| 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 | 39.2 | Very low | 46.7 | Very low | 238 Ų | 238 | 164.9 Ų | 164.9 | 100% | 1.172 | 83% | 0.834 | S | S | * | * | 0 | 91.6 | 0 | -69.2 | -171.7 | -89.5 | 0 | 0 | 105.5 | |||||
| 2 | A | 41.1 | Very low | 46.1 | Very low | 96 Ų | 96 | 160.6 Ų | 160.6 | 79% | 0.793 | 83% | 0.831 | S | S | * | * | 63 | 119.2 | 99.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 3 | H | 46.4 | Very low | 46.1 | Very low | 181 Ų | 181 | 159.8 Ų | 159.8 | 84% | 0.838 | 83% | 0.828 | S | S | * | * | cis | -158.8 | 128.9 | 25.5 | -146.7 | -96.7 | 0 | 0 | 0 | 106.6 | ||||
| 4 | E | 43.3 | Very low | 45.8 | Very low | 190 Ų | 190 | 157.6 Ų | 157.6 | 89% | 0.888 | 83% | 0.825 | S | S | * | * | trans | -67.7 | 132.1 | 173.7 | -84.5 | -171.6 | 110.9 | 0 | 0 | 110.3 | Q6 | E4-Q6 PolarHBondContact O-N 3.4Š| ||
| 5 | L | 49.9 | Very low | 45.2 | Very low | 148 Ų | 148 | 153.3 Ų | 153.3 | 78% | 0.775 | 82% | 0.821 | S | S | * | * | trans | -85.5 | 103.5 | 169.4 | -74.9 | 164.8 | 0 | 0 | 0 | 107.6 | F7 | L5-F7 HydrophobicContact CB-CD2 4.42Å; L5-F7 HydrophobicContact CB-CE2 3.91Å; L5-F7 PolarHBondContact O-N 3.48Å | ||
| 6 | Q | 47.8 | Very low | 45.1 | Very low | 195 Ų | 195 | 151.3 Ų | 151.3 | 91% | 0.911 | 82% | 0.819 | S | S | * | * | trans | -80.4 | 101.6 | 177.9 | -159.6 | 176 | -0.5 | 0 | 0 | 108.9 | E4 | E4-Q6 PolarHBondContact O-N 3.4Š| ||
| 7 | F | 49.1 | Very low | 44.4 | Very low | 165 Ų | 165 | 149.9 Ų | 149.9 | 72% | 0.724 | 82% | 0.824 | S | S | * | * | trans | -79.8 | 130.2 | 169.5 | -71.3 | -87 | 0 | 0 | 0 | 108.9 | L5 D9 | L5-F7 HydrophobicContact CB-CD2 4.42Å; L5-F7 HydrophobicContact CB-CE2 3.91Å; L5-F7 PolarHBondContact O-N 3.48Å; F7-D9 PolarHBondContact O-N 3.36Å | ||
| 8 | Q | 47.9 | Very low | 43.8 | Very low | 167 Ų | 167 | 145.9 Ų | 145.9 | 78% | 0.78 | 82% | 0.822 | S | S | * | * | trans | -83.7 | 97.6 | 178.1 | -169.7 | 161.3 | 36.6 | 0 | 0 | 108.7 | ||||
| 9 | D | 52.1 | Low | 43.2 | Very low | 148 Ų | 148 | 147.1 Ų | 147.1 | 79% | 0.791 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 123 | 172.8 | -70.5 | -40.2 | 0 | 0 | 0 | 109.9 | F7 | F7-D9 PolarHBondContact O-N 3.36Š|
| 10 | F | 41.7 | Very low | 43.1 | Very low | 168 Ų | 168 | 145.2 Ų | 145.2 | 74% | 0.737 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 133.5 | 170.8 | -74.6 | -88.7 | 0 | 0 | 0 | 109.6 | S12 | F10-S12 PolarHBondContact O-N 3.19Š|
| 11 | P | 54.9 | Low | 42.6 | Very low | 118 Ų | 118 | 143.9 Ų | 143.9 | 77% | 0.766 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 127.8 | -176.5 | 24.8 | -31.8 | 0 | 0 | 0 | 111.3 | ||
| 12 | S | 39.3 | Very low | 42.3 | Very low | 113 Ų | 113 | 137.7 Ų | 137.7 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | trans | -107.4 | 83 | 172.6 | -63.6 | 0 | 0 | 0 | 0 | 109.2 | F10 | F10-S12 PolarHBondContact O-N 3.19Š| ||
| 13 | D | 45.8 | Very low | 41.9 | Very low | 150 Ų | 150 | 138.9 Ų | 138.9 | 80% | 0.802 | 80% | 0.802 | S | S | * | * | trans | -123.1 | 103.9 | 167.2 | -75.1 | -41.1 | 0 | 0 | 0 | 107.8 | ||||
| 14 | V | 42.3 | Very low | 41.4 | Very low | 129 Ų | 129 | 135 Ų | 135 | 78% | 0.782 | 80% | 0.802 | S | S | * | * | 73.3 | 91.6 | 88.2 | 179.7 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 15 | A | 37.6 | Very low | 40.9 | Very low | 93 Ų | 93 | 137.3 Ų | 137.3 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | 64.5 | 166.5 | 124.1 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 16 | P | 43.6 | Very low | 40.3 | Very low | 121 Ų | 121 | 137.9 Ų | 137.9 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | -118.2 | 145.6 | -124.6 | 35.5 | -18.1 | 0 | 0 | 0 | 114.5 | |||||
| 17 | S | 32.2 | Very low | 39.9 | Very low | 129 Ų | 129 | 137.6 Ų | 137.6 | 90% | 0.902 | 81% | 0.805 | S | S | * | * | trans | -168.4 | 117.8 | 165.3 | 42 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 18 | G | 33.2 | Very low | 39.3 | Very low | 77 Ų | 77 | 136.7 Ų | 136.7 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | trans | 143 | 88.5 | 156.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 19 | L | 33.6 | Very low | 39.3 | Very low | 169 Ų | 169 | 137.1 Ų | 137.1 | 89% | 0.885 | 81% | 0.814 | S | S | * | * | trans | -122.2 | 158.2 | 142.2 | -112.4 | 105 | 0 | 0 | 0 | 106.1 | ||||
| 20 | P | 40.2 | Very low | 38.8 | Very low | 108 Ų | 108 | 135.8 Ų | 135.8 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | cis | -141.3 | 167.6 | 20.6 | 37.1 | -17 | 0 | 0 | 0 | 115.3 | ||||
| 21 | S | 32.7 | Very low | 38.8 | Very low | 118 Ų | 118 | 130.5 Ų | 130.5 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | 172.8 | 154.4 | 127 | 49.4 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 22 | S | 33.8 | Very low | 38.1 | Very low | 108 Ų | 108 | 132.3 Ų | 132.3 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | trans | -54.1 | 137.2 | -172.9 | 53.9 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 23 | S | 32.9 | Very low | 38.4 | Very low | 121 Ų | 121 | 136.8 Ų | 136.8 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | 155.7 | 65.3 | 129.5 | 53.5 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 24 | A | 36.6 | Very low | 38.5 | Very low | 100 Ų | 100 | 137 Ų | 137 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | trans | -168.2 | 81.6 | 160.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 25 | R | 31.6 | Very low | 38.3 | Very low | 239 Ų | 239 | 139.3 Ų | 139.3 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | trans | -98.5 | 125.1 | 158.8 | -77.1 | 179.2 | 173.7 | 140.9 | -2 | 105.5 | ||||
| 26 | D | 37.7 | Very low | 38.7 | Very low | 160 Ų | 160 | 140.1 Ų | 140.1 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 116.3 | 26 | 166 | -52.6 | -21.5 | 0 | 0 | 0 | 119.3 | ||
| 27 | E | 39.6 | Very low | 38.5 | Very low | 188 Ų | 188 | 140.2 Ų | 140.2 | 88% | 0.879 | 80% | 0.795 | S | S | * | * | trans | -129.8 | 12.2 | 167.8 | -85.1 | -151.8 | 119 | 0 | 0 | 117 | ||||
| 28 | N | 36.7 | Very low | 38.6 | Very low | 147 Ų | 147 | 142.5 Ų | 142.5 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.7 | 22.2 | -173.1 | -96.1 | -27.8 | 0 | 0 | 0 | 116.9 | ||
| 29 | L | 46.5 | Very low | 38.9 | Very low | 175 Ų | 175 | 143.2 Ų | 143.2 | 92% | 0.916 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -5.5 | 171.6 | -87 | 155.9 | 0 | 0 | 0 | 114.2 | ||
| 30 | N | 42.6 | Very low | 39.2 | Very low | 120 Ų | 120 | 139.7 Ų | 139.7 | 64% | 0.642 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -117.3 | 0.4 | -175.9 | -91.5 | -21.3 | 0 | 0 | 0 | 115.8 | N32 | N30-N32 VanDerWaalsContact C-N 3.32Å; N30-N32 PolarHBondContact O-N 2.77Å |
| 31 | A | 41 | Very low | 39.5 | Very low | 57 Ų | 57 | 143.1 Ų | 143.1 | 47% | 0.471 | 79% | 0.786 | S | S | . | * | G | 310 helix | trans | -78.7 | -11.9 | 179 | 0 | 0 | 0 | 0 | 0 | 114.2 | R33 | A31-R33 PolarHBondContact O-N 3.16Š|
| 32 | N | 40.7 | Very low | 39.9 | Very low | 156 Ų | 156 | 146.4 Ų | 146.4 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | G | 310 helix | trans | -80.2 | 13.8 | 176.9 | -81.3 | 0.4 | 0 | 0 | 0 | 114.6 | N30 | N30-N32 VanDerWaalsContact C-N 3.32Å; N30-N32 PolarHBondContact O-N 2.77Å |
| 33 | R | 46.4 | Very low | 40.6 | Very low | 208 Ų | 208 | 146 Ų | 146 | 79% | 0.785 | 78% | 0.783 | S | S | * | * | G | 310 helix | trans | -102 | 2.5 | 173.7 | -65.3 | -166.2 | -166.5 | -172.3 | 5.1 | 114.4 | A31 | A31-R33 PolarHBondContact O-N 3.16Š|
| 34 | L | 47.2 | Very low | 41.5 | Very low | 154 Ų | 154 | 142.6 Ų | 142.6 | 81% | 0.806 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -99.5 | -2.5 | -175.7 | -124.8 | 62 | 0 | 0 | 0 | 114.9 | ||
| 35 | F | 39.1 | Very low | 42.6 | Very low | 178 Ų | 178 | 142.4 Ų | 142.4 | 78% | 0.781 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -108.2 | 102.6 | 165.2 | -66.4 | -81.2 | 0 | 0 | 0 | 107.9 | ||
| 36 | P | 44.2 | Very low | 43.8 | Very low | 110 Ų | 110 | 137.3 Ų | 137.3 | 71% | 0.714 | 74% | 0.739 | S | S | * | * | trans | -60.4 | 135.9 | 164.9 | 26 | -27.6 | 0 | 0 | 0 | 106.9 | E38 | P36-E38 PolarHBondContact O-N 3.04Š| ||
| 37 | P | 40.8 | Very low | 44.6 | Very low | 123 Ų | 123 | 139.3 Ų | 139.3 | 80% | 0.799 | 74% | 0.74 | S | S | * | * | trans | -55.7 | 119.7 | 175.1 | 22.9 | -30.9 | 0 | 0 | 0 | 108.2 | S39 | P37-S39 PolarHBondContact O-N 3.13Š| ||
| 38 | E | 34.3 | Very low | 45.5 | Very low | 177 Ų | 177 | 131.5 Ų | 131.5 | 83% | 0.827 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -26.8 | 127.7 | 158.4 | -164.1 | 178 | 122.6 | 0 | 0 | 110.7 | P36 | P36-E38 PolarHBondContact O-N 3.04Š|
| 39 | S | 38.7 | Very low | 46.6 | Very low | 92 Ų | 92 | 131.4 Ų | 131.4 | 64% | 0.643 | 71% | 0.705 | S | S | * | * | trans | 46.5 | 78 | 171.4 | 52.1 | 0 | 0 | 0 | 0 | 114.9 | P37 E41 | P37-S39 PolarHBondContact O-N 3.13Å; S39-E41 PolarHBondContact O-N 2.95Å | ||
| 40 | A | 39.6 | Very low | 47.3 | Very low | 94 Ų | 94 | 130 Ų | 130 | 78% | 0.777 | 69% | 0.693 | S | S | * | * | trans | -55.7 | 91.2 | 133 | 0 | 0 | 0 | 0 | 0 | 106.2 | K42 | A40-K42 PolarHBondContact O-N 3.5Š| ||
| 41 | E | 46.2 | Very low | 47.9 | Very low | 181 Ų | 181 | 127.2 Ų | 127.2 | 85% | 0.846 | 68% | 0.676 | S | S | * | * | trans | -50.5 | 93.7 | 161.6 | -92.2 | -168.9 | 127.5 | 0 | 0 | 105 | S39 S43 | S39-E41 PolarHBondContact O-N 2.95Å; E41-S43 PolarHBondContact O-N 3.23Å | ||
| 42 | K | 42.7 | Very low | 48.6 | Very low | 186 Ų | 186 | 127.1 Ų | 127.1 | 81% | 0.809 | 67% | 0.671 | S | S | * | * | trans | -68.1 | 90 | 175.1 | -160.7 | 178.5 | -168.6 | 177.4 | 0 | 102.3 | A40 P44 | A40-K42 PolarHBondContact O-N 3.5Å; K42-P44 WeakPolarHBondContact O-CA 3.38Å; K42-P44 WeakPolarHBondContact O-CD 3.3Å | ||
| 43 | S | 47.7 | Very low | 49.6 | Very low | 101 Ų | 101 | 125.4 Ų | 125.4 | 71% | 0.706 | 66% | 0.658 | S | S | * | * | trans | -39 | 109.2 | 176.9 | 41.9 | 0 | 0 | 0 | 0 | 105.6 | E41 | E41-S43 PolarHBondContact O-N 3.23Š| ||
| 44 | P | 51.6 | Low | 50.3 | Low | 49 Ų | 49 | 119.5 Ų | 119.5 | 32% | 0.318 | 64% | 0.639 | S | S | . | * | trans | -54.8 | 137.2 | -166.7 | 14 | -26.6 | 0 | 0 | 0 | 106.7 | K42 L46 F51 | K42-P44 WeakPolarHBondContact O-CA 3.38Å; K42-P44 WeakPolarHBondContact O-CD 3.3Å; P44-L46 PolarHBondContact O-N 2.96Å; P44-F51 HydrophobicContact CB-CB 4.25Å; P44-F51 HydrophobicContact CG-CB 3.99Å; P44-F51 HydrophobicContact CG-CD2 4.05Å; P44-F51 HydrophobicContact CG-CG 4.48Å | ||
| 45 | P | 58.9 | Low | 50.8 | Low | 96 Ų | 96 | 114 Ų | 114 | 62% | 0.623 | 61% | 0.609 | S | S | * | * | trans | -48.1 | 140.5 | 179.1 | 18.9 | -29.9 | 0 | 0 | 0 | 107.7 | F47 S48 | P45-F47 CarbonylContact O-C 3.6Å; P45-F47 PolarHBondContact O-N 3.38Å; P45-S48 VanDerWaalsContact O-CB 3.28Å; P45-S48 WeakPolarHBondContact O-CB 3.41Å; P45-S48 PolarHBondContact O-N 3.45Å | ||
| 46 | L | 58.5 | Low | 51.7 | Low | 132 Ų | 132 | 109.9 Ų | 109.9 | 69% | 0.691 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | -6 | -171.1 | -64.4 | 174 | 0 | 0 | 0 | 114.9 | P44 F51 | P44-L46 PolarHBondContact O-N 2.96Å; L46-F51 HydrophobicContact CD2-CE1 4.09Å; L46-F51 HydrophobicContact CD2-CZ 4.13Å |
| 47 | F | 54 | Low | 52.4 | Low | 202 Ų | 202 | 111.1 Ų | 111.1 | 89% | 0.886 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.8 | 5.5 | 174.9 | -76.7 | -82.9 | 0 | 0 | 0 | 115 | P45 L49 | P45-F47 CarbonylContact O-C 3.6Å; P45-F47 PolarHBondContact O-N 3.38Å; F47-L49 PolarHBondContact O-N 3.29Å |
| 48 | S | 58.2 | Low | 53.1 | Low | 24 Ų | 24 | 106.9 Ų | 106.9 | 17% | 0.168 | 56% | 0.563 | C | S | . | * | trans | -63.1 | 127.1 | 171.3 | 149.4 | 0 | 0 | 0 | 0 | 108.1 | P45 Q50 F51 C52 | P45-S48 VanDerWaalsContact O-CB 3.28Å; P45-S48 WeakPolarHBondContact O-CB 3.41Å; P45-S48 PolarHBondContact O-N 3.45Å; S48-Q50 PolarHBondContact O-N 2.69Å; S48-Q50 VanDerWaalsContact OG-CB 3.28Å; S48-Q50 WeakPolarHBondContact OG-CB 3.46Å; S48-Q50 PolarHBondContact OG-N 3.01Å; S48-F51 WeakPolarHBondContact O-CA 3.42Å; S48-F51 WeakPolarHBondContact O-CB 3.38Å; S48-F51 PolarHBondContact O-N 3.32Å; S48-F51 PolarHBondContact OG-N 3.38Å; S48-C52 PolarHBondContact O-N 3.28Å | ||
| 49 | L | 60.8 | Low | 54.2 | Low | 145 Ų | 145 | 104.5 Ų | 104.5 | 76% | 0.759 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -52.4 | -30.7 | 176.4 | -128.3 | 162.4 | 0 | 0 | 0 | 111.3 | F47 C52 Q53 | F47-L49 PolarHBondContact O-N 3.29Å; L49-C52 PolarHBondContact O-N 3.06Å; L49-Q53 WeakPolarHBondContact O-CB 3.18Å; L49-Q53 PolarHBondContact O-N 3.4Å |
| 50 | Q | 59.4 | Low | 55.2 | Low | 145 Ų | 145 | 105.2 Ų | 105.2 | 68% | 0.678 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67 | -37.5 | 176.1 | -134.5 | 171 | 6 | 0 | 0 | 112.7 | S48 Q53 Q54 | S48-Q50 PolarHBondContact O-N 2.69Å; S48-Q50 VanDerWaalsContact OG-CB 3.28Å; S48-Q50 WeakPolarHBondContact OG-CB 3.46Å; S48-Q50 PolarHBondContact OG-N 3.01Å; Q50-Q53 PolarHBondContact O-N 3.34Å; Q50-Q54 PolarHBondContact O-N 3.38Å |
| 51 | F | 56 | Low | 55.7 | Low | 61 Ų | 61 | 104.5 Ų | 104.5 | 27% | 0.268 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -71.2 | -31.9 | 174.3 | -173.4 | -100.2 | 0 | 0 | 0 | 112.2 | P44 L46 S48 Q54 F55 | P44-F51 HydrophobicContact CB-CB 4.25Å; P44-F51 HydrophobicContact CG-CB 3.99Å; P44-F51 HydrophobicContact CG-CD2 4.05Å; P44-F51 HydrophobicContact CG-CG 4.48Å; L46-F51 HydrophobicContact CD2-CE1 4.09Å; L46-F51 HydrophobicContact CD2-CZ 4.13Å; S48-F51 WeakPolarHBondContact O-CA 3.42Å; S48-F51 WeakPolarHBondContact O-CB 3.38Å; S48-F51 PolarHBondContact O-N 3.32Å; S48-F51 PolarHBondContact OG-N 3.38Å; F51-Q54 WeakPolarHBondContact O-CG 3.49Å; F51-Q54 PolarHBondContact O-NE2 3.02Å; F51-Q54 VanDerWaalsContact O-NE2 3.14Å; F51-F55 AromaticContact CD1-CE2 3.91Å; F51-F55 HydrophobicContact CD1-CE2 3.91Å; F51-F55 AromaticContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CZ 4.21Å; F51-F55 HydrophobicContact CE2-CE2 4.25Å; F51-F55 HydrophobicContact CE2-CZ 4.39Å; F51-F55 HydrophobicContact CG-CE2 4.42Å; F51-F55 AromaticContact CZ-CE2 3.71Å; F51-F55 HydrophobicContact CZ-CE2 3.71Å; F51-F55 AromaticContact CZ-CZ 3.93Å; F51-F55 HydrophobicContact CZ-CZ 3.93Å; F51-F55 WeakPolarHBondContact O-CD2 3.44Å; F51-F55 VanDerWaalsContact O-CE2 3.22Å; F51-F55 WeakPolarHBondContact O-CE2 3.48Å |
| 52 | C | 56.2 | Low | 56.4 | Low | 56 Ų | 56 | 98.7 Ų | 98.7 | 38% | 0.378 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -72.2 | -40.7 | 170.1 | -70.8 | 0 | 0 | 0 | 0 | 111.2 | S48 L49 Q54 F55 F56 | S48-C52 PolarHBondContact O-N 3.28Å; L49-C52 PolarHBondContact O-N 3.06Å; C52-Q54 VanDerWaalsContact C-N 3.32Å; C52-Q54 PolarHBondContact O-N 3.41Å; C52-F55 PolarHBondContact O-N 3.45Å; C52-F56 VanDerWaalsContact O-CD2 3.26Å; C52-F56 WeakPolarHBondContact O-CD2 3.43Å; C52-F56 PolarHBondContact O-N 3.19Å |
| 53 | Q | 60.9 | Low | 57.1 | Low | 119 Ų | 119 | 90.8 Ų | 90.8 | 56% | 0.556 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.4 | -39.7 | -174.8 | -170.1 | 176.1 | -5.1 | 0 | 0 | 112.9 | L49 Q50 F55 F56 D57 | L49-Q53 WeakPolarHBondContact O-CB 3.18Å; L49-Q53 PolarHBondContact O-N 3.4Å; Q50-Q53 PolarHBondContact O-N 3.34Å; Q53-F55 PolarHBondContact O-N 2.78Å; Q53-F55 VanDerWaalsContact O-N 3.13Å; Q53-F56 PolarHBondContact O-N 3.1Å; Q53-D57 PolarHBondContact O-N 2.87Å |
| 54 | Q | 61.7 | Low | 57.6 | Low | 84 Ų | 84 | 90.1 Ų | 90.1 | 39% | 0.393 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.5 | -23.2 | 175.5 | 56.8 | 167.2 | -0.5 | 0 | 0 | 114.3 | Q50 F51 C52 | Q50-Q54 PolarHBondContact O-N 3.38Å; F51-Q54 WeakPolarHBondContact O-CG 3.49Å; F51-Q54 PolarHBondContact O-NE2 3.02Å; F51-Q54 VanDerWaalsContact O-NE2 3.14Å; C52-Q54 VanDerWaalsContact C-N 3.32Å; C52-Q54 PolarHBondContact O-N 3.41Å |
| 55 | F | 56.6 | Low | 57.9 | Low | 39 Ų | 39 | 95.9 Ų | 95.9 | 17% | 0.171 | 50% | 0.502 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.5 | -4.5 | 177.2 | -58.1 | -59.2 | 0 | 0 | 0 | 113.1 | F51 C52 Q53 P88 L90 L167 | F51-F55 AromaticContact CD1-CE2 3.91Å; F51-F55 HydrophobicContact CD1-CE2 3.91Å; F51-F55 AromaticContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CE2 3.53Å; F51-F55 HydrophobicContact CE1-CZ 4.21Å; F51-F55 HydrophobicContact CE2-CE2 4.25Å; F51-F55 HydrophobicContact CE2-CZ 4.39Å; F51-F55 HydrophobicContact CG-CE2 4.42Å; F51-F55 AromaticContact CZ-CE2 3.71Å; F51-F55 HydrophobicContact CZ-CE2 3.71Å; F51-F55 AromaticContact CZ-CZ 3.93Å; F51-F55 HydrophobicContact CZ-CZ 3.93Å; F51-F55 WeakPolarHBondContact O-CD2 3.44Å; F51-F55 VanDerWaalsContact O-CE2 3.22Å; F51-F55 WeakPolarHBondContact O-CE2 3.48Å; C52-F55 PolarHBondContact O-N 3.45Å; Q53-F55 PolarHBondContact O-N 2.78Å; Q53-F55 VanDerWaalsContact O-N 3.13Å; F55-P88 WeakPolarHBondContact CD1-O 3.38Å; F55-L90 PolarHBondContact O-N 3.29Å; F55-L90 VanDerWaalsContact O-N 3.08Å; F55-L167 HydrophobicContact CD1-CD2 3.66Å; F55-L167 HydrophobicContact CE1-CD2 3.38Å; F55-L167 HydrophobicContact CG-CD2 4.5Å; F55-L167 HydrophobicContact CZ-CD2 4.07Å |
| 56 | F | 58.2 | Low | 58 | Low | 92 Ų | 92 | 92.9 Ų | 92.9 | 40% | 0.404 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.4 | -8.2 | -178.4 | -80.2 | -104.8 | 0 | 0 | 0 | 113.4 | C52 Q53 V58 L90 F91 | C52-F56 VanDerWaalsContact O-CD2 3.26Å; C52-F56 WeakPolarHBondContact O-CD2 3.43Å; C52-F56 PolarHBondContact O-N 3.19Å; Q53-F56 PolarHBondContact O-N 3.1Å; F56-V58 PolarHBondContact O-N 3.49Å; F56-L90 HydrophobicContact CE2-CB 4.48Å; F56-F91 HydrophobicContact CD1-CB 4.36Å; F56-F91 AromaticContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CE1-CD2 4.34Å |
| 57 | D | 58.6 | Low | 58.3 | Low | 136 Ų | 136 | 88 Ų | 88 | 73% | 0.727 | 45% | 0.454 | S | S | * | . | trans | -86.8 | 79.2 | 178.3 | -162.4 | 21.9 | 0 | 0 | 0 | 111 | Q53 | Q53-D57 PolarHBondContact O-N 2.87Š| ||
| 58 | V | 56.2 | Low | 58.4 | Low | 33 Ų | 33 | 84 Ų | 84 | 20% | 0.2 | 44% | 0.441 | C | S | . | . | trans | -129.8 | 125.2 | -178.5 | -167.3 | 0 | 0 | 0 | 0 | 111.3 | F56 T60 V62 V63 D89 | F56-V58 PolarHBondContact O-N 3.49Å; V58-T60 PolarHBondContact O-N 3.17Å; V58-V62 HydrophobicContact CG1-CB 4.48Å; V58-V63 HydrophobicContact CB-CG2 4.33Å; V58-V63 HydrophobicContact CG1-CG2 3.69Å; V58-D89 HydrophobicContact CG2-CB 3.29Å | ||
| 59 | D | 58.6 | Low | 58.6 | Low | 128 Ų | 128 | 87.5 Ų | 87.5 | 68% | 0.684 | 45% | 0.451 | S | S | * | . | trans | -59.6 | 126.9 | 172.4 | -84 | -47.3 | 0 | 0 | 0 | 112 | A61 V62 V63 | D59-A61 PolarHBondContact O-N 3.16Å; D59-A61 VanDerWaalsContact O-N 3.1Å; D59-V62 HydrophobicContact CB-CG2 4.05Å; D59-V62 WeakPolarHBondContact O-CB 3.28Å; D59-V62 PolarHBondContact O-N 3.07Å; D59-V63 PolarHBondContact O-N 3.21Å | ||
| 60 | T | 57.7 | Low | 58.4 | Low | 107 Ų | 107 | 81.2 Ų | 81.2 | 66% | 0.656 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -57.4 | -32.1 | -176.2 | -32.9 | 0 | 0 | 0 | 0 | 112.5 | V58 V62 V63 V64 | V58-T60 PolarHBondContact O-N 3.17Å; T60-V62 VanDerWaalsContact C-N 3.32Å; T60-V62 PolarHBondContact O-N 3.45Å; T60-V63 WeakPolarHBondContact O-CB 3.12Å; T60-V63 PolarHBondContact O-N 3.23Å; T60-V64 WeakPolarHBondContact O-CG2 3.4Å; T60-V64 PolarHBondContact O-N 3.41Å; T60-V64 VanDerWaalsContact O-N 3.08Å |
| 61 | A | 52 | Low | 58.3 | Low | 78 Ų | 78 | 78.2 Ų | 78.2 | 65% | 0.645 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -64.8 | -34.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | D59 R65 | D59-A61 PolarHBondContact O-N 3.16Å; D59-A61 VanDerWaalsContact O-N 3.1Å; A61-R65 WeakPolarHBondContact O-CB 3.21Å; A61-R65 PolarHBondContact O-N 3.38Å; A61-R65 VanDerWaalsContact O-N 3.1Å |
| 62 | V | 60.2 | Low | 58.2 | Low | 59 Ų | 59 | 79.5 Ų | 79.5 | 36% | 0.358 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -69.2 | -42.5 | 176.9 | 177.9 | 0 | 0 | 0 | 0 | 110 | V58 D59 T60 R65 R66 | V58-V62 HydrophobicContact CG1-CB 4.48Å; D59-V62 HydrophobicContact CB-CG2 4.05Å; D59-V62 WeakPolarHBondContact O-CB 3.28Å; D59-V62 PolarHBondContact O-N 3.07Å; T60-V62 VanDerWaalsContact C-N 3.32Å; T60-V62 PolarHBondContact O-N 3.45Å; V62-R65 PolarHBondContact O-N 2.85Å; V62-R66 HydrophobicContact CG1-CG 4.34Å; V62-R66 WeakPolarHBondContact O-CB 3.27Å; V62-R66 VanDerWaalsContact O-CG 3.25Å; V62-R66 WeakPolarHBondContact O-CG 3.38Å; V62-R66 PolarHBondContact O-N 2.79Å |
| 63 | V | 57.7 | Low | 57.7 | Low | 20 Ų | 20 | 79.8 Ų | 79.8 | 12% | 0.121 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -58.8 | -49.8 | 177.2 | -176.8 | 0 | 0 | 0 | 0 | 110.6 | V58 D59 T60 R65 R66 V67 Y175 | V58-V63 HydrophobicContact CB-CG2 4.33Å; V58-V63 HydrophobicContact CG1-CG2 3.69Å; D59-V63 PolarHBondContact O-N 3.21Å; T60-V63 WeakPolarHBondContact O-CB 3.12Å; T60-V63 PolarHBondContact O-N 3.23Å; V63-R65 PolarHBondContact O-N 3.18Å; V63-R66 PolarHBondContact O-N 3.12Å; V63-V67 WeakPolarHBondContact O-CG2 3.43Å; V63-V67 PolarHBondContact O-N 3.4Å; V63-Y175 HydrophobicContact CB-CE1 4.43Å; V63-Y175 HydrophobicContact CG1-CE1 3.71Å |
| 64 | V | 57 | Low | 57 | Low | 88 Ų | 88 | 83.5 Ų | 83.5 | 53% | 0.533 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.7 | -42.9 | 179.2 | 174.6 | 0 | 0 | 0 | 0 | 111.3 | T60 R66 V67 L68 | T60-V64 WeakPolarHBondContact O-CG2 3.4Å; T60-V64 PolarHBondContact O-N 3.41Å; T60-V64 VanDerWaalsContact O-N 3.08Å; V64-R66 VanDerWaalsContact C-N 3.32Å; V64-R66 PolarHBondContact O-N 2.86Å; V64-V67 PolarHBondContact O-N 2.91Å; V64-L68 WeakPolarHBondContact O-CB 3.46Å; V64-L68 PolarHBondContact O-N 3.11Å |
| 65 | R | 57.9 | Low | 56.3 | Low | 169 Ų | 169 | 86.5 Ų | 86.5 | 64% | 0.638 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -62.3 | -41.8 | 178.1 | -155.1 | -171.9 | -147.8 | -172.4 | 10.2 | 111.4 | A61 V62 V63 L68 Y69 | A61-R65 WeakPolarHBondContact O-CB 3.21Å; A61-R65 PolarHBondContact O-N 3.38Å; A61-R65 VanDerWaalsContact O-N 3.1Å; V62-R65 PolarHBondContact O-N 2.85Å; V63-R65 PolarHBondContact O-N 3.18Å; R65-L68 PolarHBondContact O-N 3Å; R65-Y69 HydrophobicContact CG-CD2 4Å; R65-Y69 HydrophobicContact CG-CE2 3.57Å; R65-Y69 WeakPolarHBondContact O-CD2 3.45Å; R65-Y69 PolarHBondContact O-N 3.42Å |
| 66 | R | 62.2 | Low | 55.6 | Low | 33 Ų | 33 | 91.9 Ų | 91.9 | 13% | 0.125 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -66.3 | -40.8 | 177 | -74.3 | 173.7 | 173.7 | -178.9 | -3.1 | 112.2 | V62 V63 V64 Y69 S70 S83 D89 Y175 | V62-R66 HydrophobicContact CG1-CG 4.34Å; V62-R66 WeakPolarHBondContact O-CB 3.27Å; V62-R66 VanDerWaalsContact O-CG 3.25Å; V62-R66 WeakPolarHBondContact O-CG 3.38Å; V62-R66 PolarHBondContact O-N 2.79Å; V63-R66 PolarHBondContact O-N 3.12Å; V64-R66 VanDerWaalsContact C-N 3.32Å; V64-R66 PolarHBondContact O-N 2.86Å; R66-Y69 PolarHBondContact O-N 2.87Å; R66-S70 PolarHBondContact O-N 3.32Å; R66-S70 PolarHBondContact O-OG 2.95Å; R66-S83 PolarHBondContact NH2-O 3.35Å; R66-D89 IonicContact CZ-OD1 3.85Å; R66-D89 IonicContact NH1-OD1 2.68Å; R66-D89 PolarHBondContact NH1-OD1 3.13Å; R66-D89 IonicContact NH1-OD2 3.52Å; R66-Y175 HydrophobicContact CB-CD1 4.21Å; R66-Y175 HydrophobicContact CB-CE1 4.12Å |
| 67 | V | 63.8 | Low | 54.9 | Low | 31 Ų | 31 | 94.2 Ų | 94.2 | 19% | 0.188 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -59.8 | -48.7 | 171.8 | 166.3 | 0 | 0 | 0 | 0 | 110.9 | V63 V64 Y69 S70 M71 I96 Y175 | V63-V67 WeakPolarHBondContact O-CG2 3.43Å; V63-V67 PolarHBondContact O-N 3.4Å; V64-V67 PolarHBondContact O-N 2.91Å; V67-Y69 VanDerWaalsContact C-N 3.28Å; V67-Y69 PolarHBondContact O-N 3.26Å; V67-S70 WeakPolarHBondContact CA-OG 3.48Å; V67-S70 PolarHBondContact O-N 2.9Å; V67-S70 VanDerWaalsContact O-N 3.11Å; V67-S70 PolarHBondContact O-OG 3.28Å; V67-M71 PolarHBondContact O-N 3.3Å; V67-I96 HydrophobicContact CG2-CD1 3.87Å; V67-Y175 HydrophobicContact CG2-CD1 3.76Å; V67-Y175 HydrophobicContact CG2-CE1 4.17Å |
| 68 | L | 57.6 | Low | 54.5 | Low | 117 Ų | 117 | 92.1 Ų | 92.1 | 61% | 0.613 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -61.7 | -39 | -178.4 | -143.6 | 85.6 | 0 | 0 | 0 | 111.9 | V64 R65 V72 | V64-L68 WeakPolarHBondContact O-CB 3.46Å; V64-L68 PolarHBondContact O-N 3.11Å; R65-L68 PolarHBondContact O-N 3Å; L68-V72 PolarHBondContact O-N 3.39Å |
| 69 | Y | 61.8 | Low | 54.1 | Low | 98 Ų | 98 | 93.8 Ų | 93.8 | 38% | 0.384 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -75.5 | -24.9 | 176.9 | -74.5 | -54.9 | 0 | 0 | 0 | 114.3 | R65 R66 V67 F79 | R65-Y69 HydrophobicContact CG-CD2 4Å; R65-Y69 HydrophobicContact CG-CE2 3.57Å; R65-Y69 WeakPolarHBondContact O-CD2 3.45Å; R65-Y69 PolarHBondContact O-N 3.42Å; R66-Y69 PolarHBondContact O-N 2.87Å; V67-Y69 VanDerWaalsContact C-N 3.28Å; V67-Y69 PolarHBondContact O-N 3.26Å; Y69-F79 AromaticContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CG-CE2 4.22Å; Y69-F79 AromaticContact CG-CZ 3.73Å; Y69-F79 HydrophobicContact CG-CZ 3.73Å |
| 70 | S | 57.1 | Low | 53.7 | Low | 12 Ų | 12 | 87.8 Ų | 87.8 | 8% | 0.084 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -79.2 | -24.6 | 174.4 | 34.3 | 0 | 0 | 0 | 0 | 112.3 | R66 V67 | R66-S70 PolarHBondContact O-N 3.32Å; R66-S70 PolarHBondContact O-OG 2.95Å; V67-S70 WeakPolarHBondContact CA-OG 3.48Å; V67-S70 PolarHBondContact O-N 2.9Å; V67-S70 VanDerWaalsContact O-N 3.11Å; V67-S70 PolarHBondContact O-OG 3.28Å |
| 71 | M | 56.5 | Low | 53.2 | Low | 83 Ų | 83 | 86 Ų | 86 | 41% | 0.409 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -74.1 | -25.8 | 170.9 | -69.9 | -171.9 | 71.9 | 0 | 0 | 113.9 | V67 V179 P182 | V67-M71 PolarHBondContact O-N 3.3Å; M71-V179 HydrophobicContact CG-CG2 3.86Å; M71-P182 HydrophobicContact CE-CG 4.45Å |
| 72 | V | 52.8 | Low | 53 | Low | 87 Ų | 87 | 90.1 Ų | 90.1 | 53% | 0.527 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -116.8 | 99.7 | -178.4 | -175.2 | 0 | 0 | 0 | 0 | 109.4 | L68 R74 | L68-V72 PolarHBondContact O-N 3.39Å; V72-R74 VanDerWaalsContact C-N 3.35Å; V72-R74 PolarHBondContact O-N 3.04Å |
| 73 | P | 46.8 | Very low | 52.4 | Low | 63 Ų | 63 | 89.5 Ų | 89.5 | 41% | 0.409 | 45% | 0.446 | S | S | . | . | trans | -71.1 | 90.8 | -177.4 | 29 | -32 | 0 | 0 | 0 | 109.3 | L75 L212 | P73-L75 PolarHBondContact O-N 3.25Å; P73-L75 VanDerWaalsContact O-N 3.12Å; P73-L212 HydrophobicContact CB-CD1 4.43Å | ||
| 74 | R | 46.6 | Very low | 52.1 | Low | 196 Ų | 196 | 88.9 Ų | 88.9 | 74% | 0.74 | 44% | 0.442 | S | S | * | . | trans | -74.4 | 98.8 | 161.5 | -77.6 | -168.9 | 174.7 | -178.6 | -0.2 | 107.4 | V72 N76 | V72-R74 VanDerWaalsContact C-N 3.35Å; V72-R74 PolarHBondContact O-N 3.04Å; R74-N76 PolarHBondContact O-N 3.25Å | ||
| 75 | L | 45.8 | Very low | 51.6 | Low | 148 Ų | 148 | 92.8 Ų | 92.8 | 78% | 0.775 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -0.2 | -176.7 | -76.5 | 106.1 | 0 | 0 | 0 | 117 | P73 | P73-L75 PolarHBondContact O-N 3.25Å; P73-L75 VanDerWaalsContact O-N 3.12Å |
| 76 | N | 43.4 | Very low | 51.4 | Low | 151 Ų | 151 | 89.3 Ų | 89.3 | 81% | 0.807 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122 | 8.2 | -163.7 | -106.7 | -4.3 | 0 | 0 | 0 | 116.5 | R74 | R74-N76 PolarHBondContact O-N 3.25Š|
| 77 | M | 43 | Very low | 51.1 | Low | 141 Ų | 141 | 93.8 Ų | 93.8 | 70% | 0.695 | 47% | 0.469 | S | S | * | . | S | Bend | trans | -137.2 | 121.9 | -180 | -68.7 | -82.3 | 160.3 | 0 | 0 | 110.4 | F79 | M77-F79 PolarHBondContact O-N 2.91Š|
| 78 | N | 49.8 | Very low | 51 | Low | 93 Ų | 93 | 93.5 Ų | 93.5 | 50% | 0.497 | 47% | 0.468 | S | S | . | . | trans | -61.4 | 92.8 | 176.6 | -72.1 | -41 | 0 | 0 | 0 | 110.3 | I80 T81 P216 | N78-I80 PolarHBondContact O-N 3.49Å; N78-I80 VanDerWaalsContact O-N 3.13Å; N78-T81 PolarHBondContact O-N 2.93Å; N78-T81 VanDerWaalsContact O-N 3.14Å; N78-P216 WeakPolarHBondContact OD1-CG 3.27Å | ||
| 79 | F | 48.1 | Very low | 51.7 | Low | 68 Ų | 68 | 88 Ų | 88 | 30% | 0.298 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -53.9 | -36.1 | -174.3 | -129.1 | -87.8 | 0 | 0 | 0 | 113.3 | Y69 M77 S83 | Y69-F79 AromaticContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CD2-CZ 3.96Å; Y69-F79 HydrophobicContact CG-CE2 4.22Å; Y69-F79 AromaticContact CG-CZ 3.73Å; Y69-F79 HydrophobicContact CG-CZ 3.73Å; M77-F79 PolarHBondContact O-N 2.91Å; F79-S83 PolarHBondContact O-N 2.81Å |
| 80 | I | 49.4 | Very low | 52.2 | Low | 2 Ų | 2 | 85.8 Ų | 85.8 | 1% | 0.01 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -75.3 | -37.7 | -177.4 | -54.2 | -165.3 | 0 | 0 | 0 | 112.2 | N78 Q82 I84 Y164 | N78-I80 PolarHBondContact O-N 3.49Å; N78-I80 VanDerWaalsContact O-N 3.13Å; I80-Q82 PolarHBondContact O-N 3.38Å; I80-I84 HydrophobicContact CG1-CD1 4.23Å; I80-I84 HydrophobicContact CG2-CB 4.49Å; I80-I84 HydrophobicContact CG2-CD1 4.44Å; I80-Y164 HydrophobicContact CB-CD1 4.45Å; I80-Y164 HydrophobicContact CB-CE1 3.76Å; I80-Y164 HydrophobicContact CD1-CD1 4.19Å; I80-Y164 HydrophobicContact CD1-CD2 3.98Å; I80-Y164 HydrophobicContact CD1-CE1 4.02Å; I80-Y164 HydrophobicContact CD1-CE2 3.75Å; I80-Y164 HydrophobicContact CD1-CG 4.19Å; I80-Y164 HydrophobicContact CG1-CE1 4.45Å; I80-Y164 HydrophobicContact CG2-CD1 3.56Å; I80-Y164 HydrophobicContact CG2-CE1 3.23Å; I80-Y164 HydrophobicContact CG2-CG 4.49Å |
| 81 | T | 48.7 | Very low | 53.1 | Low | 69 Ų | 69 | 88.2 Ų | 88.2 | 42% | 0.423 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -71.7 | -31.7 | -174.5 | -49.8 | 0 | 0 | 0 | 0 | 112.9 | N78 | N78-T81 PolarHBondContact O-N 2.93Å; N78-T81 VanDerWaalsContact O-N 3.14Å |
| 82 | Q | 46.5 | Very low | 54.1 | Low | 165 Ų | 165 | 84.3 Ų | 84.3 | 77% | 0.771 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -109.6 | -15 | -170.1 | -156.5 | 148.3 | -5.2 | 0 | 0 | 114.9 | I80 | I80-Q82 PolarHBondContact O-N 3.38Å |
| 83 | S | 48.3 | Very low | 55.6 | Low | 46 Ų | 46 | 80.7 Ų | 80.7 | 32% | 0.322 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -117.2 | -18.4 | -179.5 | -72.6 | 0 | 0 | 0 | 0 | 115.7 | R66 F79 | R66-S83 PolarHBondContact NH2-O 3.35Å; F79-S83 PolarHBondContact O-N 2.81Å |
| 84 | I | 50.7 | Low | 57.5 | Low | 7 Ų | 7 | 81.9 Ų | 81.9 | 4% | 0.036 | 40% | 0.4 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.1 | -23.3 | -170 | -56 | -178.7 | 0 | 0 | 0 | 113 | I80 P86 H87 P88 E168 | I80-I84 HydrophobicContact CG1-CD1 4.23Å; I80-I84 HydrophobicContact CG2-CB 4.49Å; I80-I84 HydrophobicContact CG2-CD1 4.44Å; I84-P86 VanDerWaalsContact C-CD 3.45Å; I84-H87 PolarHBondContact O-N 3.14Å; I84-P88 HydrophobicContact CG2-CB 4.11Å; I84-E168 HydrophobicContact CG2-CB 4.28Å; I84-E168 HydrophobicContact CG2-CG 3.81Å |
| 85 | R | 46.3 | Very low | 59.5 | Low | 169 Ų | 169 | 78 Ų | 78 | 64% | 0.638 | 39% | 0.386 | S | S | * | . | S | Bend | trans | -64.1 | -22.5 | -171.3 | -73.1 | -152.1 | -165.9 | -126.9 | 6.3 | 118 | ||
| 86 | P | 53.7 | Low | 61.5 | Low | 97 Ų | 97 | 71.5 Ų | 71.5 | 63% | 0.63 | 35% | 0.352 | S | S | * | . | S | Bend | trans | -76.3 | -45.1 | 176.5 | -15.3 | 29.7 | 0 | 0 | 0 | 112.4 | I84 | I84-P86 VanDerWaalsContact C-CD 3.45Š|
| 87 | H | 56.6 | Low | 63.8 | Low | 126 Ų | 126 | 64.3 Ų | 64.3 | 58% | 0.583 | 31% | 0.314 | S | S | * | . | trans | -152.3 | 96.2 | -175.6 | -67 | -67.9 | 0 | 0 | 0 | 111.1 | I84 D89 | I84-H87 PolarHBondContact O-N 3.14Å; H87-D89 PolarHBondContact O-N 3.45Å | ||
| 88 | P | 62.4 | Low | 66.2 | Low | 26 Ų | 26 | 60.9 Ų | 60.9 | 17% | 0.169 | 30% | 0.298 | C | S | . | . | trans | -67.3 | 119.7 | 171.3 | 26 | -34.3 | 0 | 0 | 0 | 110.2 | F55 I84 L167 E168 | F55-P88 WeakPolarHBondContact CD1-O 3.38Å; I84-P88 HydrophobicContact CG2-CB 4.11Å; P88-L167 HydrophobicContact CB-CD2 3.63Å; P88-L167 HydrophobicContact CB-CG 4.22Å; P88-L167 HydrophobicContact CG-CD2 3.51Å; P88-L167 WeakPolarHBondContact O-CD2 3.25Å; P88-E168 HydrophobicContact CB-CG 4.25Å | ||
| 89 | D | 70.6 | Confident | 68.3 | Low | 2 Ų | 2 | 59.3 Ų | 59.3 | 1% | 0.011 | 29% | 0.291 | C | S | . | . | trans | -107.5 | 140.8 | -172 | 54.4 | -51.8 | 0 | 0 | 0 | 113.4 | V58 R66 H87 C171 Y175 | V58-D89 HydrophobicContact CG2-CB 3.29Å; R66-D89 IonicContact CZ-OD1 3.85Å; R66-D89 IonicContact NH1-OD1 2.68Å; R66-D89 PolarHBondContact NH1-OD1 3.13Å; R66-D89 IonicContact NH1-OD2 3.52Å; H87-D89 PolarHBondContact O-N 3.45Å; D89-C171 PolarHBondContact O-SG 3.01Å; D89-C171 VanDerWaalsContact O-SG 3.38Å; D89-C171 PolarHBondContact OD1-SG 3.3Å; D89-Y175 PolarHBondContact OD2-OH 3Å | ||
| 90 | L | 73.8 | Confident | 70.4 | Confident | 51 Ų | 51 | 56.6 Ų | 56.6 | 27% | 0.267 | 28% | 0.28 | S | S | . | . | S | Bend | trans | -98 | -15.3 | 176.8 | -141 | 77.8 | 0 | 0 | 0 | 112.6 | F55 F56 P93 F94 L167 I170 | F55-L90 PolarHBondContact O-N 3.29Å; F55-L90 VanDerWaalsContact O-N 3.08Å; F56-L90 HydrophobicContact CE2-CB 4.48Å; L90-P93 WeakPolarHBondContact O-CD 3.46Å; L90-F94 WeakPolarHBondContact O-CB 3.48Å; L90-F94 PolarHBondContact O-N 3.36Å; L90-L167 HydrophobicContact CD1-CD1 3.67Å; L90-L167 HydrophobicContact CD1-CG 4.41Å; L90-I170 HydrophobicContact CD1-CG2 4.03Å |
| 91 | F | 75.3 | Confident | 72.6 | Confident | 63 Ų | 63 | 57.5 Ų | 57.5 | 28% | 0.276 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -56.7 | -52.5 | 178.2 | -172.7 | -91.2 | 0 | 0 | 0 | 111.5 | F56 F94 W95 | F56-F91 HydrophobicContact CD1-CB 4.36Å; F56-F91 AromaticContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CD1-CD2 3.72Å; F56-F91 HydrophobicContact CE1-CD2 4.34Å; F91-F94 PolarHBondContact O-N 2.88Å; F91-W95 AromaticContact CD1-CD1 3.47Å; F91-W95 VanDerWaalsContact CD1-CD1 3.47Å; F91-W95 HydrophobicContact CD1-CG 4.46Å; F91-W95 AromaticContact CD2-CD1 3.49Å; F91-W95 VanDerWaalsContact CD2-CD1 3.49Å; F91-W95 AromaticContact CD2-NE1 3.29Å; F91-W95 VanDerWaalsContact CD2-NE1 3.29Å; F91-W95 AromaticContact CE1-CD1 3.35Å; F91-W95 HydrophobicContact CE1-CG 4.16Å; F91-W95 AromaticContact CE1-NE1 3.72Å; F91-W95 AromaticContact CE2-CD1 3.4Å; F91-W95 VanDerWaalsContact CE2-CD1 3.4Å; F91-W95 AromaticContact CE2-CE2 3.92Å; F91-W95 AromaticContact CE2-NE1 2.9Å; F91-W95 AromaticContact CG-CD1 3.53Å; F91-W95 AromaticContact CG-NE1 3.86Å; F91-W95 AromaticContact CZ-CD1 3.31Å; F91-W95 AromaticContact CZ-CE2 3.95Å; F91-W95 HydrophobicContact CZ-CG 4.22Å; F91-W95 AromaticContact CZ-NE1 3.13Å; F91-W95 PolarHBondContact O-N 3.4Å |
| 92 | G | 77.6 | Confident | 74.7 | Confident | 1 Ų | 1 | 61.1 Ų | 61.1 | 1% | 0.01 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -53.9 | -61 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113 | F94 W95 I96 | G92-F94 VanDerWaalsContact C-N 3.31Å; G92-F94 PolarHBondContact O-N 2.94Å; G92-W95 PolarHBondContact O-N 2.8Å; G92-I96 WeakPolarHBondContact O-CB 3.27Å; G92-I96 WeakPolarHBondContact O-CG1 3.35Å; G92-I96 PolarHBondContact O-N 3.41Å |
| 93 | P | 84 | Confident | 77 | Confident | 10 Ų | 10 | 54.2 Ų | 54.2 | 7% | 0.065 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -52.4 | -44.4 | 178.1 | -29.6 | 34.8 | 0 | 0 | 0 | 114.4 | L90 A97 I170 | L90-P93 WeakPolarHBondContact O-CD 3.46Å; P93-A97 WeakPolarHBondContact O-CB 3.36Å; P93-A97 PolarHBondContact O-N 3.48Å; P93-I170 HydrophobicContact CB-CG2 4.35Å; P93-I170 HydrophobicContact CG-CG2 4.48Å |
| 94 | F | 87.2 | Confident | 79.1 | Confident | 88 Ų | 88 | 52.3 Ų | 52.3 | 39% | 0.386 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -64.9 | -48.1 | -178.6 | 175.6 | -101.3 | 0 | 0 | 0 | 111.8 | L90 F91 G92 A97 L98 F141 | L90-F94 WeakPolarHBondContact O-CB 3.48Å; L90-F94 PolarHBondContact O-N 3.36Å; F91-F94 PolarHBondContact O-N 2.88Å; G92-F94 VanDerWaalsContact C-N 3.31Å; G92-F94 PolarHBondContact O-N 2.94Å; F94-A97 PolarHBondContact O-N 3.31Å; F94-L98 PolarHBondContact O-N 3.26Å; F94-F141 HydrophobicContact CD2-CE1 4.15Å; F94-F141 HydrophobicContact CD2-CZ 4.43Å; F94-F141 HydrophobicContact CE2-CE1 4.4Å; F94-F141 HydrophobicContact CE2-CZ 4.31Å |
| 95 | W | 87.6 | Confident | 81.1 | Confident | 114 Ų | 114 | 53.6 Ų | 53.6 | 43% | 0.432 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -71.1 | -34.1 | 179.9 | -75.5 | 107.4 | 0 | 0 | 0 | 113.1 | F91 G92 L98 T99 | F91-W95 AromaticContact CD1-CD1 3.47Å; F91-W95 VanDerWaalsContact CD1-CD1 3.47Å; F91-W95 HydrophobicContact CD1-CG 4.46Å; F91-W95 AromaticContact CD2-CD1 3.49Å; F91-W95 VanDerWaalsContact CD2-CD1 3.49Å; F91-W95 AromaticContact CD2-NE1 3.29Å; F91-W95 VanDerWaalsContact CD2-NE1 3.29Å; F91-W95 AromaticContact CE1-CD1 3.35Å; F91-W95 HydrophobicContact CE1-CG 4.16Å; F91-W95 AromaticContact CE1-NE1 3.72Å; F91-W95 AromaticContact CE2-CD1 3.4Å; F91-W95 VanDerWaalsContact CE2-CD1 3.4Å; F91-W95 AromaticContact CE2-CE2 3.92Å; F91-W95 AromaticContact CE2-NE1 2.9Å; F91-W95 AromaticContact CG-CD1 3.53Å; F91-W95 AromaticContact CG-NE1 3.86Å; F91-W95 AromaticContact CZ-CD1 3.31Å; F91-W95 AromaticContact CZ-CE2 3.95Å; F91-W95 HydrophobicContact CZ-CG 4.22Å; F91-W95 AromaticContact CZ-NE1 3.13Å; F91-W95 PolarHBondContact O-N 3.4Å; G92-W95 PolarHBondContact O-N 2.8Å; W95-L98 HydrophobicContact CE3-CD2 3.77Å; W95-L98 HydrophobicContact CZ3-CD2 3.6Å; W95-L98 PolarHBondContact O-N 2.78Å; W95-T99 WeakPolarHBondContact O-CB 3.38Å; W95-T99 WeakPolarHBondContact O-CG2 3.39Å; W95-T99 PolarHBondContact O-N 2.82Å; W95-T99 PolarHBondContact O-OG1 3.43Å |
| 96 | I | 88.7 | Confident | 83.2 | Confident | 12 Ų | 12 | 48.3 Ų | 48.3 | 6% | 0.062 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.8 | -43.6 | 172.9 | -69.4 | 168.9 | 0 | 0 | 0 | 110.1 | V67 G92 L98 T99 L100 G174 Y175 L177 I181 | V67-I96 HydrophobicContact CG2-CD1 3.87Å; G92-I96 WeakPolarHBondContact O-CB 3.27Å; G92-I96 WeakPolarHBondContact O-CG1 3.35Å; G92-I96 PolarHBondContact O-N 3.41Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.12Å; I96-T99 WeakPolarHBondContact CA-OG1 3.12Å; I96-T99 PolarHBondContact O-N 3.01Å; I96-T99 PolarHBondContact O-OG1 3.39Å; I96-L100 WeakPolarHBondContact O-CB 3.28Å; I96-L100 PolarHBondContact O-N 3.41Å; I96-G174 WeakPolarHBondContact CG2-O 3.43Å; I96-Y175 HydrophobicContact CD1-CD1 3.68Å; I96-Y175 HydrophobicContact CD1-CE1 4.16Å; I96-Y175 HydrophobicContact CD1-CG 4.4Å; I96-L177 HydrophobicContact CG2-CB 3.92Å; I96-I181 HydrophobicContact CG2-CD1 4.38Å |
| 97 | A | 92.4 | Very high | 84.9 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.008 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.9 | -41.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | P93 F94 L100 L101 I140 F141 | P93-A97 WeakPolarHBondContact O-CB 3.36Å; P93-A97 PolarHBondContact O-N 3.48Å; F94-A97 PolarHBondContact O-N 3.31Å; A97-L100 PolarHBondContact O-N 3.36Å; A97-L101 PolarHBondContact O-N 2.91Å; A97-I140 HydrophobicContact CB-CG2 4Å; A97-F141 HydrophobicContact CB-CD1 4.19Å; A97-F141 HydrophobicContact CB-CE1 3.73Å; A97-F141 HydrophobicContact CB-CZ 4.03Å |
| 98 | L | 92.8 | Very high | 86.4 | Confident | 68 Ų | 68 | 39.6 Ų | 39.6 | 36% | 0.356 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -67.4 | -44.8 | 179 | -170.9 | 68.1 | 0 | 0 | 0 | 112.6 | F94 W95 I96 L100 L101 F102 | F94-L98 PolarHBondContact O-N 3.26Å; W95-L98 HydrophobicContact CE3-CD2 3.77Å; W95-L98 HydrophobicContact CZ3-CD2 3.6Å; W95-L98 PolarHBondContact O-N 2.78Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.12Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L98-L101 WeakPolarHBondContact O-CB 3.33Å; L98-L101 PolarHBondContact O-N 3.1Å; L98-F102 PolarHBondContact O-N 2.8Å |
| 99 | T | 93 | Very high | 87.6 | Confident | 60 Ų | 60 | 41.2 Ų | 41.2 | 37% | 0.368 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -65.8 | -36.8 | 176.4 | 47.6 | 0 | 0 | 0 | 0 | 111.7 | W95 I96 F102 T103 | W95-T99 WeakPolarHBondContact O-CB 3.38Å; W95-T99 WeakPolarHBondContact O-CG2 3.39Å; W95-T99 PolarHBondContact O-N 2.82Å; W95-T99 PolarHBondContact O-OG1 3.43Å; I96-T99 WeakPolarHBondContact CA-OG1 3.12Å; I96-T99 PolarHBondContact O-N 3.01Å; I96-T99 PolarHBondContact O-OG1 3.39Å; T99-F102 PolarHBondContact O-N 3.25Å; T99-T103 WeakPolarHBondContact O-CB 3.46Å; T99-T103 WeakPolarHBondContact O-CG2 3.41Å; T99-T103 PolarHBondContact O-N 3.08Å; T99-T103 PolarHBondContact O-OG1 3.36Å |
| 100 | L | 93.3 | Very high | 88.5 | Confident | 11 Ų | 11 | 44.9 Ų | 44.9 | 6% | 0.058 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.9 | -45.3 | 171.7 | 177.2 | 57.2 | 0 | 0 | 0 | 111.7 | I96 A97 L98 F102 T103 A104 I140 F180 I181 | I96-L100 WeakPolarHBondContact O-CB 3.28Å; I96-L100 PolarHBondContact O-N 3.41Å; A97-L100 PolarHBondContact O-N 3.36Å; L98-L100 VanDerWaalsContact C-N 3.32Å; L100-F102 VanDerWaalsContact C-N 3.33Å; L100-F102 PolarHBondContact O-N 2.92Å; L100-T103 WeakPolarHBondContact CA-OG1 3.5Å; L100-T103 PolarHBondContact O-N 3.26Å; L100-T103 PolarHBondContact O-OG1 2.96Å; L100-T103 VanDerWaalsContact O-OG1 3.07Å; L100-A104 WeakPolarHBondContact O-CB 3.11Å; L100-A104 PolarHBondContact O-N 3.35Å; L100-I140 HydrophobicContact CD2-CD1 4.37Å; L100-I140 HydrophobicContact CD2-CG1 4.25Å; L100-I140 HydrophobicContact CD2-CG2 4.01Å; L100-I140 HydrophobicContact CG-CD1 4.01Å; L100-I140 HydrophobicContact CG-CG1 4.43Å; L100-F180 HydrophobicContact CD1-CB 3.48Å; L100-F180 VanDerWaalsContact CD1-CB 3.48Å; L100-F180 WeakPolarHBondContact CD1-O 3.5Å; L100-F180 HydrophobicContact CD2-CB 3.68Å; L100-F180 HydrophobicContact CD2-CG 4.39Å; L100-F180 HydrophobicContact CG-CB 4.23Å; L100-I181 HydrophobicContact CB-CG1 4.3Å |
| 101 | L | 95 | Very high | 89.1 | Confident | 22 Ų | 22 | 42.5 Ų | 42.5 | 12% | 0.115 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -59.3 | -46 | 176.4 | 175.2 | 62.1 | 0 | 0 | 0 | 111.4 | A97 L98 A104 C105 V133 M136 A137 I140 | A97-L101 PolarHBondContact O-N 2.91Å; L98-L101 WeakPolarHBondContact O-CB 3.33Å; L98-L101 PolarHBondContact O-N 3.1Å; L101-A104 PolarHBondContact O-N 3.47Å; L101-C105 PolarHBondContact O-N 2.85Å; L101-C105 PolarHBondContact O-SG 3.18Å; L101-V133 HydrophobicContact CD1-CG1 4.46Å; L101-M136 HydrophobicContact CD1-CB 3.77Å; L101-A137 HydrophobicContact CD1-CB 3.98Å; L101-A137 HydrophobicContact CD2-CB 3.64Å; L101-A137 HydrophobicContact CG-CB 4.46Å; L101-I140 HydrophobicContact CB-CD1 3.94Å; L101-I140 HydrophobicContact CD1-CD1 4.08Å |
| 102 | F | 93.3 | Very high | 89.6 | Confident | 144 Ų | 144 | 43.9 Ų | 43.9 | 63% | 0.632 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -61.8 | -51.4 | 178.5 | 179.5 | -99.4 | 0 | 0 | 0 | 111.7 | L98 T99 L100 A104 C105 V106 | L98-F102 PolarHBondContact O-N 2.8Å; T99-F102 PolarHBondContact O-N 3.25Å; L100-F102 VanDerWaalsContact C-N 3.33Å; L100-F102 PolarHBondContact O-N 2.92Å; F102-A104 VanDerWaalsContact C-N 3.32Å; F102-A104 PolarHBondContact O-N 3.46Å; F102-C105 PolarHBondContact O-N 3.45Å; F102-V106 HydrophobicContact CD1-CG2 4.29Å; F102-V106 HydrophobicContact CE1-CG2 3.86Å; F102-V106 HydrophobicContact CE2-CG2 4.26Å; F102-V106 HydrophobicContact CZ-CG2 3.84Å; F102-V106 WeakPolarHBondContact O-CG2 3.46Å; F102-V106 PolarHBondContact O-N 3.05Å |
| 103 | T | 93.8 | Very high | 89.9 | Confident | 20 Ų | 20 | 47.4 Ų | 47.4 | 12% | 0.123 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.5 | -34.8 | 179.5 | 50.2 | 0 | 0 | 0 | 0 | 112.8 | T99 L100 V106 G107 I181 S184 L185 | T99-T103 WeakPolarHBondContact O-CB 3.46Å; T99-T103 WeakPolarHBondContact O-CG2 3.41Å; T99-T103 PolarHBondContact O-N 3.08Å; T99-T103 PolarHBondContact O-OG1 3.36Å; L100-T103 WeakPolarHBondContact CA-OG1 3.5Å; L100-T103 PolarHBondContact O-N 3.26Å; L100-T103 PolarHBondContact O-OG1 2.96Å; L100-T103 VanDerWaalsContact O-OG1 3.07Å; T103-V106 PolarHBondContact O-N 3.25Å; T103-G107 PolarHBondContact O-N 2.99Å; T103-I181 HydrophobicContact CG2-CG2 4.01Å; T103-S184 VanDerWaalsContact CB-OG 3.24Å; T103-S184 WeakPolarHBondContact CB-OG 3.36Å; T103-S184 PolarHBondContact OG1-OG 3.33Å; T103-L185 HydrophobicContact CG2-CD2 4.24Å; T103-L185 HydrophobicContact CG2-CG 4.41Å |
| 104 | A | 92.9 | Very high | 90 | Very high | 7 Ų | 7 | 49.9 Ų | 49.9 | 6% | 0.058 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.3 | -40.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L100 L101 F102 N108 W187 | L100-A104 WeakPolarHBondContact O-CB 3.11Å; L100-A104 PolarHBondContact O-N 3.35Å; L101-A104 PolarHBondContact O-N 3.47Å; F102-A104 VanDerWaalsContact C-N 3.32Å; F102-A104 PolarHBondContact O-N 3.46Å; A104-N108 WeakPolarHBondContact O-CB 3.49Å; A104-N108 PolarHBondContact O-N 2.95Å; A104-W187 HydrophobicContact CB-CZ3 4.45Å |
| 105 | C | 92.3 | Very high | 89.9 | Confident | 33 Ų | 33 | 50.1 Ų | 50.1 | 22% | 0.223 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.2 | -47 | 174.6 | -67.8 | 0 | 0 | 0 | 0 | 111.2 | L101 F102 N108 Q109 | L101-C105 PolarHBondContact O-N 2.85Å; L101-C105 PolarHBondContact O-SG 3.18Å; F102-C105 PolarHBondContact O-N 3.45Å; C105-N108 PolarHBondContact O-N 2.92Å; C105-Q109 WeakPolarHBondContact O-CB 3.41Å; C105-Q109 PolarHBondContact O-N 3.42Å |
| 106 | V | 90.5 | Very high | 89.8 | Confident | 58 Ų | 58 | 45.7 Ų | 45.7 | 35% | 0.352 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.1 | -46.7 | 177.5 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | F102 T103 N108 Q109 L110 | F102-V106 HydrophobicContact CD1-CG2 4.29Å; F102-V106 HydrophobicContact CE1-CG2 3.86Å; F102-V106 HydrophobicContact CE2-CG2 4.26Å; F102-V106 HydrophobicContact CZ-CG2 3.84Å; F102-V106 WeakPolarHBondContact O-CG2 3.46Å; F102-V106 PolarHBondContact O-N 3.05Å; T103-V106 PolarHBondContact O-N 3.25Å; V106-N108 VanDerWaalsContact C-N 3.35Å; V106-N108 PolarHBondContact O-N 3.02Å; V106-Q109 PolarHBondContact O-N 2.69Å; V106-L110 WeakPolarHBondContact O-CB 3.04Å; V106-L110 PolarHBondContact O-N 3.11Å |
| 107 | G | 90.1 | Very high | 89.6 | Confident | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.01 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.6 | -42.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | T103 L110 G111 A188 | T103-G107 PolarHBondContact O-N 2.99Å; G107-L110 PolarHBondContact O-N 2.74Å; G107-G111 PolarHBondContact O-N 3.32Å; G107-A188 WeakPolarHBondContact O-CA 3.26Å |
| 108 | N | 88.4 | Confident | 89.2 | Confident | 39 Ų | 39 | 57.3 Ų | 57.3 | 21% | 0.209 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.2 | -46.3 | 174.4 | -170.8 | 74.9 | 0 | 0 | 0 | 111.5 | A104 C105 V106 L110 G111 E112 R195 | A104-N108 WeakPolarHBondContact O-CB 3.49Å; A104-N108 PolarHBondContact O-N 2.95Å; C105-N108 PolarHBondContact O-N 2.92Å; V106-N108 VanDerWaalsContact C-N 3.35Å; V106-N108 PolarHBondContact O-N 3.02Å; N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 PolarHBondContact O-N 3.42Å; N108-G111 PolarHBondContact O-N 2.92Å; N108-E112 PolarHBondContact ND2-OE1 3.38Å; N108-E112 PolarHBondContact O-N 3.09Å; N108-E112 VanDerWaalsContact O-N 3.09Å; N108-R195 PolarHBondContact OD1-NH2 3.44Å |
| 109 | Q | 87.5 | Confident | 88.5 | Confident | 60 Ų | 60 | 57 Ų | 57 | 28% | 0.28 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.6 | -41.4 | -179.5 | -171.7 | 56.1 | 76.8 | 0 | 0 | 112.4 | C105 V106 G111 E112 M113 | C105-Q109 WeakPolarHBondContact O-CB 3.41Å; C105-Q109 PolarHBondContact O-N 3.42Å; V106-Q109 PolarHBondContact O-N 2.69Å; Q109-G111 VanDerWaalsContact C-N 3.34Å; Q109-E112 PolarHBondContact O-N 2.92Å; Q109-M113 PolarHBondContact O-N 3.25Å |
| 110 | L | 89.2 | Confident | 87.5 | Confident | 79 Ų | 79 | 57.6 Ų | 57.6 | 41% | 0.414 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.9 | -38.6 | 179.4 | -157.3 | 69.3 | 0 | 0 | 0 | 110.9 | V106 G107 N108 M113 L114 A188 | V106-L110 WeakPolarHBondContact O-CB 3.04Å; V106-L110 PolarHBondContact O-N 3.11Å; G107-L110 PolarHBondContact O-N 2.74Å; N108-L110 VanDerWaalsContact C-N 3.32Å; N108-L110 PolarHBondContact O-N 3.42Å; L110-M113 HydrophobicContact CD1-CE 3.91Å; L110-M113 PolarHBondContact O-N 3.42Å; L110-L114 HydrophobicContact CG-CD1 4.47Å; L110-L114 WeakPolarHBondContact O-CB 3.48Å; L110-L114 VanDerWaalsContact O-CG 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.34Å; L110-L114 PolarHBondContact O-N 2.63Å; L110-A188 HydrophobicContact CB-CB 4.04Å; L110-A188 HydrophobicContact CD2-CB 4Å; L110-A188 HydrophobicContact CG-CB 4.31Å |
| 111 | G | 87.2 | Confident | 86.2 | Confident | 2 Ų | 2 | 59.1 Ų | 59.1 | 2% | 0.021 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -67.3 | -34.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | G107 N108 Q109 N115 A188 N190 | G107-G111 PolarHBondContact O-N 3.32Å; N108-G111 PolarHBondContact O-N 2.92Å; Q109-G111 VanDerWaalsContact C-N 3.34Å; G111-N115 WeakPolarHBondContact O-CB 3.47Å; G111-N115 PolarHBondContact O-N 2.94Å; G111-N115 VanDerWaalsContact O-N 3.12Å; G111-A188 WeakPolarHBondContact CA-O 3.49Å; G111-N190 PolarHBondContact O-ND2 2.86Å |
| 112 | E | 84.7 | Confident | 84.7 | Confident | 92 Ų | 92 | 63.2 Ų | 63.2 | 43% | 0.43 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -66.2 | -45.1 | 171 | -72.3 | 176 | -167.9 | 0 | 0 | 111.4 | N108 Q109 N115 A116 | N108-E112 PolarHBondContact ND2-OE1 3.38Å; N108-E112 PolarHBondContact O-N 3.09Å; N108-E112 VanDerWaalsContact O-N 3.09Å; Q109-E112 PolarHBondContact O-N 2.92Å; E112-N115 PolarHBondContact O-N 3.36Å; E112-A116 PolarHBondContact O-N 3.08Å |
| 113 | M | 84.9 | Confident | 83.3 | Confident | 75 Ų | 75 | 60.7 Ų | 60.7 | 37% | 0.369 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -61.1 | -48.1 | 177.6 | -174.3 | -162.5 | 80 | 0 | 0 | 111.7 | Q109 L110 N115 A116 I117 | Q109-M113 PolarHBondContact O-N 3.25Å; L110-M113 HydrophobicContact CD1-CE 3.91Å; L110-M113 PolarHBondContact O-N 3.42Å; M113-N115 VanDerWaalsContact C-N 3.3Å; M113-N115 PolarHBondContact O-N 2.94Å; M113-A116 PolarHBondContact O-N 2.89Å; M113-I117 HydrophobicContact CE-CD1 4.01Å; M113-I117 HydrophobicContact CG-CD1 3.98Å; M113-I117 WeakPolarHBondContact O-CG1 3.28Å; M113-I117 PolarHBondContact O-N 3.26Å; M113-I117 HydrophobicContact SD-CD1 4.46Å |
| 114 | L | 86.2 | Confident | 81.7 | Confident | 62 Ų | 62 | 67 Ų | 67 | 33% | 0.325 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.2 | -40.4 | 179.1 | -73 | 171.4 | 0 | 0 | 0 | 111.4 | L110 I117 H118 A188 | L110-L114 HydrophobicContact CG-CD1 4.47Å; L110-L114 WeakPolarHBondContact O-CB 3.48Å; L110-L114 VanDerWaalsContact O-CG 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.34Å; L110-L114 PolarHBondContact O-N 2.63Å; L114-I117 PolarHBondContact O-N 3.49Å; L114-H118 PolarHBondContact O-N 3.18Å; L114-H118 PolarHBondContact O-ND1 3.45Å; L114-A188 HydrophobicContact CD1-CB 4.45Å |
| 115 | N | 84.5 | Confident | 80 | Confident | 92 Ų | 92 | 75.1 Ų | 75.1 | 49% | 0.492 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67.5 | -38.6 | 177.6 | -163.5 | 21.2 | 0 | 0 | 0 | 112 | G111 E112 M113 I117 H118 G119 | G111-N115 WeakPolarHBondContact O-CB 3.47Å; G111-N115 PolarHBondContact O-N 2.94Å; G111-N115 VanDerWaalsContact O-N 3.12Å; E112-N115 PolarHBondContact O-N 3.36Å; M113-N115 VanDerWaalsContact C-N 3.3Å; M113-N115 PolarHBondContact O-N 2.94Å; N115-I117 PolarHBondContact O-N 3.3Å; N115-H118 PolarHBondContact O-N 3.38Å; N115-G119 WeakPolarHBondContact O-CA 3.37Å; N115-G119 PolarHBondContact O-N 2.9Å |
| 116 | A | 84.8 | Confident | 78.6 | Confident | 22 Ų | 22 | 75.7 Ų | 75.7 | 18% | 0.182 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -61.1 | -43.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | E112 M113 G120 G121 V123 | E112-A116 PolarHBondContact O-N 3.08Å; M113-A116 PolarHBondContact O-N 2.89Å; A116-G120 PolarHBondContact O-N 3.05Å; A116-G121 PolarHBondContact O-N 2.78Å; A116-G121 VanDerWaalsContact O-N 3.09Å; A116-V123 HydrophobicContact CB-CG2 4.45Å |
| 117 | I | 84.5 | Confident | 77.6 | Confident | 101 Ų | 101 | 78.6 Ų | 78.6 | 52% | 0.518 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65 | -46.3 | 179.1 | -65.7 | 165.7 | 0 | 0 | 0 | 111.6 | M113 L114 N115 | M113-I117 HydrophobicContact CE-CD1 4.01Å; M113-I117 HydrophobicContact CG-CD1 3.98Å; M113-I117 WeakPolarHBondContact O-CG1 3.28Å; M113-I117 PolarHBondContact O-N 3.26Å; M113-I117 HydrophobicContact SD-CD1 4.46Å; L114-I117 PolarHBondContact O-N 3.49Å; N115-I117 PolarHBondContact O-N 3.3Å |
| 118 | H | 83.5 | Confident | 76.8 | Confident | 156 Ų | 156 | 83.4 Ų | 83.4 | 72% | 0.722 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -77.7 | -31.6 | -177.7 | -68.8 | 87.7 | 0 | 0 | 0 | 113.2 | L114 N115 G120 | L114-H118 PolarHBondContact O-N 3.18Å; L114-H118 PolarHBondContact O-ND1 3.45Å; N115-H118 PolarHBondContact O-N 3.38Å; H118-G120 VanDerWaalsContact C-N 3.32Å |
| 119 | G | 79.4 | Confident | 76.7 | Confident | 60 Ų | 60 | 86.4 Ų | 86.4 | 62% | 0.619 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84 | -0 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | N115 G121 | N115-G119 WeakPolarHBondContact O-CA 3.37Å; N115-G119 PolarHBondContact O-N 2.9Å; G119-G121 PolarHBondContact O-N 3.03Å |
| 120 | G | 71.2 | Confident | 76.8 | Confident | 74 Ų | 74 | 91.8 Ų | 91.8 | 76% | 0.763 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.2 | 16.9 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | A116 H118 | A116-G120 PolarHBondContact O-N 3.05Å; H118-G120 VanDerWaalsContact C-N 3.32Å |
| 121 | G | 66.5 | Low | 76.9 | Confident | 42 Ų | 42 | 98.1 Ų | 98.1 | 43% | 0.433 | 54% | 0.54 | S | S | . | . | trans | -82.5 | 152.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A116 G119 V123 | A116-G121 PolarHBondContact O-N 2.78Å; A116-G121 VanDerWaalsContact O-N 3.09Å; G119-G121 PolarHBondContact O-N 3.03Å; G121-V123 PolarHBondContact O-N 2.94Å | ||
| 122 | T | 63.2 | Low | 77 | Confident | 108 Ų | 108 | 101.7 Ų | 101.7 | 66% | 0.663 | 56% | 0.558 | S | S | * | * | trans | -57.6 | 128.9 | 168.3 | 44.4 | 0 | 0 | 0 | 0 | 109.9 | H124 | T122-H124 VanDerWaalsContact C-N 3.27Å; T122-H124 PolarHBondContact O-N 2.9Å | ||
| 123 | V | 63.7 | Low | 77.4 | Confident | 91 Ų | 91 | 99 Ų | 99 | 55% | 0.552 | 55% | 0.548 | S | S | * | . | trans | -62.8 | 94.2 | 169.2 | -177.3 | 0 | 0 | 0 | 0 | 106.9 | A116 G121 H125 | A116-V123 HydrophobicContact CB-CG2 4.45Å; G121-V123 PolarHBondContact O-N 2.94Å; V123-H125 PolarHBondContact O-N 2.83Å | ||
| 124 | H | 60.2 | Low | 77.8 | Confident | 154 Ų | 154 | 99.6 Ų | 99.6 | 71% | 0.713 | 56% | 0.556 | S | S | * | * | trans | -62.3 | 125.9 | 168.6 | -80.7 | -43.9 | 0 | 0 | 0 | 107 | T122 A126 | T122-H124 VanDerWaalsContact C-N 3.27Å; T122-H124 PolarHBondContact O-N 2.9Å; H124-A126 VanDerWaalsContact C-N 3.32Å; H124-A126 PolarHBondContact O-N 3.5Å | ||
| 125 | H | 58.4 | Low | 78.2 | Confident | 177 Ų | 177 | 101.5 Ų | 101.5 | 82% | 0.819 | 57% | 0.566 | S | S | * | * | trans | -52.8 | 106.7 | 166.6 | -67.1 | -64 | 0 | 0 | 0 | 106.5 | V123 V127 | V123-H125 PolarHBondContact O-N 2.83Å; H125-V127 VanDerWaalsContact C-N 3.26Å; H125-V127 VanDerWaalsContact O-CG2 3.28Å; H125-V127 WeakPolarHBondContact O-CG2 3.45Å; H125-V127 PolarHBondContact O-N 3.42Å | ||
| 126 | A | 61.1 | Low | 78.7 | Confident | 44 Ų | 44 | 100.1 Ų | 100.1 | 36% | 0.364 | 56% | 0.557 | S | S | . | * | trans | -77.7 | 92 | -170.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | H124 L128 | H124-A126 VanDerWaalsContact C-N 3.32Å; H124-A126 PolarHBondContact O-N 3.5Å; A126-L128 PolarHBondContact O-N 3.42Å | ||
| 127 | V | 70.8 | Confident | 79.1 | Confident | 119 Ų | 119 | 100 Ų | 100 | 72% | 0.721 | 56% | 0.556 | S | S | * | * | trans | -68.5 | 117.1 | 177.3 | -153.4 | 0 | 0 | 0 | 0 | 105.8 | H125 N129 | H125-V127 VanDerWaalsContact C-N 3.26Å; H125-V127 VanDerWaalsContact O-CG2 3.28Å; H125-V127 WeakPolarHBondContact O-CG2 3.45Å; H125-V127 PolarHBondContact O-N 3.42Å; V127-N129 PolarHBondContact O-N 3.05Å | ||
| 128 | L | 73.4 | Confident | 79.6 | Confident | 103 Ų | 103 | 98.4 Ų | 98.4 | 54% | 0.539 | 55% | 0.554 | S | S | . | * | trans | -62.6 | 99.8 | -178.2 | -132.7 | 159.2 | 0 | 0 | 0 | 108.1 | A126 F130 V133 | A126-L128 PolarHBondContact O-N 3.42Å; L128-F130 PolarHBondContact O-N 2.76Å; L128-V133 HydrophobicContact CD2-CG2 3.07Å | ||
| 129 | N | 85.5 | Confident | 80.1 | Confident | 102 Ų | 102 | 95.1 Ų | 95.1 | 55% | 0.545 | 55% | 0.545 | S | S | . | . | trans | -71 | 104.8 | -177.8 | -92.7 | -52.6 | 0 | 0 | 0 | 108.9 | V127 R131 I132 V133 | V127-N129 PolarHBondContact O-N 3.05Å; N129-R131 PolarHBondContact O-N 3.35Å; N129-I132 HydrophobicContact CB-CB 4.3Å; N129-I132 HydrophobicContact CB-CD1 3.87Å; N129-I132 HydrophobicContact CB-CG1 3.91Å; N129-I132 PolarHBondContact O-N 3Å; N129-V133 PolarHBondContact O-N 3.22Å | ||
| 130 | F | 88.8 | Confident | 80.8 | Confident | 172 Ų | 172 | 93.2 Ų | 93.2 | 75% | 0.754 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -51.1 | -34.2 | 178.6 | -66.5 | -72.7 | 0 | 0 | 0 | 112.4 | L128 I132 V133 T134 | L128-F130 PolarHBondContact O-N 2.76Å; F130-I132 VanDerWaalsContact C-N 3.35Å; F130-I132 PolarHBondContact O-N 3.46Å; F130-V133 PolarHBondContact O-N 2.77Å; F130-T134 WeakPolarHBondContact O-CB 3.37Å; F130-T134 PolarHBondContact O-N 2.75Å; F130-T134 PolarHBondContact O-OG1 3.44Å |
| 131 | R | 91.5 | Very high | 81.8 | Confident | 213 Ų | 213 | 92.2 Ų | 92.2 | 80% | 0.804 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.7 | -41.1 | 176 | -162.8 | 175.9 | 101.9 | -145.4 | 6.8 | 112.9 | N129 L135 | N129-R131 PolarHBondContact O-N 3.35Å; R131-L135 WeakPolarHBondContact O-CB 3.06Å; R131-L135 PolarHBondContact O-N 3.03Å |
| 132 | I | 90.6 | Very high | 83.1 | Confident | 77 Ų | 77 | 92.6 Ų | 92.6 | 40% | 0.395 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -70.7 | -44.4 | 179.5 | -60.6 | 178.1 | 0 | 0 | 0 | 109.3 | N129 F130 T134 L135 M136 | N129-I132 HydrophobicContact CB-CB 4.3Å; N129-I132 HydrophobicContact CB-CD1 3.87Å; N129-I132 HydrophobicContact CB-CG1 3.91Å; N129-I132 PolarHBondContact O-N 3Å; F130-I132 VanDerWaalsContact C-N 3.35Å; F130-I132 PolarHBondContact O-N 3.46Å; I132-T134 PolarHBondContact O-N 3.31Å; I132-L135 WeakPolarHBondContact O-CB 3.35Å; I132-L135 PolarHBondContact O-N 3.4Å; I132-M136 HydrophobicContact CG2-CE 4.16Å; I132-M136 HydrophobicContact CG2-CG 4.43Å; I132-M136 WeakPolarHBondContact O-CG 3.34Å; I132-M136 PolarHBondContact O-N 2.92Å |
| 133 | V | 92.1 | Very high | 84.4 | Confident | 35 Ų | 35 | 90.3 Ų | 90.3 | 21% | 0.212 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -60.4 | -46.8 | 177.6 | -177.3 | 0 | 0 | 0 | 0 | 111.5 | L101 L128 N129 F130 L135 M136 A137 | L101-V133 HydrophobicContact CD1-CG1 4.46Å; L128-V133 HydrophobicContact CD2-CG2 3.07Å; N129-V133 PolarHBondContact O-N 3.22Å; F130-V133 PolarHBondContact O-N 2.77Å; V133-L135 VanDerWaalsContact C-N 3.27Å; V133-L135 PolarHBondContact O-N 2.89Å; V133-M136 PolarHBondContact O-N 3.44Å; V133-A137 WeakPolarHBondContact O-CB 2.94Å; V133-A137 PolarHBondContact O-N 3.33Å |
| 134 | T | 93.9 | Very high | 85.6 | Confident | 88 Ų | 88 | 86.3 Ų | 86.3 | 54% | 0.54 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.6 | -37.6 | 178.1 | -58.5 | 0 | 0 | 0 | 0 | 111 | F130 I132 A137 S138 | F130-T134 WeakPolarHBondContact O-CB 3.37Å; F130-T134 PolarHBondContact O-N 2.75Å; F130-T134 PolarHBondContact O-OG1 3.44Å; I132-T134 PolarHBondContact O-N 3.31Å; T134-A137 PolarHBondContact O-N 2.69Å; T134-S138 WeakPolarHBondContact O-CB 3.3Å; T134-S138 PolarHBondContact O-N 3.13Å; T134-S138 PolarHBondContact O-OG 3.49Å |
| 135 | L | 94.6 | Very high | 87 | Confident | 101 Ų | 101 | 84 Ų | 84 | 53% | 0.529 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.7 | -47 | 174.4 | -164.7 | 161.8 | 0 | 0 | 0 | 110.9 | R131 I132 V133 A137 S138 V139 | R131-L135 WeakPolarHBondContact O-CB 3.06Å; R131-L135 PolarHBondContact O-N 3.03Å; I132-L135 WeakPolarHBondContact O-CB 3.35Å; I132-L135 PolarHBondContact O-N 3.4Å; V133-L135 VanDerWaalsContact C-N 3.27Å; V133-L135 PolarHBondContact O-N 2.89Å; L135-A137 VanDerWaalsContact C-N 3.34Å; L135-A137 PolarHBondContact O-N 2.89Å; L135-S138 WeakPolarHBondContact O-CB 3.49Å; L135-S138 PolarHBondContact O-N 3.44Å; L135-V139 HydrophobicContact CD2-CG2 3.84Å; L135-V139 WeakPolarHBondContact O-CG2 3.39Å; L135-V139 PolarHBondContact O-N 3.26Å |
| 136 | M | 93.9 | Very high | 88.5 | Confident | 63 Ų | 63 | 80.7 Ų | 80.7 | 31% | 0.31 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -60 | -44.5 | 176.6 | -65.7 | -60 | 174.9 | 0 | 0 | 111.8 | L101 I132 V133 S138 V139 I140 | L101-M136 HydrophobicContact CD1-CB 3.77Å; I132-M136 HydrophobicContact CG2-CE 4.16Å; I132-M136 HydrophobicContact CG2-CG 4.43Å; I132-M136 WeakPolarHBondContact O-CG 3.34Å; I132-M136 PolarHBondContact O-N 2.92Å; V133-M136 PolarHBondContact O-N 3.44Å; M136-S138 VanDerWaalsContact C-N 3.34Å; M136-S138 PolarHBondContact O-N 3.1Å; M136-V139 PolarHBondContact O-N 3.32Å; M136-I140 WeakPolarHBondContact O-CB 3.09Å; M136-I140 VanDerWaalsContact O-CG1 3.29Å; M136-I140 WeakPolarHBondContact O-CG1 3.09Å; M136-I140 PolarHBondContact O-N 3.04Å |
| 137 | A | 94.6 | Very high | 89.8 | Confident | 20 Ų | 20 | 80 Ų | 80 | 17% | 0.165 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -59.6 | -47.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | L101 V133 T134 L135 V139 I140 F141 | L101-A137 HydrophobicContact CD1-CB 3.98Å; L101-A137 HydrophobicContact CD2-CB 3.64Å; L101-A137 HydrophobicContact CG-CB 4.46Å; V133-A137 WeakPolarHBondContact O-CB 2.94Å; V133-A137 PolarHBondContact O-N 3.33Å; T134-A137 PolarHBondContact O-N 2.69Å; L135-A137 VanDerWaalsContact C-N 3.34Å; L135-A137 PolarHBondContact O-N 2.89Å; A137-V139 VanDerWaalsContact C-N 3.32Å; A137-V139 PolarHBondContact O-N 3.33Å; A137-I140 PolarHBondContact O-N 3.49Å; A137-F141 WeakPolarHBondContact O-CB 3.46Å; A137-F141 VanDerWaalsContact O-CD2 3.3Å; A137-F141 WeakPolarHBondContact O-CD2 3.48Å; A137-F141 PolarHBondContact O-N 3.31Å |
| 138 | S | 94.8 | Very high | 90.6 | Very high | 68 Ų | 68 | 74.3 Ų | 74.3 | 48% | 0.476 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -57.5 | -46.3 | 178.1 | -55.5 | 0 | 0 | 0 | 0 | 111 | T134 L135 M136 A142 | T134-S138 WeakPolarHBondContact O-CB 3.3Å; T134-S138 PolarHBondContact O-N 3.13Å; T134-S138 PolarHBondContact O-OG 3.49Å; L135-S138 WeakPolarHBondContact O-CB 3.49Å; L135-S138 PolarHBondContact O-N 3.44Å; M136-S138 VanDerWaalsContact C-N 3.34Å; M136-S138 PolarHBondContact O-N 3.1Å; S138-A142 WeakPolarHBondContact O-CA 3.14Å; S138-A142 WeakPolarHBondContact O-CB 3.2Å; S138-A142 PolarHBondContact O-N 3.42Å |
| 139 | V | 94.5 | Very high | 91.3 | Very high | 86 Ų | 86 | 70.4 Ų | 70.4 | 52% | 0.521 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -65.6 | -45.2 | 179.7 | 171.2 | 0 | 0 | 0 | 0 | 111.5 | L135 M136 A137 Y143 | L135-V139 HydrophobicContact CD2-CG2 3.84Å; L135-V139 WeakPolarHBondContact O-CG2 3.39Å; L135-V139 PolarHBondContact O-N 3.26Å; M136-V139 PolarHBondContact O-N 3.32Å; A137-V139 VanDerWaalsContact C-N 3.32Å; A137-V139 PolarHBondContact O-N 3.33Å; V139-Y143 WeakPolarHBondContact O-CB 3.29Å; V139-Y143 PolarHBondContact O-N 2.94Å |
| 140 | I | 93.4 | Very high | 91.4 | Very high | 21 Ų | 21 | 71 Ų | 71 | 11% | 0.108 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -64.5 | -50.5 | -178.6 | -69.7 | 164.4 | 0 | 0 | 0 | 110.7 | A97 L100 L101 M136 A137 Y143 A144 | A97-I140 HydrophobicContact CB-CG2 4Å; L100-I140 HydrophobicContact CD2-CD1 4.37Å; L100-I140 HydrophobicContact CD2-CG1 4.25Å; L100-I140 HydrophobicContact CD2-CG2 4.01Å; L100-I140 HydrophobicContact CG-CD1 4.01Å; L100-I140 HydrophobicContact CG-CG1 4.43Å; L101-I140 HydrophobicContact CB-CD1 3.94Å; L101-I140 HydrophobicContact CD1-CD1 4.08Å; M136-I140 WeakPolarHBondContact O-CB 3.09Å; M136-I140 VanDerWaalsContact O-CG1 3.29Å; M136-I140 WeakPolarHBondContact O-CG1 3.09Å; M136-I140 PolarHBondContact O-N 3.04Å; A137-I140 PolarHBondContact O-N 3.49Å; I140-Y143 PolarHBondContact O-N 3.27Å; I140-A144 WeakPolarHBondContact O-CB 3.42Å; I140-A144 PolarHBondContact O-N 2.96Å |
| 141 | F | 92.7 | Very high | 91.2 | Very high | 53 Ų | 53 | 65 Ų | 65 | 23% | 0.232 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -67.9 | -41.7 | 179.2 | -78.6 | -71.5 | 0 | 0 | 0 | 111.5 | F94 A97 A137 Y143 A144 F145 | F94-F141 HydrophobicContact CD2-CE1 4.15Å; F94-F141 HydrophobicContact CD2-CZ 4.43Å; F94-F141 HydrophobicContact CE2-CE1 4.4Å; F94-F141 HydrophobicContact CE2-CZ 4.31Å; A97-F141 HydrophobicContact CB-CD1 4.19Å; A97-F141 HydrophobicContact CB-CE1 3.73Å; A97-F141 HydrophobicContact CB-CZ 4.03Å; A137-F141 WeakPolarHBondContact O-CB 3.46Å; A137-F141 VanDerWaalsContact O-CD2 3.3Å; A137-F141 WeakPolarHBondContact O-CD2 3.48Å; A137-F141 PolarHBondContact O-N 3.31Å; F141-Y143 VanDerWaalsContact C-N 3.3Å; F141-Y143 PolarHBondContact O-N 3.41Å; F141-A144 PolarHBondContact O-N 3.47Å; F141-F145 AromaticContact CD1-CE2 3.99Å; F141-F145 HydrophobicContact CD1-CE2 3.99Å; F141-F145 WeakPolarHBondContact O-CD2 2.94Å; F141-F145 PolarHBondContact O-N 3.2Å |
| 142 | A | 93.5 | Very high | 90.9 | Very high | 50 Ų | 50 | 55.8 Ų | 55.8 | 41% | 0.413 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -57.7 | -45.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | S138 A144 F145 L146 | S138-A142 WeakPolarHBondContact O-CA 3.14Å; S138-A142 WeakPolarHBondContact O-CB 3.2Å; S138-A142 PolarHBondContact O-N 3.42Å; A142-A144 VanDerWaalsContact C-N 3.34Å; A142-A144 PolarHBondContact O-N 2.93Å; A142-F145 PolarHBondContact O-N 3.16Å; A142-L146 WeakPolarHBondContact O-CA 3.44Å; A142-L146 WeakPolarHBondContact O-CB 3.45Å; A142-L146 PolarHBondContact O-N 3.19Å |
| 143 | Y | 90.7 | Very high | 90.8 | Very high | 59 Ų | 59 | 56.8 Ų | 56.8 | 23% | 0.231 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -62.3 | -41.2 | 177.1 | -174.2 | -117.1 | 0 | 0 | 0 | 112.3 | V139 I140 F141 F145 V147 Y173 L177 F180 S206 | V139-Y143 WeakPolarHBondContact O-CB 3.29Å; V139-Y143 PolarHBondContact O-N 2.94Å; I140-Y143 PolarHBondContact O-N 3.27Å; F141-Y143 VanDerWaalsContact C-N 3.3Å; F141-Y143 PolarHBondContact O-N 3.41Å; Y143-F145 VanDerWaalsContact C-N 3.34Å; Y143-F145 PolarHBondContact O-N 3.33Å; Y143-V147 HydrophobicContact CD2-CG2 3.83Å; Y143-V147 HydrophobicContact CE2-CG2 3.77Å; Y143-Y173 HydrophobicContact CE1-CE1 4.49Å; Y143-Y173 AromaticContact CE1-CZ 3.96Å; Y143-Y173 WeakPolarHBondContact CE1-OH 2.99Å; Y143-Y173 VanDerWaalsContact CE2-OH 3.3Å; Y143-Y173 WeakPolarHBondContact CE2-OH 3.48Å; Y143-Y173 WeakPolarHBondContact O-CE1 3.38Å; Y143-Y173 PolarHBondContact OH-OH 3.34Å; Y143-Y173 VanDerWaalsContact OH-OH 3.05Å; Y143-L177 HydrophobicContact CD1-CD2 3.59Å; Y143-L177 HydrophobicContact CE1-CD2 3.5Å; Y143-L177 VanDerWaalsContact CE1-CD2 3.5Å; Y143-F180 AromaticContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CZ 4.34Å; Y143-S206 PolarHBondContact OH-OG 3.36Å |
| 144 | A | 89.5 | Confident | 90.5 | Very high | 8 Ų | 8 | 59.3 Ų | 59.3 | 7% | 0.066 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.5 | -35.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | I140 F141 A142 P148 L177 | I140-A144 WeakPolarHBondContact O-CB 3.42Å; I140-A144 PolarHBondContact O-N 2.96Å; F141-A144 PolarHBondContact O-N 3.47Å; A142-A144 VanDerWaalsContact C-N 3.34Å; A142-A144 PolarHBondContact O-N 2.93Å; A144-P148 WeakPolarHBondContact O-CD 3.41Å; A144-P148 WeakPolarHBondContact O-CG 3.48Å; A144-L177 HydrophobicContact CB-CD1 3.67Å |
| 145 | F | 88.8 | Confident | 89.9 | Confident | 105 Ų | 105 | 55.1 Ų | 55.1 | 46% | 0.461 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -98 | -37.7 | -178.2 | -70.9 | -72 | 0 | 0 | 0 | 114 | F141 A142 Y143 V147 P148 G149 I170 | F141-F145 AromaticContact CD1-CE2 3.99Å; F141-F145 HydrophobicContact CD1-CE2 3.99Å; F141-F145 WeakPolarHBondContact O-CD2 2.94Å; F141-F145 PolarHBondContact O-N 3.2Å; A142-F145 PolarHBondContact O-N 3.16Å; Y143-F145 VanDerWaalsContact C-N 3.34Å; Y143-F145 PolarHBondContact O-N 3.33Å; F145-V147 PolarHBondContact O-N 3.19Å; F145-P148 WeakPolarHBondContact O-CD 3.5Å; F145-G149 PolarHBondContact O-N 3.29Å; F145-I170 HydrophobicContact CD1-CD1 3.73Å; F145-I170 HydrophobicContact CD1-CG1 4.39Å; F145-I170 HydrophobicContact CE1-CD1 3.96Å; F145-I170 HydrophobicContact CE1-CG2 4.29Å |
| 146 | L | 90.6 | Very high | 89.4 | Confident | 108 Ų | 108 | 56 Ų | 56 | 57% | 0.565 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -66.4 | -41.3 | -174.3 | -172.4 | 150 | 0 | 0 | 0 | 111.3 | A142 G149 L150 | A142-L146 WeakPolarHBondContact O-CA 3.44Å; A142-L146 WeakPolarHBondContact O-CB 3.45Å; A142-L146 PolarHBondContact O-N 3.19Å; L146-G149 PolarHBondContact O-N 2.52Å; L146-L150 HydrophobicContact CD2-CD1 4.21Å; L146-L150 WeakPolarHBondContact O-CB 3.3Å; L146-L150 PolarHBondContact O-N 2.68Å |
| 147 | V | 88.4 | Confident | 89 | Confident | 28 Ų | 28 | 62.5 Ų | 62.5 | 17% | 0.17 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.4 | -52.5 | -179.4 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | Y143 F145 G149 L150 F151 Y173 L210 | Y143-V147 HydrophobicContact CD2-CG2 3.83Å; Y143-V147 HydrophobicContact CE2-CG2 3.77Å; F145-V147 PolarHBondContact O-N 3.19Å; V147-G149 VanDerWaalsContact C-N 3.29Å; V147-G149 PolarHBondContact O-N 3.28Å; V147-L150 PolarHBondContact O-N 3.26Å; V147-F151 HydrophobicContact CG1-CD2 4.46Å; V147-F151 WeakPolarHBondContact O-CD2 3.34Å; V147-F151 PolarHBondContact O-N 2.89Å; V147-Y173 HydrophobicContact CB-CD1 4.49Å; V147-Y173 HydrophobicContact CB-CE1 3.8Å; V147-Y173 HydrophobicContact CB-CE2 4.44Å; V147-Y173 HydrophobicContact CG1-CD2 4.46Å; V147-Y173 HydrophobicContact CG1-CE1 4.15Å; V147-Y173 HydrophobicContact CG1-CE2 3.9Å; V147-Y173 HydrophobicContact CG2-CE1 4.38Å; V147-L210 HydrophobicContact CG1-CD2 3.81Å |
| 148 | P | 86.7 | Confident | 88.3 | Confident | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -55.6 | -41.9 | 171.2 | -30.2 | 38.5 | 0 | 0 | 0 | 113.5 | A144 F145 L150 F151 I152 L169 I170 Y173 | A144-P148 WeakPolarHBondContact O-CD 3.41Å; A144-P148 WeakPolarHBondContact O-CG 3.48Å; F145-P148 WeakPolarHBondContact O-CD 3.5Å; P148-L150 PolarHBondContact O-N 3.27Å; P148-F151 PolarHBondContact O-N 3.08Å; P148-I152 WeakPolarHBondContact O-CG1 3.25Å; P148-I152 PolarHBondContact O-N 3.38Å; P148-L169 HydrophobicContact CB-CB 4.18Å; P148-I170 HydrophobicContact CB-CG1 3.66Å; P148-I170 HydrophobicContact CG-CG1 3.96Å; P148-Y173 HydrophobicContact CG-CD1 3.62Å; P148-Y173 HydrophobicContact CG-CE1 4.45Å; P148-Y173 HydrophobicContact CG-CG 3.98Å |
| 149 | G | 87.4 | Confident | 87.4 | Confident | 22 Ų | 22 | 70.8 Ų | 70.8 | 23% | 0.227 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -61 | -42.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | F145 L146 V147 F151 I152 V153 | F145-G149 PolarHBondContact O-N 3.29Å; L146-G149 PolarHBondContact O-N 2.52Å; V147-G149 VanDerWaalsContact C-N 3.29Å; V147-G149 PolarHBondContact O-N 3.28Å; G149-F151 VanDerWaalsContact C-N 3.3Å; G149-F151 PolarHBondContact O-N 3.34Å; G149-I152 PolarHBondContact O-N 2.93Å; G149-V153 WeakPolarHBondContact O-CG2 3.37Å; G149-V153 PolarHBondContact O-N 3.17Å |
| 150 | L | 89.2 | Confident | 86.3 | Confident | 114 Ų | 114 | 67.2 Ų | 67.2 | 60% | 0.597 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -62.5 | -38.6 | 179.1 | -147.9 | 111.9 | 0 | 0 | 0 | 111.7 | L146 V147 P148 V153 F154 | L146-L150 HydrophobicContact CD2-CD1 4.21Å; L146-L150 WeakPolarHBondContact O-CB 3.3Å; L146-L150 PolarHBondContact O-N 2.68Å; V147-L150 PolarHBondContact O-N 3.26Å; P148-L150 PolarHBondContact O-N 3.27Å; L150-V153 PolarHBondContact O-N 3.36Å; L150-F154 WeakPolarHBondContact O-CB 3.37Å; L150-F154 PolarHBondContact O-N 3.21Å |
| 151 | F | 84.8 | Confident | 85.1 | Confident | 45 Ų | 45 | 73.9 Ų | 73.9 | 20% | 0.197 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -69.5 | -40 | 175.9 | -88.8 | -84.1 | 0 | 0 | 0 | 112.8 | V147 P148 G149 F154 F155 L169 L210 L211 I214 | V147-F151 HydrophobicContact CG1-CD2 4.46Å; V147-F151 WeakPolarHBondContact O-CD2 3.34Å; V147-F151 PolarHBondContact O-N 2.89Å; P148-F151 PolarHBondContact O-N 3.08Å; G149-F151 VanDerWaalsContact C-N 3.3Å; G149-F151 PolarHBondContact O-N 3.34Å; F151-F154 WeakPolarHBondContact O-CB 3.49Å; F151-F154 PolarHBondContact O-N 2.85Å; F151-F155 HydrophobicContact CB-CE2 4.37Å; F151-F155 HydrophobicContact CD1-CZ 4.45Å; F151-F155 WeakPolarHBondContact O-CD2 3.37Å; F151-F155 VanDerWaalsContact O-CG 3.27Å; F151-F155 WeakPolarHBondContact O-CG 3.48Å; F151-F155 PolarHBondContact O-N 3.14Å; F151-L169 HydrophobicContact CB-CD2 3.6Å; F151-L210 HydrophobicContact CD2-CD2 3.31Å; F151-L210 HydrophobicContact CE2-CD2 3.18Å; F151-L210 HydrophobicContact CE2-CG 4.46Å; F151-L210 HydrophobicContact CG-CD2 4.11Å; F151-L210 HydrophobicContact CZ-CD2 3.87Å; F151-L211 HydrophobicContact CZ-CD2 4.26Å; F151-I214 HydrophobicContact CB-CD1 4.04Å; F151-I214 HydrophobicContact CD1-CD1 3.24Å; F151-I214 HydrophobicContact CD1-CG2 4.31Å; F151-I214 HydrophobicContact CD2-CD1 4.28Å; F151-I214 HydrophobicContact CE1-CD1 3.61Å; F151-I214 HydrophobicContact CE1-CG2 4.21Å; F151-I214 HydrophobicContact CG-CD1 3.59Å; F151-I214 HydrophobicContact CZ-CD1 4.28Å |
| 152 | I | 84.2 | Confident | 83.8 | Confident | 21 Ų | 21 | 75.5 Ų | 75.5 | 11% | 0.108 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60.9 | -46.9 | 173.4 | -69.7 | -71.4 | 0 | 0 | 0 | 110.5 | P148 G149 F154 F155 M156 Y164 L166 L169 | P148-I152 WeakPolarHBondContact O-CG1 3.25Å; P148-I152 PolarHBondContact O-N 3.38Å; G149-I152 PolarHBondContact O-N 2.93Å; I152-F154 VanDerWaalsContact C-N 3.29Å; I152-F154 PolarHBondContact O-N 3.44Å; I152-F155 PolarHBondContact O-N 2.83Å; I152-F155 VanDerWaalsContact O-N 3.17Å; I152-M156 HydrophobicContact CG2-CG 4.34Å; I152-M156 HydrophobicContact CG2-SD 4.14Å; I152-M156 WeakPolarHBondContact O-CG 3.38Å; I152-M156 PolarHBondContact O-N 3.1Å; I152-Y164 WeakPolarHBondContact CD1-O 3.42Å; I152-L166 HydrophobicContact CD1-CB 4.15Å; I152-L166 HydrophobicContact CG1-CB 4.05Å; I152-L166 HydrophobicContact CG1-CD1 4.38Å; I152-L166 HydrophobicContact CG1-CG 4.42Å; I152-L169 HydrophobicContact CD1-CD2 4.35Å; I152-L169 HydrophobicContact CG1-CD2 4.16Å |
| 153 | V | 88.1 | Confident | 82.7 | Confident | 98 Ų | 98 | 76.2 Ų | 76.2 | 59% | 0.594 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -59 | -42.4 | 175.9 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | G149 L150 F155 M156 W157 | G149-V153 WeakPolarHBondContact O-CG2 3.37Å; G149-V153 PolarHBondContact O-N 3.17Å; L150-V153 PolarHBondContact O-N 3.36Å; V153-F155 PolarHBondContact O-N 3.3Å; V153-M156 PolarHBondContact O-N 3.49Å; V153-W157 WeakPolarHBondContact O-CB 3.38Å; V153-W157 PolarHBondContact O-N 3.32Å |
| 154 | F | 85.7 | Confident | 81.7 | Confident | 88 Ų | 88 | 74.5 Ų | 74.5 | 39% | 0.386 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 176 | 176.5 | -97.7 | 0 | 0 | 0 | 112.6 | L150 F151 I152 W157 R158 | L150-F154 WeakPolarHBondContact O-CB 3.37Å; L150-F154 PolarHBondContact O-N 3.21Å; F151-F154 WeakPolarHBondContact O-CB 3.49Å; F151-F154 PolarHBondContact O-N 2.85Å; I152-F154 VanDerWaalsContact C-N 3.29Å; I152-F154 PolarHBondContact O-N 3.44Å; F154-W157 HydrophobicContact CD2-CE3 4.37Å; F154-W157 HydrophobicContact CE2-CE3 4.43Å; F154-W157 PolarHBondContact O-N 3.24Å; F154-R158 HydrophobicContact CE1-CG 4.37Å; F154-R158 HydrophobicContact CE2-CG 4.46Å; F154-R158 HydrophobicContact CZ-CG 4.21Å; F154-R158 WeakPolarHBondContact O-CG 3.36Å; F154-R158 PolarHBondContact O-N 3.36Å |
| 155 | F | 83 | Confident | 81.2 | Confident | 0 Ų | 0 | 77.7 Ų | 77.7 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -67.8 | -41.1 | 177 | -67.7 | -43.1 | 0 | 0 | 0 | 112.4 | F151 I152 V153 W157 R158 N159 M160 M163 L169 I214 V218 | F151-F155 HydrophobicContact CB-CE2 4.37Å; F151-F155 HydrophobicContact CD1-CZ 4.45Å; F151-F155 WeakPolarHBondContact O-CD2 3.37Å; F151-F155 VanDerWaalsContact O-CG 3.27Å; F151-F155 WeakPolarHBondContact O-CG 3.48Å; F151-F155 PolarHBondContact O-N 3.14Å; I152-F155 PolarHBondContact O-N 2.83Å; I152-F155 VanDerWaalsContact O-N 3.17Å; V153-F155 PolarHBondContact O-N 3.3Å; F155-W157 VanDerWaalsContact C-N 3.29Å; F155-W157 PolarHBondContact O-N 2.69Å; F155-R158 CarbonylContact O-C 3.57Å; F155-R158 PolarHBondContact O-N 3.45Å; F155-R158 VanDerWaalsContact O-N 3.07Å; F155-N159 PolarHBondContact O-N 2.92Å; F155-N159 VanDerWaalsContact O-N 3.16Å; F155-M160 HydrophobicContact CD1-CG 4.36Å; F155-M163 HydrophobicContact CB-CE 3.26Å; F155-M163 HydrophobicContact CB-CG 3.87Å; F155-M163 HydrophobicContact CB-SD 3.69Å; F155-M163 HydrophobicContact CD2-CE 4.42Å; F155-M163 HydrophobicContact CG-CE 4.3Å; F155-M163 HydrophobicContact CG-CG 4.41Å; F155-L169 HydrophobicContact CE2-CD2 4.35Å; F155-I214 HydrophobicContact CE1-CG2 3.8Å; F155-I214 HydrophobicContact CE2-CD1 4.18Å; F155-I214 HydrophobicContact CE2-CG1 4.44Å; F155-I214 HydrophobicContact CZ-CB 4.22Å; F155-I214 HydrophobicContact CZ-CD1 3.93Å; F155-I214 HydrophobicContact CZ-CG1 3.94Å; F155-I214 HydrophobicContact CZ-CG2 3.4Å; F155-I214 VanDerWaalsContact CZ-CG2 3.4Å; F155-V218 HydrophobicContact CE1-CG2 4.04Å |
| 156 | M | 83.4 | Confident | 80.8 | Confident | 120 Ų | 120 | 76.9 Ų | 76.9 | 59% | 0.591 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -60.1 | -42.8 | 174.3 | -71.8 | -176.7 | 71.9 | 0 | 0 | 110.7 | I152 V153 R158 N159 M163 | I152-M156 HydrophobicContact CG2-CG 4.34Å; I152-M156 HydrophobicContact CG2-SD 4.14Å; I152-M156 WeakPolarHBondContact O-CG 3.38Å; I152-M156 PolarHBondContact O-N 3.1Å; V153-M156 PolarHBondContact O-N 3.49Å; M156-R158 PolarHBondContact O-N 3.07Å; M156-N159 PolarHBondContact O-N 3.33Å; M156-M163 HydrophobicContact CG-CE 3.82Å |
| 157 | W | 85.4 | Confident | 80.2 | Confident | 199 Ų | 199 | 73.8 Ų | 73.8 | 75% | 0.754 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -62.2 | -26.7 | 176.7 | -175.3 | 54.3 | 0 | 0 | 0 | 113.1 | V153 F154 F155 | V153-W157 WeakPolarHBondContact O-CB 3.38Å; V153-W157 PolarHBondContact O-N 3.32Å; F154-W157 HydrophobicContact CD2-CE3 4.37Å; F154-W157 HydrophobicContact CE2-CE3 4.43Å; F154-W157 PolarHBondContact O-N 3.24Å; F155-W157 VanDerWaalsContact C-N 3.29Å; F155-W157 PolarHBondContact O-N 2.69Å |
| 158 | R | 80.4 | Confident | 79.8 | Confident | 128 Ų | 128 | 73.5 Ų | 73.5 | 48% | 0.483 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | -1.4 | 179.4 | -67.2 | -74.2 | -79.9 | 150.7 | -6.5 | 114.3 | F154 F155 M156 M160 | F154-R158 HydrophobicContact CE1-CG 4.37Å; F154-R158 HydrophobicContact CE2-CG 4.46Å; F154-R158 HydrophobicContact CZ-CG 4.21Å; F154-R158 WeakPolarHBondContact O-CG 3.36Å; F154-R158 PolarHBondContact O-N 3.36Å; F155-R158 CarbonylContact O-C 3.57Å; F155-R158 PolarHBondContact O-N 3.45Å; F155-R158 VanDerWaalsContact O-N 3.07Å; M156-R158 PolarHBondContact O-N 3.07Å; R158-M160 VanDerWaalsContact C-N 3.28Å; R158-M160 HydrophobicContact CB-CG 3.75Å; R158-M160 HydrophobicContact CB-SD 3.6Å; R158-M160 VanDerWaalsContact CB-SD 3.6Å; R158-M160 PolarHBondContact O-N 3.08Å |
| 159 | N | 75.1 | Confident | 79.5 | Confident | 134 Ų | 134 | 73.5 Ų | 73.5 | 72% | 0.717 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.6 | 47.7 | -176.9 | -68.5 | -54.1 | 0 | 0 | 0 | 112.8 | F155 M156 | F155-N159 PolarHBondContact O-N 2.92Å; F155-N159 VanDerWaalsContact O-N 3.16Å; M156-N159 PolarHBondContact O-N 3.33Å |
| 160 | M | 71.2 | Confident | 79.4 | Confident | 10 Ų | 10 | 73 Ų | 73 | 5% | 0.049 | 36% | 0.358 | C | S | . | . | trans | -79.7 | 128.9 | 179 | -43.1 | -75.6 | -99.1 | 0 | 0 | 108.5 | F155 R158 M163 H221 | F155-M160 HydrophobicContact CD1-CG 4.36Å; R158-M160 VanDerWaalsContact C-N 3.28Å; R158-M160 HydrophobicContact CB-CG 3.75Å; R158-M160 HydrophobicContact CB-SD 3.6Å; R158-M160 VanDerWaalsContact CB-SD 3.6Å; R158-M160 PolarHBondContact O-N 3.08Å; M160-M163 HydrophobicContact CB-CG 4.03Å; M160-M163 WeakPolarHBondContact O-CG 3.46Å; M160-H221 HydrophobicContact CE-CB 3.33Å; M160-H221 HydrophobicContact SD-CB 3.89Å; M160-H221 PolarHBondContact SD-CD2 3.23Å; M160-H221 PolarHBondContact SD-CE1 3.36Å; M160-H221 PolarHBondContact SD-ND1 3.27Å; M160-H221 PolarHBondContact SD-NE2 3.37Å; M160-H221 VanDerWaalsContact SD-NE2 3.41Å | ||
| 161 | D | 67.5 | Low | 79.1 | Confident | 161 Ų | 161 | 67.6 Ų | 67.6 | 86% | 0.861 | 33% | 0.33 | S | S | * | . | S | Bend | trans | -79.2 | -29.7 | 179.5 | -63.4 | -46.2 | 0 | 0 | 0 | 113.1 | M163 | D161-M163 PolarHBondContact O-N 3.36Å; D161-M163 VanDerWaalsContact O-N 3.1Å |
| 162 | D | 67 | Low | 78.8 | Confident | 88 Ų | 88 | 66.1 Ų | 66.1 | 47% | 0.471 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -86.3 | 51 | 178.8 | -87 | -30.9 | 0 | 0 | 0 | 111.8 | V217 K220 | D162-V217 VanDerWaalsContact O-CG1 3.28Å; D162-V217 WeakPolarHBondContact O-CG1 3.32Å; D162-K220 WeakPolarHBondContact OD2-CE 3.35Å; D162-K220 IonicContact OD2-NZ 2.69Å; D162-K220 PolarHBondContact OD2-NZ 3.05Å |
| 163 | M | 69.2 | Low | 78.8 | Confident | 65 Ų | 65 | 65.2 Ų | 65.2 | 32% | 0.32 | 32% | 0.321 | S | S | . | . | P | Polyproline II helix | trans | -80.3 | 136.3 | -178.6 | -77.4 | 176.5 | 65.3 | 0 | 0 | 112.7 | F155 M156 M160 D161 | F155-M163 HydrophobicContact CB-CE 3.26Å; F155-M163 HydrophobicContact CB-CG 3.87Å; F155-M163 HydrophobicContact CB-SD 3.69Å; F155-M163 HydrophobicContact CD2-CE 4.42Å; F155-M163 HydrophobicContact CG-CE 4.3Å; F155-M163 HydrophobicContact CG-CG 4.41Å; M156-M163 HydrophobicContact CG-CE 3.82Å; M160-M163 HydrophobicContact CB-CG 4.03Å; M160-M163 WeakPolarHBondContact O-CG 3.46Å; D161-M163 PolarHBondContact O-N 3.36Å; D161-M163 VanDerWaalsContact O-N 3.1Å |
| 164 | Y | 71 | Confident | 78.7 | Confident | 23 Ų | 23 | 60.6 Ų | 60.6 | 9% | 0.09 | 29% | 0.293 | C | S | . | . | P | Polyproline II helix | trans | -69.4 | 143 | 163.1 | -68 | -56.4 | 0 | 0 | 0 | 109.9 | I80 I152 L169 V217 | I80-Y164 HydrophobicContact CB-CD1 4.45Å; I80-Y164 HydrophobicContact CB-CE1 3.76Å; I80-Y164 HydrophobicContact CD1-CD1 4.19Å; I80-Y164 HydrophobicContact CD1-CD2 3.98Å; I80-Y164 HydrophobicContact CD1-CE1 4.02Å; I80-Y164 HydrophobicContact CD1-CE2 3.75Å; I80-Y164 HydrophobicContact CD1-CG 4.19Å; I80-Y164 HydrophobicContact CG1-CE1 4.45Å; I80-Y164 HydrophobicContact CG2-CD1 3.56Å; I80-Y164 HydrophobicContact CG2-CE1 3.23Å; I80-Y164 HydrophobicContact CG2-CG 4.49Å; I152-Y164 WeakPolarHBondContact CD1-O 3.42Å; Y164-L169 VanDerWaalsContact CB-CD1 3.43Å; Y164-L169 HydrophobicContact CD2-CD1 3.98Å; Y164-L169 HydrophobicContact CG-CD1 4.05Å; Y164-V217 HydrophobicContact CD2-CG2 4.11Å; Y164-V217 HydrophobicContact CE1-CG2 4.46Å; Y164-V217 HydrophobicContact CE2-CB 4.31Å; Y164-V217 HydrophobicContact CE2-CG2 3.27Å; Y164-V217 VanDerWaalsContact CZ-CG2 3.48Å; Y164-V217 WeakPolarHBondContact OH-CG2 3.42Å |
| 165 | T | 77.9 | Confident | 78.5 | Confident | 75 Ų | 75 | 56.9 Ų | 56.9 | 46% | 0.46 | 28% | 0.276 | S | S | . | . | P | Polyproline II helix | trans | -67 | 150.1 | 173.7 | 62 | 0 | 0 | 0 | 0 | 110.3 | L167 E168 L169 | T165-L167 PolarHBondContact O-N 3.16Å; T165-E168 PolarHBondContact N-OE2 2.82Å; T165-E168 PolarHBondContact O-N 3.26Å; T165-E168 VanDerWaalsContact O-N 3.1Å; T165-E168 WeakPolarHBondContact OG1-CB 3.5Å; T165-E168 VanDerWaalsContact OG1-CD 3.25Å; T165-E168 WeakPolarHBondContact OG1-CG 3.16Å; T165-E168 PolarHBondContact OG1-N 3.44Å; T165-E168 PolarHBondContact OG1-OE2 3.13Å; T165-L169 PolarHBondContact O-N 3.06Å; T165-L169 VanDerWaalsContact O-N 3.08Å |
| 166 | L | 80 | Confident | 78.7 | Confident | 87 Ų | 87 | 56.9 Ų | 56.9 | 46% | 0.455 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -55.8 | -34.7 | 176.3 | 176.4 | 144.1 | 0 | 0 | 0 | 111.5 | I152 L169 I170 | I152-L166 HydrophobicContact CD1-CB 4.15Å; I152-L166 HydrophobicContact CG1-CB 4.05Å; I152-L166 HydrophobicContact CG1-CD1 4.38Å; I152-L166 HydrophobicContact CG1-CG 4.42Å; L166-L169 PolarHBondContact O-N 3.11Å; L166-I170 HydrophobicContact CD2-CD1 3.31Å; L166-I170 HydrophobicContact CD2-CG1 4.32Å; L166-I170 HydrophobicContact CG-CD1 3.91Å; L166-I170 WeakPolarHBondContact O-CB 3Å; L166-I170 VanDerWaalsContact O-CG1 3.29Å; L166-I170 WeakPolarHBondContact O-CG1 3.43Å; L166-I170 PolarHBondContact O-N 2.89Å |
| 167 | L | 79.7 | Confident | 78.9 | Confident | 43 Ų | 43 | 51.2 Ų | 51.2 | 23% | 0.225 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66.9 | -43.8 | 177.6 | -156.8 | 87.2 | 0 | 0 | 0 | 112.1 | F55 P88 L90 T165 L169 I170 C171 | F55-L167 HydrophobicContact CD1-CD2 3.66Å; F55-L167 HydrophobicContact CE1-CD2 3.38Å; F55-L167 HydrophobicContact CG-CD2 4.5Å; F55-L167 HydrophobicContact CZ-CD2 4.07Å; P88-L167 HydrophobicContact CB-CD2 3.63Å; P88-L167 HydrophobicContact CB-CG 4.22Å; P88-L167 HydrophobicContact CG-CD2 3.51Å; P88-L167 WeakPolarHBondContact O-CD2 3.25Å; L90-L167 HydrophobicContact CD1-CD1 3.67Å; L90-L167 HydrophobicContact CD1-CG 4.41Å; T165-L167 PolarHBondContact O-N 3.16Å; L167-L169 VanDerWaalsContact C-N 3.29Å; L167-L169 PolarHBondContact O-N 3.43Å; L167-I170 PolarHBondContact O-N 3.44Å; L167-C171 WeakPolarHBondContact O-CB 3.18Å; L167-C171 PolarHBondContact O-N 2.9Å |
| 168 | E | 78.4 | Confident | 79 | Confident | 22 Ų | 22 | 42 Ų | 42 | 10% | 0.103 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62 | -38.7 | 174.8 | -73.3 | 167.6 | 138.6 | 0 | 0 | 111.8 | I84 P88 T165 S172 | I84-E168 HydrophobicContact CG2-CB 4.28Å; I84-E168 HydrophobicContact CG2-CG 3.81Å; P88-E168 HydrophobicContact CB-CG 4.25Å; T165-E168 PolarHBondContact N-OE2 2.82Å; T165-E168 PolarHBondContact O-N 3.26Å; T165-E168 VanDerWaalsContact O-N 3.1Å; T165-E168 WeakPolarHBondContact OG1-CB 3.5Å; T165-E168 VanDerWaalsContact OG1-CD 3.25Å; T165-E168 WeakPolarHBondContact OG1-CG 3.16Å; T165-E168 PolarHBondContact OG1-N 3.44Å; T165-E168 PolarHBondContact OG1-OE2 3.13Å; E168-S172 WeakPolarHBondContact O-CB 3.06Å; E168-S172 PolarHBondContact O-N 3.29Å; E168-S172 PolarHBondContact O-OG 2.89Å |
| 169 | L | 81.5 | Confident | 79.3 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -68.7 | -46.1 | 178 | -119.3 | 77.2 | 0 | 0 | 0 | 111.8 | P148 F151 I152 F155 Y164 T165 L166 L167 C171 S172 Y173 I214 | P148-L169 HydrophobicContact CB-CB 4.18Å; F151-L169 HydrophobicContact CB-CD2 3.6Å; I152-L169 HydrophobicContact CD1-CD2 4.35Å; I152-L169 HydrophobicContact CG1-CD2 4.16Å; F155-L169 HydrophobicContact CE2-CD2 4.35Å; Y164-L169 VanDerWaalsContact CB-CD1 3.43Å; Y164-L169 HydrophobicContact CD2-CD1 3.98Å; Y164-L169 HydrophobicContact CG-CD1 4.05Å; T165-L169 PolarHBondContact O-N 3.06Å; T165-L169 VanDerWaalsContact O-N 3.08Å; L166-L169 PolarHBondContact O-N 3.11Å; L167-L169 VanDerWaalsContact C-N 3.29Å; L167-L169 PolarHBondContact O-N 3.43Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-S172 PolarHBondContact O-OG 3.19Å; L169-S172 VanDerWaalsContact O-OG 3.12Å; L169-Y173 WeakPolarHBondContact O-CB 3.33Å; L169-Y173 PolarHBondContact O-N 3.06Å; L169-I214 HydrophobicContact CD2-CD1 4.23Å |
| 170 | I | 84.2 | Confident | 80 | Confident | 12 Ų | 12 | 30.9 Ų | 30.9 | 6% | 0.062 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.1 | -41.6 | 175.6 | -70.7 | 171 | 0 | 0 | 0 | 110.9 | L90 P93 F145 P148 L166 L167 G174 | L90-I170 HydrophobicContact CD1-CG2 4.03Å; P93-I170 HydrophobicContact CB-CG2 4.35Å; P93-I170 HydrophobicContact CG-CG2 4.48Å; F145-I170 HydrophobicContact CD1-CD1 3.73Å; F145-I170 HydrophobicContact CD1-CG1 4.39Å; F145-I170 HydrophobicContact CE1-CD1 3.96Å; F145-I170 HydrophobicContact CE1-CG2 4.29Å; P148-I170 HydrophobicContact CB-CG1 3.66Å; P148-I170 HydrophobicContact CG-CG1 3.96Å; L166-I170 HydrophobicContact CD2-CD1 3.31Å; L166-I170 HydrophobicContact CD2-CG1 4.32Å; L166-I170 HydrophobicContact CG-CD1 3.91Å; L166-I170 WeakPolarHBondContact O-CB 3Å; L166-I170 VanDerWaalsContact O-CG1 3.29Å; L166-I170 WeakPolarHBondContact O-CG1 3.43Å; L166-I170 PolarHBondContact O-N 2.89Å; L167-I170 PolarHBondContact O-N 3.44Å; I170-G174 WeakPolarHBondContact O-CA 3.21Å; I170-G174 PolarHBondContact O-N 3.45Å |
| 171 | C | 83.3 | Confident | 81 | Confident | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -57.5 | -63.2 | 176.3 | 179.7 | 0 | 0 | 0 | 0 | 110.5 | D89 L167 L169 Y173 G174 Y175 | D89-C171 PolarHBondContact O-SG 3.01Å; D89-C171 VanDerWaalsContact O-SG 3.38Å; D89-C171 PolarHBondContact OD1-SG 3.3Å; L167-C171 WeakPolarHBondContact O-CB 3.18Å; L167-C171 PolarHBondContact O-N 2.9Å; L169-C171 VanDerWaalsContact C-N 3.34Å; C171-Y173 VanDerWaalsContact C-N 3.31Å; C171-Y173 PolarHBondContact O-N 3.47Å; C171-G174 PolarHBondContact O-N 2.79Å; C171-Y175 WeakPolarHBondContact O-CD2 3.22Å; C171-Y175 PolarHBondContact O-N 3.47Å; C171-Y175 VanDerWaalsContact O-N 3.08Å; C171-Y175 VanDerWaalsContact SG-CE2 3.55Å |
| 172 | S | 78.3 | Confident | 82.1 | Confident | 15 Ų | 15 | 27.4 Ų | 27.4 | 11% | 0.105 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -57.4 | -42.1 | -178.8 | 56.9 | 0 | 0 | 0 | 0 | 113.1 | E168 L169 S176 | E168-S172 WeakPolarHBondContact O-CB 3.06Å; E168-S172 PolarHBondContact O-N 3.29Å; E168-S172 PolarHBondContact O-OG 2.89Å; L169-S172 PolarHBondContact O-OG 3.19Å; L169-S172 VanDerWaalsContact O-OG 3.12Å; S172-S176 PolarHBondContact O-N 2.94Å |
| 173 | Y | 85 | Confident | 83.2 | Confident | 2 Ų | 2 | 23.8 Ų | 23.8 | 1% | 0.008 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -70.8 | -43.1 | 179 | -173.2 | -114.9 | 0 | 0 | 0 | 113 | Y143 V147 P148 L169 C171 Y175 S176 L177 L210 | Y143-Y173 HydrophobicContact CE1-CE1 4.49Å; Y143-Y173 AromaticContact CE1-CZ 3.96Å; Y143-Y173 WeakPolarHBondContact CE1-OH 2.99Å; Y143-Y173 VanDerWaalsContact CE2-OH 3.3Å; Y143-Y173 WeakPolarHBondContact CE2-OH 3.48Å; Y143-Y173 WeakPolarHBondContact O-CE1 3.38Å; Y143-Y173 PolarHBondContact OH-OH 3.34Å; Y143-Y173 VanDerWaalsContact OH-OH 3.05Å; V147-Y173 HydrophobicContact CB-CD1 4.49Å; V147-Y173 HydrophobicContact CB-CE1 3.8Å; V147-Y173 HydrophobicContact CB-CE2 4.44Å; V147-Y173 HydrophobicContact CG1-CD2 4.46Å; V147-Y173 HydrophobicContact CG1-CE1 4.15Å; V147-Y173 HydrophobicContact CG1-CE2 3.9Å; V147-Y173 HydrophobicContact CG2-CE1 4.38Å; P148-Y173 HydrophobicContact CG-CD1 3.62Å; P148-Y173 HydrophobicContact CG-CE1 4.45Å; P148-Y173 HydrophobicContact CG-CG 3.98Å; L169-Y173 WeakPolarHBondContact O-CB 3.33Å; L169-Y173 PolarHBondContact O-N 3.06Å; C171-Y173 VanDerWaalsContact C-N 3.31Å; C171-Y173 PolarHBondContact O-N 3.47Å; Y173-Y175 PolarHBondContact O-N 3.34Å; Y173-S176 WeakPolarHBondContact O-CA 3.06Å; Y173-S176 WeakPolarHBondContact O-CB 3.44Å; Y173-S176 PolarHBondContact O-N 3.47Å; Y173-S176 PolarHBondContact O-OG 3.49Å; Y173-L177 HydrophobicContact CE1-CD2 4.2Å; Y173-L177 PolarHBondContact O-N 2.89Å; Y173-L210 HydrophobicContact CD2-CB 4.12Å; Y173-L210 HydrophobicContact CD2-CD1 3.7Å; Y173-L210 HydrophobicContact CD2-CD2 4.47Å; Y173-L210 HydrophobicContact CD2-CG 4.32Å; Y173-L210 HydrophobicContact CG-CD1 4Å |
| 174 | G | 85.6 | Confident | 84.3 | Confident | 1 Ų | 1 | 20.7 Ų | 20.7 | 1% | 0.01 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -58.8 | -36.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | I96 I170 C171 S176 L177 | I96-G174 WeakPolarHBondContact CG2-O 3.43Å; I170-G174 WeakPolarHBondContact O-CA 3.21Å; I170-G174 PolarHBondContact O-N 3.45Å; C171-G174 PolarHBondContact O-N 2.79Å; G174-S176 VanDerWaalsContact C-N 3.35Å; G174-S176 PolarHBondContact O-N 3.35Å; G174-L177 WeakPolarHBondContact O-CB 3.46Å; G174-L177 PolarHBondContact O-N 3.01Å |
| 175 | Y | 82.4 | Confident | 85.2 | Confident | 9 Ų | 9 | 23.6 Ų | 23.6 | 4% | 0.035 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.2 | -39.6 | 171.2 | -81.4 | -66.8 | 0 | 0 | 0 | 113.2 | V63 R66 V67 D89 I96 C171 Y173 L177 S178 | V63-Y175 HydrophobicContact CB-CE1 4.43Å; V63-Y175 HydrophobicContact CG1-CE1 3.71Å; R66-Y175 HydrophobicContact CB-CD1 4.21Å; R66-Y175 HydrophobicContact CB-CE1 4.12Å; V67-Y175 HydrophobicContact CG2-CD1 3.76Å; V67-Y175 HydrophobicContact CG2-CE1 4.17Å; D89-Y175 PolarHBondContact OD2-OH 3Å; I96-Y175 HydrophobicContact CD1-CD1 3.68Å; I96-Y175 HydrophobicContact CD1-CE1 4.16Å; I96-Y175 HydrophobicContact CD1-CG 4.4Å; C171-Y175 WeakPolarHBondContact O-CD2 3.22Å; C171-Y175 PolarHBondContact O-N 3.47Å; C171-Y175 VanDerWaalsContact O-N 3.08Å; C171-Y175 VanDerWaalsContact SG-CE2 3.55Å; Y173-Y175 PolarHBondContact O-N 3.34Å; Y175-L177 PolarHBondContact O-N 3.35Å; Y175-S178 VanDerWaalsContact O-CB 3.3Å; Y175-S178 WeakPolarHBondContact O-CB 3.38Å; Y175-S178 PolarHBondContact O-N 3.18Å; Y175-S178 PolarHBondContact O-OG 3.47Å |
| 176 | S | 85.4 | Confident | 85.8 | Confident | 1 Ų | 1 | 23.8 Ų | 23.8 | 1% | 0.007 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -66 | -22.5 | 177.6 | 80.7 | 0 | 0 | 0 | 0 | 113.7 | S172 Y173 G174 S178 V179 | S172-S176 PolarHBondContact O-N 2.94Å; Y173-S176 WeakPolarHBondContact O-CA 3.06Å; Y173-S176 WeakPolarHBondContact O-CB 3.44Å; Y173-S176 PolarHBondContact O-N 3.47Å; Y173-S176 PolarHBondContact O-OG 3.49Å; G174-S176 VanDerWaalsContact C-N 3.35Å; G174-S176 PolarHBondContact O-N 3.35Å; S176-S178 PolarHBondContact O-N 2.97Å; S176-V179 WeakPolarHBondContact O-CG2 3.27Å; S176-V179 PolarHBondContact O-N 2.96Å |
| 177 | L | 87.6 | Confident | 86.2 | Confident | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.005 | 12% | 0.115 | C | C | . | . | G | 310 helix | trans | -66.8 | -14.8 | 175.9 | -63.6 | 178.4 | 0 | 0 | 0 | 113.2 | I96 Y143 A144 Y173 G174 Y175 V179 F180 | I96-L177 HydrophobicContact CG2-CB 3.92Å; Y143-L177 HydrophobicContact CD1-CD2 3.59Å; Y143-L177 HydrophobicContact CE1-CD2 3.5Å; Y143-L177 VanDerWaalsContact CE1-CD2 3.5Å; A144-L177 HydrophobicContact CB-CD1 3.67Å; Y173-L177 HydrophobicContact CE1-CD2 4.2Å; Y173-L177 PolarHBondContact O-N 2.89Å; G174-L177 WeakPolarHBondContact O-CB 3.46Å; G174-L177 PolarHBondContact O-N 3.01Å; Y175-L177 PolarHBondContact O-N 3.35Å; L177-V179 PolarHBondContact O-N 2.97Å; L177-V179 VanDerWaalsContact O-N 3.16Å; L177-F180 HydrophobicContact CD2-CD2 4.14Å; L177-F180 HydrophobicContact CD2-CE2 4.25Å; L177-F180 WeakPolarHBondContact O-CB 3.32Å; L177-F180 PolarHBondContact O-N 3.28Å |
| 178 | S | 87.4 | Confident | 86.5 | Confident | 6 Ų | 6 | 20.1 Ų | 20.1 | 4% | 0.042 | 11% | 0.107 | C | C | . | . | G | 310 helix | trans | -56.4 | -29.2 | 174.3 | 59.4 | 0 | 0 | 0 | 0 | 113.1 | Y175 S176 F180 I181 P182 | Y175-S178 VanDerWaalsContact O-CB 3.3Å; Y175-S178 WeakPolarHBondContact O-CB 3.38Å; Y175-S178 PolarHBondContact O-N 3.18Å; Y175-S178 PolarHBondContact O-OG 3.47Å; S176-S178 PolarHBondContact O-N 2.97Å; S178-F180 PolarHBondContact O-N 3.4Å; S178-I181 WeakPolarHBondContact O-CB 3.43Å; S178-I181 PolarHBondContact O-N 2.93Å; S178-P182 VanDerWaalsContact O-CD 3.27Å; S178-P182 WeakPolarHBondContact O-CD 3.3Å |
| 179 | V | 87.5 | Confident | 86.9 | Confident | 12 Ų | 12 | 22.3 Ų | 22.3 | 7% | 0.073 | 12% | 0.122 | C | C | . | . | G | 310 helix | trans | -58.2 | -29.7 | 174.2 | 177.1 | 0 | 0 | 0 | 0 | 111.7 | M71 S176 L177 I181 P182 I183 L205 | M71-V179 HydrophobicContact CG-CG2 3.86Å; S176-V179 WeakPolarHBondContact O-CG2 3.27Å; S176-V179 PolarHBondContact O-N 2.96Å; L177-V179 PolarHBondContact O-N 2.97Å; L177-V179 VanDerWaalsContact O-N 3.16Å; V179-I181 VanDerWaalsContact C-N 3.31Å; V179-I181 PolarHBondContact O-N 3.13Å; V179-P182 WeakPolarHBondContact O-CD 3.41Å; V179-P182 WeakPolarHBondContact O-CG 3.24Å; V179-I183 HydrophobicContact CG1-CD1 3.92Å; V179-I183 WeakPolarHBondContact O-CD1 3.21Å; V179-I183 WeakPolarHBondContact O-CG1 3.35Å; V179-L205 HydrophobicContact CG1-CB 4.24Å; V179-L205 HydrophobicContact CG1-CD1 3.84Å |
| 180 | F | 90.3 | Very high | 87 | Confident | 16 Ų | 16 | 25.4 Ų | 25.4 | 7% | 0.07 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -74.3 | -19.2 | 177.9 | -78.9 | -85.6 | 0 | 0 | 0 | 113.6 | L100 Y143 L177 S178 I183 S184 V203 | L100-F180 HydrophobicContact CD1-CB 3.48Å; L100-F180 VanDerWaalsContact CD1-CB 3.48Å; L100-F180 WeakPolarHBondContact CD1-O 3.5Å; L100-F180 HydrophobicContact CD2-CB 3.68Å; L100-F180 HydrophobicContact CD2-CG 4.39Å; L100-F180 HydrophobicContact CG-CB 4.23Å; Y143-F180 AromaticContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CE2 4Å; Y143-F180 HydrophobicContact CE1-CZ 4.34Å; L177-F180 HydrophobicContact CD2-CD2 4.14Å; L177-F180 HydrophobicContact CD2-CE2 4.25Å; L177-F180 WeakPolarHBondContact O-CB 3.32Å; L177-F180 PolarHBondContact O-N 3.28Å; S178-F180 PolarHBondContact O-N 3.4Å; F180-I183 PolarHBondContact O-N 3.44Å; F180-S184 VanDerWaalsContact O-CB 3.3Å; F180-S184 WeakPolarHBondContact O-CB 3.37Å; F180-S184 PolarHBondContact O-N 3.37Å; F180-S184 PolarHBondContact O-OG 3.21Å; F180-V203 HydrophobicContact CZ-CG2 3.86Å; F180-V203 VanDerWaalsContact CZ-N 3.34Å |
| 181 | I | 91.2 | Very high | 87.1 | Confident | 42 Ų | 42 | 29.3 Ų | 29.3 | 22% | 0.215 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.6 | -52.5 | -179.2 | -60.6 | 174.6 | 0 | 0 | 0 | 111.7 | I96 L100 T103 S178 V179 I183 S184 L185 | I96-I181 HydrophobicContact CG2-CD1 4.38Å; L100-I181 HydrophobicContact CB-CG1 4.3Å; T103-I181 HydrophobicContact CG2-CG2 4.01Å; S178-I181 WeakPolarHBondContact O-CB 3.43Å; S178-I181 PolarHBondContact O-N 2.93Å; V179-I181 VanDerWaalsContact C-N 3.31Å; V179-I181 PolarHBondContact O-N 3.13Å; I181-I183 VanDerWaalsContact C-N 3.32Å; I181-I183 PolarHBondContact O-N 3.3Å; I181-S184 PolarHBondContact O-N 2.82Å; I181-S184 PolarHBondContact O-OG 2.87Å; I181-L185 PolarHBondContact O-N 2.93Å |
| 182 | P | 90.5 | Very high | 87.3 | Confident | 56 Ų | 56 | 35 Ų | 35 | 36% | 0.364 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -65.4 | -37.9 | 173.9 | 24.5 | -33.1 | 0 | 0 | 0 | 111.5 | M71 S178 V179 S184 L185 L186 | M71-P182 HydrophobicContact CE-CG 4.45Å; S178-P182 VanDerWaalsContact O-CD 3.27Å; S178-P182 WeakPolarHBondContact O-CD 3.3Å; V179-P182 WeakPolarHBondContact O-CD 3.41Å; V179-P182 WeakPolarHBondContact O-CG 3.24Å; P182-S184 VanDerWaalsContact C-N 3.31Å; P182-S184 PolarHBondContact O-N 3.3Å; P182-L185 PolarHBondContact O-N 2.84Å; P182-L186 WeakPolarHBondContact O-CD1 3.35Å; P182-L186 PolarHBondContact O-N 3.46Å; P182-L186 VanDerWaalsContact O-N 3.07Å |
| 183 | I | 90.4 | Very high | 87.9 | Confident | 11 Ų | 11 | 42.9 Ų | 42.9 | 6% | 0.056 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.2 | -41.6 | 178.7 | -69.9 | 171.3 | 0 | 0 | 0 | 111.8 | V179 F180 I181 L185 L186 W187 L198 | V179-I183 HydrophobicContact CG1-CD1 3.92Å; V179-I183 WeakPolarHBondContact O-CD1 3.21Å; V179-I183 WeakPolarHBondContact O-CG1 3.35Å; F180-I183 PolarHBondContact O-N 3.44Å; I181-I183 VanDerWaalsContact C-N 3.32Å; I181-I183 PolarHBondContact O-N 3.3Å; I183-L185 VanDerWaalsContact C-N 3.3Å; I183-L185 PolarHBondContact O-N 3.47Å; I183-L186 WeakPolarHBondContact O-CB 3.19Å; I183-L186 PolarHBondContact O-N 3.47Å; I183-L186 VanDerWaalsContact O-N 3.11Å; I183-W187 HydrophobicContact CG2-CZ2 4.43Å; I183-W187 PolarHBondContact O-N 2.9Å; I183-W187 VanDerWaalsContact O-N 3.16Å; I183-L198 HydrophobicContact CG2-CB 3.85Å |
| 184 | S | 92 | Very high | 88.2 | Confident | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.007 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.1 | -32.5 | -178.3 | 74.7 | 0 | 0 | 0 | 0 | 112 | T103 F180 I181 P182 W187 | T103-S184 VanDerWaalsContact CB-OG 3.24Å; T103-S184 WeakPolarHBondContact CB-OG 3.36Å; T103-S184 PolarHBondContact OG1-OG 3.33Å; F180-S184 VanDerWaalsContact O-CB 3.3Å; F180-S184 WeakPolarHBondContact O-CB 3.37Å; F180-S184 PolarHBondContact O-N 3.37Å; F180-S184 PolarHBondContact O-OG 3.21Å; I181-S184 PolarHBondContact O-N 2.82Å; I181-S184 PolarHBondContact O-OG 2.87Å; P182-S184 VanDerWaalsContact C-N 3.31Å; P182-S184 PolarHBondContact O-N 3.3Å; S184-W187 WeakPolarHBondContact O-CB 3.38Å; S184-W187 PolarHBondContact O-N 3.2Å |
| 185 | L | 90.1 | Very high | 88.4 | Confident | 83 Ų | 83 | 48.1 Ų | 48.1 | 44% | 0.435 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -69.5 | -38.5 | 170.6 | -66.9 | 175.4 | 0 | 0 | 0 | 111.8 | T103 I181 P182 I183 W187 A188 | T103-L185 HydrophobicContact CG2-CD2 4.24Å; T103-L185 HydrophobicContact CG2-CG 4.41Å; I181-L185 PolarHBondContact O-N 2.93Å; P182-L185 PolarHBondContact O-N 2.84Å; I183-L185 VanDerWaalsContact C-N 3.3Å; I183-L185 PolarHBondContact O-N 3.47Å; L185-W187 PolarHBondContact O-N 2.91Å; L185-A188 VanDerWaalsContact O-CB 3.23Å; L185-A188 WeakPolarHBondContact O-CB 3.29Å; L185-A188 PolarHBondContact O-N 3.2Å; L185-A188 VanDerWaalsContact O-N 3.08Å |
| 186 | L | 90.6 | Very high | 88.9 | Confident | 79 Ų | 79 | 54.9 Ų | 54.9 | 41% | 0.414 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -64.7 | -21.7 | 176.4 | -90.3 | 73.8 | 0 | 0 | 0 | 112.9 | P182 I183 A188 V189 F194 L198 | P182-L186 WeakPolarHBondContact O-CD1 3.35Å; P182-L186 PolarHBondContact O-N 3.46Å; P182-L186 VanDerWaalsContact O-N 3.07Å; I183-L186 WeakPolarHBondContact O-CB 3.19Å; I183-L186 PolarHBondContact O-N 3.47Å; I183-L186 VanDerWaalsContact O-N 3.11Å; L186-A188 PolarHBondContact O-N 3.05Å; L186-A188 VanDerWaalsContact O-N 3.13Å; L186-V189 PolarHBondContact O-N 3.21Å; L186-F194 HydrophobicContact CD2-CZ 4.4Å; L186-L198 HydrophobicContact CB-CD1 3.68Å; L186-L198 HydrophobicContact CD2-CD1 4.24Å; L186-L198 HydrophobicContact CD2-CD2 4.2Å |
| 187 | W | 88.2 | Confident | 89.3 | Confident | 45 Ų | 45 | 58.6 Ų | 58.6 | 17% | 0.17 | 28% | 0.279 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.2 | -10 | 171.8 | -69.4 | -14.8 | 0 | 0 | 0 | 114.3 | A104 I183 S184 L185 V189 R195 T199 | A104-W187 HydrophobicContact CB-CZ3 4.45Å; I183-W187 HydrophobicContact CG2-CZ2 4.43Å; I183-W187 PolarHBondContact O-N 2.9Å; I183-W187 VanDerWaalsContact O-N 3.16Å; S184-W187 WeakPolarHBondContact O-CB 3.38Å; S184-W187 PolarHBondContact O-N 3.2Å; L185-W187 PolarHBondContact O-N 2.91Å; W187-V189 PolarHBondContact O-N 3.39Å; W187-R195 HydrophobicContact CB-CG 4.45Å; W187-R195 HydrophobicContact CG-CG 4.31Å; W187-T199 VanDerWaalsContact CZ2-OG1 3.25Å; W187-T199 WeakPolarHBondContact CZ2-OG1 3.28Å |
| 188 | A | 86.8 | Confident | 89.5 | Confident | 9 Ų | 9 | 59.3 Ų | 59.3 | 7% | 0.074 | 28% | 0.283 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -25.6 | 167.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | G107 L110 G111 L114 L185 L186 N190 | G107-A188 WeakPolarHBondContact O-CA 3.26Å; L110-A188 HydrophobicContact CB-CB 4.04Å; L110-A188 HydrophobicContact CD2-CB 4Å; L110-A188 HydrophobicContact CG-CB 4.31Å; G111-A188 WeakPolarHBondContact CA-O 3.49Å; L114-A188 HydrophobicContact CD1-CB 4.45Å; L185-A188 VanDerWaalsContact O-CB 3.23Å; L185-A188 WeakPolarHBondContact O-CB 3.29Å; L185-A188 PolarHBondContact O-N 3.2Å; L185-A188 VanDerWaalsContact O-N 3.08Å; L186-A188 PolarHBondContact O-N 3.05Å; L186-A188 VanDerWaalsContact O-N 3.13Å; A188-N190 PolarHBondContact O-N 2.64Å; A188-N190 VanDerWaalsContact O-N 3.15Å |
| 189 | V | 86.3 | Confident | 89.6 | Confident | 68 Ų | 68 | 60.9 Ų | 60.9 | 41% | 0.412 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -75.1 | 103.5 | 168.8 | -175.4 | 0 | 0 | 0 | 0 | 108.6 | L186 W187 I191 F194 | L186-V189 PolarHBondContact O-N 3.21Å; W187-V189 PolarHBondContact O-N 3.39Å; V189-I191 HydrophobicContact CG1-CB 4.45Å; V189-I191 HydrophobicContact CG1-CD1 3.72Å; V189-I191 HydrophobicContact CG1-CG1 3.91Å; V189-I191 PolarHBondContact O-N 2.71Å; V189-F194 HydrophobicContact CB-CD1 4.25Å; V189-F194 HydrophobicContact CB-CE1 4.32Å; V189-F194 HydrophobicContact CG1-CD1 4.35Å |
| 190 | N | 83.1 | Confident | 89.9 | Confident | 65 Ų | 65 | 65.9 Ų | 65.9 | 35% | 0.348 | 32% | 0.318 | S | S | . | . | trans | -77.5 | 50.8 | -172.4 | -158 | -7.8 | 0 | 0 | 0 | 113.6 | G111 A188 | G111-N190 PolarHBondContact O-ND2 2.86Å; A188-N190 PolarHBondContact O-N 2.64Å; A188-N190 VanDerWaalsContact O-N 3.15Å | ||
| 191 | I | 86.6 | Confident | 89.9 | Confident | 93 Ų | 93 | 70.4 Ų | 70.4 | 48% | 0.477 | 34% | 0.338 | S | S | . | . | trans | -107.3 | 114.4 | 175.2 | -60.5 | 171.8 | 0 | 0 | 0 | 108.2 | V189 W193 F194 R195 | V189-I191 HydrophobicContact CG1-CB 4.45Å; V189-I191 HydrophobicContact CG1-CD1 3.72Å; V189-I191 HydrophobicContact CG1-CG1 3.91Å; V189-I191 PolarHBondContact O-N 2.71Å; I191-W193 PolarHBondContact O-N 3.32Å; I191-F194 HydrophobicContact CB-CB 3.91Å; I191-F194 HydrophobicContact CG2-CB 3.94Å; I191-F194 WeakPolarHBondContact O-CB 3.3Å; I191-F194 PolarHBondContact O-N 3.33Å; I191-F194 VanDerWaalsContact O-N 3.13Å; I191-R195 PolarHBondContact O-N 3.46Å | ||
| 192 | Q | 87.6 | Confident | 89.9 | Confident | 121 Ų | 121 | 68.4 Ų | 68.4 | 57% | 0.565 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -56.2 | -50.1 | -171.2 | -175.7 | 65.8 | -1.3 | 0 | 0 | 113.3 | F194 R195 W196 | Q192-F194 VanDerWaalsContact C-N 3.32Å; Q192-F194 PolarHBondContact O-N 3.15Å; Q192-R195 PolarHBondContact O-N 3.01Å; Q192-W196 VanDerWaalsContact NE2-NE1 3.13Å; Q192-W196 VanDerWaalsContact O-CD1 3.24Å; Q192-W196 PolarHBondContact O-N 2.8Å |
| 193 | W | 91.7 | Very high | 89.9 | Confident | 180 Ų | 180 | 68.7 Ų | 68.7 | 68% | 0.682 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -62 | -39.6 | 179.1 | 160.7 | 74 | 0 | 0 | 0 | 112.4 | I191 R195 W196 L197 | I191-W193 PolarHBondContact O-N 3.32Å; W193-R195 PolarHBondContact O-N 2.79Å; W193-W196 PolarHBondContact O-N 2.69Å; W193-L197 HydrophobicContact CH2-CD1 4.34Å; W193-L197 HydrophobicContact CZ2-CD1 3.52Å; W193-L197 WeakPolarHBondContact O-CB 3.49Å; W193-L197 PolarHBondContact O-N 3.07Å |
| 194 | F | 90.5 | Very high | 89.8 | Confident | 61 Ų | 61 | 75.6 Ų | 75.6 | 27% | 0.268 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -64.7 | -40.7 | 179.3 | -174.8 | -114 | 0 | 0 | 0 | 111.6 | L186 V189 I191 Q192 W196 L197 L198 | L186-F194 HydrophobicContact CD2-CZ 4.4Å; V189-F194 HydrophobicContact CB-CD1 4.25Å; V189-F194 HydrophobicContact CB-CE1 4.32Å; V189-F194 HydrophobicContact CG1-CD1 4.35Å; I191-F194 HydrophobicContact CB-CB 3.91Å; I191-F194 HydrophobicContact CG2-CB 3.94Å; I191-F194 WeakPolarHBondContact O-CB 3.3Å; I191-F194 PolarHBondContact O-N 3.33Å; I191-F194 VanDerWaalsContact O-N 3.13Å; Q192-F194 VanDerWaalsContact C-N 3.32Å; Q192-F194 PolarHBondContact O-N 3.15Å; F194-W196 PolarHBondContact O-N 3.21Å; F194-L197 PolarHBondContact O-N 2.89Å; F194-L198 HydrophobicContact CD1-CD1 3.8Å; F194-L198 HydrophobicContact CD1-CG 4.46Å; F194-L198 HydrophobicContact CE1-CD1 3.41Å; F194-L198 VanDerWaalsContact CE1-CD1 3.41Å; F194-L198 HydrophobicContact CE1-CG 4.18Å; F194-L198 HydrophobicContact CE2-CD1 4.41Å; F194-L198 HydrophobicContact CE2-CG 4.33Å; F194-L198 HydrophobicContact CG-CD1 4.46Å; F194-L198 HydrophobicContact CZ-CD1 3.75Å; F194-L198 HydrophobicContact CZ-CD2 4.26Å; F194-L198 HydrophobicContact CZ-CG 4.1Å; F194-L198 WeakPolarHBondContact O-CB 3.49Å; F194-L198 WeakPolarHBondContact O-CG 3.41Å; F194-L198 PolarHBondContact O-N 3.08Å |
| 195 | R | 90.4 | Very high | 89.6 | Confident | 52 Ų | 52 | 77.8 Ų | 77.8 | 20% | 0.196 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -59.7 | -47 | 174.6 | -66.7 | 176.4 | 81 | 167.5 | 6.6 | 111.3 | N108 W187 I191 Q192 W193 L198 T199 | N108-R195 PolarHBondContact OD1-NH2 3.44Å; W187-R195 HydrophobicContact CB-CG 4.45Å; W187-R195 HydrophobicContact CG-CG 4.31Å; I191-R195 PolarHBondContact O-N 3.46Å; Q192-R195 PolarHBondContact O-N 3.01Å; W193-R195 PolarHBondContact O-N 2.79Å; R195-L198 PolarHBondContact O-N 2.79Å; R195-T199 PolarHBondContact O-N 2.99Å; R195-T199 PolarHBondContact O-OG1 3.4Å |
| 196 | W | 91.8 | Very high | 89.4 | Confident | 151 Ų | 151 | 73.9 Ų | 73.9 | 57% | 0.572 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -62.4 | -42.7 | 176.9 | -79.7 | 106.5 | 0 | 0 | 0 | 112.9 | Q192 W193 F194 T199 L200 | Q192-W196 VanDerWaalsContact NE2-NE1 3.13Å; Q192-W196 VanDerWaalsContact O-CD1 3.24Å; Q192-W196 PolarHBondContact O-N 2.8Å; W193-W196 PolarHBondContact O-N 2.69Å; F194-W196 PolarHBondContact O-N 3.21Å; W196-T199 PolarHBondContact O-N 3.5Å; W196-L200 WeakPolarHBondContact O-CB 3.41Å; W196-L200 WeakPolarHBondContact O-CG 3.47Å; W196-L200 PolarHBondContact O-N 2.95Å |
| 197 | L | 94 | Very high | 89.2 | Confident | 78 Ų | 78 | 71 Ų | 71 | 41% | 0.408 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 178.6 | -167.9 | 149.6 | 0 | 0 | 0 | 111.1 | W193 F194 L200 F201 | W193-L197 HydrophobicContact CH2-CD1 4.34Å; W193-L197 HydrophobicContact CZ2-CD1 3.52Å; W193-L197 WeakPolarHBondContact O-CB 3.49Å; W193-L197 PolarHBondContact O-N 3.07Å; F194-L197 PolarHBondContact O-N 2.89Å; L197-L200 PolarHBondContact O-N 3.4Å; L197-F201 VanDerWaalsContact O-CB 3.28Å; L197-F201 WeakPolarHBondContact O-CB 3.39Å; L197-F201 PolarHBondContact O-N 3.02Å |
| 198 | L | 91.6 | Very high | 88.9 | Confident | 17 Ų | 17 | 69.9 Ų | 69.9 | 9% | 0.089 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.3 | -41.5 | 174.9 | -73.8 | 175.9 | 0 | 0 | 0 | 112.6 | I183 L186 F194 R195 F201 G202 | I183-L198 HydrophobicContact CG2-CB 3.85Å; L186-L198 HydrophobicContact CB-CD1 3.68Å; L186-L198 HydrophobicContact CD2-CD1 4.24Å; L186-L198 HydrophobicContact CD2-CD2 4.2Å; F194-L198 HydrophobicContact CD1-CD1 3.8Å; F194-L198 HydrophobicContact CD1-CG 4.46Å; F194-L198 HydrophobicContact CE1-CD1 3.41Å; F194-L198 VanDerWaalsContact CE1-CD1 3.41Å; F194-L198 HydrophobicContact CE1-CG 4.18Å; F194-L198 HydrophobicContact CE2-CD1 4.41Å; F194-L198 HydrophobicContact CE2-CG 4.33Å; F194-L198 HydrophobicContact CG-CD1 4.46Å; F194-L198 HydrophobicContact CZ-CD1 3.75Å; F194-L198 HydrophobicContact CZ-CD2 4.26Å; F194-L198 HydrophobicContact CZ-CG 4.1Å; F194-L198 WeakPolarHBondContact O-CB 3.49Å; F194-L198 WeakPolarHBondContact O-CG 3.41Å; F194-L198 PolarHBondContact O-N 3.08Å; R195-L198 PolarHBondContact O-N 2.79Å; L198-F201 PolarHBondContact O-N 3.41Å; L198-G202 PolarHBondContact O-N 2.84Å |
| 199 | T | 90.6 | Very high | 88.6 | Confident | 39 Ų | 39 | 70.7 Ų | 70.7 | 24% | 0.239 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.4 | -48.3 | 176.8 | -56.6 | 0 | 0 | 0 | 0 | 111.2 | W187 R195 W196 F201 G202 V203 | W187-T199 VanDerWaalsContact CZ2-OG1 3.25Å; W187-T199 WeakPolarHBondContact CZ2-OG1 3.28Å; R195-T199 PolarHBondContact O-N 2.99Å; R195-T199 PolarHBondContact O-OG1 3.4Å; W196-T199 PolarHBondContact O-N 3.5Å; T199-F201 VanDerWaalsContact C-N 3.29Å; T199-F201 PolarHBondContact O-N 3.47Å; T199-G202 PolarHBondContact O-N 3.43Å; T199-V203 WeakPolarHBondContact O-CG2 3.28Å; T199-V203 PolarHBondContact O-N 3.2Å |
| 200 | L | 93.2 | Very high | 88.2 | Confident | 116 Ų | 116 | 67.7 Ų | 67.7 | 61% | 0.607 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -61.5 | -40.8 | 177.8 | -72.3 | 173.8 | 0 | 0 | 0 | 111.5 | W196 L197 V203 F204 | W196-L200 WeakPolarHBondContact O-CB 3.41Å; W196-L200 WeakPolarHBondContact O-CG 3.47Å; W196-L200 PolarHBondContact O-N 2.95Å; L197-L200 PolarHBondContact O-N 3.4Å; L200-V203 PolarHBondContact O-N 3.18Å; L200-F204 VanDerWaalsContact O-CB 3.28Å; L200-F204 WeakPolarHBondContact O-CB 3.1Å; L200-F204 PolarHBondContact O-N 2.87Å |
| 201 | F | 91.4 | Very high | 88.1 | Confident | 112 Ų | 112 | 69.1 Ų | 69.1 | 49% | 0.491 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.8 | -44.1 | 176.2 | -174.6 | -109.2 | 0 | 0 | 0 | 112 | L197 L198 T199 F204 L205 | L197-F201 VanDerWaalsContact O-CB 3.28Å; L197-F201 WeakPolarHBondContact O-CB 3.39Å; L197-F201 PolarHBondContact O-N 3.02Å; L198-F201 PolarHBondContact O-N 3.41Å; T199-F201 VanDerWaalsContact C-N 3.29Å; T199-F201 PolarHBondContact O-N 3.47Å; F201-F204 PolarHBondContact O-N 3Å; F201-L205 HydrophobicContact CD1-CD1 3.69Å; F201-L205 HydrophobicContact CE1-CD1 3.22Å; F201-L205 HydrophobicContact CE1-CG 4.38Å; F201-L205 HydrophobicContact CE2-CD1 4.11Å; F201-L205 HydrophobicContact CG-CD1 4.32Å; F201-L205 HydrophobicContact CZ-CD1 3.46Å; F201-L205 VanDerWaalsContact CZ-CD1 3.46Å; F201-L205 HydrophobicContact CZ-CG 4.29Å; F201-L205 WeakPolarHBondContact O-CB 3.23Å; F201-L205 PolarHBondContact O-N 3.39Å |
| 202 | G | 89.6 | Confident | 87.8 | Confident | 0 Ų | 0 | 69 Ų | 69 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60.6 | -48.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L198 T199 F204 L205 S206 | L198-G202 PolarHBondContact O-N 2.84Å; T199-G202 PolarHBondContact O-N 3.43Å; G202-F204 VanDerWaalsContact C-N 3.3Å; G202-F204 PolarHBondContact O-N 3.19Å; G202-L205 PolarHBondContact O-N 3.47Å; G202-S206 PolarHBondContact O-N 3.44Å; G202-S206 PolarHBondContact O-OG 2.98Å; G202-S206 VanDerWaalsContact O-OG 3.09Å |
| 203 | V | 90.9 | Very high | 87.2 | Confident | 61 Ų | 61 | 64 Ų | 64 | 37% | 0.37 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -60.9 | -40.7 | 177.5 | 170.5 | 0 | 0 | 0 | 0 | 111.2 | F180 T199 L200 S206 G207 | F180-V203 HydrophobicContact CZ-CG2 3.86Å; F180-V203 VanDerWaalsContact CZ-N 3.34Å; T199-V203 WeakPolarHBondContact O-CG2 3.28Å; T199-V203 PolarHBondContact O-N 3.2Å; L200-V203 PolarHBondContact O-N 3.18Å; V203-S206 PolarHBondContact O-OG 3.26Å; V203-G207 WeakPolarHBondContact O-CA 3.33Å; V203-G207 PolarHBondContact O-N 3.18Å |
| 204 | F | 89.8 | Confident | 86.4 | Confident | 157 Ų | 157 | 55.7 Ų | 55.7 | 69% | 0.689 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -67.2 | -42.8 | 178.4 | -178.2 | -98.7 | 0 | 0 | 0 | 111.9 | L200 F201 G202 G208 | L200-F204 VanDerWaalsContact O-CB 3.28Å; L200-F204 WeakPolarHBondContact O-CB 3.1Å; L200-F204 PolarHBondContact O-N 2.87Å; F201-F204 PolarHBondContact O-N 3Å; G202-F204 VanDerWaalsContact C-N 3.3Å; G202-F204 PolarHBondContact O-N 3.19Å; F204-G208 WeakPolarHBondContact O-CA 3.39Å; F204-G208 PolarHBondContact O-N 3.07Å |
| 205 | L | 86.1 | Confident | 85.9 | Confident | 47 Ų | 47 | 59.9 Ų | 59.9 | 25% | 0.246 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66 | -50.3 | 177.3 | -84.3 | 166.2 | 0 | 0 | 0 | 112 | V179 F201 G202 G208 V209 | V179-L205 HydrophobicContact CG1-CB 4.24Å; V179-L205 HydrophobicContact CG1-CD1 3.84Å; F201-L205 HydrophobicContact CD1-CD1 3.69Å; F201-L205 HydrophobicContact CE1-CD1 3.22Å; F201-L205 HydrophobicContact CE1-CG 4.38Å; F201-L205 HydrophobicContact CE2-CD1 4.11Å; F201-L205 HydrophobicContact CG-CD1 4.32Å; F201-L205 HydrophobicContact CZ-CD1 3.46Å; F201-L205 VanDerWaalsContact CZ-CD1 3.46Å; F201-L205 HydrophobicContact CZ-CG 4.29Å; F201-L205 WeakPolarHBondContact O-CB 3.23Å; F201-L205 PolarHBondContact O-N 3.39Å; G202-L205 PolarHBondContact O-N 3.47Å; L205-G208 PolarHBondContact O-N 2.87Å; L205-V209 WeakPolarHBondContact O-CG2 3.45Å; L205-V209 PolarHBondContact O-N 3.48Å |
| 206 | S | 87.4 | Confident | 85.2 | Confident | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.7 | -45.2 | 179.4 | 61.8 | 0 | 0 | 0 | 0 | 111.5 | Y143 G202 V203 G208 V209 L210 | Y143-S206 PolarHBondContact OH-OG 3.36Å; G202-S206 PolarHBondContact O-N 3.44Å; G202-S206 PolarHBondContact O-OG 2.98Å; G202-S206 VanDerWaalsContact O-OG 3.09Å; V203-S206 PolarHBondContact O-OG 3.26Å; S206-G208 VanDerWaalsContact C-N 3.34Å; S206-G208 PolarHBondContact O-N 2.95Å; S206-V209 PolarHBondContact O-N 3.05Å; S206-L210 PolarHBondContact O-N 2.87Å |
| 207 | G | 85.1 | Confident | 84.3 | Confident | 20 Ų | 20 | 53.1 Ų | 53.1 | 21% | 0.206 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.5 | -37.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V203 L210 L211 | V203-G207 WeakPolarHBondContact O-CA 3.33Å; V203-G207 PolarHBondContact O-N 3.18Å; G207-L210 PolarHBondContact O-N 3.42Å; G207-L211 WeakPolarHBondContact O-CB 3.19Å; G207-L211 WeakPolarHBondContact O-CG 3.4Å; G207-L211 PolarHBondContact O-N 3.34Å |
| 208 | G | 82.7 | Confident | 83.4 | Confident | 20 Ų | 20 | 51.8 Ų | 51.8 | 21% | 0.206 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | F204 L205 S206 L210 L211 L212 | F204-G208 WeakPolarHBondContact O-CA 3.39Å; F204-G208 PolarHBondContact O-N 3.07Å; L205-G208 PolarHBondContact O-N 2.87Å; S206-G208 VanDerWaalsContact C-N 3.34Å; S206-G208 PolarHBondContact O-N 2.95Å; G208-L210 VanDerWaalsContact C-N 3.31Å; G208-L210 PolarHBondContact O-N 2.83Å; G208-L211 PolarHBondContact O-N 3.12Å; G208-L212 WeakPolarHBondContact O-CB 3.48Å; G208-L212 WeakPolarHBondContact O-CG 3.33Å; G208-L212 PolarHBondContact O-N 2.87Å |
| 209 | V | 79.3 | Confident | 82.7 | Confident | 27 Ų | 27 | 57.8 Ų | 57.8 | 16% | 0.164 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.9 | -42.3 | 176.2 | 171.4 | 0 | 0 | 0 | 0 | 111.3 | L205 S206 S213 | L205-V209 WeakPolarHBondContact O-CG2 3.45Å; L205-V209 PolarHBondContact O-N 3.48Å; S206-V209 PolarHBondContact O-N 3.05Å; V209-S213 WeakPolarHBondContact O-CB 3.4Å; V209-S213 PolarHBondContact O-N 3.32Å; V209-S213 PolarHBondContact O-OG 2.77Å |
| 210 | L | 79.1 | Confident | 81.9 | Confident | 4 Ų | 4 | 61.2 Ų | 61.2 | 2% | 0.021 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66.1 | -47.3 | 177.1 | -167.2 | 92 | 0 | 0 | 0 | 111.8 | V147 F151 Y173 S206 G207 G208 L212 S213 I214 | V147-L210 HydrophobicContact CG1-CD2 3.81Å; F151-L210 HydrophobicContact CD2-CD2 3.31Å; F151-L210 HydrophobicContact CE2-CD2 3.18Å; F151-L210 HydrophobicContact CE2-CG 4.46Å; F151-L210 HydrophobicContact CG-CD2 4.11Å; F151-L210 HydrophobicContact CZ-CD2 3.87Å; Y173-L210 HydrophobicContact CD2-CB 4.12Å; Y173-L210 HydrophobicContact CD2-CD1 3.7Å; Y173-L210 HydrophobicContact CD2-CD2 4.47Å; Y173-L210 HydrophobicContact CD2-CG 4.32Å; Y173-L210 HydrophobicContact CG-CD1 4Å; S206-L210 PolarHBondContact O-N 2.87Å; G207-L210 PolarHBondContact O-N 3.42Å; G208-L210 VanDerWaalsContact C-N 3.31Å; G208-L210 PolarHBondContact O-N 2.83Å; L210-L212 VanDerWaalsContact C-N 3.33Å; L210-L212 PolarHBondContact O-N 3.27Å; L210-S213 WeakPolarHBondContact O-CB 3.39Å; L210-S213 PolarHBondContact O-N 2.86Å; L210-S213 VanDerWaalsContact O-N 3.11Å; L210-I214 HydrophobicContact CD2-CD1 4.15Å; L210-I214 HydrophobicContact CG-CD1 3.91Å; L210-I214 WeakPolarHBondContact O-CB 3.44Å; L210-I214 WeakPolarHBondContact O-CG1 3.36Å; L210-I214 PolarHBondContact O-N 3.4Å |
| 211 | L | 80.9 | Confident | 80.7 | Confident | 96 Ų | 96 | 57.5 Ų | 57.5 | 50% | 0.503 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -57.6 | -46.1 | 176.7 | -84.1 | 164.3 | 0 | 0 | 0 | 111.3 | F151 G207 G208 S213 I214 W215 | F151-L211 HydrophobicContact CZ-CD2 4.26Å; G207-L211 WeakPolarHBondContact O-CB 3.19Å; G207-L211 WeakPolarHBondContact O-CG 3.4Å; G207-L211 PolarHBondContact O-N 3.34Å; G208-L211 PolarHBondContact O-N 3.12Å; L211-S213 VanDerWaalsContact C-N 3.28Å; L211-S213 PolarHBondContact O-N 3.21Å; L211-I214 PolarHBondContact O-N 3.42Å; L211-W215 WeakPolarHBondContact O-CA 3.4Å; L211-W215 WeakPolarHBondContact O-CB 3.46Å; L211-W215 PolarHBondContact O-N 3.28Å |
| 212 | L | 79.3 | Confident | 79.7 | Confident | 89 Ų | 89 | 55.2 Ų | 55.2 | 47% | 0.466 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -63.6 | -33.9 | 177.1 | -70.6 | 172.4 | 0 | 0 | 0 | 112.4 | P73 G208 L210 P216 | P73-L212 HydrophobicContact CB-CD1 4.43Å; G208-L212 WeakPolarHBondContact O-CB 3.48Å; G208-L212 WeakPolarHBondContact O-CG 3.33Å; G208-L212 PolarHBondContact O-N 2.87Å; L210-L212 VanDerWaalsContact C-N 3.33Å; L210-L212 PolarHBondContact O-N 3.27Å; L212-P216 VanDerWaalsContact O-CD 3.27Å; L212-P216 WeakPolarHBondContact O-CD 3.32Å |
| 213 | S | 75.5 | Confident | 78.8 | Confident | 16 Ų | 16 | 63.8 Ų | 63.8 | 11% | 0.112 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -71.4 | -34.9 | 177 | -60.5 | 0 | 0 | 0 | 0 | 112.3 | V209 L210 L211 P216 | V209-S213 WeakPolarHBondContact O-CB 3.4Å; V209-S213 PolarHBondContact O-N 3.32Å; V209-S213 PolarHBondContact O-OG 2.77Å; L210-S213 WeakPolarHBondContact O-CB 3.39Å; L210-S213 PolarHBondContact O-N 2.86Å; L210-S213 VanDerWaalsContact O-N 3.11Å; L211-S213 VanDerWaalsContact C-N 3.28Å; L211-S213 PolarHBondContact O-N 3.21Å; S213-P216 WeakPolarHBondContact O-CD 3.43Å |
| 214 | I | 76.2 | Confident | 77.7 | Confident | 6 Ų | 6 | 66.1 Ų | 66.1 | 3% | 0.031 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -87.3 | -30 | -177.8 | -72.7 | 175.3 | 0 | 0 | 0 | 112.5 | F151 F155 L169 L210 L211 P216 V217 V218 | F151-I214 HydrophobicContact CB-CD1 4.04Å; F151-I214 HydrophobicContact CD1-CD1 3.24Å; F151-I214 HydrophobicContact CD1-CG2 4.31Å; F151-I214 HydrophobicContact CD2-CD1 4.28Å; F151-I214 HydrophobicContact CE1-CD1 3.61Å; F151-I214 HydrophobicContact CE1-CG2 4.21Å; F151-I214 HydrophobicContact CG-CD1 3.59Å; F151-I214 HydrophobicContact CZ-CD1 4.28Å; F155-I214 HydrophobicContact CE1-CG2 3.8Å; F155-I214 HydrophobicContact CE2-CD1 4.18Å; F155-I214 HydrophobicContact CE2-CG1 4.44Å; F155-I214 HydrophobicContact CZ-CB 4.22Å; F155-I214 HydrophobicContact CZ-CD1 3.93Å; F155-I214 HydrophobicContact CZ-CG1 3.94Å; F155-I214 HydrophobicContact CZ-CG2 3.4Å; F155-I214 VanDerWaalsContact CZ-CG2 3.4Å; L169-I214 HydrophobicContact CD2-CD1 4.23Å; L210-I214 HydrophobicContact CD2-CD1 4.15Å; L210-I214 HydrophobicContact CG-CD1 3.91Å; L210-I214 WeakPolarHBondContact O-CB 3.44Å; L210-I214 WeakPolarHBondContact O-CG1 3.36Å; L210-I214 PolarHBondContact O-N 3.4Å; L211-I214 PolarHBondContact O-N 3.42Å; I214-P216 VanDerWaalsContact C-N 3.34Å; I214-V217 WeakPolarHBondContact O-CB 3.42Å; I214-V217 PolarHBondContact O-N 3.04Å; I214-V218 HydrophobicContact CG2-CG2 3.74Å; I214-V218 PolarHBondContact O-N 3.45Å |
| 215 | W | 78.5 | Confident | 76.5 | Confident | 150 Ų | 150 | 63.6 Ų | 63.6 | 57% | 0.568 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -48.8 | -43.6 | -176.8 | -176.2 | -98.5 | 0 | 0 | 0 | 114.6 | L211 V217 V218 R219 | L211-W215 WeakPolarHBondContact O-CA 3.4Å; L211-W215 WeakPolarHBondContact O-CB 3.46Å; L211-W215 PolarHBondContact O-N 3.28Å; W215-V217 VanDerWaalsContact C-N 3.31Å; W215-V217 PolarHBondContact O-N 3.4Å; W215-V218 PolarHBondContact O-N 2.98Å; W215-R219 VanDerWaalsContact O-CB 3.3Å; W215-R219 WeakPolarHBondContact O-CB 3.37Å; W215-R219 PolarHBondContact O-N 3.42Å |
| 216 | P | 75.6 | Confident | 75.5 | Confident | 43 Ų | 43 | 67 Ų | 67 | 28% | 0.279 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -61.7 | -38.8 | 179.3 | -19.6 | 31.8 | 0 | 0 | 0 | 112.6 | N78 L212 S213 I214 K220 | N78-P216 WeakPolarHBondContact OD1-CG 3.27Å; L212-P216 VanDerWaalsContact O-CD 3.27Å; L212-P216 WeakPolarHBondContact O-CD 3.32Å; S213-P216 WeakPolarHBondContact O-CD 3.43Å; I214-P216 VanDerWaalsContact C-N 3.34Å; P216-K220 WeakPolarHBondContact O-CB 3.42Å; P216-K220 PolarHBondContact O-N 2.96Å |
| 217 | V | 74.3 | Confident | 73.7 | Confident | 17 Ų | 17 | 78.7 Ų | 78.7 | 10% | 0.103 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -68.2 | -48.5 | -179.5 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | D162 Y164 I214 W215 R219 K220 H221 | D162-V217 VanDerWaalsContact O-CG1 3.28Å; D162-V217 WeakPolarHBondContact O-CG1 3.32Å; Y164-V217 HydrophobicContact CD2-CG2 4.11Å; Y164-V217 HydrophobicContact CE1-CG2 4.46Å; Y164-V217 HydrophobicContact CE2-CB 4.31Å; Y164-V217 HydrophobicContact CE2-CG2 3.27Å; Y164-V217 VanDerWaalsContact CZ-CG2 3.48Å; Y164-V217 WeakPolarHBondContact OH-CG2 3.42Å; I214-V217 WeakPolarHBondContact O-CB 3.42Å; I214-V217 PolarHBondContact O-N 3.04Å; W215-V217 VanDerWaalsContact C-N 3.31Å; W215-V217 PolarHBondContact O-N 3.4Å; V217-R219 VanDerWaalsContact C-N 3.3Å; V217-R219 PolarHBondContact O-N 2.95Å; V217-K220 PolarHBondContact O-N 2.85Å; V217-H221 PolarHBondContact O-N 3.48Å |
| 218 | V | 74.7 | Confident | 73.2 | Confident | 51 Ų | 51 | 81.7 Ų | 81.7 | 31% | 0.309 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.8 | -42.4 | 177.6 | 174 | 0 | 0 | 0 | 0 | 110.8 | F155 I214 W215 K220 H221 S222 | F155-V218 HydrophobicContact CE1-CG2 4.04Å; I214-V218 HydrophobicContact CG2-CG2 3.74Å; I214-V218 PolarHBondContact O-N 3.45Å; W215-V218 PolarHBondContact O-N 2.98Å; V218-K220 PolarHBondContact O-N 3.03Å; V218-H221 PolarHBondContact O-N 3.09Å; V218-S222 PolarHBondContact O-N 3.27Å |
| 219 | R | 76.2 | Confident | 72.7 | Confident | 143 Ų | 143 | 84.9 Ų | 84.9 | 54% | 0.54 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -66.6 | -37.7 | 179.2 | -155.5 | -179.1 | -149.9 | -172 | 6.8 | 112 | W215 V217 S222 R223 | W215-R219 VanDerWaalsContact O-CB 3.3Å; W215-R219 WeakPolarHBondContact O-CB 3.37Å; W215-R219 PolarHBondContact O-N 3.42Å; V217-R219 VanDerWaalsContact C-N 3.3Å; V217-R219 PolarHBondContact O-N 2.95Å; R219-S222 PolarHBondContact O-OG 3.31Å; R219-R223 PolarHBondContact O-N 3.09Å |
| 220 | K | 73.2 | Confident | 72.3 | Confident | 110 Ų | 110 | 88.1 Ų | 88.1 | 48% | 0.478 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.9 | -47.9 | 175.2 | -170 | -175.7 | 177.7 | -163.3 | 0 | 110.8 | D162 P216 V217 V218 S222 R223 L224 | D162-K220 WeakPolarHBondContact OD2-CE 3.35Å; D162-K220 IonicContact OD2-NZ 2.69Å; D162-K220 PolarHBondContact OD2-NZ 3.05Å; P216-K220 WeakPolarHBondContact O-CB 3.42Å; P216-K220 PolarHBondContact O-N 2.96Å; V217-K220 PolarHBondContact O-N 2.85Å; V218-K220 PolarHBondContact O-N 3.03Å; K220-S222 PolarHBondContact O-N 3.03Å; K220-R223 PolarHBondContact O-N 2.81Å; K220-L224 PolarHBondContact O-N 3.32Å |
| 221 | H | 69.7 | Low | 71.9 | Confident | 38 Ų | 38 | 93.1 Ų | 93.1 | 18% | 0.176 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 178.5 | -170.8 | -85.4 | 0 | 0 | 0 | 112.8 | M160 V217 V218 R223 L224 V225 | M160-H221 HydrophobicContact CE-CB 3.33Å; M160-H221 HydrophobicContact SD-CB 3.89Å; M160-H221 PolarHBondContact SD-CD2 3.23Å; M160-H221 PolarHBondContact SD-CE1 3.36Å; M160-H221 PolarHBondContact SD-ND1 3.27Å; M160-H221 PolarHBondContact SD-NE2 3.37Å; M160-H221 VanDerWaalsContact SD-NE2 3.41Å; V217-H221 PolarHBondContact O-N 3.48Å; V218-H221 PolarHBondContact O-N 3.09Å; H221-R223 PolarHBondContact O-N 2.82Å; H221-R223 VanDerWaalsContact O-N 3.16Å; H221-L224 PolarHBondContact O-N 2.82Å; H221-V225 WeakPolarHBondContact CE1-CG2 3.28Å; H221-V225 PolarHBondContact O-N 3.19Å; H221-V225 VanDerWaalsContact O-N 3.13Å |
| 222 | S | 70.3 | Confident | 71.4 | Confident | 64 Ų | 64 | 92.9 Ų | 92.9 | 45% | 0.448 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -58.7 | -30.5 | 177.7 | 70.4 | 0 | 0 | 0 | 0 | 113.4 | V218 R219 K220 | V218-S222 PolarHBondContact O-N 3.27Å; R219-S222 PolarHBondContact O-OG 3.31Å; K220-S222 PolarHBondContact O-N 3.03Å |
| 223 | R | 70.2 | Confident | 70.8 | Confident | 181 Ų | 181 | 93.1 Ų | 93.1 | 68% | 0.683 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -78.9 | -27 | 177 | -72.9 | -160.3 | -88.4 | -175.7 | -5.3 | 113.4 | R219 K220 H221 | R219-R223 PolarHBondContact O-N 3.09Å; K220-R223 PolarHBondContact O-N 2.81Å; H221-R223 PolarHBondContact O-N 2.82Å; H221-R223 VanDerWaalsContact O-N 3.16Å |
| 224 | L | 67.2 | Low | 70.5 | Confident | 110 Ų | 110 | 98.6 Ų | 98.6 | 58% | 0.576 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -76.3 | -37.3 | 177 | -67.3 | 170.7 | 0 | 0 | 0 | 111.6 | K220 H221 C226 K227 | K220-L224 PolarHBondContact O-N 3.32Å; H221-L224 PolarHBondContact O-N 2.82Å; L224-C226 VanDerWaalsContact C-N 3.27Å; L224-C226 PolarHBondContact O-N 3.48Å; L224-K227 PolarHBondContact O-N 3.23Å |
| 225 | V | 66 | Low | 70 | Confident | 103 Ų | 103 | 105.8 Ų | 105.8 | 62% | 0.624 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -71.2 | -21.9 | 178.6 | 178.3 | 0 | 0 | 0 | 0 | 112.8 | H221 | H221-V225 WeakPolarHBondContact CE1-CG2 3.28Å; H221-V225 PolarHBondContact O-N 3.19Å; H221-V225 VanDerWaalsContact O-N 3.13Å |
| 226 | C | 63.4 | Low | 69.3 | Low | 120 Ų | 120 | 102.1 Ų | 102.1 | 81% | 0.811 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | 6.7 | -177.8 | -150.3 | 0 | 0 | 0 | 0 | 113.4 | L224 | L224-C226 VanDerWaalsContact C-N 3.27Å; L224-C226 PolarHBondContact O-N 3.48Å |
| 227 | K | 51.3 | Low | 68.8 | Low | 245 Ų | 245 | 107.5 Ų | 107.5 | 100% | 1.065 | 53% | 0.528 | S | S | * | . | trans | -111.5 | 0 | 177.6 | -124.8 | -173.3 | -178.2 | -170.6 | 0 | 109.9 | L224 | L224-K227 PolarHBondContact O-N 3.23Š|
Retrieved 227 of 227 residues in 344.8 ms
(Link to these results)