | 22.2 Ų | 22.2 | 4% | 0.042 | 13% | 0.131 | C | C | . | . | S | Bend | trans | -140.3 | 135.7 | -177.1 | 163.2 | 0 | 0 | 0 | 0 | 109.6 | T104 G108 V109 S110 A255 | T104-S106 PolarHBondContact O-N 3.21Å; T104-S106 PolarHBondContact OG1-O 3.44Å; S106-G108 PolarHBondContact OG-N 2.97Å; S106-V109 PolarHBondContact OG-N 3.22Å; S106-S110 WeakPolarHBondContact O-CB 3.5Å; S106-S110 PolarHBondContact O-N 3.43Å; S106-A255 PolarHBondContact OG-O 2.98Å |
| 107 | V | 89.9 | Confident | 89.6 | Confident | 11 Ų | 11 | 22.1 Ų | 22.1 | 7% | 0.067 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63 | -45.4 | 177 | 170.5 | 0 | 0 | 0 | 0 | 111.2 | L101 V109 S110 F111 A255 L320 P325 | L101-V107 HydrophobicContact CD2-CB 4.49Å; L101-V107 HydrophobicContact CD2-CG2 4.02Å; V107-V109 PolarHBondContact O-N 2.89Å; V107-S110 WeakPolarHBondContact O-CB 3.49Å; V107-S110 PolarHBondContact O-N 3.3Å; V107-F111 HydrophobicContact CG1-CD2 3.86Å; V107-F111 HydrophobicContact CG1-CE2 3.74Å; V107-F111 VanDerWaalsContact O-CD2 3.29Å; V107-F111 WeakPolarHBondContact O-CD2 3.39Å; V107-F111 PolarHBondContact O-N 3.48Å; V107-A255 HydrophobicContact CB-CB 4.42Å; V107-A255 HydrophobicContact CG1-CB 4.33Å; V107-A255 PolarHBondContact N-O 2.96Å; V107-L320 HydrophobicContact CG1-CD1 3.42Å; V107-L320 VanDerWaalsContact CG1-CD1 3.42Å; V107-L320 HydrophobicContact CG1-CD2 4.43Å; V107-L320 HydrophobicContact CG2-CD2 4.08Å; V107-P325 HydrophobicContact CG2-CB 4.17Å; V107-P325 HydrophobicContact CG2-CG 3.7Å |
| 108 | G | 89.8 | Confident | 90 | Very high | 5 Ų | 5 | 22.1 Ų | 22.1 | 5% | 0.052 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63.7 | -42.8 | -179 | 0 | 0 | 0 | 0 | 0 | 112.3 | S106 F111 I112 A255 | S106-G108 PolarHBondContact OG-N 2.97Å; G108-F111 PolarHBondContact O-N 3.28Å; G108-I112 WeakPolarHBondContact O-CG1 3.4Å; G108-I112 PolarHBondContact O-N 3.24Å; G108-I112 VanDerWaalsContact O-N 3.12Å; G108-A255 PolarHBondContact N-O 3.31Å |
| 109 | V | 90.7 | Very high | 90.6 | Very high | 31 Ų | 31 | 25.7 Ų | 25.7 | 19% | 0.188 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.6 | -40 | 176.1 | -178.3 | 0 | 0 | 0 | 0 | 111.3 | T104 S106 V107 F111 I112 I113 P261 | T104-V109 HydrophobicContact CG2-CB 4.45Å; T104-V109 HydrophobicContact CG2-CG1 3.95Å; S106-V109 PolarHBondContact OG-N 3.22Å; V107-V109 PolarHBondContact O-N 2.89Å; V109-F111 VanDerWaalsContact C-N 3.34Å; V109-F111 PolarHBondContact O-N 3.44Å; V109-I112 PolarHBondContact O-N 2.99Å; V109-I113 HydrophobicContact CG1-CD1 4.24Å; V109-I113 WeakPolarHBondContact O-CG1 3.32Å; V109-I113 PolarHBondContact O-N 3.03Å; V109-P261 HydrophobicContact CG1-CG 4.01Å |
| 110 | S | 90.8 | Very high | 91.2 | Very high | 4 Ų | 4 | 29.6 Ų | 29.6 | 3% | 0.028 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -56.9 | -45.6 | 173.9 | -179.7 | 0 | 0 | 0 | 0 | 111.9 | L100 T104 S106 V107 I112 I113 W114 | L100-S110 WeakPolarHBondContact CD2-O 3.48Å; L100-S110 WeakPolarHBondContact CD2-OG 3.26Å; T104-S110 WeakPolarHBondContact OG1-CB 3.33Å; S106-S110 WeakPolarHBondContact O-CB 3.5Å; S106-S110 PolarHBondContact O-N 3.43Å; V107-S110 WeakPolarHBondContact O-CB 3.49Å; V107-S110 PolarHBondContact O-N 3.3Å; S110-I112 PolarHBondContact O-N 2.88Å; S110-I113 PolarHBondContact O-N 3.45Å; S110-W114 PolarHBondContact O-N 2.96Å |
| 111 | F | 91.4 | Very high | 91.6 | Very high | 36 Ų | 36 | 29.7 Ų | 29.7 | 16% | 0.158 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.5 | -43.2 | 175.7 | -88.2 | -67.3 | 0 | 0 | 0 | 113.7 | V107 G108 V109 I113 W114 L115 L252 N316 I317 L320 | V107-F111 HydrophobicContact CG1-CD2 3.86Å; V107-F111 HydrophobicContact CG1-CE2 3.74Å; V107-F111 VanDerWaalsContact O-CD2 3.29Å; V107-F111 WeakPolarHBondContact O-CD2 3.39Å; V107-F111 PolarHBondContact O-N 3.48Å; G108-F111 PolarHBondContact O-N 3.28Å; V109-F111 VanDerWaalsContact C-N 3.34Å; V109-F111 PolarHBondContact O-N 3.44Å; F111-I113 VanDerWaalsContact C-N 3.29Å; F111-I113 PolarHBondContact O-N 2.93Å; F111-W114 WeakPolarHBondContact O-CB 3.36Å; F111-W114 PolarHBondContact O-N 3.07Å; F111-L115 PolarHBondContact O-N 3.24Å; F111-L252 HydrophobicContact CE2-CD2 4.4Å; F111-N316 HydrophobicContact CD1-CB 4.42Å; F111-N316 HydrophobicContact CE1-CB 3.51Å; F111-N316 HydrophobicContact CZ-CB 3.79Å; F111-I317 HydrophobicContact CE1-CD1 4.43Å; F111-I317 HydrophobicContact CE1-CG1 3.58Å; F111-I317 HydrophobicContact CE2-CG1 4.46Å; F111-I317 HydrophobicContact CZ-CB 4.27Å; F111-I317 HydrophobicContact CZ-CG1 3.45Å; F111-I317 VanDerWaalsContact CZ-CG1 3.45Å; F111-L320 HydrophobicContact CD2-CD1 4.44Å; F111-L320 HydrophobicContact CE2-CD1 3.37Å; F111-L320 HydrophobicContact CZ-CD1 3.73Å |
| 112 | I | 93.3 | Very high | 92 | Very high | 97 Ų | 97 | 31.5 Ų | 31.5 | 50% | 0.497 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -60.1 | -44.1 | 177.4 | -68.3 | 167.7 | 0 | 0 | 0 | 110 | G108 V109 S110 L115 A116 F256 | G108-I112 WeakPolarHBondContact O-CG1 3.4Å; G108-I112 PolarHBondContact O-N 3.24Å; G108-I112 VanDerWaalsContact O-N 3.12Å; V109-I112 PolarHBondContact O-N 2.99Å; S110-I112 PolarHBondContact O-N 2.88Å; I112-L115 PolarHBondContact O-N 2.92Å; I112-A116 VanDerWaalsContact O-CB 3.27Å; I112-A116 WeakPolarHBondContact O-CB 3.4Å; I112-A116 PolarHBondContact O-N 2.72Å; I112-F256 HydrophobicContact CD1-CE1 3.97Å; I112-F256 HydrophobicContact CD1-CZ 4.3Å |
| 113 | I | 93.4 | Very high | 92.5 | Very high | 6 Ų | 6 | 34.8 Ų | 34.8 | 3% | 0.031 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -65.9 | -40.2 | 178.5 | -65.2 | -179.6 | 0 | 0 | 0 | 111.2 | L100 T104 V109 S110 F111 L115 A116 C117 I266 A269 F270 | L100-I113 HydrophobicContact CD1-CG2 4.06Å; L100-I113 HydrophobicContact CD2-CB 4.2Å; L100-I113 HydrophobicContact CD2-CG2 4.09Å; L100-I113 HydrophobicContact CG-CG2 4.46Å; T104-I113 HydrophobicContact CG2-CD1 3.57Å; V109-I113 HydrophobicContact CG1-CD1 4.24Å; V109-I113 WeakPolarHBondContact O-CG1 3.32Å; V109-I113 PolarHBondContact O-N 3.03Å; S110-I113 PolarHBondContact O-N 3.45Å; F111-I113 VanDerWaalsContact C-N 3.29Å; F111-I113 PolarHBondContact O-N 2.93Å; I113-L115 PolarHBondContact O-N 3.24Å; I113-A116 PolarHBondContact O-N 3.48Å; I113-C117 WeakPolarHBondContact O-CB 3.22Å; I113-C117 PolarHBondContact O-N 2.93Å; I113-C117 PolarHBondContact O-SG 2.91Å; I113-I266 HydrophobicContact CD1-CG2 4.43Å; I113-A269 HydrophobicContact CD1-CB 3.64Å; I113-A269 HydrophobicContact CG2-CB 4.38Å; I113-F270 HydrophobicContact CG1-CE2 4.38Å; I113-F270 HydrophobicContact CG2-CD1 4.35Å; I113-F270 HydrophobicContact CG2-CD2 4.43Å; I113-F270 HydrophobicContact CG2-CE1 4.39Å; I113-F270 HydrophobicContact CG2-CE2 4.48Å; I113-F270 HydrophobicContact CG2-CG 4.36Å; I113-F270 HydrophobicContact CG2-CZ 4.46Å |
| 114 | W | 93.8 | Very high | 92.8 | Very high | 2 Ų | 2 | 33.4 Ų | 33.4 | 1% | 0.008 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -57.4 | -46.1 | 174.3 | -91.7 | 114.4 | 0 | 0 | 0 | 112.9 | I93 P97 L100 S110 F111 G118 A276 Y277 Y312 N316 | I93-W114 HydrophobicContact CD1-CH2 3.8Å; I93-W114 HydrophobicContact CD1-CZ2 4.21Å; I93-W114 HydrophobicContact CD1-CZ3 4.27Å; P97-W114 HydrophobicContact CG-CZ2 4.11Å; L100-W114 HydrophobicContact CD2-CD2 4.16Å; L100-W114 HydrophobicContact CD2-CG 3.77Å; L100-W114 VanDerWaalsContact CD2-NE1 3.3Å; S110-W114 PolarHBondContact O-N 2.96Å; F111-W114 WeakPolarHBondContact O-CB 3.36Å; F111-W114 PolarHBondContact O-N 3.07Å; W114-G118 PolarHBondContact O-N 3.34Å; W114-A276 HydrophobicContact CH2-CB 3.33Å; W114-A276 HydrophobicContact CZ3-CB 3.47Å; W114-A276 VanDerWaalsContact CZ3-CB 3.47Å; W114-Y277 AromaticContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CZ3-CD2 4.41Å; W114-Y277 AromaticContact CZ3-CE2 3.89Å; W114-Y277 HydrophobicContact CZ3-CE2 3.89Å; W114-Y277 WeakPolarHBondContact O-CE2 3.21Å; W114-Y277 PolarHBondContact O-OH 3.14Å; W114-Y312 HydrophobicContact CE3-CD2 4.04Å; W114-Y312 HydrophobicContact CH2-CD2 4.38Å; W114-Y312 AromaticContact CZ3-CD2 3.48Å; W114-Y312 HydrophobicContact CZ3-CD2 3.48Å; W114-Y312 VanDerWaalsContact CZ3-CD2 3.48Å; W114-Y312 AromaticContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CG 4.16Å; W114-N316 PolarHBondContact NE1-ND2 3.02Å; W114-N316 PolarHBondContact NE1-OD1 3.46Å |
| 115 | L | 95.3 | Very high | 93.1 | Very high | 87 Ų | 87 | 33.3 Ų | 33.3 | 46% | 0.455 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -69.1 | -42 | 177.7 | -68.5 | 176.8 | 0 | 0 | 0 | 111.4 | F111 I112 I113 C117 G118 V119 T309 A313 | F111-L115 PolarHBondContact O-N 3.24Å; I112-L115 PolarHBondContact O-N 2.92Å; I113-L115 PolarHBondContact O-N 3.24Å; L115-C117 VanDerWaalsContact C-N 3.33Å; L115-C117 PolarHBondContact O-N 2.84Å; L115-G118 PolarHBondContact O-N 3.16Å; L115-V119 WeakPolarHBondContact O-CG2 3.49Å; L115-V119 PolarHBondContact O-N 3.3Å; L115-T309 HydrophobicContact CD2-CG2 4.17Å; L115-A313 HydrophobicContact CD2-CB 4.16Å |
| 116 | A | 96 | Very high | 93.6 | Very high | 30 Ų | 30 | 34.7 Ų | 34.7 | 25% | 0.248 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.6 | -42.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | I112 I113 G118 V119 L120 F270 | I112-A116 VanDerWaalsContact O-CB 3.27Å; I112-A116 WeakPolarHBondContact O-CB 3.4Å; I112-A116 PolarHBondContact O-N 2.72Å; I113-A116 PolarHBondContact O-N 3.48Å; A116-G118 VanDerWaalsContact C-N 3.34Å; A116-G118 PolarHBondContact O-N 3.47Å; A116-V119 PolarHBondContact O-N 3.22Å; A116-L120 WeakPolarHBondContact O-CB 3.48Å; A116-L120 VanDerWaalsContact O-CG 3.26Å; A116-L120 WeakPolarHBondContact O-CG 3.21Å; A116-L120 PolarHBondContact O-N 3.49Å; A116-F270 HydrophobicContact CB-CE1 3.85Å; A116-F270 HydrophobicContact CB-CZ 3.89Å |
| 117 | C | 95.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.4 | -44.7 | 174.2 | -68.4 | 0 | 0 | 0 | 0 | 111.4 | I113 L115 V119 L120 S121 F270 L274 Y277 | I113-C117 WeakPolarHBondContact O-CB 3.22Å; I113-C117 PolarHBondContact O-N 2.93Å; I113-C117 PolarHBondContact O-SG 2.91Å; L115-C117 VanDerWaalsContact C-N 3.33Å; L115-C117 PolarHBondContact O-N 2.84Å; C117-V119 PolarHBondContact O-N 2.91Å; C117-L120 PolarHBondContact O-N 3.38Å; C117-S121 WeakPolarHBondContact O-CB 3.5Å; C117-S121 PolarHBondContact O-N 3.02Å; C117-S121 PolarHBondContact O-OG 3.46Å; C117-F270 VanDerWaalsContact SG-CD1 3.55Å; C117-L274 HydrophobicContact CB-CD2 4.23Å; C117-Y277 HydrophobicContact CB-CD2 3.66Å; C117-Y277 HydrophobicContact CB-CE2 3.6Å |
| 118 | G | 95.4 | Very high | 94 | Very high | 1 Ų | 1 | 39.1 Ų | 39.1 | 1% | 0.01 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.4 | -39.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | W114 L115 A116 L122 Y277 | W114-G118 PolarHBondContact O-N 3.34Å; L115-G118 PolarHBondContact O-N 3.16Å; A116-G118 VanDerWaalsContact C-N 3.34Å; A116-G118 PolarHBondContact O-N 3.47Å; G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 2.93Å; G118-Y277 VanDerWaalsContact CA-CZ 3.45Å |
| 119 | V | 96.4 | Very high | 94.1 | Very high | 83 Ų | 83 | 39.1 Ų | 39.1 | 50% | 0.503 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -65.5 | -45.5 | 174.1 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | L115 A116 C117 S121 L122 L123 | L115-V119 WeakPolarHBondContact O-CG2 3.49Å; L115-V119 PolarHBondContact O-N 3.3Å; A116-V119 PolarHBondContact O-N 3.22Å; C117-V119 PolarHBondContact O-N 2.91Å; V119-S121 VanDerWaalsContact C-N 3.34Å; V119-S121 PolarHBondContact O-N 3Å; V119-L122 PolarHBondContact O-N 2.85Å; V119-L123 HydrophobicContact CG1-CD1 4.06Å; V119-L123 HydrophobicContact CG1-CG 4.38Å; V119-L123 WeakPolarHBondContact O-CG 3.44Å; V119-L123 PolarHBondContact O-N 2.97Å |
| 120 | L | 96.2 | Very high | 94.2 | Very high | 87 Ų | 87 | 44.6 Ų | 44.6 | 46% | 0.455 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.4 | -43.5 | 177 | -72.6 | 173.1 | 0 | 0 | 0 | 111.7 | A116 C117 L122 L123 G124 F270 | A116-L120 WeakPolarHBondContact O-CB 3.48Å; A116-L120 VanDerWaalsContact O-CG 3.26Å; A116-L120 WeakPolarHBondContact O-CG 3.21Å; A116-L120 PolarHBondContact O-N 3.49Å; C117-L120 PolarHBondContact O-N 3.38Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-L122 PolarHBondContact O-N 2.88Å; L120-L123 PolarHBondContact O-N 3.41Å; L120-G124 PolarHBondContact O-N 3.06Å; L120-F270 HydrophobicContact CD1-CD1 4.1Å; L120-F270 HydrophobicContact CD1-CE1 3.72Å |
| 121 | S | 95.4 | Very high | 94.2 | Very high | 3 Ų | 3 | 47.3 Ų | 47.3 | 2% | 0.021 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.9 | -38.4 | 175.8 | -59.9 | 0 | 0 | 0 | 0 | 112.2 | C117 V119 A125 Y277 | C117-S121 WeakPolarHBondContact O-CB 3.5Å; C117-S121 PolarHBondContact O-N 3.02Å; C117-S121 PolarHBondContact O-OG 3.46Å; V119-S121 VanDerWaalsContact C-N 3.34Å; V119-S121 PolarHBondContact O-N 3Å; S121-A125 WeakPolarHBondContact O-CB 3.47Å; S121-A125 PolarHBondContact O-N 3.09Å; S121-Y277 WeakPolarHBondContact OG-CB 3.3Å |
| 122 | L | 95.3 | Very high | 94 | Very high | 44 Ų | 44 | 45.6 Ų | 45.6 | 23% | 0.23 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.4 | -47.6 | 175.2 | 178.7 | 62.8 | 0 | 0 | 0 | 111.8 | G118 V119 L120 A125 L126 I301 I305 P306 | G118-L122 WeakPolarHBondContact O-CB 3.36Å; G118-L122 PolarHBondContact O-N 2.93Å; V119-L122 PolarHBondContact O-N 2.85Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-L122 PolarHBondContact O-N 2.88Å; L122-A125 PolarHBondContact O-N 3.37Å; L122-L126 HydrophobicContact CD1-CD1 4.28Å; L122-L126 HydrophobicContact CD1-CG 4.29Å; L122-L126 HydrophobicContact CG-CD1 4.18Å; L122-L126 VanDerWaalsContact O-CG 3.31Å; L122-L126 WeakPolarHBondContact O-CG 3.28Å; L122-L126 PolarHBondContact O-N 3.35Å; L122-I301 HydrophobicContact CD1-CG2 4.36Å; L122-I305 HydrophobicContact CB-CG2 3.93Å; L122-I305 HydrophobicContact CD1-CB 4.2Å; L122-I305 HydrophobicContact CD1-CD1 4.46Å; L122-I305 HydrophobicContact CD1-CG2 4.41Å; L122-P306 HydrophobicContact CD1-CG 4.33Å; L122-P306 HydrophobicContact CD2-CG 4.28Å |
| 123 | L | 96.2 | Very high | 93.8 | Very high | 104 Ų | 104 | 43.6 Ų | 43.6 | 55% | 0.545 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.8 | -44.1 | 178.9 | -66.8 | 175.9 | 0 | 0 | 0 | 111.4 | V119 L120 L126 A127 | V119-L123 HydrophobicContact CG1-CD1 4.06Å; V119-L123 HydrophobicContact CG1-CG 4.38Å; V119-L123 WeakPolarHBondContact O-CG 3.44Å; V119-L123 PolarHBondContact O-N 2.97Å; L120-L123 PolarHBondContact O-N 3.41Å; L123-L126 PolarHBondContact O-N 3.02Å; L123-A127 PolarHBondContact O-N 2.95Å; L123-A127 VanDerWaalsContact O-N 3.13Å |
| 124 | G | 94.5 | Very high | 93.6 | Very high | 24 Ų | 24 | 50.1 Ų | 50.1 | 25% | 0.247 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.9 | -44.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L120 L126 A127 Y128 | L120-G124 PolarHBondContact O-N 3.06Å; G124-L126 PolarHBondContact O-N 3.39Å; G124-A127 PolarHBondContact O-N 3.24Å; G124-Y128 VanDerWaalsContact O-CD2 3.3Å; G124-Y128 WeakPolarHBondContact O-CD2 3.24Å; G124-Y128 PolarHBondContact O-N 3.45Å |
| 125 | A | 94.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.9 | -34.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | S121 L122 Y128 A129 W280 I301 I305 | S121-A125 WeakPolarHBondContact O-CB 3.47Å; S121-A125 PolarHBondContact O-N 3.09Å; L122-A125 PolarHBondContact O-N 3.37Å; A125-Y128 CarbonylContact O-C 3.59Å; A125-Y128 PolarHBondContact O-N 3.46Å; A125-A129 WeakPolarHBondContact O-CB 3.25Å; A125-A129 PolarHBondContact O-N 2.99Å; A125-W280 HydrophobicContact CB-CB 4.48Å; A125-W280 HydrophobicContact CB-CD2 4.48Å; A125-W280 HydrophobicContact CB-CE3 3.72Å; A125-W280 HydrophobicContact CB-CZ3 4.43Å; A125-I301 HydrophobicContact CB-CD1 4.42Å; A125-I301 HydrophobicContact CB-CG2 3.57Å; A125-I305 HydrophobicContact CB-CD1 3.18Å |
| 126 | L | 94.1 | Very high | 92.4 | Very high | 67 Ų | 67 | 49.5 Ų | 49.5 | 35% | 0.351 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.6 | -42 | 175.4 | -73.8 | 172.2 | 0 | 0 | 0 | 111.9 | L122 L123 G124 Y128 A129 E130 I301 I302 | L122-L126 HydrophobicContact CD1-CD1 4.28Å; L122-L126 HydrophobicContact CD1-CG 4.29Å; L122-L126 HydrophobicContact CG-CD1 4.18Å; L122-L126 VanDerWaalsContact O-CG 3.31Å; L122-L126 WeakPolarHBondContact O-CG 3.28Å; L122-L126 PolarHBondContact O-N 3.35Å; L123-L126 PolarHBondContact O-N 3.02Å; G124-L126 PolarHBondContact O-N 3.39Å; L126-Y128 VanDerWaalsContact C-N 3.28Å; L126-Y128 PolarHBondContact O-N 3.43Å; L126-A129 WeakPolarHBondContact O-CB 3.31Å; L126-A129 PolarHBondContact O-N 2.96Å; L126-A129 VanDerWaalsContact O-N 3.13Å; L126-E130 PolarHBondContact O-N 3.4Å; L126-E130 VanDerWaalsContact O-N 3.14Å; L126-I301 HydrophobicContact CD2-CG2 4.36Å; L126-I302 HydrophobicContact CD2-CD1 4.23Å; L126-I302 HydrophobicContact CD2-CG1 3.9Å |
| 127 | A | 94.2 | Very high | 91.6 | Very high | 51 Ų | 51 | 49.9 Ų | 49.9 | 42% | 0.421 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.9 | -40 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | L123 G124 A129 E130 L131 | L123-A127 PolarHBondContact O-N 2.95Å; L123-A127 VanDerWaalsContact O-N 3.13Å; G124-A127 PolarHBondContact O-N 3.24Å; A127-A129 VanDerWaalsContact C-N 3.34Å; A127-E130 PolarHBondContact O-N 3.4Å; A127-L131 PolarHBondContact O-N 2.95Å |
| 128 | Y | 91.9 | Very high | 90.5 | Very high | 60 Ų | 60 | 49.9 Ų | 49.9 | 24% | 0.235 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -69.4 | -31.2 | 174.4 | -88.8 | -126.6 | 0 | 0 | 0 | 112.7 | G124 A125 L126 E130 L131 G132 E141 Y144 W280 N281 N284 | G124-Y128 VanDerWaalsContact O-CD2 3.3Å; G124-Y128 WeakPolarHBondContact O-CD2 3.24Å; G124-Y128 PolarHBondContact O-N 3.45Å; A125-Y128 CarbonylContact O-C 3.59Å; A125-Y128 PolarHBondContact O-N 3.46Å; L126-Y128 VanDerWaalsContact C-N 3.28Å; L126-Y128 PolarHBondContact O-N 3.43Å; Y128-E130 VanDerWaalsContact C-N 3.33Å; Y128-L131 PolarHBondContact O-N 3.46Å; Y128-G132 PolarHBondContact O-N 3.39Å; Y128-E141 HydrophobicContact CE1-CG 3.5Å; Y128-E141 VanDerWaalsContact CE1-CG 3.5Å; Y128-E141 WeakPolarHBondContact CE1-OE1 3.45Å; Y128-E141 WeakPolarHBondContact OH-CG 3.36Å; Y128-Y144 HydrophobicContact CD1-CE2 4.13Å; Y128-Y144 HydrophobicContact CE1-CE2 4.39Å; Y128-W280 HydrophobicContact CD1-CH2 4.28Å; Y128-W280 AromaticContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD2-CH2 4.03Å; Y128-W280 AromaticContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CE1-CH2 4.15Å; Y128-W280 HydrophobicContact CE1-CZ3 4.2Å; Y128-W280 AromaticContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CZ3 4.22Å; Y128-W280 HydrophobicContact CG-CH2 4.22Å; Y128-W280 AromaticContact CG-CZ3 3.69Å; Y128-W280 HydrophobicContact CG-CZ3 3.69Å; Y128-N281 HydrophobicContact CD1-CB 4.13Å; Y128-N281 HydrophobicContact CE1-CB 4.23Å; Y128-N284 PolarHBondContact O-ND2 3.29Å |
| 129 | A | 91.8 | Very high | 89.6 | Confident | 5 Ų | 5 | 49.9 Ų | 49.9 | 4% | 0.041 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62.9 | -44.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | A125 L126 A127 G132 T133 P298 I301 | A125-A129 WeakPolarHBondContact O-CB 3.25Å; A125-A129 PolarHBondContact O-N 2.99Å; L126-A129 WeakPolarHBondContact O-CB 3.31Å; L126-A129 PolarHBondContact O-N 2.96Å; L126-A129 VanDerWaalsContact O-N 3.13Å; A127-A129 VanDerWaalsContact C-N 3.34Å; A129-G132 PolarHBondContact O-N 3.46Å; A129-T133 WeakPolarHBondContact O-CG2 3.25Å; A129-T133 PolarHBondContact O-N 3.24Å; A129-T133 PolarHBondContact O-OG1 2.93Å; A129-P298 HydrophobicContact CB-CB 4.44Å; A129-I301 HydrophobicContact CB-CD1 3.69Å |
| 130 | E | 92.8 | Very high | 89.1 | Confident | 145 Ų | 145 | 45.9 Ų | 45.9 | 68% | 0.678 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -57.3 | -52.3 | 175 | -174.4 | 175.9 | -176.1 | 0 | 0 | 110.9 | L126 A127 Y128 G132 T133 M134 | L126-E130 PolarHBondContact O-N 3.4Å; L126-E130 VanDerWaalsContact O-N 3.14Å; A127-E130 PolarHBondContact O-N 3.4Å; Y128-E130 VanDerWaalsContact C-N 3.33Å; E130-G132 PolarHBondContact O-N 2.9Å; E130-T133 PolarHBondContact O-N 3.36Å; E130-T133 VanDerWaalsContact O-N 3.12Å; E130-T133 PolarHBondContact O-OG1 3.02Å; E130-M134 PolarHBondContact O-N 3.41Å |
| 131 | L | 91.3 | Very high | 88.8 | Confident | 62 Ų | 62 | 42.1 Ų | 42.1 | 33% | 0.325 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -57.9 | -44 | 176.8 | -67.7 | 173.1 | 0 | 0 | 0 | 112.7 | A127 Y128 T133 M134 N135 Y144 | A127-L131 PolarHBondContact O-N 2.95Å; Y128-L131 PolarHBondContact O-N 3.46Å; L131-T133 VanDerWaalsContact C-N 3.3Å; L131-T133 PolarHBondContact O-N 3.39Å; L131-M134 HydrophobicContact CD2-CE 4.2Å; L131-M134 PolarHBondContact O-N 3.16Å; L131-N135 PolarHBondContact O-N 3.24Å; L131-Y144 HydrophobicContact CB-CD1 4.06Å; L131-Y144 HydrophobicContact CB-CD2 4.02Å; L131-Y144 HydrophobicContact CB-CE1 3.85Å; L131-Y144 HydrophobicContact CB-CE2 3.79Å; L131-Y144 HydrophobicContact CB-CG 4.17Å; L131-Y144 HydrophobicContact CD1-CD2 3.82Å; L131-Y144 HydrophobicContact CD1-CE2 4.18Å; L131-Y144 HydrophobicContact CD1-CG 4.25Å |
| 132 | G | 87.1 | Confident | 88.5 | Confident | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -71.2 | -22.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114 | Y128 A129 E130 N135 Y144 T287 | Y128-G132 PolarHBondContact O-N 3.39Å; A129-G132 PolarHBondContact O-N 3.46Å; E130-G132 PolarHBondContact O-N 2.9Å; G132-N135 CarbonylContact O-C 3.59Å; G132-Y144 WeakPolarHBondContact CA-OH 3.34Å; G132-Y144 PolarHBondContact N-OH 3Å; G132-T287 WeakPolarHBondContact O-CG2 3.28Å |
| 133 | T | 89 | Confident | 88.2 | Confident | 54 Ų | 54 | 40.5 Ų | 40.5 | 33% | 0.331 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -83 | -27.2 | 170.4 | 58.3 | 0 | 0 | 0 | 0 | 113.1 | A129 E130 L131 L297 | A129-T133 WeakPolarHBondContact O-CG2 3.25Å; A129-T133 PolarHBondContact O-N 3.24Å; A129-T133 PolarHBondContact O-OG1 2.93Å; E130-T133 PolarHBondContact O-N 3.36Å; E130-T133 VanDerWaalsContact O-N 3.12Å; E130-T133 PolarHBondContact O-OG1 3.02Å; L131-T133 VanDerWaalsContact C-N 3.3Å; L131-T133 PolarHBondContact O-N 3.39Å; T133-L297 HydrophobicContact CG2-CD2 4.17Å |
| 134 | M | 89.4 | Confident | 87.9 | Confident | 143 Ų | 143 | 36.5 Ų | 36.5 | 70% | 0.704 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -76.4 | -51.4 | 175.3 | -173.5 | 179.4 | 72.3 | 0 | 0 | 111.2 | E130 L131 | E130-M134 PolarHBondContact O-N 3.41Å; L131-M134 HydrophobicContact CD2-CE 4.2Å; L131-M134 PolarHBondContact O-N 3.16Å |
| 135 | N | 85.4 | Confident | 87.8 | Confident | 21 Ų | 21 | 38.5 Ų | 38.5 | 11% | 0.112 | 20% | 0.204 | C | C | . | . | trans | -109.6 | 104.6 | 171.9 | -172.8 | -7.8 | 0 | 0 | 0 | 109.9 | L131 G132 S137 Y144 D147 | L131-N135 PolarHBondContact O-N 3.24Å; G132-N135 CarbonylContact O-C 3.59Å; N135-S137 PolarHBondContact O-N 3.11Å; N135-S137 WeakPolarHBondContact OD1-CB 3.45Å; N135-S137 PolarHBondContact OD1-N 2.95Å; N135-S137 PolarHBondContact OD1-OG 3.2Å; N135-Y144 HydrophobicContact CB-CD1 4.49Å; N135-Y144 HydrophobicContact CB-CE1 4.46Å; N135-D147 PolarHBondContact ND2-OD2 3.27Å | ||
| 136 | T | 79.3 | Confident | 87.6 | Confident | 55 Ų | 55 | 41 Ų | 41 | 34% | 0.337 | 22% | 0.216 | S | C | . | . | trans | -84.5 | 8 | -179.7 | 60.4 | 0 | 0 | 0 | 0 | 114 | T287 E288 P293 | T136-T287 HydrophobicContact CG2-CG2 4.32Å; T136-E288 WeakPolarHBondContact O-CG 3.43Å; T136-P293 HydrophobicContact CG2-CB 4.44Å; T136-P293 HydrophobicContact CG2-CG 4.01Å | ||
| 137 | S | 77.4 | Confident | 87.3 | Confident | 38 Ų | 38 | 42.8 Ų | 42.8 | 27% | 0.266 | 23% | 0.226 | S | C | . | . | trans | -69.8 | 153.1 | 178.4 | -53.2 | 0 | 0 | 0 | 0 | 112 | N135 E288 | N135-S137 PolarHBondContact O-N 3.11Å; N135-S137 WeakPolarHBondContact OD1-CB 3.45Å; N135-S137 PolarHBondContact OD1-N 2.95Å; N135-S137 PolarHBondContact OD1-OG 3.2Å; S137-E288 VanDerWaalsContact CA-OE1 3.29Å; S137-E288 WeakPolarHBondContact CA-OE1 3.31Å | ||
| 138 | S | 74.3 | Confident | 87.3 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.007 | 23% | 0.234 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | 149.3 | 175.5 | 178.7 | 0 | 0 | 0 | 0 | 109.8 | Y285 E288 A375 | S138-Y285 PolarHBondContact OG-O 3.4Å; S138-E288 VanDerWaalsContact CB-CD 3.44Å; S138-E288 VanDerWaalsContact N-CG 3.32Å; S138-E288 PolarHBondContact N-OE1 3.09Å; S138-A375 WeakPolarHBondContact O-CB 3.07Å |
| 139 | G | 75.8 | Confident | 87.3 | Confident | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 25% | 0.254 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 108.3 | -5.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | E141 W142 | G139-E141 PolarHBondContact O-N 3.06Å; G139-W142 WeakPolarHBondContact O-CB 3.26Å; G139-W142 PolarHBondContact O-N 3.16Å |
| 140 | A | 86.6 | Confident | 87.3 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 26% | 0.261 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 48.9 | -114.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | W142 A143 Y144 N284 Y285 | A140-W142 PolarHBondContact O-N 3.4Å; A140-W142 VanDerWaalsContact O-N 3.16Å; A140-A143 WeakPolarHBondContact O-CA 3.29Å; A140-A143 WeakPolarHBondContact O-CB 3.41Å; A140-A143 PolarHBondContact O-N 3.28Å; A140-Y144 WeakPolarHBondContact O-CD1 3.41Å; A140-Y144 PolarHBondContact O-N 2.87Å; A140-Y144 VanDerWaalsContact O-N 3.07Å; A140-N284 HydrophobicContact CB-CB 3.84Å; A140-Y285 HydrophobicContact CB-CD1 3.74Å; A140-Y285 HydrophobicContact CB-CD2 3.86Å; A140-Y285 HydrophobicContact CB-CE1 3.91Å; A140-Y285 HydrophobicContact CB-CE2 4.04Å; A140-Y285 HydrophobicContact CB-CG 3.74Å |
| 141 | E | 89.4 | Confident | 87.2 | Confident | 8 Ų | 8 | 46.1 Ų | 46.1 | 4% | 0.037 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.9 | -32.9 | -174.6 | -58.5 | 88.5 | 157.6 | 0 | 0 | 112.6 | Y128 G139 A143 Y144 F145 F157 N281 Y285 | Y128-E141 HydrophobicContact CE1-CG 3.5Å; Y128-E141 VanDerWaalsContact CE1-CG 3.5Å; Y128-E141 WeakPolarHBondContact CE1-OE1 3.45Å; Y128-E141 WeakPolarHBondContact OH-CG 3.36Å; G139-E141 PolarHBondContact O-N 3.06Å; E141-A143 VanDerWaalsContact C-N 3.31Å; E141-A143 PolarHBondContact O-N 3.05Å; E141-Y144 PolarHBondContact O-N 3.43Å; E141-F145 HydrophobicContact CB-CD2 4.3Å; E141-F145 HydrophobicContact CB-CE2 4.12Å; E141-F145 WeakPolarHBondContact O-CB 3.5Å; E141-F145 WeakPolarHBondContact O-CD2 3.49Å; E141-F145 WeakPolarHBondContact O-CG 3.49Å; E141-F145 PolarHBondContact O-N 3.07Å; E141-F157 HydrophobicContact CB-CD1 4.27Å; E141-F157 HydrophobicContact CB-CD2 4.49Å; E141-F157 HydrophobicContact CB-CE1 3.67Å; E141-F157 HydrophobicContact CB-CE2 3.88Å; E141-F157 HydrophobicContact CB-CZ 3.45Å; E141-F157 VanDerWaalsContact CB-CZ 3.45Å; E141-F157 HydrophobicContact CG-CE2 4.33Å; E141-F157 HydrophobicContact CG-CZ 4.01Å; E141-N281 PolarHBondContact OE1-ND2 3.48Å; E141-Y285 PolarHBondContact OE1-OH 3.22Å; E141-Y285 WeakPolarHBondContact OE2-CE1 3.35Å; E141-Y285 WeakPolarHBondContact OE2-CE2 2.9Å; E141-Y285 PolarHBondContact OE2-OH 3.37Å |
| 142 | W | 89.3 | Confident | 87.2 | Confident | 9 Ų | 9 | 46.3 Ų | 46.3 | 3% | 0.034 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.2 | -45.1 | 174.6 | 174.5 | 82.5 | 0 | 0 | 0 | 111.2 | G139 A140 F145 M146 A154 F157 L372 A375 A376 E379 H381 | G139-W142 WeakPolarHBondContact O-CB 3.26Å; G139-W142 PolarHBondContact O-N 3.16Å; A140-W142 PolarHBondContact O-N 3.4Å; A140-W142 VanDerWaalsContact O-N 3.16Å; W142-F145 PolarHBondContact O-N 3.32Å; W142-M146 HydrophobicContact CH2-CB 4.4Å; W142-M146 HydrophobicContact CH2-CG 4.25Å; W142-M146 HydrophobicContact CZ2-CG 4.43Å; W142-M146 WeakPolarHBondContact O-CB 3.4Å; W142-M146 PolarHBondContact O-N 3.35Å; W142-A154 VanDerWaalsContact CD1-O 3.29Å; W142-F157 HydrophobicContact CB-CD1 4.01Å; W142-F157 HydrophobicContact CB-CE1 4.18Å; W142-L372 HydrophobicContact CB-CD1 3.75Å; W142-A375 HydrophobicContact CE3-CB 4.11Å; W142-A375 HydrophobicContact CZ3-CB 4.48Å; W142-A376 HydrophobicContact CD2-CB 4.25Å; W142-A376 HydrophobicContact CG-CB 4.2Å; W142-E379 HydrophobicContact CH2-CB 3.82Å; W142-E379 HydrophobicContact CH2-CG 3.5Å; W142-E379 HydrophobicContact CZ2-CB 3.74Å; W142-E379 HydrophobicContact CZ2-CG 3.98Å; W142-E379 HydrophobicContact CZ3-CG 4.42Å; W142-H381 AromaticContact NE1-ND1 3.61Å |
| 143 | A | 87.7 | Confident | 87.4 | Confident | 3 Ų | 3 | 48.7 Ų | 48.7 | 3% | 0.025 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -68.5 | -38.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | A140 E141 M146 D147 | A140-A143 WeakPolarHBondContact O-CA 3.29Å; A140-A143 WeakPolarHBondContact O-CB 3.41Å; A140-A143 PolarHBondContact O-N 3.28Å; E141-A143 VanDerWaalsContact C-N 3.31Å; E141-A143 PolarHBondContact O-N 3.05Å; A143-M146 WeakPolarHBondContact O-CB 3.46Å; A143-M146 PolarHBondContact O-N 3.5Å; A143-D147 PolarHBondContact O-N 3.45Å |
| 144 | Y | 91.2 | Very high | 87.4 | Confident | 21 Ų | 21 | 46.1 Ų | 46.1 | 8% | 0.082 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -65.8 | -40.9 | 177.2 | -49.5 | -26.5 | 0 | 0 | 0 | 112 | Y128 L131 G132 N135 A140 E141 M146 D147 A148 N284 | Y128-Y144 HydrophobicContact CD1-CE2 4.13Å; Y128-Y144 HydrophobicContact CE1-CE2 4.39Å; L131-Y144 HydrophobicContact CB-CD1 4.06Å; L131-Y144 HydrophobicContact CB-CD2 4.02Å; L131-Y144 HydrophobicContact CB-CE1 3.85Å; L131-Y144 HydrophobicContact CB-CE2 3.79Å; L131-Y144 HydrophobicContact CB-CG 4.17Å; L131-Y144 HydrophobicContact CD1-CD2 3.82Å; L131-Y144 HydrophobicContact CD1-CE2 4.18Å; L131-Y144 HydrophobicContact CD1-CG 4.25Å; G132-Y144 WeakPolarHBondContact CA-OH 3.34Å; G132-Y144 PolarHBondContact N-OH 3Å; N135-Y144 HydrophobicContact CB-CD1 4.49Å; N135-Y144 HydrophobicContact CB-CE1 4.46Å; A140-Y144 WeakPolarHBondContact O-CD1 3.41Å; A140-Y144 PolarHBondContact O-N 2.87Å; A140-Y144 VanDerWaalsContact O-N 3.07Å; E141-Y144 PolarHBondContact O-N 3.43Å; Y144-M146 VanDerWaalsContact C-N 3.32Å; Y144-D147 PolarHBondContact O-N 3.32Å; Y144-A148 VanDerWaalsContact O-CB 3.27Å; Y144-A148 WeakPolarHBondContact O-CB 3.36Å; Y144-A148 PolarHBondContact O-N 3.29Å; Y144-N284 PolarHBondContact OH-ND2 3.45Å |
| 145 | F | 91.5 | Very high | 87.4 | Confident | 66 Ų | 66 | 43.3 Ų | 43.3 | 29% | 0.289 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -65.5 | -38 | 174.6 | -75.2 | -53.7 | 0 | 0 | 0 | 111.8 | E141 W142 Y149 G150 A154 F157 | E141-F145 HydrophobicContact CB-CD2 4.3Å; E141-F145 HydrophobicContact CB-CE2 4.12Å; E141-F145 WeakPolarHBondContact O-CB 3.5Å; E141-F145 WeakPolarHBondContact O-CD2 3.49Å; E141-F145 WeakPolarHBondContact O-CG 3.49Å; E141-F145 PolarHBondContact O-N 3.07Å; W142-F145 PolarHBondContact O-N 3.32Å; F145-Y149 AromaticContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CE2 4.06Å; F145-Y149 HydrophobicContact CE1-CD2 4.41Å; F145-Y149 HydrophobicContact CE1-CE2 4.3Å; F145-Y149 CarbonylContact O-C 3.47Å; F145-Y149 PolarHBondContact O-N 2.98Å; F145-G150 PolarHBondContact O-N 3.04Å; F145-G150 VanDerWaalsContact O-N 3.1Å; F145-A154 HydrophobicContact CB-CB 3.96Å; F145-F157 HydrophobicContact CD2-CB 3.66Å; F145-F157 HydrophobicContact CD2-CD1 4.19Å; F145-F157 HydrophobicContact CD2-CD2 4.13Å; F145-F157 AromaticContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CE2-CB 3.84Å; F145-F157 HydrophobicContact CE2-CD1 4.43Å; F145-F157 AromaticContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CE2 4.28Å; F145-F157 AromaticContact CE2-CG 3.67Å; F145-F157 HydrophobicContact CE2-CG 3.67Å |
| 146 | M | 89.1 | Confident | 87.7 | Confident | 53 Ų | 53 | 47.4 Ų | 47.4 | 26% | 0.261 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.7 | -45.7 | 177 | -167.5 | 64.4 | 171.1 | 0 | 0 | 111.2 | W142 A143 Y144 G150 P151 A154 | W142-M146 HydrophobicContact CH2-CB 4.4Å; W142-M146 HydrophobicContact CH2-CG 4.25Å; W142-M146 HydrophobicContact CZ2-CG 4.43Å; W142-M146 WeakPolarHBondContact O-CB 3.4Å; W142-M146 PolarHBondContact O-N 3.35Å; A143-M146 WeakPolarHBondContact O-CB 3.46Å; A143-M146 PolarHBondContact O-N 3.5Å; Y144-M146 VanDerWaalsContact C-N 3.32Å; M146-G150 VanDerWaalsContact O-CA 3.31Å; M146-G150 WeakPolarHBondContact O-CA 3.31Å; M146-G150 PolarHBondContact O-N 3.11Å; M146-P151 HydrophobicContact CE-CB 4.26Å; M146-P151 HydrophobicContact SD-CB 4.09Å; M146-A154 HydrophobicContact CB-CB 4.18Å; M146-A154 HydrophobicContact SD-CB 4.19Å |
| 147 | D | 89.6 | Confident | 88.2 | Confident | 103 Ų | 103 | 46.6 Ų | 46.6 | 55% | 0.551 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -69.8 | -40.6 | 179.7 | -68 | -16.2 | 0 | 0 | 0 | 112.9 | N135 A143 Y144 | N135-D147 PolarHBondContact ND2-OD2 3.27Å; A143-D147 PolarHBondContact O-N 3.45Å; Y144-D147 PolarHBondContact O-N 3.32Å |
| 148 | A | 93.1 | Very high | 88.6 | Confident | 71 Ų | 71 | 44.8 Ų | 44.8 | 59% | 0.587 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -88.2 | -38.5 | -171.5 | 0 | 0 | 0 | 0 | 0 | 114 | Y144 | Y144-A148 VanDerWaalsContact O-CB 3.27Å; Y144-A148 WeakPolarHBondContact O-CB 3.36Å; Y144-A148 PolarHBondContact O-N 3.29Å |
| 149 | Y | 92.8 | Very high | 89.2 | Confident | 169 Ų | 169 | 51.1 Ų | 51.1 | 66% | 0.663 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -126.9 | -4.4 | -171.1 | -54.5 | -84.2 | 0 | 0 | 0 | 113.9 | F145 | F145-Y149 AromaticContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CD2 3.76Å; F145-Y149 HydrophobicContact CD1-CE2 4.06Å; F145-Y149 HydrophobicContact CE1-CD2 4.41Å; F145-Y149 HydrophobicContact CE1-CE2 4.3Å; F145-Y149 CarbonylContact O-C 3.47Å; F145-Y149 PolarHBondContact O-N 2.98Å |
| 150 | G | 90.9 | Very high | 89.8 | Confident | 19 Ų | 19 | 54.2 Ų | 54.2 | 20% | 0.196 | 29% | 0.289 | C | S | . | . | trans | 81.5 | -165.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | F145 M146 A152 | F145-G150 PolarHBondContact O-N 3.04Å; F145-G150 VanDerWaalsContact O-N 3.1Å; M146-G150 VanDerWaalsContact O-CA 3.31Å; M146-G150 WeakPolarHBondContact O-CA 3.31Å; M146-G150 PolarHBondContact O-N 3.11Å; G150-A152 PolarHBondContact O-N 3.32Å | ||
| 151 | P | 90.6 | Very high | 89.8 | Confident | 72 Ų | 72 | 54.3 Ų | 54.3 | 47% | 0.468 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -74 | -32.9 | -161.6 | 24.7 | -33.3 | 0 | 0 | 0 | 115 | M146 A154 F155 | M146-P151 HydrophobicContact CE-CB 4.26Å; M146-P151 HydrophobicContact SD-CB 4.09Å; P151-A154 PolarHBondContact O-N 3.48Å; P151-F155 VanDerWaalsContact O-CB 3.31Å; P151-F155 WeakPolarHBondContact O-CB 3.32Å; P151-F155 PolarHBondContact O-N 2.9Å |
| 152 | A | 91.4 | Very high | 89.4 | Confident | 67 Ų | 67 | 54 Ų | 54 | 55% | 0.554 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -67.2 | -49.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | G150 A154 F155 L156 | G150-A152 PolarHBondContact O-N 3.32Å; A152-A154 PolarHBondContact O-N 3.41Å; A152-F155 PolarHBondContact O-N 3.28Å; A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 3.38Å |
| 153 | P | 92.3 | Very high | 89 | Confident | 49 Ų | 49 | 55.2 Ų | 55.2 | 32% | 0.318 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64.6 | -37 | 173.2 | -26 | 39.2 | 0 | 0 | 0 | 113.1 | F155 L156 F157 | P153-F155 PolarHBondContact O-N 3.48Å; P153-L156 PolarHBondContact O-N 3.14Å; P153-F157 PolarHBondContact O-N 2.88Å |
| 154 | A | 89.3 | Confident | 88.8 | Confident | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.7 | -41.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | W142 F145 M146 P151 A152 S158 | W142-A154 VanDerWaalsContact CD1-O 3.29Å; F145-A154 HydrophobicContact CB-CB 3.96Å; M146-A154 HydrophobicContact CB-CB 4.18Å; M146-A154 HydrophobicContact SD-CB 4.19Å; P151-A154 PolarHBondContact O-N 3.48Å; A152-A154 PolarHBondContact O-N 3.41Å; A154-S158 WeakPolarHBondContact O-CB 3.36Å; A154-S158 PolarHBondContact O-N 3.14Å |
| 155 | F | 88.6 | Confident | 88.5 | Confident | 85 Ų | 85 | 61.7 Ų | 61.7 | 37% | 0.373 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.8 | -47.9 | 174.1 | 174.1 | -96.3 | 0 | 0 | 0 | 111.9 | P151 A152 P153 F157 S158 W159 H381 | P151-F155 VanDerWaalsContact O-CB 3.31Å; P151-F155 WeakPolarHBondContact O-CB 3.32Å; P151-F155 PolarHBondContact O-N 2.9Å; A152-F155 PolarHBondContact O-N 3.28Å; P153-F155 PolarHBondContact O-N 3.48Å; F155-F157 VanDerWaalsContact C-N 3.32Å; F155-F157 PolarHBondContact O-N 2.97Å; F155-S158 PolarHBondContact O-N 3.19Å; F155-S158 VanDerWaalsContact O-N 3.17Å; F155-W159 HydrophobicContact CZ-CE3 4.47Å; F155-W159 WeakPolarHBondContact O-CB 3.41Å; F155-W159 PolarHBondContact O-N 3.04Å; F155-H381 HydrophobicContact CD2-CB 4.09Å; F155-H381 WeakPolarHBondContact CD2-O 3.33Å; F155-H381 VanDerWaalsContact CE2-O 3.22Å; F155-H381 WeakPolarHBondContact CE2-O 3.3Å |
| 156 | L | 91 | Very high | 88.1 | Confident | 107 Ų | 107 | 59 Ų | 59 | 56% | 0.56 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -58.8 | -43.8 | 178 | -74.2 | 172.9 | 0 | 0 | 0 | 111.8 | A152 P153 W159 V160 | A152-L156 WeakPolarHBondContact O-CG 3.45Å; A152-L156 PolarHBondContact O-N 3.38Å; P153-L156 PolarHBondContact O-N 3.14Å; L156-W159 PolarHBondContact O-N 3.47Å; L156-V160 WeakPolarHBondContact O-CG2 3.17Å; L156-V160 PolarHBondContact O-N 2.97Å |
| 157 | F | 90.1 | Very high | 87.9 | Confident | 37 Ų | 37 | 56.8 Ų | 56.8 | 16% | 0.162 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.2 | -47.6 | 174.8 | 173.5 | -97.1 | 0 | 0 | 0 | 111.7 | E141 W142 F145 P153 F155 W159 V160 S161 L372 | E141-F157 HydrophobicContact CB-CD1 4.27Å; E141-F157 HydrophobicContact CB-CD2 4.49Å; E141-F157 HydrophobicContact CB-CE1 3.67Å; E141-F157 HydrophobicContact CB-CE2 3.88Å; E141-F157 HydrophobicContact CB-CZ 3.45Å; E141-F157 VanDerWaalsContact CB-CZ 3.45Å; E141-F157 HydrophobicContact CG-CE2 4.33Å; E141-F157 HydrophobicContact CG-CZ 4.01Å; W142-F157 HydrophobicContact CB-CD1 4.01Å; W142-F157 HydrophobicContact CB-CE1 4.18Å; F145-F157 HydrophobicContact CD2-CB 3.66Å; F145-F157 HydrophobicContact CD2-CD1 4.19Å; F145-F157 HydrophobicContact CD2-CD2 4.13Å; F145-F157 AromaticContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CD2-CG 3.71Å; F145-F157 HydrophobicContact CE2-CB 3.84Å; F145-F157 HydrophobicContact CE2-CD1 4.43Å; F145-F157 AromaticContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CD2 3.59Å; F145-F157 HydrophobicContact CE2-CE2 4.28Å; F145-F157 AromaticContact CE2-CG 3.67Å; F145-F157 HydrophobicContact CE2-CG 3.67Å; P153-F157 PolarHBondContact O-N 2.88Å; F155-F157 VanDerWaalsContact C-N 3.32Å; F155-F157 PolarHBondContact O-N 2.97Å; F157-W159 VanDerWaalsContact C-N 3.31Å; F157-W159 PolarHBondContact O-N 3.23Å; F157-V160 PolarHBondContact O-N 3.38Å; F157-S161 WeakPolarHBondContact CE2-OG 3.47Å; F157-S161 WeakPolarHBondContact CZ-OG 3.28Å; F157-S161 WeakPolarHBondContact O-CB 3.35Å; F157-S161 PolarHBondContact O-N 3.49Å; F157-S161 PolarHBondContact O-OG 2.95Å; F157-L372 HydrophobicContact CE1-CD1 3.99Å |
| 158 | S | 86.8 | Confident | 87.7 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.1 | -43.8 | 178.6 | -174.4 | 0 | 0 | 0 | 0 | 111.7 | A154 F155 T162 A376 L382 | A154-S158 WeakPolarHBondContact O-CB 3.36Å; A154-S158 PolarHBondContact O-N 3.14Å; F155-S158 PolarHBondContact O-N 3.19Å; F155-S158 VanDerWaalsContact O-N 3.17Å; S158-T162 WeakPolarHBondContact O-CB 3.42Å; S158-T162 PolarHBondContact O-N 3.48Å; S158-T162 PolarHBondContact O-OG1 3.36Å; S158-A376 VanDerWaalsContact OG-CB 3.26Å; S158-A376 WeakPolarHBondContact OG-CB 3.41Å; S158-L382 WeakPolarHBondContact OG-CD1 3.5Å |
| 159 | W | 86.7 | Confident | 87.3 | Confident | 135 Ų | 135 | 52.4 Ų | 52.4 | 51% | 0.511 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.2 | -54.1 | 178 | 179.5 | -99.1 | 0 | 0 | 0 | 112 | F155 L156 F157 L163 | F155-W159 HydrophobicContact CZ-CE3 4.47Å; F155-W159 WeakPolarHBondContact O-CB 3.41Å; F155-W159 PolarHBondContact O-N 3.04Å; L156-W159 PolarHBondContact O-N 3.47Å; F157-W159 VanDerWaalsContact C-N 3.31Å; F157-W159 PolarHBondContact O-N 3.23Å; W159-L163 HydrophobicContact CD2-CD1 3.43Å; W159-L163 VanDerWaalsContact CD2-CD1 3.43Å; W159-L163 HydrophobicContact CD2-CG 4.45Å; W159-L163 HydrophobicContact CE3-CD1 3.65Å; W159-L163 HydrophobicContact CG-CD1 4.15Å; W159-L163 HydrophobicContact CH2-CD1 3.51Å; W159-L163 HydrophobicContact CZ2-CD1 3.26Å; W159-L163 HydrophobicContact CZ3-CD1 3.69Å; W159-L163 VanDerWaalsContact O-CB 3.31Å; W159-L163 WeakPolarHBondContact O-CB 3.45Å; W159-L163 WeakPolarHBondContact O-CG 3.49Å; W159-L163 PolarHBondContact O-N 3.31Å |
| 160 | V | 88.8 | Confident | 87 | Confident | 64 Ų | 64 | 44.9 Ų | 44.9 | 39% | 0.388 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -65.1 | -44 | -179 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | L156 F157 T162 V164 L165 | L156-V160 WeakPolarHBondContact O-CG2 3.17Å; L156-V160 PolarHBondContact O-N 2.97Å; F157-V160 PolarHBondContact O-N 3.38Å; V160-T162 PolarHBondContact O-N 3.33Å; V160-V164 WeakPolarHBondContact O-CA 3.45Å; V160-V164 VanDerWaalsContact O-CB 3.3Å; V160-V164 WeakPolarHBondContact O-CB 3.36Å; V160-V164 PolarHBondContact O-N 2.9Å; V160-L165 HydrophobicContact CG1-CD1 4.32Å; V160-L165 HydrophobicContact CG1-CG 4.16Å; V160-L165 PolarHBondContact O-N 3.33Å; V160-L165 VanDerWaalsContact O-N 3.1Å |
| 161 | S | 85.6 | Confident | 86.7 | Confident | 2 Ų | 2 | 44.5 Ų | 44.5 | 1% | 0.014 | 25% | 0.247 | C | C | . | . | I | π-helix | trans | -65.6 | -42 | -178.8 | -67.3 | 0 | 0 | 0 | 0 | 112.4 | F157 L165 K166 | F157-S161 WeakPolarHBondContact CE2-OG 3.47Å; F157-S161 WeakPolarHBondContact CZ-OG 3.28Å; F157-S161 WeakPolarHBondContact O-CB 3.35Å; F157-S161 PolarHBondContact O-N 3.49Å; F157-S161 PolarHBondContact O-OG 2.95Å; S161-L165 PolarHBondContact O-N 2.93Å; S161-K166 WeakPolarHBondContact O-CB 3.48Å; S161-K166 WeakPolarHBondContact O-CG 3.28Å; S161-K166 PolarHBondContact O-N 3.21Å |
| 162 | T | 81.8 | Confident | 86.4 | Confident | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.012 | 24% | 0.24 | C | C | . | . | I | π-helix | trans | -76.7 | -37.4 | -175.7 | -55 | 0 | 0 | 0 | 0 | 112.1 | S158 V160 P167 F402 H403 | S158-T162 WeakPolarHBondContact O-CB 3.42Å; S158-T162 PolarHBondContact O-N 3.48Å; S158-T162 PolarHBondContact O-OG1 3.36Å; V160-T162 PolarHBondContact O-N 3.33Å; T162-P167 VanDerWaalsContact O-CD 3.32Å; T162-P167 WeakPolarHBondContact O-CD 3.42Å; T162-P167 VanDerWaalsContact O-CG 3.27Å; T162-P167 WeakPolarHBondContact O-CG 3.43Å; T162-F402 HydrophobicContact CG2-CD1 3.98Å; T162-F402 HydrophobicContact CG2-CE1 3.75Å; T162-H403 PolarHBondContact O-CE1 3.42Å |
| 163 | L | 80.9 | Confident | 86.1 | Confident | 34 Ų | 34 | 41 Ų | 41 | 18% | 0.178 | 21% | 0.214 | C | C | . | . | I | π-helix | trans | -91.7 | -32.1 | -176.4 | -65.4 | 179.2 | 0 | 0 | 0 | 114.5 | W159 F402 | W159-L163 HydrophobicContact CD2-CD1 3.43Å; W159-L163 VanDerWaalsContact CD2-CD1 3.43Å; W159-L163 HydrophobicContact CD2-CG 4.45Å; W159-L163 HydrophobicContact CE3-CD1 3.65Å; W159-L163 HydrophobicContact CG-CD1 4.15Å; W159-L163 HydrophobicContact CH2-CD1 3.51Å; W159-L163 HydrophobicContact CZ2-CD1 3.26Å; W159-L163 HydrophobicContact CZ3-CD1 3.69Å; W159-L163 VanDerWaalsContact O-CB 3.31Å; W159-L163 WeakPolarHBondContact O-CB 3.45Å; W159-L163 WeakPolarHBondContact O-CG 3.49Å; W159-L163 PolarHBondContact O-N 3.31Å; L163-F402 HydrophobicContact CD2-CE1 3.91Å; L163-F402 HydrophobicContact CD2-CZ 3.75Å |
| 164 | V | 83.1 | Confident | 85.9 | Confident | 79 Ų | 79 | 38.8 Ų | 38.8 | 48% | 0.479 | 20% | 0.2 | S | C | . | . | I | π-helix | trans | -112.6 | -60 | -172.1 | -174.1 | 0 | 0 | 0 | 0 | 110.5 | V160 S168 | V160-V164 WeakPolarHBondContact O-CA 3.45Å; V160-V164 VanDerWaalsContact O-CB 3.3Å; V160-V164 WeakPolarHBondContact O-CB 3.36Å; V160-V164 PolarHBondContact O-N 2.9Å; V164-S168 WeakPolarHBondContact O-CB 3.35Å; V164-S168 PolarHBondContact O-N 3.49Å; V164-S168 PolarHBondContact O-OG 3.24Å |
| 165 | L | 84.4 | Confident | 85.7 | Confident | 82 Ų | 82 | 40.5 Ų | 40.5 | 43% | 0.429 | 21% | 0.209 | S | C | . | . | I | π-helix | trans | -68.4 | -58.8 | -167 | -56.2 | 179.5 | 0 | 0 | 0 | 112.6 | V160 S161 S168 Q169 | V160-L165 HydrophobicContact CG1-CD1 4.32Å; V160-L165 HydrophobicContact CG1-CG 4.16Å; V160-L165 PolarHBondContact O-N 3.33Å; V160-L165 VanDerWaalsContact O-N 3.1Å; S161-L165 PolarHBondContact O-N 2.93Å; L165-S168 PolarHBondContact O-N 2.91Å; L165-Q169 WeakPolarHBondContact O-CB 3.36Å; L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.47Å |
| 166 | K | 84.4 | Confident | 85.5 | Confident | 8 Ų | 8 | 37.1 Ų | 37.1 | 4% | 0.035 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.4 | -43.4 | -174.9 | -64.8 | -63.6 | -178 | -172.1 | 0 | 113.2 | S161 M170 A369 | S161-K166 WeakPolarHBondContact O-CB 3.48Å; S161-K166 WeakPolarHBondContact O-CG 3.28Å; S161-K166 PolarHBondContact O-N 3.21Å; K166-M170 PolarHBondContact O-N 3.33Å; K166-M170 VanDerWaalsContact O-N 3.09Å; K166-A369 HydrophobicContact CB-CB 4.23Å; K166-A369 HydrophobicContact CD-CB 4.1Å; K166-A369 HydrophobicContact CG-CB 4.1Å |
| 167 | P | 83.6 | Confident | 85.4 | Confident | 7 Ų | 7 | 33.7 Ų | 33.7 | 5% | 0.045 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.4 | -41.7 | 174.5 | -25.4 | 36.7 | 0 | 0 | 0 | 113.3 | T162 M170 A171 L407 | T162-P167 VanDerWaalsContact O-CD 3.32Å; T162-P167 WeakPolarHBondContact O-CD 3.42Å; T162-P167 VanDerWaalsContact O-CG 3.27Å; T162-P167 WeakPolarHBondContact O-CG 3.43Å; P167-M170 PolarHBondContact O-N 2.99Å; P167-A171 WeakPolarHBondContact O-CB 3.41Å; P167-A171 PolarHBondContact O-N 3.19Å; P167-L407 HydrophobicContact CB-CD1 3.97Å |
| 168 | S | 85 | Confident | 85.3 | Confident | 52 Ų | 52 | 31.9 Ų | 31.9 | 36% | 0.364 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -67.3 | -44.1 | -179.8 | -55.9 | 0 | 0 | 0 | 0 | 111.5 | V164 L165 M170 A171 I172 | V164-S168 WeakPolarHBondContact O-CB 3.35Å; V164-S168 PolarHBondContact O-N 3.49Å; V164-S168 PolarHBondContact O-OG 3.24Å; L165-S168 PolarHBondContact O-N 2.91Å; S168-M170 VanDerWaalsContact C-N 3.29Å; S168-M170 PolarHBondContact O-N 3.3Å; S168-A171 PolarHBondContact O-N 2.98Å; S168-I172 VanDerWaalsContact O-CG1 3.31Å; S168-I172 WeakPolarHBondContact O-CG1 3.37Å; S168-I172 PolarHBondContact O-N 2.92Å |
| 169 | Q | 85.3 | Confident | 85 | Confident | 30 Ų | 30 | 33.6 Ų | 33.6 | 14% | 0.14 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -54.7 | -47.3 | 173.1 | -76.4 | 178.7 | -26.6 | 0 | 0 | 111 | L165 A171 I172 I173 W275 D278 T365 | L165-Q169 WeakPolarHBondContact O-CB 3.36Å; L165-Q169 WeakPolarHBondContact O-CG 3.47Å; L165-Q169 PolarHBondContact O-N 3.47Å; Q169-A171 PolarHBondContact O-N 3.31Å; Q169-I172 PolarHBondContact O-N 3.43Å; Q169-I173 VanDerWaalsContact O-CG1 3.3Å; Q169-I173 WeakPolarHBondContact O-CG1 3.41Å; Q169-I173 PolarHBondContact O-N 3.37Å; Q169-I173 VanDerWaalsContact O-N 3.12Å; Q169-W275 HydrophobicContact CG-CZ3 4.19Å; Q169-D278 PolarHBondContact NE2-OD1 2.94Å; Q169-D278 VanDerWaalsContact NE2-OD1 3.17Å; Q169-D278 PolarHBondContact NE2-OD2 3.5Å; Q169-T365 HydrophobicContact CB-CG2 4.47Å |
| 170 | M | 85.6 | Confident | 84.9 | Confident | 11 Ų | 11 | 27.4 Ų | 27.4 | 5% | 0.054 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.2 | -42.8 | 179.5 | -106.5 | -52.5 | -160.7 | 0 | 0 | 113.6 | K166 P167 S168 I173 C174 I207 A362 L366 | K166-M170 PolarHBondContact O-N 3.33Å; K166-M170 VanDerWaalsContact O-N 3.09Å; P167-M170 PolarHBondContact O-N 2.99Å; S168-M170 VanDerWaalsContact C-N 3.29Å; S168-M170 PolarHBondContact O-N 3.3Å; M170-I173 PolarHBondContact O-N 2.87Å; M170-C174 WeakPolarHBondContact O-CB 3.39Å; M170-C174 PolarHBondContact O-N 3.02Å; M170-C174 PolarHBondContact O-SG 2.97Å; M170-I207 HydrophobicContact CE-CG2 4.31Å; M170-A362 VanDerWaalsContact CE-C 3.43Å; M170-A362 HydrophobicContact CE-CB 3.75Å; M170-A362 WeakPolarHBondContact CE-O 3.12Å; M170-A362 HydrophobicContact SD-CB 3.68Å; M170-L366 HydrophobicContact CE-CB 3.54Å; M170-L366 HydrophobicContact CE-CD1 4.49Å; M170-L366 HydrophobicContact CE-CG 4.37Å |
| 171 | A | 85.3 | Confident | 84.7 | Confident | 12 Ų | 12 | 25.2 Ų | 25.2 | 10% | 0.099 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.8 | -47.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | P167 S168 Q169 C174 L175 L407 L410 | P167-A171 WeakPolarHBondContact O-CB 3.41Å; P167-A171 PolarHBondContact O-N 3.19Å; S168-A171 PolarHBondContact O-N 2.98Å; Q169-A171 PolarHBondContact O-N 3.31Å; A171-C174 PolarHBondContact O-N 3.34Å; A171-L175 VanDerWaalsContact O-CB 3.3Å; A171-L175 WeakPolarHBondContact O-CB 3.42Å; A171-L175 VanDerWaalsContact O-CG 3.22Å; A171-L175 WeakPolarHBondContact O-CG 3.3Å; A171-L175 PolarHBondContact O-N 3.34Å; A171-L407 HydrophobicContact CB-CD2 4.35Å; A171-L410 HydrophobicContact CB-CD1 3.83Å; A171-L410 HydrophobicContact CB-CD2 4.21Å; A171-L410 HydrophobicContact CB-CG 4.33Å |
| 172 | I | 83.9 | Confident | 84.6 | Confident | 62 Ų | 62 | 25.7 Ų | 25.7 | 32% | 0.318 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -61.8 | -48.4 | -179.6 | -63.1 | 163.7 | 0 | 0 | 0 | 110.4 | S168 Q169 C174 L175 S176 W275 | S168-I172 VanDerWaalsContact O-CG1 3.31Å; S168-I172 WeakPolarHBondContact O-CG1 3.37Å; S168-I172 PolarHBondContact O-N 2.92Å; Q169-I172 PolarHBondContact O-N 3.43Å; I172-C174 PolarHBondContact O-N 2.91Å; I172-L175 PolarHBondContact O-N 2.98Å; I172-S176 PolarHBondContact O-N 3.44Å; I172-S176 PolarHBondContact O-OG 2.94Å; I172-S176 VanDerWaalsContact O-OG 3.12Å; I172-W275 HydrophobicContact CB-CH2 3.87Å; I172-W275 HydrophobicContact CB-CZ2 3.88Å; I172-W275 HydrophobicContact CD1-CH2 3.93Å; I172-W275 HydrophobicContact CD1-CZ2 4.41Å; I172-W275 HydrophobicContact CD1-CZ3 4.2Å; I172-W275 HydrophobicContact CG2-CH2 3.82Å; I172-W275 HydrophobicContact CG2-CZ2 3.31Å |
| 173 | I | 86.4 | Confident | 84.4 | Confident | 3 Ų | 3 | 27.8 Ų | 27.8 | 2% | 0.015 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.6 | -43.5 | -178.9 | -61.4 | 164.7 | 0 | 0 | 0 | 111.2 | Q169 M170 S176 F177 W275 T358 A362 | Q169-I173 VanDerWaalsContact O-CG1 3.3Å; Q169-I173 WeakPolarHBondContact O-CG1 3.41Å; Q169-I173 PolarHBondContact O-N 3.37Å; Q169-I173 VanDerWaalsContact O-N 3.12Å; M170-I173 PolarHBondContact O-N 2.87Å; I173-S176 PolarHBondContact O-N 3.17Å; I173-F177 PolarHBondContact O-N 2.67Å; I173-W275 HydrophobicContact CG1-CH2 4.41Å; I173-W275 HydrophobicContact CG1-CZ2 4.33Å; I173-T358 VanDerWaalsContact CG2-O 3.24Å; I173-T358 WeakPolarHBondContact CG2-O 3.47Å; I173-A362 HydrophobicContact CG2-CB 3.8Å |
| 174 | C | 88.2 | Confident | 84.2 | Confident | 2 Ų | 2 | 28.5 Ų | 28.5 | 1% | 0.014 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -73.4 | -30.6 | -178.5 | -64.9 | 0 | 0 | 0 | 0 | 113 | M170 A171 I172 F177 A178 A200 I204 | M170-C174 WeakPolarHBondContact O-CB 3.39Å; M170-C174 PolarHBondContact O-N 3.02Å; M170-C174 PolarHBondContact O-SG 2.97Å; A171-C174 PolarHBondContact O-N 3.34Å; I172-C174 PolarHBondContact O-N 2.91Å; C174-F177 WeakPolarHBondContact O-CB 3.3Å; C174-F177 PolarHBondContact O-N 2.91Å; C174-A178 WeakPolarHBondContact O-CB 3.42Å; C174-A178 PolarHBondContact O-N 3.01Å; C174-A200 HydrophobicContact CB-CB 4.24Å; C174-A200 WeakPolarHBondContact O-CB 3.19Å; C174-I204 HydrophobicContact CB-CD1 3.98Å; C174-I204 HydrophobicContact CB-CG1 3.73Å; C174-I204 WeakPolarHBondContact SG-CG1 3.28Å |
| 175 | L | 84.9 | Confident | 83.9 | Confident | 36 Ų | 36 | 33.2 Ų | 33.2 | 19% | 0.188 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67.1 | -43.6 | 171.1 | -76.8 | 168.9 | 0 | 0 | 0 | 111 | A171 I172 A178 Q179 V196 A200 L410 | A171-L175 VanDerWaalsContact O-CB 3.3Å; A171-L175 WeakPolarHBondContact O-CB 3.42Å; A171-L175 VanDerWaalsContact O-CG 3.22Å; A171-L175 WeakPolarHBondContact O-CG 3.3Å; A171-L175 PolarHBondContact O-N 3.34Å; I172-L175 PolarHBondContact O-N 2.98Å; L175-A178 PolarHBondContact O-N 3.5Å; L175-Q179 PolarHBondContact O-N 2.7Å; L175-V196 HydrophobicContact CD2-CG1 4.47Å; L175-A200 HydrophobicContact CD2-CB 4.25Å; L175-L410 HydrophobicContact CD1-CD2 4.21Å |
| 176 | S | 84.4 | Confident | 83.2 | Confident | 14 Ų | 14 | 31.7 Ų | 31.7 | 10% | 0.098 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.3 | -45.4 | 172.4 | -58.1 | 0 | 0 | 0 | 0 | 111.4 | S91 I172 I173 A178 Q179 Y180 | S91-S176 VanDerWaalsContact CB-CB 3.44Å; S91-S176 WeakPolarHBondContact CB-OG 3.39Å; I172-S176 PolarHBondContact O-N 3.44Å; I172-S176 PolarHBondContact O-OG 2.94Å; I172-S176 VanDerWaalsContact O-OG 3.12Å; I173-S176 PolarHBondContact O-N 3.17Å; S176-A178 VanDerWaalsContact C-N 3.28Å; S176-A178 PolarHBondContact O-N 3.07Å; S176-Q179 PolarHBondContact O-N 3.34Å; S176-Y180 VanDerWaalsContact O-CD2 3.3Å; S176-Y180 WeakPolarHBondContact O-CD2 3.46Å; S176-Y180 PolarHBondContact O-N 3.08Å; S176-Y180 VanDerWaalsContact O-N 3.16Å |
| 177 | F | 88.2 | Confident | 82.1 | Confident | 35 Ų | 35 | 37.5 Ų | 37.5 | 15% | 0.154 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -51.9 | -49.5 | 173.3 | 167.5 | -92.4 | 0 | 0 | 0 | 111.4 | I173 C174 A181 V199 A203 T355 T358 F359 | I173-F177 PolarHBondContact O-N 2.67Å; C174-F177 WeakPolarHBondContact O-CB 3.3Å; C174-F177 PolarHBondContact O-N 2.91Å; F177-A181 HydrophobicContact CE1-CB 4.44Å; F177-A181 WeakPolarHBondContact O-CB 3.47Å; F177-A181 PolarHBondContact O-N 3.24Å; F177-V199 HydrophobicContact CD1-CG1 4.34Å; F177-V199 HydrophobicContact CE1-CG1 3.9Å; F177-A203 HydrophobicContact CD1-CB 3.75Å; F177-A203 HydrophobicContact CE1-CB 3.68Å; F177-A203 HydrophobicContact CZ-CB 4.46Å; F177-T355 HydrophobicContact CD2-CG2 4.16Å; F177-T355 VanDerWaalsContact CD2-O 3.3Å; F177-T355 WeakPolarHBondContact CD2-O 3.38Å; F177-T355 HydrophobicContact CE2-CG2 4.13Å; F177-T358 WeakPolarHBondContact CA-OG1 3.47Å; F177-T358 WeakPolarHBondContact CB-OG1 3.23Å; F177-T358 WeakPolarHBondContact CD2-OG1 3.48Å; F177-F359 HydrophobicContact CD2-CB 4.23Å; F177-F359 HydrophobicContact CE2-CB 4.2Å; F177-F359 HydrophobicContact CE2-CD2 4.28Å |
| 178 | A | 87.4 | Confident | 81 | Confident | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -68.7 | -37.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113 | C174 L175 S176 A181 V182 V196 V199 A200 | C174-A178 WeakPolarHBondContact O-CB 3.42Å; C174-A178 PolarHBondContact O-N 3.01Å; L175-A178 PolarHBondContact O-N 3.5Å; S176-A178 VanDerWaalsContact C-N 3.28Å; S176-A178 PolarHBondContact O-N 3.07Å; A178-A181 PolarHBondContact O-N 2.82Å; A178-V182 WeakPolarHBondContact O-CB 3.42Å; A178-V182 WeakPolarHBondContact O-CG2 3.45Å; A178-V182 PolarHBondContact O-N 3.4Å; A178-V196 HydrophobicContact CB-CG1 3.7Å; A178-V196 WeakPolarHBondContact CB-O 3.36Å; A178-V199 HydrophobicContact CB-CB 3.94Å; A178-V199 HydrophobicContact CB-CG1 3.85Å; A178-A200 HydrophobicContact CB-CB 3.86Å |
| 179 | Q | 82.1 | Confident | 80.2 | Confident | 36 Ų | 36 | 47.7 Ų | 47.7 | 17% | 0.168 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.4 | -52.4 | 176.8 | -172.4 | 167 | -1 | 0 | 0 | 110.4 | L175 S176 A181 V182 E183 E332 | L175-Q179 PolarHBondContact O-N 2.7Å; S176-Q179 PolarHBondContact O-N 3.34Å; Q179-A181 VanDerWaalsContact C-N 3.33Å; Q179-A181 PolarHBondContact O-N 3.18Å; Q179-V182 PolarHBondContact O-N 3.41Å; Q179-E183 VanDerWaalsContact O-CB 3.24Å; Q179-E183 WeakPolarHBondContact O-CB 3.24Å; Q179-E183 PolarHBondContact O-N 3.16Å; Q179-E332 PolarHBondContact NE2-OE2 3.28Å |
| 180 | Y | 82.8 | Confident | 79.3 | Confident | 4 Ų | 4 | 52.7 Ų | 52.7 | 2% | 0.016 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -65.9 | -32.8 | 177.8 | -80 | -93.4 | 0 | 0 | 0 | 113.3 | F94 S176 A184 A333 A335 V336 V354 | F94-Y180 HydrophobicContact CB-CE2 4.4Å; F94-Y180 WeakPolarHBondContact CB-OH 3.33Å; F94-Y180 PolarHBondContact O-OH 3.49Å; S176-Y180 VanDerWaalsContact O-CD2 3.3Å; S176-Y180 WeakPolarHBondContact O-CD2 3.46Å; S176-Y180 PolarHBondContact O-N 3.08Å; S176-Y180 VanDerWaalsContact O-N 3.16Å; Y180-A184 PolarHBondContact O-N 2.76Å; Y180-A333 HydrophobicContact CD1-CB 4.22Å; Y180-A333 HydrophobicContact CE1-CB 3.58Å; Y180-A333 WeakPolarHBondContact OH-CA 3.46Å; Y180-A335 HydrophobicContact CE1-CB 4.45Å; Y180-V336 HydrophobicContact CD1-CG2 3.93Å; Y180-V336 HydrophobicContact CE1-CG2 4.03Å; Y180-V354 HydrophobicContact CD1-CB 3.86Å; Y180-V354 HydrophobicContact CD1-CG1 3.52Å; Y180-V354 HydrophobicContact CD1-CG2 3.99Å; Y180-V354 HydrophobicContact CD2-CG1 3.76Å; Y180-V354 HydrophobicContact CE1-CB 4.33Å; Y180-V354 HydrophobicContact CE1-CG1 3.88Å; Y180-V354 HydrophobicContact CE1-CG2 4.04Å; Y180-V354 HydrophobicContact CE2-CG1 4.14Å; Y180-V354 HydrophobicContact CG-CB 4.15Å; Y180-V354 HydrophobicContact CG-CG1 3.43Å; Y180-V354 VanDerWaalsContact CG-CG1 3.43Å |
| 181 | A | 86.2 | Confident | 78.5 | Confident | 18 Ų | 18 | 53.2 Ų | 53.2 | 15% | 0.149 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -68.8 | -41 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F177 A178 Q179 A184 F185 V199 T355 | F177-A181 HydrophobicContact CE1-CB 4.44Å; F177-A181 WeakPolarHBondContact O-CB 3.47Å; F177-A181 PolarHBondContact O-N 3.24Å; A178-A181 PolarHBondContact O-N 2.82Å; Q179-A181 VanDerWaalsContact C-N 3.33Å; Q179-A181 PolarHBondContact O-N 3.18Å; A181-A184 WeakPolarHBondContact O-CB 3.32Å; A181-F185 WeakPolarHBondContact O-CD2 3.25Å; A181-F185 WeakPolarHBondContact O-CE2 3.18Å; A181-V199 HydrophobicContact CB-CG1 4.34Å; A181-T355 HydrophobicContact CB-CG2 3.72Å |
| 182 | V | 83.6 | Confident | 78.3 | Confident | 12 Ų | 12 | 56.1 Ų | 56.1 | 7% | 0.073 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -77.5 | -39.9 | -178.6 | 178.3 | 0 | 0 | 0 | 0 | 111 | A178 Q179 A184 F185 V186 P191 V195 V196 V199 | A178-V182 WeakPolarHBondContact O-CB 3.42Å; A178-V182 WeakPolarHBondContact O-CG2 3.45Å; A178-V182 PolarHBondContact O-N 3.4Å; Q179-V182 PolarHBondContact O-N 3.41Å; V182-A184 PolarHBondContact O-N 3.39Å; V182-F185 PolarHBondContact O-N 2.72Å; V182-V186 HydrophobicContact CG1-CG2 4.22Å; V182-V186 PolarHBondContact O-N 3.28Å; V182-V186 VanDerWaalsContact O-N 3.14Å; V182-P191 HydrophobicContact CB-CB 4.09Å; V182-P191 HydrophobicContact CG1-CB 3.5Å; V182-V195 HydrophobicContact CG1-CG1 4.32Å; V182-V195 HydrophobicContact CG2-CG1 3.96Å; V182-V196 HydrophobicContact CB-CG2 4.4Å; V182-V196 HydrophobicContact CG2-CG2 4.26Å; V182-V199 HydrophobicContact CG2-CG2 4.05Å |
| 183 | E | 76.2 | Confident | 78 | Confident | 46 Ų | 46 | 61.4 Ų | 61.4 | 22% | 0.215 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.3 | -29.3 | 177 | -169.4 | 177.6 | 170.4 | 0 | 0 | 112.3 | Q179 F185 V186 A333 | Q179-E183 VanDerWaalsContact O-CB 3.24Å; Q179-E183 WeakPolarHBondContact O-CB 3.24Å; Q179-E183 PolarHBondContact O-N 3.16Å; E183-F185 PolarHBondContact O-N 3.36Å; E183-F185 VanDerWaalsContact O-N 3.14Å; E183-V186 CarbonylContact O-C 3.5Å; E183-V186 PolarHBondContact O-N 3.01Å; E183-V186 VanDerWaalsContact O-O 3.14Å; E183-A333 VanDerWaalsContact OE1-CB 3.31Å; E183-A333 WeakPolarHBondContact OE1-CB 3.25Å; E183-A333 VanDerWaalsContact OE2-CB 3.25Å; E183-A333 WeakPolarHBondContact OE2-CB 3.28Å |
| 184 | A | 76.3 | Confident | 77.8 | Confident | 50 Ų | 50 | 63.5 Ų | 63.5 | 41% | 0.413 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -24.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y180 A181 V182 P351 | Y180-A184 PolarHBondContact O-N 2.76Å; A181-A184 WeakPolarHBondContact O-CB 3.32Å; V182-A184 PolarHBondContact O-N 3.39Å; A184-P351 HydrophobicContact CB-CB 3.89Å; A184-P351 HydrophobicContact CB-CG 3.99Å |
| 185 | F | 77.8 | Confident | 77.6 | Confident | 178 Ų | 178 | 66.7 Ų | 66.7 | 78% | 0.781 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.2 | -15.1 | 179.9 | -60.9 | -77.1 | 0 | 0 | 0 | 113.4 | A181 V182 E183 | A181-F185 WeakPolarHBondContact O-CD2 3.25Å; A181-F185 WeakPolarHBondContact O-CE2 3.18Å; V182-F185 PolarHBondContact O-N 2.72Å; E183-F185 PolarHBondContact O-N 3.36Å; E183-F185 VanDerWaalsContact O-N 3.14Å |
| 186 | V | 70.1 | Confident | 77.5 | Confident | 50 Ų | 50 | 65.8 Ų | 65.8 | 30% | 0.303 | 36% | 0.364 | S | S | . | . | trans | -123.7 | 97 | -177 | -172.2 | 0 | 0 | 0 | 0 | 108.3 | V182 E183 C189 | V182-V186 HydrophobicContact CG1-CG2 4.22Å; V182-V186 PolarHBondContact O-N 3.28Å; V182-V186 VanDerWaalsContact O-N 3.14Å; E183-V186 CarbonylContact O-C 3.5Å; E183-V186 PolarHBondContact O-N 3.01Å; E183-V186 VanDerWaalsContact O-O 3.14Å; V186-C189 HydrophobicContact CG1-CB 4.01Å; V186-C189 VanDerWaalsContact CG1-O 3.32Å; V186-C189 WeakPolarHBondContact CG1-O 3.15Å | ||
| 187 | T | 61.3 | Low | 77.5 | Confident | 129 Ų | 129 | 67.3 Ų | 67.3 | 79% | 0.791 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -87.7 | -14.7 | -172.2 | 47 | 0 | 0 | 0 | 0 | 114.8 | ||
| 188 | E | 60.9 | Low | 77.4 | Confident | 180 Ų | 180 | 72.2 Ų | 72.2 | 84% | 0.841 | 39% | 0.394 | S | S | * | . | S | Bend | trans | -127.9 | 0.2 | -168.6 | -64.3 | -171.6 | -178.7 | 0 | 0 | 114.8 | ||
| 189 | C | 67.6 | Low | 77.5 | Confident | 94 Ų | 94 | 74.2 Ų | 74.2 | 64% | 0.635 | 41% | 0.406 | S | S | * | . | S | Bend | trans | -143.6 | 150.4 | -176.8 | -70 | 0 | 0 | 0 | 0 | 111.9 | V186 | V186-C189 HydrophobicContact CG1-CB 4.01Å; V186-C189 VanDerWaalsContact CG1-O 3.32Å; V186-C189 WeakPolarHBondContact CG1-O 3.15Å |
| 190 | D | 67.1 | Low | 77.8 | Confident | 134 Ų | 134 | 72.6 Ų | 72.6 | 72% | 0.717 | 40% | 0.399 | S | S | * | . | P | Polyproline II helix | trans | -57 | 130.2 | 172.5 | -63.5 | -20.4 | 0 | 0 | 0 | 110.2 | ||
| 191 | P | 68.8 | Low | 78 | Confident | 22 Ų | 22 | 76 Ų | 76 | 14% | 0.143 | 42% | 0.417 | C | S | . | . | P | Polyproline II helix | trans | -64 | 130.8 | -176.4 | 24.2 | -32.4 | 0 | 0 | 0 | 110 | V182 R193 V196 | V182-P191 HydrophobicContact CB-CB 4.09Å; V182-P191 HydrophobicContact CG1-CB 3.5Å; P191-R193 PolarHBondContact O-N 3.42Å; P191-R193 VanDerWaalsContact O-N 3.14Å; P191-V196 HydrophobicContact CB-CG2 3.77Å; P191-V196 HydrophobicContact CG-CG2 4.12Å |
| 192 | P | 79.9 | Confident | 78.2 | Confident | 74 Ų | 74 | 80 Ų | 80 | 48% | 0.481 | 44% | 0.439 | S | S | . | . | P | Polyproline II helix | trans | -57.2 | 123.5 | -178.5 | -23.8 | 31.6 | 0 | 0 | 0 | 111.1 | G194 V195 V196 | P192-G194 PolarHBondContact O-N 2.8Å; P192-V195 HydrophobicContact CB-CB 4.43Å; P192-V195 HydrophobicContact CB-CG2 4.04Å; P192-V195 HydrophobicContact CG-CG2 4.38Å; P192-V195 PolarHBondContact O-N 3.3Å; P192-V196 PolarHBondContact O-N 3.48Å |
| 193 | R | 78.8 | Confident | 78.5 | Confident | 172 Ų | 172 | 79.6 Ų | 79.6 | 65% | 0.649 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -51.1 | -37.5 | -175.9 | -65.6 | -178.8 | 179.9 | 174.3 | -1.4 | 113 | P191 K197 | P191-R193 PolarHBondContact O-N 3.42Å; P191-R193 VanDerWaalsContact O-N 3.14Å; R193-K197 WeakPolarHBondContact O-CG 3.33Å; R193-K197 PolarHBondContact O-N 3.41Å |
| 194 | G | 81.1 | Confident | 79.1 | Confident | 48 Ų | 48 | 77.9 Ų | 77.9 | 50% | 0.495 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63 | -40.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | P192 M198 | P192-G194 PolarHBondContact O-N 2.8Å; G194-M198 WeakPolarHBondContact O-CG 3.46Å; G194-M198 PolarHBondContact O-N 3.4Å |
| 195 | V | 84.4 | Confident | 79.6 | Confident | 69 Ų | 69 | 79.1 Ų | 79.1 | 42% | 0.418 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -69.7 | -45.9 | 179.4 | 178.3 | 0 | 0 | 0 | 0 | 110.2 | V182 P192 K197 M198 V199 | V182-V195 HydrophobicContact CG1-CG1 4.32Å; V182-V195 HydrophobicContact CG2-CG1 3.96Å; P192-V195 HydrophobicContact CB-CB 4.43Å; P192-V195 HydrophobicContact CB-CG2 4.04Å; P192-V195 HydrophobicContact CG-CG2 4.38Å; P192-V195 PolarHBondContact O-N 3.3Å; V195-K197 VanDerWaalsContact C-N 3.32Å; V195-K197 PolarHBondContact O-N 3.12Å; V195-M198 PolarHBondContact O-N 3.31Å; V195-M198 VanDerWaalsContact O-N 3.14Å; V195-V199 HydrophobicContact CG1-CG2 4.31Å; V195-V199 WeakPolarHBondContact O-CG2 2.98Å; V195-V199 PolarHBondContact O-N 3.42Å |
| 196 | V | 83.6 | Confident | 80.1 | Confident | 17 Ų | 17 | 75.8 Ų | 75.8 | 10% | 0.103 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -56.9 | -46.5 | 176.4 | 178.5 | 0 | 0 | 0 | 0 | 110.6 | L175 A178 V182 P191 P192 M198 V199 A200 | L175-V196 HydrophobicContact CD2-CG1 4.47Å; A178-V196 HydrophobicContact CB-CG1 3.7Å; A178-V196 WeakPolarHBondContact CB-O 3.36Å; V182-V196 HydrophobicContact CB-CG2 4.4Å; V182-V196 HydrophobicContact CG2-CG2 4.26Å; P191-V196 HydrophobicContact CB-CG2 3.77Å; P191-V196 HydrophobicContact CG-CG2 4.12Å; P192-V196 PolarHBondContact O-N 3.48Å; V196-M198 PolarHBondContact O-N 3.1Å; V196-V199 PolarHBondContact O-N 2.83Å; V196-A200 WeakPolarHBondContact O-CB 3.46Å; V196-A200 PolarHBondContact O-N 2.99Å |
| 197 | K | 83.4 | Confident | 81 | Confident | 45 Ų | 45 | 73.5 Ų | 73.5 | 20% | 0.196 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 176.3 | -72.7 | -174.7 | -174.1 | -168.1 | 0 | 112.5 | R193 V195 A200 L201 D414 | R193-K197 WeakPolarHBondContact O-CG 3.33Å; R193-K197 PolarHBondContact O-N 3.41Å; V195-K197 VanDerWaalsContact C-N 3.32Å; V195-K197 PolarHBondContact O-N 3.12Å; K197-A200 PolarHBondContact O-N 2.82Å; K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 3.42Å; K197-D414 IonicContact NZ-OD1 2.74Å; K197-D414 PolarHBondContact NZ-OD1 2.67Å; K197-D414 IonicContact NZ-OD2 3.11Å; K197-D414 PolarHBondContact NZ-OD2 3.24Å |
| 198 | M | 87 | Confident | 82.1 | Confident | 138 Ų | 138 | 68.1 Ų | 68.1 | 68% | 0.68 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -64.5 | -44.2 | 178.3 | -78 | -167.1 | 162.2 | 0 | 0 | 112.3 | G194 V195 V196 A200 L201 V202 | G194-M198 WeakPolarHBondContact O-CG 3.46Å; G194-M198 PolarHBondContact O-N 3.4Å; V195-M198 PolarHBondContact O-N 3.31Å; V195-M198 VanDerWaalsContact O-N 3.14Å; V196-M198 PolarHBondContact O-N 3.1Å; M198-A200 VanDerWaalsContact C-N 3.34Å; M198-A200 PolarHBondContact O-N 3.09Å; M198-L201 PolarHBondContact O-N 3.39Å; M198-V202 WeakPolarHBondContact O-CG2 3.39Å; M198-V202 PolarHBondContact O-N 2.93Å |
| 199 | V | 89 | Confident | 83.3 | Confident | 43 Ų | 43 | 66.1 Ų | 66.1 | 26% | 0.261 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.5 | -42.2 | 176.6 | 173.2 | 0 | 0 | 0 | 0 | 110.8 | F177 A178 A181 V182 V195 V196 L201 V202 A203 | F177-V199 HydrophobicContact CD1-CG1 4.34Å; F177-V199 HydrophobicContact CE1-CG1 3.9Å; A178-V199 HydrophobicContact CB-CB 3.94Å; A178-V199 HydrophobicContact CB-CG1 3.85Å; A181-V199 HydrophobicContact CB-CG1 4.34Å; V182-V199 HydrophobicContact CG2-CG2 4.05Å; V195-V199 HydrophobicContact CG1-CG2 4.31Å; V195-V199 WeakPolarHBondContact O-CG2 2.98Å; V195-V199 PolarHBondContact O-N 3.42Å; V196-V199 PolarHBondContact O-N 2.83Å; V199-L201 PolarHBondContact O-N 3.43Å; V199-V202 PolarHBondContact O-N 3.2Å; V199-A203 PolarHBondContact O-N 3.39Å |
| 200 | A | 87.9 | Confident | 84.1 | Confident | 2 Ų | 2 | 62.6 Ų | 62.6 | 2% | 0.017 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60 | -46.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | C174 L175 A178 V196 K197 M198 V202 A203 I204 | C174-A200 HydrophobicContact CB-CB 4.24Å; C174-A200 WeakPolarHBondContact O-CB 3.19Å; L175-A200 HydrophobicContact CD2-CB 4.25Å; A178-A200 HydrophobicContact CB-CB 3.86Å; V196-A200 WeakPolarHBondContact O-CB 3.46Å; V196-A200 PolarHBondContact O-N 2.99Å; K197-A200 PolarHBondContact O-N 2.82Å; M198-A200 VanDerWaalsContact C-N 3.34Å; M198-A200 PolarHBondContact O-N 3.09Å; A200-V202 PolarHBondContact O-N 2.92Å; A200-A203 WeakPolarHBondContact O-CB 3.49Å; A200-A203 PolarHBondContact O-N 2.81Å; A200-I204 WeakPolarHBondContact O-CD1 3.4Å; A200-I204 VanDerWaalsContact O-CG1 3.25Å; A200-I204 WeakPolarHBondContact O-CG1 3.37Å; A200-I204 PolarHBondContact O-N 3.5Å |
| 201 | L | 87.4 | Confident | 84.9 | Confident | 76 Ų | 76 | 56.5 Ų | 56.5 | 40% | 0.398 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61 | -43.4 | 177.2 | -73.6 | 172.3 | 0 | 0 | 0 | 112.3 | K197 M198 V199 A203 I204 V205 | K197-L201 WeakPolarHBondContact O-CG 3.3Å; K197-L201 PolarHBondContact O-N 3.42Å; M198-L201 PolarHBondContact O-N 3.39Å; V199-L201 PolarHBondContact O-N 3.43Å; L201-A203 VanDerWaalsContact C-N 3.32Å; L201-A203 PolarHBondContact O-N 3.29Å; L201-I204 PolarHBondContact O-N 3.03Å; L201-V205 WeakPolarHBondContact O-CG2 3.4Å; L201-V205 PolarHBondContact O-N 3Å |
| 202 | V | 90 | Very high | 85.5 | Confident | 100 Ų | 100 | 56.7 Ų | 56.7 | 61% | 0.606 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -60.4 | -44.1 | 175.9 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | M198 V199 A200 I204 V205 M206 | M198-V202 WeakPolarHBondContact O-CG2 3.39Å; M198-V202 PolarHBondContact O-N 2.93Å; V199-V202 PolarHBondContact O-N 3.2Å; A200-V202 PolarHBondContact O-N 2.92Å; V202-I204 PolarHBondContact O-N 3.42Å; V202-V205 PolarHBondContact O-N 3.38Å; V202-M206 WeakPolarHBondContact O-CB 3.44Å; V202-M206 PolarHBondContact O-N 3.36Å |
| 203 | A | 89.6 | Confident | 85.6 | Confident | 5 Ų | 5 | 58.4 Ų | 58.4 | 4% | 0.041 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | F177 V199 A200 L201 V205 M206 I207 | F177-A203 HydrophobicContact CD1-CB 3.75Å; F177-A203 HydrophobicContact CE1-CB 3.68Å; F177-A203 HydrophobicContact CZ-CB 4.46Å; V199-A203 PolarHBondContact O-N 3.39Å; A200-A203 WeakPolarHBondContact O-CB 3.49Å; A200-A203 PolarHBondContact O-N 2.81Å; L201-A203 VanDerWaalsContact C-N 3.32Å; L201-A203 PolarHBondContact O-N 3.29Å; A203-V205 PolarHBondContact O-N 3.39Å; A203-M206 PolarHBondContact O-N 2.92Å; A203-I207 VanDerWaalsContact O-CG1 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.47Å; A203-I207 PolarHBondContact O-N 3.03Å |
| 204 | I | 88.2 | Confident | 85.6 | Confident | 9 Ų | 9 | 51.8 Ų | 51.8 | 5% | 0.046 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 178.7 | -61.3 | 152.8 | 0 | 0 | 0 | 110.8 | C174 A200 L201 V202 M206 I207 L208 L404 L407 | C174-I204 HydrophobicContact CB-CD1 3.98Å; C174-I204 HydrophobicContact CB-CG1 3.73Å; C174-I204 WeakPolarHBondContact SG-CG1 3.28Å; A200-I204 WeakPolarHBondContact O-CD1 3.4Å; A200-I204 VanDerWaalsContact O-CG1 3.25Å; A200-I204 WeakPolarHBondContact O-CG1 3.37Å; A200-I204 PolarHBondContact O-N 3.5Å; L201-I204 PolarHBondContact O-N 3.03Å; V202-I204 PolarHBondContact O-N 3.42Å; I204-M206 VanDerWaalsContact C-N 3.3Å; I204-M206 PolarHBondContact O-N 3.46Å; I204-I207 PolarHBondContact O-N 3.22Å; I204-L208 WeakPolarHBondContact O-CB 3.38Å; I204-L208 PolarHBondContact O-N 2.76Å; I204-L404 HydrophobicContact CB-CD1 4.33Å; I204-L404 HydrophobicContact CG2-CD1 3.45Å; I204-L404 VanDerWaalsContact CG2-CD1 3.45Å; I204-L407 HydrophobicContact CD1-CD2 3.25Å; I204-L407 HydrophobicContact CG1-CD2 4.16Å; I204-L407 HydrophobicContact CG2-CD2 4.4Å |
| 205 | V | 88.1 | Confident | 85.3 | Confident | 76 Ų | 76 | 50.6 Ų | 50.6 | 46% | 0.461 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.5 | -39.6 | 179.2 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | L201 V202 A203 L208 F209 L404 | L201-V205 WeakPolarHBondContact O-CG2 3.4Å; L201-V205 PolarHBondContact O-N 3Å; V202-V205 PolarHBondContact O-N 3.38Å; A203-V205 PolarHBondContact O-N 3.39Å; V205-L208 PolarHBondContact O-N 3.29Å; V205-F209 WeakPolarHBondContact O-CB 3.41Å; V205-F209 PolarHBondContact O-N 3.49Å; V205-L404 HydrophobicContact CG2-CD1 4.18Å; V205-L404 HydrophobicContact CG2-CD2 4.32Å |
| 206 | M | 88.6 | Confident | 85.2 | Confident | 109 Ų | 109 | 51.4 Ų | 51.4 | 54% | 0.537 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -64.7 | -47.7 | 176.7 | -172.6 | -177.8 | -172.1 | 0 | 0 | 111.8 | V202 A203 I204 L208 F209 V210 F359 | V202-M206 WeakPolarHBondContact O-CB 3.44Å; V202-M206 PolarHBondContact O-N 3.36Å; A203-M206 PolarHBondContact O-N 2.92Å; I204-M206 VanDerWaalsContact C-N 3.3Å; I204-M206 PolarHBondContact O-N 3.46Å; M206-L208 VanDerWaalsContact C-N 3.3Å; M206-L208 PolarHBondContact O-N 3.41Å; M206-F209 PolarHBondContact O-N 3.21Å; M206-V210 WeakPolarHBondContact O-CG2 3.41Å; M206-V210 PolarHBondContact O-N 3.47Å; M206-F359 HydrophobicContact CG-CZ 4.34Å; M206-F359 HydrophobicContact SD-CE2 4.01Å; M206-F359 HydrophobicContact SD-CZ 4.13Å |
| 207 | I | 87.8 | Confident | 85.2 | Confident | 1 Ų | 1 | 54.1 Ų | 54.1 | 1% | 0.005 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 177.9 | -65.7 | 165.7 | 0 | 0 | 0 | 110.1 | M170 A203 I204 F209 V210 N211 F359 A362 N363 L366 | M170-I207 HydrophobicContact CE-CG2 4.31Å; A203-I207 VanDerWaalsContact O-CG1 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.47Å; A203-I207 PolarHBondContact O-N 3.03Å; I204-I207 PolarHBondContact O-N 3.22Å; I207-F209 PolarHBondContact O-N 3.27Å; I207-V210 PolarHBondContact O-N 3Å; I207-N211 WeakPolarHBondContact O-CB 3.26Å; I207-N211 PolarHBondContact O-N 2.89Å; I207-N211 PolarHBondContact O-ND2 2.99Å; I207-F359 HydrophobicContact CD1-CD1 4.49Å; I207-F359 HydrophobicContact CD1-CD2 4.04Å; I207-F359 HydrophobicContact CD1-CE1 4.44Å; I207-F359 HydrophobicContact CD1-CE2 3.99Å; I207-F359 HydrophobicContact CD1-CG 4.31Å; I207-F359 HydrophobicContact CD1-CZ 4.21Å; I207-F359 HydrophobicContact CG1-CD1 4.27Å; I207-F359 HydrophobicContact CG1-CD2 4.07Å; I207-F359 HydrophobicContact CG1-CE1 3.74Å; I207-F359 HydrophobicContact CG1-CE2 3.52Å; I207-F359 HydrophobicContact CG1-CG 4.42Å; I207-F359 HydrophobicContact CG1-CZ 3.35Å; I207-A362 HydrophobicContact CD1-CB 3.56Å; I207-N363 HydrophobicContact CG2-CB 4.16Å; I207-L366 HydrophobicContact CG2-CB 4.26Å; I207-L366 HydrophobicContact CG2-CD2 3.72Å |
| 208 | L | 85.1 | Confident | 85.2 | Confident | 17 Ų | 17 | 52 Ų | 52 | 9% | 0.089 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -58.6 | -48.3 | 174.9 | 175.9 | 65.1 | 0 | 0 | 0 | 111.4 | I204 V205 M206 V210 N211 C212 L366 L400 I401 L404 | I204-L208 WeakPolarHBondContact O-CB 3.38Å; I204-L208 PolarHBondContact O-N 2.76Å; V205-L208 PolarHBondContact O-N 3.29Å; M206-L208 VanDerWaalsContact C-N 3.3Å; M206-L208 PolarHBondContact O-N 3.41Å; L208-V210 VanDerWaalsContact C-N 3.34Å; L208-V210 PolarHBondContact O-N 3.47Å; L208-N211 PolarHBondContact O-N 3.35Å; L208-C212 VanDerWaalsContact O-CB 3.29Å; L208-C212 WeakPolarHBondContact O-CB 3.29Å; L208-C212 PolarHBondContact O-N 3.07Å; L208-C212 PolarHBondContact O-SG 2.9Å; L208-C212 VanDerWaalsContact O-SG 3.33Å; L208-L366 HydrophobicContact CB-CD2 4.34Å; L208-L366 HydrophobicContact CD1-CD2 4.39Å; L208-L400 HydrophobicContact CD1-CB 3.39Å; L208-I401 HydrophobicContact CD1-CG1 4.49Å; L208-I401 HydrophobicContact CD2-CG1 4.26Å; L208-L404 HydrophobicContact CD2-CB 3.99Å; L208-L404 HydrophobicContact CD2-CD2 3.55Å; L208-L404 HydrophobicContact CD2-CG 4.26Å |
| 209 | F | 85.6 | Confident | 85 | Confident | 137 Ų | 137 | 46.1 Ų | 46.1 | 60% | 0.601 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -58.8 | -46.2 | 180 | 179.1 | -98 | 0 | 0 | 0 | 111.6 | V205 M206 I207 C212 Y213 | V205-F209 WeakPolarHBondContact O-CB 3.41Å; V205-F209 PolarHBondContact O-N 3.49Å; M206-F209 PolarHBondContact O-N 3.21Å; I207-F209 PolarHBondContact O-N 3.27Å; F209-C212 PolarHBondContact O-N 3.43Å; F209-Y213 HydrophobicContact CZ-CD2 4.31Å; F209-Y213 VanDerWaalsContact O-CB 3.27Å; F209-Y213 WeakPolarHBondContact O-CB 3.37Å; F209-Y213 PolarHBondContact O-N 3.33Å |
| 210 | V | 85.7 | Confident | 85 | Confident | 20 Ų | 20 | 46.5 Ų | 46.5 | 12% | 0.121 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.2 | -47.6 | 177.8 | 171.7 | 0 | 0 | 0 | 0 | 111.2 | M206 I207 L208 Y213 S214 L217 V221 | M206-V210 WeakPolarHBondContact O-CG2 3.41Å; M206-V210 PolarHBondContact O-N 3.47Å; I207-V210 PolarHBondContact O-N 3Å; L208-V210 VanDerWaalsContact C-N 3.34Å; L208-V210 PolarHBondContact O-N 3.47Å; V210-Y213 PolarHBondContact O-N 3Å; V210-S214 PolarHBondContact O-N 3.47Å; V210-L217 HydrophobicContact CG1-CD2 4.03Å; V210-L217 HydrophobicContact CG1-CG 4.04Å; V210-V221 HydrophobicContact CG1-CG2 4.4Å |
| 211 | N | 83.2 | Confident | 85 | Confident | 7 Ų | 7 | 47.9 Ų | 47.9 | 4% | 0.037 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -68.8 | -34.2 | -179.2 | -79.6 | -82.2 | 0 | 0 | 0 | 112.9 | I207 L208 Y213 N363 L366 T395 L400 | I207-N211 WeakPolarHBondContact O-CB 3.26Å; I207-N211 PolarHBondContact O-N 2.89Å; I207-N211 PolarHBondContact O-ND2 2.99Å; L208-N211 PolarHBondContact O-N 3.35Å; N211-Y213 VanDerWaalsContact C-N 3.35Å; N211-N363 PolarHBondContact ND2-OD1 2.89Å; N211-L366 HydrophobicContact CB-CD2 4.23Å; N211-T395 VanDerWaalsContact O-CG2 3.28Å; N211-T395 WeakPolarHBondContact O-CG2 3.43Å; N211-L400 HydrophobicContact CB-CD1 4.12Å |
| 212 | C | 80.3 | Confident | 85 | Confident | 25 Ų | 25 | 44.3 Ų | 44.3 | 17% | 0.169 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -71.7 | -30.3 | 173.2 | -74.4 | 0 | 0 | 0 | 0 | 112.2 | L208 F209 T395 A397 | L208-C212 VanDerWaalsContact O-CB 3.29Å; L208-C212 WeakPolarHBondContact O-CB 3.29Å; L208-C212 PolarHBondContact O-N 3.07Å; L208-C212 PolarHBondContact O-SG 2.9Å; L208-C212 VanDerWaalsContact O-SG 3.33Å; F209-C212 PolarHBondContact O-N 3.43Å; C212-T395 PolarHBondContact O-OG1 3.41Å; C212-A397 HydrophobicContact CB-CB 4.45Å |
| 213 | Y | 82.2 | Confident | 85 | Confident | 111 Ų | 111 | 41.1 Ų | 41.1 | 44% | 0.435 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -74 | -48.9 | -176.3 | -172.4 | -85.7 | 0 | 0 | 0 | 112.8 | F209 V210 N211 L217 R393 | F209-Y213 HydrophobicContact CZ-CD2 4.31Å; F209-Y213 VanDerWaalsContact O-CB 3.27Å; F209-Y213 WeakPolarHBondContact O-CB 3.37Å; F209-Y213 PolarHBondContact O-N 3.33Å; V210-Y213 PolarHBondContact O-N 3Å; N211-Y213 VanDerWaalsContact C-N 3.35Å; Y213-L217 HydrophobicContact CD1-CD2 4.27Å; Y213-R393 VanDerWaalsContact O-CD 3.23Å; Y213-R393 WeakPolarHBondContact O-CD 3.09Å |
| 214 | S | 79.8 | Confident | 85.1 | Confident | 32 Ų | 32 | 45.4 Ų | 45.4 | 22% | 0.224 | 25% | 0.246 | C | C | . | . | trans | -161.5 | 130.3 | 178.4 | -178.6 | 0 | 0 | 0 | 0 | 112.1 | V210 N216 L217 G218 | V210-S214 PolarHBondContact O-N 3.47Å; S214-N216 VanDerWaalsContact C-N 3.27Å; S214-N216 PolarHBondContact O-N 3.21Å; S214-N216 PolarHBondContact OG-N 2.9Å; S214-L217 PolarHBondContact O-N 3.43Å; S214-G218 PolarHBondContact O-N 3.22Å | ||
| 215 | V | 75.1 | Confident | 85.1 | Confident | 24 Ų | 24 | 47.5 Ų | 47.5 | 15% | 0.145 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.1 | -40.7 | 171.5 | -178.2 | 0 | 0 | 0 | 0 | 111.2 | L217 G218 M219 F367 T395 | V215-L217 VanDerWaalsContact C-N 3.35Å; V215-L217 PolarHBondContact O-N 3.39Å; V215-G218 PolarHBondContact O-N 2.85Å; V215-M219 PolarHBondContact O-N 2.83Å; V215-F367 HydrophobicContact CG1-CE2 3.71Å; V215-F367 HydrophobicContact CG1-CZ 3.93Å; V215-T395 HydrophobicContact CG2-CG2 3.59Å |
| 216 | N | 81.2 | Confident | 85.2 | Confident | 85 Ų | 85 | 44.1 Ų | 44.1 | 46% | 0.455 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.4 | -40.7 | 179.5 | -69.8 | -8.4 | 0 | 0 | 0 | 111.5 | R74 S214 A220 | R74-N216 PolarHBondContact NH1-ND2 3.01Å; R74-N216 VanDerWaalsContact NH1-ND2 3.14Å; R74-N216 PolarHBondContact NH1-OD1 2.66Å; S214-N216 VanDerWaalsContact C-N 3.27Å; S214-N216 PolarHBondContact O-N 3.21Å; S214-N216 PolarHBondContact OG-N 2.9Å; N216-A220 WeakPolarHBondContact O-CB 3.41Å; N216-A220 PolarHBondContact O-N 3.3Å |
| 217 | L | 84.6 | Confident | 85.3 | Confident | 75 Ų | 75 | 41.4 Ų | 41.4 | 39% | 0.393 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -65.6 | -46.6 | 176.6 | -176.1 | 66.4 | 0 | 0 | 0 | 110.5 | V210 Y213 S214 V215 M219 A220 V221 | V210-L217 HydrophobicContact CG1-CD2 4.03Å; V210-L217 HydrophobicContact CG1-CG 4.04Å; Y213-L217 HydrophobicContact CD1-CD2 4.27Å; S214-L217 PolarHBondContact O-N 3.43Å; V215-L217 VanDerWaalsContact C-N 3.35Å; V215-L217 PolarHBondContact O-N 3.39Å; L217-M219 VanDerWaalsContact C-N 3.3Å; L217-M219 PolarHBondContact O-N 3Å; L217-A220 PolarHBondContact O-N 3.39Å; L217-V221 HydrophobicContact CD1-CG2 4.31Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.34Å; L217-V221 VanDerWaalsContact O-CG2 3.23Å; L217-V221 WeakPolarHBondContact O-CG2 3.38Å; L217-V221 PolarHBondContact O-N 3.33Å |
| 218 | G | 82.6 | Confident | 85.4 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.1 | -42.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | S214 V215 Q222 N363 | S214-G218 PolarHBondContact O-N 3.22Å; V215-G218 PolarHBondContact O-N 2.85Å; G218-Q222 WeakPolarHBondContact O-CB 3.34Å; G218-Q222 PolarHBondContact O-N 3.44Å; G218-N363 PolarHBondContact O-ND2 3.14Å |
| 219 | M | 83.8 | Confident | 85.6 | Confident | 15 Ų | 15 | 42.7 Ų | 42.7 | 7% | 0.074 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -72.9 | -36.9 | 176.1 | -72.9 | -58.2 | -47.7 | 0 | 0 | 113.7 | L75 V215 L217 Q222 N223 F367 | L75-M219 HydrophobicContact CD2-CE 3.51Å; L75-M219 HydrophobicContact CD2-CG 3.81Å; L75-M219 HydrophobicContact CD2-SD 3.73Å; V215-M219 PolarHBondContact O-N 2.83Å; L217-M219 VanDerWaalsContact C-N 3.3Å; L217-M219 PolarHBondContact O-N 3Å; M219-Q222 WeakPolarHBondContact O-CB 3.36Å; M219-Q222 PolarHBondContact O-N 2.92Å; M219-N223 PolarHBondContact O-N 3.24Å; M219-F367 HydrophobicContact CG-CE2 3.92Å; M219-F367 HydrophobicContact CG-CZ 3.73Å; M219-F367 HydrophobicContact SD-CD1 4.28Å; M219-F367 HydrophobicContact SD-CD2 4.48Å; M219-F367 HydrophobicContact SD-CE1 3.69Å; M219-F367 HydrophobicContact SD-CE2 3.91Å; M219-F367 HydrophobicContact SD-CZ 3.46Å; M219-F367 WeakPolarHBondContact SD-CZ 3.38Å |
| 220 | A | 87.9 | Confident | 85.8 | Confident | 51 Ų | 51 | 38.6 Ų | 38.6 | 42% | 0.421 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.3 | -45.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | N216 L217 Q222 N223 V224 | N216-A220 WeakPolarHBondContact O-CB 3.41Å; N216-A220 PolarHBondContact O-N 3.3Å; L217-A220 PolarHBondContact O-N 3.39Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 2.99Å; A220-N223 PolarHBondContact O-N 3.42Å; A220-V224 WeakPolarHBondContact O-CG2 3.33Å; A220-V224 PolarHBondContact O-N 3.43Å |
| 221 | V | 87.8 | Confident | 86 | Confident | 31 Ų | 31 | 42.2 Ų | 42.2 | 19% | 0.188 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -58.1 | -45 | 173.8 | 171.1 | 0 | 0 | 0 | 0 | 110.6 | V210 L217 N223 V224 F225 F359 | V210-V221 HydrophobicContact CG1-CG2 4.4Å; L217-V221 HydrophobicContact CD1-CG2 4.31Å; L217-V221 HydrophobicContact CG-CG2 4.34Å; L217-V221 WeakPolarHBondContact O-CB 3.34Å; L217-V221 VanDerWaalsContact O-CG2 3.23Å; L217-V221 WeakPolarHBondContact O-CG2 3.38Å; L217-V221 PolarHBondContact O-N 3.33Å; V221-N223 PolarHBondContact O-N 3.12Å; V221-V224 PolarHBondContact O-N 3.01Å; V221-F225 HydrophobicContact CG1-CD2 3.47Å; V221-F225 VanDerWaalsContact CG1-CD2 3.47Å; V221-F225 HydrophobicContact CG1-CE2 3.21Å; V221-F225 HydrophobicContact CG1-CG 4.48Å; V221-F225 HydrophobicContact CG1-CZ 4.06Å; V221-F225 WeakPolarHBondContact O-CB 3.42Å; V221-F225 WeakPolarHBondContact O-CD2 3.49Å; V221-F225 WeakPolarHBondContact O-CG 3.27Å; V221-F225 PolarHBondContact O-N 3.06Å; V221-F359 HydrophobicContact CG1-CE1 4.46Å |
| 222 | Q | 88.5 | Confident | 86.2 | Confident | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.005 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -56.9 | -48.5 | 175.5 | -170 | 63.2 | 43.7 | 0 | 0 | 112.4 | L83 G218 M219 A220 T226 G360 N363 | L83-Q222 HydrophobicContact CD1-CG 4.06Å; G218-Q222 WeakPolarHBondContact O-CB 3.34Å; G218-Q222 PolarHBondContact O-N 3.44Å; M219-Q222 WeakPolarHBondContact O-CB 3.36Å; M219-Q222 PolarHBondContact O-N 2.92Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 2.99Å; Q222-T226 PolarHBondContact NE2-OG1 2.99Å; Q222-T226 VanDerWaalsContact O-CB 3.25Å; Q222-T226 WeakPolarHBondContact O-CB 3.25Å; Q222-T226 PolarHBondContact O-N 2.99Å; Q222-T226 PolarHBondContact O-OG1 3.4Å; Q222-G360 PolarHBondContact NE2-O 3.38Å; Q222-G360 PolarHBondContact OE1-O 2.89Å; Q222-N363 PolarHBondContact OE1-ND2 3.18Å |
| 223 | N | 89.4 | Confident | 86.6 | Confident | 33 Ų | 33 | 41.6 Ų | 41.6 | 18% | 0.176 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.8 | -43.8 | -178.1 | -73.8 | -6.3 | 0 | 0 | 0 | 111.5 | S79 A82 M219 A220 V221 T226 A227 | S79-N223 PolarHBondContact OG-ND2 3.39Å; A82-N223 WeakPolarHBondContact CB-OD1 3.32Å; M219-N223 PolarHBondContact O-N 3.24Å; A220-N223 PolarHBondContact O-N 3.42Å; V221-N223 PolarHBondContact O-N 3.12Å; N223-T226 PolarHBondContact O-N 3.38Å; N223-A227 PolarHBondContact O-N 3.33Å |
| 224 | V | 91.3 | Very high | 87.1 | Confident | 95 Ų | 95 | 40.2 Ų | 40.2 | 58% | 0.576 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -63.7 | -48.1 | 178.7 | 172 | 0 | 0 | 0 | 0 | 111.1 | A220 V221 T226 A227 A228 | A220-V224 WeakPolarHBondContact O-CG2 3.33Å; A220-V224 PolarHBondContact O-N 3.43Å; V221-V224 PolarHBondContact O-N 3.01Å; V224-T226 VanDerWaalsContact C-N 3.28Å; V224-T226 PolarHBondContact O-N 3.34Å; V224-A227 PolarHBondContact O-N 2.8Å; V224-A228 WeakPolarHBondContact O-CB 3.23Å; V224-A228 PolarHBondContact O-N 2.89Å |
| 225 | F | 89.8 | Confident | 87.5 | Confident | 53 Ų | 53 | 40.9 Ų | 40.9 | 23% | 0.232 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -67.7 | -30.4 | 178.3 | -67.5 | -28 | 0 | 0 | 0 | 112.9 | V221 A228 K229 I356 F359 | V221-F225 HydrophobicContact CG1-CD2 3.47Å; V221-F225 VanDerWaalsContact CG1-CD2 3.47Å; V221-F225 HydrophobicContact CG1-CE2 3.21Å; V221-F225 HydrophobicContact CG1-CG 4.48Å; V221-F225 HydrophobicContact CG1-CZ 4.06Å; V221-F225 WeakPolarHBondContact O-CB 3.42Å; V221-F225 WeakPolarHBondContact O-CD2 3.49Å; V221-F225 WeakPolarHBondContact O-CG 3.27Å; V221-F225 PolarHBondContact O-N 3.06Å; F225-A228 PolarHBondContact O-N 3.42Å; F225-K229 WeakPolarHBondContact O-CB 3.22Å; F225-K229 WeakPolarHBondContact O-CG 3.23Å; F225-K229 PolarHBondContact O-N 3.37Å; F225-I356 HydrophobicContact CB-CG2 4.08Å; F225-I356 HydrophobicContact CD1-CG2 3.64Å; F225-I356 HydrophobicContact CE1-CG2 4.35Å; F225-I356 HydrophobicContact CG-CG2 4.07Å; F225-F359 AromaticContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CE1 4.4Å; F225-F359 AromaticContact CE2-CD1 3.28Å; F225-F359 HydrophobicContact CE2-CD1 3.28Å; F225-F359 AromaticContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CG 4.27Å; F225-F359 HydrophobicContact CZ-CD1 4.19Å; F225-F359 HydrophobicContact CZ-CE1 4.41Å |
| 226 | T | 89.6 | Confident | 88.2 | Confident | 4 Ų | 4 | 40 Ų | 40 | 3% | 0.025 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -69.2 | -38.7 | 173.5 | -56.2 | 0 | 0 | 0 | 0 | 112.2 | A82 V85 G86 Q222 N223 V224 K229 L230 | A82-T226 HydrophobicContact CB-CG2 4.18Å; A82-T226 WeakPolarHBondContact O-CG2 3.22Å; A82-T226 PolarHBondContact O-OG1 3.2Å; V85-T226 HydrophobicContact CB-CG2 4.17Å; V85-T226 HydrophobicContact CG1-CG2 4.04Å; G86-T226 VanDerWaalsContact CA-OG1 3.3Å; G86-T226 WeakPolarHBondContact CA-OG1 3.29Å; Q222-T226 PolarHBondContact NE2-OG1 2.99Å; Q222-T226 VanDerWaalsContact O-CB 3.25Å; Q222-T226 WeakPolarHBondContact O-CB 3.25Å; Q222-T226 PolarHBondContact O-N 2.99Å; Q222-T226 PolarHBondContact O-OG1 3.4Å; N223-T226 PolarHBondContact O-N 3.38Å; V224-T226 VanDerWaalsContact C-N 3.28Å; V224-T226 PolarHBondContact O-N 3.34Å; T226-K229 VanDerWaalsContact O-CG 3.28Å; T226-K229 WeakPolarHBondContact O-CG 3.3Å; T226-L230 VanDerWaalsContact O-CG 3.32Å; T226-L230 WeakPolarHBondContact O-CG 3.49Å; T226-L230 PolarHBondContact O-N 2.8Å |
| 227 | A | 90.6 | Very high | 88.7 | Confident | 52 Ų | 52 | 37.6 Ų | 37.6 | 43% | 0.43 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -64.7 | -47.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111 | N223 V224 K229 L230 V231 | N223-A227 PolarHBondContact O-N 3.33Å; V224-A227 PolarHBondContact O-N 2.8Å; A227-K229 PolarHBondContact O-N 3.12Å; A227-L230 PolarHBondContact O-N 3.49Å; A227-V231 WeakPolarHBondContact O-CG2 3.46Å; A227-V231 PolarHBondContact O-N 3.14Å; A227-V231 VanDerWaalsContact O-N 3.11Å |
| 228 | A | 89.6 | Confident | 89 | Confident | 42 Ų | 42 | 37.8 Ų | 37.8 | 35% | 0.347 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.2 | -43.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | V224 F225 V231 A232 I356 | V224-A228 WeakPolarHBondContact O-CB 3.23Å; V224-A228 PolarHBondContact O-N 2.89Å; F225-A228 PolarHBondContact O-N 3.42Å; A228-V231 WeakPolarHBondContact O-CB 3.36Å; A228-V231 PolarHBondContact O-N 2.92Å; A228-A232 PolarHBondContact O-N 3.19Å; A228-A232 VanDerWaalsContact O-N 3.09Å; A228-I356 HydrophobicContact CB-CG2 3.94Å |
| 229 | K | 88.5 | Confident | 89.3 | Confident | 3 Ų | 3 | 38.2 Ų | 38.2 | 1% | 0.013 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -70.4 | -32.4 | 178.1 | 73.4 | -170.5 | -172.3 | 162.7 | 0 | 113.3 | V85 G86 I89 F225 T226 A227 V231 A232 V233 | V85-K229 WeakPolarHBondContact O-CE 3.39Å; V85-K229 PolarHBondContact O-NZ 3.28Å; G86-K229 PolarHBondContact O-NZ 3.28Å; I89-K229 HydrophobicContact CB-CD 4.28Å; I89-K229 HydrophobicContact CG2-CD 4.25Å; I89-K229 PolarHBondContact O-NZ 2.73Å; F225-K229 WeakPolarHBondContact O-CB 3.22Å; F225-K229 WeakPolarHBondContact O-CG 3.23Å; F225-K229 PolarHBondContact O-N 3.37Å; T226-K229 VanDerWaalsContact O-CG 3.28Å; T226-K229 WeakPolarHBondContact O-CG 3.3Å; A227-K229 PolarHBondContact O-N 3.12Å; K229-V231 VanDerWaalsContact C-N 3.3Å; K229-V231 PolarHBondContact O-N 2.65Å; K229-A232 WeakPolarHBondContact O-CB 3.41Å; K229-A232 PolarHBondContact O-N 3.04Å; K229-V233 WeakPolarHBondContact O-CG2 3.41Å; K229-V233 PolarHBondContact O-N 2.73Å |
| 230 | L | 89.8 | Confident | 89.6 | Confident | 52 Ų | 52 | 37.5 Ų | 37.5 | 27% | 0.272 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64.5 | -38.3 | 174 | -75.8 | 175.8 | 0 | 0 | 0 | 110.9 | V85 I89 T226 A227 V233 V234 | V85-L230 HydrophobicContact CG1-CD1 4.41Å; V85-L230 HydrophobicContact CG1-CD2 3.97Å; V85-L230 HydrophobicContact CG1-CG 4.35Å; I89-L230 HydrophobicContact CD1-CD2 4.08Å; T226-L230 VanDerWaalsContact O-CG 3.32Å; T226-L230 WeakPolarHBondContact O-CG 3.49Å; T226-L230 PolarHBondContact O-N 2.8Å; A227-L230 PolarHBondContact O-N 3.49Å; L230-V233 PolarHBondContact O-N 3.02Å; L230-V234 WeakPolarHBondContact O-CG2 3.3Å; L230-V234 PolarHBondContact O-N 3.19Å |
| 231 | V | 90.2 | Very high | 89.7 | Confident | 95 Ų | 95 | 37.2 Ų | 37.2 | 58% | 0.576 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -60 | -46.8 | 171.5 | 177 | 0 | 0 | 0 | 0 | 110.6 | A227 A228 K229 V233 V234 V235 | A227-V231 WeakPolarHBondContact O-CG2 3.46Å; A227-V231 PolarHBondContact O-N 3.14Å; A227-V231 VanDerWaalsContact O-N 3.11Å; A228-V231 WeakPolarHBondContact O-CB 3.36Å; A228-V231 PolarHBondContact O-N 2.92Å; K229-V231 VanDerWaalsContact C-N 3.3Å; K229-V231 PolarHBondContact O-N 2.65Å; V231-V233 VanDerWaalsContact C-N 3.35Å; V231-V233 PolarHBondContact O-N 2.9Å; V231-V234 WeakPolarHBondContact O-CB 3.04Å; V231-V234 PolarHBondContact O-N 3.17Å; V231-V235 WeakPolarHBondContact O-CG2 3.09Å; V231-V235 PolarHBondContact O-N 3.45Å |
| 232 | A | 87.2 | Confident | 89.9 | Confident | 13 Ų | 13 | 41.9 Ų | 41.9 | 11% | 0.107 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.8 | -42.2 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | A228 K229 V234 V235 V236 S353 | A228-A232 PolarHBondContact O-N 3.19Å; A228-A232 VanDerWaalsContact O-N 3.09Å; K229-A232 WeakPolarHBondContact O-CB 3.41Å; K229-A232 PolarHBondContact O-N 3.04Å; A232-V234 VanDerWaalsContact C-N 3.33Å; A232-V234 PolarHBondContact O-N 2.98Å; A232-V235 WeakPolarHBondContact O-CB 3.42Å; A232-V235 PolarHBondContact O-N 2.67Å; A232-V236 WeakPolarHBondContact O-CG2 3.49Å; A232-V236 PolarHBondContact O-N 2.78Å; A232-S353 VanDerWaalsContact CB-CB 3.41Å; A232-S353 WeakPolarHBondContact CB-OG 3.44Å |
| 233 | V | 90 | Very high | 89.8 | Confident | 7 Ų | 7 | 44 Ų | 44 | 4% | 0.042 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.3 | -43.7 | 174.5 | 165.5 | 0 | 0 | 0 | 0 | 110.9 | I89 K229 L230 V231 V235 V236 I237 C311 I315 | I89-V233 HydrophobicContact CG2-CG2 4.42Å; K229-V233 WeakPolarHBondContact O-CG2 3.41Å; K229-V233 PolarHBondContact O-N 2.73Å; L230-V233 PolarHBondContact O-N 3.02Å; V231-V233 VanDerWaalsContact C-N 3.35Å; V231-V233 PolarHBondContact O-N 2.9Å; V233-V235 VanDerWaalsContact C-N 3.32Å; V233-V235 PolarHBondContact O-N 2.8Å; V233-V236 PolarHBondContact O-N 2.83Å; V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.35Å; V233-I237 VanDerWaalsContact O-CG1 3.26Å; V233-I237 WeakPolarHBondContact O-CG1 3.42Å; V233-I237 PolarHBondContact O-N 3.26Å; V233-C311 HydrophobicContact CG1-CB 3.91Å; V233-I315 HydrophobicContact CB-CD1 4.39Å; V233-I315 HydrophobicContact CG1-CD1 3.84Å; V233-I315 HydrophobicContact CG1-CG1 4.17Å; V233-I315 HydrophobicContact CG2-CD1 3.88Å |
| 234 | V | 91.1 | Very high | 89.8 | Confident | 82 Ų | 82 | 45.3 Ų | 45.3 | 50% | 0.497 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.1 | -41.6 | 175.9 | 170.2 | 0 | 0 | 0 | 0 | 111.2 | L230 V231 A232 V236 I237 C238 | L230-V234 WeakPolarHBondContact O-CG2 3.3Å; L230-V234 PolarHBondContact O-N 3.19Å; V231-V234 WeakPolarHBondContact O-CB 3.04Å; V231-V234 PolarHBondContact O-N 3.17Å; A232-V234 VanDerWaalsContact C-N 3.33Å; A232-V234 PolarHBondContact O-N 2.98Å; V234-V236 VanDerWaalsContact C-N 3.34Å; V234-V236 PolarHBondContact O-N 3.22Å; V234-I237 PolarHBondContact O-N 3.24Å; V234-C238 WeakPolarHBondContact O-CB 3.35Å; V234-C238 PolarHBondContact O-N 2.99Å; V234-C238 PolarHBondContact O-SG 3.47Å |
| 235 | V | 89.1 | Confident | 89.6 | Confident | 46 Ų | 46 | 47.9 Ų | 47.9 | 28% | 0.279 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59 | -44.7 | 176 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | V231 A232 V233 C238 G239 L343 | V231-V235 WeakPolarHBondContact O-CG2 3.09Å; V231-V235 PolarHBondContact O-N 3.45Å; A232-V235 WeakPolarHBondContact O-CB 3.42Å; A232-V235 PolarHBondContact O-N 2.67Å; V233-V235 VanDerWaalsContact C-N 3.32Å; V233-V235 PolarHBondContact O-N 2.8Å; V235-C238 PolarHBondContact O-N 3.06Å; V235-G239 PolarHBondContact O-N 2.85Å; V235-L343 HydrophobicContact CG1-CD1 4.33Å; V235-L343 HydrophobicContact CG1-CD2 4.31Å |
| 236 | V | 89.3 | Confident | 89.5 | Confident | 5 Ų | 5 | 50.3 Ų | 50.3 | 3% | 0.03 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -61.8 | -46.8 | 176.2 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | A232 V233 V234 C238 G239 G240 I315 Y319 F338 M350 | A232-V236 WeakPolarHBondContact O-CG2 3.49Å; A232-V236 PolarHBondContact O-N 2.78Å; V233-V236 PolarHBondContact O-N 2.83Å; V234-V236 VanDerWaalsContact C-N 3.34Å; V234-V236 PolarHBondContact O-N 3.22Å; V236-C238 PolarHBondContact O-N 3.3Å; V236-G239 PolarHBondContact O-N 3.45Å; V236-G240 PolarHBondContact O-N 3.32Å; V236-I315 HydrophobicContact CG1-CG1 4.34Å; V236-I315 HydrophobicContact CG1-CG2 4.34Å; V236-Y319 HydrophobicContact CG1-CD1 4.45Å; V236-Y319 HydrophobicContact CG1-CE1 3.97Å; V236-F338 HydrophobicContact CB-CE1 4.16Å; V236-F338 HydrophobicContact CB-CZ 4.45Å; V236-F338 HydrophobicContact CG1-CD1 4.4Å; V236-F338 HydrophobicContact CG1-CE1 3.88Å; V236-F338 HydrophobicContact CG1-CE2 4.42Å; V236-F338 HydrophobicContact CG1-CZ 3.87Å; V236-F338 HydrophobicContact CG2-CD1 4.42Å; V236-F338 HydrophobicContact CG2-CE1 4.1Å; V236-F338 WeakPolarHBondContact O-CZ 3.25Å; V236-M350 HydrophobicContact CG2-CE 3.54Å; V236-M350 HydrophobicContact CG2-SD 4.06Å |
| 237 | I | 91.7 | Very high | 89.2 | Confident | 35 Ų | 35 | 52.4 Ų | 52.4 | 18% | 0.179 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.5 | -44.8 | -179.7 | -66.4 | 169.2 | 0 | 0 | 0 | 111.1 | V233 V234 G240 A241 L314 I315 | V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.35Å; V233-I237 VanDerWaalsContact O-CG1 3.26Å; V233-I237 WeakPolarHBondContact O-CG1 3.42Å; V233-I237 PolarHBondContact O-N 3.26Å; V234-I237 PolarHBondContact O-N 3.24Å; I237-G240 PolarHBondContact O-N 2.85Å; I237-A241 WeakPolarHBondContact O-CB 3.5Å; I237-A241 PolarHBondContact O-N 2.83Å; I237-L314 HydrophobicContact CD1-CB 3.73Å; I237-L314 HydrophobicContact CD1-CD1 3.95Å; I237-L314 HydrophobicContact CG1-CB 3.76Å; I237-L314 HydrophobicContact CG2-CB 4.25Å; I237-L314 HydrophobicContact CG2-CD1 4.29Å; I237-I315 HydrophobicContact CG1-CG1 4.41Å |
| 238 | C | 91.9 | Very high | 88.8 | Confident | 78 Ų | 78 | 52.1 Ų | 52.1 | 53% | 0.527 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 177 | -70.6 | 0 | 0 | 0 | 0 | 111.9 | V234 V235 V236 A241 W242 | V234-C238 WeakPolarHBondContact O-CB 3.35Å; V234-C238 PolarHBondContact O-N 2.99Å; V234-C238 PolarHBondContact O-SG 3.47Å; V235-C238 PolarHBondContact O-N 3.06Å; V236-C238 PolarHBondContact O-N 3.3Å; C238-A241 PolarHBondContact O-N 3.29Å; C238-W242 WeakPolarHBondContact O-CB 3.41Å; C238-W242 PolarHBondContact O-N 3.22Å |
| 239 | G | 89.1 | Confident | 88.5 | Confident | 10 Ų | 10 | 53.5 Ų | 53.5 | 10% | 0.103 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.3 | -42.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | V235 V236 W242 K243 | V235-G239 PolarHBondContact O-N 2.85Å; V236-G239 PolarHBondContact O-N 3.45Å; G239-W242 PolarHBondContact O-N 2.97Å; G239-K243 PolarHBondContact O-N 3.16Å |
| 240 | G | 88.8 | Confident | 88 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.9 | -49.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V236 I237 W242 K243 L244 | V236-G240 PolarHBondContact O-N 3.32Å; I237-G240 PolarHBondContact O-N 2.85Å; G240-W242 VanDerWaalsContact C-N 3.26Å; G240-W242 PolarHBondContact O-N 3.18Å; G240-K243 WeakPolarHBondContact O-CA 3.24Å; G240-K243 WeakPolarHBondContact O-CB 3.42Å; G240-K243 PolarHBondContact O-N 2.86Å; G240-L244 WeakPolarHBondContact O-CD1 3.38Å; G240-L244 PolarHBondContact O-N 2.76Å |
| 241 | A | 90.8 | Very high | 87.5 | Confident | 44 Ų | 44 | 60.1 Ų | 60.1 | 36% | 0.364 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -56.8 | -40.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I237 C238 K243 L244 M245 | I237-A241 WeakPolarHBondContact O-CB 3.5Å; I237-A241 PolarHBondContact O-N 2.83Å; C238-A241 PolarHBondContact O-N 3.29Å; A241-K243 PolarHBondContact O-N 3.01Å; A241-L244 PolarHBondContact O-N 2.79Å; A241-M245 WeakPolarHBondContact O-CG 3.46Å; A241-M245 PolarHBondContact O-N 3.39Å |
| 242 | W | 91 | Very high | 86.9 | Confident | 129 Ų | 129 | 57.7 Ų | 57.7 | 49% | 0.489 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -61 | -42.1 | 174.3 | -179.5 | 61.8 | 0 | 0 | 0 | 112.8 | C238 G239 G240 M245 Q246 | C238-W242 WeakPolarHBondContact O-CB 3.41Å; C238-W242 PolarHBondContact O-N 3.22Å; G239-W242 PolarHBondContact O-N 2.97Å; G240-W242 VanDerWaalsContact C-N 3.26Å; G240-W242 PolarHBondContact O-N 3.18Å; W242-M245 HydrophobicContact CB-CE 4.43Å; W242-M245 PolarHBondContact O-N 3.34Å; W242-Q246 WeakPolarHBondContact O-CG 3.35Å; W242-Q246 PolarHBondContact O-N 2.81Å |
| 243 | K | 87.6 | Confident | 86.4 | Confident | 47 Ų | 47 | 61.6 Ų | 61.6 | 20% | 0.204 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -66.6 | -37 | 174.3 | -75.2 | -69.6 | -178 | -176.8 | 0 | 113.2 | G239 G240 A241 M245 Q246 N248 A321 I342 | G239-K243 PolarHBondContact O-N 3.16Å; G240-K243 WeakPolarHBondContact O-CA 3.24Å; G240-K243 WeakPolarHBondContact O-CB 3.42Å; G240-K243 PolarHBondContact O-N 2.86Å; A241-K243 PolarHBondContact O-N 3.01Å; K243-M245 VanDerWaalsContact C-N 3.35Å; K243-Q246 PolarHBondContact O-N 3.26Å; K243-N248 WeakPolarHBondContact O-CB 3.27Å; K243-N248 PolarHBondContact O-N 3.03Å; K243-A321 HydrophobicContact CB-CB 4.23Å; K243-I342 HydrophobicContact CG-CD1 4.05Å; K243-I342 HydrophobicContact CG-CG1 4.1Å |
| 244 | L | 88.6 | Confident | 85.9 | Confident | 59 Ų | 59 | 66 Ų | 66 | 31% | 0.309 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.6 | -42.5 | 172 | -88.5 | 96.2 | 0 | 0 | 0 | 111.5 | G240 A241 Q246 G247 L252 I317 A321 | G240-L244 WeakPolarHBondContact O-CD1 3.38Å; G240-L244 PolarHBondContact O-N 2.76Å; A241-L244 PolarHBondContact O-N 2.79Å; L244-Q246 PolarHBondContact O-N 3.41Å; L244-G247 WeakPolarHBondContact O-CA 3.39Å; L244-G247 PolarHBondContact O-N 3.08Å; L244-L252 HydrophobicContact CD2-CD1 4.36Å; L244-I317 HydrophobicContact CD1-CG2 4.08Å; L244-I317 HydrophobicContact CD2-CG2 4.44Å; L244-A321 HydrophobicContact CD1-CB 3.32Å; L244-A321 HydrophobicContact CG-CB 4.16Å |
| 245 | M | 88.5 | Confident | 85.3 | Confident | 150 Ų | 150 | 63 Ų | 63 | 74% | 0.739 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -64.3 | -26.1 | 178.3 | -72.2 | -174.3 | -70.1 | 0 | 0 | 113 | A241 W242 K243 G247 | A241-M245 WeakPolarHBondContact O-CG 3.46Å; A241-M245 PolarHBondContact O-N 3.39Å; W242-M245 HydrophobicContact CB-CE 4.43Å; W242-M245 PolarHBondContact O-N 3.34Å; K243-M245 VanDerWaalsContact C-N 3.35Å; M245-G247 PolarHBondContact O-N 3.13Å |
| 246 | Q | 87.3 | Confident | 85.1 | Confident | 104 Ų | 104 | 67.3 Ų | 67.3 | 49% | 0.486 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.3 | -2.2 | 171.1 | -69.5 | 175.5 | 5.3 | 0 | 0 | 113.6 | W242 K243 L244 | W242-Q246 WeakPolarHBondContact O-CG 3.35Å; W242-Q246 PolarHBondContact O-N 2.81Å; K243-Q246 PolarHBondContact O-N 3.26Å; L244-Q246 PolarHBondContact O-N 3.41Å |
| 247 | G | 83.4 | Confident | 84.5 | Confident | 48 Ų | 48 | 72.9 Ų | 72.9 | 50% | 0.495 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.9 | 13.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | L244 M245 T249 | L244-G247 WeakPolarHBondContact O-CA 3.39Å; L244-G247 PolarHBondContact O-N 3.08Å; M245-G247 PolarHBondContact O-N 3.13Å; G247-T249 PolarHBondContact O-N 2.91Å |
| 248 | N | 81.6 | Confident | 83.8 | Confident | 46 Ų | 46 | 72.7 Ų | 72.7 | 25% | 0.246 | 40% | 0.403 | C | S | . | . | trans | -80.8 | 60.3 | -179.4 | -156.9 | 26.7 | 0 | 0 | 0 | 112.9 | K243 A321 | K243-N248 WeakPolarHBondContact O-CB 3.27Å; K243-N248 PolarHBondContact O-N 3.03Å; N248-A321 PolarHBondContact ND2-O 2.89Å | ||
| 249 | T | 82.3 | Confident | 83.2 | Confident | 70 Ų | 70 | 73.9 Ų | 73.9 | 43% | 0.429 | 41% | 0.409 | S | S | . | . | trans | -98.8 | 5.8 | -179 | 56.5 | 0 | 0 | 0 | 0 | 113.3 | G247 H251 L252 S253 | G247-T249 PolarHBondContact O-N 2.91Å; T249-H251 VanDerWaalsContact C-N 3.29Å; T249-H251 PolarHBondContact O-N 2.88Å; T249-L252 PolarHBondContact O-N 2.96Å; T249-S253 PolarHBondContact O-N 3.41Å | ||
| 250 | Q | 79.4 | Confident | 82.6 | Confident | 139 Ų | 139 | 82 Ų | 82 | 65% | 0.65 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -58.3 | -39.3 | -172.3 | -59.2 | -177.7 | 8.2 | 0 | 0 | 112.6 | L252 | Q250-L252 VanDerWaalsContact C-N 3.32Å; Q250-L252 PolarHBondContact O-N 2.94Å |
| 251 | H | 78.8 | Confident | 82.3 | Confident | 55 Ų | 55 | 83.1 Ų | 83.1 | 26% | 0.255 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -77.2 | -16 | 179.1 | -56.4 | -48.8 | 0 | 0 | 0 | 113.8 | T249 L320 | T249-H251 VanDerWaalsContact C-N 3.29Å; T249-H251 PolarHBondContact O-N 2.88Å; H251-L320 WeakPolarHBondContact CB-O 3.12Å; H251-L320 PolarHBondContact CD2-O 2.81Å |
| 252 | L | 77.1 | Confident | 82.2 | Confident | 45 Ų | 45 | 86.3 Ų | 86.3 | 24% | 0.236 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -94.6 | -28.5 | 177.7 | -71.7 | 151.7 | 0 | 0 | 0 | 112 | F111 L244 T249 Q250 N254 A255 | F111-L252 HydrophobicContact CE2-CD2 4.4Å; L244-L252 HydrophobicContact CD2-CD1 4.36Å; T249-L252 PolarHBondContact O-N 2.96Å; Q250-L252 VanDerWaalsContact C-N 3.32Å; Q250-L252 PolarHBondContact O-N 2.94Å; L252-N254 VanDerWaalsContact C-N 3.26Å; L252-N254 PolarHBondContact O-N 3.15Å; L252-A255 WeakPolarHBondContact O-CB 3.2Å; L252-A255 PolarHBondContact O-N 2.65Å |
| 253 | S | 77.1 | Confident | 82.2 | Confident | 95 Ų | 95 | 86 Ų | 86 | 66% | 0.664 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.9 | -30.5 | -177.4 | -174.6 | 0 | 0 | 0 | 0 | 113.6 | T249 | T249-S253 PolarHBondContact O-N 3.41Å |
| 254 | N | 79 | Confident | 82.3 | Confident | 100 Ų | 100 | 85.9 Ų | 85.9 | 54% | 0.535 | 49% | 0.489 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.4 | 36.9 | -178.9 | -74.6 | -33.6 | 0 | 0 | 0 | 111.6 | L252 F256 N257 | L252-N254 VanDerWaalsContact C-N 3.26Å; L252-N254 PolarHBondContact O-N 3.15Å; N254-F256 PolarHBondContact O-N 2.93Å; N254-F256 VanDerWaalsContact O-N 3.11Å; N254-N257 HydrophobicContact CB-CB 4.25Å; N254-N257 WeakPolarHBondContact CB-ND2 3.49Å; N254-N257 WeakPolarHBondContact O-CB 3.4Å; N254-N257 PolarHBondContact O-N 3.48Å; N254-N257 PolarHBondContact OD1-ND2 3.22Å |
| 255 | A | 79.8 | Confident | 82.2 | Confident | 19 Ų | 19 | 84 Ų | 84 | 16% | 0.157 | 48% | 0.482 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | -34.3 | -169.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | S106 V107 G108 L252 | S106-A255 PolarHBondContact OG-O 2.98Å; V107-A255 HydrophobicContact CB-CB 4.42Å; V107-A255 HydrophobicContact CG1-CB 4.33Å; V107-A255 PolarHBondContact N-O 2.96Å; G108-A255 PolarHBondContact N-O 3.31Å; L252-A255 WeakPolarHBondContact O-CB 3.2Å; L252-A255 PolarHBondContact O-N 2.65Å |
| 256 | F | 84.5 | Confident | 82.3 | Confident | 136 Ų | 136 | 79.7 Ų | 79.7 | 60% | 0.596 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.3 | 4.3 | -178.2 | -65.3 | -78.9 | 0 | 0 | 0 | 114.4 | I112 N254 G258 | I112-F256 HydrophobicContact CD1-CE1 3.97Å; I112-F256 HydrophobicContact CD1-CZ 4.3Å; N254-F256 PolarHBondContact O-N 2.93Å; N254-F256 VanDerWaalsContact O-N 3.11Å; F256-G258 PolarHBondContact O-N 2.95Å |
| 257 | N | 76.9 | Confident | 82.5 | Confident | 121 Ų | 121 | 76.9 Ų | 76.9 | 65% | 0.647 | 46% | 0.456 | S | S | * | . | trans | -78.7 | 89.3 | 174.7 | -73.6 | -14.6 | 0 | 0 | 0 | 109.4 | N254 | N254-N257 HydrophobicContact CB-CB 4.25Å; N254-N257 WeakPolarHBondContact CB-ND2 3.49Å; N254-N257 WeakPolarHBondContact O-CB 3.4Å; N254-N257 PolarHBondContact O-N 3.48Å; N254-N257 PolarHBondContact OD1-ND2 3.22Å | ||
| 258 | G | 76.7 | Confident | 82.7 | Confident | 32 Ų | 32 | 77 Ų | 77 | 33% | 0.33 | 45% | 0.447 | S | S | . | . | S | Bend | trans | -166.5 | 160.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | G105 F256 M260 | G105-G258 WeakPolarHBondContact O-CA 3.46Å; F256-G258 PolarHBondContact O-N 2.95Å; G258-M260 PolarHBondContact O-N 3.27Å |
| 259 | P | 78.3 | Confident | 83.1 | Confident | 102 Ų | 102 | 74.8 Ų | 74.8 | 66% | 0.662 | 44% | 0.435 | S | S | * | . | P | Polyproline II helix | trans | -60.5 | 139.3 | 174.8 | 26.1 | -32.3 | 0 | 0 | 0 | 109.8 | P261 | P259-P261 WeakPolarHBondContact O-CD 3.36Š|
| 260 | M | 77.6 | Confident | 83.5 | Confident | 180 Ų | 180 | 73.9 Ų | 73.9 | 89% | 0.887 | 43% | 0.426 | S | S | * | . | P | Polyproline II helix | trans | -61.8 | 120.5 | 172.2 | -85.7 | -89.1 | -100.1 | 0 | 0 | 109 | G258 | G258-M260 PolarHBondContact O-N 3.27Š|
| 261 | P | 82 | Confident | 84 | Confident | 25 Ų | 25 | 75.9 Ų | 75.9 | 16% | 0.162 | 43% | 0.428 | C | S | . | . | P | Polyproline II helix | trans | -68.6 | 142.8 | -178.5 | 24.5 | -30.1 | 0 | 0 | 0 | 110.4 | V109 P259 A265 I266 | V109-P261 HydrophobicContact CG1-CG 4.01Å; P259-P261 WeakPolarHBondContact O-CD 3.36Å; P261-A265 HydrophobicContact CB-CB 4.02Å; P261-I266 HydrophobicContact CB-CG1 4.04Å; P261-I266 HydrophobicContact CG-CD1 4.25Å; P261-I266 HydrophobicContact CG-CG1 3.84Å |
| 262 | N | 89.1 | Confident | 84.5 | Confident | 111 Ų | 111 | 74 Ų | 74 | 59% | 0.594 | 42% | 0.42 | S | S | * | . | P | Polyproline II helix | trans | -69.7 | 165.2 | 173 | 70.8 | 22.5 | 0 | 0 | 0 | 110.6 | G264 A265 I266 | N262-G264 PolarHBondContact O-N 3.28Å; N262-G264 PolarHBondContact OD1-N 3.44Å; N262-A265 PolarHBondContact O-N 3.03Å; N262-A265 VanDerWaalsContact O-N 3.1Å; N262-A265 WeakPolarHBondContact OD1-CB 2.98Å; N262-A265 PolarHBondContact OD1-N 3.36Å; N262-I266 WeakPolarHBondContact O-CG1 3.38Å; N262-I266 PolarHBondContact O-N 3.48Å |
| 263 | V | 90.3 | Very high | 85.1 | Confident | 123 Ų | 123 | 71.8 Ų | 71.8 | 75% | 0.745 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -58.4 | -35.8 | -177.9 | 179.5 | 0 | 0 | 0 | 0 | 112.1 | I266 A267 | V263-I266 PolarHBondContact O-N 3.06Å; V263-A267 WeakPolarHBondContact O-CB 3.46Å; V263-A267 PolarHBondContact O-N 3.46Å |
| 264 | G | 89.4 | Confident | 85.8 | Confident | 43 Ų | 43 | 70.5 Ų | 70.5 | 44% | 0.443 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -67.2 | -38.6 | 177 | 0 | 0 | 0 | 0 | 0 | 113.4 | N262 A267 T268 | N262-G264 PolarHBondContact O-N 3.28Å; N262-G264 PolarHBondContact OD1-N 3.44Å; G264-A267 PolarHBondContact O-N 2.93Å; G264-T268 WeakPolarHBondContact O-CG2 3.3Å; G264-T268 PolarHBondContact O-N 3.49Å; G264-T268 PolarHBondContact O-OG1 3.45Å; G264-T268 VanDerWaalsContact O-OG1 3.14Å |
| 265 | A | 87.6 | Confident | 86.3 | Confident | 19 Ų | 19 | 68.9 Ų | 68.9 | 16% | 0.157 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -67.6 | -40.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | P261 N262 T268 A269 | P261-A265 HydrophobicContact CB-CB 4.02Å; N262-A265 PolarHBondContact O-N 3.03Å; N262-A265 VanDerWaalsContact O-N 3.1Å; N262-A265 WeakPolarHBondContact OD1-CB 2.98Å; N262-A265 PolarHBondContact OD1-N 3.36Å; A265-T268 PolarHBondContact O-N 3.43Å; A265-T268 PolarHBondContact O-OG1 3.18Å; A265-T268 VanDerWaalsContact O-OG1 3.12Å; A265-A269 VanDerWaalsContact O-CB 3.29Å; A265-A269 WeakPolarHBondContact O-CB 3.48Å; A265-A269 PolarHBondContact O-N 2.99Å |
| 266 | I | 89.8 | Confident | 86.9 | Confident | 60 Ų | 60 | 68 Ų | 68 | 31% | 0.308 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.1 | -47.9 | 172.3 | -63.8 | 170.2 | 0 | 0 | 0 | 110.5 | I113 P261 N262 V263 T268 A269 F270 | I113-I266 HydrophobicContact CD1-CG2 4.43Å; P261-I266 HydrophobicContact CB-CG1 4.04Å; P261-I266 HydrophobicContact CG-CD1 4.25Å; P261-I266 HydrophobicContact CG-CG1 3.84Å; N262-I266 WeakPolarHBondContact O-CG1 3.38Å; N262-I266 PolarHBondContact O-N 3.48Å; V263-I266 PolarHBondContact O-N 3.06Å; I266-T268 PolarHBondContact O-N 3.25Å; I266-A269 WeakPolarHBondContact O-CB 3.42Å; I266-A269 PolarHBondContact O-N 3.45Å; I266-F270 HydrophobicContact CG2-CD2 3.9Å; I266-F270 HydrophobicContact CG2-CE2 3.8Å; I266-F270 WeakPolarHBondContact O-CD2 3.48Å; I266-F270 PolarHBondContact O-N 3.36Å |
| 267 | A | 91.2 | Very high | 87.3 | Confident | 46 Ų | 46 | 61.6 Ų | 61.6 | 38% | 0.38 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V263 G264 A269 F270 Y271 | V263-A267 WeakPolarHBondContact O-CB 3.46Å; V263-A267 PolarHBondContact O-N 3.46Å; G264-A267 PolarHBondContact O-N 2.93Å; A267-A269 VanDerWaalsContact C-N 3.34Å; A267-F270 WeakPolarHBondContact O-CB 3.47Å; A267-F270 PolarHBondContact O-N 2.83Å; A267-Y271 VanDerWaalsContact O-CD2 3.23Å; A267-Y271 WeakPolarHBondContact O-CD2 3.45Å; A267-Y271 PolarHBondContact O-N 2.98Å; A267-Y271 VanDerWaalsContact O-N 3.17Å |
| 268 | T | 87.6 | Confident | 87.9 | Confident | 49 Ų | 49 | 57.4 Ų | 57.4 | 30% | 0.301 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -71.3 | -27.7 | 177.1 | 61.7 | 0 | 0 | 0 | 0 | 113.7 | R103 G264 A265 I266 Y271 T272 | R103-T268 VanDerWaalsContact CD-C 3.48Å; R103-T268 WeakPolarHBondContact CD-O 3.36Å; R103-T268 PolarHBondContact NH1-OG1 2.96Å; G264-T268 WeakPolarHBondContact O-CG2 3.3Å; G264-T268 PolarHBondContact O-N 3.49Å; G264-T268 PolarHBondContact O-OG1 3.45Å; G264-T268 VanDerWaalsContact O-OG1 3.14Å; A265-T268 PolarHBondContact O-N 3.43Å; A265-T268 PolarHBondContact O-OG1 3.18Å; A265-T268 VanDerWaalsContact O-OG1 3.12Å; I266-T268 PolarHBondContact O-N 3.25Å; T268-Y271 PolarHBondContact O-N 2.7Å; T268-T272 PolarHBondContact O-N 3.09Å; T268-T272 PolarHBondContact O-OG1 3.04Å; T268-T272 VanDerWaalsContact O-OG1 3.05Å |
| 269 | A | 89.9 | Confident | 88.4 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.2 | -43.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | L100 R103 T104 I113 A265 I266 A267 Y271 T272 G273 | L100-A269 HydrophobicContact CD1-CB 3.79Å; L100-A269 WeakPolarHBondContact CD1-O 3.42Å; L100-A269 HydrophobicContact CG-CB 4.43Å; R103-A269 HydrophobicContact CB-CB 4.02Å; T104-A269 HydrophobicContact CG2-CB 4.12Å; I113-A269 HydrophobicContact CD1-CB 3.64Å; I113-A269 HydrophobicContact CG2-CB 4.38Å; A265-A269 VanDerWaalsContact O-CB 3.29Å; A265-A269 WeakPolarHBondContact O-CB 3.48Å; A265-A269 PolarHBondContact O-N 2.99Å; I266-A269 WeakPolarHBondContact O-CB 3.42Å; I266-A269 PolarHBondContact O-N 3.45Å; A267-A269 VanDerWaalsContact C-N 3.34Å; A269-Y271 VanDerWaalsContact C-N 3.31Å; A269-Y271 PolarHBondContact O-N 3.1Å; A269-T272 WeakPolarHBondContact O-CB 3.48Å; A269-T272 PolarHBondContact O-N 2.97Å; A269-G273 PolarHBondContact O-N 2.85Å |
| 270 | F | 92.5 | Very high | 89 | Confident | 52 Ų | 52 | 53.4 Ų | 53.4 | 23% | 0.228 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.1 | -39.8 | 173.2 | -88.5 | -78.5 | 0 | 0 | 0 | 112.8 | I113 A116 C117 L120 I266 A267 T272 G273 L274 | I113-F270 HydrophobicContact CG1-CE2 4.38Å; I113-F270 HydrophobicContact CG2-CD1 4.35Å; I113-F270 HydrophobicContact CG2-CD2 4.43Å; I113-F270 HydrophobicContact CG2-CE1 4.39Å; I113-F270 HydrophobicContact CG2-CE2 4.48Å; I113-F270 HydrophobicContact CG2-CG 4.36Å; I113-F270 HydrophobicContact CG2-CZ 4.46Å; A116-F270 HydrophobicContact CB-CE1 3.85Å; A116-F270 HydrophobicContact CB-CZ 3.89Å; C117-F270 VanDerWaalsContact SG-CD1 3.55Å; L120-F270 HydrophobicContact CD1-CD1 4.1Å; L120-F270 HydrophobicContact CD1-CE1 3.72Å; I266-F270 HydrophobicContact CG2-CD2 3.9Å; I266-F270 HydrophobicContact CG2-CE2 3.8Å; I266-F270 WeakPolarHBondContact O-CD2 3.48Å; I266-F270 PolarHBondContact O-N 3.36Å; A267-F270 WeakPolarHBondContact O-CB 3.47Å; A267-F270 PolarHBondContact O-N 2.83Å; F270-T272 VanDerWaalsContact C-N 3.31Å; F270-T272 PolarHBondContact O-N 3.3Å; F270-G273 PolarHBondContact O-N 3.12Å; F270-L274 VanDerWaalsContact O-CB 3.23Å; F270-L274 WeakPolarHBondContact O-CB 3.43Å; F270-L274 VanDerWaalsContact O-CG 3.22Å; F270-L274 WeakPolarHBondContact O-CG 3.45Å; F270-L274 PolarHBondContact O-N 2.76Å |
| 271 | Y | 89.6 | Confident | 89.6 | Confident | 181 Ų | 181 | 45.7 Ų | 45.7 | 71% | 0.71 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -59 | -42.7 | 173.5 | -79.7 | -72.1 | 0 | 0 | 0 | 112.4 | A267 T268 A269 W275 | A267-Y271 VanDerWaalsContact O-CD2 3.23Å; A267-Y271 WeakPolarHBondContact O-CD2 3.45Å; A267-Y271 PolarHBondContact O-N 2.98Å; A267-Y271 VanDerWaalsContact O-N 3.17Å; T268-Y271 PolarHBondContact O-N 2.7Å; A269-Y271 VanDerWaalsContact C-N 3.31Å; A269-Y271 PolarHBondContact O-N 3.1Å; Y271-W275 WeakPolarHBondContact O-CB 3.34Å; Y271-W275 PolarHBondContact O-N 3.05Å |
| 272 | T | 87.7 | Confident | 89.8 | Confident | 14 Ų | 14 | 44.6 Ų | 44.6 | 9% | 0.086 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -69.5 | -38.8 | 179.8 | -51.4 | 0 | 0 | 0 | 0 | 111.9 | S96 L100 R103 T268 A269 F270 | S96-T272 WeakPolarHBondContact CB-O 3.37Å; S96-T272 PolarHBondContact OG-O 3.06Å; L100-T272 HydrophobicContact CD1-CG2 4.44Å; R103-T272 PolarHBondContact NE-OG1 3.37Å; R103-T272 VanDerWaalsContact NE-OG1 3.1Å; T268-T272 PolarHBondContact O-N 3.09Å; T268-T272 PolarHBondContact O-OG1 3.04Å; T268-T272 VanDerWaalsContact O-OG1 3.05Å; A269-T272 WeakPolarHBondContact O-CB 3.48Å; A269-T272 PolarHBondContact O-N 2.97Å; F270-T272 VanDerWaalsContact C-N 3.31Å; F270-T272 PolarHBondContact O-N 3.3Å |
| 273 | G | 90.7 | Very high | 89.8 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -70.1 | -46.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A269 F270 W275 A276 Y277 | A269-G273 PolarHBondContact O-N 2.85Å; F270-G273 PolarHBondContact O-N 3.12Å; G273-W275 VanDerWaalsContact C-N 3.28Å; G273-W275 PolarHBondContact O-N 2.71Å; G273-A276 WeakPolarHBondContact O-CB 3.23Å; G273-A276 PolarHBondContact O-N 3.42Å; G273-Y277 WeakPolarHBondContact O-CD2 3.45Å; G273-Y277 PolarHBondContact O-N 3.1Å |
| 274 | L | 91.8 | Very high | 89.7 | Confident | 68 Ų | 68 | 33.5 Ų | 33.5 | 36% | 0.356 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -64.8 | -31.5 | 178.7 | -71.9 | 170.7 | 0 | 0 | 0 | 112.4 | C117 F270 A276 Y277 D278 | C117-L274 HydrophobicContact CB-CD2 4.23Å; F270-L274 VanDerWaalsContact O-CB 3.23Å; F270-L274 WeakPolarHBondContact O-CB 3.43Å; F270-L274 VanDerWaalsContact O-CG 3.22Å; F270-L274 WeakPolarHBondContact O-CG 3.45Å; F270-L274 PolarHBondContact O-N 2.76Å; L274-A276 VanDerWaalsContact C-N 3.26Å; L274-A276 PolarHBondContact O-N 3.36Å; L274-Y277 CarbonylContact O-C 3.53Å; L274-Y277 PolarHBondContact O-N 3.33Å; L274-Y277 VanDerWaalsContact O-N 3.13Å; L274-D278 PolarHBondContact O-N 2.96Å; L274-D278 VanDerWaalsContact O-N 3.12Å |
| 275 | W | 90.2 | Very high | 89.5 | Confident | 65 Ų | 65 | 31.7 Ų | 31.7 | 25% | 0.246 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -56.7 | -40.5 | 169.2 | 171.1 | -106.5 | 0 | 0 | 0 | 112 | Q169 I172 I173 Y271 G273 Y277 D278 | Q169-W275 HydrophobicContact CG-CZ3 4.19Å; I172-W275 HydrophobicContact CB-CH2 3.87Å; I172-W275 HydrophobicContact CB-CZ2 3.88Å; I172-W275 HydrophobicContact CD1-CH2 3.93Å; I172-W275 HydrophobicContact CD1-CZ2 4.41Å; I172-W275 HydrophobicContact CD1-CZ3 4.2Å; I172-W275 HydrophobicContact CG2-CH2 3.82Å; I172-W275 HydrophobicContact CG2-CZ2 3.31Å; I173-W275 HydrophobicContact CG1-CH2 4.41Å; I173-W275 HydrophobicContact CG1-CZ2 4.33Å; Y271-W275 WeakPolarHBondContact O-CB 3.34Å; Y271-W275 PolarHBondContact O-N 3.05Å; G273-W275 VanDerWaalsContact C-N 3.28Å; G273-W275 PolarHBondContact O-N 2.71Å; W275-Y277 PolarHBondContact O-N 3.26Å; W275-D278 VanDerWaalsContact O-CB 3.28Å; W275-D278 WeakPolarHBondContact O-CB 3.46Å; W275-D278 PolarHBondContact O-N 2.92Å; W275-D278 VanDerWaalsContact O-N 3.16Å |
| 276 | A | 90.9 | Very high | 89.3 | Confident | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.008 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -69.7 | -22.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114 | W114 G273 L274 Y312 | W114-A276 HydrophobicContact CH2-CB 3.33Å; W114-A276 HydrophobicContact CZ3-CB 3.47Å; W114-A276 VanDerWaalsContact CZ3-CB 3.47Å; G273-A276 WeakPolarHBondContact O-CB 3.23Å; G273-A276 PolarHBondContact O-N 3.42Å; L274-A276 VanDerWaalsContact C-N 3.26Å; L274-A276 PolarHBondContact O-N 3.36Å; A276-Y312 HydrophobicContact CB-CE2 4.1Å; A276-Y312 WeakPolarHBondContact O-CE2 3.22Å; A276-Y312 PolarHBondContact O-OH 2.86Å |
| 277 | Y | 92.8 | Very high | 89 | Confident | 1 Ų | 1 | 28 Ų | 28 | 0% | 0.004 | 14% | 0.135 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.4 | 3.8 | 173.8 | -72.3 | -86.1 | 0 | 0 | 0 | 113.3 | W114 C117 G118 S121 G273 L274 W275 W280 V308 T309 Y312 | W114-Y277 AromaticContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CE3-CE2 3.68Å; W114-Y277 HydrophobicContact CZ3-CD2 4.41Å; W114-Y277 AromaticContact CZ3-CE2 3.89Å; W114-Y277 HydrophobicContact CZ3-CE2 3.89Å; W114-Y277 WeakPolarHBondContact O-CE2 3.21Å; W114-Y277 PolarHBondContact O-OH 3.14Å; C117-Y277 HydrophobicContact CB-CD2 3.66Å; C117-Y277 HydrophobicContact CB-CE2 3.6Å; G118-Y277 VanDerWaalsContact CA-CZ 3.45Å; S121-Y277 WeakPolarHBondContact OG-CB 3.3Å; G273-Y277 WeakPolarHBondContact O-CD2 3.45Å; G273-Y277 PolarHBondContact O-N 3.1Å; L274-Y277 CarbonylContact O-C 3.53Å; L274-Y277 PolarHBondContact O-N 3.33Å; L274-Y277 VanDerWaalsContact O-N 3.13Å; W275-Y277 PolarHBondContact O-N 3.26Å; Y277-W280 VanDerWaalsContact O-CD1 3.29Å; Y277-V308 HydrophobicContact CD1-CG1 4.39Å; Y277-V308 HydrophobicContact CE1-CG1 4.28Å; Y277-T309 WeakPolarHBondContact CE1-OG1 3.17Å; Y277-Y312 HydrophobicContact CD1-CD2 4.32Å; Y277-Y312 HydrophobicContact CD1-CE2 4.21Å; Y277-Y312 HydrophobicContact CD2-CD2 4.46Å; Y277-Y312 HydrophobicContact CD2-CE2 4.46Å; Y277-Y312 AromaticContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CE2 4.14Å; Y277-Y312 AromaticContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CE2 4.42Å; Y277-Y312 HydrophobicContact CG-CE2 4.37Å; Y277-Y312 AromaticContact CZ-CD2 3.62Å |
| 278 | D | 90.1 | Very high | 88.5 | Confident | 34 Ų | 34 | 27.6 Ų | 27.6 | 18% | 0.182 | 13% | 0.125 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | 140.6 | 179.9 | -176.9 | 54.7 | 0 | 0 | 0 | 112.1 | M88 Q169 L274 W275 | M88-D278 WeakPolarHBondContact CA-O 3.49Å; Q169-D278 PolarHBondContact NE2-OD1 2.94Å; Q169-D278 VanDerWaalsContact NE2-OD1 3.17Å; Q169-D278 PolarHBondContact NE2-OD2 3.5Å; L274-D278 PolarHBondContact O-N 2.96Å; L274-D278 VanDerWaalsContact O-N 3.12Å; W275-D278 VanDerWaalsContact O-CB 3.28Å; W275-D278 WeakPolarHBondContact O-CB 3.46Å; W275-D278 PolarHBondContact O-N 2.92Å; W275-D278 VanDerWaalsContact O-N 3.16Å |
| 279 | G | 88.1 | Confident | 88.3 | Confident | 1 Ų | 1 | 25.6 Ų | 25.6 | 1% | 0.01 | 11% | 0.112 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 100.5 | 3.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | T87 N281 N282 | T87-G279 PolarHBondContact OG1-O 3.05Å; G279-N281 PolarHBondContact O-N 3.26Å; G279-N282 WeakPolarHBondContact CA-ND2 3.32Å; G279-N282 WeakPolarHBondContact O-CB 3.4Å; G279-N282 PolarHBondContact O-N 3Å; G279-N282 VanDerWaalsContact O-N 3.16Å |
| 280 | W | 91.2 | Very high | 88.2 | Confident | 49 Ų | 49 | 25.8 Ų | 25.8 | 19% | 0.186 | 11% | 0.113 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -28.5 | 170.7 | 57.9 | -99 | 0 | 0 | 0 | 113.1 | M88 A125 Y128 Y277 I305 | M88-W280 HydrophobicContact SD-CB 3.77Å; A125-W280 HydrophobicContact CB-CB 4.48Å; A125-W280 HydrophobicContact CB-CD2 4.48Å; A125-W280 HydrophobicContact CB-CE3 3.72Å; A125-W280 HydrophobicContact CB-CZ3 4.43Å; Y128-W280 HydrophobicContact CD1-CH2 4.28Å; Y128-W280 AromaticContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD1-CZ3 3.87Å; Y128-W280 HydrophobicContact CD2-CH2 4.03Å; Y128-W280 AromaticContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CD2-CZ3 3.86Å; Y128-W280 HydrophobicContact CE1-CH2 4.15Å; Y128-W280 HydrophobicContact CE1-CZ3 4.2Å; Y128-W280 AromaticContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CH2 3.93Å; Y128-W280 HydrophobicContact CE2-CZ3 4.22Å; Y128-W280 HydrophobicContact CG-CH2 4.22Å; Y128-W280 AromaticContact CG-CZ3 3.69Å; Y128-W280 HydrophobicContact CG-CZ3 3.69Å; Y277-W280 VanDerWaalsContact O-CD1 3.29Å; W280-I305 HydrophobicContact CB-CD1 3.93Å; W280-I305 HydrophobicContact CB-CG1 4.5Å |
| 281 | N | 89.3 | Confident | 88 | Confident | 18 Ų | 18 | 28.4 Ų | 28.4 | 10% | 0.096 | 13% | 0.125 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | -8.7 | 177.9 | 61 | -25.6 | 0 | 0 | 0 | 114.1 | Y128 E141 G279 L283 N284 Y285 | Y128-N281 HydrophobicContact CD1-CB 4.13Å; Y128-N281 HydrophobicContact CE1-CB 4.23Å; E141-N281 PolarHBondContact OE1-ND2 3.48Å; G279-N281 PolarHBondContact O-N 3.26Å; N281-L283 PolarHBondContact O-N 2.74Å; N281-L283 VanDerWaalsContact O-N 3.16Å; N281-N284 WeakPolarHBondContact O-CB 3.27Å; N281-N284 PolarHBondContact O-N 3.28Å; N281-Y285 WeakPolarHBondContact O-CD2 3.33Å |
| 282 | N | 87.1 | Confident | 87.9 | Confident | 2 Ų | 2 | 24.8 Ų | 24.8 | 1% | 0.011 | 12% | 0.118 | C | C | . | . | G | 310 helix | trans | -61.9 | -29 | -173.8 | -81.3 | -25.9 | 0 | 0 | 0 | 113.1 | T87 G279 N284 Y285 A368 | T87-N282 WeakPolarHBondContact CB-ND2 3.47Å; T87-N282 HydrophobicContact CG2-CB 4.32Å; T87-N282 WeakPolarHBondContact CG2-ND2 3.21Å; G279-N282 WeakPolarHBondContact CA-ND2 3.32Å; G279-N282 WeakPolarHBondContact O-CB 3.4Å; G279-N282 PolarHBondContact O-N 3Å; G279-N282 VanDerWaalsContact O-N 3.16Å; N282-N284 VanDerWaalsContact C-N 3.27Å; N282-N284 PolarHBondContact O-N 3.42Å; N282-Y285 PolarHBondContact O-N 3.37Å; N282-A368 HydrophobicContact CB-CB 4.16Å; N282-A368 WeakPolarHBondContact OD1-CB 3.41Å |
| 283 | L | 87.3 | Confident | 87.9 | Confident | 1 Ų | 1 | 24.6 Ų | 24.6 | 1% | 0.005 | 12% | 0.117 | C | C | . | . | G | 310 helix | trans | -66.6 | -29.2 | 178.5 | -168.8 | 63.6 | 0 | 0 | 0 | 112.4 | L83 I84 N281 Y285 V286 I290 L297 | L83-L283 HydrophobicContact CD2-CD1 3.97Å; I84-L283 HydrophobicContact CD1-CB 3.94Å; I84-L283 HydrophobicContact CD1-CD2 3.44Å; I84-L283 VanDerWaalsContact CD1-CD2 3.44Å; I84-L283 HydrophobicContact CD1-CG 4.28Å; I84-L283 HydrophobicContact CG1-CB 3.78Å; I84-L283 HydrophobicContact CG1-CD2 3.94Å; I84-L283 HydrophobicContact CG1-CG 4.37Å; N281-L283 PolarHBondContact O-N 2.74Å; N281-L283 VanDerWaalsContact O-N 3.16Å; L283-Y285 VanDerWaalsContact C-N 3.27Å; L283-Y285 PolarHBondContact O-N 2.73Å; L283-V286 HydrophobicContact CD1-CG2 3.79Å; L283-V286 WeakPolarHBondContact O-CG2 3.38Å; L283-V286 PolarHBondContact O-N 3.48Å; L283-I290 HydrophobicContact CD1-CD1 3.71Å; L283-I290 HydrophobicContact CD1-CG1 4.44Å; L283-I290 HydrophobicContact CD2-CD1 4.33Å; L283-I290 HydrophobicContact CG-CD1 3.77Å; L283-L297 HydrophobicContact CB-CD1 4.22Å; L283-L297 HydrophobicContact CD2-CD1 3.71Å; L283-L297 HydrophobicContact CG-CD1 3.67Å |
| 284 | N | 89.6 | Confident | 87.8 | Confident | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 14% | 0.144 | C | C | . | . | G | 310 helix | trans | -67.1 | -28.7 | 177.6 | -72.9 | 77.6 | 0 | 0 | 0 | 112.6 | Y128 A140 Y144 N281 N282 V286 T287 | Y128-N284 PolarHBondContact O-ND2 3.29Å; A140-N284 HydrophobicContact CB-CB 3.84Å; Y144-N284 PolarHBondContact OH-ND2 3.45Å; N281-N284 WeakPolarHBondContact O-CB 3.27Å; N281-N284 PolarHBondContact O-N 3.28Å; N282-N284 VanDerWaalsContact C-N 3.27Å; N282-N284 PolarHBondContact O-N 3.42Å; N284-V286 PolarHBondContact O-N 3.1Å; N284-T287 WeakPolarHBondContact CA-OG1 3.4Å; N284-T287 PolarHBondContact O-N 3.36Å; N284-T287 PolarHBondContact O-OG1 2.75Å |
| 285 | Y | 85.2 | Confident | 87.7 | Confident | 5 Ų | 5 | 31.3 Ų | 31.3 | 2% | 0.02 | 15% | 0.153 | C | C | . | . | G | 310 helix | trans | -69.5 | -20.3 | 178 | -70 | -91.8 | 0 | 0 | 0 | 112.9 | S138 A140 E141 N281 N282 L283 A368 L372 | S138-Y285 PolarHBondContact OG-O 3.4Å; A140-Y285 HydrophobicContact CB-CD1 3.74Å; A140-Y285 HydrophobicContact CB-CD2 3.86Å; A140-Y285 HydrophobicContact CB-CE1 3.91Å; A140-Y285 HydrophobicContact CB-CE2 4.04Å; A140-Y285 HydrophobicContact CB-CG 3.74Å; E141-Y285 PolarHBondContact OE1-OH 3.22Å; E141-Y285 WeakPolarHBondContact OE2-CE1 3.35Å; E141-Y285 WeakPolarHBondContact OE2-CE2 2.9Å; E141-Y285 PolarHBondContact OE2-OH 3.37Å; N281-Y285 WeakPolarHBondContact O-CD2 3.33Å; N282-Y285 PolarHBondContact O-N 3.37Å; L283-Y285 VanDerWaalsContact C-N 3.27Å; L283-Y285 PolarHBondContact O-N 2.73Å; Y285-A368 HydrophobicContact CD2-CB 4.24Å; Y285-A368 HydrophobicContact CG-CB 4.17Å; Y285-L372 HydrophobicContact CD1-CB 4.04Å; Y285-L372 HydrophobicContact CE1-CB 3.92Å; Y285-L372 HydrophobicContact CE1-CD1 4.19Å; Y285-L372 HydrophobicContact CE1-CD2 4.25Å; Y285-L372 HydrophobicContact CE1-CG 4.34Å |
| 286 | V | 82.9 | Confident | 87.8 | Confident | 1 Ų | 1 | 29.3 Ų | 29.3 | 1% | 0.006 | 15% | 0.147 | C | C | . | . | G | 310 helix | trans | -109.7 | 17.2 | -175.6 | -58.3 | 0 | 0 | 0 | 0 | 112 | L75 L83 L283 N284 E288 E289 I290 F367 | L75-V286 HydrophobicContact CD1-CB 3.92Å; L75-V286 HydrophobicContact CD1-CG2 3.84Å; L83-V286 HydrophobicContact CD2-CG1 4.4Å; L83-V286 HydrophobicContact CD2-CG2 3.74Å; L283-V286 HydrophobicContact CD1-CG2 3.79Å; L283-V286 WeakPolarHBondContact O-CG2 3.38Å; L283-V286 PolarHBondContact O-N 3.48Å; N284-V286 PolarHBondContact O-N 3.1Å; V286-E288 VanDerWaalsContact C-N 3.29Å; V286-E288 PolarHBondContact O-N 3.21Å; V286-E289 PolarHBondContact O-N 3.43Å; V286-I290 HydrophobicContact CG2-CD1 4.46Å; V286-I290 PolarHBondContact O-N 3Å; V286-F367 HydrophobicContact CB-CE1 4.33Å; V286-F367 HydrophobicContact CG1-CD1 3.62Å; V286-F367 HydrophobicContact CG1-CE1 3.44Å; V286-F367 VanDerWaalsContact CG1-CE1 3.44Å |
| 287 | T | 83.4 | Confident | 87.8 | Confident | 1 Ų | 1 | 29.3 Ų | 29.3 | 1% | 0.006 | 15% | 0.147 | C | C | . | . | G | 310 helix | trans | -57.8 | -37.7 | -173.1 | -55.9 | 0 | 0 | 0 | 0 | 113.3 | G132 T136 N284 E289 I290 P293 | G132-T287 WeakPolarHBondContact O-CG2 3.28Å; T136-T287 HydrophobicContact CG2-CG2 4.32Å; N284-T287 WeakPolarHBondContact CA-OG1 3.4Å; N284-T287 PolarHBondContact O-N 3.36Å; N284-T287 PolarHBondContact O-OG1 2.75Å; T287-E289 PolarHBondContact O-N 3.37Å; T287-E289 VanDerWaalsContact O-N 3.16Å; T287-I290 PolarHBondContact O-N 2.81Å; T287-I290 VanDerWaalsContact O-N 3.11Å; T287-P293 HydrophobicContact CG2-CB 3.81Å |
| 288 | E | 81.2 | Confident | 87.9 | Confident | 36 Ų | 36 | 30.8 Ų | 30.8 | 17% | 0.168 | 16% | 0.157 | C | C | . | . | G | 310 helix | trans | -59.5 | -26.2 | 176.4 | -75.4 | -176 | -173 | 0 | 0 | 113.1 | R73 T136 S137 S138 V286 | R73-E288 VanDerWaalsContact CG-O 3.23Å; R73-E288 WeakPolarHBondContact CG-O 2.88Å; T136-E288 WeakPolarHBondContact O-CG 3.43Å; S137-E288 VanDerWaalsContact CA-OE1 3.29Å; S137-E288 WeakPolarHBondContact CA-OE1 3.31Å; S138-E288 VanDerWaalsContact CB-CD 3.44Å; S138-E288 VanDerWaalsContact N-CG 3.32Å; S138-E288 PolarHBondContact N-OE1 3.09Å; V286-E288 VanDerWaalsContact C-N 3.29Å; V286-E288 PolarHBondContact O-N 3.21Å |
| 289 | E | 83.9 | Confident | 88.1 | Confident | 7 Ų | 7 | 35.7 Ų | 35.7 | 3% | 0.033 | 17% | 0.173 | C | C | . | . | G | 310 helix | trans | -95.1 | -6.4 | -178.4 | -69.6 | 172.9 | -127 | 0 | 0 | 113.3 | L71 R73 R74 L75 V286 T287 R371 | L71-E289 HydrophobicContact CB-CG 3.92Å; L71-E289 HydrophobicContact CD2-CG 4.48Å; R73-E289 CarbonylContact C-O 3.51Å; R73-E289 WeakPolarHBondContact CA-O 3.42Å; R74-E289 PolarHBondContact N-O 2.78Å; L75-E289 WeakPolarHBondContact CB-O 3.49Å; L75-E289 HydrophobicContact CD1-CB 3.77Å; L75-E289 HydrophobicContact CG-CB 4.07Å; L75-E289 PolarHBondContact N-O 2.86Å; V286-E289 PolarHBondContact O-N 3.43Å; T287-E289 PolarHBondContact O-N 3.37Å; T287-E289 VanDerWaalsContact O-N 3.16Å; E289-R371 IonicContact OE1-CZ 2.76Å; E289-R371 IonicContact OE1-NE 3.75Å; E289-R371 PolarHBondContact OE1-NE 3.02Å; E289-R371 IonicContact OE1-NH2 2.71Å; E289-R371 PolarHBondContact OE1-NH2 3.08Å; E289-R371 IonicContact OE2-CZ 2.66Å; E289-R371 IonicContact OE2-NE 3.97Å; E289-R371 IonicContact OE2-NH2 3.22Å; E289-R371 PolarHBondContact OE2-NH2 3.48Å |
| 290 | I | 87.4 | Confident | 88.3 | Confident | 4 Ų | 4 | 35.7 Ų | 35.7 | 2% | 0.021 | 17% | 0.173 | C | C | . | . | B | Isolated β-bridge | trans | -77.6 | 130 | 178.4 | -61.7 | 175 | 0 | 0 | 0 | 110.2 | L75 L283 V286 T287 N292 P293 N296 L297 | L75-I290 HydrophobicContact CB-CG1 4.36Å; L75-I290 HydrophobicContact CD1-CG1 4.43Å; L283-I290 HydrophobicContact CD1-CD1 3.71Å; L283-I290 HydrophobicContact CD1-CG1 4.44Å; L283-I290 HydrophobicContact CD2-CD1 4.33Å; L283-I290 HydrophobicContact CG-CD1 3.77Å; V286-I290 HydrophobicContact CG2-CD1 4.46Å; V286-I290 PolarHBondContact O-N 3Å; T287-I290 PolarHBondContact O-N 2.81Å; T287-I290 VanDerWaalsContact O-N 3.11Å; I290-N292 PolarHBondContact O-N 2.74Å; I290-P293 HydrophobicContact CB-CB 4.39Å; I290-P293 HydrophobicContact CG2-CB 4.39Å; I290-N296 HydrophobicContact CG2-CB 3.88Å; I290-L297 HydrophobicContact CD1-CD1 4Å |
| 291 | K | 87.8 | Confident | 88.5 | Confident | 107 Ų | 107 | 33.4 Ų | 33.4 | 47% | 0.465 | 16% | 0.164 | S | C | . | . | S | Bend | trans | -68.4 | 124.6 | 168 | -67.3 | -179.8 | 178.9 | -178.4 | 0 | 108.5 | R73 L75 N296 | R73-K291 HydrophobicContact CB-CG 4.4Å; R73-K291 VanDerWaalsContact O-CE 3.26Å; R73-K291 WeakPolarHBondContact O-CE 3.48Å; R73-K291 WeakPolarHBondContact O-CG 3.46Å; L75-K291 WeakPolarHBondContact O-CB 3.49Å; L75-K291 PolarHBondContact O-N 3.47Å; K291-N296 WeakPolarHBondContact O-CB 3.14Å; K291-N296 PolarHBondContact O-ND2 3.34Å |
| 292 | N | 87.9 | Confident | 88.8 | Confident | 105 Ų | 105 | 37.2 Ų | 37.2 | 56% | 0.561 | 18% | 0.183 | S | C | * | . | S | Bend | trans | 50.8 | 64.9 | -179.7 | -60.9 | -30.1 | 0 | 0 | 0 | 113.2 | I290 S294 K295 N296 | I290-N292 PolarHBondContact O-N 2.74Å; N292-S294 VanDerWaalsContact C-N 3.27Å; N292-S294 PolarHBondContact O-N 2.72Å; N292-K295 PolarHBondContact O-N 2.66Å; N292-K295 VanDerWaalsContact O-N 3.08Å; N292-N296 PolarHBondContact O-N 3.17Å |
| 293 | P | 86.9 | Confident | 89.1 | Confident | 11 Ų | 11 | 41.2 Ų | 41.2 | 7% | 0.071 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -57.5 | -37.6 | -172.9 | 22.8 | -32.7 | 0 | 0 | 0 | 112.7 | T136 T287 I290 K295 N296 L297 | T136-P293 HydrophobicContact CG2-CB 4.44Å; T136-P293 HydrophobicContact CG2-CG 4.01Å; T287-P293 HydrophobicContact CG2-CB 3.81Å; I290-P293 HydrophobicContact CB-CB 4.39Å; I290-P293 HydrophobicContact CG2-CB 4.39Å; P293-K295 PolarHBondContact O-N 3.11Å; P293-N296 PolarHBondContact O-N 3.16Å; P293-L297 WeakPolarHBondContact O-CB 3.24Å; P293-L297 PolarHBondContact O-N 3.07Å |
| 294 | S | 87.9 | Confident | 89.4 | Confident | 80 Ų | 80 | 41.1 Ų | 41.1 | 56% | 0.559 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -56.1 | -25.9 | 178.1 | 58 | 0 | 0 | 0 | 0 | 115 | N292 P298 | N292-S294 VanDerWaalsContact C-N 3.27Å; N292-S294 PolarHBondContact O-N 2.72Å; S294-P298 WeakPolarHBondContact O-CG 3.47Å |
| 295 | K | 90.6 | Very high | 89.7 | Confident | 129 Ų | 129 | 41.1 Ų | 41.1 | 56% | 0.561 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -108.8 | -42.7 | 177.8 | -64.7 | -175.8 | -178.8 | 179.7 | 0 | 112.1 | N292 P293 R299 | N292-K295 PolarHBondContact O-N 2.66Å; N292-K295 VanDerWaalsContact O-N 3.08Å; P293-K295 PolarHBondContact O-N 3.11Å; K295-R299 VanDerWaalsContact O-CB 3.3Å; K295-R299 WeakPolarHBondContact O-CB 3.49Å; K295-R299 VanDerWaalsContact O-CD 3.3Å; K295-R299 WeakPolarHBondContact O-CD 3.03Å; K295-R299 WeakPolarHBondContact O-CG 3.47Å; K295-R299 PolarHBondContact O-N 3.06Å |
| 296 | N | 92.4 | Very high | 90.2 | Very high | 23 Ų | 23 | 43.3 Ų | 43.3 | 12% | 0.123 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -80.9 | -29.1 | -170.9 | -74.9 | -12.1 | 0 | 0 | 0 | 113.2 | L77 I290 K291 N292 P293 S300 | L77-N296 HydrophobicContact CD1-CB 4.48Å; I290-N296 HydrophobicContact CG2-CB 3.88Å; K291-N296 WeakPolarHBondContact O-CB 3.14Å; K291-N296 PolarHBondContact O-ND2 3.34Å; N292-N296 PolarHBondContact O-N 3.17Å; P293-N296 PolarHBondContact O-N 3.16Å; N296-S300 VanDerWaalsContact O-CB 3.3Å; N296-S300 WeakPolarHBondContact O-CB 3.41Å; N296-S300 PolarHBondContact O-N 3.25Å; N296-S300 PolarHBondContact O-OG 3.16Å |
| 297 | L | 91.4 | Very high | 90.8 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.3 | -59 | 174.2 | -178.9 | 69.9 | 0 | 0 | 0 | 111.5 | T133 L283 I290 P293 R299 S300 I301 | T133-L297 HydrophobicContact CG2-CD2 4.17Å; L283-L297 HydrophobicContact CB-CD1 4.22Å; L283-L297 HydrophobicContact CD2-CD1 3.71Å; L283-L297 HydrophobicContact CG-CD1 3.67Å; I290-L297 HydrophobicContact CD1-CD1 4Å; P293-L297 WeakPolarHBondContact O-CB 3.24Å; P293-L297 PolarHBondContact O-N 3.07Å; L297-R299 VanDerWaalsContact C-N 3.34Å; L297-R299 PolarHBondContact O-N 2.96Å; L297-S300 PolarHBondContact O-N 2.96Å; L297-I301 HydrophobicContact CD1-CD1 4.37Å; L297-I301 HydrophobicContact CG-CD1 4.37Å; L297-I301 PolarHBondContact O-N 3.05Å |
| 298 | P | 93.4 | Very high | 91.3 | Very high | 33 Ų | 33 | 46.2 Ų | 46.2 | 21% | 0.214 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.6 | -37 | -179 | 24.4 | -34.5 | 0 | 0 | 0 | 112.6 | A129 S294 S300 I301 I302 | A129-P298 HydrophobicContact CB-CB 4.44Å; S294-P298 WeakPolarHBondContact O-CG 3.47Å; P298-S300 VanDerWaalsContact C-N 3.34Å; P298-S300 PolarHBondContact O-N 3.44Å; P298-I301 PolarHBondContact O-N 3.1Å; P298-I302 WeakPolarHBondContact O-CG1 3.44Å; P298-I302 PolarHBondContact O-N 3.38Å |
| 299 | R | 94.6 | Very high | 92 | Very high | 137 Ų | 137 | 45.5 Ų | 45.5 | 52% | 0.517 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.5 | -40 | 175.5 | -74.5 | 175.4 | 179.3 | -173.1 | -4.5 | 112.3 | L77 K295 L297 I301 I303 | L77-R299 HydrophobicContact CD1-CB 3.73Å; K295-R299 VanDerWaalsContact O-CB 3.3Å; K295-R299 WeakPolarHBondContact O-CB 3.49Å; K295-R299 VanDerWaalsContact O-CD 3.3Å; K295-R299 WeakPolarHBondContact O-CD 3.03Å; K295-R299 WeakPolarHBondContact O-CG 3.47Å; K295-R299 PolarHBondContact O-N 3.06Å; L297-R299 VanDerWaalsContact C-N 3.34Å; L297-R299 PolarHBondContact O-N 2.96Å; R299-I301 VanDerWaalsContact C-N 3.29Å; R299-I301 PolarHBondContact O-N 2.95Å; R299-I303 WeakPolarHBondContact O-CB 3.49Å; R299-I303 WeakPolarHBondContact O-CD1 3.26Å; R299-I303 VanDerWaalsContact O-CG1 3.23Å; R299-I303 WeakPolarHBondContact O-CG1 3.4Å; R299-I303 PolarHBondContact O-N 2.92Å; R299-I303 VanDerWaalsContact O-N 3.1Å |
| 300 | S | 93.8 | Very high | 92.5 | Very high | 1 Ų | 1 | 50.1 Ų | 50.1 | 1% | 0.007 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.9 | -38.5 | 178.2 | -59.7 | 0 | 0 | 0 | 0 | 111.6 | N296 L297 P298 G304 | N296-S300 VanDerWaalsContact O-CB 3.3Å; N296-S300 WeakPolarHBondContact O-CB 3.41Å; N296-S300 PolarHBondContact O-N 3.25Å; N296-S300 PolarHBondContact O-OG 3.16Å; L297-S300 PolarHBondContact O-N 2.96Å; P298-S300 VanDerWaalsContact C-N 3.34Å; P298-S300 PolarHBondContact O-N 3.44Å; S300-G304 WeakPolarHBondContact O-CA 3.46Å; S300-G304 PolarHBondContact O-N 3.12Å |
| 301 | I | 93.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -68.7 | -49.7 | 179.2 | -71.1 | 167.6 | 0 | 0 | 0 | 111.3 | I84 L122 A125 L126 A129 L297 P298 R299 I303 G304 I305 | I84-I301 HydrophobicContact CD1-CB 4.4Å; I84-I301 HydrophobicContact CD1-CG1 3.61Å; L122-I301 HydrophobicContact CD1-CG2 4.36Å; A125-I301 HydrophobicContact CB-CD1 4.42Å; A125-I301 HydrophobicContact CB-CG2 3.57Å; L126-I301 HydrophobicContact CD2-CG2 4.36Å; A129-I301 HydrophobicContact CB-CD1 3.69Å; L297-I301 HydrophobicContact CD1-CD1 4.37Å; L297-I301 HydrophobicContact CG-CD1 4.37Å; L297-I301 PolarHBondContact O-N 3.05Å; P298-I301 PolarHBondContact O-N 3.1Å; R299-I301 VanDerWaalsContact C-N 3.29Å; R299-I301 PolarHBondContact O-N 2.95Å; I301-I303 PolarHBondContact O-N 3.16Å; I301-G304 PolarHBondContact O-N 3.39Å; I301-I305 HydrophobicContact CG2-CD1 3.8Å; I301-I305 PolarHBondContact O-N 3.27Å |
| 302 | I | 95.1 | Very high | 93.2 | Very high | 98 Ų | 98 | 45.4 Ų | 45.4 | 50% | 0.503 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.8 | -29.5 | -179.3 | -69.6 | 164.6 | 0 | 0 | 0 | 112 | L126 P298 P306 | L126-I302 HydrophobicContact CD2-CD1 4.23Å; L126-I302 HydrophobicContact CD2-CG1 3.9Å; P298-I302 WeakPolarHBondContact O-CG1 3.44Å; P298-I302 PolarHBondContact O-N 3.38Å; I302-P306 WeakPolarHBondContact O-CD 3.48Å; I302-P306 WeakPolarHBondContact O-CG 3.28Å |
| 303 | I | 95 | Very high | 93.4 | Very high | 86 Ų | 86 | 41.1 Ų | 41.1 | 44% | 0.441 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -84.8 | -47.6 | 175.5 | -64.1 | 167.3 | 0 | 0 | 0 | 110.6 | V81 R299 I301 L307 | V81-I303 HydrophobicContact CG1-CG2 4.13Å; V81-I303 HydrophobicContact CG2-CB 4.21Å; V81-I303 HydrophobicContact CG2-CG2 4.17Å; R299-I303 WeakPolarHBondContact O-CB 3.49Å; R299-I303 WeakPolarHBondContact O-CD1 3.26Å; R299-I303 VanDerWaalsContact O-CG1 3.23Å; R299-I303 WeakPolarHBondContact O-CG1 3.4Å; R299-I303 PolarHBondContact O-N 2.92Å; R299-I303 VanDerWaalsContact O-N 3.1Å; I301-I303 PolarHBondContact O-N 3.16Å; I303-L307 VanDerWaalsContact O-CB 3.26Å; I303-L307 WeakPolarHBondContact O-CB 3.47Å; I303-L307 PolarHBondContact O-N 3.27Å |
| 304 | G | 93.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -71.3 | -47.8 | -169 | 0 | 0 | 0 | 0 | 0 | 114 | S300 I301 L307 V308 | S300-G304 WeakPolarHBondContact O-CA 3.46Å; S300-G304 PolarHBondContact O-N 3.12Å; I301-G304 PolarHBondContact O-N 3.39Å; G304-L307 PolarHBondContact O-N 3Å; G304-V308 WeakPolarHBondContact O-CG2 3.12Å; G304-V308 PolarHBondContact O-N 3.05Å; G304-V308 VanDerWaalsContact O-N 3.1Å |
| 305 | I | 95.3 | Very high | 94 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -68.5 | -49.8 | -174.8 | -61.1 | 176.6 | 0 | 0 | 0 | 111.7 | I84 M88 L122 A125 W280 I301 L307 V308 T309 | I84-I305 HydrophobicContact CG2-CG1 4.31Å; M88-I305 HydrophobicContact CE-CB 4.29Å; M88-I305 HydrophobicContact CE-CG1 3.73Å; M88-I305 HydrophobicContact SD-CG1 4.03Å; L122-I305 HydrophobicContact CB-CG2 3.93Å; L122-I305 HydrophobicContact CD1-CB 4.2Å; L122-I305 HydrophobicContact CD1-CD1 4.46Å; L122-I305 HydrophobicContact CD1-CG2 4.41Å; A125-I305 HydrophobicContact CB-CD1 3.18Å; W280-I305 HydrophobicContact CB-CD1 3.93Å; W280-I305 HydrophobicContact CB-CG1 4.5Å; I301-I305 HydrophobicContact CG2-CD1 3.8Å; I301-I305 PolarHBondContact O-N 3.27Å; I305-L307 VanDerWaalsContact C-N 3.26Å; I305-L307 PolarHBondContact O-N 3.35Å; I305-V308 PolarHBondContact O-N 3.21Å; I305-V308 VanDerWaalsContact O-N 3.09Å; I305-T309 PolarHBondContact O-N 2.95Å; I305-T309 PolarHBondContact O-OG1 3.37Å; I305-T309 VanDerWaalsContact O-OG1 3.09Å |
| 306 | P | 95.8 | Very high | 94 | Very high | 51 Ų | 51 | 33.8 Ų | 33.8 | 33% | 0.331 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -61 | -34.9 | 177.7 | -26.4 | 38.9 | 0 | 0 | 0 | 113.1 | L122 I302 T309 L310 | L122-P306 HydrophobicContact CD1-CG 4.33Å; L122-P306 HydrophobicContact CD2-CG 4.28Å; I302-P306 WeakPolarHBondContact O-CD 3.48Å; I302-P306 WeakPolarHBondContact O-CG 3.28Å; P306-T309 PolarHBondContact O-N 3.33Å; P306-L310 WeakPolarHBondContact O-CB 3.34Å; P306-L310 PolarHBondContact O-N 2.79Å |
| 307 | L | 94.6 | Very high | 94 | Very high | 63 Ų | 63 | 35.3 Ų | 35.3 | 33% | 0.33 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -60 | -47 | 173.3 | 177.3 | 65.8 | 0 | 0 | 0 | 111.2 | V85 I303 G304 I305 L310 C311 | V85-L307 HydrophobicContact CG2-CD2 4.09Å; I303-L307 VanDerWaalsContact O-CB 3.26Å; I303-L307 WeakPolarHBondContact O-CB 3.47Å; I303-L307 PolarHBondContact O-N 3.27Å; G304-L307 PolarHBondContact O-N 3Å; I305-L307 VanDerWaalsContact C-N 3.26Å; I305-L307 PolarHBondContact O-N 3.35Å; L307-L310 PolarHBondContact O-N 2.85Å; L307-C311 WeakPolarHBondContact O-CB 3.32Å; L307-C311 PolarHBondContact O-N 3.41Å; L307-C311 PolarHBondContact O-SG 3.41Å |
| 308 | V | 95.3 | Very high | 94 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.1 | -45 | 177.4 | 173 | 0 | 0 | 0 | 0 | 111.4 | V85 M88 I89 Y277 G304 I305 L310 C311 Y312 | V85-V308 HydrophobicContact CB-CG2 4.35Å; V85-V308 HydrophobicContact CG1-CG2 4.17Å; V85-V308 HydrophobicContact CG2-CG2 4.17Å; M88-V308 HydrophobicContact CB-CG1 4.17Å; M88-V308 HydrophobicContact CB-CG2 4.3Å; M88-V308 HydrophobicContact CE-CB 3.9Å; M88-V308 HydrophobicContact CE-CG1 4.37Å; M88-V308 HydrophobicContact CE-CG2 3.53Å; I89-V308 HydrophobicContact CD1-CG2 4Å; I89-V308 HydrophobicContact CG1-CB 4.42Å; I89-V308 HydrophobicContact CG1-CG1 3.99Å; I89-V308 HydrophobicContact CG1-CG2 3.72Å; Y277-V308 HydrophobicContact CD1-CG1 4.39Å; Y277-V308 HydrophobicContact CE1-CG1 4.28Å; G304-V308 WeakPolarHBondContact O-CG2 3.12Å; G304-V308 PolarHBondContact O-N 3.05Å; G304-V308 VanDerWaalsContact O-N 3.1Å; I305-V308 PolarHBondContact O-N 3.21Å; I305-V308 VanDerWaalsContact O-N 3.09Å; V308-L310 VanDerWaalsContact C-N 3.3Å; V308-L310 PolarHBondContact O-N 3.26Å; V308-C311 WeakPolarHBondContact O-CB 3.23Å; V308-C311 PolarHBondContact O-N 2.85Å; V308-Y312 HydrophobicContact CG1-CD1 4.08Å; V308-Y312 HydrophobicContact CG1-CD2 3.92Å; V308-Y312 HydrophobicContact CG1-CE1 3.78Å; V308-Y312 HydrophobicContact CG1-CE2 3.61Å; V308-Y312 HydrophobicContact CG1-CG 4.17Å; V308-Y312 WeakPolarHBondContact O-CB 3.37Å; V308-Y312 PolarHBondContact O-N 3.11Å |
| 309 | T | 95.3 | Very high | 93.9 | Very high | 21 Ų | 21 | 34 Ų | 34 | 13% | 0.129 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -56.8 | -45.1 | 176.5 | -56.2 | 0 | 0 | 0 | 0 | 111.5 | L115 Y277 I305 P306 Y312 A313 | L115-T309 HydrophobicContact CD2-CG2 4.17Å; Y277-T309 WeakPolarHBondContact CE1-OG1 3.17Å; I305-T309 PolarHBondContact O-N 2.95Å; I305-T309 PolarHBondContact O-OG1 3.37Å; I305-T309 VanDerWaalsContact O-OG1 3.09Å; P306-T309 PolarHBondContact O-N 3.33Å; T309-Y312 PolarHBondContact O-N 2.9Å; T309-A313 WeakPolarHBondContact O-CB 3.43Å; T309-A313 PolarHBondContact O-N 3.18Å |
| 310 | L | 95.1 | Very high | 93.6 | Very high | 103 Ų | 103 | 27.6 Ų | 27.6 | 54% | 0.539 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -63.6 | -47.4 | 176.8 | 179.4 | 62.4 | 0 | 0 | 0 | 111.3 | P306 L307 V308 Y312 A313 L314 | P306-L310 WeakPolarHBondContact O-CB 3.34Å; P306-L310 PolarHBondContact O-N 2.79Å; L307-L310 PolarHBondContact O-N 2.85Å; V308-L310 VanDerWaalsContact C-N 3.3Å; V308-L310 PolarHBondContact O-N 3.26Å; L310-Y312 VanDerWaalsContact C-N 3.33Å; L310-Y312 PolarHBondContact O-N 3.02Å; L310-A313 PolarHBondContact O-N 3.45Å; L310-L314 HydrophobicContact CD1-CD1 3.99Å; L310-L314 HydrophobicContact CD1-CG 4.2Å; L310-L314 HydrophobicContact CG-CD1 3.97Å; L310-L314 VanDerWaalsContact O-CG 3.28Å; L310-L314 WeakPolarHBondContact O-CG 3.42Å; L310-L314 PolarHBondContact O-N 3.17Å |
| 311 | C | 94.3 | Very high | 93.4 | Very high | 13 Ų | 13 | 27.6 Ų | 27.6 | 9% | 0.088 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -57.2 | -46.2 | 176 | -74.3 | 0 | 0 | 0 | 0 | 111.7 | V233 L307 V308 L314 I315 | V233-C311 HydrophobicContact CG1-CB 3.91Å; L307-C311 WeakPolarHBondContact O-CB 3.32Å; L307-C311 PolarHBondContact O-N 3.41Å; L307-C311 PolarHBondContact O-SG 3.41Å; V308-C311 WeakPolarHBondContact O-CB 3.23Å; V308-C311 PolarHBondContact O-N 2.85Å; C311-L314 PolarHBondContact O-N 3.39Å; C311-I315 WeakPolarHBondContact O-CB 3.17Å; C311-I315 WeakPolarHBondContact O-CD1 3.46Å; C311-I315 WeakPolarHBondContact O-CG1 3.44Å; C311-I315 PolarHBondContact O-N 3.43Å |
| 312 | Y | 94.4 | Very high | 93 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.5 | -42.5 | -180 | -74.2 | 1.3 | 0 | 0 | 0 | 112.4 | M88 I89 I93 W114 A276 Y277 V308 T309 L310 I315 N316 | M88-Y312 PolarHBondContact O-OH 3.32Å; I89-Y312 WeakPolarHBondContact CA-OH 3.32Å; I89-Y312 HydrophobicContact CB-CE1 4.45Å; I89-Y312 HydrophobicContact CG1-CE1 3.94Å; I89-Y312 HydrophobicContact CG2-CE1 4.43Å; I93-Y312 HydrophobicContact CB-CD1 4Å; I93-Y312 HydrophobicContact CB-CE1 3.51Å; I93-Y312 HydrophobicContact CD1-CD1 3.54Å; I93-Y312 HydrophobicContact CD1-CD2 4.28Å; I93-Y312 HydrophobicContact CD1-CE1 3.99Å; I93-Y312 HydrophobicContact CD1-CG 3.68Å; I93-Y312 HydrophobicContact CG1-CD1 3.57Å; I93-Y312 HydrophobicContact CG1-CE1 3.65Å; I93-Y312 HydrophobicContact CG1-CG 4.24Å; I93-Y312 HydrophobicContact CG2-CE1 4.06Å; W114-Y312 HydrophobicContact CE3-CD2 4.04Å; W114-Y312 HydrophobicContact CH2-CD2 4.38Å; W114-Y312 AromaticContact CZ3-CD2 3.48Å; W114-Y312 HydrophobicContact CZ3-CD2 3.48Å; W114-Y312 VanDerWaalsContact CZ3-CD2 3.48Å; W114-Y312 AromaticContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CE2 3.99Å; W114-Y312 HydrophobicContact CZ3-CG 4.16Å; A276-Y312 HydrophobicContact CB-CE2 4.1Å; A276-Y312 WeakPolarHBondContact O-CE2 3.22Å; A276-Y312 PolarHBondContact O-OH 2.86Å; Y277-Y312 HydrophobicContact CD1-CD2 4.32Å; Y277-Y312 HydrophobicContact CD1-CE2 4.21Å; Y277-Y312 HydrophobicContact CD2-CD2 4.46Å; Y277-Y312 HydrophobicContact CD2-CE2 4.46Å; Y277-Y312 AromaticContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CD2 3.79Å; Y277-Y312 HydrophobicContact CE1-CE2 4.14Å; Y277-Y312 AromaticContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CD2 3.98Å; Y277-Y312 HydrophobicContact CE2-CE2 4.42Å; Y277-Y312 HydrophobicContact CG-CE2 4.37Å; Y277-Y312 AromaticContact CZ-CD2 3.62Å; V308-Y312 HydrophobicContact CG1-CD1 4.08Å; V308-Y312 HydrophobicContact CG1-CD2 3.92Å; V308-Y312 HydrophobicContact CG1-CE1 3.78Å; V308-Y312 HydrophobicContact CG1-CE2 3.61Å; V308-Y312 HydrophobicContact CG1-CG 4.17Å; V308-Y312 WeakPolarHBondContact O-CB 3.37Å; V308-Y312 PolarHBondContact O-N 3.11Å; T309-Y312 PolarHBondContact O-N 2.9Å; L310-Y312 VanDerWaalsContact C-N 3.33Å; L310-Y312 PolarHBondContact O-N 3.02Å; Y312-I315 HydrophobicContact CD1-CD1 4.45Å; Y312-I315 PolarHBondContact O-N 3.47Å; Y312-N316 PolarHBondContact O-N 3.33Å; Y312-N316 PolarHBondContact O-ND2 2.92Å |
| 313 | A | 93.5 | Very high | 92.7 | Very high | 15 Ų | 15 | 23.2 Ų | 23.2 | 12% | 0.124 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -59.8 | -47.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | L115 T309 L310 I315 N316 I317 | L115-A313 HydrophobicContact CD2-CB 4.16Å; T309-A313 WeakPolarHBondContact O-CB 3.43Å; T309-A313 PolarHBondContact O-N 3.18Å; L310-A313 PolarHBondContact O-N 3.45Å; A313-I315 PolarHBondContact O-N 3.14Å; A313-N316 PolarHBondContact O-N 3.45Å; A313-I317 WeakPolarHBondContact O-CG1 3.29Å; A313-I317 PolarHBondContact O-N 3.46Å |
| 314 | L | 93.8 | Very high | 92.4 | Very high | 60 Ų | 60 | 20.7 Ų | 20.7 | 31% | 0.314 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -67.5 | -36.3 | -179.3 | -66.4 | 173.3 | 0 | 0 | 0 | 113 | I237 L310 C311 I317 S318 | I237-L314 HydrophobicContact CD1-CB 3.73Å; I237-L314 HydrophobicContact CD1-CD1 3.95Å; I237-L314 HydrophobicContact CG1-CB 3.76Å; I237-L314 HydrophobicContact CG2-CB 4.25Å; I237-L314 HydrophobicContact CG2-CD1 4.29Å; L310-L314 HydrophobicContact CD1-CD1 3.99Å; L310-L314 HydrophobicContact CD1-CG 4.2Å; L310-L314 HydrophobicContact CG-CD1 3.97Å; L310-L314 VanDerWaalsContact O-CG 3.28Å; L310-L314 WeakPolarHBondContact O-CG 3.42Å; L310-L314 PolarHBondContact O-N 3.17Å; C311-L314 PolarHBondContact O-N 3.39Å; L314-I317 PolarHBondContact O-N 3.29Å; L314-S318 WeakPolarHBondContact O-CB 3.3Å; L314-S318 PolarHBondContact O-N 3.33Å; L314-S318 PolarHBondContact O-OG 3.37Å |
| 315 | I | 92.4 | Very high | 92 | Very high | 2 Ų | 2 | 22.5 Ų | 22.5 | 1% | 0.01 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -63.2 | -46.8 | 174.3 | -71.6 | 162.9 | 0 | 0 | 0 | 110.5 | I93 V233 V236 I237 C311 Y312 A313 I317 S318 Y319 | I93-I315 HydrophobicContact CD1-CG2 4.29Å; I93-I315 HydrophobicContact CG1-CD1 3.86Å; I93-I315 HydrophobicContact CG1-CG2 4.1Å; V233-I315 HydrophobicContact CB-CD1 4.39Å; V233-I315 HydrophobicContact CG1-CD1 3.84Å; V233-I315 HydrophobicContact CG1-CG1 4.17Å; V233-I315 HydrophobicContact CG2-CD1 3.88Å; V236-I315 HydrophobicContact CG1-CG1 4.34Å; V236-I315 HydrophobicContact CG1-CG2 4.34Å; I237-I315 HydrophobicContact CG1-CG1 4.41Å; C311-I315 WeakPolarHBondContact O-CB 3.17Å; C311-I315 WeakPolarHBondContact O-CD1 3.46Å; C311-I315 WeakPolarHBondContact O-CG1 3.44Å; C311-I315 PolarHBondContact O-N 3.43Å; Y312-I315 HydrophobicContact CD1-CD1 4.45Å; Y312-I315 PolarHBondContact O-N 3.47Å; A313-I315 PolarHBondContact O-N 3.14Å; I315-I317 VanDerWaalsContact C-N 3.32Å; I315-I317 PolarHBondContact O-N 2.85Å; I315-S318 WeakPolarHBondContact O-CA 3.2Å; I315-S318 WeakPolarHBondContact O-CB 3.47Å; I315-S318 PolarHBondContact O-N 3.45Å; I315-Y319 HydrophobicContact CG2-CD1 4.47Å; I315-Y319 HydrophobicContact CG2-CD2 3.91Å; I315-Y319 HydrophobicContact CG2-CE1 3.99Å; I315-Y319 HydrophobicContact CG2-CE2 3.35Å; I315-Y319 HydrophobicContact CG2-CG 4.45Å; I315-Y319 PolarHBondContact O-N 3.28Å |
| 316 | N | 91.8 | Very high | 91.6 | Very high | 3 Ų | 3 | 27.8 Ų | 27.8 | 2% | 0.016 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 178.4 | -81 | -78.9 | 0 | 0 | 0 | 111.6 | F111 W114 Y312 A313 S318 Y319 L320 | F111-N316 HydrophobicContact CD1-CB 4.42Å; F111-N316 HydrophobicContact CE1-CB 3.51Å; F111-N316 HydrophobicContact CZ-CB 3.79Å; W114-N316 PolarHBondContact NE1-ND2 3.02Å; W114-N316 PolarHBondContact NE1-OD1 3.46Å; Y312-N316 PolarHBondContact O-N 3.33Å; Y312-N316 PolarHBondContact O-ND2 2.92Å; A313-N316 PolarHBondContact O-N 3.45Å; N316-S318 VanDerWaalsContact C-N 3.29Å; N316-S318 PolarHBondContact O-N 3.22Å; N316-Y319 PolarHBondContact O-N 3.23Å; N316-L320 WeakPolarHBondContact O-CG 3.37Å; N316-L320 PolarHBondContact O-N 3.49Å; N316-L320 VanDerWaalsContact O-N 3.16Å |
| 317 | I | 91.6 | Very high | 91.1 | Very high | 55 Ų | 55 | 27.4 Ų | 27.4 | 28% | 0.282 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -61.1 | -42.2 | 173.3 | -66.6 | 168.3 | 0 | 0 | 0 | 110.4 | F111 L244 A313 L314 I315 L320 A321 | F111-I317 HydrophobicContact CE1-CD1 4.43Å; F111-I317 HydrophobicContact CE1-CG1 3.58Å; F111-I317 HydrophobicContact CE2-CG1 4.46Å; F111-I317 HydrophobicContact CZ-CB 4.27Å; F111-I317 HydrophobicContact CZ-CG1 3.45Å; F111-I317 VanDerWaalsContact CZ-CG1 3.45Å; L244-I317 HydrophobicContact CD1-CG2 4.08Å; L244-I317 HydrophobicContact CD2-CG2 4.44Å; A313-I317 WeakPolarHBondContact O-CG1 3.29Å; A313-I317 PolarHBondContact O-N 3.46Å; L314-I317 PolarHBondContact O-N 3.29Å; I315-I317 VanDerWaalsContact C-N 3.32Å; I315-I317 PolarHBondContact O-N 2.85Å; I317-L320 PolarHBondContact O-N 3.21Å; I317-A321 WeakPolarHBondContact O-CB 3.12Å; I317-A321 PolarHBondContact O-N 2.99Å |
| 318 | S | 91.8 | Very high | 90.6 | Very high | 4 Ų | 4 | 24.5 Ų | 24.5 | 3% | 0.028 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -64.3 | -43.3 | -179.8 | -58.6 | 0 | 0 | 0 | 0 | 112.1 | L314 I315 N316 A321 A322 F338 | L314-S318 WeakPolarHBondContact O-CB 3.3Å; L314-S318 PolarHBondContact O-N 3.33Å; L314-S318 PolarHBondContact O-OG 3.37Å; I315-S318 WeakPolarHBondContact O-CA 3.2Å; I315-S318 WeakPolarHBondContact O-CB 3.47Å; I315-S318 PolarHBondContact O-N 3.45Å; N316-S318 VanDerWaalsContact C-N 3.29Å; N316-S318 PolarHBondContact O-N 3.22Å; S318-A321 PolarHBondContact O-N 3.08Å; S318-A322 PolarHBondContact O-N 2.95Å; S318-F338 WeakPolarHBondContact O-CE2 3.45Å |
| 319 | Y | 90.1 | Very high | 90.1 | Very high | 1 Ų | 1 | 26.6 Ų | 26.6 | 0% | 0.004 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -59.4 | -49.3 | 175.4 | -66.8 | -23.2 | 0 | 0 | 0 | 111.3 | P97 V236 I315 N316 A321 A322 M323 M328 V334 F338 | P97-Y319 HydrophobicContact CB-CD2 4.46Å; P97-Y319 HydrophobicContact CG-CD2 4.36Å; P97-Y319 HydrophobicContact CG-CE2 4.16Å; V236-Y319 HydrophobicContact CG1-CD1 4.45Å; V236-Y319 HydrophobicContact CG1-CE1 3.97Å; I315-Y319 HydrophobicContact CG2-CD1 4.47Å; I315-Y319 HydrophobicContact CG2-CD2 3.91Å; I315-Y319 HydrophobicContact CG2-CE1 3.99Å; I315-Y319 HydrophobicContact CG2-CE2 3.35Å; I315-Y319 HydrophobicContact CG2-CG 4.45Å; I315-Y319 PolarHBondContact O-N 3.28Å; N316-Y319 PolarHBondContact O-N 3.23Å; Y319-A321 PolarHBondContact O-N 2.91Å; Y319-A322 PolarHBondContact O-N 3.32Å; Y319-M323 WeakPolarHBondContact O-CG 3.31Å; Y319-M323 PolarHBondContact O-N 3.32Å; Y319-M328 HydrophobicContact CD2-SD 4.13Å; Y319-M328 HydrophobicContact CG-SD 4.4Å; Y319-V334 HydrophobicContact CD1-CG1 4.37Å; Y319-V334 HydrophobicContact CD2-CG1 3.7Å; Y319-V334 HydrophobicContact CE2-CG1 3.87Å; Y319-V334 HydrophobicContact CG-CG1 3.98Å; Y319-F338 HydrophobicContact CD1-CB 4Å; Y319-F338 AromaticContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CE2 4.27Å; Y319-F338 AromaticContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CE1-CB 4.03Å; Y319-F338 HydrophobicContact CE1-CD2 4.22Å; Y319-F338 HydrophobicContact CE1-CG 4.03Å |
| 320 | L | 89.2 | Confident | 89.5 | Confident | 4 Ų | 4 | 32.2 Ų | 32.2 | 2% | 0.021 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -68.2 | -19.3 | -179.5 | -68.4 | 164 | 0 | 0 | 0 | 114 | V107 F111 H251 N316 I317 P325 M328 | V107-L320 HydrophobicContact CG1-CD1 3.42Å; V107-L320 VanDerWaalsContact CG1-CD1 3.42Å; V107-L320 HydrophobicContact CG1-CD2 4.43Å; V107-L320 HydrophobicContact CG2-CD2 4.08Å; F111-L320 HydrophobicContact CD2-CD1 4.44Å; F111-L320 HydrophobicContact CE2-CD1 3.37Å; F111-L320 HydrophobicContact CZ-CD1 3.73Å; H251-L320 WeakPolarHBondContact CB-O 3.12Å; H251-L320 PolarHBondContact CD2-O 2.81Å; N316-L320 WeakPolarHBondContact O-CG 3.37Å; N316-L320 PolarHBondContact O-N 3.49Å; N316-L320 VanDerWaalsContact O-N 3.16Å; I317-L320 PolarHBondContact O-N 3.21Å; L320-P325 HydrophobicContact CD2-CG 4.12Å; L320-M328 HydrophobicContact CD2-CE 4.03Å; L320-M328 HydrophobicContact CG-CE 4.36Å |
| 321 | A | 88.8 | Confident | 88.5 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -79.6 | -19.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | K243 L244 N248 I317 S318 Y319 | K243-A321 HydrophobicContact CB-CB 4.23Å; L244-A321 HydrophobicContact CD1-CB 3.32Å; L244-A321 HydrophobicContact CG-CB 4.16Å; N248-A321 PolarHBondContact ND2-O 2.89Å; I317-A321 WeakPolarHBondContact O-CB 3.12Å; I317-A321 PolarHBondContact O-N 2.99Å; S318-A321 PolarHBondContact O-N 3.08Å; Y319-A321 PolarHBondContact O-N 2.91Å |
| 322 | A | 87.3 | Confident | 87.3 | Confident | 6 Ų | 6 | 32.5 Ų | 32.5 | 5% | 0.05 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -100.7 | -32.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | S318 Y319 F338 R341 I342 | S318-A322 PolarHBondContact O-N 2.95Å; Y319-A322 PolarHBondContact O-N 3.32Å; A322-F338 HydrophobicContact CB-CD2 3.5Å; A322-F338 HydrophobicContact CB-CE2 3.72Å; A322-R341 VanDerWaalsContact O-CD 3.28Å; A322-R341 WeakPolarHBondContact O-CD 3.45Å; A322-R341 PolarHBondContact O-NH1 2.9Å; A322-R341 VanDerWaalsContact O-NH1 3.08Å; A322-I342 HydrophobicContact CB-CD1 3.68Å; A322-I342 HydrophobicContact CB-CG1 4.44Å |
| 323 | M | 87.4 | Confident | 86.4 | Confident | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 17% | 0.169 | C | C | . | . | S | Bend | trans | -139.4 | 159.6 | -174.9 | 65.7 | -173.8 | 75 | 0 | 0 | 112.1 | Y319 E327 M328 V334 T337 F338 | Y319-M323 WeakPolarHBondContact O-CG 3.31Å; Y319-M323 PolarHBondContact O-N 3.32Å; M323-E327 HydrophobicContact CB-CB 4.37Å; M323-E327 HydrophobicContact CB-CG 4.19Å; M323-E327 WeakPolarHBondContact CB-OE2 3.43Å; M323-M328 HydrophobicContact CG-CB 4.29Å; M323-M328 HydrophobicContact SD-CB 3.92Å; M323-M328 HydrophobicContact SD-CG 4.31Å; M323-V334 HydrophobicContact CE-CG1 4.4Å; M323-V334 HydrophobicContact SD-CG1 4.15Å; M323-T337 HydrophobicContact CE-CG2 3.96Å; M323-T337 HydrophobicContact SD-CG2 4.36Å; M323-F338 HydrophobicContact CE-CB 3.73Å |
| 324 | S | 89.2 | Confident | 85.8 | Confident | 34 Ų | 34 | 31.9 Ų | 31.9 | 24% | 0.238 | 16% | 0.164 | C | C | . | . | trans | -74.8 | 157.4 | 176.9 | 74 | 0 | 0 | 0 | 0 | 111.5 | Q326 E327 M328 | S324-Q326 PolarHBondContact O-N 3.48Å; S324-E327 PolarHBondContact O-N 3.25Å; S324-E327 WeakPolarHBondContact OG-CB 3.26Å; S324-E327 PolarHBondContact OG-N 3.09Å; S324-M328 PolarHBondContact O-N 3.4Å | ||
| 325 | P | 85.9 | Confident | 85.3 | Confident | 37 Ų | 37 | 29 Ų | 29 | 24% | 0.24 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.4 | -37.2 | 175 | -26 | 35 | 0 | 0 | 0 | 113.1 | L101 V107 L320 M328 I329 | L101-P325 HydrophobicContact CD1-CB 4Å; V107-P325 HydrophobicContact CG2-CB 4.17Å; V107-P325 HydrophobicContact CG2-CG 3.7Å; L320-P325 HydrophobicContact CD2-CG 4.12Å; P325-M328 PolarHBondContact O-N 2.86Å; P325-I329 VanDerWaalsContact O-CG1 3.31Å; P325-I329 WeakPolarHBondContact O-CG1 3.48Å; P325-I329 PolarHBondContact O-N 3.27Å; P325-I329 VanDerWaalsContact O-N 3.16Å |
| 326 | Q | 85.5 | Confident | 84.8 | Confident | 111 Ų | 111 | 29.9 Ų | 29.9 | 52% | 0.519 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -67 | -44.4 | 179.3 | -171.3 | 65.4 | 18.6 | 0 | 0 | 111.7 | S324 M328 I329 E330 | S324-Q326 PolarHBondContact O-N 3.48Å; Q326-M328 VanDerWaalsContact C-N 3.3Å; Q326-M328 PolarHBondContact O-N 3.09Å; Q326-I329 WeakPolarHBondContact O-CB 3.36Å; Q326-I329 PolarHBondContact O-N 3.03Å; Q326-I329 VanDerWaalsContact O-N 3.11Å; Q326-E330 WeakPolarHBondContact CG-OE1 3.42Å; Q326-E330 PolarHBondContact NE2-OE1 3.39Å; Q326-E330 WeakPolarHBondContact O-CG 3.22Å; Q326-E330 PolarHBondContact O-N 3.14Å |
| 327 | E | 85.3 | Confident | 84.4 | Confident | 44 Ų | 44 | 31.1 Ų | 31.1 | 21% | 0.206 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.6 | -36.4 | 175.8 | -177.5 | 178.6 | -172.4 | 0 | 0 | 112.1 | M323 S324 I329 E330 S331 R341 | M323-E327 HydrophobicContact CB-CB 4.37Å; M323-E327 HydrophobicContact CB-CG 4.19Å; M323-E327 WeakPolarHBondContact CB-OE2 3.43Å; S324-E327 PolarHBondContact O-N 3.25Å; S324-E327 WeakPolarHBondContact OG-CB 3.26Å; S324-E327 PolarHBondContact OG-N 3.09Å; E327-I329 VanDerWaalsContact C-N 3.27Å; E327-I329 PolarHBondContact O-N 3.34Å; E327-E330 PolarHBondContact O-N 3.22Å; E327-S331 VanDerWaalsContact O-CB 3.26Å; E327-S331 WeakPolarHBondContact O-CB 3.45Å; E327-S331 PolarHBondContact O-N 3.38Å; E327-R341 VanDerWaalsContact CD-CZ 3.44Å; E327-R341 IonicContact OE1-CZ 3Å; E327-R341 IonicContact OE1-NE 2.86Å; E327-R341 PolarHBondContact OE1-NE 2.53Å; E327-R341 IonicContact OE1-NH2 2.66Å; E327-R341 PolarHBondContact OE1-NH2 2.8Å; E327-R341 IonicContact OE2-CZ 3.06Å; E327-R341 IonicContact OE2-NE 3.6Å; E327-R341 IonicContact OE2-NH1 3.5Å; E327-R341 PolarHBondContact OE2-NH1 3.36Å; E327-R341 IonicContact OE2-NH2 2.78Å; E327-R341 PolarHBondContact OE2-NH2 3.17Å |
| 328 | M | 84.6 | Confident | 84.1 | Confident | 1 Ų | 1 | 28.6 Ų | 28.6 | 1% | 0.005 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -66.1 | -31 | 174.6 | -173.2 | 159.7 | 71.8 | 0 | 0 | 112.4 | P97 S98 L101 Y319 L320 M323 S324 P325 Q326 V334 | P97-M328 HydrophobicContact CB-CE 4.19Å; P97-M328 HydrophobicContact CB-SD 3.94Å; S98-M328 WeakPolarHBondContact CB-O 3.44Å; S98-M328 PolarHBondContact OG-O 3.27Å; L101-M328 HydrophobicContact CD1-CB 4.45Å; L101-M328 HydrophobicContact CD1-CE 3.07Å; L101-M328 HydrophobicContact CG-CE 3.69Å; Y319-M328 HydrophobicContact CD2-SD 4.13Å; Y319-M328 HydrophobicContact CG-SD 4.4Å; L320-M328 HydrophobicContact CD2-CE 4.03Å; L320-M328 HydrophobicContact CG-CE 4.36Å; M323-M328 HydrophobicContact CG-CB 4.29Å; M323-M328 HydrophobicContact SD-CB 3.92Å; M323-M328 HydrophobicContact SD-CG 4.31Å; S324-M328 PolarHBondContact O-N 3.4Å; P325-M328 PolarHBondContact O-N 2.86Å; Q326-M328 VanDerWaalsContact C-N 3.3Å; Q326-M328 PolarHBondContact O-N 3.09Å; M328-V334 HydrophobicContact CG-CB 4.48Å; M328-V334 HydrophobicContact CG-CG1 3.71Å; M328-V334 HydrophobicContact CG-CG2 3.88Å; M328-V334 HydrophobicContact SD-CG1 3.75Å |
| 329 | I | 84.8 | Confident | 83.8 | Confident | 45 Ų | 45 | 28.4 Ų | 28.4 | 23% | 0.231 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -73 | -41.7 | 176.2 | -69.1 | 167.6 | 0 | 0 | 0 | 111 | S98 L101 V102 P325 Q326 E327 S331 | S98-I329 WeakPolarHBondContact OG-CA 3.49Å; S98-I329 PolarHBondContact OG-O 3.06Å; L101-I329 HydrophobicContact CB-CD1 4.25Å; L101-I329 HydrophobicContact CB-CG1 4.11Å; L101-I329 HydrophobicContact CD1-CG1 4.5Å; V102-I329 HydrophobicContact CG2-CB 4.23Å; V102-I329 HydrophobicContact CG2-CD1 4.2Å; V102-I329 HydrophobicContact CG2-CG1 3.85Å; V102-I329 HydrophobicContact CG2-CG2 3.5Å; V102-I329 VanDerWaalsContact CG2-CG2 3.5Å; P325-I329 VanDerWaalsContact O-CG1 3.31Å; P325-I329 WeakPolarHBondContact O-CG1 3.48Å; P325-I329 PolarHBondContact O-N 3.27Å; P325-I329 VanDerWaalsContact O-N 3.16Å; Q326-I329 WeakPolarHBondContact O-CB 3.36Å; Q326-I329 PolarHBondContact O-N 3.03Å; Q326-I329 VanDerWaalsContact O-N 3.11Å; E327-I329 VanDerWaalsContact C-N 3.27Å; E327-I329 PolarHBondContact O-N 3.34Å; I329-S331 VanDerWaalsContact C-N 3.34Å |
| 330 | E | 82.7 | Confident | 83.6 | Confident | 138 Ų | 138 | 33.1 Ų | 33.1 | 65% | 0.645 | 17% | 0.173 | S | C | * | . | H | α-helix | trans | -75.4 | -23.4 | -177.6 | -70.7 | 169.6 | -169.3 | 0 | 0 | 113.1 | Q326 E327 E332 | Q326-E330 WeakPolarHBondContact CG-OE1 3.42Å; Q326-E330 PolarHBondContact NE2-OE1 3.39Å; Q326-E330 WeakPolarHBondContact O-CG 3.22Å; Q326-E330 PolarHBondContact O-N 3.14Å; E327-E330 PolarHBondContact O-N 3.22Å; E330-E332 PolarHBondContact O-N 3.17Å |
| 331 | S | 74.5 | Confident | 83.3 | Confident | 17 Ų | 17 | 39.1 Ų | 39.1 | 12% | 0.119 | 20% | 0.195 | C | C | . | . | trans | -77 | 118.3 | -179.7 | 177.3 | 0 | 0 | 0 | 0 | 112.2 | E327 I329 A333 V334 T337 | E327-S331 VanDerWaalsContact O-CB 3.26Å; E327-S331 WeakPolarHBondContact O-CB 3.45Å; E327-S331 PolarHBondContact O-N 3.38Å; I329-S331 VanDerWaalsContact C-N 3.34Å; S331-A333 VanDerWaalsContact C-N 3.32Å; S331-A333 PolarHBondContact O-N 2.82Å; S331-A333 VanDerWaalsContact OG-C 3.28Å; S331-A333 PolarHBondContact OG-O 3.23Å; S331-V334 PolarHBondContact OG-N 3.22Å; S331-T337 PolarHBondContact OG-OG1 3.41Å | ||
| 332 | E | 69.1 | Low | 83.1 | Confident | 106 Ų | 106 | 40.5 Ų | 40.5 | 50% | 0.495 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -38.1 | 171.2 | -62.9 | -159.6 | 163.1 | 0 | 0 | 112.4 | Q179 E330 | Q179-E332 PolarHBondContact NE2-OE2 3.28Å; E330-E332 PolarHBondContact O-N 3.17Å |
| 333 | A | 75.6 | Confident | 82.8 | Confident | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.008 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -120 | 77.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y180 E183 S331 A335 V336 T337 | Y180-A333 HydrophobicContact CD1-CB 4.22Å; Y180-A333 HydrophobicContact CE1-CB 3.58Å; Y180-A333 WeakPolarHBondContact OH-CA 3.46Å; E183-A333 VanDerWaalsContact OE1-CB 3.31Å; E183-A333 WeakPolarHBondContact OE1-CB 3.25Å; E183-A333 VanDerWaalsContact OE2-CB 3.25Å; E183-A333 WeakPolarHBondContact OE2-CB 3.28Å; S331-A333 VanDerWaalsContact C-N 3.32Å; S331-A333 PolarHBondContact O-N 2.82Å; S331-A333 VanDerWaalsContact OG-C 3.28Å; S331-A333 PolarHBondContact OG-O 3.23Å; A333-A335 PolarHBondContact O-N 3.1Å; A333-V336 HydrophobicContact CB-CB 3.96Å; A333-V336 HydrophobicContact CB-CG2 3.88Å; A333-V336 PolarHBondContact O-N 3.47Å; A333-T337 PolarHBondContact O-N 3.44Å; A333-T337 VanDerWaalsContact O-N 3.1Å; A333-T337 PolarHBondContact O-OG1 3.07Å |
| 334 | V | 80.8 | Confident | 82.5 | Confident | 1 Ų | 1 | 44.2 Ų | 44.2 | 1% | 0.006 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -49.4 | -40.7 | -175.8 | -179.5 | 0 | 0 | 0 | 0 | 112.8 | Y319 M323 M328 S331 F338 | Y319-V334 HydrophobicContact CD1-CG1 4.37Å; Y319-V334 HydrophobicContact CD2-CG1 3.7Å; Y319-V334 HydrophobicContact CE2-CG1 3.87Å; Y319-V334 HydrophobicContact CG-CG1 3.98Å; M323-V334 HydrophobicContact CE-CG1 4.4Å; M323-V334 HydrophobicContact SD-CG1 4.15Å; M328-V334 HydrophobicContact CG-CB 4.48Å; M328-V334 HydrophobicContact CG-CG1 3.71Å; M328-V334 HydrophobicContact CG-CG2 3.88Å; M328-V334 HydrophobicContact SD-CG1 3.75Å; S331-V334 PolarHBondContact OG-N 3.22Å; V334-F338 WeakPolarHBondContact O-CB 3.39Å; V334-F338 PolarHBondContact O-N 3.11Å |
| 335 | A | 82.6 | Confident | 81.9 | Confident | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -68.2 | -35 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | F94 Y180 A333 G339 M350 V354 | F94-A335 HydrophobicContact CD1-CB 3.68Å; F94-A335 HydrophobicContact CE1-CB 4.2Å; Y180-A335 HydrophobicContact CE1-CB 4.45Å; A333-A335 PolarHBondContact O-N 3.1Å; A335-G339 PolarHBondContact O-N 3.34Å; A335-M350 HydrophobicContact CB-CE 3.92Å; A335-M350 WeakPolarHBondContact O-CE 2.9Å; A335-V354 HydrophobicContact CB-CG2 3.9Å |
| 336 | V | 82.1 | Confident | 81.7 | Confident | 19 Ų | 19 | 50 Ų | 50 | 12% | 0.115 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -71.9 | -44.4 | 178.1 | 177.7 | 0 | 0 | 0 | 0 | 109.4 | Y180 A333 F338 G339 N340 P351 | Y180-V336 HydrophobicContact CD1-CG2 3.93Å; Y180-V336 HydrophobicContact CE1-CG2 4.03Å; A333-V336 HydrophobicContact CB-CB 3.96Å; A333-V336 HydrophobicContact CB-CG2 3.88Å; A333-V336 PolarHBondContact O-N 3.47Å; V336-F338 VanDerWaalsContact C-N 3.3Å; V336-F338 PolarHBondContact O-N 2.98Å; V336-G339 WeakPolarHBondContact O-CA 3.32Å; V336-G339 PolarHBondContact O-N 3.34Å; V336-N340 PolarHBondContact O-N 3.4Å; V336-N340 PolarHBondContact O-ND2 3.25Å; V336-P351 HydrophobicContact CG2-CB 4.12Å; V336-P351 HydrophobicContact CG2-CG 4.48Å |
| 337 | T | 83.4 | Confident | 81.5 | Confident | 30 Ų | 30 | 45.2 Ų | 45.2 | 18% | 0.184 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -57.8 | -42 | 174.6 | -56.6 | 0 | 0 | 0 | 0 | 111.9 | M323 S331 A333 N340 R341 | M323-T337 HydrophobicContact CE-CG2 3.96Å; M323-T337 HydrophobicContact SD-CG2 4.36Å; S331-T337 PolarHBondContact OG-OG1 3.41Å; A333-T337 PolarHBondContact O-N 3.44Å; A333-T337 VanDerWaalsContact O-N 3.1Å; A333-T337 PolarHBondContact O-OG1 3.07Å; T337-N340 PolarHBondContact O-N 3.48Å; T337-R341 PolarHBondContact O-N 3.39Å |
| 338 | F | 86.6 | Confident | 81.2 | Confident | 2 Ų | 2 | 50.8 Ų | 50.8 | 1% | 0.009 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 172.2 | 176.3 | -88.8 | 0 | 0 | 0 | 112.1 | V236 S318 Y319 A322 M323 V334 V336 N340 R341 I342 M350 | V236-F338 HydrophobicContact CB-CE1 4.16Å; V236-F338 HydrophobicContact CB-CZ 4.45Å; V236-F338 HydrophobicContact CG1-CD1 4.4Å; V236-F338 HydrophobicContact CG1-CE1 3.88Å; V236-F338 HydrophobicContact CG1-CE2 4.42Å; V236-F338 HydrophobicContact CG1-CZ 3.87Å; V236-F338 HydrophobicContact CG2-CD1 4.42Å; V236-F338 HydrophobicContact CG2-CE1 4.1Å; V236-F338 WeakPolarHBondContact O-CZ 3.25Å; S318-F338 WeakPolarHBondContact O-CE2 3.45Å; Y319-F338 HydrophobicContact CD1-CB 4Å; Y319-F338 AromaticContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CD2 3.65Å; Y319-F338 HydrophobicContact CD1-CE2 4.27Å; Y319-F338 AromaticContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CD1-CG 3.89Å; Y319-F338 HydrophobicContact CE1-CB 4.03Å; Y319-F338 HydrophobicContact CE1-CD2 4.22Å; Y319-F338 HydrophobicContact CE1-CG 4.03Å; A322-F338 HydrophobicContact CB-CD2 3.5Å; A322-F338 HydrophobicContact CB-CE2 3.72Å; M323-F338 HydrophobicContact CE-CB 3.73Å; V334-F338 WeakPolarHBondContact O-CB 3.39Å; V334-F338 PolarHBondContact O-N 3.11Å; V336-F338 VanDerWaalsContact C-N 3.3Å; V336-F338 PolarHBondContact O-N 2.98Å; F338-N340 PolarHBondContact O-N 2.88Å; F338-R341 PolarHBondContact O-N 3Å; F338-I342 HydrophobicContact CD1-CD1 4.26Å; F338-I342 HydrophobicContact CD2-CD1 3.71Å; F338-I342 HydrophobicContact CE1-CD1 3.73Å; F338-I342 HydrophobicContact CE2-CD1 3.13Å; F338-I342 HydrophobicContact CG-CD1 4.25Å; F338-I342 HydrophobicContact CZ-CD1 3.14Å; F338-I342 HydrophobicContact CZ-CG1 4.48Å; F338-I342 PolarHBondContact O-N 3.26Å; F338-I342 VanDerWaalsContact O-N 3.13Å; F338-M350 HydrophobicContact CD1-CE 4.47Å |
| 339 | G | 85.1 | Confident | 81.1 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -57.8 | -46.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | A335 V336 R341 I342 L343 G344 M350 | A335-G339 PolarHBondContact O-N 3.34Å; V336-G339 WeakPolarHBondContact O-CA 3.32Å; V336-G339 PolarHBondContact O-N 3.34Å; G339-R341 VanDerWaalsContact C-N 3.26Å; G339-R341 PolarHBondContact O-N 3.27Å; G339-I342 PolarHBondContact O-N 3.06Å; G339-L343 WeakPolarHBondContact O-CA 3.09Å; G339-L343 WeakPolarHBondContact O-CB 3.43Å; G339-L343 PolarHBondContact O-N 3.02Å; G339-G344 PolarHBondContact O-N 2.99Å; G339-M350 VanDerWaalsContact CA-CG 3.48Å |
| 340 | N | 84.9 | Confident | 81.1 | Confident | 100 Ų | 100 | 51.5 Ų | 51.5 | 54% | 0.535 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.6 | -36.5 | 178.3 | -72.4 | -27.2 | 0 | 0 | 0 | 112.1 | V336 T337 F338 A347 | V336-N340 PolarHBondContact O-N 3.4Å; V336-N340 PolarHBondContact O-ND2 3.25Å; T337-N340 PolarHBondContact O-N 3.48Å; F338-N340 PolarHBondContact O-N 2.88Å; N340-A347 WeakPolarHBondContact OD1-CB 3.27Å |
| 341 | R | 83.6 | Confident | 81.2 | Confident | 130 Ų | 130 | 45.4 Ų | 45.4 | 49% | 0.491 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -78.4 | -31.7 | -179.6 | -74.7 | -168 | 170.5 | -135.1 | -7.4 | 115.1 | A322 E327 T337 F338 G339 | A322-R341 VanDerWaalsContact O-CD 3.28Å; A322-R341 WeakPolarHBondContact O-CD 3.45Å; A322-R341 PolarHBondContact O-NH1 2.9Å; A322-R341 VanDerWaalsContact O-NH1 3.08Å; E327-R341 VanDerWaalsContact CD-CZ 3.44Å; E327-R341 IonicContact OE1-CZ 3Å; E327-R341 IonicContact OE1-NE 2.86Å; E327-R341 PolarHBondContact OE1-NE 2.53Å; E327-R341 IonicContact OE1-NH2 2.66Å; E327-R341 PolarHBondContact OE1-NH2 2.8Å; E327-R341 IonicContact OE2-CZ 3.06Å; E327-R341 IonicContact OE2-NE 3.6Å; E327-R341 IonicContact OE2-NH1 3.5Å; E327-R341 PolarHBondContact OE2-NH1 3.36Å; E327-R341 IonicContact OE2-NH2 2.78Å; E327-R341 PolarHBondContact OE2-NH2 3.17Å; T337-R341 PolarHBondContact O-N 3.39Å; F338-R341 PolarHBondContact O-N 3Å; G339-R341 VanDerWaalsContact C-N 3.26Å; G339-R341 PolarHBondContact O-N 3.27Å |
| 342 | I | 84.8 | Confident | 81.8 | Confident | 28 Ų | 28 | 48.1 Ų | 48.1 | 14% | 0.144 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -107.4 | -45.2 | -172.6 | -73.2 | 163 | 0 | 0 | 0 | 112.5 | K243 A322 F338 G339 | K243-I342 HydrophobicContact CG-CD1 4.05Å; K243-I342 HydrophobicContact CG-CG1 4.1Å; A322-I342 HydrophobicContact CB-CD1 3.68Å; A322-I342 HydrophobicContact CB-CG1 4.44Å; F338-I342 HydrophobicContact CD1-CD1 4.26Å; F338-I342 HydrophobicContact CD2-CD1 3.71Å; F338-I342 HydrophobicContact CE1-CD1 3.73Å; F338-I342 HydrophobicContact CE2-CD1 3.13Å; F338-I342 HydrophobicContact CG-CD1 4.25Å; F338-I342 HydrophobicContact CZ-CD1 3.14Å; F338-I342 HydrophobicContact CZ-CG1 4.48Å; F338-I342 PolarHBondContact O-N 3.26Å; F338-I342 VanDerWaalsContact O-N 3.13Å; G339-I342 PolarHBondContact O-N 3.06Å |
| 343 | L | 80.1 | Confident | 82.6 | Confident | 39 Ų | 39 | 43.9 Ų | 43.9 | 20% | 0.204 | 24% | 0.241 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.6 | -18.4 | -169.7 | -66.3 | 175.9 | 0 | 0 | 0 | 112.7 | V235 G339 A345 L346 M350 | V235-L343 HydrophobicContact CG1-CD1 4.33Å; V235-L343 HydrophobicContact CG1-CD2 4.31Å; G339-L343 WeakPolarHBondContact O-CA 3.09Å; G339-L343 WeakPolarHBondContact O-CB 3.43Å; G339-L343 PolarHBondContact O-N 3.02Å; L343-A345 PolarHBondContact O-N 3.34Å; L343-L346 HydrophobicContact CB-CB 3.99Å; L343-L346 PolarHBondContact O-N 3.3Å; L343-M350 HydrophobicContact CD1-CG 3.91Å; L343-M350 HydrophobicContact CD1-SD 3.93Å |
| 344 | G | 81.6 | Confident | 83.2 | Confident | 46 Ų | 46 | 43.9 Ų | 43.9 | 47% | 0.474 | 24% | 0.24 | S | C | . | . | G | 310 helix | trans | 53.2 | -107.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | G339 L346 A347 | G339-G344 PolarHBondContact O-N 2.99Å; G344-L346 PolarHBondContact O-N 3.28Å; G344-L346 VanDerWaalsContact O-N 3.15Å; G344-A347 WeakPolarHBondContact O-CB 3.31Å; G344-A347 PolarHBondContact O-N 3.49Å |
| 345 | A | 77.4 | Confident | 83.6 | Confident | 96 Ų | 96 | 44.6 Ų | 44.6 | 79% | 0.793 | 25% | 0.245 | S | C | * | . | G | 310 helix | trans | -59.1 | -23.8 | 177 | 0 | 0 | 0 | 0 | 0 | 114.4 | L343 | L343-A345 PolarHBondContact O-N 3.34Š|
| 346 | L | 80.8 | Confident | 83.9 | Confident | 96 Ų | 96 | 46.6 Ų | 46.6 | 50% | 0.503 | 26% | 0.255 | S | S | . | . | G | 310 helix | trans | -95.1 | 12.4 | 176.9 | -64.3 | 176.7 | 0 | 0 | 0 | 113 | L343 G344 W348 L349 | L343-L346 HydrophobicContact CB-CB 3.99Å; L343-L346 PolarHBondContact O-N 3.3Å; G344-L346 PolarHBondContact O-N 3.28Å; G344-L346 VanDerWaalsContact O-N 3.15Å; L346-W348 PolarHBondContact O-N 3.44Å; L346-L349 WeakPolarHBondContact O-CB 3.35Å; L346-L349 PolarHBondContact O-N 3.17Å |
| 347 | A | 80.4 | Confident | 84.3 | Confident | 11 Ų | 11 | 45.8 Ų | 45.8 | 9% | 0.091 | 25% | 0.25 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59 | -30.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | N340 G344 L349 M350 P351 | N340-A347 WeakPolarHBondContact OD1-CB 3.27Å; G344-A347 WeakPolarHBondContact O-CB 3.31Å; G344-A347 PolarHBondContact O-N 3.49Å; A347-L349 PolarHBondContact O-N 3.28Å; A347-L349 VanDerWaalsContact O-N 3.13Å; A347-M350 PolarHBondContact O-N 3.36Å; A347-M350 VanDerWaalsContact O-N 3.11Å; A347-P351 VanDerWaalsContact O-CD 3.22Å; A347-P351 WeakPolarHBondContact O-CD 3.46Å |
| 348 | W | 81 | Confident | 84.7 | Confident | 160 Ų | 160 | 44.3 Ų | 44.3 | 61% | 0.606 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | -20 | 175.8 | 69.3 | -92.2 | 0 | 0 | 0 | 113.7 | L346 M350 P351 L352 | L346-W348 PolarHBondContact O-N 3.44Å; W348-M350 VanDerWaalsContact C-N 3.27Å; W348-M350 PolarHBondContact O-N 3.45Å; W348-P351 WeakPolarHBondContact O-CD 3.37Å; W348-P351 WeakPolarHBondContact O-CG 3.41Å; W348-L352 HydrophobicContact CE3-CD2 4.29Å; W348-L352 HydrophobicContact CZ3-CD2 3.66Å; W348-L352 PolarHBondContact O-N 3.47Å |
| 349 | L | 82.3 | Confident | 84.9 | Confident | 57 Ų | 57 | 45.3 Ų | 45.3 | 30% | 0.298 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -68.1 | -28 | 177.1 | -168.4 | 69 | 0 | 0 | 0 | 112.1 | L346 A347 S353 | L346-L349 WeakPolarHBondContact O-CB 3.35Å; L346-L349 PolarHBondContact O-N 3.17Å; A347-L349 PolarHBondContact O-N 3.28Å; A347-L349 VanDerWaalsContact O-N 3.13Å; L349-S353 VanDerWaalsContact O-CB 3.3Å; L349-S353 WeakPolarHBondContact O-CB 3.32Å; L349-S353 PolarHBondContact O-N 3.1Å; L349-S353 PolarHBondContact O-OG 3.34Å |
| 350 | M | 84.3 | Confident | 85.1 | Confident | 5 Ų | 5 | 45.3 Ų | 45.3 | 3% | 0.025 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -67.4 | -56.6 | -179.4 | -70.4 | -52.7 | -61.1 | 0 | 0 | 113.2 | V236 A335 F338 G339 L343 A347 W348 L352 S353 V354 | V236-M350 HydrophobicContact CG2-CE 3.54Å; V236-M350 HydrophobicContact CG2-SD 4.06Å; A335-M350 HydrophobicContact CB-CE 3.92Å; A335-M350 WeakPolarHBondContact O-CE 2.9Å; F338-M350 HydrophobicContact CD1-CE 4.47Å; G339-M350 VanDerWaalsContact CA-CG 3.48Å; L343-M350 HydrophobicContact CD1-CG 3.91Å; L343-M350 HydrophobicContact CD1-SD 3.93Å; A347-M350 PolarHBondContact O-N 3.36Å; A347-M350 VanDerWaalsContact O-N 3.11Å; W348-M350 VanDerWaalsContact C-N 3.27Å; W348-M350 PolarHBondContact O-N 3.45Å; M350-L352 VanDerWaalsContact C-N 3.25Å; M350-L352 PolarHBondContact O-N 2.82Å; M350-S353 WeakPolarHBondContact O-CB 3.27Å; M350-S353 PolarHBondContact O-N 3.23Å; M350-V354 WeakPolarHBondContact O-CG2 3.19Å; M350-V354 PolarHBondContact O-N 2.64Å |
| 351 | P | 84.4 | Confident | 85.4 | Confident | 10 Ų | 10 | 40.8 Ų | 40.8 | 7% | 0.065 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.1 | -33.8 | 176.8 | 23.2 | -31.7 | 0 | 0 | 0 | 112.1 | A184 V336 A347 W348 S353 V354 T355 | A184-P351 HydrophobicContact CB-CB 3.89Å; A184-P351 HydrophobicContact CB-CG 3.99Å; V336-P351 HydrophobicContact CG2-CB 4.12Å; V336-P351 HydrophobicContact CG2-CG 4.48Å; A347-P351 VanDerWaalsContact O-CD 3.22Å; A347-P351 WeakPolarHBondContact O-CD 3.46Å; W348-P351 WeakPolarHBondContact O-CD 3.37Å; W348-P351 WeakPolarHBondContact O-CG 3.41Å; P351-S353 VanDerWaalsContact C-N 3.35Å; P351-S353 PolarHBondContact O-N 3.14Å; P351-V354 PolarHBondContact O-N 3.37Å; P351-T355 WeakPolarHBondContact O-CB 3.23Å; P351-T355 VanDerWaalsContact O-CG2 3.28Å; P351-T355 WeakPolarHBondContact O-CG2 3.42Å; P351-T355 PolarHBondContact O-N 3.32Å; P351-T355 PolarHBondContact O-OG1 3.14Å |
| 352 | L | 86.8 | Confident | 85.8 | Confident | 73 Ų | 73 | 34.7 Ų | 34.7 | 38% | 0.382 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -61 | -43.3 | 171.7 | 179.5 | 61.2 | 0 | 0 | 0 | 112.1 | W348 M350 T355 I356 | W348-L352 HydrophobicContact CE3-CD2 4.29Å; W348-L352 HydrophobicContact CZ3-CD2 3.66Å; W348-L352 PolarHBondContact O-N 3.47Å; M350-L352 VanDerWaalsContact C-N 3.25Å; M350-L352 PolarHBondContact O-N 2.82Å; L352-T355 WeakPolarHBondContact CA-OG1 3.39Å; L352-T355 PolarHBondContact O-N 2.92Å; L352-T355 PolarHBondContact O-OG1 3.12Å; L352-I356 HydrophobicContact CD1-CD1 4.03Å; L352-I356 HydrophobicContact CD1-CG1 4.36Å; L352-I356 HydrophobicContact CG-CD1 3.96Å; L352-I356 WeakPolarHBondContact O-CD1 3.23Å; L352-I356 VanDerWaalsContact O-CG1 3.25Å; L352-I356 WeakPolarHBondContact O-CG1 3.4Å; L352-I356 PolarHBondContact O-N 3.16Å |
| 353 | S | 86.6 | Confident | 86.1 | Confident | 18 Ų | 18 | 33.4 Ų | 33.4 | 13% | 0.126 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.1 | -40.1 | 178.3 | -63.8 | 0 | 0 | 0 | 0 | 112.3 | A232 L349 M350 P351 I356 S357 | A232-S353 VanDerWaalsContact CB-CB 3.41Å; A232-S353 WeakPolarHBondContact CB-OG 3.44Å; L349-S353 VanDerWaalsContact O-CB 3.3Å; L349-S353 WeakPolarHBondContact O-CB 3.32Å; L349-S353 PolarHBondContact O-N 3.1Å; L349-S353 PolarHBondContact O-OG 3.34Å; M350-S353 WeakPolarHBondContact O-CB 3.27Å; M350-S353 PolarHBondContact O-N 3.23Å; P351-S353 VanDerWaalsContact C-N 3.35Å; P351-S353 PolarHBondContact O-N 3.14Å; S353-I356 PolarHBondContact O-N 3.47Å; S353-S357 WeakPolarHBondContact O-CB 3.4Å; S353-S357 PolarHBondContact O-N 3.31Å |
| 354 | V | 87 | Confident | 86.4 | Confident | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -65.3 | -44.1 | 177 | 176.2 | 0 | 0 | 0 | 0 | 111 | F94 Y180 A335 M350 P351 S357 T358 | F94-V354 HydrophobicContact CD1-CG2 3.82Å; F94-V354 HydrophobicContact CD2-CB 4.29Å; F94-V354 HydrophobicContact CD2-CG1 3.61Å; F94-V354 HydrophobicContact CD2-CG2 4.05Å; F94-V354 HydrophobicContact CE1-CG2 3.75Å; F94-V354 HydrophobicContact CE2-CB 4.2Å; F94-V354 HydrophobicContact CE2-CG1 3.92Å; F94-V354 HydrophobicContact CE2-CG2 3.98Å; F94-V354 HydrophobicContact CG-CG1 4.04Å; F94-V354 HydrophobicContact CG-CG2 3.95Å; F94-V354 HydrophobicContact CZ-CB 4.43Å; F94-V354 HydrophobicContact CZ-CG2 3.82Å; Y180-V354 HydrophobicContact CD1-CB 3.86Å; Y180-V354 HydrophobicContact CD1-CG1 3.52Å; Y180-V354 HydrophobicContact CD1-CG2 3.99Å; Y180-V354 HydrophobicContact CD2-CG1 3.76Å; Y180-V354 HydrophobicContact CE1-CB 4.33Å; Y180-V354 HydrophobicContact CE1-CG1 3.88Å; Y180-V354 HydrophobicContact CE1-CG2 4.04Å; Y180-V354 HydrophobicContact CE2-CG1 4.14Å; Y180-V354 HydrophobicContact CG-CB 4.15Å; Y180-V354 HydrophobicContact CG-CG1 3.43Å; Y180-V354 VanDerWaalsContact CG-CG1 3.43Å; A335-V354 HydrophobicContact CB-CG2 3.9Å; M350-V354 WeakPolarHBondContact O-CG2 3.19Å; M350-V354 PolarHBondContact O-N 2.64Å; P351-V354 PolarHBondContact O-N 3.37Å; V354-S357 WeakPolarHBondContact O-CB 3.48Å; V354-S357 PolarHBondContact O-N 3.24Å; V354-T358 HydrophobicContact CG1-CG2 4.27Å; V354-T358 WeakPolarHBondContact O-CG2 3.34Å; V354-T358 PolarHBondContact O-N 3.25Å; V354-T358 PolarHBondContact O-OG1 3.33Å |
| 355 | T | 89.3 | Confident | 86.7 | Confident | 16 Ų | 16 | 29.4 Ų | 29.4 | 10% | 0.098 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.3 | -41 | 177.9 | 50.7 | 0 | 0 | 0 | 0 | 111.9 | F177 A181 P351 L352 S357 T358 F359 | F177-T355 HydrophobicContact CD2-CG2 4.16Å; F177-T355 VanDerWaalsContact CD2-O 3.3Å; F177-T355 WeakPolarHBondContact CD2-O 3.38Å; F177-T355 HydrophobicContact CE2-CG2 4.13Å; A181-T355 HydrophobicContact CB-CG2 3.72Å; P351-T355 WeakPolarHBondContact O-CB 3.23Å; P351-T355 VanDerWaalsContact O-CG2 3.28Å; P351-T355 WeakPolarHBondContact O-CG2 3.42Å; P351-T355 PolarHBondContact O-N 3.32Å; P351-T355 PolarHBondContact O-OG1 3.14Å; L352-T355 WeakPolarHBondContact CA-OG1 3.39Å; L352-T355 PolarHBondContact O-N 2.92Å; L352-T355 PolarHBondContact O-OG1 3.12Å; T355-S357 PolarHBondContact O-N 3.39Å; T355-T358 WeakPolarHBondContact CA-OG1 3.36Å; T355-T358 PolarHBondContact O-OG1 2.94Å; T355-T358 VanDerWaalsContact O-OG1 3.09Å; T355-F359 VanDerWaalsContact O-CB 3.29Å; T355-F359 WeakPolarHBondContact O-CB 3.42Å; T355-F359 PolarHBondContact O-N 3.35Å |
| 356 | I | 90 | Very high | 87.2 | Confident | 42 Ų | 42 | 25.3 Ų | 25.3 | 22% | 0.215 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61 | -44 | 172.3 | -69.9 | 166.9 | 0 | 0 | 0 | 111.3 | F225 A228 L352 S353 G360 | F225-I356 HydrophobicContact CB-CG2 4.08Å; F225-I356 HydrophobicContact CD1-CG2 3.64Å; F225-I356 HydrophobicContact CE1-CG2 4.35Å; F225-I356 HydrophobicContact CG-CG2 4.07Å; A228-I356 HydrophobicContact CB-CG2 3.94Å; L352-I356 HydrophobicContact CD1-CD1 4.03Å; L352-I356 HydrophobicContact CD1-CG1 4.36Å; L352-I356 HydrophobicContact CG-CD1 3.96Å; L352-I356 WeakPolarHBondContact O-CD1 3.23Å; L352-I356 VanDerWaalsContact O-CG1 3.25Å; L352-I356 WeakPolarHBondContact O-CG1 3.4Å; L352-I356 PolarHBondContact O-N 3.16Å; S353-I356 PolarHBondContact O-N 3.47Å; I356-G360 PolarHBondContact O-N 2.94Å |
| 357 | S | 91.1 | Very high | 87.3 | Confident | 2 Ų | 2 | 20.9 Ų | 20.9 | 1% | 0.014 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -64.3 | -47.7 | -179.1 | -172.4 | 0 | 0 | 0 | 0 | 112.3 | I89 S353 V354 T355 G360 S361 | I89-S357 PolarHBondContact O-OG 2.72Å; I89-S357 VanDerWaalsContact O-OG 3.07Å; S353-S357 WeakPolarHBondContact O-CB 3.4Å; S353-S357 PolarHBondContact O-N 3.31Å; V354-S357 WeakPolarHBondContact O-CB 3.48Å; V354-S357 PolarHBondContact O-N 3.24Å; T355-S357 PolarHBondContact O-N 3.39Å; S357-G360 PolarHBondContact O-N 3.36Å; S357-S361 PolarHBondContact O-N 2.93Å |
| 358 | T | 90.4 | Very high | 87.4 | Confident | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -66.6 | -40.6 | 179.5 | 47.9 | 0 | 0 | 0 | 0 | 112.1 | I173 F177 V354 T355 S361 A362 | I173-T358 VanDerWaalsContact CG2-O 3.24Å; I173-T358 WeakPolarHBondContact CG2-O 3.47Å; F177-T358 WeakPolarHBondContact CA-OG1 3.47Å; F177-T358 WeakPolarHBondContact CB-OG1 3.23Å; F177-T358 WeakPolarHBondContact CD2-OG1 3.48Å; V354-T358 HydrophobicContact CG1-CG2 4.27Å; V354-T358 WeakPolarHBondContact O-CG2 3.34Å; V354-T358 PolarHBondContact O-N 3.25Å; V354-T358 PolarHBondContact O-OG1 3.33Å; T355-T358 WeakPolarHBondContact CA-OG1 3.36Å; T355-T358 PolarHBondContact O-OG1 2.94Å; T355-T358 VanDerWaalsContact O-OG1 3.09Å; T358-S361 PolarHBondContact O-N 3.07Å; T358-A362 WeakPolarHBondContact O-CB 3.34Å; T358-A362 PolarHBondContact O-N 2.74Å |
| 359 | F | 90.3 | Very high | 87.5 | Confident | 22 Ų | 22 | 13 Ų | 13 | 10% | 0.096 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -62.1 | -43.7 | 173.1 | -169 | -76 | 0 | 0 | 0 | 111.8 | F177 M206 I207 V221 F225 T355 A362 N363 | F177-F359 HydrophobicContact CD2-CB 4.23Å; F177-F359 HydrophobicContact CE2-CB 4.2Å; F177-F359 HydrophobicContact CE2-CD2 4.28Å; M206-F359 HydrophobicContact CG-CZ 4.34Å; M206-F359 HydrophobicContact SD-CE2 4.01Å; M206-F359 HydrophobicContact SD-CZ 4.13Å; I207-F359 HydrophobicContact CD1-CD1 4.49Å; I207-F359 HydrophobicContact CD1-CD2 4.04Å; I207-F359 HydrophobicContact CD1-CE1 4.44Å; I207-F359 HydrophobicContact CD1-CE2 3.99Å; I207-F359 HydrophobicContact CD1-CG 4.31Å; I207-F359 HydrophobicContact CD1-CZ 4.21Å; I207-F359 HydrophobicContact CG1-CD1 4.27Å; I207-F359 HydrophobicContact CG1-CD2 4.07Å; I207-F359 HydrophobicContact CG1-CE1 3.74Å; I207-F359 HydrophobicContact CG1-CE2 3.52Å; I207-F359 HydrophobicContact CG1-CG 4.42Å; I207-F359 HydrophobicContact CG1-CZ 3.35Å; V221-F359 HydrophobicContact CG1-CE1 4.46Å; F225-F359 AromaticContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CD1 3.83Å; F225-F359 HydrophobicContact CD2-CE1 4.4Å; F225-F359 AromaticContact CE2-CD1 3.28Å; F225-F359 HydrophobicContact CE2-CD1 3.28Å; F225-F359 AromaticContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CE1 3.58Å; F225-F359 HydrophobicContact CE2-CG 4.27Å; F225-F359 HydrophobicContact CZ-CD1 4.19Å; F225-F359 HydrophobicContact CZ-CE1 4.41Å; T355-F359 VanDerWaalsContact O-CB 3.29Å; T355-F359 WeakPolarHBondContact O-CB 3.42Å; T355-F359 PolarHBondContact O-N 3.35Å; F359-A362 PolarHBondContact O-N 3.17Å; F359-N363 WeakPolarHBondContact O-CB 3.46Å; F359-N363 PolarHBondContact O-N 3.41Å |
| 360 | G | 90.1 | Very high | 87.4 | Confident | 0 Ų | 0 | 10.2 Ų | 10.2 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -63.6 | -40.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q222 I356 S357 G364 | Q222-G360 PolarHBondContact NE2-O 3.38Å; Q222-G360 PolarHBondContact OE1-O 2.89Å; I356-G360 PolarHBondContact O-N 2.94Å; S357-G360 PolarHBondContact O-N 3.36Å; G360-G364 PolarHBondContact O-N 3.13Å |
| 361 | S | 91.4 | Very high | 87.2 | Confident | 6 Ų | 6 | 10.5 Ų | 10.5 | 4% | 0.042 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -66.4 | -45.3 | 175.6 | 176 | 0 | 0 | 0 | 0 | 111.4 | G86 T87 S357 T358 N363 G364 T365 | G86-S361 WeakPolarHBondContact O-CA 3.47Å; T87-S361 PolarHBondContact O-OG 3.1Å; S357-S361 PolarHBondContact O-N 2.93Å; T358-S361 PolarHBondContact O-N 3.07Å; S361-N363 PolarHBondContact O-N 2.87Å; S361-G364 PolarHBondContact O-N 2.76Å; S361-T365 PolarHBondContact O-N 3.44Å; S361-T365 PolarHBondContact O-OG1 3.02Å |
| 362 | A | 90.9 | Very high | 87.1 | Confident | 1 Ų | 1 | 10 Ų | 10 | 1% | 0.008 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -56.8 | -48.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | M170 I173 I207 T358 F359 G364 T365 L366 | M170-A362 VanDerWaalsContact CE-C 3.43Å; M170-A362 HydrophobicContact CE-CB 3.75Å; M170-A362 WeakPolarHBondContact CE-O 3.12Å; M170-A362 HydrophobicContact SD-CB 3.68Å; I173-A362 HydrophobicContact CG2-CB 3.8Å; I207-A362 HydrophobicContact CD1-CB 3.56Å; T358-A362 WeakPolarHBondContact O-CB 3.34Å; T358-A362 PolarHBondContact O-N 2.74Å; F359-A362 PolarHBondContact O-N 3.17Å; A362-G364 PolarHBondContact O-N 2.71Å; A362-T365 PolarHBondContact O-N 3.25Å; A362-L366 PolarHBondContact O-N 3.21Å |
| 363 | N | 90.9 | Very high | 86.8 | Confident | 1 Ų | 1 | 6.5 Ų | 6.5 | 1% | 0.005 | 4% | 0.036 | C | C | . | . | H | α-helix | trans | -55.5 | -47.7 | 177.2 | 179.8 | 74 | 0 | 0 | 0 | 112.8 | I207 N211 G218 Q222 F359 S361 T365 L366 F367 | I207-N363 HydrophobicContact CG2-CB 4.16Å; N211-N363 PolarHBondContact ND2-OD1 2.89Å; G218-N363 PolarHBondContact O-ND2 3.14Å; Q222-N363 PolarHBondContact OE1-ND2 3.18Å; F359-N363 WeakPolarHBondContact O-CB 3.46Å; F359-N363 PolarHBondContact O-N 3.41Å; S361-N363 PolarHBondContact O-N 2.87Å; N363-T365 PolarHBondContact O-N 2.78Å; N363-L366 PolarHBondContact O-N 3.05Å; N363-F367 WeakPolarHBondContact O-CB 3.46Å; N363-F367 PolarHBondContact O-N 3.43Å |
| 364 | G | 87.5 | Confident | 86.2 | Confident | 0 Ų | 0 | 6.1 Ų | 6.1 | 0% | 0 | 3% | 0.032 | C | C | . | . | H | α-helix | trans | -65.7 | -36.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.3 | G360 S361 A362 F367 A368 | G360-G364 PolarHBondContact O-N 3.13Å; S361-G364 PolarHBondContact O-N 2.76Å; A362-G364 PolarHBondContact O-N 2.71Å; G364-F367 WeakPolarHBondContact O-CB 3.33Å; G364-F367 PolarHBondContact O-N 3.35Å; G364-A368 PolarHBondContact O-N 2.92Å; G364-A368 VanDerWaalsContact O-N 3.11Å |
| 365 | T | 88.1 | Confident | 85.7 | Confident | 2 Ų | 2 | 6.1 Ų | 6.1 | 1% | 0.012 | 3% | 0.032 | C | C | . | . | H | α-helix | trans | -66.4 | -42.1 | 175.5 | -63.4 | 0 | 0 | 0 | 0 | 111.8 | Q169 S361 A362 N363 F367 A368 A369 | Q169-T365 HydrophobicContact CB-CG2 4.47Å; S361-T365 PolarHBondContact O-N 3.44Å; S361-T365 PolarHBondContact O-OG1 3.02Å; A362-T365 PolarHBondContact O-N 3.25Å; N363-T365 PolarHBondContact O-N 2.78Å; T365-F367 VanDerWaalsContact C-N 3.31Å; T365-F367 PolarHBondContact O-N 3.01Å; T365-A368 PolarHBondContact O-N 3.38Å; T365-A369 WeakPolarHBondContact O-CB 3.33Å; T365-A369 PolarHBondContact O-N 3.13Å |
| 366 | L | 87 | Confident | 85.1 | Confident | 9 Ų | 9 | 5.3 Ų | 5.3 | 5% | 0.047 | 3% | 0.027 | C | C | . | . | H | α-helix | trans | -64.2 | -40.2 | 175.4 | -170 | 59.9 | 0 | 0 | 0 | 111.5 | M170 I207 L208 N211 A362 N363 A368 A369 G370 L400 | M170-L366 HydrophobicContact CE-CB 3.54Å; M170-L366 HydrophobicContact CE-CD1 4.49Å; M170-L366 HydrophobicContact CE-CG 4.37Å; I207-L366 HydrophobicContact CG2-CB 4.26Å; I207-L366 HydrophobicContact CG2-CD2 3.72Å; L208-L366 HydrophobicContact CB-CD2 4.34Å; L208-L366 HydrophobicContact CD1-CD2 4.39Å; N211-L366 HydrophobicContact CB-CD2 4.23Å; A362-L366 PolarHBondContact O-N 3.21Å; N363-L366 PolarHBondContact O-N 3.05Å; L366-A368 VanDerWaalsContact C-N 3.32Å; L366-A368 PolarHBondContact O-N 3.43Å; L366-A369 PolarHBondContact O-N 3.31Å; L366-G370 PolarHBondContact O-N 3.48Å; L366-G370 VanDerWaalsContact O-N 3.1Å; L366-L400 HydrophobicContact CD1-CD2 3.76Å; L366-L400 HydrophobicContact CD2-CD2 4.31Å; L366-L400 HydrophobicContact CG-CD2 3.68Å |
| 367 | F | 83.5 | Confident | 84.5 | Confident | 4 Ų | 4 | 3.3 Ų | 3.3 | 2% | 0.018 | 2% | 0.017 | C | C | . | . | H | α-helix | trans | -57.5 | -45.4 | 177.2 | -169.7 | -97.7 | 0 | 0 | 0 | 111.3 | V215 M219 V286 N363 G364 T365 R371 | V215-F367 HydrophobicContact CG1-CE2 3.71Å; V215-F367 HydrophobicContact CG1-CZ 3.93Å; M219-F367 HydrophobicContact CG-CE2 3.92Å; M219-F367 HydrophobicContact CG-CZ 3.73Å; M219-F367 HydrophobicContact SD-CD1 4.28Å; M219-F367 HydrophobicContact SD-CD2 4.48Å; M219-F367 HydrophobicContact SD-CE1 3.69Å; M219-F367 HydrophobicContact SD-CE2 3.91Å; M219-F367 HydrophobicContact SD-CZ 3.46Å; M219-F367 WeakPolarHBondContact SD-CZ 3.38Å; V286-F367 HydrophobicContact CB-CE1 4.33Å; V286-F367 HydrophobicContact CG1-CD1 3.62Å; V286-F367 HydrophobicContact CG1-CE1 3.44Å; V286-F367 VanDerWaalsContact CG1-CE1 3.44Å; N363-F367 WeakPolarHBondContact O-CB 3.46Å; N363-F367 PolarHBondContact O-N 3.43Å; G364-F367 WeakPolarHBondContact O-CB 3.33Å; G364-F367 PolarHBondContact O-N 3.35Å; T365-F367 VanDerWaalsContact C-N 3.31Å; T365-F367 PolarHBondContact O-N 3.01Å; F367-R371 VanDerWaalsContact CD2-NH1 3.3Å; F367-R371 VanDerWaalsContact CE1-NH1 3.28Å; F367-R371 VanDerWaalsContact CE2-NH2 3.3Å; F367-R371 PolarHBondContact O-NH1 2.89Å |
| 368 | A | 83.1 | Confident | 83.6 | Confident | 1 Ų | 1 | 5 Ų | 5 | 1% | 0.008 | 2% | 0.023 | C | C | . | . | H | α-helix | trans | -67.2 | -41.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | N282 Y285 G364 T365 L366 G370 R371 L372 | N282-A368 HydrophobicContact CB-CB 4.16Å; N282-A368 WeakPolarHBondContact OD1-CB 3.41Å; Y285-A368 HydrophobicContact CD2-CB 4.24Å; Y285-A368 HydrophobicContact CG-CB 4.17Å; G364-A368 PolarHBondContact O-N 2.92Å; G364-A368 VanDerWaalsContact O-N 3.11Å; T365-A368 PolarHBondContact O-N 3.38Å; L366-A368 VanDerWaalsContact C-N 3.32Å; L366-A368 PolarHBondContact O-N 3.43Å; A368-G370 PolarHBondContact O-N 3.03Å; A368-R371 PolarHBondContact O-N 2.88Å; A368-R371 VanDerWaalsContact O-N 3.14Å; A368-L372 PolarHBondContact O-N 3.41Å |
| 369 | A | 82.8 | Confident | 82.8 | Confident | 3 Ų | 3 | 8.5 Ų | 8.5 | 3% | 0.025 | 4% | 0.039 | C | C | . | . | H | α-helix | trans | -60.7 | -39.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | K166 T365 L366 R371 L372 C373 | K166-A369 HydrophobicContact CB-CB 4.23Å; K166-A369 HydrophobicContact CD-CB 4.1Å; K166-A369 HydrophobicContact CG-CB 4.1Å; T365-A369 WeakPolarHBondContact O-CB 3.33Å; T365-A369 PolarHBondContact O-N 3.13Å; L366-A369 PolarHBondContact O-N 3.31Å; A369-R371 PolarHBondContact O-N 3.14Å; A369-L372 PolarHBondContact O-N 3.42Å; A369-C373 PolarHBondContact O-N 3.36Å |
| 370 | G | 79.9 | Confident | 82.1 | Confident | 0 Ų | 0 | 9.9 Ų | 9.9 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -59.6 | -31.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | L366 A368 F374 | L366-G370 PolarHBondContact O-N 3.48Å; L366-G370 VanDerWaalsContact O-N 3.1Å; A368-G370 PolarHBondContact O-N 3.03Å; G370-F374 WeakPolarHBondContact O-CB 3.22Å; G370-F374 PolarHBondContact O-N 3.08Å; G370-F374 VanDerWaalsContact O-N 3.1Å |
| 371 | R | 80.4 | Confident | 81.3 | Confident | 10 Ų | 10 | 11.5 Ų | 11.5 | 4% | 0.038 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -80.9 | -32.5 | -178.2 | -76.5 | 159.2 | 179.7 | 84.9 | 2.4 | 113.6 | E289 F367 A368 A369 A375 | E289-R371 IonicContact OE1-CZ 2.76Å; E289-R371 IonicContact OE1-NE 3.75Å; E289-R371 PolarHBondContact OE1-NE 3.02Å; E289-R371 IonicContact OE1-NH2 2.71Å; E289-R371 PolarHBondContact OE1-NH2 3.08Å; E289-R371 IonicContact OE2-CZ 2.66Å; E289-R371 IonicContact OE2-NE 3.97Å; E289-R371 IonicContact OE2-NH2 3.22Å; E289-R371 PolarHBondContact OE2-NH2 3.48Å; F367-R371 VanDerWaalsContact CD2-NH1 3.3Å; F367-R371 VanDerWaalsContact CE1-NH1 3.28Å; F367-R371 VanDerWaalsContact CE2-NH2 3.3Å; F367-R371 PolarHBondContact O-NH1 2.89Å; A368-R371 PolarHBondContact O-N 2.88Å; A368-R371 VanDerWaalsContact O-N 3.14Å; A369-R371 PolarHBondContact O-N 3.14Å; R371-A375 WeakPolarHBondContact O-CB 3.36Å; R371-A375 PolarHBondContact O-N 2.71Å |
| 372 | L | 82.4 | Confident | 80.4 | Confident | 0 Ų | 0 | 12.4 Ų | 12.4 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -60.6 | -50 | 169.2 | 175.9 | 60.7 | 0 | 0 | 0 | 110.6 | W142 F157 Y285 A368 A369 F374 A375 A376 | W142-L372 HydrophobicContact CB-CD1 3.75Å; F157-L372 HydrophobicContact CE1-CD1 3.99Å; Y285-L372 HydrophobicContact CD1-CB 4.04Å; Y285-L372 HydrophobicContact CE1-CB 3.92Å; Y285-L372 HydrophobicContact CE1-CD1 4.19Å; Y285-L372 HydrophobicContact CE1-CD2 4.25Å; Y285-L372 HydrophobicContact CE1-CG 4.34Å; A368-L372 PolarHBondContact O-N 3.41Å; A369-L372 PolarHBondContact O-N 3.42Å; L372-F374 VanDerWaalsContact C-N 3.33Å; L372-F374 PolarHBondContact O-N 3.06Å; L372-A375 PolarHBondContact O-N 3.2Å; L372-A376 WeakPolarHBondContact O-CB 3.18Å; L372-A376 PolarHBondContact O-N 3.1Å |
| 373 | C | 79.1 | Confident | 79.6 | Confident | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -59.9 | -44.9 | 178.1 | -73.1 | 0 | 0 | 0 | 0 | 111.7 | A369 S377 H403 | A369-C373 PolarHBondContact O-N 3.36Å; C373-S377 VanDerWaalsContact O-CB 3.3Å; C373-S377 WeakPolarHBondContact O-CB 3.43Å; C373-S377 PolarHBondContact O-N 3.43Å; C373-S377 PolarHBondContact O-OG 2.62Å; C373-H403 PolarHBondContact SG-NE2 3.18Å |
| 374 | F | 75.1 | Confident | 78.5 | Confident | 9 Ų | 9 | 22.3 Ų | 22.3 | 4% | 0.039 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -61 | -45.6 | 178.8 | 174.2 | -106.8 | 0 | 0 | 0 | 112.5 | V5 L71 G370 L372 S377 R378 S387 V389 P396 | V5-F374 HydrophobicContact CB-CE2 4.18Å; V5-F374 HydrophobicContact CB-CZ 4.05Å; V5-F374 HydrophobicContact CG1-CZ 4.2Å; V5-F374 HydrophobicContact CG2-CE2 4.01Å; V5-F374 HydrophobicContact CG2-CZ 3.94Å; L71-F374 HydrophobicContact CD1-CD1 4.37Å; L71-F374 HydrophobicContact CD1-CE1 4.08Å; G370-F374 WeakPolarHBondContact O-CB 3.22Å; G370-F374 PolarHBondContact O-N 3.08Å; G370-F374 VanDerWaalsContact O-N 3.1Å; L372-F374 VanDerWaalsContact C-N 3.33Å; L372-F374 PolarHBondContact O-N 3.06Å; F374-S377 PolarHBondContact O-OG 3.04Å; F374-S377 VanDerWaalsContact O-OG 3.1Å; F374-R378 PolarHBondContact O-N 3.36Å; F374-S387 WeakPolarHBondContact CD2-O 3.37Å; F374-S387 VanDerWaalsContact CE2-O 3.27Å; F374-S387 WeakPolarHBondContact CE2-O 3.13Å; F374-V389 HydrophobicContact CD2-CG2 3.72Å; F374-V389 HydrophobicContact CE2-CG2 3.34Å; F374-V389 HydrophobicContact CZ-CG2 4.09Å; F374-P396 HydrophobicContact CB-CB 4.33Å |
| 375 | A | 77.3 | Confident | 77.5 | Confident | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.4 | -48 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S138 W142 R371 L372 S377 R378 | S138-A375 WeakPolarHBondContact O-CB 3.07Å; W142-A375 HydrophobicContact CE3-CB 4.11Å; W142-A375 HydrophobicContact CZ3-CB 4.48Å; R371-A375 WeakPolarHBondContact O-CB 3.36Å; R371-A375 PolarHBondContact O-N 2.71Å; L372-A375 PolarHBondContact O-N 3.2Å; A375-S377 VanDerWaalsContact C-N 3.33Å; A375-S377 PolarHBondContact O-N 3.48Å; A375-R378 PolarHBondContact O-N 3.43Å |
| 376 | A | 76.3 | Confident | 76.5 | Confident | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -70.1 | -28.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | W142 S158 L372 H381 L382 | W142-A376 HydrophobicContact CD2-CB 4.25Å; W142-A376 HydrophobicContact CG-CB 4.2Å; S158-A376 VanDerWaalsContact OG-CB 3.26Å; S158-A376 WeakPolarHBondContact OG-CB 3.41Å; L372-A376 WeakPolarHBondContact O-CB 3.18Å; L372-A376 PolarHBondContact O-N 3.1Å; A376-H381 WeakPolarHBondContact O-CB 3.27Å; A376-H381 PolarHBondContact O-N 2.91Å; A376-L382 HydrophobicContact CB-CD1 3.72Å; A376-L382 HydrophobicContact CB-CG 4.05Å; A376-L382 PolarHBondContact O-N 3.49Å |
| 377 | S | 76.1 | Confident | 75.4 | Confident | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -78 | -28.1 | 175.7 | 53.2 | 0 | 0 | 0 | 0 | 113.2 | C373 F374 A375 E379 G380 L386 S387 | C373-S377 VanDerWaalsContact O-CB 3.3Å; C373-S377 WeakPolarHBondContact O-CB 3.43Å; C373-S377 PolarHBondContact O-N 3.43Å; C373-S377 PolarHBondContact O-OG 2.62Å; F374-S377 PolarHBondContact O-OG 3.04Å; F374-S377 VanDerWaalsContact O-OG 3.1Å; A375-S377 VanDerWaalsContact C-N 3.33Å; A375-S377 PolarHBondContact O-N 3.48Å; S377-E379 PolarHBondContact O-N 3.1Å; S377-G380 PolarHBondContact O-N 2.84Å; S377-L386 VanDerWaalsContact OG-C 3.3Å; S377-S387 WeakPolarHBondContact OG-CA 3.14Å; S377-S387 WeakPolarHBondContact OG-CB 3.3Å; S377-S387 PolarHBondContact OG-N 2.6Å |
| 378 | R | 73.3 | Confident | 74.5 | Confident | 37 Ų | 37 | 31.5 Ų | 31.5 | 14% | 0.14 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -59.2 | -27.7 | 173.5 | -175.4 | 173 | 71.6 | -164.5 | 0.3 | 112.9 | P7 F374 A375 | P7-R378 HydrophobicContact CB-CG 4.24Å; F374-R378 PolarHBondContact O-N 3.36Å; A375-R378 PolarHBondContact O-N 3.43Å |
| 379 | E | 74.3 | Confident | 73.6 | Confident | 73 Ų | 73 | 32 Ų | 32 | 34% | 0.341 | 17% | 0.169 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -105.2 | 13.1 | -173 | -64.9 | -85.9 | -179.1 | 0 | 0 | 111.5 | W142 S377 H381 | W142-E379 HydrophobicContact CH2-CB 3.82Å; W142-E379 HydrophobicContact CH2-CG 3.5Å; W142-E379 HydrophobicContact CZ2-CB 3.74Å; W142-E379 HydrophobicContact CZ2-CG 3.98Å; W142-E379 HydrophobicContact CZ3-CG 4.42Å; S377-E379 PolarHBondContact O-N 3.1Å; E379-H381 PolarHBondContact O-CD2 2.77Å; E379-H381 VanDerWaalsContact O-CD2 3.3Å; E379-H381 PolarHBondContact O-N 3.18Å |
| 380 | G | 73.7 | Confident | 72.7 | Confident | 52 Ų | 52 | 32.9 Ų | 32.9 | 54% | 0.536 | 17% | 0.173 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 72.9 | 7.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | S377 | S377-G380 PolarHBondContact O-N 2.84Š|
| 381 | H | 74.3 | Confident | 71.6 | Confident | 33 Ų | 33 | 36.2 Ų | 36.2 | 15% | 0.153 | 19% | 0.193 | C | C | . | . | S | Bend | trans | -82.5 | -16.2 | 178.9 | -70.3 | -170.4 | 0 | 0 | 0 | 112.8 | W142 F155 A376 E379 | W142-H381 AromaticContact NE1-ND1 3.61Å; F155-H381 HydrophobicContact CD2-CB 4.09Å; F155-H381 WeakPolarHBondContact CD2-O 3.33Å; F155-H381 VanDerWaalsContact CE2-O 3.22Å; F155-H381 WeakPolarHBondContact CE2-O 3.3Å; A376-H381 WeakPolarHBondContact O-CB 3.27Å; A376-H381 PolarHBondContact O-N 2.91Å; E379-H381 PolarHBondContact O-CD2 2.77Å; E379-H381 VanDerWaalsContact O-CD2 3.3Å; E379-H381 PolarHBondContact O-N 3.18Å |
| 382 | L | 73.3 | Confident | 70.7 | Confident | 26 Ų | 26 | 46.1 Ų | 46.1 | 14% | 0.136 | 23% | 0.23 | C | C | . | . | S | Bend | trans | -127 | 169.3 | 171.6 | -74.6 | 178.4 | 0 | 0 | 0 | 109.5 | S158 A376 D384 L386 | S158-L382 WeakPolarHBondContact OG-CD1 3.5Å; A376-L382 HydrophobicContact CB-CD1 3.72Å; A376-L382 HydrophobicContact CB-CG 4.05Å; A376-L382 PolarHBondContact O-N 3.49Å; L382-D384 PolarHBondContact O-N 3.11Å; L382-L386 HydrophobicContact CB-CD1 4.37Å |
| 383 | L | 73.2 | Confident | 69.7 | Low | 117 Ų | 117 | 51.1 Ų | 51.1 | 61% | 0.613 | 25% | 0.249 | S | C | * | . | trans | -53.7 | 128.2 | 176.4 | -64.7 | 170.3 | 0 | 0 | 0 | 110.9 | I385 L386 | L383-I385 PolarHBondContact O-N 2.78Å; L383-L386 HydrophobicContact CB-CD1 4.3Å; L383-L386 HydrophobicContact CB-CG 4.23Å; L383-L386 WeakPolarHBondContact O-CB 3.1Å; L383-L386 PolarHBondContact O-N 2.98Å | ||
| 384 | D | 67.1 | Low | 69 | Low | 92 Ų | 92 | 53.9 Ų | 53.9 | 49% | 0.492 | 26% | 0.264 | S | S | . | . | G | 310 helix | trans | -54.4 | -28.1 | 179.8 | -64.6 | -15.6 | 0 | 0 | 0 | 112.9 | L382 L386 S387 Y388 | L382-D384 PolarHBondContact O-N 3.11Å; D384-L386 PolarHBondContact O-N 3.45Å; D384-L386 VanDerWaalsContact O-N 3.14Å; D384-S387 PolarHBondContact O-N 3.18Å; D384-S387 VanDerWaalsContact O-N 3.08Å; D384-S387 PolarHBondContact O-OG 3.07Å; D384-Y388 WeakPolarHBondContact O-CD2 3.4Å; D384-Y388 WeakPolarHBondContact O-CE2 3.09Å |
| 385 | I | 66.7 | Low | 68.5 | Low | 115 Ų | 115 | 53.6 Ų | 53.6 | 59% | 0.59 | 26% | 0.262 | S | S | * | . | G | 310 helix | trans | -58.8 | -27 | 176.8 | -65.1 | 162.8 | 0 | 0 | 0 | 111.8 | L383 S387 Y388 P398 | L383-I385 PolarHBondContact O-N 2.78Å; I385-S387 VanDerWaalsContact C-N 3.35Å; I385-Y388 WeakPolarHBondContact O-CD2 3.1Å; I385-P398 HydrophobicContact CG2-CB 4.38Å; I385-P398 WeakPolarHBondContact O-CB 3.4Å |
| 386 | L | 68.2 | Low | 68.1 | Low | 10 Ų | 10 | 54.2 Ų | 54.2 | 5% | 0.052 | 27% | 0.266 | C | S | . | . | G | 310 helix | trans | -80.5 | -13.5 | -179.1 | -54.5 | 178.1 | 0 | 0 | 0 | 113.3 | S377 L382 L383 D384 F402 | S377-L386 VanDerWaalsContact OG-C 3.3Å; L382-L386 HydrophobicContact CB-CD1 4.37Å; L383-L386 HydrophobicContact CB-CD1 4.3Å; L383-L386 HydrophobicContact CB-CG 4.23Å; L383-L386 WeakPolarHBondContact O-CB 3.1Å; L383-L386 PolarHBondContact O-N 2.98Å; D384-L386 PolarHBondContact O-N 3.45Å; D384-L386 VanDerWaalsContact O-N 3.14Å; L386-F402 HydrophobicContact CD1-CG 4.39Å; L386-F402 HydrophobicContact CD2-CB 3.72Å; L386-F402 HydrophobicContact CD2-CD2 4.28Å; L386-F402 HydrophobicContact CD2-CG 4.1Å |
| 387 | S | 62.7 | Low | 67.7 | Low | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 27% | 0.269 | C | S | . | . | G | 310 helix | trans | -85.5 | -10.1 | 178.1 | 76.6 | 0 | 0 | 0 | 0 | 113 | H4 F374 S377 D384 I385 V389 | H4-S387 PolarHBondContact CD2-OG 2.97Å; H4-S387 PolarHBondContact NE2-OG 2.77Å; F374-S387 WeakPolarHBondContact CD2-O 3.37Å; F374-S387 VanDerWaalsContact CE2-O 3.27Å; F374-S387 WeakPolarHBondContact CE2-O 3.13Å; S377-S387 WeakPolarHBondContact OG-CA 3.14Å; S377-S387 WeakPolarHBondContact OG-CB 3.3Å; S377-S387 PolarHBondContact OG-N 2.6Å; D384-S387 PolarHBondContact O-N 3.18Å; D384-S387 VanDerWaalsContact O-N 3.08Å; D384-S387 PolarHBondContact O-OG 3.07Å; I385-S387 VanDerWaalsContact C-N 3.35Å; S387-V389 PolarHBondContact O-N 2.93Å |
| 388 | Y | 65.9 | Low | 67.4 | Low | 83 Ų | 83 | 55.6 Ų | 55.6 | 33% | 0.325 | 28% | 0.276 | S | S | . | . | trans | -70.5 | 125.6 | -174.6 | -80.6 | -90.5 | 0 | 0 | 0 | 112.1 | Y2 H4 D384 I385 P398 | Y2-Y388 VanDerWaalsContact CB-CD1 3.47Å; H4-Y388 HydrophobicContact CB-CE1 4.38Å; D384-Y388 WeakPolarHBondContact O-CD2 3.4Å; D384-Y388 WeakPolarHBondContact O-CE2 3.09Å; I385-Y388 WeakPolarHBondContact O-CD2 3.1Å; Y388-P398 WeakPolarHBondContact O-CD 3.5Å | ||
| 389 | V | 64 | Low | 67 | Low | 11 Ų | 11 | 53.9 Ų | 53.9 | 7% | 0.067 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 138.5 | 175.1 | 177.8 | 0 | 0 | 0 | 0 | 109.6 | Y2 Q3 F374 S387 V391 L394 | Y2-V389 WeakPolarHBondContact CA-O 3.29Å; Q3-V389 PolarHBondContact N-O 3.16Å; Q3-V389 VanDerWaalsContact N-O 3.17Å; Q3-V389 PolarHBondContact O-N 3.15Å; F374-V389 HydrophobicContact CD2-CG2 3.72Å; F374-V389 HydrophobicContact CE2-CG2 3.34Å; F374-V389 HydrophobicContact CZ-CG2 4.09Å; S387-V389 PolarHBondContact O-N 2.93Å; V389-V391 PolarHBondContact O-N 3.2Å; V389-L394 VanDerWaalsContact CG1-C 3.48Å; V389-L394 VanDerWaalsContact CG1-CA 3.49Å; V389-L394 HydrophobicContact CG1-CB 4.42Å; V389-L394 HydrophobicContact CG1-CD2 4.4Å |
| 390 | H | 63.6 | Low | 66.8 | Low | 22 Ų | 22 | 50.7 Ų | 50.7 | 10% | 0.102 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 121.4 | 178.7 | -172.2 | -77.9 | 0 | 0 | 0 | 111.4 | Y2 R392 R393 L394 T395 | Y2-H390 HydrophobicContact CD1-CB 4.22Å; Y2-H390 HydrophobicContact CE1-CB 3.92Å; Y2-H390 AromaticContact CE1-CD2 3.98Å; Y2-H390 AromaticContact CZ-CD2 3.94Å; H390-R392 VanDerWaalsContact C-N 3.32Å; H390-R392 PolarHBondContact ND1-N 3.37Å; H390-R392 PolarHBondContact O-N 3.47Å; H390-R392 VanDerWaalsContact O-N 3.14Å; H390-R393 HydrophobicContact CB-CB 4.29Å; H390-R393 PolarHBondContact ND1-N 3.23Å; H390-R393 PolarHBondContact O-N 2.94Å; H390-R393 VanDerWaalsContact O-N 3.1Å; H390-L394 WeakPolarHBondContact O-CA 3.13Å; H390-L394 PolarHBondContact O-N 3.19Å; H390-T395 PolarHBondContact N-O 3.31Å |
| 391 | V | 57 | Low | 66.7 | Low | 71 Ų | 71 | 52.4 Ų | 52.4 | 43% | 0.43 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -36.5 | -168.9 | 177.3 | 0 | 0 | 0 | 0 | 113.9 | M1 Q3 V389 | M1-V391 WeakPolarHBondContact O-CG2 3.15Å; M1-V391 PolarHBondContact O-N 2.92Å; Q3-V391 HydrophobicContact CB-CG2 4.11Å; Q3-V391 HydrophobicContact CG-CG2 4.48Å; V389-V391 PolarHBondContact O-N 3.2Å |
| 392 | R | 61.3 | Low | 66.6 | Low | 218 Ų | 218 | 52.9 Ų | 52.9 | 82% | 0.823 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | -18.5 | -179.9 | -65.4 | -172.5 | -180 | -177.6 | 0.4 | 115.1 | H390 | H390-R392 VanDerWaalsContact C-N 3.32Å; H390-R392 PolarHBondContact ND1-N 3.37Å; H390-R392 PolarHBondContact O-N 3.47Å; H390-R392 VanDerWaalsContact O-N 3.14Å |
| 393 | R | 60.6 | Low | 66.3 | Low | 105 Ų | 105 | 52.1 Ų | 52.1 | 40% | 0.396 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -119.3 | -14.4 | -167.2 | -69.9 | 177.4 | 174.3 | -160.4 | -0.2 | 113 | Y213 H390 T395 | Y213-R393 VanDerWaalsContact O-CD 3.23Å; Y213-R393 WeakPolarHBondContact O-CD 3.09Å; H390-R393 HydrophobicContact CB-CB 4.29Å; H390-R393 PolarHBondContact ND1-N 3.23Å; H390-R393 PolarHBondContact O-N 2.94Å; H390-R393 VanDerWaalsContact O-N 3.1Å; R393-T395 HydrophobicContact CB-CG2 4.42Å; R393-T395 PolarHBondContact O-N 3.38Å |
| 394 | L | 64.3 | Low | 65.9 | Low | 58 Ų | 58 | 48.9 Ų | 48.9 | 30% | 0.304 | 23% | 0.231 | S | C | . | . | trans | 54.9 | 32.8 | 179.8 | -58.2 | 169.9 | 0 | 0 | 0 | 112.6 | V69 V389 H390 | V69-L394 HydrophobicContact CG1-CD2 3.7Å; V389-L394 VanDerWaalsContact CG1-C 3.48Å; V389-L394 VanDerWaalsContact CG1-CA 3.49Å; V389-L394 HydrophobicContact CG1-CB 4.42Å; V389-L394 HydrophobicContact CG1-CD2 4.4Å; H390-L394 WeakPolarHBondContact O-CA 3.13Å; H390-L394 PolarHBondContact O-N 3.19Å | ||
| 395 | T | 66.4 | Low | 65.6 | Low | 2 Ų | 2 | 51 Ų | 51 | 1% | 0.012 | 24% | 0.238 | C | C | . | . | trans | -105.6 | 138.7 | 179.1 | 50.1 | 0 | 0 | 0 | 0 | 111.3 | N211 C212 V215 H390 R393 A397 | N211-T395 VanDerWaalsContact O-CG2 3.28Å; N211-T395 WeakPolarHBondContact O-CG2 3.43Å; C212-T395 PolarHBondContact O-OG1 3.41Å; V215-T395 HydrophobicContact CG2-CG2 3.59Å; H390-T395 PolarHBondContact N-O 3.31Å; R393-T395 HydrophobicContact CB-CG2 4.42Å; R393-T395 PolarHBondContact O-N 3.38Å; T395-A397 PolarHBondContact O-N 2.83Å | ||
| 396 | P | 69 | Low | 65.3 | Low | 13 Ų | 13 | 51.2 Ų | 51.2 | 8% | 0.084 | 23% | 0.231 | C | C | . | . | trans | -80.9 | 62 | 174.6 | 34.1 | -35.4 | 0 | 0 | 0 | 111.2 | F374 G399 L400 | F374-P396 HydrophobicContact CB-CB 4.33Å; P396-G399 PolarHBondContact O-N 3.12Å; P396-L400 WeakPolarHBondContact O-CG 3.41Å; P396-L400 PolarHBondContact O-N 2.85Å | ||
| 397 | A | 67.6 | Low | 64.8 | Low | 7 Ų | 7 | 51.2 Ų | 51.2 | 6% | 0.058 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -57.8 | -41.3 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | Y2 C212 T395 G399 L400 I401 | Y2-A397 HydrophobicContact CE1-CB 4.37Å; C212-A397 HydrophobicContact CB-CB 4.45Å; T395-A397 PolarHBondContact O-N 2.83Å; A397-G399 PolarHBondContact O-N 3.28Å; A397-L400 PolarHBondContact O-N 3.21Å; A397-I401 WeakPolarHBondContact O-CD1 3.41Å; A397-I401 VanDerWaalsContact O-CG1 3.25Å; A397-I401 WeakPolarHBondContact O-CG1 3.46Å; A397-I401 PolarHBondContact O-N 2.88Å |
| 398 | P | 69.3 | Low | 64.1 | Low | 23 Ų | 23 | 53.4 Ų | 53.4 | 15% | 0.149 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.4 | -39.4 | 179.3 | -24.6 | 37.2 | 0 | 0 | 0 | 114 | Y2 I385 Y388 L400 I401 F402 | Y2-P398 HydrophobicContact CE1-CG 4.3Å; I385-P398 HydrophobicContact CG2-CB 4.38Å; I385-P398 WeakPolarHBondContact O-CB 3.4Å; Y388-P398 WeakPolarHBondContact O-CD 3.5Å; P398-L400 VanDerWaalsContact C-N 3.33Å; P398-L400 PolarHBondContact O-N 2.95Å; P398-I401 PolarHBondContact O-N 2.81Å; P398-F402 PolarHBondContact O-N 3.42Å |
| 399 | G | 63.8 | Low | 63.3 | Low | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.8 | -40.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | P396 A397 F402 H403 | P396-G399 PolarHBondContact O-N 3.12Å; A397-G399 PolarHBondContact O-N 3.28Å; G399-F402 PolarHBondContact O-N 3.29Å; G399-H403 PolarHBondContact O-CD2 3.19Å; G399-H403 PolarHBondContact O-N 3.34Å |
| 400 | L | 70 | Confident | 62.6 | Low | 6 Ų | 6 | 55.6 Ų | 55.6 | 3% | 0.031 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -67.6 | -40.1 | 176.9 | -63.5 | 172.1 | 0 | 0 | 0 | 112.4 | L208 N211 L366 P396 A397 P398 F402 H403 L404 | L208-L400 HydrophobicContact CD1-CB 3.39Å; N211-L400 HydrophobicContact CB-CD1 4.12Å; L366-L400 HydrophobicContact CD1-CD2 3.76Å; L366-L400 HydrophobicContact CD2-CD2 4.31Å; L366-L400 HydrophobicContact CG-CD2 3.68Å; P396-L400 WeakPolarHBondContact O-CG 3.41Å; P396-L400 PolarHBondContact O-N 2.85Å; A397-L400 PolarHBondContact O-N 3.21Å; P398-L400 VanDerWaalsContact C-N 3.33Å; P398-L400 PolarHBondContact O-N 2.95Å; L400-F402 VanDerWaalsContact C-N 3.35Å; L400-H403 PolarHBondContact O-N 3.25Å; L400-L404 PolarHBondContact O-N 3.41Å |
| 401 | I | 72.6 | Confident | 61.9 | Low | 88 Ų | 88 | 63.9 Ų | 63.9 | 45% | 0.451 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -68 | -34.9 | 177.5 | -66.8 | 162.9 | 0 | 0 | 0 | 111.3 | L208 A397 P398 H403 L404 H405 | L208-I401 HydrophobicContact CD1-CG1 4.49Å; L208-I401 HydrophobicContact CD2-CG1 4.26Å; A397-I401 WeakPolarHBondContact O-CD1 3.41Å; A397-I401 VanDerWaalsContact O-CG1 3.25Å; A397-I401 WeakPolarHBondContact O-CG1 3.46Å; A397-I401 PolarHBondContact O-N 2.88Å; P398-I401 PolarHBondContact O-N 2.81Å; I401-H403 VanDerWaalsContact C-N 3.31Å; I401-H403 PolarHBondContact O-N 3.45Å; I401-L404 WeakPolarHBondContact O-CB 3.3Å; I401-L404 PolarHBondContact O-N 3.36Å; I401-L404 VanDerWaalsContact O-N 3.11Å; I401-H405 PolarHBondContact O-N 3.01Å |
| 402 | F | 71.7 | Confident | 61.3 | Low | 44 Ų | 44 | 69.2 Ų | 69.2 | 19% | 0.193 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 176.7 | -179.4 | -93.5 | 0 | 0 | 0 | 112.3 | T162 L163 L386 P398 G399 L400 L404 H405 R406 | T162-F402 HydrophobicContact CG2-CD1 3.98Å; T162-F402 HydrophobicContact CG2-CE1 3.75Å; L163-F402 HydrophobicContact CD2-CE1 3.91Å; L163-F402 HydrophobicContact CD2-CZ 3.75Å; L386-F402 HydrophobicContact CD1-CG 4.39Å; L386-F402 HydrophobicContact CD2-CB 3.72Å; L386-F402 HydrophobicContact CD2-CD2 4.28Å; L386-F402 HydrophobicContact CD2-CG 4.1Å; P398-F402 PolarHBondContact O-N 3.42Å; G399-F402 PolarHBondContact O-N 3.29Å; L400-F402 VanDerWaalsContact C-N 3.35Å; F402-L404 VanDerWaalsContact C-N 3.3Å; F402-L404 PolarHBondContact O-N 2.86Å; F402-H405 PolarHBondContact O-N 3.41Å; F402-R406 HydrophobicContact CE1-CG 4.23Å; F402-R406 HydrophobicContact CZ-CG 4.21Å; F402-R406 PolarHBondContact O-N 3.43Å |
| 403 | H | 67.8 | Low | 60.6 | Low | 10 Ų | 10 | 60 Ų | 60 | 5% | 0.046 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.6 | -38.8 | 174.6 | -78.7 | -62.6 | 0 | 0 | 0 | 112.2 | T162 C373 G399 L400 I401 L407 | T162-H403 PolarHBondContact O-CE1 3.42Å; C373-H403 PolarHBondContact SG-NE2 3.18Å; G399-H403 PolarHBondContact O-CD2 3.19Å; G399-H403 PolarHBondContact O-N 3.34Å; L400-H403 PolarHBondContact O-N 3.25Å; I401-H403 VanDerWaalsContact C-N 3.31Å; I401-H403 PolarHBondContact O-N 3.45Å; H403-L407 WeakPolarHBondContact O-CD1 3.17Å |
| 404 | L | 64.5 | Low | 59.9 | Low | 48 Ų | 48 | 60.4 Ų | 60.4 | 25% | 0.251 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 175.6 | -178.6 | 74.2 | 0 | 0 | 0 | 112.1 | I204 V205 L208 L400 I401 F402 R406 L407 | I204-L404 HydrophobicContact CB-CD1 4.33Å; I204-L404 HydrophobicContact CG2-CD1 3.45Å; I204-L404 VanDerWaalsContact CG2-CD1 3.45Å; V205-L404 HydrophobicContact CG2-CD1 4.18Å; V205-L404 HydrophobicContact CG2-CD2 4.32Å; L208-L404 HydrophobicContact CD2-CB 3.99Å; L208-L404 HydrophobicContact CD2-CD2 3.55Å; L208-L404 HydrophobicContact CD2-CG 4.26Å; L400-L404 PolarHBondContact O-N 3.41Å; I401-L404 WeakPolarHBondContact O-CB 3.3Å; I401-L404 PolarHBondContact O-N 3.36Å; I401-L404 VanDerWaalsContact O-N 3.11Å; F402-L404 VanDerWaalsContact C-N 3.3Å; F402-L404 PolarHBondContact O-N 2.86Å; L404-R406 PolarHBondContact O-N 3.02Å; L404-L407 WeakPolarHBondContact O-CB 3.35Å; L404-L407 PolarHBondContact O-N 3.41Å |
| 405 | H | 60.6 | Low | 59 | Low | 136 Ų | 136 | 62 Ų | 62 | 63% | 0.63 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -64 | -30.9 | -175.8 | -168.7 | 29.5 | 0 | 0 | 0 | 112.3 | I401 F402 L407 D408 | I401-H405 PolarHBondContact O-N 3.01Å; F402-H405 PolarHBondContact O-N 3.41Å; H405-L407 VanDerWaalsContact C-N 3.33Å; H405-D408 VanDerWaalsContact O-CB 3.22Å; H405-D408 WeakPolarHBondContact O-CB 3.42Å; H405-D408 PolarHBondContact O-N 3.01Å |
| 406 | R | 61.3 | Low | 57.5 | Low | 120 Ų | 120 | 63.7 Ų | 63.7 | 45% | 0.453 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -79.4 | -12 | 176.9 | -69.6 | -65.8 | -175.4 | 162 | -1.1 | 114.2 | F402 L404 D408 I409 | F402-R406 HydrophobicContact CE1-CG 4.23Å; F402-R406 HydrophobicContact CZ-CG 4.21Å; F402-R406 PolarHBondContact O-N 3.43Å; L404-R406 PolarHBondContact O-N 3.02Å; R406-D408 PolarHBondContact O-N 2.89Å; R406-I409 WeakPolarHBondContact O-CD1 3.13Å; R406-I409 VanDerWaalsContact O-CG1 3.31Å; R406-I409 WeakPolarHBondContact O-CG1 3.31Å; R406-I409 PolarHBondContact O-N 2.95Å |
| 407 | L | 55.9 | Low | 55.9 | Low | 10 Ų | 10 | 69.8 Ų | 69.8 | 5% | 0.052 | 36% | 0.36 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.9 | -4.8 | 165.8 | -90.7 | 83.9 | 0 | 0 | 0 | 113.2 | P167 A171 I204 H403 L404 H405 I409 L410 | P167-L407 HydrophobicContact CB-CD1 3.97Å; A171-L407 HydrophobicContact CB-CD2 4.35Å; I204-L407 HydrophobicContact CD1-CD2 3.25Å; I204-L407 HydrophobicContact CG1-CD2 4.16Å; I204-L407 HydrophobicContact CG2-CD2 4.4Å; H403-L407 WeakPolarHBondContact O-CD1 3.17Å; L404-L407 WeakPolarHBondContact O-CB 3.35Å; L404-L407 PolarHBondContact O-N 3.41Å; H405-L407 VanDerWaalsContact C-N 3.33Å; L407-I409 PolarHBondContact O-N 2.72Å; L407-L410 HydrophobicContact CD2-CD1 3.97Å; L407-L410 HydrophobicContact CG-CD1 4.32Å; L407-L410 WeakPolarHBondContact O-CB 3.4Å; L407-L410 PolarHBondContact O-N 3.16Å |
| 408 | D | 49.2 | Very low | 54.6 | Low | 47 Ų | 47 | 76.8 Ų | 76.8 | 25% | 0.251 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -12.7 | 166.7 | -164.2 | 49.3 | 0 | 0 | 0 | 112.6 | H405 R406 L410 R411 R412 | H405-D408 VanDerWaalsContact O-CB 3.22Å; H405-D408 WeakPolarHBondContact O-CB 3.42Å; H405-D408 PolarHBondContact O-N 3.01Å; R406-D408 PolarHBondContact O-N 2.89Å; D408-L410 PolarHBondContact O-N 3.39Å; D408-R411 WeakPolarHBondContact O-CB 3.26Å; D408-R411 PolarHBondContact O-N 2.8Å; D408-R411 VanDerWaalsContact O-N 3.09Å; D408-R411 WeakPolarHBondContact OD1-CB 3.4Å; D408-R411 VanDerWaalsContact OD1-CD 3.32Å; D408-R411 WeakPolarHBondContact OD1-CD 3.46Å; D408-R412 WeakPolarHBondContact O-CG 3.5Å; D408-R412 PolarHBondContact O-N 2.97Å; D408-R412 IonicContact OD2-CZ 2.81Å; D408-R412 IonicContact OD2-NE 3.85Å; D408-R412 PolarHBondContact OD2-NE 2.97Å; D408-R412 IonicContact OD2-NH2 3.89Å |
| 409 | I | 49.8 | Very low | 53.4 | Low | 111 Ų | 111 | 82.4 Ų | 82.4 | 57% | 0.569 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -56.8 | -37.9 | 165.5 | -68.1 | 169.7 | 0 | 0 | 0 | 111.5 | R406 L407 R411 R412 S413 | R406-I409 WeakPolarHBondContact O-CD1 3.13Å; R406-I409 VanDerWaalsContact O-CG1 3.31Å; R406-I409 WeakPolarHBondContact O-CG1 3.31Å; R406-I409 PolarHBondContact O-N 2.95Å; L407-I409 PolarHBondContact O-N 2.72Å; I409-R411 VanDerWaalsContact C-N 3.25Å; I409-R411 PolarHBondContact O-N 3.3Å; I409-R412 PolarHBondContact O-N 3Å; I409-S413 PolarHBondContact O-N 3.01Å |
| 410 | L | 48.2 | Very low | 52.2 | Low | 29 Ų | 29 | 88 Ų | 88 | 15% | 0.152 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -66.5 | -28.6 | 175.8 | -67.3 | 172.6 | 0 | 0 | 0 | 112.5 | A171 L175 L407 D408 | A171-L410 HydrophobicContact CB-CD1 3.83Å; A171-L410 HydrophobicContact CB-CD2 4.21Å; A171-L410 HydrophobicContact CB-CG 4.33Å; L175-L410 HydrophobicContact CD1-CD2 4.21Å; L407-L410 HydrophobicContact CD2-CD1 3.97Å; L407-L410 HydrophobicContact CG-CD1 4.32Å; L407-L410 WeakPolarHBondContact O-CB 3.4Å; L407-L410 PolarHBondContact O-N 3.16Å; D408-L410 PolarHBondContact O-N 3.39Å |
| 411 | R | 48.5 | Very low | 50.4 | Low | 195 Ų | 195 | 90.9 Ų | 90.9 | 74% | 0.736 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -81.8 | -39 | 176.4 | -167.3 | -178.6 | -175.6 | 163.3 | 1.1 | 111.8 | D408 I409 S413 | D408-R411 WeakPolarHBondContact O-CB 3.26Å; D408-R411 PolarHBondContact O-N 2.8Å; D408-R411 VanDerWaalsContact O-N 3.09Å; D408-R411 WeakPolarHBondContact OD1-CB 3.4Å; D408-R411 VanDerWaalsContact OD1-CD 3.32Å; D408-R411 WeakPolarHBondContact OD1-CD 3.46Å; I409-R411 VanDerWaalsContact C-N 3.25Å; I409-R411 PolarHBondContact O-N 3.3Å; R411-S413 VanDerWaalsContact C-N 3.3Å; R411-S413 PolarHBondContact O-N 3.26Å |
| 412 | R | 44.9 | Very low | 48.5 | Very low | 183 Ų | 183 | 90.9 Ų | 90.9 | 69% | 0.691 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -74.6 | -17.1 | 178.8 | -72 | -177.1 | -172.7 | -153.2 | -2.5 | 114 | D408 I409 D414 A415 | D408-R412 WeakPolarHBondContact O-CG 3.5Å; D408-R412 PolarHBondContact O-N 2.97Å; D408-R412 IonicContact OD2-CZ 2.81Å; D408-R412 IonicContact OD2-NE 3.85Å; D408-R412 PolarHBondContact OD2-NE 2.97Å; D408-R412 IonicContact OD2-NH2 3.89Å; I409-R412 PolarHBondContact O-N 3Å; R412-D414 PolarHBondContact O-N 3.44Å; R412-D414 VanDerWaalsContact O-N 3.14Å; R412-A415 PolarHBondContact O-N 3.3Å |
| 413 | S | 46.5 | Very low | 46.8 | Very low | 26 Ų | 26 | 92.3 Ų | 92.3 | 18% | 0.182 | 48% | 0.477 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -14.3 | 174.7 | -167.6 | 0 | 0 | 0 | 0 | 113.9 | I409 R411 H423 | I409-S413 PolarHBondContact O-N 3.01Å; R411-S413 VanDerWaalsContact C-N 3.3Å; R411-S413 PolarHBondContact O-N 3.26Å; S413-H423 VanDerWaalsContact CB-NE2 3.32Å; S413-H423 WeakPolarHBondContact CB-NE2 3.38Å; S413-H423 PolarHBondContact OG-CD2 3.45Å; S413-H423 PolarHBondContact OG-NE2 2.87Å; S413-H423 VanDerWaalsContact OG-NE2 3.17Å |
| 414 | D | 46.1 | Very low | 45.2 | Very low | 113 Ų | 113 | 96.9 Ų | 96.9 | 60% | 0.604 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.7 | 0.6 | 179.2 | -66.1 | -25.8 | 0 | 0 | 0 | 113.6 | K197 R412 | K197-D414 IonicContact NZ-OD1 2.74Å; K197-D414 PolarHBondContact NZ-OD1 2.67Å; K197-D414 IonicContact NZ-OD2 3.11Å; K197-D414 PolarHBondContact NZ-OD2 3.24Å; R412-D414 PolarHBondContact O-N 3.44Å; R412-D414 VanDerWaalsContact O-N 3.14Å |
| 415 | A | 44.4 | Very low | 43.8 | Very low | 91 Ų | 91 | 98.5 Ų | 98.5 | 75% | 0.752 | 51% | 0.51 | S | S | * | . | S | Bend | trans | -96 | 12.5 | -172.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | R412 | R412-A415 PolarHBondContact O-N 3.3Š|
| 416 | G | 36 | Very low | 42.6 | Very low | 38 Ų | 38 | 98.7 Ų | 98.7 | 39% | 0.392 | 51% | 0.511 | S | S | . | . | trans | -122.7 | 132.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | D418 | G416-D418 PolarHBondContact O-N 3.17Å; G416-D418 VanDerWaalsContact O-N 3.09Å | ||
| 417 | P | 36.2 | Very low | 41.3 | Very low | 141 Ų | 141 | 97.1 Ų | 97.1 | 92% | 0.916 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69 | -3.7 | -178.2 | -15.1 | 28.8 | 0 | 0 | 0 | 115.3 | ||
| 418 | D | 39.8 | Very low | 40.2 | Very low | 153 Ų | 153 | 98.4 Ų | 98.4 | 82% | 0.818 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -137.8 | 37 | -156.6 | -132.1 | 2.6 | 0 | 0 | 0 | 113.2 | G416 | G416-D418 PolarHBondContact O-N 3.17Å; G416-D418 VanDerWaalsContact O-N 3.09Å |
| 419 | R | 43.7 | Very low | 39.5 | Very low | 141 Ų | 141 | 98.8 Ų | 98.8 | 53% | 0.532 | 53% | 0.531 | S | S | . | . | trans | -136 | 27.3 | -167.6 | -81.5 | -167.3 | 169.1 | -166.6 | -3.1 | 117.2 | A421 L422 | R419-A421 PolarHBondContact O-N 3.39Å; R419-A421 VanDerWaalsContact O-N 3.1Å; R419-L422 HydrophobicContact CG-CB 4.44Å; R419-L422 PolarHBondContact O-N 3.22Å | ||
| 420 | D | 37.7 | Very low | 38.7 | Very low | 119 Ų | 119 | 95.6 Ų | 95.6 | 64% | 0.636 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -15 | 154.5 | -70.9 | -37.1 | 0 | 0 | 0 | 111.5 | Q424 | D420-Q424 WeakPolarHBondContact O-CB 3.45Å; D420-Q424 PolarHBondContact O-OE1 3.27Å |
| 421 | A | 32.7 | Very low | 38 | Very low | 66 Ų | 66 | 96.4 Ų | 96.4 | 55% | 0.545 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -36.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | R419 T425 | R419-A421 PolarHBondContact O-N 3.39Å; R419-A421 VanDerWaalsContact O-N 3.1Å; A421-T425 VanDerWaalsContact O-CB 3.27Å; A421-T425 WeakPolarHBondContact O-CB 3.49Å; A421-T425 PolarHBondContact O-N 3.35Å; A421-T425 PolarHBondContact O-OG1 3.07Å |
| 422 | L | 33.6 | Very low | 37.3 | Very low | 88 Ų | 88 | 93.3 Ų | 93.3 | 46% | 0.461 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -89.2 | -34.8 | -165.1 | -141.4 | 92.4 | 0 | 0 | 0 | 114.3 | R419 T425 Q426 | R419-L422 HydrophobicContact CG-CB 4.44Å; R419-L422 PolarHBondContact O-N 3.22Å; L422-T425 PolarHBondContact O-N 3.49Å; L422-Q426 PolarHBondContact O-N 3.38Å |
| 423 | H | 34.9 | Very low | 36.6 | Very low | 74 Ų | 74 | 87.2 Ų | 87.2 | 34% | 0.343 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -81.7 | -53.6 | -179.9 | -115.1 | -92.4 | 0 | 0 | 0 | 112.2 | S413 Q426 L427 | S413-H423 VanDerWaalsContact CB-NE2 3.32Å; S413-H423 WeakPolarHBondContact CB-NE2 3.38Å; S413-H423 PolarHBondContact OG-CD2 3.45Å; S413-H423 PolarHBondContact OG-NE2 2.87Å; S413-H423 VanDerWaalsContact OG-NE2 3.17Å; H423-Q426 PolarHBondContact O-N 2.83Å; H423-L427 WeakPolarHBondContact O-CB 3.46Å; H423-L427 PolarHBondContact O-N 3.5Å |
| 424 | Q | 34.9 | Very low | 35.8 | Very low | 106 Ų | 106 | 89 Ų | 89 | 50% | 0.495 | 53% | 0.53 | S | S | . | . | H | α-helix | 32.4 | -106.5 | 107.8 | -72.1 | 156.5 | -36.5 | 0 | 0 | 115.9 | D420 Q426 S428 | D420-Q424 WeakPolarHBondContact O-CB 3.45Å; D420-Q424 PolarHBondContact O-OE1 3.27Å; Q424-Q426 PolarHBondContact O-N 3.43Å; Q424-S428 WeakPolarHBondContact O-CA 3.48Å; Q424-S428 WeakPolarHBondContact O-CB 3.04Å; Q424-S428 PolarHBondContact O-N 2.99Å; Q424-S428 PolarHBondContact O-OG 2.8Å | |
| 425 | T | 35.5 | Very low | 34.9 | Very low | 81 Ų | 81 | 91.4 Ų | 91.4 | 50% | 0.497 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.1 | -31.3 | -178.4 | -58.1 | 0 | 0 | 0 | 0 | 115.5 | A421 L422 S428 A429 | A421-T425 VanDerWaalsContact O-CB 3.27Å; A421-T425 WeakPolarHBondContact O-CB 3.49Å; A421-T425 PolarHBondContact O-N 3.35Å; A421-T425 PolarHBondContact O-OG1 3.07Å; L422-T425 PolarHBondContact O-N 3.49Å; T425-S428 VanDerWaalsContact CA-OG 3.24Å; T425-S428 WeakPolarHBondContact CA-OG 3.31Å; T425-A429 WeakPolarHBondContact O-CA 3.45Å; T425-A429 WeakPolarHBondContact O-CB 3.47Å; T425-A429 PolarHBondContact O-N 3.36Å |
| 426 | Q | 35.8 | Very low | 34.1 | Very low | 140 Ų | 140 | 95.5 Ų | 95.5 | 65% | 0.654 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -81.7 | -40.9 | 179.6 | -77.7 | -90.5 | -49.8 | 0 | 0 | 111.9 | L422 H423 Q424 A430 | L422-Q426 PolarHBondContact O-N 3.38Å; H423-Q426 PolarHBondContact O-N 2.83Å; Q424-Q426 PolarHBondContact O-N 3.43Å; Q426-A430 PolarHBondContact O-N 3.2Å |
| 427 | L | 33.8 | Very low | 33.8 | Very low | 87 Ų | 87 | 101.1 Ų | 101.1 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -74.3 | -36.6 | 174.4 | -152.3 | 79.2 | 0 | 0 | 0 | 110.5 | H423 A430 L431 | H423-L427 WeakPolarHBondContact O-CB 3.46Å; H423-L427 PolarHBondContact O-N 3.5Å; L427-A430 CarbonylContact O-C 3.54Å; L427-A430 PolarHBondContact O-N 2.9Å; L427-L431 HydrophobicContact CD2-CD1 4.25Å; L427-L431 HydrophobicContact CG-CD1 3.91Å; L427-L431 WeakPolarHBondContact O-CA 3.22Å; L427-L431 WeakPolarHBondContact O-CB 3.32Å; L427-L431 WeakPolarHBondContact O-CG 3.31Å; L427-L431 PolarHBondContact O-N 3.1Å |
| 428 | S | 32.6 | Very low | 33.3 | Very low | 38 Ų | 38 | 100.2 Ų | 100.2 | 27% | 0.266 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -77.2 | -27.8 | 173.7 | 72.5 | 0 | 0 | 0 | 0 | 113.7 | Q424 T425 A430 L431 Q432 | Q424-S428 WeakPolarHBondContact O-CA 3.48Å; Q424-S428 WeakPolarHBondContact O-CB 3.04Å; Q424-S428 PolarHBondContact O-N 2.99Å; Q424-S428 PolarHBondContact O-OG 2.8Å; T425-S428 VanDerWaalsContact CA-OG 3.24Å; T425-S428 WeakPolarHBondContact CA-OG 3.31Å; S428-A430 PolarHBondContact O-N 3.49Å; S428-L431 PolarHBondContact O-N 2.75Å; S428-Q432 CarbonylContact O-C 3.52Å; S428-Q432 PolarHBondContact O-N 3.02Å; S428-Q432 VanDerWaalsContact O-O 3.13Å |
| 429 | A | 34.4 | Very low | 32.8 | Very low | 54 Ų | 54 | 104.3 Ų | 104.3 | 45% | 0.446 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.3 | -27.9 | 166.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | R103 T425 | R103-A429 PolarHBondContact NH2-O 3.46Å; T425-A429 WeakPolarHBondContact O-CA 3.45Å; T425-A429 WeakPolarHBondContact O-CB 3.47Å; T425-A429 PolarHBondContact O-N 3.36Å |
| 430 | A | 33 | Very low | 31.9 | Very low | 44 Ų | 44 | 103.9 Ų | 103.9 | 36% | 0.364 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -87.2 | -27.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q426 L427 S428 | Q426-A430 PolarHBondContact O-N 3.2Å; L427-A430 CarbonylContact O-C 3.54Å; L427-A430 PolarHBondContact O-N 2.9Å; S428-A430 PolarHBondContact O-N 3.49Å |
| 431 | L | 34 | Very low | 31.4 | Very low | 47 Ų | 47 | 101.8 Ų | 101.8 | 25% | 0.246 | 59% | 0.587 | C | S | . | * | H | α-helix | trans | -122.4 | -16.4 | -168.4 | -72.1 | 173.7 | 0 | 0 | 0 | 118.1 | V95 L427 S428 | V95-L431 HydrophobicContact CG1-CD2 3.51Å; V95-L431 HydrophobicContact CG1-CG 4.36Å; L427-L431 HydrophobicContact CD2-CD1 4.25Å; L427-L431 HydrophobicContact CG-CD1 3.91Å; L427-L431 WeakPolarHBondContact O-CA 3.22Å; L427-L431 WeakPolarHBondContact O-CB 3.32Å; L427-L431 WeakPolarHBondContact O-CG 3.31Å; L427-L431 PolarHBondContact O-N 3.1Å; S428-L431 PolarHBondContact O-N 2.75Å |
| 432 | Q | 32.8 | Very low | 31.2 | Very low | 129 Ų | 129 | 107.1 Ų | 107.1 | 60% | 0.603 | 61% | 0.605 | S | S | * | * | trans | -155.8 | 114.3 | -177.6 | -106 | 155 | 14.7 | 0 | 0 | 114.1 | S428 | S428-Q432 CarbonylContact O-C 3.52Å; S428-Q432 PolarHBondContact O-N 3.02Å; S428-Q432 VanDerWaalsContact O-O 3.13Å | ||
| 433 | G | 30.8 | Very low | 30.8 | Very low | 56 Ų | 56 | 106.1 Ų | 106.1 | 58% | 0.577 | 62% | 0.616 | S | S | * | * | trans | -107.3 | 67.2 | 146.1 | 0 | 0 | 0 | 0 | 0 | 109 | V102 | V102-G433 WeakPolarHBondContact CG1-O 3.27Š| ||
| 434 | A | 29.3 | Very low | 30.6 | Very low | 64 Ų | 64 | 111.1 Ų | 111.1 | 53% | 0.529 | 64% | 0.639 | S | S | . | * | trans | -149.3 | 89 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 435 | D | 28 | Very low | 30.1 | Very low | 163 Ų | 163 | 114.1 Ų | 114.1 | 87% | 0.872 | 66% | 0.658 | S | S | * | * | trans | -126.8 | 94.9 | 164.5 | -123.5 | -16.5 | 0 | 0 | 0 | 107.8 | ||||
| 436 | H | 26.7 | Very low | 29.7 | Very low | 177 Ų | 177 | 121.1 Ų | 121.1 | 82% | 0.819 | 68% | 0.675 | S | S | * | * | trans | -157.3 | 121.8 | 137.2 | -113.9 | -20 | 0 | 0 | 0 | 112.1 | ||||
| 437 | H | 28.9 | Very low | 29.3 | Very low | 155 Ų | 155 | 120.5 Ų | 120.5 | 72% | 0.718 | 68% | 0.68 | S | S | * | * | trans | 63.6 | 110.2 | 160.3 | -83.5 | -71.6 | 0 | 0 | 0 | 118.4 | ||||
| 438 | S | 26.1 | Very low | 28.9 | Very low | 123 Ų | 123 | 121.7 Ų | 121.7 | 86% | 0.86 | 70% | 0.696 | S | S | * | * | -170.9 | 143.6 | 110.7 | -78.5 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 439 | R | 28.9 | Very low | 28.7 | Very low | 239 Ų | 239 | 131.1 Ų | 131.1 | 90% | 0.902 | 73% | 0.726 | S | S | * | * | trans | -71.8 | 144.6 | -174.3 | -65.2 | 165.4 | 177.5 | -177.5 | -0.8 | 111.2 | ||||
| 440 | C | 24.8 | Very low | 28.3 | Very low | 131 Ų | 131 | 132.2 Ų | 132.2 | 89% | 0.885 | 74% | 0.742 | S | S | * | * | trans | -108.8 | 119.4 | 151.3 | -141.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 441 | G | 27.8 | Very low | 28 | Very low | 76 Ų | 76 | 133.2 Ų | 133.2 | 78% | 0.784 | 76% | 0.757 | S | S | * | * | trans | -73.8 | 122.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 442 | L | 27.7 | Very low | 27.8 | Very low | 177 Ų | 177 | 137.5 Ų | 137.5 | 93% | 0.927 | 79% | 0.785 | S | S | * | * | trans | -91.3 | 113.4 | 162.4 | -105.4 | 130.1 | 0 | 0 | 0 | 108.5 | ||||
| 443 | G | 26 | Very low | 27.5 | Very low | 67 Ų | 67 | 137.9 Ų | 137.9 | 69% | 0.691 | 79% | 0.792 | S | S | * | * | trans | -59.1 | 140.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 444 | H | 30.1 | Very low | 27.5 | Very low | 179 Ų | 179 | 141.3 Ų | 141.3 | 83% | 0.829 | 80% | 0.796 | S | S | * | * | trans | -7.9 | 118.9 | 155.6 | -89.3 | -95.8 | 0 | 0 | 0 | 116.7 | ||||
| 445 | L | 25.7 | Very low | 27.4 | Very low | 170 Ų | 170 | 148.7 Ų | 148.7 | 89% | 0.89 | 81% | 0.81 | S | S | * | * | trans | -149.8 | 87.6 | 138.6 | -103.8 | 156.9 | 0 | 0 | 0 | 108.6 | V447 | L445-V447 PolarHBondContact O-N 2.79Š| ||
| 446 | R | 25.6 | Very low | 27.5 | Very low | 228 Ų | 228 | 147.4 Ų | 147.4 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -75.3 | 107.1 | 171.1 | -162.1 | -179.9 | -157.6 | 167 | 5 | 107.1 | S448 | R446-S448 PolarHBondContact O-N 3.12Š| ||
| 447 | V | 29.3 | Very low | 27.6 | Very low | 126 Ų | 126 | 144.9 Ų | 144.9 | 76% | 0.764 | 80% | 0.8 | S | S | * | * | trans | -65.9 | 104.8 | 168.5 | 174.3 | 0 | 0 | 0 | 0 | 107.8 | L445 R449 | L445-V447 PolarHBondContact O-N 2.79Å; V447-R449 PolarHBondContact O-N 2.88Å | ||
| 448 | S | 24.4 | Very low | 27.8 | Very low | 113 Ų | 113 | 141.9 Ų | 141.9 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -77.7 | 110.1 | 166 | -172.3 | 0 | 0 | 0 | 0 | 108.2 | R446 | R446-S448 PolarHBondContact O-N 3.12Š| ||
| 449 | R | 29.4 | Very low | 28.1 | Very low | 235 Ų | 235 | 151.4 Ų | 151.4 | 89% | 0.887 | 82% | 0.819 | S | S | * | * | trans | -107.6 | 111.8 | 157.1 | -98.2 | -174.3 | 175.2 | 178.3 | -0.5 | 107.4 | V447 | V447-R449 PolarHBondContact O-N 2.88Š| ||
| 450 | G | 25.7 | Very low | 28 | Very low | 77 Ų | 77 | 147.1 Ų | 147.1 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -66.6 | 153.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 451 | G | 26.3 | Very low | 28.2 | Very low | 66 Ų | 66 | 147.9 Ų | 147.9 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | trans | 167.5 | 80.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 452 | T | 29.2 | Very low | 28.2 | Very low | 136 Ų | 136 | 151.9 Ų | 151.9 | 83% | 0.834 | 81% | 0.813 | S | S | * | * | trans | 9.3 | 141 | 135.6 | 43.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 453 | N | 26.5 | Very low | 28.2 | Very low | 137 Ų | 137 | 150.4 Ų | 150.4 | 73% | 0.733 | 81% | 0.806 | S | S | * | * | cis | 178.3 | 168.8 | 4.8 | -162.4 | -0.6 | 0 | 0 | 0 | 104.6 | ||||
| 454 | I | 30.4 | Very low | 28.4 | Very low | 129 Ų | 129 | 155.6 Ų | 155.6 | 66% | 0.662 | 81% | 0.813 | S | S | * | * | trans | 89.6 | 109.9 | 155.6 | -55.6 | 159.3 | 0 | 0 | 0 | 117.9 | ||||
| 455 | R | 28.7 | Very low | 28.3 | Very low | 218 Ų | 218 | 154.1 Ų | 154.1 | 82% | 0.823 | 81% | 0.812 | S | S | * | * | 43.5 | 138.4 | 129.3 | -59.3 | -178 | -174.3 | 170.2 | -0 | 118.1 | |||||
| 456 | D | 28.7 | Very low | 28.5 | Very low | 136 Ų | 136 | 152.9 Ų | 152.9 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | cis | -167.1 | 158.1 | 37 | -108.2 | -35.7 | 0 | 0 | 0 | 109.9 | ||||
| 457 | T | 30.4 | Very low | 28.7 | Very low | 125 Ų | 125 | 147.2 Ų | 147.2 | 77% | 0.767 | 80% | 0.803 | S | S | * | * | trans | -17.3 | 137.6 | 154.8 | 42 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 458 | A | 31.4 | Very low | 28.6 | Very low | 91 Ų | 91 | 148.9 Ų | 148.9 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | 146.5 | 127.9 | 111.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 459 | R | 32.4 | Very low | 29 | Very low | 324 Ų | 324 | 152.2 Ų | 152.2 | 100% | 1.223 | 81% | 0.807 | S | S | * | * | trans | 77.6 | 0 | 161.2 | -69.7 | -174.1 | -178.1 | -176 | 1.4 | 119.5 |
Retrieved 459 of 459 residues in 103.9 ms
(Link to these results)