| 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 | 38.4 | Very low | 41 | Very low | 252 Ų | 252 | 145.1 Ų | 145.1 | 100% | 1.241 | 84% | 0.838 | S | S | * | * | 0 | 115.6 | 0 | -64.8 | 158 | 67.3 | 0 | 0 | 105.9 | |||||
| 2 | G | 36.7 | Very low | 40.7 | Very low | 70 Ų | 70 | 143.8 Ų | 143.8 | 72% | 0.722 | 84% | 0.844 | S | S | * | * | cis | 136 | 110.2 | 14.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 3 | N | 31.1 | Very low | 39.7 | Very low | 142 Ų | 142 | 138.6 Ų | 138.6 | 76% | 0.759 | 84% | 0.839 | S | S | * | * | trans | 76.2 | 123 | 161.3 | -64.5 | -9.3 | 0 | 0 | 0 | 118.9 | ||||
| 4 | K | 46 | Very low | 39 | Very low | 175 Ų | 175 | 135 Ų | 135 | 76% | 0.761 | 84% | 0.844 | S | S | * | * | 79.2 | 111.8 | 63.6 | -69.7 | 174.4 | -175 | -179.2 | 0 | 113.5 | |||||
| 5 | N | 39.8 | Very low | 38.3 | Very low | 158 Ų | 158 | 130.5 Ų | 130.5 | 85% | 0.845 | 84% | 0.835 | S | S | * | * | trans | 40 | 133.5 | 147.5 | -50.5 | -19 | 0 | 0 | 0 | 120.2 | ||||
| 6 | A | 38.6 | Very low | 37.8 | Very low | 99 Ų | 99 | 131.3 Ų | 131.3 | 82% | 0.818 | 84% | 0.836 | S | S | * | * | 163 | 129.2 | 120.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 7 | V | 41.1 | Very low | 37.8 | Very low | 135 Ų | 135 | 131.2 Ų | 131.2 | 82% | 0.818 | 83% | 0.834 | S | S | * | * | trans | -97 | 159.8 | 139.4 | 170.5 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 8 | P | 60.5 | Low | 37.3 | Very low | 112 Ų | 112 | 128.3 Ų | 128.3 | 73% | 0.727 | 83% | 0.833 | S | S | * | * | cis | -125 | -157.7 | -9.1 | 33.5 | -9.5 | 0 | 0 | 0 | 111.3 | ||||
| 9 | P | 51.4 | Low | 37.1 | Very low | 128 Ų | 128 | 130.7 Ų | 130.7 | 83% | 0.831 | 83% | 0.829 | S | S | * | * | -145.2 | 173.6 | 76.3 | 36.2 | -14.9 | 0 | 0 | 0 | 115.7 | |||||
| 10 | R | 35.8 | Very low | 36.8 | Very low | 253 Ų | 253 | 131.4 Ų | 131.4 | 96% | 0.955 | 82% | 0.821 | S | S | * | * | trans | -100.7 | 152.4 | -179.2 | -163 | -175 | -164.6 | -161.8 | 4.9 | 109.9 | ||||
| 11 | G | 31.3 | Very low | 36.5 | Very low | 72 Ų | 72 | 132.7 Ų | 132.7 | 74% | 0.742 | 82% | 0.823 | S | S | * | * | trans | 119.2 | 153.8 | 156 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 12 | S | 37.4 | Very low | 36.2 | Very low | 130 Ų | 130 | 125.3 Ų | 125.3 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | cis | 179.4 | 145.7 | -9.2 | 179.4 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 13 | G | 27.8 | Very low | 35.8 | Very low | 76 Ų | 76 | 126.9 Ų | 126.9 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | trans | 146.5 | 103.2 | 152.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 14 | G | 30.7 | Very low | 36 | Very low | 88 Ų | 88 | 128.1 Ų | 128.1 | 91% | 0.907 | 81% | 0.814 | S | S | * | * | trans | 96.3 | 121.4 | 151.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 15 | G | 27.7 | Very low | 35.3 | Very low | 68 Ų | 68 | 126.1 Ų | 126.1 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | cis | 152.6 | 135.6 | 6.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 16 | V | 31 | Very low | 34.9 | Very low | 142 Ų | 142 | 123.7 Ų | 123.7 | 86% | 0.861 | 81% | 0.811 | S | S | * | * | trans | 64.5 | 109.1 | 156.2 | -176.7 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 17 | T | 36.8 | Very low | 34.6 | Very low | 131 Ų | 131 | 124.9 Ų | 124.9 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | -154.2 | 119.3 | 68.3 | 47.6 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 18 | G | 29.6 | Very low | 34 | Very low | 79 Ų | 79 | 122.9 Ų | 122.9 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | 73.8 | 124.6 | 83.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 19 | K | 32.8 | Very low | 32.8 | Very low | 174 Ų | 174 | 125.2 Ų | 125.2 | 76% | 0.757 | 82% | 0.816 | S | S | * | * | cis | -170.5 | 132 | 0 | -162.2 | 173.8 | 177.9 | 178.1 | 0 | 106.9 | ||||
| 20 | E | 32.5 | Very low | 31.9 | Very low | 144 Ų | 144 | 125.8 Ų | 125.8 | 67% | 0.673 | 82% | 0.817 | S | S | * | * | trans | 32.6 | 130.2 | 137.9 | -49.3 | 148.4 | -154.9 | 0 | 0 | 118.4 | ||||
| 21 | D | 30.2 | Very low | 31.5 | Very low | 159 Ų | 159 | 117.2 Ų | 117.2 | 85% | 0.85 | 81% | 0.807 | S | S | * | * | -166.7 | 155.1 | 70.5 | -87.2 | -47.3 | 0 | 0 | 0 | 113.9 | |||||
| 22 | A | 32.5 | Very low | 31.5 | Very low | 97 Ų | 97 | 119.2 Ų | 119.2 | 80% | 0.802 | 81% | 0.809 | S | S | * | * | trans | -89.9 | 152.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 23 | A | 27.5 | Very low | 31.1 | Very low | 102 Ų | 102 | 120.1 Ų | 120.1 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | -167.3 | 126.9 | 146 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 24 | L | 34.2 | Very low | 31.3 | Very low | 169 Ų | 169 | 121.6 Ų | 121.6 | 89% | 0.885 | 81% | 0.808 | S | S | * | * | trans | -70.3 | 150.6 | 153 | -82.2 | 159.8 | 0 | 0 | 0 | 110 | ||||
| 25 | V | 31.5 | Very low | 31.4 | Very low | 132 Ų | 132 | 123.4 Ų | 123.4 | 80% | 0.8 | 80% | 0.801 | S | S | * | * | trans | 139.3 | 109.1 | 142.3 | 174.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 26 | S | 31.1 | Very low | 31.8 | Very low | 108 Ų | 108 | 126.8 Ų | 126.8 | 76% | 0.755 | 80% | 0.803 | S | S | * | * | trans | 51.5 | 128 | 139.3 | -52.9 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 27 | S | 33.4 | Very low | 31.9 | Very low | 124 Ų | 124 | 129.2 Ų | 129.2 | 87% | 0.867 | 81% | 0.805 | S | S | * | * | trans | 73.6 | 111.7 | 143.7 | -94.5 | 0 | 0 | 0 | 0 | 121 | ||||
| 28 | A | 28.1 | Very low | 32.4 | Very low | 93 Ų | 93 | 128.3 Ų | 128.3 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | -179.5 | 113.1 | 114.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 29 | I | 35.5 | Very low | 33 | Very low | 160 Ų | 160 | 132.6 Ų | 132.6 | 82% | 0.821 | 80% | 0.798 | S | S | * | * | trans | 25.5 | 135 | 133.6 | -36 | -179.1 | 0 | 0 | 0 | 120.1 | ||||
| 30 | V | 32.8 | Very low | 33.7 | Very low | 141 Ų | 141 | 126.9 Ų | 126.9 | 86% | 0.855 | 78% | 0.78 | S | S | * | * | trans | 108 | 114.2 | 148.2 | -169.6 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 31 | G | 27.8 | Very low | 34.4 | Very low | 73 Ų | 73 | 123.1 Ų | 123.1 | 75% | 0.753 | 77% | 0.768 | S | S | * | * | trans | 140.4 | 86.4 | 147.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 32 | S | 30.2 | Very low | 35.6 | Very low | 113 Ų | 113 | 119.3 Ų | 119.3 | 79% | 0.79 | 75% | 0.754 | S | S | * | * | trans | -47.3 | 152.2 | 168.9 | -57.6 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 33 | I | 29.2 | Very low | 36.6 | Very low | 150 Ų | 150 | 120.4 Ų | 120.4 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | 175.6 | 95.9 | 113.2 | -79.2 | 149.1 | 0 | 0 | 0 | 106.5 | T35 | I33-T35 HydrophobicContact CG2-CG2 4.16Š| |||
| 34 | A | 32.7 | Very low | 37.9 | Very low | 107 Ų | 107 | 122.4 Ų | 122.4 | 88% | 0.884 | 74% | 0.738 | S | S | * | * | trans | -85.8 | 117.3 | 164.7 | 0 | 0 | 0 | 0 | 0 | 107.3 | D36 | A34-D36 PolarHBondContact O-N 3.44Š| ||
| 35 | T | 33.2 | Very low | 39 | Very low | 126 Ų | 126 | 117.7 Ų | 117.7 | 77% | 0.773 | 71% | 0.713 | S | S | * | * | trans | -84.8 | 104 | 174.8 | 30.3 | 0 | 0 | 0 | 0 | 109 | I33 | I33-T35 HydrophobicContact CG2-CG2 4.16Š| ||
| 36 | D | 34.4 | Very low | 40.3 | Very low | 139 Ų | 139 | 114.7 Ų | 114.7 | 74% | 0.743 | 69% | 0.692 | S | S | * | * | trans | 51.1 | 86.8 | 131.5 | -141.9 | 21.7 | 0 | 0 | 0 | 118.5 | A34 V38 | A34-D36 PolarHBondContact O-N 3.44Å; D36-V38 WeakPolarHBondContact OD1-CG2 3.47Å | ||
| 37 | E | 33.6 | Very low | 41.7 | Very low | 193 Ų | 193 | 112.1 Ų | 112.1 | 90% | 0.902 | 68% | 0.677 | S | S | * | * | trans | -120.8 | 80.2 | 156.4 | -157.6 | -177.6 | 168.3 | 0 | 0 | 108.7 | Q39 | E37-Q39 PolarHBondContact O-N 3.39Š| ||
| 38 | V | 47 | Very low | 42.8 | Very low | 111 Ų | 111 | 109.5 Ų | 109.5 | 67% | 0.673 | 66% | 0.659 | S | S | * | * | trans | -84.5 | 88.5 | 175.2 | 174.1 | 0 | 0 | 0 | 0 | 108.2 | D36 | D36-V38 WeakPolarHBondContact OD1-CG2 3.47Š| ||
| 39 | Q | 43.5 | Very low | 44.2 | Very low | 169 Ų | 169 | 107 Ų | 107 | 79% | 0.79 | 63% | 0.632 | S | S | * | * | trans | -154.8 | 129.4 | 160.8 | -115.4 | 165.9 | 67 | 0 | 0 | 113.7 | E37 | E37-Q39 PolarHBondContact O-N 3.39Š| ||
| 40 | S | 47.2 | Very low | 45.7 | Very low | 55 Ų | 55 | 106.3 Ų | 106.3 | 39% | 0.385 | 63% | 0.626 | S | S | . | * | trans | 86.5 | 24.1 | 143.8 | -60.8 | 0 | 0 | 0 | 0 | 124.8 | S42 | S40-S42 VanDerWaalsContact C-N 3.26Å; S40-S42 PolarHBondContact O-N 3.27Å | ||
| 41 | P | 47.1 | Very low | 46.9 | Very low | 64 Ų | 64 | 101.9 Ų | 101.9 | 42% | 0.416 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -67.6 | -27.3 | 161.1 | 24.4 | -28.3 | 0 | 0 | 0 | 112.6 | L45 | P41-L45 WeakPolarHBondContact O-CD1 3.37Å; P41-L45 VanDerWaalsContact O-CG 3.32Å; P41-L45 WeakPolarHBondContact O-CG 3.43Å |
| 42 | S | 54.6 | Low | 48.2 | Very low | 80 Ų | 80 | 99.8 Ų | 99.8 | 56% | 0.559 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -77.4 | -24.9 | 179.1 | 81.5 | 0 | 0 | 0 | 0 | 113.6 | S40 L46 | S40-S42 VanDerWaalsContact C-N 3.26Å; S40-S42 PolarHBondContact O-N 3.27Å; S42-L46 WeakPolarHBondContact O-CB 3.31Å; S42-L46 VanDerWaalsContact O-CG 3.25Å; S42-L46 WeakPolarHBondContact O-CG 3.31Å; S42-L46 PolarHBondContact O-N 2.8Å; S42-L46 VanDerWaalsContact O-N 3.09Å |
| 43 | L | 54.8 | Low | 49.5 | Very low | 119 Ų | 119 | 96.8 Ų | 96.8 | 62% | 0.623 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -79.1 | -34.8 | -176.2 | -157.3 | 128.2 | 0 | 0 | 0 | 111.2 | A47 | L43-A47 WeakPolarHBondContact O-CB 3.43Å; L43-A47 PolarHBondContact O-N 2.85Å |
| 44 | E | 54.7 | Low | 50.9 | Low | 145 Ų | 145 | 97.1 Ų | 97.1 | 68% | 0.678 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71.1 | -34.6 | 174.3 | -163.7 | 172.6 | -172.8 | 0 | 0 | 112.2 | S48 | E44-S48 PolarHBondContact O-N 3.04Å; E44-S48 PolarHBondContact O-OG 3.4Å |
| 45 | L | 57.5 | Low | 51.8 | Low | 70 Ų | 70 | 96.9 Ų | 96.9 | 37% | 0.366 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -73.6 | -35.8 | 175.4 | -70 | 172.4 | 0 | 0 | 0 | 112.8 | P41 S48 L49 | P41-L45 WeakPolarHBondContact O-CD1 3.37Å; P41-L45 VanDerWaalsContact O-CG 3.32Å; P41-L45 WeakPolarHBondContact O-CG 3.43Å; L45-S48 WeakPolarHBondContact O-CB 3.16Å; L45-S48 PolarHBondContact O-N 2.89Å; L45-L49 PolarHBondContact O-N 3.24Å |
| 46 | L | 57.8 | Low | 52.7 | Low | 69 Ų | 69 | 97.2 Ų | 97.2 | 36% | 0.361 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69.1 | -37.7 | 172 | -73 | 173.8 | 0 | 0 | 0 | 112.1 | S42 S48 L49 Q50 L85 | S42-L46 WeakPolarHBondContact O-CB 3.31Å; S42-L46 VanDerWaalsContact O-CG 3.25Å; S42-L46 WeakPolarHBondContact O-CG 3.31Å; S42-L46 PolarHBondContact O-N 2.8Å; S42-L46 VanDerWaalsContact O-N 3.09Å; L46-S48 VanDerWaalsContact C-N 3.25Å; L46-S48 PolarHBondContact O-N 3.44Å; L46-L49 HydrophobicContact CD2-CD1 4.29Å; L46-L49 PolarHBondContact O-N 3.27Å; L46-Q50 PolarHBondContact O-N 3.43Å; L46-L85 HydrophobicContact CD1-CD1 4.28Å; L46-L85 HydrophobicContact CD2-CD1 3.95Å; L46-L85 HydrophobicContact CD2-CD2 4.29Å |
| 47 | A | 59.8 | Low | 53.8 | Low | 53 Ų | 53 | 95.6 Ų | 95.6 | 44% | 0.438 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.5 | -35.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L43 Q50 A51 | L43-A47 WeakPolarHBondContact O-CB 3.43Å; L43-A47 PolarHBondContact O-N 2.85Å; A47-Q50 PolarHBondContact O-N 2.97Å; A47-A51 WeakPolarHBondContact O-CB 3.11Å; A47-A51 PolarHBondContact O-N 3.44Å |
| 48 | S | 56.9 | Low | 54.9 | Low | 69 Ų | 69 | 93.1 Ų | 93.1 | 48% | 0.483 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.2 | -37.2 | 174.2 | -59.3 | 0 | 0 | 0 | 0 | 112.5 | E44 L45 L46 L52 | E44-S48 PolarHBondContact O-N 3.04Å; E44-S48 PolarHBondContact O-OG 3.4Å; L45-S48 WeakPolarHBondContact O-CB 3.16Å; L45-S48 PolarHBondContact O-N 2.89Å; L46-S48 VanDerWaalsContact C-N 3.25Å; L46-S48 PolarHBondContact O-N 3.44Å; S48-L52 VanDerWaalsContact O-CB 3.31Å; S48-L52 WeakPolarHBondContact O-CB 3.25Å; S48-L52 PolarHBondContact O-N 3.21Å |
| 49 | L | 58.6 | Low | 55.8 | Low | 41 Ų | 41 | 92.9 Ų | 92.9 | 22% | 0.215 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -67.6 | -39 | 171.8 | -82 | 177.5 | 0 | 0 | 0 | 112.4 | L45 L46 L52 G53 L61 I68 | L45-L49 PolarHBondContact O-N 3.24Å; L46-L49 HydrophobicContact CD2-CD1 4.29Å; L46-L49 PolarHBondContact O-N 3.27Å; L49-L52 CarbonylContact O-C 3.59Å; L49-L52 PolarHBondContact O-N 2.88Å; L49-G53 PolarHBondContact O-N 3.27Å; L49-L61 HydrophobicContact CD2-CD1 4.04Å; L49-I68 HydrophobicContact CD1-CD1 3.37Å; L49-I68 HydrophobicContact CD2-CD1 4.35Å; L49-I68 HydrophobicContact CG-CD1 3.88Å |
| 50 | Q | 65.7 | Low | 56.5 | Low | 146 Ų | 146 | 89.1 Ų | 89.1 | 68% | 0.682 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.4 | -42.2 | 175.5 | -175.7 | 175.7 | -10.4 | 0 | 0 | 111.3 | L46 A47 L52 G53 E54 | L46-Q50 PolarHBondContact O-N 3.43Å; A47-Q50 PolarHBondContact O-N 2.97Å; Q50-L52 VanDerWaalsContact C-N 3.3Å; Q50-L52 PolarHBondContact O-N 3.46Å; Q50-G53 PolarHBondContact O-N 2.93Å; Q50-E54 PolarHBondContact O-N 2.86Å |
| 51 | A | 59.2 | Low | 57.4 | Low | 47 Ų | 47 | 89.7 Ų | 89.7 | 39% | 0.388 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66 | -31.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A47 E54 N55 | A47-A51 WeakPolarHBondContact O-CB 3.11Å; A47-A51 PolarHBondContact O-N 3.44Å; A51-E54 PolarHBondContact O-N 3.29Å; A51-N55 PolarHBondContact O-N 3Å; A51-N55 PolarHBondContact O-ND2 2.9Å |
| 52 | L | 53.7 | Low | 58.1 | Low | 29 Ų | 29 | 90.9 Ų | 90.9 | 15% | 0.152 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -75.2 | -26.1 | 173.6 | -168.2 | 66.3 | 0 | 0 | 0 | 112.5 | S48 L49 Q50 E54 L60 L61 | S48-L52 VanDerWaalsContact O-CB 3.31Å; S48-L52 WeakPolarHBondContact O-CB 3.25Å; S48-L52 PolarHBondContact O-N 3.21Å; L49-L52 CarbonylContact O-C 3.59Å; L49-L52 PolarHBondContact O-N 2.88Å; Q50-L52 VanDerWaalsContact C-N 3.3Å; Q50-L52 PolarHBondContact O-N 3.46Å; L52-E54 VanDerWaalsContact C-N 3.29Å; L52-L60 HydrophobicContact CD1-CB 4.36Å; L52-L60 HydrophobicContact CD2-CB 4.46Å; L52-L61 HydrophobicContact CD2-CB 4.31Å; L52-L61 HydrophobicContact CD2-CD1 4.17Å |
| 53 | G | 58.1 | Low | 58.5 | Low | 51 Ų | 51 | 93.6 Ų | 93.6 | 53% | 0.526 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -73.3 | -21.2 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L49 Q50 | L49-G53 PolarHBondContact O-N 3.27Å; Q50-G53 PolarHBondContact O-N 2.93Å |
| 54 | E | 58 | Low | 58.9 | Low | 156 Ų | 156 | 89.6 Ų | 89.6 | 73% | 0.729 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -93.9 | -12.7 | 179.9 | -163.6 | 158.4 | -163.5 | 0 | 0 | 113.2 | Q50 A51 L52 | Q50-E54 PolarHBondContact O-N 2.86Å; A51-E54 PolarHBondContact O-N 3.29Å; L52-E54 VanDerWaalsContact C-N 3.29Å |
| 55 | N | 53.4 | Low | 59.6 | Low | 103 Ų | 103 | 87.3 Ų | 87.3 | 55% | 0.551 | 48% | 0.484 | S | S | * | . | S | Bend | trans | -114.5 | 119.1 | 170.8 | -63.5 | -76.4 | 0 | 0 | 0 | 108 | A51 D57 | A51-N55 PolarHBondContact O-N 3Å; A51-N55 PolarHBondContact O-ND2 2.9Å; N55-D57 PolarHBondContact O-N 3.23Å |
| 56 | D | 51.5 | Low | 60.2 | Low | 132 Ų | 132 | 90.2 Ų | 90.2 | 71% | 0.706 | 50% | 0.495 | S | S | * | . | trans | -62.1 | 16.7 | -172.5 | -62.6 | -59.9 | 0 | 0 | 0 | 116.4 | Y58 | D56-Y58 HydrophobicContact CB-CE2 4.22Å; D56-Y58 WeakPolarHBondContact O-CD2 3.44Å; D56-Y58 PolarHBondContact O-N 2.7Å; D56-Y58 VanDerWaalsContact O-N 3.13Å | ||
| 57 | D | 56.8 | Low | 60.6 | Low | 106 Ų | 106 | 93.6 Ų | 93.6 | 57% | 0.567 | 51% | 0.507 | S | S | * | . | trans | -87.1 | 72.1 | 179 | -82.8 | -32.5 | 0 | 0 | 0 | 111.8 | N55 T59 | N55-D57 PolarHBondContact O-N 3.23Å; D57-T59 PolarHBondContact O-N 3.02Å | ||
| 58 | Y | 57.5 | Low | 61 | Low | 140 Ų | 140 | 92.5 Ų | 92.5 | 55% | 0.549 | 49% | 0.493 | S | S | . | . | G | 310 helix | trans | -65 | -3.8 | 176.5 | -62.1 | -82.9 | 0 | 0 | 0 | 114.6 | D56 L60 L61 | D56-Y58 HydrophobicContact CB-CE2 4.22Å; D56-Y58 WeakPolarHBondContact O-CD2 3.44Å; D56-Y58 PolarHBondContact O-N 2.7Å; D56-Y58 VanDerWaalsContact O-N 3.13Å; Y58-L60 PolarHBondContact O-N 3.47Å; Y58-L61 HydrophobicContact CD1-CD2 4.4Å; Y58-L61 WeakPolarHBondContact O-CB 3.32Å; Y58-L61 PolarHBondContact O-N 3.42Å |
| 59 | T | 64.9 | Low | 61.2 | Low | 106 Ų | 106 | 91.7 Ų | 91.7 | 65% | 0.65 | 49% | 0.491 | S | S | * | . | G | 310 helix | trans | -68.6 | -22.4 | -178.8 | 61.1 | 0 | 0 | 0 | 0 | 113.2 | D57 | D57-T59 PolarHBondContact O-N 3.02Š|
| 60 | L | 59.1 | Low | 61.3 | Low | 91 Ų | 91 | 95.4 Ų | 95.4 | 48% | 0.476 | 51% | 0.507 | S | S | . | . | G | 310 helix | trans | -99 | -4.9 | 179.5 | -58.1 | 178.3 | 0 | 0 | 0 | 113.2 | L52 Y58 Q63 S64 | L52-L60 HydrophobicContact CD1-CB 4.36Å; L52-L60 HydrophobicContact CD2-CB 4.46Å; Y58-L60 PolarHBondContact O-N 3.47Å; L60-Q63 PolarHBondContact O-N 3.06Å; L60-S64 PolarHBondContact O-N 3.28Å; L60-S64 PolarHBondContact O-OG 3.13Å; L60-S64 VanDerWaalsContact O-OG 3.05Å |
| 61 | L | 65 | Low | 60.8 | Low | 67 Ų | 67 | 91.6 Ų | 91.6 | 35% | 0.351 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -42.8 | 178.9 | -172.3 | 67.8 | 0 | 0 | 0 | 112.6 | L49 L52 Y58 Q63 S64 L65 | L49-L61 HydrophobicContact CD2-CD1 4.04Å; L52-L61 HydrophobicContact CD2-CB 4.31Å; L52-L61 HydrophobicContact CD2-CD1 4.17Å; Y58-L61 HydrophobicContact CD1-CD2 4.4Å; Y58-L61 WeakPolarHBondContact O-CB 3.32Å; Y58-L61 PolarHBondContact O-N 3.42Å; L61-Q63 VanDerWaalsContact C-N 3.32Å; L61-Q63 PolarHBondContact O-N 3.01Å; L61-S64 WeakPolarHBondContact CA-OG 3.34Å; L61-S64 PolarHBondContact O-OG 3.43Å; L61-L65 VanDerWaalsContact O-CB 3.25Å; L61-L65 WeakPolarHBondContact O-CB 3.45Å; L61-L65 PolarHBondContact O-N 3.09Å |
| 62 | P | 63.2 | Low | 60.5 | Low | 89 Ų | 89 | 91.1 Ų | 91.1 | 58% | 0.578 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.2 | -37.9 | 178.7 | -21.6 | 34.2 | 0 | 0 | 0 | 112.5 | H66 | P62-H66 VanDerWaalsContact O-CB 3.27Å; P62-H66 WeakPolarHBondContact O-CB 3.39Å; P62-H66 PolarHBondContact O-N 3.42Å |
| 63 | Q | 62.4 | Low | 60.6 | Low | 137 Ų | 137 | 94.6 Ų | 94.6 | 64% | 0.64 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -74.9 | -39.4 | -177.8 | -65 | -175.7 | 0.2 | 0 | 0 | 112.2 | L60 L61 K67 | L60-Q63 PolarHBondContact O-N 3.06Å; L61-Q63 VanDerWaalsContact C-N 3.32Å; L61-Q63 PolarHBondContact O-N 3.01Å; Q63-K67 WeakPolarHBondContact O-CB 3.47Å; Q63-K67 PolarHBondContact O-N 3.14Å |
| 64 | S | 63.7 | Low | 60.3 | Low | 35 Ų | 35 | 99.9 Ų | 99.9 | 25% | 0.245 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -66.2 | -41.2 | 175.1 | 56.6 | 0 | 0 | 0 | 0 | 111.6 | L60 L61 K67 I68 | L60-S64 PolarHBondContact O-N 3.28Å; L60-S64 PolarHBondContact O-OG 3.13Å; L60-S64 VanDerWaalsContact O-OG 3.05Å; L61-S64 WeakPolarHBondContact CA-OG 3.34Å; L61-S64 PolarHBondContact O-OG 3.43Å; S64-K67 PolarHBondContact O-N 3.23Å; S64-I68 WeakPolarHBondContact O-CD1 3.37Å; S64-I68 VanDerWaalsContact O-CG1 3.26Å; S64-I68 WeakPolarHBondContact O-CG1 3.31Å; S64-I68 PolarHBondContact O-N 3.45Å |
| 65 | L | 68.7 | Low | 60 | Low | 96 Ų | 96 | 99.3 Ų | 99.3 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.8 | -37.6 | 178.2 | -154.3 | 145.7 | 0 | 0 | 0 | 111.8 | L61 I68 A69 | L61-L65 VanDerWaalsContact O-CB 3.25Å; L61-L65 WeakPolarHBondContact O-CB 3.45Å; L61-L65 PolarHBondContact O-N 3.09Å; L65-I68 PolarHBondContact O-N 3Å; L65-A69 WeakPolarHBondContact O-CB 3.49Å; L65-A69 PolarHBondContact O-N 3.36Å |
| 66 | H | 69.6 | Low | 59.7 | Low | 132 Ų | 132 | 103.6 Ų | 103.6 | 61% | 0.611 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.2 | -41.5 | 171.9 | -171.4 | 73.9 | 0 | 0 | 0 | 112.1 | P62 I68 A69 E70 | P62-H66 VanDerWaalsContact O-CB 3.27Å; P62-H66 WeakPolarHBondContact O-CB 3.39Å; P62-H66 PolarHBondContact O-N 3.42Å; H66-I68 PolarHBondContact O-N 3Å; H66-A69 PolarHBondContact O-N 3.33Å; H66-E70 WeakPolarHBondContact O-CB 3.26Å; H66-E70 PolarHBondContact O-N 3.47Å |
| 67 | K | 67.1 | Low | 59.6 | Low | 139 Ų | 139 | 100.3 Ų | 100.3 | 60% | 0.604 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -70.2 | -31.7 | 178.7 | -160.8 | 149 | -173.6 | 170.4 | 0 | 113 | Q63 S64 T71 | Q63-K67 WeakPolarHBondContact O-CB 3.47Å; Q63-K67 PolarHBondContact O-N 3.14Å; S64-K67 PolarHBondContact O-N 3.23Å; K67-T71 WeakPolarHBondContact O-CG2 3.35Å; K67-T71 PolarHBondContact O-N 3.19Å; K67-T71 VanDerWaalsContact O-N 3.08Å; K67-T71 PolarHBondContact O-OG1 2.97Å |
| 68 | I | 67.5 | Low | 59.1 | Low | 30 Ų | 30 | 99.4 Ų | 99.4 | 15% | 0.154 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -68.4 | -45.6 | 170.7 | -67.8 | 163.7 | 0 | 0 | 0 | 110 | L49 S64 L65 H66 E70 T71 C72 | L49-I68 HydrophobicContact CD1-CD1 3.37Å; L49-I68 HydrophobicContact CD2-CD1 4.35Å; L49-I68 HydrophobicContact CG-CD1 3.88Å; S64-I68 WeakPolarHBondContact O-CD1 3.37Å; S64-I68 VanDerWaalsContact O-CG1 3.26Å; S64-I68 WeakPolarHBondContact O-CG1 3.31Å; S64-I68 PolarHBondContact O-N 3.45Å; L65-I68 PolarHBondContact O-N 3Å; H66-I68 PolarHBondContact O-N 3Å; I68-E70 VanDerWaalsContact C-N 3.32Å; I68-E70 PolarHBondContact O-N 3.05Å; I68-T71 PolarHBondContact O-N 3.03Å; I68-T71 PolarHBondContact O-OG1 3.1Å; I68-T71 VanDerWaalsContact O-OG1 3.05Å; I68-C72 VanDerWaalsContact O-CB 3.25Å; I68-C72 WeakPolarHBondContact O-CB 3.38Å; I68-C72 PolarHBondContact O-N 3.32Å; I68-C72 PolarHBondContact O-SG 3.33Å; I68-C72 VanDerWaalsContact O-SG 3.33Å |
| 69 | A | 62.6 | Low | 58.6 | Low | 53 Ų | 53 | 101.1 Ų | 101.1 | 44% | 0.438 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.7 | -40.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | L65 H66 C72 S73 | L65-A69 WeakPolarHBondContact O-CB 3.49Å; L65-A69 PolarHBondContact O-N 3.36Å; H66-A69 PolarHBondContact O-N 3.33Å; A69-C72 PolarHBondContact O-N 3.06Å; A69-S73 WeakPolarHBondContact O-CB 3.43Å; A69-S73 PolarHBondContact O-N 3.47Å |
| 70 | E | 59.5 | Low | 57.9 | Low | 119 Ų | 119 | 102.6 Ų | 102.6 | 56% | 0.556 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.2 | -45.8 | 177.4 | -168.8 | -177 | -172.3 | 0 | 0 | 112 | H66 I68 C72 S73 L74 | H66-E70 WeakPolarHBondContact O-CB 3.26Å; H66-E70 PolarHBondContact O-N 3.47Å; I68-E70 VanDerWaalsContact C-N 3.32Å; I68-E70 PolarHBondContact O-N 3.05Å; E70-C72 PolarHBondContact O-N 3.48Å; E70-S73 PolarHBondContact O-N 3.09Å; E70-L74 WeakPolarHBondContact O-CB 3.25Å; E70-L74 PolarHBondContact O-N 3.46Å |
| 71 | T | 56.1 | Low | 57.5 | Low | 65 Ų | 65 | 101 Ų | 101 | 40% | 0.399 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69 | -32.6 | 177.4 | 53.1 | 0 | 0 | 0 | 0 | 112.9 | K67 I68 R75 | K67-T71 WeakPolarHBondContact O-CG2 3.35Å; K67-T71 PolarHBondContact O-N 3.19Å; K67-T71 VanDerWaalsContact O-N 3.08Å; K67-T71 PolarHBondContact O-OG1 2.97Å; I68-T71 PolarHBondContact O-N 3.03Å; I68-T71 PolarHBondContact O-OG1 3.1Å; I68-T71 VanDerWaalsContact O-OG1 3.05Å; T71-R75 VanDerWaalsContact O-CB 3.31Å; T71-R75 WeakPolarHBondContact O-CB 3.35Å; T71-R75 PolarHBondContact O-N 3.38Å; T71-R75 VanDerWaalsContact O-N 3.08Å |
| 72 | C | 53.4 | Low | 57 | Low | 38 Ų | 38 | 100.6 Ų | 100.6 | 26% | 0.257 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -72.3 | -31.8 | 171.7 | -75.7 | 0 | 0 | 0 | 0 | 112.9 | I68 A69 E70 R75 V82 | I68-C72 VanDerWaalsContact O-CB 3.25Å; I68-C72 WeakPolarHBondContact O-CB 3.38Å; I68-C72 PolarHBondContact O-N 3.32Å; I68-C72 PolarHBondContact O-SG 3.33Å; I68-C72 VanDerWaalsContact O-SG 3.33Å; A69-C72 PolarHBondContact O-N 3.06Å; E70-C72 PolarHBondContact O-N 3.48Å; C72-R75 CarbonylContact O-C 3.57Å; C72-V82 HydrophobicContact CB-CG2 4Å |
| 73 | S | 55.8 | Low | 56.6 | Low | 102 Ų | 102 | 102.6 Ų | 102.6 | 71% | 0.713 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -73.4 | -40.9 | 176.1 | -168 | 0 | 0 | 0 | 0 | 111.3 | A69 E70 | A69-S73 WeakPolarHBondContact O-CB 3.43Å; A69-S73 PolarHBondContact O-N 3.47Å; E70-S73 PolarHBondContact O-N 3.09Å |
| 74 | L | 50.6 | Low | 56.1 | Low | 161 Ų | 161 | 97.7 Ų | 97.7 | 84% | 0.843 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -72.5 | -34.8 | 179.4 | -161.7 | 78.9 | 0 | 0 | 0 | 112.6 | E70 Q76 | E70-L74 WeakPolarHBondContact O-CB 3.25Å; E70-L74 PolarHBondContact O-N 3.46Å; L74-Q76 PolarHBondContact O-N 3.33Å |
| 75 | R | 50.8 | Low | 55.8 | Low | 145 Ų | 145 | 98.9 Ų | 98.9 | 55% | 0.547 | 53% | 0.532 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96 | 87.3 | 172.9 | -170.6 | -174 | -63.8 | -141.7 | -4.4 | 107.2 | T71 C72 T77 | T71-R75 VanDerWaalsContact O-CB 3.31Å; T71-R75 WeakPolarHBondContact O-CB 3.35Å; T71-R75 PolarHBondContact O-N 3.38Å; T71-R75 VanDerWaalsContact O-N 3.08Å; C72-R75 CarbonylContact O-C 3.57Å; R75-T77 HydrophobicContact CG-CG2 3.76Å; R75-T77 PolarHBondContact O-N 3.4Å; R75-T77 PolarHBondContact O-OG1 2.87Å |
| 76 | Q | 49 | Very low | 55.1 | Low | 193 Ų | 193 | 98.6 Ų | 98.6 | 90% | 0.902 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | 66.5 | 174 | -162.4 | 166.3 | 43.5 | 0 | 0 | 111 | L74 | L74-Q76 PolarHBondContact O-N 3.33Š|
| 77 | T | 48.6 | Very low | 54.3 | Low | 63 Ų | 63 | 97.8 Ų | 97.8 | 39% | 0.387 | 53% | 0.531 | S | S | . | . | trans | -84.8 | 112 | 170.5 | 36.9 | 0 | 0 | 0 | 0 | 103.5 | R75 Q79 | R75-T77 HydrophobicContact CG-CG2 3.76Å; R75-T77 PolarHBondContact O-N 3.4Å; R75-T77 PolarHBondContact O-OG1 2.87Å; T77-Q79 PolarHBondContact O-N 3.05Å | ||
| 78 | S | 45.5 | Very low | 53.7 | Low | 87 Ų | 87 | 97.6 Ų | 97.6 | 61% | 0.608 | 53% | 0.53 | S | S | * | . | trans | -12.5 | 114.3 | 172.9 | 42.8 | 0 | 0 | 0 | 0 | 112.6 | D80 A81 | S78-D80 PolarHBondContact O-N 3.5Å; S78-A81 PolarHBondContact O-N 2.94Å | ||
| 79 | Q | 47.3 | Very low | 53.2 | Low | 176 Ų | 176 | 99.4 Ų | 99.4 | 82% | 0.822 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -27.9 | -28.5 | 179.8 | -131.7 | 173.1 | -16.9 | 0 | 0 | 116.3 | T77 A81 Q83 | T77-Q79 PolarHBondContact O-N 3.05Å; Q79-A81 PolarHBondContact O-N 3.08Å; Q79-Q83 PolarHBondContact O-N 3.35Å |
| 80 | D | 51.4 | Low | 52.7 | Low | 137 Ų | 137 | 104.2 Ų | 104.2 | 73% | 0.733 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -65 | -30 | 178.1 | -57.7 | -28.5 | 0 | 0 | 0 | 114.7 | S78 G84 | S78-D80 PolarHBondContact O-N 3.5Å; D80-G84 PolarHBondContact O-N 3.45Å |
| 81 | A | 50.5 | Low | 52.2 | Low | 58 Ų | 58 | 103.9 Ų | 103.9 | 48% | 0.479 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -80 | -34.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | S78 Q79 L85 | S78-A81 PolarHBondContact O-N 2.94Å; Q79-A81 PolarHBondContact O-N 3.08Å; A81-L85 PolarHBondContact O-N 3.12Å |
| 82 | V | 54 | Low | 52 | Low | 58 Ų | 58 | 106.2 Ų | 106.2 | 35% | 0.352 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -72.9 | -39.8 | 178.1 | -179.7 | 0 | 0 | 0 | 0 | 110.2 | C72 G84 L85 V86 | C72-V82 HydrophobicContact CB-CG2 4Å; V82-G84 VanDerWaalsContact C-N 3.34Å; V82-G84 PolarHBondContact O-N 2.82Å; V82-L85 PolarHBondContact O-N 3.38Å; V82-V86 WeakPolarHBondContact O-CG2 3.31Å; V82-V86 PolarHBondContact O-N 2.98Å; V82-V86 VanDerWaalsContact O-N 3.09Å |
| 83 | Q | 54.1 | Low | 51.7 | Low | 131 Ų | 131 | 108.3 Ų | 108.3 | 61% | 0.612 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -59.8 | -44.5 | 173.2 | -168.2 | 72.5 | 20.9 | 0 | 0 | 111.3 | Q79 L85 V86 E87 | Q79-Q83 PolarHBondContact O-N 3.35Å; Q83-L85 PolarHBondContact O-N 2.87Å; Q83-V86 PolarHBondContact O-N 3.37Å; Q83-E87 WeakPolarHBondContact O-CB 3.4Å; Q83-E87 PolarHBondContact O-N 2.92Å |
| 84 | G | 53.6 | Low | 51.2 | Low | 33 Ų | 33 | 108 Ų | 108 | 34% | 0.34 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -68.6 | -29.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | D80 V82 K88 | D80-G84 PolarHBondContact O-N 3.45Å; V82-G84 VanDerWaalsContact C-N 3.34Å; V82-G84 PolarHBondContact O-N 2.82Å; G84-K88 WeakPolarHBondContact O-CB 3.32Å; G84-K88 PolarHBondContact O-N 3.27Å |
| 85 | L | 56.3 | Low | 51 | Low | 61 Ų | 61 | 106.2 Ų | 106.2 | 32% | 0.319 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -77.6 | -41 | 176.3 | -167.1 | 71.5 | 0 | 0 | 0 | 111.5 | L46 A81 V82 Q83 K88 V89 | L46-L85 HydrophobicContact CD1-CD1 4.28Å; L46-L85 HydrophobicContact CD2-CD1 3.95Å; L46-L85 HydrophobicContact CD2-CD2 4.29Å; A81-L85 PolarHBondContact O-N 3.12Å; V82-L85 PolarHBondContact O-N 3.38Å; Q83-L85 PolarHBondContact O-N 2.87Å; L85-K88 PolarHBondContact O-N 3.38Å; L85-V89 VanDerWaalsContact O-CG2 3.31Å; L85-V89 WeakPolarHBondContact O-CG2 3.44Å; L85-V89 PolarHBondContact O-N 3.28Å |
| 86 | V | 54 | Low | 50.7 | Low | 90 Ų | 90 | 104.4 Ų | 104.4 | 55% | 0.545 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.7 | -41.9 | 174.2 | 175.3 | 0 | 0 | 0 | 0 | 110.3 | V82 Q83 K88 V89 Y90 | V82-V86 WeakPolarHBondContact O-CG2 3.31Å; V82-V86 PolarHBondContact O-N 2.98Å; V82-V86 VanDerWaalsContact O-N 3.09Å; Q83-V86 PolarHBondContact O-N 3.37Å; V86-K88 PolarHBondContact O-N 3.5Å; V86-V89 PolarHBondContact O-N 2.88Å; V86-Y90 VanDerWaalsContact O-CB 3.32Å; V86-Y90 WeakPolarHBondContact O-CB 3.26Å; V86-Y90 PolarHBondContact O-N 2.83Å |
| 87 | E | 53 | Low | 50.6 | Low | 114 Ų | 114 | 101.3 Ų | 101.3 | 53% | 0.533 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.2 | -37.4 | 175.5 | -168.6 | 171 | -165 | 0 | 0 | 111.8 | Q83 Y90 E91 | Q83-E87 WeakPolarHBondContact O-CB 3.4Å; Q83-E87 PolarHBondContact O-N 2.92Å; E87-Y90 PolarHBondContact O-N 2.91Å; E87-E91 WeakPolarHBondContact O-CG 3.25Å; E87-E91 PolarHBondContact O-N 2.98Å |
| 88 | K | 54.4 | Low | 50.6 | Low | 135 Ų | 135 | 102.8 Ų | 102.8 | 59% | 0.587 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -71.4 | -37.2 | 174.8 | -115.9 | 163.5 | 174.5 | 125.1 | 0 | 114 | G84 L85 V86 Y90 E91 N92 | G84-K88 WeakPolarHBondContact O-CB 3.32Å; G84-K88 PolarHBondContact O-N 3.27Å; L85-K88 PolarHBondContact O-N 3.38Å; V86-K88 PolarHBondContact O-N 3.5Å; K88-Y90 VanDerWaalsContact C-N 3.3Å; K88-E91 PolarHBondContact O-N 2.98Å; K88-N92 WeakPolarHBondContact O-CB 3.27Å; K88-N92 VanDerWaalsContact O-CG 3.27Å; K88-N92 PolarHBondContact O-N 3.38Å; K88-N92 PolarHBondContact O-ND2 3.03Å; K88-N92 VanDerWaalsContact O-ND2 3.14Å |
| 89 | V | 57.1 | Low | 50.6 | Low | 68 Ų | 68 | 101.8 Ų | 101.8 | 41% | 0.412 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.4 | -38.9 | 172.7 | 172.4 | 0 | 0 | 0 | 0 | 109.5 | L85 V86 N92 V93 | L85-V89 VanDerWaalsContact O-CG2 3.31Å; L85-V89 WeakPolarHBondContact O-CG2 3.44Å; L85-V89 PolarHBondContact O-N 3.28Å; V86-V89 PolarHBondContact O-N 2.88Å; V89-N92 PolarHBondContact O-N 3.01Å; V89-V93 HydrophobicContact CG1-CG2 4.44Å; V89-V93 WeakPolarHBondContact O-CB 3.44Å; V89-V93 VanDerWaalsContact O-CG2 3.26Å; V89-V93 WeakPolarHBondContact O-CG2 3.42Å; V89-V93 PolarHBondContact O-N 3.41Å |
| 90 | Y | 52.3 | Low | 50.4 | Low | 154 Ų | 154 | 103.6 Ų | 103.6 | 60% | 0.604 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -67.1 | -40.1 | 175.5 | -148.1 | -102.8 | 0 | 0 | 0 | 112 | V86 E87 K88 V93 L94 | V86-Y90 VanDerWaalsContact O-CB 3.32Å; V86-Y90 WeakPolarHBondContact O-CB 3.26Å; V86-Y90 PolarHBondContact O-N 2.83Å; E87-Y90 PolarHBondContact O-N 2.91Å; K88-Y90 VanDerWaalsContact C-N 3.3Å; Y90-V93 PolarHBondContact O-N 3.28Å; Y90-L94 HydrophobicContact CD1-CD1 3.62Å; Y90-L94 HydrophobicContact CD1-CD2 4.46Å; Y90-L94 HydrophobicContact CE1-CD1 3.28Å; Y90-L94 HydrophobicContact CE1-CD2 4.19Å; Y90-L94 HydrophobicContact CE1-CG 4.36Å; Y90-L94 HydrophobicContact CE2-CD1 4.37Å; Y90-L94 HydrophobicContact CG-CD1 4.3Å; Y90-L94 VanDerWaalsContact O-CB 3.29Å; Y90-L94 WeakPolarHBondContact O-CB 3.17Å; Y90-L94 PolarHBondContact O-N 3.48Å |
| 91 | E | 48.9 | Very low | 50 | Low | 113 Ų | 113 | 104.1 Ų | 104.1 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.8 | -40.6 | 174 | -79.1 | -172.1 | 160.2 | 0 | 0 | 112.5 | E87 K88 L95 | E87-E91 WeakPolarHBondContact O-CG 3.25Å; E87-E91 PolarHBondContact O-N 2.98Å; K88-E91 PolarHBondContact O-N 2.98Å; E91-L95 WeakPolarHBondContact O-CB 3.29Å; E91-L95 WeakPolarHBondContact O-CD1 3.21Å; E91-L95 WeakPolarHBondContact O-CG 3.32Å; E91-L95 PolarHBondContact O-N 3.03Å; E91-L95 VanDerWaalsContact O-N 3.12Å |
| 92 | N | 50.4 | Low | 49.6 | Very low | 114 Ų | 114 | 105 Ų | 105 | 61% | 0.61 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -70.3 | -32.2 | 178.1 | -71.4 | -31.8 | 0 | 0 | 0 | 112.7 | K88 V89 | K88-N92 WeakPolarHBondContact O-CB 3.27Å; K88-N92 VanDerWaalsContact O-CG 3.27Å; K88-N92 PolarHBondContact O-N 3.38Å; K88-N92 PolarHBondContact O-ND2 3.03Å; K88-N92 VanDerWaalsContact O-ND2 3.14Å; V89-N92 PolarHBondContact O-N 3.01Å |
| 93 | V | 47.5 | Very low | 49.2 | Very low | 82 Ų | 82 | 107 Ų | 107 | 50% | 0.497 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -80.4 | -40.2 | 176.6 | 171.8 | 0 | 0 | 0 | 0 | 111.6 | V89 Y90 L95 D96 | V89-V93 HydrophobicContact CG1-CG2 4.44Å; V89-V93 WeakPolarHBondContact O-CB 3.44Å; V89-V93 VanDerWaalsContact O-CG2 3.26Å; V89-V93 WeakPolarHBondContact O-CG2 3.42Å; V89-V93 PolarHBondContact O-N 3.41Å; Y90-V93 PolarHBondContact O-N 3.28Å; V93-L95 VanDerWaalsContact C-N 3.32Å; V93-L95 PolarHBondContact O-N 2.98Å; V93-D96 PolarHBondContact O-N 2.71Å |
| 94 | L | 46 | Very low | 48.8 | Very low | 94 Ų | 94 | 103.4 Ų | 103.4 | 49% | 0.492 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -69 | -27.7 | 177.7 | -113.9 | 76.5 | 0 | 0 | 0 | 113.5 | Y90 D96 | Y90-L94 HydrophobicContact CD1-CD1 3.62Å; Y90-L94 HydrophobicContact CD1-CD2 4.46Å; Y90-L94 HydrophobicContact CE1-CD1 3.28Å; Y90-L94 HydrophobicContact CE1-CD2 4.19Å; Y90-L94 HydrophobicContact CE1-CG 4.36Å; Y90-L94 HydrophobicContact CE2-CD1 4.37Å; Y90-L94 HydrophobicContact CG-CD1 4.3Å; Y90-L94 VanDerWaalsContact O-CB 3.29Å; Y90-L94 WeakPolarHBondContact O-CB 3.17Å; Y90-L94 PolarHBondContact O-N 3.48Å; L94-D96 VanDerWaalsContact C-N 3.28Å |
| 95 | L | 46.5 | Very low | 48.1 | Very low | 125 Ų | 125 | 108.3 Ų | 108.3 | 65% | 0.654 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | -19.6 | 176.2 | -79.9 | 164.2 | 0 | 0 | 0 | 112.5 | E91 V93 | E91-L95 WeakPolarHBondContact O-CB 3.29Å; E91-L95 WeakPolarHBondContact O-CD1 3.21Å; E91-L95 WeakPolarHBondContact O-CG 3.32Å; E91-L95 PolarHBondContact O-N 3.03Å; E91-L95 VanDerWaalsContact O-N 3.12Å; V93-L95 VanDerWaalsContact C-N 3.32Å; V93-L95 PolarHBondContact O-N 2.98Å |
| 96 | D | 44.3 | Very low | 47.5 | Very low | 106 Ų | 106 | 110.2 Ų | 110.2 | 57% | 0.567 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.6 | -21.8 | -178.9 | -132 | 11.4 | 0 | 0 | 0 | 113.3 | V93 L94 S98 N99 | V93-D96 PolarHBondContact O-N 2.71Å; L94-D96 VanDerWaalsContact C-N 3.28Å; D96-S98 PolarHBondContact O-N 3.39Å; D96-S98 VanDerWaalsContact O-N 3.1Å; D96-N99 PolarHBondContact O-N 3.25Å |
| 97 | D | 45.8 | Very low | 46.6 | Very low | 128 Ų | 128 | 114.4 Ų | 114.4 | 68% | 0.684 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | -12.4 | 178.5 | -86.7 | -15.2 | 0 | 0 | 0 | 114.2 | ||
| 98 | S | 49.1 | Very low | 46 | Very low | 95 Ų | 95 | 114.9 Ų | 114.9 | 66% | 0.664 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.2 | 2.2 | 173.8 | 54.9 | 0 | 0 | 0 | 0 | 114.4 | D96 | D96-S98 PolarHBondContact O-N 3.39Å; D96-S98 VanDerWaalsContact O-N 3.1Å |
| 99 | N | 46.5 | Very low | 45.4 | Very low | 65 Ų | 65 | 113.1 Ų | 113.1 | 35% | 0.348 | 60% | 0.604 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -116.9 | -14.3 | -177.1 | -157.8 | 21.2 | 0 | 0 | 0 | 115.2 | D96 L101 T102 L103 | D96-N99 PolarHBondContact O-N 3.25Å; N99-L101 VanDerWaalsContact C-N 3.31Å; N99-L101 PolarHBondContact O-N 2.57Å; N99-T102 PolarHBondContact O-N 3.44Å; N99-L103 VanDerWaalsContact ND2-CD1 3.31Å; N99-L103 WeakPolarHBondContact ND2-CD1 3.42Å; N99-L103 PolarHBondContact O-N 2.86Å |
| 100 | W | 42 | Very low | 44.5 | Very low | 215 Ų | 215 | 115.8 Ų | 115.8 | 81% | 0.814 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -58.7 | -38.9 | 179.3 | -178.8 | -103.4 | 0 | 0 | 0 | 113.5 | T102 G104 | W100-T102 VanDerWaalsContact C-N 3.34Å; W100-T102 PolarHBondContact O-N 3.08Å; W100-G104 PolarHBondContact O-N 2.93Å |
| 101 | L | 44.2 | Very low | 43.8 | Very low | 148 Ų | 148 | 118.2 Ų | 118.2 | 78% | 0.775 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -73.6 | -22.9 | 177.4 | -88.8 | 102.5 | 0 | 0 | 0 | 113.9 | N99 | N99-L101 VanDerWaalsContact C-N 3.31Å; N99-L101 PolarHBondContact O-N 2.57Å |
| 102 | T | 41.9 | Very low | 43.2 | Very low | 76 Ų | 76 | 118.9 Ų | 118.9 | 47% | 0.466 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -94.2 | -23.2 | -176.5 | -44.6 | 0 | 0 | 0 | 0 | 112.2 | N99 W100 N106 | N99-T102 PolarHBondContact O-N 3.44Å; W100-T102 VanDerWaalsContact C-N 3.34Å; W100-T102 PolarHBondContact O-N 3.08Å; T102-N106 PolarHBondContact O-ND2 2.82Å |
| 103 | L | 44.6 | Very low | 42.2 | Very low | 99 Ų | 99 | 121 Ų | 121 | 52% | 0.518 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -80.1 | -28.2 | 172.3 | -103.1 | 152.1 | 0 | 0 | 0 | 113.2 | N99 L105 | N99-L103 VanDerWaalsContact ND2-CD1 3.31Å; N99-L103 WeakPolarHBondContact ND2-CD1 3.42Å; N99-L103 PolarHBondContact O-N 2.86Å; L103-L105 PolarHBondContact O-N 3.46Å |
| 104 | G | 45.5 | Very low | 41.5 | Very low | 56 Ų | 56 | 125.1 Ų | 125.1 | 58% | 0.577 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -70 | -23.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | W100 | W100-G104 PolarHBondContact O-N 2.93Å |
| 105 | L | 40.5 | Very low | 40.8 | Very low | 137 Ų | 137 | 129.5 Ų | 129.5 | 72% | 0.717 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -106.1 | -17.5 | -178.3 | -83.9 | 162.3 | 0 | 0 | 0 | 114.5 | L103 | L103-L105 PolarHBondContact O-N 3.46Å |
| 106 | N | 42.8 | Very low | 40.2 | Very low | 101 Ų | 101 | 131 Ų | 131 | 54% | 0.54 | 69% | 0.686 | S | S | . | * | H | α-helix | trans | -90 | -14.9 | 178.5 | -72.5 | -51.7 | 0 | 0 | 0 | 113.4 | T102 T108 | T102-N106 PolarHBondContact O-ND2 2.82Å; N106-T108 VanDerWaalsContact C-N 3.33Å; N106-T108 PolarHBondContact O-N 3.26Å |
| 107 | F | 36.1 | Very low | 39.5 | Very low | 178 Ų | 178 | 132.9 Ų | 132.9 | 78% | 0.781 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -17.6 | -178.3 | -158.2 | -99.9 | 0 | 0 | 0 | 114.1 | ||
| 108 | T | 40 | Very low | 39 | Very low | 124 Ų | 124 | 134.6 Ų | 134.6 | 76% | 0.761 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | -1.9 | -178.5 | 54.3 | 0 | 0 | 0 | 0 | 114.8 | N106 | N106-T108 VanDerWaalsContact C-N 3.33Å; N106-T108 PolarHBondContact O-N 3.26Å |
| 109 | S | 41.6 | Very low | 38.2 | Very low | 97 Ų | 97 | 140.6 Ų | 140.6 | 68% | 0.678 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.9 | -10.8 | -170.1 | -160.1 | 0 | 0 | 0 | 0 | 117.7 | ||
| 110 | T | 37.6 | Very low | 37.4 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 77% | 0.767 | 73% | 0.729 | S | S | * | * | trans | -127.5 | 70.6 | -175.3 | 51.4 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 111 | K | 37.7 | Very low | 37.3 | Very low | 205 Ų | 205 | 144 Ų | 144 | 89% | 0.891 | 73% | 0.731 | S | S | * | * | trans | -128.1 | 62.2 | 158 | -139.8 | 173.9 | -165.2 | 165.6 | 0 | 110.4 | ||||
| 112 | T | 36.6 | Very low | 36.4 | Very low | 126 Ų | 126 | 146.2 Ų | 146.2 | 77% | 0.773 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -139 | 121.6 | 155.5 | 52.9 | 0 | 0 | 0 | 0 | 111.1 | ||
| 113 | N | 30.2 | Very low | 36 | Very low | 160 Ų | 160 | 149.6 Ų | 149.6 | 86% | 0.856 | 75% | 0.749 | S | S | * | * | trans | 72.5 | 112.3 | 162.2 | -69 | -45.3 | 0 | 0 | 0 | 121.2 | ||||
| 114 | Q | 32.8 | Very low | 35.3 | Very low | 167 Ų | 167 | 152.7 Ų | 152.7 | 78% | 0.78 | 76% | 0.761 | S | S | * | * | trans | -37.3 | 144.6 | 147.4 | -68 | 175 | 7.5 | 0 | 0 | 112.1 | ||||
| 115 | R | 30.8 | Very low | 34.7 | Very low | 187 Ų | 187 | 155.5 Ų | 155.5 | 71% | 0.706 | 77% | 0.767 | S | S | * | * | 163.2 | 141.6 | 91.6 | -155.6 | 179.1 | -76.4 | 178.5 | -3.6 | 110 | |||||
| 116 | E | 32.9 | Very low | 34.1 | Very low | 157 Ų | 157 | 158.6 Ų | 158.6 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | trans | 64.3 | 145.9 | 160 | -76.8 | 146.3 | -162.6 | 0 | 0 | 116.6 | ||||
| 117 | D | 29.6 | Very low | 34 | Very low | 144 Ų | 144 | 158.5 Ų | 158.5 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | cis | -163.6 | 162.5 | 12.8 | -136.1 | -21.1 | 0 | 0 | 0 | 109.5 | ||||
| 118 | Q | 36.9 | Very low | 34.3 | Very low | 165 Ų | 165 | 156.7 Ų | 156.7 | 77% | 0.771 | 79% | 0.785 | S | S | * | * | trans | -61.8 | 145 | 176.7 | -56.5 | -176 | 12.2 | 0 | 0 | 113.4 | ||||
| 119 | R | 31.2 | Very low | 34.6 | Very low | 221 Ų | 221 | 155.5 Ų | 155.5 | 83% | 0.834 | 78% | 0.781 | S | S | * | * | 162.6 | 144.5 | 123.2 | -91.2 | 177.3 | -125.9 | -159.8 | 3.3 | 115.7 | |||||
| 120 | K | 29.9 | Very low | 34.6 | Very low | 184 Ų | 184 | 155 Ų | 155 | 80% | 0.8 | 78% | 0.778 | S | S | * | * | trans | 87.6 | 95.7 | 144 | -78.1 | 174.7 | -176.1 | -169.1 | 0 | 120.5 | ||||
| 121 | I | 39.1 | Very low | 35 | Very low | 168 Ų | 168 | 155.3 Ų | 155.3 | 86% | 0.862 | 78% | 0.775 | S | S | * | * | trans | -24 | 127.7 | 134.6 | -59.9 | 158.6 | 0 | 0 | 0 | 113.2 | ||||
| 122 | K | 26.2 | Very low | 35.2 | Very low | 193 Ų | 193 | 150.3 Ų | 150.3 | 84% | 0.839 | 76% | 0.762 | S | S | * | * | trans | -146 | 105 | 146.5 | -155.1 | 171.7 | -171.7 | -178.4 | 0 | 111.4 | ||||
| 123 | L | 33.5 | Very low | 35.6 | Very low | 148 Ų | 148 | 151.1 Ų | 151.1 | 78% | 0.775 | 76% | 0.755 | S | S | * | * | trans | -61.5 | 127.1 | 165.4 | -158.2 | 78.3 | 0 | 0 | 0 | 109.5 | ||||
| 124 | Q | 29.4 | Very low | 36.5 | Very low | 164 Ų | 164 | 148.3 Ų | 148.3 | 77% | 0.766 | 74% | 0.739 | S | S | * | * | trans | -142.5 | 101.1 | 147.3 | -91.3 | -149.3 | 3.3 | 0 | 0 | 110.9 | ||||
| 125 | T | 33.5 | Very low | 36.7 | Very low | 114 Ų | 114 | 149.9 Ų | 149.9 | 70% | 0.699 | 74% | 0.738 | S | S | * | * | trans | -28.4 | 120.7 | 146.5 | 23.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 126 | K | 27.6 | Very low | 37.2 | Very low | 203 Ų | 203 | 148.3 Ų | 148.3 | 88% | 0.883 | 74% | 0.736 | S | S | * | * | trans | -141.8 | 79.9 | 133.4 | -73.4 | -166.7 | -179.4 | 167.4 | 0 | 109.4 | ||||
| 127 | S | 40.3 | Very low | 37.8 | Very low | 99 Ų | 99 | 148.6 Ų | 148.6 | 69% | 0.692 | 73% | 0.731 | S | S | * | * | trans | -70.6 | 160.5 | 156.2 | 178.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 128 | V | 43.1 | Very low | 38.7 | Very low | 140 Ų | 140 | 149 Ų | 149 | 85% | 0.848 | 73% | 0.726 | S | S | * | * | S | Bend | trans | 94.5 | 61.6 | 177.4 | -156.7 | 0 | 0 | 0 | 0 | 115.3 | ||
| 129 | S | 45.7 | Very low | 39 | Very low | 98 Ų | 98 | 146.8 Ų | 146.8 | 69% | 0.685 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -159.2 | -11.8 | 142.7 | -166 | 0 | 0 | 0 | 0 | 114 | ||
| 130 | S | 42.6 | Very low | 39.7 | Very low | 87 Ų | 87 | 141.8 Ų | 141.8 | 61% | 0.608 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -82.8 | -16.1 | -174.5 | -57.7 | 0 | 0 | 0 | 0 | 115.8 | ||
| 131 | N | 44.8 | Very low | 40.7 | Very low | 132 Ų | 132 | 138.3 Ų | 138.3 | 71% | 0.706 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -78.6 | -21 | -173.7 | -80.8 | -18 | 0 | 0 | 0 | 114.3 | ||
| 132 | T | 43.1 | Very low | 40.8 | Very low | 100 Ų | 100 | 137.7 Ų | 137.7 | 61% | 0.613 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -83.2 | -28.9 | 178.2 | 49.8 | 0 | 0 | 0 | 0 | 112.6 | K136 | T132-K136 WeakPolarHBondContact O-CG 3.46Å; T132-K136 PolarHBondContact O-N 3.49Å |
| 133 | F | 43.5 | Very low | 41.8 | Very low | 142 Ų | 142 | 134 Ų | 134 | 62% | 0.623 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -76.8 | -40.1 | 180 | -162.6 | -99.3 | 0 | 0 | 0 | 112.1 | W135 K136 R137 | F133-W135 VanDerWaalsContact C-N 3.35Å; F133-W135 PolarHBondContact O-N 3.4Å; F133-K136 PolarHBondContact O-N 3.44Å; F133-R137 PolarHBondContact O-N 3.16Å; F133-R137 VanDerWaalsContact O-N 3.16Å |
| 134 | L | 50.1 | Low | 42.2 | Very low | 101 Ų | 101 | 135.4 Ų | 135.4 | 53% | 0.529 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -65.3 | -36 | 175.4 | -85 | 158.7 | 0 | 0 | 0 | 112.6 | R137 K138 | L134-R137 PolarHBondContact O-N 3.37Å; L134-K138 PolarHBondContact O-N 2.98Å |
| 135 | W | 37.5 | Very low | 42.9 | Very low | 201 Ų | 201 | 136.9 Ų | 136.9 | 76% | 0.761 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -69.4 | -39.6 | 177.9 | -126.4 | 42.7 | 0 | 0 | 0 | 112.5 | F133 R137 K138 H139 | F133-W135 VanDerWaalsContact C-N 3.35Å; F133-W135 PolarHBondContact O-N 3.4Å; W135-R137 VanDerWaalsContact C-N 3.32Å; W135-R137 PolarHBondContact O-N 3Å; W135-K138 PolarHBondContact O-N 3.4Å; W135-H139 WeakPolarHBondContact O-CB 3.41Å; W135-H139 PolarHBondContact O-N 3.44Å |
| 136 | K | 41.7 | Very low | 43 | Very low | 153 Ų | 153 | 138.8 Ų | 138.8 | 67% | 0.665 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -64.9 | -35.1 | 174.6 | -72.2 | -176.6 | 178.5 | -170.8 | 0 | 112.3 | T132 F133 I140 | T132-K136 WeakPolarHBondContact O-CG 3.46Å; T132-K136 PolarHBondContact O-N 3.49Å; F133-K136 PolarHBondContact O-N 3.44Å; K136-I140 WeakPolarHBondContact O-CD1 3.36Å; K136-I140 WeakPolarHBondContact O-CG1 3.48Å; K136-I140 PolarHBondContact O-N 3.39Å |
| 137 | R | 43.8 | Very low | 43.3 | Very low | 163 Ų | 163 | 134.4 Ų | 134.4 | 62% | 0.615 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -72.1 | -39.4 | 175.2 | -115.6 | 175.4 | 165.6 | 165.3 | -3.8 | 113.1 | F133 L134 W135 I140 I141 | F133-R137 PolarHBondContact O-N 3.16Å; F133-R137 VanDerWaalsContact O-N 3.16Å; L134-R137 PolarHBondContact O-N 3.37Å; W135-R137 VanDerWaalsContact C-N 3.32Å; W135-R137 PolarHBondContact O-N 3Å; R137-I140 PolarHBondContact O-N 3.45Å; R137-I141 PolarHBondContact O-N 3.46Å |
| 138 | K | 48.6 | Very low | 42.8 | Very low | 152 Ų | 152 | 135.1 Ų | 135.1 | 66% | 0.661 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -64.5 | -38.5 | 174.1 | -79 | -168.6 | 170.8 | -171.2 | 0 | 112.6 | L134 W135 I140 I141 F142 | L134-K138 PolarHBondContact O-N 2.98Å; W135-K138 PolarHBondContact O-N 3.4Å; K138-I140 VanDerWaalsContact C-N 3.33Å; K138-I140 PolarHBondContact O-N 3.45Å; K138-I141 PolarHBondContact O-N 3.01Å; K138-F142 PolarHBondContact O-N 3.31Å |
| 139 | H | 43.6 | Very low | 42.3 | Very low | 120 Ų | 120 | 137.2 Ų | 137.2 | 56% | 0.556 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -69.5 | -29.2 | -179.2 | -150.7 | -70.4 | 0 | 0 | 0 | 113.2 | W135 I143 | W135-H139 WeakPolarHBondContact O-CB 3.41Å; W135-H139 PolarHBondContact O-N 3.44Å; H139-I143 VanDerWaalsContact ND1-CD1 3.34Å; H139-I143 WeakPolarHBondContact ND1-CD1 3.39Å; H139-I143 VanDerWaalsContact O-CG1 3.32Å; H139-I143 WeakPolarHBondContact O-CG1 3.37Å; H139-I143 PolarHBondContact O-N 3.03Å |
| 140 | I | 45.9 | Very low | 41.7 | Very low | 115 Ų | 115 | 137.8 Ų | 137.8 | 59% | 0.59 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -72.3 | -32.6 | 176.1 | -72.3 | 165.8 | 0 | 0 | 0 | 111.6 | K136 R137 K138 | K136-I140 WeakPolarHBondContact O-CD1 3.36Å; K136-I140 WeakPolarHBondContact O-CG1 3.48Å; K136-I140 PolarHBondContact O-N 3.39Å; R137-I140 PolarHBondContact O-N 3.45Å; K138-I140 VanDerWaalsContact C-N 3.33Å; K138-I140 PolarHBondContact O-N 3.45Å |
| 141 | I | 51.7 | Low | 41.4 | Very low | 111 Ų | 111 | 137.6 Ų | 137.6 | 57% | 0.569 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -78.5 | -38.6 | 177 | -62.5 | 169 | 0 | 0 | 0 | 110.6 | R137 K138 I143 K144 Y145 | R137-I141 PolarHBondContact O-N 3.46Å; K138-I141 PolarHBondContact O-N 3.01Å; I141-I143 PolarHBondContact O-N 3.18Å; I141-K144 PolarHBondContact O-N 3.44Å; I141-Y145 PolarHBondContact O-N 3.36Å |
| 142 | F | 40.1 | Very low | 40.9 | Very low | 156 Ų | 156 | 137 Ų | 137 | 68% | 0.684 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -65.7 | -35.2 | 179.5 | -158.5 | -95.1 | 0 | 0 | 0 | 112.9 | K138 K144 Y145 | K138-F142 PolarHBondContact O-N 3.31Å; F142-K144 VanDerWaalsContact C-N 3.33Å; F142-Y145 PolarHBondContact O-N 2.8Å |
| 143 | I | 47.3 | Very low | 40.9 | Very low | 114 Ų | 114 | 140.8 Ų | 140.8 | 59% | 0.585 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -70.5 | -29.1 | 175.4 | -67.4 | 170.7 | 0 | 0 | 0 | 111.8 | H139 I141 Y145 | H139-I143 VanDerWaalsContact ND1-CD1 3.34Å; H139-I143 WeakPolarHBondContact ND1-CD1 3.39Å; H139-I143 VanDerWaalsContact O-CG1 3.32Å; H139-I143 WeakPolarHBondContact O-CG1 3.37Å; H139-I143 PolarHBondContact O-N 3.03Å; I141-I143 PolarHBondContact O-N 3.18Å; I143-Y145 VanDerWaalsContact C-N 3.31Å; I143-Y145 PolarHBondContact O-N 2.9Å |
| 144 | K | 42.7 | Very low | 40.6 | Very low | 179 Ų | 179 | 141.3 Ų | 141.3 | 78% | 0.778 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -78.7 | -10.7 | 177.2 | -91.4 | -173.8 | 171.6 | -177 | 0 | 114.2 | I141 F142 | I141-K144 PolarHBondContact O-N 3.44Å; F142-K144 VanDerWaalsContact C-N 3.33Å |
| 145 | Y | 43.6 | Very low | 40.3 | Very low | 194 Ų | 194 | 142.3 Ų | 142.3 | 76% | 0.761 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.6 | 42.7 | -175.9 | -89.8 | -86.3 | 0 | 0 | 0 | 112.9 | I141 F142 I143 P147 | I141-Y145 PolarHBondContact O-N 3.36Å; F142-Y145 PolarHBondContact O-N 2.8Å; I143-Y145 VanDerWaalsContact C-N 3.31Å; I143-Y145 PolarHBondContact O-N 2.9Å; Y145-P147 WeakPolarHBondContact O-CD 3.37Å |
| 146 | Q | 35.2 | Very low | 40.7 | Very low | 154 Ų | 154 | 140.3 Ų | 140.3 | 72% | 0.72 | 69% | 0.686 | S | S | * | * | trans | -96.9 | 95.7 | 165.9 | -167.9 | 168.2 | 0.8 | 0 | 0 | 110 | S148 | Q146-S148 PolarHBondContact O-N 2.82Š| ||
| 147 | P | 34.1 | Very low | 40.8 | Very low | 112 Ų | 112 | 140.2 Ų | 140.2 | 73% | 0.727 | 69% | 0.693 | S | S | * | * | trans | -70.1 | 112.5 | 163.5 | 28.3 | -29.1 | 0 | 0 | 0 | 107.3 | Y145 F149 | Y145-P147 WeakPolarHBondContact O-CD 3.37Å; P147-F149 VanDerWaalsContact C-N 3.28Å; P147-F149 PolarHBondContact O-N 3.24Å | ||
| 148 | S | 29.6 | Very low | 40.7 | Very low | 113 Ų | 113 | 137.5 Ų | 137.5 | 79% | 0.79 | 70% | 0.695 | S | S | * | * | trans | -67 | 89.1 | 168 | 42.9 | 0 | 0 | 0 | 0 | 109 | Q146 S150 | Q146-S148 PolarHBondContact O-N 2.82Å; S148-S150 PolarHBondContact O-N 3.49Å; S148-S150 VanDerWaalsContact O-N 3.16Å | ||
| 149 | F | 33.8 | Very low | 40.5 | Very low | 184 Ų | 184 | 134 Ų | 134 | 81% | 0.807 | 69% | 0.694 | S | S | * | * | trans | -78.5 | 90 | 167.1 | -165.8 | -98.5 | 0 | 0 | 0 | 108.3 | P147 T151 | P147-F149 VanDerWaalsContact C-N 3.28Å; P147-F149 PolarHBondContact O-N 3.24Å; F149-T151 PolarHBondContact O-N 3.31Å | ||
| 150 | S | 32.1 | Very low | 40.4 | Very low | 111 Ų | 111 | 136.6 Ų | 136.6 | 78% | 0.776 | 70% | 0.704 | S | S | * | * | trans | -76.6 | 110.5 | 166.1 | -177 | 0 | 0 | 0 | 0 | 108.3 | S148 D152 | S148-S150 PolarHBondContact O-N 3.49Å; S148-S150 VanDerWaalsContact O-N 3.16Å; S150-D152 PolarHBondContact O-N 3.09Å | ||
| 151 | T | 36.7 | Very low | 40.7 | Very low | 82 Ų | 82 | 136.9 Ų | 136.9 | 50% | 0.503 | 71% | 0.706 | S | S | . | * | trans | -62.8 | 114.2 | 176.4 | -57.3 | 0 | 0 | 0 | 0 | 111.3 | F149 Q153 | F149-T151 PolarHBondContact O-N 3.31Å; T151-Q153 HydrophobicContact CG2-CB 3.49Å; T151-Q153 VanDerWaalsContact CG2-CB 3.49Å | ||
| 152 | D | 33.9 | Very low | 40.3 | Very low | 120 Ų | 120 | 138.4 Ų | 138.4 | 64% | 0.642 | 72% | 0.715 | S | S | * | * | trans | -111.2 | 68.4 | 160 | -127.5 | -2.9 | 0 | 0 | 0 | 109.6 | S150 K154 | S150-D152 PolarHBondContact O-N 3.09Å; D152-K154 PolarHBondContact O-N 3.35Å; D152-K154 WeakPolarHBondContact OD1-CE 3.32Å; D152-K154 IonicContact OD1-NZ 3.87Å | ||
| 153 | Q | 42.6 | Very low | 40.4 | Very low | 179 Ų | 179 | 136 Ų | 136 | 84% | 0.836 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | 50.9 | -179.3 | -169.6 | 177 | 37.9 | 0 | 0 | 111.8 | T151 | T151-Q153 HydrophobicContact CG2-CB 3.49Å; T151-Q153 VanDerWaalsContact CG2-CB 3.49Å |
| 154 | K | 39.1 | Very low | 40.3 | Very low | 154 Ų | 154 | 138.7 Ų | 138.7 | 67% | 0.67 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.3 | 4.6 | 179.1 | 58.8 | 178 | 170.3 | -177.5 | 0 | 117 | D152 | D152-K154 PolarHBondContact O-N 3.35Å; D152-K154 WeakPolarHBondContact OD1-CE 3.32Å; D152-K154 IonicContact OD1-NZ 3.87Å |
| 155 | N | 42.6 | Very low | 40.5 | Very low | 122 Ų | 122 | 137 Ų | 137 | 65% | 0.652 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -119.7 | 5.2 | -179.9 | -89.1 | -39.7 | 0 | 0 | 0 | 116.5 | T158 | N155-T158 PolarHBondContact O-OG1 2.81Š|
| 156 | L | 45.1 | Very low | 40.4 | Very low | 158 Ų | 158 | 131.2 Ų | 131.2 | 83% | 0.827 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -92.2 | -7.4 | 178.8 | -71.8 | 170.3 | 0 | 0 | 0 | 114.6 | ||
| 157 | N | 43.9 | Very low | 40.8 | Very low | 152 Ų | 152 | 130 Ų | 130 | 81% | 0.813 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -87.8 | -5.3 | 178.6 | -83.2 | -17.2 | 0 | 0 | 0 | 114.4 | ||
| 158 | T | 43.4 | Very low | 41 | Very low | 106 Ų | 106 | 133.7 Ų | 133.7 | 65% | 0.65 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -94.2 | -16.6 | 178.5 | 24.9 | 0 | 0 | 0 | 0 | 113.8 | N155 | N155-T158 PolarHBondContact O-OG1 2.81Š|
| 159 | A | 43.5 | Very low | 41.1 | Very low | 78 Ų | 78 | 132.6 Ų | 132.6 | 65% | 0.645 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -88.8 | -8.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 160 | F | 41.6 | Very low | 41.1 | Very low | 174 Ų | 174 | 131.4 Ų | 131.4 | 76% | 0.763 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -91.1 | -13.9 | -178 | -163.9 | -102.4 | 0 | 0 | 0 | 113.9 | ||
| 161 | I | 53 | Low | 41.3 | Very low | 122 Ų | 122 | 135.9 Ų | 135.9 | 63% | 0.626 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -90.9 | -19.4 | -178.8 | -60.6 | -62.8 | 0 | 0 | 0 | 112.8 | S163 | I161-S163 PolarHBondContact O-N 3.18Š|
| 162 | D | 42.1 | Very low | 40.9 | Very low | 143 Ų | 143 | 136.2 Ų | 136.2 | 77% | 0.765 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | -4.2 | -173.7 | -143.8 | 31 | 0 | 0 | 0 | 114.5 | ||
| 163 | S | 43.3 | Very low | 40.6 | Very low | 104 Ų | 104 | 142.3 Ų | 142.3 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | -1.8 | 179.7 | -162.4 | 0 | 0 | 0 | 0 | 114.1 | I161 | I161-S163 PolarHBondContact O-N 3.18Š|
| 164 | Q | 45.4 | Very low | 40.1 | Very low | 171 Ų | 171 | 142.7 Ų | 142.7 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -111.2 | 6.5 | -176.4 | -94 | -140.2 | 96.4 | 0 | 0 | 116.4 | ||
| 165 | I | 46.8 | Very low | 39.7 | Very low | 144 Ų | 144 | 140.6 Ų | 140.6 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -105 | -5.1 | 178.6 | -61.9 | 172.1 | 0 | 0 | 0 | 112.5 | ||
| 166 | G | 41.5 | Very low | 39.2 | Very low | 72 Ų | 72 | 144.2 Ų | 144.2 | 74% | 0.742 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -95.4 | -0 | -168.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||
| 167 | T | 41.8 | Very low | 38.5 | Very low | 129 Ų | 129 | 140.4 Ų | 140.4 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -119.3 | 7.5 | -167.9 | 42 | 0 | 0 | 0 | 0 | 116.4 | ||
| 168 | E | 39.6 | Very low | 37.8 | Very low | 189 Ų | 189 | 140.5 Ų | 140.5 | 88% | 0.883 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -134.4 | 62.4 | 176.6 | -65.2 | -167.8 | 158.9 | 0 | 0 | 112.9 | ||
| 169 | A | 32 | Very low | 37.5 | Very low | 90 Ų | 90 | 145.1 Ų | 145.1 | 74% | 0.744 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -153.6 | 111.4 | 163.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 170 | L | 33.7 | Very low | 38.2 | Very low | 160 Ų | 160 | 146.4 Ų | 146.4 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | trans | 87.7 | 63 | 150.5 | -56.3 | 175.4 | 0 | 0 | 0 | 118.8 | ||||
| 171 | Q | 35.4 | Very low | 37.7 | Very low | 204 Ų | 204 | 146.1 Ų | 146.1 | 95% | 0.953 | 79% | 0.785 | S | S | * | * | trans | -73.1 | 100.6 | 132.2 | -152.9 | -176.4 | 31.9 | 0 | 0 | 108.3 | ||||
| 172 | S | 28.3 | Very low | 36.7 | Very low | 89 Ų | 89 | 148.4 Ų | 148.4 | 62% | 0.622 | 79% | 0.79 | S | S | * | * | trans | -163.6 | 110.6 | 166.4 | -171.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 173 | R | 28.7 | Very low | 36.2 | Very low | 249 Ų | 249 | 146.2 Ų | 146.2 | 94% | 0.94 | 78% | 0.782 | S | S | * | * | trans | 87.9 | 136.7 | 143.4 | -81.7 | -172.7 | 172.6 | -168 | -0.3 | 123 | ||||
| 174 | H | 30.8 | Very low | 35.6 | Very low | 187 Ų | 187 | 149.3 Ų | 149.3 | 87% | 0.866 | 79% | 0.785 | S | S | * | * | trans | -106.2 | 166.9 | -168.3 | -123.5 | -73.8 | 0 | 0 | 0 | 112.8 | ||||
| 175 | S | 30.3 | Very low | 34.9 | Very low | 109 Ų | 109 | 145.6 Ų | 145.6 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | trans | 95.2 | 141.3 | 150.7 | 83.5 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 176 | K | 33.7 | Very low | 34 | Very low | 198 Ų | 198 | 146.7 Ų | 146.7 | 86% | 0.861 | 78% | 0.782 | S | S | * | * | cis | -172.3 | 155.3 | 17.6 | -158.8 | 172.3 | -179.4 | 164.7 | 0 | 112.4 | ||||
| 177 | A | 29.8 | Very low | 33.4 | Very low | 78 Ų | 78 | 151.7 Ų | 151.7 | 65% | 0.645 | 79% | 0.788 | S | S | * | * | trans | 68.6 | 147.2 | 148.6 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 178 | N | 29.7 | Very low | 32.7 | Very low | 154 Ų | 154 | 150.4 Ų | 150.4 | 82% | 0.824 | 78% | 0.784 | S | S | * | * | cis | -168.2 | 139.8 | 5 | -106.2 | -21.6 | 0 | 0 | 0 | 111.8 | ||||
| 179 | K | 37 | Very low | 32.3 | Very low | 203 Ų | 203 | 150.4 Ų | 150.4 | 88% | 0.883 | 78% | 0.784 | S | S | * | * | trans | 58.9 | 157.5 | 144 | -93.1 | -145.7 | 165 | 176.3 | 0 | 126.8 | ||||
| 180 | P | 58.5 | Low | 32.2 | Very low | 105 Ų | 105 | 151.1 Ų | 151.1 | 68% | 0.682 | 78% | 0.784 | S | S | * | * | trans | -124.4 | -177.3 | -158.1 | 46.9 | -33.4 | 0 | 0 | 0 | 116 | ||||
| 181 | E | 30.9 | Very low | 31.9 | Very low | 169 Ų | 169 | 150.9 Ų | 150.9 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | trans | -161.9 | 125.1 | 149.9 | -101.7 | -171 | 131.1 | 0 | 0 | 110.5 | ||||
| 182 | K | 31.4 | Very low | 31.6 | Very low | 169 Ų | 169 | 148.8 Ų | 148.8 | 74% | 0.735 | 78% | 0.778 | S | S | * | * | 80.8 | 137.2 | 92.9 | -133 | -162.8 | -177.2 | 170.5 | 0 | 112.1 | |||||
| 183 | T | 31 | Very low | 31.6 | Very low | 97 Ų | 97 | 149.3 Ų | 149.3 | 60% | 0.595 | 78% | 0.782 | S | S | * | * | cis | -171.3 | 149.2 | 29.6 | -20.9 | 0 | 0 | 0 | 0 | 104.2 | ||||
| 184 | Q | 32.3 | Very low | 31.5 | Very low | 170 Ų | 170 | 142.3 Ų | 142.3 | 79% | 0.794 | 77% | 0.771 | S | S | * | * | 163.4 | 126.8 | 78.2 | -121.8 | 157.9 | -7.9 | 0 | 0 | 105.7 | |||||
| 185 | S | 29 | Very low | 31.2 | Very low | 92 Ų | 92 | 139.9 Ų | 139.9 | 64% | 0.643 | 76% | 0.763 | S | S | * | * | 78.9 | 127.1 | 94.5 | -165 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 186 | M | 29.1 | Very low | 30.9 | Very low | 168 Ų | 168 | 142.1 Ų | 142.1 | 83% | 0.828 | 76% | 0.762 | S | S | * | * | cis | -162.3 | 141.5 | 20.4 | -105.8 | 152.8 | 167.5 | 0 | 0 | 107.1 | ||||
| 187 | M | 28.1 | Very low | 30.7 | Very low | 176 Ų | 176 | 144.1 Ų | 144.1 | 87% | 0.867 | 76% | 0.764 | S | S | * | * | 37.5 | 124.9 | 102.7 | -95 | 158.7 | 72.2 | 0 | 0 | 114.6 | |||||
| 188 | S | 28.2 | Very low | 30.9 | Very low | 103 Ų | 103 | 148.3 Ų | 148.3 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | cis | -160 | 139.3 | 43.7 | -62.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 189 | Q | 30.4 | Very low | 30.8 | Very low | 189 Ų | 189 | 150.1 Ų | 150.1 | 88% | 0.883 | 77% | 0.774 | S | S | * | * | 53.5 | 134.1 | 79.6 | -89.9 | -167.9 | 2.2 | 0 | 0 | 117.3 | |||||
| 190 | S | 29.9 | Very low | 30.7 | Very low | 105 Ų | 105 | 149.7 Ų | 149.7 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | trans | 95.8 | 138.6 | 168.2 | 69.1 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 191 | D | 27.5 | Very low | 29.5 | Very low | 155 Ų | 155 | 153.1 Ų | 153.1 | 83% | 0.829 | 78% | 0.782 | S | S | * | * | cis | -164.2 | 154.3 | -18.5 | -103.8 | -40.7 | 0 | 0 | 0 | 107.5 | ||||
| 192 | L | 30.2 | Very low | 29.8 | Very low | 159 Ų | 159 | 153.9 Ų | 153.9 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | trans | -53 | 144.4 | 166.5 | -75.3 | 150.6 | 0 | 0 | 0 | 111.4 | ||||
| 193 | S | 27.8 | Very low | 29.9 | Very low | 101 Ų | 101 | 156.5 Ų | 156.5 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | 167.1 | 139.1 | 108 | -73.6 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 194 | S | 26.4 | Very low | 30.1 | Very low | 102 Ų | 102 | 161 Ų | 161 | 71% | 0.713 | 81% | 0.805 | S | S | * | * | trans | 72.7 | 142.1 | 133.9 | 66.6 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 195 | L | 24.2 | Very low | 30 | Very low | 135 Ų | 135 | 160.6 Ų | 160.6 | 71% | 0.707 | 81% | 0.808 | S | S | * | * | cis | -170.8 | 149.5 | 11.1 | -143.9 | 79.9 | 0 | 0 | 0 | 106.9 | ||||
| 196 | Q | 25 | Very low | 30.4 | Very low | 157 Ų | 157 | 164.9 Ų | 164.9 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | trans | 40.5 | 125.8 | 143.3 | -78.9 | 172.7 | -83.7 | 0 | 0 | 120.2 | ||||
| 197 | R | 27.8 | Very low | 30.5 | Very low | 239 Ų | 239 | 159.5 Ų | 159.5 | 90% | 0.902 | 80% | 0.803 | S | S | * | * | -167.5 | 137.3 | 98.2 | -134.9 | 164.6 | 167.1 | 152.4 | -7 | 112.4 | |||||
| 198 | E | 34 | Very low | 30.9 | Very low | 166 Ų | 166 | 158.3 Ų | 158.3 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | trans | -58 | 144.8 | 166.4 | -61.3 | 156 | 163.7 | 0 | 0 | 110.7 | ||||
| 199 | E | 29.2 | Very low | 31.4 | Very low | 192 Ų | 192 | 161.8 Ų | 161.8 | 90% | 0.897 | 80% | 0.8 | S | S | * | * | -173.8 | 114.6 | 129.4 | -103.3 | 169.4 | 158.5 | 0 | 0 | 109.2 | |||||
| 200 | E | 34.8 | Very low | 31.4 | Very low | 195 Ų | 195 | 157.7 Ų | 157.7 | 91% | 0.911 | 80% | 0.799 | S | S | * | * | trans | -65 | 134.3 | 153.9 | -77.7 | -177.9 | 138.3 | 0 | 0 | 108.1 | ||||
| 201 | E | 31.9 | Very low | 31.9 | Very low | 176 Ų | 176 | 161.2 Ų | 161.2 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | trans | -159.7 | 127.9 | 130.6 | -120.1 | -174.9 | -176 | 0 | 0 | 111.4 | ||||
| 202 | E | 37.5 | Very low | 32.3 | Very low | 185 Ų | 185 | 162.5 Ų | 162.5 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | trans | -59.8 | 131 | 168.6 | -170.9 | -177.6 | -174 | 0 | 0 | 110.6 | ||||
| 203 | R | 33.2 | Very low | 32.5 | Very low | 224 Ų | 224 | 163.1 Ų | 163.1 | 85% | 0.845 | 81% | 0.808 | S | S | * | * | trans | -134.3 | 120.9 | 158.7 | -81.5 | -159 | 174.6 | 152.6 | 5.6 | 111.6 | ||||
| 204 | Q | 35.1 | Very low | 32.8 | Very low | 193 Ų | 193 | 161.9 Ų | 161.9 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | trans | -34.9 | 133.5 | 154.9 | -84.8 | 167.8 | -33.7 | 0 | 0 | 112.8 | ||||
| 205 | D | 30.1 | Very low | 32.9 | Very low | 160 Ų | 160 | 165.1 Ų | 165.1 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | trans | -123.9 | 117.6 | 148.8 | -168.6 | 21.2 | 0 | 0 | 0 | 108.4 | ||||
| 206 | K | 38.8 | Very low | 33.6 | Very low | 183 Ų | 183 | 167 Ų | 167 | 80% | 0.796 | 82% | 0.82 | S | S | * | * | trans | -141.9 | 109.1 | 169.5 | -164.6 | -170.6 | -177.9 | -147.1 | 0 | 107.7 | ||||
| 207 | G | 29.8 | Very low | 34.2 | Very low | 54 Ų | 54 | 165.7 Ų | 165.7 | 56% | 0.557 | 82% | 0.822 | S | S | * | * | trans | -167.3 | 107.8 | 154.4 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 208 | E | 37.1 | Very low | 34.6 | Very low | 152 Ų | 152 | 162.8 Ų | 162.8 | 71% | 0.71 | 82% | 0.819 | S | S | * | * | 59.6 | 119.2 | 82.6 | -73.2 | -177.8 | -166.3 | 0 | 0 | 109.4 | |||||
| 209 | E | 38.3 | Very low | 34.7 | Very low | 175 Ų | 175 | 159 Ų | 159 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | cis | -168.5 | 147.6 | 14.2 | -43.2 | 178.8 | -157.8 | 0 | 0 | 106.7 | ||||
| 210 | A | 29.9 | Very low | 34.9 | Very low | 104 Ų | 104 | 159 Ų | 159 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | -164.9 | 113 | 149.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 211 | L | 40.3 | Very low | 34.9 | Very low | 179 Ų | 179 | 157.7 Ų | 157.7 | 94% | 0.937 | 81% | 0.81 | S | S | * | * | trans | -72.3 | 129.5 | 159.5 | -86.8 | 142.6 | 0 | 0 | 0 | 109.5 | ||||
| 212 | E | 37 | Very low | 34.8 | Very low | 182 Ų | 182 | 158.1 Ų | 158.1 | 85% | 0.85 | 81% | 0.812 | S | S | * | * | trans | -178.9 | 141 | 155.7 | -105.4 | 179.7 | -164.6 | 0 | 0 | 104.5 | ||||
| 213 | E | 33.6 | Very low | 34.6 | Very low | 172 Ų | 172 | 157.6 Ų | 157.6 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | cis | -167.1 | 153.6 | -7.8 | -159.7 | -179.7 | 178.9 | 0 | 0 | 102.7 | Q215 | E213-Q215 PolarHBondContact O-N 3.38Š| ||
| 214 | G | 35.1 | Very low | 34.7 | Very low | 74 Ų | 74 | 153.5 Ų | 153.5 | 76% | 0.763 | 81% | 0.809 | S | S | * | * | trans | -63.9 | 128.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 215 | Q | 28.8 | Very low | 34.5 | Very low | 170 Ų | 170 | 152.5 Ų | 152.5 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | trans | -112.8 | 97.5 | 163.8 | -169.2 | 169.1 | -24.4 | 0 | 0 | 108.4 | E213 V217 | E213-Q215 PolarHBondContact O-N 3.38Å; Q215-V217 PolarHBondContact O-N 2.76Å | ||
| 216 | E | 37.9 | Very low | 34.9 | Very low | 175 Ų | 175 | 149.6 Ų | 149.6 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -49.1 | 115.6 | 156.6 | 51.9 | -154.1 | 151.4 | 0 | 0 | 110 | ||||
| 217 | V | 37.9 | Very low | 34.8 | Very low | 129 Ų | 129 | 149.6 Ų | 149.6 | 78% | 0.782 | 81% | 0.806 | S | S | * | * | trans | -103.6 | 109.4 | 163.4 | -84.8 | 0 | 0 | 0 | 0 | 106.4 | Q215 | Q215-V217 PolarHBondContact O-N 2.76Š| ||
| 218 | E | 35.2 | Very low | 35.1 | Very low | 178 Ų | 178 | 153.9 Ų | 153.9 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | trans | -55.6 | 140.6 | 176.2 | -61 | -148.4 | 144.6 | 0 | 0 | 110.9 | E220 | E218-E220 PolarHBondContact O-N 3.26Š| ||
| 219 | A | 36.5 | Very low | 34.8 | Very low | 87 Ų | 87 | 154.4 Ų | 154.4 | 72% | 0.719 | 81% | 0.813 | S | S | * | * | trans | -67.1 | 111.6 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | E221 | A219-E221 PolarHBondContact O-N 3.4Å; A219-E221 VanDerWaalsContact O-N 3.14Å | ||
| 220 | E | 34.5 | Very low | 34.6 | Very low | 193 Ų | 193 | 150.1 Ų | 150.1 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | -73.6 | 101.6 | 161.1 | -71.2 | -151.2 | 151.8 | 0 | 0 | 108.2 | E218 Q222 | E218-E220 PolarHBondContact O-N 3.26Å; E220-Q222 PolarHBondContact O-N 2.7Å | ||
| 221 | E | 34.8 | Very low | 34.6 | Very low | 166 Ų | 166 | 151.2 Ų | 151.2 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | trans | -69 | 110.9 | 165.1 | -63 | -178.6 | 162.1 | 0 | 0 | 108.2 | A219 E223 | A219-E221 PolarHBondContact O-N 3.4Å; A219-E221 VanDerWaalsContact O-N 3.14Å; E221-E223 PolarHBondContact O-N 3.49Å; E221-E223 VanDerWaalsContact O-N 3.17Å | ||
| 222 | Q | 29.9 | Very low | 34 | Very low | 186 Ų | 186 | 152.1 Ų | 152.1 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | trans | -82.1 | 89.3 | 169.7 | -169 | 164.7 | 12.2 | 0 | 0 | 108.8 | E220 | E220-Q222 PolarHBondContact O-N 2.7Š| ||
| 223 | E | 32.3 | Very low | 33.6 | Very low | 173 Ų | 173 | 146.7 Ų | 146.7 | 81% | 0.808 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 130.4 | 163.1 | -70.5 | -171.2 | 141 | 0 | 0 | 109.7 | E221 | E221-E223 PolarHBondContact O-N 3.49Å; E221-E223 VanDerWaalsContact O-N 3.17Å |
| 224 | V | 34.8 | Very low | 33.7 | Very low | 139 Ų | 139 | 147 Ų | 147 | 84% | 0.842 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -102.6 | 117.6 | 164.5 | -152.8 | 0 | 0 | 0 | 0 | 106.5 | A226 | V224-A226 PolarHBondContact O-N 2.96Š|
| 225 | E | 32 | Very low | 33.2 | Very low | 171 Ų | 171 | 150.9 Ų | 150.9 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 127.6 | -175.6 | -60.7 | -172.3 | 150.8 | 0 | 0 | 113.4 | ||
| 226 | A | 38.9 | Very low | 33.4 | Very low | 100 Ų | 100 | 149.1 Ų | 149.1 | 83% | 0.826 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -96.8 | 117.3 | 145.3 | 0 | 0 | 0 | 0 | 0 | 106.4 | V224 E228 | V224-A226 PolarHBondContact O-N 2.96Å; A226-E228 PolarHBondContact O-N 2.9Å |
| 227 | E | 36.6 | Very low | 33.6 | Very low | 182 Ų | 182 | 146 Ų | 146 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 133.7 | -175.3 | -79.1 | -153.4 | 158.6 | 0 | 0 | 113.8 | ||
| 228 | E | 35 | Very low | 33.3 | Very low | 145 Ų | 145 | 149.4 Ų | 149.4 | 68% | 0.678 | 80% | 0.795 | S | S | * | * | trans | -27.8 | 145.5 | 158.3 | -120 | -169.8 | 96.1 | 0 | 0 | 117 | A226 V230 | A226-E228 PolarHBondContact O-N 2.9Å; E228-V230 HydrophobicContact CG-CG2 3.98Å; E228-V230 WeakPolarHBondContact OE1-CG2 3.4Å | ||
| 229 | H | 32.1 | Very low | 33.7 | Very low | 162 Ų | 162 | 150.3 Ų | 150.3 | 75% | 0.75 | 80% | 0.799 | S | S | * | * | -167.4 | 108.4 | 89.7 | -156.8 | 57 | 0 | 0 | 0 | 112.5 | |||||
| 230 | V | 33.5 | Very low | 33.7 | Very low | 86 Ų | 86 | 154.9 Ų | 154.9 | 52% | 0.521 | 81% | 0.806 | S | S | . | * | trans | 25.4 | 124.6 | 132.6 | -157 | 0 | 0 | 0 | 0 | 116.3 | E228 | E228-V230 HydrophobicContact CG-CG2 3.98Å; E228-V230 WeakPolarHBondContact OE1-CG2 3.4Å | ||
| 231 | T | 29.7 | Very low | 34.3 | Very low | 126 Ų | 126 | 154.9 Ų | 154.9 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | -162.6 | 119.1 | 72.7 | 45.1 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 232 | H | 28.5 | Very low | 34.2 | Very low | 198 Ų | 198 | 152.9 Ų | 152.9 | 92% | 0.917 | 81% | 0.805 | S | S | * | * | trans | 33.2 | 126.2 | 130.1 | -133.2 | -73.4 | 0 | 0 | 0 | 121 | ||||
| 233 | G | 28.8 | Very low | 34.5 | Very low | 68 Ų | 68 | 152.1 Ų | 152.1 | 70% | 0.701 | 80% | 0.799 | S | S | * | * | trans | 154 | 100.2 | 153.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 234 | E | 34 | Very low | 34.7 | Very low | 179 Ų | 179 | 148.9 Ų | 148.9 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -58.5 | 170.9 | 163.7 | -85.6 | 174.1 | 104 | 0 | 0 | 112.7 | ||||
| 235 | D | 26.1 | Very low | 35 | Very low | 155 Ų | 155 | 149.3 Ų | 149.3 | 83% | 0.829 | 78% | 0.783 | S | S | * | * | trans | 98.9 | 91.7 | 162.6 | -55.8 | -33.9 | 0 | 0 | 0 | 117.7 | ||||
| 236 | T | 31.9 | Very low | 35.9 | Very low | 133 Ų | 133 | 151.8 Ų | 151.8 | 82% | 0.816 | 79% | 0.785 | S | S | * | * | trans | -73.8 | 159.2 | 135.5 | 30.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 237 | P | 43.6 | Very low | 35.9 | Very low | 110 Ų | 110 | 152.8 Ų | 152.8 | 71% | 0.714 | 78% | 0.783 | S | S | * | * | cis | -130.1 | 166.2 | -8 | 38.6 | -22.8 | 0 | 0 | 0 | 112.4 | ||||
| 238 | E | 30.6 | Very low | 36.4 | Very low | 200 Ų | 200 | 149.3 Ų | 149.3 | 94% | 0.935 | 79% | 0.785 | S | S | * | * | trans | -179.4 | 147.1 | 144.6 | -101.9 | 166.6 | -161.6 | 0 | 0 | 112.3 | ||||
| 239 | E | 44.4 | Very low | 37.1 | Very low | 198 Ų | 198 | 145.9 Ų | 145.9 | 93% | 0.925 | 79% | 0.789 | S | S | * | * | trans | -80.7 | 131.7 | -171.6 | -50.6 | -177.5 | 155.9 | 0 | 0 | 111.5 | ||||
| 240 | E | 36.7 | Very low | 37.3 | Very low | 182 Ų | 182 | 145.3 Ų | 145.3 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | trans | -144.7 | 123.5 | 161.7 | -160.2 | 177.8 | 154.4 | 0 | 0 | 111.8 | V242 | E240-V242 PolarHBondContact O-N 3.42Š| ||
| 241 | E | 45.9 | Very low | 38 | Very low | 193 Ų | 193 | 145.7 Ų | 145.7 | 90% | 0.902 | 81% | 0.809 | S | S | * | * | trans | -67 | 105.2 | -177.7 | -58.3 | 177.3 | 163.7 | 0 | 0 | 111.9 | K243 | E241-K243 PolarHBondContact O-N 3.39Š| ||
| 242 | V | 32.2 | Very low | 38.6 | Very low | 124 Ų | 124 | 149 Ų | 149 | 75% | 0.752 | 82% | 0.815 | S | S | * | * | trans | -92.1 | 100.6 | 172.5 | 178.2 | 0 | 0 | 0 | 0 | 111 | E240 V244 | E240-V242 PolarHBondContact O-N 3.42Å; V242-V244 HydrophobicContact CG1-CG2 4.45Å; V242-V244 PolarHBondContact O-N 3.23Å; V242-V244 VanDerWaalsContact O-N 3.17Å | ||
| 243 | K | 37.3 | Very low | 39.3 | Very low | 171 Ų | 171 | 143.5 Ų | 143.5 | 74% | 0.743 | 80% | 0.804 | S | S | * | * | trans | -58.6 | 104.5 | 162.7 | 178.3 | -176.9 | 176.4 | -116.5 | 0 | 109.9 | E241 E245 | E241-K243 PolarHBondContact O-N 3.39Å; K243-E245 IonicContact NZ-OE2 3.13Å; K243-E245 PolarHBondContact NZ-OE2 3.06Å; K243-E245 VanDerWaalsContact NZ-OE2 3.13Å; K243-E245 PolarHBondContact O-N 2.9Å | ||
| 244 | V | 35.7 | Very low | 40.2 | Very low | 104 Ų | 104 | 142.8 Ų | 142.8 | 63% | 0.63 | 79% | 0.789 | S | S | * | * | trans | -82.3 | 101.5 | 172.7 | -174.4 | 0 | 0 | 0 | 0 | 109.5 | V242 | V242-V244 HydrophobicContact CG1-CG2 4.45Å; V242-V244 PolarHBondContact O-N 3.23Å; V242-V244 VanDerWaalsContact O-N 3.17Å | ||
| 245 | E | 42.1 | Very low | 41.2 | Very low | 148 Ų | 148 | 141 Ų | 141 | 69% | 0.692 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 119.3 | 167.6 | -173.8 | 163.8 | 159.5 | 0 | 0 | 109 | K243 | K243-E245 IonicContact NZ-OE2 3.13Å; K243-E245 PolarHBondContact NZ-OE2 3.06Å; K243-E245 VanDerWaalsContact NZ-OE2 3.13Å; K243-E245 PolarHBondContact O-N 2.9Å |
| 246 | W | 50.1 | Low | 42.6 | Very low | 224 Ų | 224 | 141.4 Ų | 141.4 | 85% | 0.848 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 129.3 | -178.5 | -69.2 | 98.9 | 0 | 0 | 0 | 111.3 | A248 | W246-A248 PolarHBondContact O-N 3.44Š|
| 247 | P | 39.6 | Very low | 43.5 | Very low | 121 Ų | 121 | 140.4 Ų | 140.4 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 127 | 177.1 | -20.4 | 32.1 | 0 | 0 | 0 | 112.2 | ||
| 248 | A | 46 | Very low | 43.8 | Very low | 108 Ų | 108 | 140.6 Ų | 140.6 | 89% | 0.893 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 130.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | W246 | W246-A248 PolarHBondContact O-N 3.44Š|
| 249 | G | 50.5 | Low | 44.6 | Very low | 73 Ų | 73 | 133.9 Ų | 133.9 | 75% | 0.753 | 74% | 0.742 | S | S | * | * | trans | 142.4 | 54.3 | 162.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 250 | V | 37.2 | Very low | 44.8 | Very low | 150 Ų | 150 | 132.3 Ų | 132.3 | 91% | 0.909 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -134.2 | 132.7 | 156 | -179.6 | 0 | 0 | 0 | 0 | 108.1 | Q252 | V250-Q252 PolarHBondContact O-N 3.34Š|
| 251 | A | 46.8 | Very low | 45.1 | Very low | 94 Ų | 94 | 130.3 Ų | 130.3 | 78% | 0.777 | 73% | 0.727 | S | S | * | * | trans | -48.2 | 130.4 | -162.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | A253 | A251-A253 PolarHBondContact O-N 2.83Š| ||
| 252 | Q | 42.6 | Very low | 45.2 | Very low | 196 Ų | 196 | 125.5 Ų | 125.5 | 92% | 0.916 | 71% | 0.714 | S | S | * | * | trans | -58.2 | 111.5 | 165.8 | -78.7 | -159.3 | -19.5 | 0 | 0 | 109.7 | V250 S254 | V250-Q252 PolarHBondContact O-N 3.34Å; Q252-S254 PolarHBondContact O-N 3.38Å | ||
| 253 | A | 43.3 | Very low | 46.1 | Very low | 83 Ų | 83 | 126.8 Ų | 126.8 | 69% | 0.686 | 72% | 0.715 | S | S | * | * | trans | -64.7 | 120.1 | 161.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | A251 | A251-A253 PolarHBondContact O-N 2.83Š| ||
| 254 | S | 48.4 | Very low | 46.5 | Very low | 53 Ų | 53 | 122.5 Ų | 122.5 | 37% | 0.371 | 71% | 0.712 | S | S | . | * | trans | -71.1 | 134 | 176.3 | -168.9 | 0 | 0 | 0 | 0 | 109.5 | Q252 K256 D257 | Q252-S254 PolarHBondContact O-N 3.38Å; S254-K256 PolarHBondContact O-N 2.9Å; S254-K256 WeakPolarHBondContact OG-CG 3.4Å; S254-D257 PolarHBondContact O-N 2.92Å; S254-D257 VanDerWaalsContact O-N 3.12Å | ||
| 255 | D | 54.4 | Low | 46.9 | Very low | 141 Ų | 141 | 126 Ų | 126 | 75% | 0.754 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.4 | -10 | 178 | -64.9 | -44.4 | 0 | 0 | 0 | 114.8 | ||
| 256 | K | 55.2 | Low | 47.5 | Very low | 164 Ų | 164 | 122.5 Ų | 122.5 | 71% | 0.713 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -23.9 | -178 | -50.5 | 175.7 | -170.2 | 176.3 | 0 | 112.9 | S254 | S254-K256 PolarHBondContact O-N 2.9Å; S254-K256 WeakPolarHBondContact OG-CG 3.4Å |
| 257 | D | 50.6 | Low | 47.5 | Very low | 111 Ų | 111 | 117 Ų | 117 | 59% | 0.594 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | -17.4 | -179.8 | -76.4 | -33.2 | 0 | 0 | 0 | 113.6 | S254 A259 | S254-D257 PolarHBondContact O-N 2.92Å; S254-D257 VanDerWaalsContact O-N 3.12Å; D257-A259 VanDerWaalsContact C-N 3.35Å |
| 258 | L | 49.6 | Very low | 47.6 | Very low | 114 Ų | 114 | 116.7 Ų | 116.7 | 60% | 0.597 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | -20 | 177.4 | -63.4 | -179.9 | 0 | 0 | 0 | 113.5 | ||
| 259 | A | 48.9 | Very low | 47.2 | Very low | 60 Ų | 60 | 117 Ų | 117 | 50% | 0.496 | 72% | 0.716 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.7 | -15.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | D257 S262 | D257-A259 VanDerWaalsContact C-N 3.35Å; A259-S262 PolarHBondContact O-OG 3.4Å |
| 260 | K | 47.9 | Very low | 46.9 | Very low | 164 Ų | 164 | 118.7 Ų | 118.7 | 71% | 0.713 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.4 | -15.2 | -178.6 | -74.7 | -176.7 | 176.8 | -179.8 | 0 | 114.1 | ||
| 261 | L | 43.6 | Very low | 47.8 | Very low | 141 Ų | 141 | 119.7 Ų | 119.7 | 74% | 0.738 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -89.5 | -10.9 | 171.7 | -67.9 | 173 | 0 | 0 | 0 | 113.4 | ||
| 262 | S | 47.4 | Very low | 48.5 | Very low | 92 Ų | 92 | 118.4 Ų | 118.4 | 64% | 0.643 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -86 | -12.5 | -178.3 | 70.3 | 0 | 0 | 0 | 0 | 114.9 | A259 | A259-S262 PolarHBondContact O-OG 3.4Š|
| 263 | I | 50.1 | Low | 49.1 | Very low | 151 Ų | 151 | 116.9 Ų | 116.9 | 77% | 0.774 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -110.4 | -12.9 | -177.9 | -59.8 | 176.5 | 0 | 0 | 0 | 112.2 | ||
| 264 | A | 46.2 | Very low | 49.7 | Very low | 81 Ų | 81 | 119.4 Ų | 119.4 | 67% | 0.669 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -112.7 | 46.3 | -174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 265 | E | 43.6 | Very low | 50.7 | Low | 178 Ų | 178 | 121.6 Ų | 121.6 | 83% | 0.832 | 73% | 0.73 | S | S | * | * | trans | -149.5 | 55 | 162.9 | -157.2 | 149.3 | -173.1 | 0 | 0 | 111.3 | ||||
| 266 | G | 55.4 | Low | 51.4 | Low | 73 Ų | 73 | 123.1 Ų | 123.1 | 75% | 0.753 | 74% | 0.736 | S | S | * | * | trans | -103.2 | 73.2 | 166 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 267 | S | 49.8 | Very low | 51.8 | Low | 110 Ų | 110 | 122.5 Ų | 122.5 | 77% | 0.769 | 74% | 0.74 | S | S | * | * | S | Bend | trans | 169.2 | 85.7 | 149.5 | 57 | 0 | 0 | 0 | 0 | 112.1 | ||
| 268 | S | 41.4 | Very low | 52.4 | Low | 113 Ų | 113 | 126.4 Ų | 126.4 | 79% | 0.79 | 75% | 0.752 | S | S | * | * | trans | 168.7 | 107 | 131.4 | 56.2 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 269 | S | 38.6 | Very low | 53.4 | Low | 114 Ų | 114 | 131.9 Ų | 131.9 | 80% | 0.797 | 77% | 0.765 | S | S | * | * | trans | -81.1 | 128.3 | 175.5 | -59.1 | 0 | 0 | 0 | 0 | 109.4 | D271 | S269-D271 PolarHBondContact O-N 2.9Š| ||
| 270 | P | 44.7 | Very low | 53.5 | Low | 110 Ų | 110 | 140.2 Ų | 140.2 | 71% | 0.714 | 78% | 0.783 | S | S | * | * | trans | -68.8 | 112.8 | 147.4 | 28 | -27.4 | 0 | 0 | 0 | 107.2 | G272 | P270-G272 PolarHBondContact O-N 3.34Š| ||
| 271 | D | 56.3 | Low | 53.5 | Low | 170 Ų | 170 | 143.5 Ų | 143.5 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | 118.3 | 179 | -152.1 | 6 | 0 | 0 | 0 | 109.7 | S269 | S269-D271 PolarHBondContact O-N 2.9Š|
| 272 | G | 60.8 | Low | 53.2 | Low | 68 Ų | 68 | 141.6 Ų | 141.6 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 132.6 | -5.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | P270 | P270-G272 PolarHBondContact O-N 3.34Š|
| 273 | L | 55.5 | Low | 52.9 | Low | 164 Ų | 164 | 142.5 Ų | 142.5 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -103.9 | 113.4 | 176.1 | -66.1 | 175.9 | 0 | 0 | 0 | 111.8 | ||||
| 274 | V | 56.3 | Low | 52.6 | Low | 135 Ų | 135 | 143.2 Ų | 143.2 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -86.5 | 122.7 | 173.8 | -176.1 | 0 | 0 | 0 | 0 | 108.9 | I276 | V274-I276 PolarHBondContact O-N 2.87Š| ||
| 275 | S | 68.6 | Low | 52.2 | Low | 100 Ų | 100 | 146.2 Ų | 146.2 | 70% | 0.699 | 81% | 0.811 | S | S | * | * | trans | -62 | 120.9 | -179.5 | 65.5 | 0 | 0 | 0 | 0 | 111.8 | L277 | S275-L277 PolarHBondContact O-N 3.46Š| ||
| 276 | I | 69.8 | Low | 52.4 | Low | 172 Ų | 172 | 141.1 Ų | 141.1 | 88% | 0.882 | 81% | 0.806 | S | S | * | * | trans | -76 | -15.4 | 175.5 | -56 | 169.8 | 0 | 0 | 0 | 111.1 | V274 K278 | V274-I276 PolarHBondContact O-N 2.87Å; I276-K278 PolarHBondContact O-N 2.89Å; I276-K278 VanDerWaalsContact O-N 3.14Å | ||
| 277 | L | 62.4 | Low | 51.6 | Low | 152 Ų | 152 | 144.9 Ų | 144.9 | 80% | 0.796 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -73.2 | 106.3 | 178.4 | -162.1 | 74.1 | 0 | 0 | 0 | 110.9 | S275 R279 | S275-L277 PolarHBondContact O-N 3.46Å; L277-R279 PolarHBondContact O-N 2.88Å |
| 278 | K | 63.6 | Low | 51.2 | Low | 192 Ų | 192 | 145 Ų | 145 | 84% | 0.835 | 81% | 0.807 | S | S | * | * | trans | -67.4 | 101.8 | 176.9 | -171.5 | 161 | 178.7 | 163.4 | 0 | 110.3 | I276 R280 | I276-K278 PolarHBondContact O-N 2.89Å; I276-K278 VanDerWaalsContact O-N 3.14Å; K278-R280 PolarHBondContact O-N 3.44Å; K278-R280 VanDerWaalsContact O-N 3.09Å | ||
| 279 | R | 71.1 | Confident | 51.2 | Low | 230 Ų | 230 | 145.4 Ų | 145.4 | 87% | 0.868 | 81% | 0.807 | S | S | * | * | trans | -55.8 | 110.6 | 173.3 | -173.7 | -173.9 | -66.9 | 179.4 | -0.8 | 109.8 | L277 R281 | L277-R279 PolarHBondContact O-N 2.88Å; R279-R281 PolarHBondContact O-N 2.91Å | ||
| 280 | R | 50.4 | Low | 51.2 | Low | 235 Ų | 235 | 146 Ų | 146 | 89% | 0.887 | 81% | 0.807 | S | S | * | * | trans | -72.8 | 119.1 | 168.9 | -65.5 | -172.9 | -175.9 | -173.9 | 2.2 | 107.5 | K278 A282 | K278-R280 PolarHBondContact O-N 3.44Å; K278-R280 VanDerWaalsContact O-N 3.09Å; R280-A282 PolarHBondContact O-N 3.47Å | ||
| 281 | R | 47.1 | Very low | 51.1 | Low | 233 Ų | 233 | 146.4 Ų | 146.4 | 88% | 0.879 | 81% | 0.813 | S | S | * | * | trans | -69.3 | 113.9 | 164.2 | -64.4 | -160.6 | -166.6 | -150.2 | 7.4 | 106.3 | R279 S283 | R279-R281 PolarHBondContact O-N 2.91Å; R281-S283 VanDerWaalsContact C-N 3.35Å; R281-S283 PolarHBondContact O-N 3.13Å | ||
| 282 | A | 39 | Very low | 50.3 | Low | 100 Ų | 100 | 143.1 Ų | 143.1 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | trans | -63.2 | 102.6 | 159.4 | 0 | 0 | 0 | 0 | 0 | 106.5 | R280 L284 | R280-A282 PolarHBondContact O-N 3.47Å; A282-L284 PolarHBondContact O-N 3.41Å | ||
| 283 | S | 40.4 | Very low | 49.2 | Very low | 112 Ų | 112 | 144 Ų | 144 | 78% | 0.783 | 81% | 0.811 | S | S | * | * | trans | -73.4 | 87.1 | 168.1 | 55.6 | 0 | 0 | 0 | 0 | 107.3 | R281 | R281-S283 VanDerWaalsContact C-N 3.35Å; R281-S283 PolarHBondContact O-N 3.13Å | ||
| 284 | L | 42.8 | Very low | 48.3 | Very low | 165 Ų | 165 | 142.4 Ų | 142.4 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | trans | -69.2 | 136.7 | 145.3 | -170.7 | 73.7 | 0 | 0 | 0 | 106.3 | A282 | A282-L284 PolarHBondContact O-N 3.41Š| ||
| 285 | D | 38.1 | Very low | 47.2 | Very low | 144 Ų | 144 | 141.4 Ų | 141.4 | 77% | 0.77 | 80% | 0.802 | S | S | * | * | trans | 92.6 | 102.5 | 168 | -134.4 | 12.6 | 0 | 0 | 0 | 116.4 | ||||
| 286 | G | 47.3 | Very low | 46.2 | Very low | 71 Ų | 71 | 143.2 Ų | 143.2 | 73% | 0.732 | 81% | 0.809 | S | S | * | * | trans | -87.8 | 108.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 287 | L | 39.3 | Very low | 44.5 | Very low | 152 Ų | 152 | 141.5 Ų | 141.5 | 80% | 0.796 | 80% | 0.802 | S | S | * | * | trans | -149.8 | 148.9 | 155.1 | -75.8 | -177.4 | 0 | 0 | 0 | 109.1 | ||||
| 288 | P | 41.7 | Very low | 43.7 | Very low | 113 Ų | 113 | 142.8 Ų | 142.8 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 142.4 | -176.6 | 31.9 | -32.6 | 0 | 0 | 0 | 110.5 | ||
| 289 | P | 41.2 | Very low | 42.8 | Very low | 122 Ų | 122 | 141.9 Ų | 141.9 | 79% | 0.792 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 137.9 | 179.1 | 28.8 | -31.7 | 0 | 0 | 0 | 111.6 | ||
| 290 | P | 39.1 | Very low | 41.7 | Very low | 125 Ų | 125 | 139.3 Ų | 139.3 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -75 | 144 | 171.2 | 31.9 | -31.8 | 0 | 0 | 0 | 110.5 | ||
| 291 | S | 41.7 | Very low | 41.5 | Very low | 120 Ų | 120 | 132.5 Ų | 132.5 | 84% | 0.839 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 147.8 | -177.2 | -22.6 | 0 | 0 | 0 | 0 | 113.2 | ||
| 292 | A | 39.8 | Very low | 41.7 | Very low | 100 Ų | 100 | 131.1 Ų | 131.1 | 83% | 0.826 | 79% | 0.788 | S | S | * | * | trans | 75.3 | 107.8 | 160.8 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 293 | A | 37.3 | Very low | 43.1 | Very low | 88 Ų | 88 | 137.2 Ų | 137.2 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | 161.2 | 131.2 | 90.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 294 | T | 37.5 | Very low | 44.6 | Very low | 129 Ų | 129 | 140 Ų | 140 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | trans | 61.4 | 95.8 | 150.5 | -32 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 295 | T | 32.4 | Very low | 46 | Very low | 115 Ų | 115 | 137.5 Ų | 137.5 | 71% | 0.706 | 78% | 0.779 | S | S | * | * | -163.2 | 133.7 | 116.5 | 43.6 | 0 | 0 | 0 | 0 | 109.4 | D297 | T295-D297 PolarHBondContact O-N 3.23Å; T295-D297 VanDerWaalsContact O-N 3.11Å | |||
| 296 | T | 47.7 | Very low | 47.7 | Very low | 138 Ų | 138 | 140.5 Ų | 140.5 | 85% | 0.847 | 78% | 0.78 | S | S | * | * | trans | -33.8 | 108.2 | 163.4 | 47.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 297 | D | 34.4 | Very low | 48.5 | Very low | 135 Ų | 135 | 146.3 Ų | 146.3 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | trans | -144.2 | 103.6 | 167.7 | -99.5 | -45.5 | 0 | 0 | 0 | 112.1 | T295 | T295-D297 PolarHBondContact O-N 3.23Å; T295-D297 VanDerWaalsContact O-N 3.11Å | ||
| 298 | K | 45.8 | Very low | 49.5 | Very low | 179 Ų | 179 | 144.8 Ų | 144.8 | 78% | 0.778 | 79% | 0.787 | S | S | * | * | trans | 63.1 | 83.1 | 136.5 | -129 | 163.6 | -175.2 | 170.2 | 0 | 113.7 | M300 | K298-M300 VanDerWaalsContact C-N 3.29Å; K298-M300 PolarHBondContact O-N 3.15Å | ||
| 299 | Q | 45 | Very low | 50.4 | Low | 174 Ų | 174 | 147.1 Ų | 147.1 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | trans | -41.6 | 103 | 149.2 | -170.6 | -149.7 | -16.3 | 0 | 0 | 107.8 | S301 | Q299-S301 PolarHBondContact O-N 3.25Š| ||
| 300 | M | 47 | Very low | 51.4 | Low | 176 Ų | 176 | 146.1 Ų | 146.1 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | trans | -71 | 86.8 | 171.1 | 24.4 | -152.7 | 172.7 | 0 | 0 | 105.5 | K298 K302 | K298-M300 VanDerWaalsContact C-N 3.29Å; K298-M300 PolarHBondContact O-N 3.15Å; M300-K302 VanDerWaalsContact C-N 3.27Å; M300-K302 PolarHBondContact O-N 3.5Å | ||
| 301 | S | 47.2 | Very low | 51.9 | Low | 91 Ų | 91 | 147.1 Ų | 147.1 | 64% | 0.636 | 78% | 0.776 | S | S | * | * | trans | -53.2 | 98.2 | 167.8 | -179.9 | 0 | 0 | 0 | 0 | 106.6 | Q299 R303 | Q299-S301 PolarHBondContact O-N 3.25Å; S301-R303 PolarHBondContact O-N 2.89Å | ||
| 302 | K | 51.8 | Low | 52.5 | Low | 205 Ų | 205 | 149 Ų | 149 | 89% | 0.891 | 78% | 0.776 | S | S | * | * | trans | -59.5 | 92.4 | 167.9 | -107.8 | 174.5 | 173.1 | 176 | 0 | 105.3 | M300 K304 | M300-K302 VanDerWaalsContact C-N 3.27Å; M300-K302 PolarHBondContact O-N 3.5Å; K302-K304 PolarHBondContact O-N 3.21Å | ||
| 303 | R | 68.3 | Low | 53.5 | Low | 227 Ų | 227 | 145.7 Ų | 145.7 | 86% | 0.857 | 75% | 0.753 | S | S | * | * | trans | -68.6 | 93 | 170.7 | -162.5 | -178 | -77 | -178.2 | -4.9 | 105.6 | S301 V305 | S301-R303 PolarHBondContact O-N 2.89Å; R303-V305 PolarHBondContact O-N 3.16Å; R303-V305 VanDerWaalsContact O-N 3.09Å | ||
| 304 | K | 72.2 | Confident | 54.2 | Low | 171 Ų | 171 | 145.7 Ų | 145.7 | 74% | 0.743 | 74% | 0.743 | S | S | * | * | trans | -64.5 | 109 | 173.5 | -179.9 | 162.8 | 169.1 | 170.7 | 0 | 105.9 | K302 R306 | K302-K304 PolarHBondContact O-N 3.21Å; K304-R306 VanDerWaalsContact C-N 3.34Å; K304-R306 PolarHBondContact O-N 2.83Å | ||
| 305 | V | 71.1 | Confident | 55.1 | Low | 112 Ų | 112 | 145.4 Ų | 145.4 | 68% | 0.679 | 74% | 0.737 | S | S | * | * | trans | -61.2 | 103.5 | 170.6 | 176.8 | 0 | 0 | 0 | 0 | 105.5 | R303 | R303-V305 PolarHBondContact O-N 3.16Å; R303-V305 VanDerWaalsContact O-N 3.09Å | ||
| 306 | R | 74.4 | Confident | 56.1 | Low | 208 Ų | 208 | 147 Ų | 147 | 79% | 0.785 | 74% | 0.736 | S | S | * | * | trans | -86.8 | 120.6 | 162.1 | -62.4 | -172 | -177.5 | -148.6 | 2.3 | 103.9 | K304 S308 | K304-R306 VanDerWaalsContact C-N 3.34Å; K304-R306 PolarHBondContact O-N 2.83Å; R306-S308 PolarHBondContact O-N 3.4Å | ||
| 307 | F | 63.4 | Low | 56.4 | Low | 192 Ų | 192 | 147.5 Ų | 147.5 | 84% | 0.842 | 73% | 0.734 | S | S | * | * | trans | -60.7 | 126.8 | 161.6 | -71.5 | -85.6 | 0 | 0 | 0 | 105.6 | E309 | F307-E309 PolarHBondContact O-N 3.49Š| ||
| 308 | S | 60.8 | Low | 57.4 | Low | 121 Ų | 121 | 147 Ų | 147 | 85% | 0.846 | 73% | 0.731 | S | S | * | * | trans | -65.2 | 100.4 | 158.7 | -57.6 | 0 | 0 | 0 | 0 | 104.4 | R306 | R306-S308 PolarHBondContact O-N 3.4Š| ||
| 309 | E | 60.8 | Low | 57.7 | Low | 161 Ų | 161 | 143.1 Ų | 143.1 | 75% | 0.752 | 72% | 0.722 | S | S | * | * | trans | -56 | 125.4 | 162.5 | -159.1 | 155.3 | 97.9 | 0 | 0 | 105.2 | F307 E311 | F307-E309 PolarHBondContact O-N 3.49Å; E309-E311 PolarHBondContact O-N 3.23Å | ||
| 310 | P | 60.9 | Low | 58.4 | Low | 102 Ų | 102 | 136.7 Ų | 136.7 | 66% | 0.662 | 70% | 0.703 | S | S | * | * | trans | -53.5 | 129.1 | 168.4 | 25.2 | -31 | 0 | 0 | 0 | 105.5 | D312 | P310-D312 VanDerWaalsContact C-N 3.29Å; P310-D312 PolarHBondContact O-N 3.49Å | ||
| 311 | E | 49.4 | Very low | 59.3 | Low | 145 Ų | 145 | 129.9 Ų | 129.9 | 68% | 0.678 | 68% | 0.678 | S | S | * | * | trans | -60.4 | 95 | -175.7 | -158.3 | -92 | 166.7 | 0 | 0 | 107.5 | E309 G313 V314 | E309-E311 PolarHBondContact O-N 3.23Å; E311-G313 PolarHBondContact O-N 3.15Å; E311-G313 WeakPolarHBondContact OE2-CA 3.19Å; E311-V314 PolarHBondContact OE2-N 3.39Å | ||
| 312 | D | 55.8 | Low | 60.5 | Low | 159 Ų | 159 | 130.6 Ų | 130.6 | 85% | 0.85 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | 61.9 | 167.2 | -86.7 | -30.1 | 0 | 0 | 0 | 107.6 | P310 | P310-D312 VanDerWaalsContact C-N 3.29Å; P310-D312 PolarHBondContact O-N 3.49Å |
| 313 | G | 60 | Low | 62 | Low | 32 Ų | 32 | 123.8 Ų | 123.8 | 33% | 0.33 | 65% | 0.652 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -153.6 | 22.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | E311 D315 | E311-G313 PolarHBondContact O-N 3.15Å; E311-G313 WeakPolarHBondContact OE2-CA 3.19Å; G313-D315 VanDerWaalsContact C-N 3.25Å; G313-D315 PolarHBondContact O-N 3.07Å |
| 314 | V | 52.7 | Low | 62.7 | Low | 88 Ų | 88 | 116.2 Ų | 116.2 | 53% | 0.533 | 63% | 0.633 | S | S | . | * | trans | -73.4 | 95.2 | 161 | 74.8 | 0 | 0 | 0 | 0 | 106.4 | E311 Q316 | E311-V314 PolarHBondContact OE2-N 3.39Å; V314-Q316 HydrophobicContact CG1-CB 4.12Å; V314-Q316 HydrophobicContact CG1-CG 4.35Å; V314-Q316 HydrophobicContact CG2-CB 4.25Å; V314-Q316 HydrophobicContact CG2-CG 4.31Å; V314-Q316 PolarHBondContact O-N 3.14Å | ||
| 315 | D | 56.5 | Low | 63.3 | Low | 122 Ų | 122 | 113.2 Ų | 113.2 | 65% | 0.652 | 63% | 0.625 | S | S | * | * | trans | -53 | 80.6 | 145.5 | -69.8 | -62 | 0 | 0 | 0 | 106.4 | G313 D317 D318 | G313-D315 VanDerWaalsContact C-N 3.25Å; G313-D315 PolarHBondContact O-N 3.07Å; D315-D317 PolarHBondContact O-N 3.35Å; D315-D318 PolarHBondContact O-N 2.98Å | ||
| 316 | Q | 51.9 | Low | 64.1 | Low | 150 Ų | 150 | 112.9 Ų | 112.9 | 70% | 0.701 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -70.6 | 2 | 180 | -146.4 | 173.1 | 59.9 | 0 | 0 | 111.4 | V314 | V314-Q316 HydrophobicContact CG1-CB 4.12Å; V314-Q316 HydrophobicContact CG1-CG 4.35Å; V314-Q316 HydrophobicContact CG2-CB 4.25Å; V314-Q316 HydrophobicContact CG2-CG 4.31Å; V314-Q316 PolarHBondContact O-N 3.14Å |
| 317 | D | 54.4 | Low | 64.6 | Low | 147 Ų | 147 | 108.6 Ų | 108.6 | 79% | 0.786 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -79.7 | -27.1 | 174.2 | -127.1 | 34.5 | 0 | 0 | 0 | 111.9 | D315 G321 | D315-D317 PolarHBondContact O-N 3.35Å; D317-G321 PolarHBondContact O-N 3.28Å |
| 318 | D | 55.3 | Low | 65.8 | Low | 124 Ų | 124 | 104.5 Ų | 104.5 | 66% | 0.663 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -84.9 | -25.6 | -178.9 | -80.7 | -45.7 | 0 | 0 | 0 | 113.7 | D315 | D315-D318 PolarHBondContact O-N 2.98Å |
| 319 | V | 53.7 | Low | 67.1 | Low | 99 Ų | 99 | 104 Ų | 104 | 60% | 0.6 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -83.2 | -27.4 | 177.1 | 179.3 | 0 | 0 | 0 | 0 | 111.9 | S323 | V319-S323 PolarHBondContact O-OG 2.97Å |
| 320 | G | 58 | Low | 68.5 | Low | 39 Ų | 39 | 101.3 Ų | 101.3 | 40% | 0.402 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -79.8 | -32.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | S323 C324 | G320-S323 PolarHBondContact O-N 3.13Å; G320-C324 WeakPolarHBondContact O-CB 3.06Å; G320-C324 PolarHBondContact O-N 3.15Å |
| 321 | G | 65.9 | Low | 69.9 | Low | 33 Ų | 33 | 99.8 Ų | 99.8 | 34% | 0.34 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.7 | -52.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | D317 S323 C324 L325 | D317-G321 PolarHBondContact O-N 3.28Å; G321-S323 VanDerWaalsContact C-N 3.29Å; G321-S323 PolarHBondContact O-N 2.79Å; G321-C324 PolarHBondContact O-N 2.93Å; G321-L325 VanDerWaalsContact O-CG 3.32Å; G321-L325 WeakPolarHBondContact O-CG 3.46Å; G321-L325 PolarHBondContact O-N 3.14Å |
| 322 | D | 72.6 | Confident | 71.8 | Confident | 106 Ų | 106 | 97.2 Ų | 97.2 | 57% | 0.567 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64 | -36.6 | 177.8 | -77 | -6.4 | 0 | 0 | 0 | 111.5 | C324 L325 I326 | D322-C324 PolarHBondContact O-N 3.33Å; D322-L325 PolarHBondContact O-N 2.81Å; D322-I326 VanDerWaalsContact O-CB 3.32Å; D322-I326 WeakPolarHBondContact O-CB 3.34Å; D322-I326 VanDerWaalsContact O-CD1 3.24Å; D322-I326 WeakPolarHBondContact O-CD1 3.23Å; D322-I326 WeakPolarHBondContact O-CG1 3.43Å; D322-I326 PolarHBondContact O-N 2.85Å |
| 323 | S | 84.1 | Confident | 73.5 | Confident | 61 Ų | 61 | 92.8 Ų | 92.8 | 43% | 0.427 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 175.3 | -60.6 | 0 | 0 | 0 | 0 | 112 | V319 G320 G321 L327 | V319-S323 PolarHBondContact O-OG 2.97Å; G320-S323 PolarHBondContact O-N 3.13Å; G321-S323 VanDerWaalsContact C-N 3.29Å; G321-S323 PolarHBondContact O-N 2.79Å; S323-L327 VanDerWaalsContact O-CG 3.29Å; S323-L327 WeakPolarHBondContact O-CG 3.32Å; S323-L327 PolarHBondContact O-N 2.77Å |
| 324 | C | 82.1 | Confident | 75.1 | Confident | 68 Ų | 68 | 94.8 Ų | 94.8 | 46% | 0.459 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -68.1 | -43.8 | 175.2 | -174.8 | 0 | 0 | 0 | 0 | 112 | G320 G321 D322 I326 L327 L328 | G320-C324 WeakPolarHBondContact O-CB 3.06Å; G320-C324 PolarHBondContact O-N 3.15Å; G321-C324 PolarHBondContact O-N 2.93Å; D322-C324 PolarHBondContact O-N 3.33Å; C324-I326 VanDerWaalsContact C-N 3.3Å; C324-I326 PolarHBondContact O-N 3.04Å; C324-L327 PolarHBondContact O-N 3.36Å; C324-L328 WeakPolarHBondContact O-CG 3.3Å; C324-L328 PolarHBondContact O-N 2.99Å |
| 325 | L | 85.3 | Confident | 76.9 | Confident | 109 Ų | 109 | 94 Ų | 94 | 57% | 0.571 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.2 | -38 | 176.3 | -68.2 | 176.1 | 0 | 0 | 0 | 112 | G321 D322 L328 L329 | G321-L325 VanDerWaalsContact O-CG 3.32Å; G321-L325 WeakPolarHBondContact O-CG 3.46Å; G321-L325 PolarHBondContact O-N 3.14Å; D322-L325 PolarHBondContact O-N 2.81Å; L325-L328 PolarHBondContact O-N 2.04Å; L325-L329 WeakPolarHBondContact O-CB 3.48Å; L325-L329 PolarHBondContact O-N 3.41Å |
| 326 | I | 86.9 | Confident | 78.4 | Confident | 104 Ų | 104 | 92.5 Ų | 92.5 | 53% | 0.533 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.4 | -43.8 | 174.4 | -70.1 | 160.3 | 0 | 0 | 0 | 110.4 | D322 C324 L329 L330 | D322-I326 VanDerWaalsContact O-CB 3.32Å; D322-I326 WeakPolarHBondContact O-CB 3.34Å; D322-I326 VanDerWaalsContact O-CD1 3.24Å; D322-I326 WeakPolarHBondContact O-CD1 3.23Å; D322-I326 WeakPolarHBondContact O-CG1 3.43Å; D322-I326 PolarHBondContact O-N 2.85Å; C324-I326 VanDerWaalsContact C-N 3.3Å; C324-I326 PolarHBondContact O-N 3.04Å; I326-L329 PolarHBondContact O-N 3.43Å; I326-L330 VanDerWaalsContact O-CB 3.24Å; I326-L330 WeakPolarHBondContact O-CB 3.07Å; I326-L330 PolarHBondContact O-N 3.27Å |
| 327 | L | 86.7 | Confident | 80.2 | Confident | 119 Ų | 119 | 90.7 Ų | 90.7 | 62% | 0.623 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.6 | -41.9 | 176.4 | -70.1 | 173.9 | 0 | 0 | 0 | 111.9 | S323 C324 L330 C331 | S323-L327 VanDerWaalsContact O-CG 3.29Å; S323-L327 WeakPolarHBondContact O-CG 3.32Å; S323-L327 PolarHBondContact O-N 2.77Å; C324-L327 PolarHBondContact O-N 3.36Å; L327-L330 PolarHBondContact O-N 3.12Å; L327-C331 VanDerWaalsContact O-CB 3.22Å; L327-C331 WeakPolarHBondContact O-CB 3.4Å; L327-C331 PolarHBondContact O-N 2.79Å |
| 328 | L | 87.1 | Confident | 81.8 | Confident | 105 Ų | 105 | 87.5 Ų | 87.5 | 55% | 0.55 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.1 | -42 | 175.3 | -72.3 | 174.1 | 0 | 0 | 0 | 112.1 | C324 L325 C331 L332 | C324-L328 WeakPolarHBondContact O-CG 3.3Å; C324-L328 PolarHBondContact O-N 2.99Å; L325-L328 PolarHBondContact O-N 2.04Å; L328-C331 WeakPolarHBondContact O-CB 3.16Å; L328-C331 PolarHBondContact O-N 3.11Å; L328-L332 WeakPolarHBondContact O-CB 3.23Å; L328-L332 PolarHBondContact O-N 2.89Å |
| 329 | L | 87.9 | Confident | 83.4 | Confident | 112 Ų | 112 | 84.2 Ų | 84.2 | 59% | 0.586 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.2 | -44.6 | 175.9 | -177.7 | 66.5 | 0 | 0 | 0 | 110.9 | L325 I326 C331 L332 V333 | L325-L329 WeakPolarHBondContact O-CB 3.48Å; L325-L329 PolarHBondContact O-N 3.41Å; I326-L329 PolarHBondContact O-N 3.43Å; L329-C331 VanDerWaalsContact C-N 3.33Å; L329-L332 PolarHBondContact O-N 3.24Å; L329-V333 VanDerWaalsContact O-CG2 3.3Å; L329-V333 WeakPolarHBondContact O-CG2 3.41Å; L329-V333 PolarHBondContact O-N 3.25Å |
| 330 | L | 90.6 | Very high | 85 | Confident | 104 Ų | 104 | 81.2 Ų | 81.2 | 55% | 0.545 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 176.6 | -175 | 62.3 | 0 | 0 | 0 | 111.1 | I326 L327 V333 T334 | I326-L330 VanDerWaalsContact O-CB 3.24Å; I326-L330 WeakPolarHBondContact O-CB 3.07Å; I326-L330 PolarHBondContact O-N 3.27Å; L327-L330 PolarHBondContact O-N 3.12Å; L330-V333 PolarHBondContact O-N 3.46Å; L330-T334 WeakPolarHBondContact O-CG2 3.34Å; L330-T334 PolarHBondContact O-N 2.96Å; L330-T334 PolarHBondContact O-OG1 3.34Å |
| 331 | C | 91.4 | Very high | 86.4 | Confident | 69 Ų | 69 | 81 Ų | 81 | 47% | 0.466 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.6 | -43.7 | 174.4 | -175.6 | 0 | 0 | 0 | 0 | 112 | L327 L328 L329 V333 T334 V335 | L327-C331 VanDerWaalsContact O-CB 3.22Å; L327-C331 WeakPolarHBondContact O-CB 3.4Å; L327-C331 PolarHBondContact O-N 2.79Å; L328-C331 WeakPolarHBondContact O-CB 3.16Å; L328-C331 PolarHBondContact O-N 3.11Å; L329-C331 VanDerWaalsContact C-N 3.33Å; C331-V333 VanDerWaalsContact C-N 3.32Å; C331-V333 PolarHBondContact O-N 3.43Å; C331-T334 WeakPolarHBondContact CA-OG1 3.32Å; C331-T334 PolarHBondContact O-N 3.31Å; C331-T334 PolarHBondContact O-OG1 3.12Å; C331-V335 WeakPolarHBondContact O-CB 3.37Å; C331-V335 VanDerWaalsContact O-CG2 3.28Å; C331-V335 WeakPolarHBondContact O-CG2 3.38Å; C331-V335 PolarHBondContact O-N 3.42Å |
| 332 | L | 88.7 | Confident | 87.4 | Confident | 92 Ų | 92 | 81.8 Ų | 81.8 | 48% | 0.482 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 176.2 | -173.7 | 130.2 | 0 | 0 | 0 | 111.2 | L328 L329 V335 V336 | L328-L332 WeakPolarHBondContact O-CB 3.23Å; L328-L332 PolarHBondContact O-N 2.89Å; L329-L332 PolarHBondContact O-N 3.24Å; L332-V335 PolarHBondContact O-N 3.45Å; L332-V336 HydrophobicContact CD2-CG2 4.49Å; L332-V336 WeakPolarHBondContact O-CB 3.37Å; L332-V336 VanDerWaalsContact O-CG2 3.25Å; L332-V336 WeakPolarHBondContact O-CG2 3.25Å; L332-V336 PolarHBondContact O-N 2.94Å |
| 333 | V | 91 | Very high | 88.1 | Confident | 65 Ų | 65 | 78.3 Ų | 78.3 | 39% | 0.394 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63 | -44.2 | 175.3 | 170 | 0 | 0 | 0 | 0 | 111.3 | L329 L330 C331 V336 I337 | L329-V333 VanDerWaalsContact O-CG2 3.3Å; L329-V333 WeakPolarHBondContact O-CG2 3.41Å; L329-V333 PolarHBondContact O-N 3.25Å; L330-V333 PolarHBondContact O-N 3.46Å; C331-V333 VanDerWaalsContact C-N 3.32Å; C331-V333 PolarHBondContact O-N 3.43Å; V333-V336 PolarHBondContact O-N 3.28Å; V333-I337 HydrophobicContact CG1-CD1 3.63Å; V333-I337 HydrophobicContact CG1-CG1 4.36Å; V333-I337 WeakPolarHBondContact O-CB 3.46Å; V333-I337 VanDerWaalsContact O-CG1 3.23Å; V333-I337 WeakPolarHBondContact O-CG1 3.2Å; V333-I337 PolarHBondContact O-N 3.36Å |
| 334 | T | 93.7 | Very high | 88.1 | Confident | 75 Ų | 75 | 81.4 Ų | 81.4 | 46% | 0.46 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.8 | -38.3 | 179 | 54.3 | 0 | 0 | 0 | 0 | 112.3 | L330 C331 I337 S338 | L330-T334 WeakPolarHBondContact O-CG2 3.34Å; L330-T334 PolarHBondContact O-N 2.96Å; L330-T334 PolarHBondContact O-OG1 3.34Å; C331-T334 WeakPolarHBondContact CA-OG1 3.32Å; C331-T334 PolarHBondContact O-N 3.31Å; C331-T334 PolarHBondContact O-OG1 3.12Å; T334-I337 PolarHBondContact O-N 3.43Å; T334-S338 WeakPolarHBondContact O-CB 3.15Å; T334-S338 PolarHBondContact O-N 2.83Å |
| 335 | V | 90.8 | Very high | 88.4 | Confident | 70 Ų | 70 | 83.5 Ų | 83.5 | 42% | 0.424 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63 | -45.6 | 174 | 170.6 | 0 | 0 | 0 | 0 | 111 | C331 L332 I337 S338 I339 | C331-V335 WeakPolarHBondContact O-CB 3.37Å; C331-V335 VanDerWaalsContact O-CG2 3.28Å; C331-V335 WeakPolarHBondContact O-CG2 3.38Å; C331-V335 PolarHBondContact O-N 3.42Å; L332-V335 PolarHBondContact O-N 3.45Å; V335-I337 VanDerWaalsContact C-N 3.33Å; V335-I337 PolarHBondContact O-N 3.43Å; V335-S338 PolarHBondContact O-N 3.3Å; V335-I339 HydrophobicContact CG1-CD1 3.62Å; V335-I339 HydrophobicContact CG1-CG1 4.41Å; V335-I339 WeakPolarHBondContact O-CG1 3.12Å; V335-I339 PolarHBondContact O-N 2.86Å |
| 336 | V | 88.2 | Confident | 88.5 | Confident | 91 Ų | 91 | 79 Ų | 79 | 55% | 0.552 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -64 | -39.1 | 177.1 | 170.9 | 0 | 0 | 0 | 0 | 111.3 | L332 V333 G340 | L332-V336 HydrophobicContact CD2-CG2 4.49Å; L332-V336 WeakPolarHBondContact O-CB 3.37Å; L332-V336 VanDerWaalsContact O-CG2 3.25Å; L332-V336 WeakPolarHBondContact O-CG2 3.25Å; L332-V336 PolarHBondContact O-N 2.94Å; V333-V336 PolarHBondContact O-N 3.28Å; V336-G340 WeakPolarHBondContact O-CA 3.47Å; V336-G340 PolarHBondContact O-N 2.97Å |
| 337 | I | 89.8 | Confident | 88.2 | Confident | 113 Ų | 113 | 79 Ų | 79 | 58% | 0.579 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -68.7 | -35.9 | 175.6 | -68.5 | 168.5 | 0 | 0 | 0 | 111.1 | V333 T334 V335 G341 | V333-I337 HydrophobicContact CG1-CD1 3.63Å; V333-I337 HydrophobicContact CG1-CG1 4.36Å; V333-I337 WeakPolarHBondContact O-CB 3.46Å; V333-I337 VanDerWaalsContact O-CG1 3.23Å; V333-I337 WeakPolarHBondContact O-CG1 3.2Å; V333-I337 PolarHBondContact O-N 3.36Å; T334-I337 PolarHBondContact O-N 3.43Å; V335-I337 VanDerWaalsContact C-N 3.33Å; V335-I337 PolarHBondContact O-N 3.43Å; I337-G341 WeakPolarHBondContact O-CA 2.96Å; I337-G341 PolarHBondContact O-N 2.94Å |
| 338 | S | 89.1 | Confident | 87.9 | Confident | 79 Ų | 79 | 78.8 Ų | 78.8 | 55% | 0.552 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -67.3 | -55.4 | 177.7 | -178.5 | 0 | 0 | 0 | 0 | 111.4 | T334 V335 T342 | T334-S338 WeakPolarHBondContact O-CB 3.15Å; T334-S338 PolarHBondContact O-N 2.83Å; V335-S338 PolarHBondContact O-N 3.3Å; S338-T342 WeakPolarHBondContact O-CG2 3.48Å; S338-T342 PolarHBondContact O-N 2.83Å; S338-T342 VanDerWaalsContact O-N 3.15Å; S338-T342 PolarHBondContact O-OG1 3.36Å |
| 339 | I | 87.9 | Confident | 87.4 | Confident | 56 Ų | 56 | 77.8 Ų | 77.8 | 29% | 0.287 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -71.7 | -42.4 | -178.1 | -60.7 | 171.4 | 0 | 0 | 0 | 111.2 | V335 T342 A343 F359 Y366 | V335-I339 HydrophobicContact CG1-CD1 3.62Å; V335-I339 HydrophobicContact CG1-CG1 4.41Å; V335-I339 WeakPolarHBondContact O-CG1 3.12Å; V335-I339 PolarHBondContact O-N 2.86Å; I339-T342 PolarHBondContact O-OG1 3.36Å; I339-A343 WeakPolarHBondContact O-CB 3.49Å; I339-A343 PolarHBondContact O-N 3.29Å; I339-A343 VanDerWaalsContact O-N 3.15Å; I339-F359 HydrophobicContact CG2-CE2 4.03Å; I339-F359 HydrophobicContact CG2-CZ 4.18Å; I339-Y366 HydrophobicContact CD1-CD1 4.16Å |
| 340 | G | 86.9 | Confident | 86.4 | Confident | 36 Ų | 36 | 78 Ų | 78 | 37% | 0.371 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -72.3 | -32.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | V336 A343 F344 | V336-G340 WeakPolarHBondContact O-CA 3.47Å; V336-G340 PolarHBondContact O-N 2.97Å; G340-A343 PolarHBondContact O-N 3.46Å; G340-F344 WeakPolarHBondContact O-CB 3.33Å; G340-F344 PolarHBondContact O-N 2.9Å |
| 341 | G | 88.7 | Confident | 85.1 | Confident | 34 Ų | 34 | 77.1 Ų | 77.1 | 35% | 0.351 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -68.3 | -40.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | I337 F344 Y345 | I337-G341 WeakPolarHBondContact O-CA 2.96Å; I337-G341 PolarHBondContact O-N 2.94Å; G341-F344 PolarHBondContact O-N 2.88Å; G341-Y345 WeakPolarHBondContact O-CB 3.29Å; G341-Y345 PolarHBondContact O-N 2.92Å |
| 342 | T | 86.7 | Confident | 83.9 | Confident | 49 Ų | 49 | 83.6 Ų | 83.6 | 30% | 0.301 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.4 | -44.4 | 172.6 | 52.5 | 0 | 0 | 0 | 0 | 111.6 | S338 I339 F344 Y345 C346 F359 | S338-T342 WeakPolarHBondContact O-CG2 3.48Å; S338-T342 PolarHBondContact O-N 2.83Å; S338-T342 VanDerWaalsContact O-N 3.15Å; S338-T342 PolarHBondContact O-OG1 3.36Å; I339-T342 PolarHBondContact O-OG1 3.36Å; T342-F344 VanDerWaalsContact C-N 3.32Å; T342-F344 PolarHBondContact O-N 2.86Å; T342-Y345 PolarHBondContact O-N 3.21Å; T342-C346 WeakPolarHBondContact O-CB 3.48Å; T342-C346 PolarHBondContact O-N 3.25Å; T342-C346 PolarHBondContact O-SG 3.41Å; T342-F359 WeakPolarHBondContact OG1-CE2 2.99Å |
| 343 | A | 86.1 | Confident | 83.4 | Confident | 33 Ų | 33 | 81.3 Ų | 81.3 | 27% | 0.273 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -56.3 | -47.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | I339 G340 C346 T347 F359 | I339-A343 WeakPolarHBondContact O-CB 3.49Å; I339-A343 PolarHBondContact O-N 3.29Å; I339-A343 VanDerWaalsContact O-N 3.15Å; G340-A343 PolarHBondContact O-N 3.46Å; A343-C346 PolarHBondContact O-N 3.15Å; A343-T347 WeakPolarHBondContact O-CG2 3.16Å; A343-T347 PolarHBondContact O-N 3.39Å; A343-T347 VanDerWaalsContact O-N 3.14Å; A343-F359 HydrophobicContact CB-CE1 3.52Å; A343-F359 HydrophobicContact CB-CZ 3.69Å |
| 344 | F | 85.4 | Confident | 82.9 | Confident | 127 Ų | 127 | 84.7 Ų | 84.7 | 56% | 0.557 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -66.7 | -42 | -180 | -174.7 | -109.8 | 0 | 0 | 0 | 112.3 | G340 G341 T342 C346 T347 L348 | G340-F344 WeakPolarHBondContact O-CB 3.33Å; G340-F344 PolarHBondContact O-N 2.9Å; G341-F344 PolarHBondContact O-N 2.88Å; T342-F344 VanDerWaalsContact C-N 3.32Å; T342-F344 PolarHBondContact O-N 2.86Å; F344-C346 VanDerWaalsContact C-N 3.26Å; F344-C346 PolarHBondContact O-N 2.83Å; F344-T347 PolarHBondContact O-N 3.44Å; F344-T347 PolarHBondContact O-OG1 3.47Å; F344-L348 HydrophobicContact CD1-CD1 3.84Å; F344-L348 HydrophobicContact CD1-CG 4.5Å; F344-L348 HydrophobicContact CE1-CD1 3.21Å; F344-L348 HydrophobicContact CE1-CG 4.16Å; F344-L348 HydrophobicContact CE2-CD1 4.12Å; F344-L348 HydrophobicContact CE2-CG 4.31Å; F344-L348 HydrophobicContact CZ-CD1 3.39Å; F344-L348 HydrophobicContact CZ-CD2 4.48Å; F344-L348 HydrophobicContact CZ-CG 4.06Å; F344-L348 PolarHBondContact O-N 3.18Å; F344-L348 VanDerWaalsContact O-N 3.15Å |
| 345 | Y | 86.8 | Confident | 82.4 | Confident | 112 Ų | 112 | 85.9 Ų | 85.9 | 44% | 0.439 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -55.5 | -43.9 | 173.2 | 177.4 | -99.3 | 0 | 0 | 0 | 111.1 | G341 T342 T347 L348 V349 | G341-Y345 WeakPolarHBondContact O-CB 3.29Å; G341-Y345 PolarHBondContact O-N 2.92Å; T342-Y345 PolarHBondContact O-N 3.21Å; Y345-T347 VanDerWaalsContact C-N 3.3Å; Y345-T347 PolarHBondContact O-N 3.36Å; Y345-L348 PolarHBondContact O-N 2.84Å; Y345-V349 HydrophobicContact CD2-CB 4.31Å; Y345-V349 HydrophobicContact CD2-CG2 3.92Å; Y345-V349 HydrophobicContact CE2-CB 3.96Å; Y345-V349 HydrophobicContact CE2-CG1 4.01Å; Y345-V349 HydrophobicContact CE2-CG2 3.77Å; Y345-V349 PolarHBondContact O-N 3.46Å |
| 346 | C | 87.8 | Confident | 82.2 | Confident | 13 Ų | 13 | 82.9 Ų | 82.9 | 9% | 0.088 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -68.9 | -24.2 | 177.8 | -64.3 | 0 | 0 | 0 | 0 | 114.3 | T342 A343 F344 C356 | T342-C346 WeakPolarHBondContact O-CB 3.48Å; T342-C346 PolarHBondContact O-N 3.25Å; T342-C346 PolarHBondContact O-SG 3.41Å; A343-C346 PolarHBondContact O-N 3.15Å; F344-C346 VanDerWaalsContact C-N 3.26Å; F344-C346 PolarHBondContact O-N 2.83Å; C346-C356 WeakPolarHBondContact CA-SG 3.36Å; C346-C356 HydrophobicContact CB-CB 3.7Å; C346-C356 WeakPolarHBondContact CB-SG 3.3Å; C346-C356 WeakPolarHBondContact SG-CA 3.23Å; C346-C356 WeakPolarHBondContact SG-CB 3.45Å; C346-C356 CovalentContact SG-SG 2.04Å; C346-C356 PolarHBondContact SG-SG 3.07Å |
| 347 | T | 81.4 | Confident | 81.9 | Confident | 105 Ų | 105 | 81.9 Ų | 81.9 | 64% | 0.644 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -79.4 | -25.3 | 172.6 | 62 | 0 | 0 | 0 | 0 | 113.9 | A343 F344 Y345 | A343-T347 WeakPolarHBondContact O-CG2 3.16Å; A343-T347 PolarHBondContact O-N 3.39Å; A343-T347 VanDerWaalsContact O-N 3.14Å; F344-T347 PolarHBondContact O-N 3.44Å; F344-T347 PolarHBondContact O-OG1 3.47Å; Y345-T347 VanDerWaalsContact C-N 3.3Å; Y345-T347 PolarHBondContact O-N 3.36Å |
| 348 | L | 80.6 | Confident | 81.7 | Confident | 114 Ų | 114 | 81 Ų | 81 | 60% | 0.597 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -100.2 | -35.7 | -173.9 | -71.7 | -175 | 0 | 0 | 0 | 114.4 | F344 Y345 | F344-L348 HydrophobicContact CD1-CD1 3.84Å; F344-L348 HydrophobicContact CD1-CG 4.5Å; F344-L348 HydrophobicContact CE1-CD1 3.21Å; F344-L348 HydrophobicContact CE1-CG 4.16Å; F344-L348 HydrophobicContact CE2-CD1 4.12Å; F344-L348 HydrophobicContact CE2-CG 4.31Å; F344-L348 HydrophobicContact CZ-CD1 3.39Å; F344-L348 HydrophobicContact CZ-CD2 4.48Å; F344-L348 HydrophobicContact CZ-CG 4.06Å; F344-L348 PolarHBondContact O-N 3.18Å; F344-L348 VanDerWaalsContact O-N 3.15Å; Y345-L348 PolarHBondContact O-N 2.84Å |
| 349 | V | 76.9 | Confident | 81.6 | Confident | 84 Ų | 84 | 78.7 Ų | 78.7 | 51% | 0.509 | 43% | 0.43 | S | S | . | . | S | Bend | trans | -106.1 | 13.9 | -167.3 | -176.4 | 0 | 0 | 0 | 0 | 112.3 | Y345 | Y345-V349 HydrophobicContact CD2-CB 4.31Å; Y345-V349 HydrophobicContact CD2-CG2 3.92Å; Y345-V349 HydrophobicContact CE2-CB 3.96Å; Y345-V349 HydrophobicContact CE2-CG1 4.01Å; Y345-V349 HydrophobicContact CE2-CG2 3.77Å; Y345-V349 PolarHBondContact O-N 3.46Å |
| 350 | D | 65.2 | Low | 81.3 | Confident | 116 Ų | 116 | 79.1 Ų | 79.1 | 62% | 0.62 | 44% | 0.442 | S | S | * | . | trans | 71.5 | 140.5 | -173.3 | -89.4 | -40.2 | 0 | 0 | 0 | 115.5 | Y352 | D350-Y352 HydrophobicContact CB-CD2 4.3Å; D350-Y352 PolarHBondContact O-N 2.85Å; D350-Y352 VanDerWaalsContact O-N 3.13Å | ||
| 351 | T | 63.8 | Low | 81 | Confident | 86 Ų | 86 | 84.8 Ų | 84.8 | 53% | 0.528 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.5 | 3.3 | -173.8 | 46.2 | 0 | 0 | 0 | 0 | 115 | S353 | T351-S353 VanDerWaalsContact C-N 3.29Å; T351-S353 PolarHBondContact O-N 3.38Å |
| 352 | Y | 65.6 | Low | 80.8 | Confident | 206 Ų | 206 | 86.2 Ų | 86.2 | 81% | 0.808 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | -2.5 | -174.5 | -75.7 | -81.8 | 0 | 0 | 0 | 114.8 | D350 | D350-Y352 HydrophobicContact CB-CD2 4.3Å; D350-Y352 PolarHBondContact O-N 2.85Å; D350-Y352 VanDerWaalsContact O-N 3.13Å |
| 353 | S | 78.9 | Confident | 80.7 | Confident | 44 Ų | 44 | 86.3 Ų | 86.3 | 31% | 0.308 | 46% | 0.459 | S | S | . | . | S | Bend | trans | -79 | 138.5 | 172.8 | -173.9 | 0 | 0 | 0 | 0 | 110.9 | T351 I355 C356 T357 | T351-S353 VanDerWaalsContact C-N 3.29Å; T351-S353 PolarHBondContact O-N 3.38Å; S353-I355 PolarHBondContact O-N 3.31Å; S353-C356 WeakPolarHBondContact O-CB 3.2Å; S353-C356 PolarHBondContact O-N 3.28Å; S353-T357 PolarHBondContact O-N 3.43Å |
| 354 | N | 80.8 | Confident | 80.6 | Confident | 135 Ų | 135 | 90.2 Ų | 90.2 | 72% | 0.722 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -52.4 | -29.1 | 172.9 | -82 | -3.6 | 0 | 0 | 0 | 112.6 | C356 T357 D358 | N354-C356 VanDerWaalsContact C-N 3.33Å; N354-T357 WeakPolarHBondContact CA-OG1 3.33Å; N354-T357 PolarHBondContact O-OG1 2.92Å; N354-D358 WeakPolarHBondContact O-CB 3.12Å; N354-D358 PolarHBondContact O-N 3.2Å; N354-D358 VanDerWaalsContact O-N 3.12Å |
| 355 | I | 83 | Confident | 80.6 | Confident | 101 Ų | 101 | 90.9 Ų | 90.9 | 52% | 0.518 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.6 | -38.7 | 175.3 | -83.5 | 73.4 | 0 | 0 | 0 | 111.5 | S353 F359 | S353-I355 PolarHBondContact O-N 3.31Å; I355-F359 WeakPolarHBondContact O-CB 3.28Å; I355-F359 PolarHBondContact O-N 2.99Å; I355-F359 VanDerWaalsContact O-N 3.11Å |
| 356 | C | 86.3 | Confident | 80.5 | Confident | 6 Ų | 6 | 90.5 Ų | 90.5 | 4% | 0.041 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -78.7 | -32.2 | -177.4 | -67.1 | 0 | 0 | 0 | 0 | 112.7 | C346 S353 N354 A360 | C346-C356 WeakPolarHBondContact CA-SG 3.36Å; C346-C356 HydrophobicContact CB-CB 3.7Å; C346-C356 WeakPolarHBondContact CB-SG 3.3Å; C346-C356 WeakPolarHBondContact SG-CA 3.23Å; C346-C356 WeakPolarHBondContact SG-CB 3.45Å; C346-C356 CovalentContact SG-SG 2.04Å; C346-C356 PolarHBondContact SG-SG 3.07Å; S353-C356 WeakPolarHBondContact O-CB 3.2Å; S353-C356 PolarHBondContact O-N 3.28Å; N354-C356 VanDerWaalsContact C-N 3.33Å; C356-A360 VanDerWaalsContact O-CB 3.32Å; C356-A360 WeakPolarHBondContact O-CB 3.5Å; C356-A360 PolarHBondContact O-N 2.81Å |
| 357 | T | 83.4 | Confident | 80.3 | Confident | 71 Ų | 71 | 93.1 Ų | 93.1 | 44% | 0.436 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.7 | -41.5 | 174.2 | 52.2 | 0 | 0 | 0 | 0 | 112 | S353 N354 A360 Q361 | S353-T357 PolarHBondContact O-N 3.43Å; N354-T357 WeakPolarHBondContact CA-OG1 3.33Å; N354-T357 PolarHBondContact O-OG1 2.92Å; T357-A360 PolarHBondContact O-N 2.71Å; T357-Q361 WeakPolarHBondContact O-CG 3.42Å; T357-Q361 PolarHBondContact O-N 3.39Å |
| 358 | D | 85.1 | Confident | 80.5 | Confident | 94 Ų | 94 | 92 Ų | 92 | 50% | 0.503 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.3 | -44.3 | 175.9 | -177.5 | 74.9 | 0 | 0 | 0 | 111.3 | N354 A360 Q361 N362 | N354-D358 WeakPolarHBondContact O-CB 3.12Å; N354-D358 PolarHBondContact O-N 3.2Å; N354-D358 VanDerWaalsContact O-N 3.12Å; D358-A360 PolarHBondContact O-N 3.07Å; D358-Q361 PolarHBondContact O-N 3.32Å; D358-N362 PolarHBondContact O-N 3.38Å; D358-N362 VanDerWaalsContact O-N 3.15Å; D358-N362 PolarHBondContact O-ND2 2.88Å; D358-N362 PolarHBondContact OD1-ND2 3.34Å; D358-N362 PolarHBondContact OD2-ND2 3.17Å |
| 359 | F | 85.6 | Confident | 80.7 | Confident | 30 Ų | 30 | 91.7 Ų | 91.7 | 13% | 0.132 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -60.6 | -43.2 | 175.4 | -177.9 | -100.2 | 0 | 0 | 0 | 112.5 | I339 T342 A343 I355 Q361 N362 V363 | I339-F359 HydrophobicContact CG2-CE2 4.03Å; I339-F359 HydrophobicContact CG2-CZ 4.18Å; T342-F359 WeakPolarHBondContact OG1-CE2 2.99Å; A343-F359 HydrophobicContact CB-CE1 3.52Å; A343-F359 HydrophobicContact CB-CZ 3.69Å; I355-F359 WeakPolarHBondContact O-CB 3.28Å; I355-F359 PolarHBondContact O-N 2.99Å; I355-F359 VanDerWaalsContact O-N 3.11Å; F359-Q361 VanDerWaalsContact C-N 3.27Å; F359-Q361 PolarHBondContact O-N 2.85Å; F359-N362 CarbonylContact O-C 3.5Å; F359-N362 PolarHBondContact O-N 3.34Å; F359-N362 VanDerWaalsContact O-N 3.12Å; F359-V363 HydrophobicContact CD1-CB 4.45Å; F359-V363 HydrophobicContact CE1-CB 4.04Å; F359-V363 HydrophobicContact CE1-CG2 3.72Å; F359-V363 HydrophobicContact CE2-CG2 4.48Å; F359-V363 HydrophobicContact CZ-CB 4.18Å; F359-V363 HydrophobicContact CZ-CG2 3.66Å; F359-V363 WeakPolarHBondContact O-CB 3.48Å; F359-V363 PolarHBondContact O-N 2.97Å |
| 360 | A | 81.4 | Confident | 80.9 | Confident | 66 Ų | 66 | 90 Ų | 90 | 55% | 0.545 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.6 | -30.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | C356 T357 D358 | C356-A360 VanDerWaalsContact O-CB 3.32Å; C356-A360 WeakPolarHBondContact O-CB 3.5Å; C356-A360 PolarHBondContact O-N 2.81Å; T357-A360 PolarHBondContact O-N 2.71Å; D358-A360 PolarHBondContact O-N 3.07Å |
| 361 | Q | 82.2 | Confident | 81.7 | Confident | 155 Ų | 155 | 92 Ų | 92 | 72% | 0.724 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -73.4 | -32.9 | 174.1 | -71.1 | -176.6 | -12.1 | 0 | 0 | 112.1 | T357 D358 F359 | T357-Q361 WeakPolarHBondContact O-CG 3.42Å; T357-Q361 PolarHBondContact O-N 3.39Å; D358-Q361 PolarHBondContact O-N 3.32Å; F359-Q361 VanDerWaalsContact C-N 3.27Å; F359-Q361 PolarHBondContact O-N 2.85Å |
| 362 | N | 83.7 | Confident | 82.7 | Confident | 63 Ų | 63 | 89.7 Ų | 89.7 | 34% | 0.337 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -99.8 | -10.8 | -172.9 | -64.8 | -32.5 | 0 | 0 | 0 | 113.9 | D358 F359 D364 F365 Y366 | D358-N362 PolarHBondContact O-N 3.38Å; D358-N362 VanDerWaalsContact O-N 3.15Å; D358-N362 PolarHBondContact O-ND2 2.88Å; D358-N362 PolarHBondContact OD1-ND2 3.34Å; D358-N362 PolarHBondContact OD2-ND2 3.17Å; F359-N362 CarbonylContact O-C 3.5Å; F359-N362 PolarHBondContact O-N 3.34Å; F359-N362 VanDerWaalsContact O-N 3.12Å; N362-D364 PolarHBondContact O-N 2.76Å; N362-F365 WeakPolarHBondContact O-CB 3.5Å; N362-F365 PolarHBondContact O-N 3.48Å; N362-F365 VanDerWaalsContact O-N 3.13Å; N362-Y366 HydrophobicContact CB-CE2 3.97Å; N362-Y366 WeakPolarHBondContact O-CD2 3.43Å; N362-Y366 PolarHBondContact O-N 2.87Å |
| 363 | V | 84.2 | Confident | 83.5 | Confident | 52 Ų | 52 | 85.4 Ų | 85.4 | 32% | 0.315 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.5 | -33.3 | -176.4 | 73.4 | 0 | 0 | 0 | 0 | 112.8 | F359 F365 Y366 V367 | F359-V363 HydrophobicContact CD1-CB 4.45Å; F359-V363 HydrophobicContact CE1-CB 4.04Å; F359-V363 HydrophobicContact CE1-CG2 3.72Å; F359-V363 HydrophobicContact CE2-CG2 4.48Å; F359-V363 HydrophobicContact CZ-CB 4.18Å; F359-V363 HydrophobicContact CZ-CG2 3.66Å; F359-V363 WeakPolarHBondContact O-CB 3.48Å; F359-V363 PolarHBondContact O-N 2.97Å; V363-F365 VanDerWaalsContact C-N 3.28Å; V363-F365 PolarHBondContact O-N 3.14Å; V363-Y366 PolarHBondContact O-N 3.23Å; V363-V367 HydrophobicContact CG2-CG2 4.11Å; V363-V367 WeakPolarHBondContact O-CB 3.32Å; V363-V367 VanDerWaalsContact O-CG2 3.3Å; V363-V367 WeakPolarHBondContact O-CG2 3.37Å; V363-V367 PolarHBondContact O-N 3.17Å |
| 364 | D | 84.8 | Confident | 83.5 | Confident | 115 Ų | 115 | 88.7 Ų | 88.7 | 62% | 0.615 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -64.2 | -35.8 | 179.9 | -166.2 | 42.5 | 0 | 0 | 0 | 111.6 | N362 T368 | N362-D364 PolarHBondContact O-N 2.76Å; D364-T368 WeakPolarHBondContact O-CB 3.5Å; D364-T368 PolarHBondContact O-N 3.32Å; D364-T368 PolarHBondContact O-OG1 3.41Å |
| 365 | F | 85.1 | Confident | 83.6 | Confident | 140 Ų | 140 | 88.2 Ų | 88.2 | 61% | 0.614 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.4 | -47.4 | 173.6 | 177.8 | -98.7 | 0 | 0 | 0 | 111.6 | N362 V363 V367 T368 N369 | N362-F365 WeakPolarHBondContact O-CB 3.5Å; N362-F365 PolarHBondContact O-N 3.48Å; N362-F365 VanDerWaalsContact O-N 3.13Å; V363-F365 VanDerWaalsContact C-N 3.28Å; V363-F365 PolarHBondContact O-N 3.14Å; F365-V367 PolarHBondContact O-N 2.95Å; F365-T368 PolarHBondContact O-N 2.99Å; F365-N369 VanDerWaalsContact O-CB 3.23Å; F365-N369 WeakPolarHBondContact O-CB 3.47Å; F365-N369 PolarHBondContact O-N 3.11Å |
| 366 | Y | 85 | Confident | 83.5 | Confident | 105 Ų | 105 | 84.5 Ų | 84.5 | 41% | 0.412 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 178.6 | -64.8 | -69.8 | 0 | 0 | 0 | 112.3 | I339 N362 V363 A370 | I339-Y366 HydrophobicContact CD1-CD1 4.16Å; N362-Y366 HydrophobicContact CB-CE2 3.97Å; N362-Y366 WeakPolarHBondContact O-CD2 3.43Å; N362-Y366 PolarHBondContact O-N 2.87Å; V363-Y366 PolarHBondContact O-N 3.23Å; Y366-A370 WeakPolarHBondContact O-CB 3.05Å; Y366-A370 PolarHBondContact O-N 2.8Å |
| 367 | V | 83.1 | Confident | 83.1 | Confident | 67 Ų | 67 | 87.4 Ų | 87.4 | 41% | 0.406 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.8 | -42.4 | 179 | 172 | 0 | 0 | 0 | 0 | 111.1 | V363 F365 A370 R371 | V363-V367 HydrophobicContact CG2-CG2 4.11Å; V363-V367 WeakPolarHBondContact O-CB 3.32Å; V363-V367 VanDerWaalsContact O-CG2 3.3Å; V363-V367 WeakPolarHBondContact O-CG2 3.37Å; V363-V367 PolarHBondContact O-N 3.17Å; F365-V367 PolarHBondContact O-N 2.95Å; V367-A370 PolarHBondContact O-N 2.78Å; V367-R371 WeakPolarHBondContact O-CB 3.24Å; V367-R371 WeakPolarHBondContact O-CG 3.06Å; V367-R371 PolarHBondContact O-N 3.09Å |
| 368 | T | 85.3 | Confident | 82.6 | Confident | 83 Ų | 83 | 86.3 Ų | 86.3 | 51% | 0.509 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.9 | -43.5 | 177.7 | -60.8 | 0 | 0 | 0 | 0 | 111.1 | D364 F365 R371 G372 | D364-T368 WeakPolarHBondContact O-CB 3.5Å; D364-T368 PolarHBondContact O-N 3.32Å; D364-T368 PolarHBondContact O-OG1 3.41Å; F365-T368 PolarHBondContact O-N 2.99Å; T368-R371 PolarHBondContact O-N 3.34Å; T368-G372 PolarHBondContact O-N 3.02Å |
| 369 | N | 84.8 | Confident | 82.1 | Confident | 106 Ų | 106 | 89.4 Ų | 89.4 | 57% | 0.567 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -67.5 | -39.2 | 177.3 | -164.9 | 60.3 | 0 | 0 | 0 | 112 | F365 G372 F373 | F365-N369 VanDerWaalsContact O-CB 3.23Å; F365-N369 WeakPolarHBondContact O-CB 3.47Å; F365-N369 PolarHBondContact O-N 3.11Å; N369-G372 PolarHBondContact O-N 3.47Å; N369-F373 WeakPolarHBondContact O-CB 3.29Å; N369-F373 PolarHBondContact O-N 3.14Å |
| 370 | A | 82.3 | Confident | 81.3 | Confident | 48 Ų | 48 | 98.2 Ų | 98.2 | 40% | 0.397 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.7 | -40.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | Y366 V367 F373 L374 | Y366-A370 WeakPolarHBondContact O-CB 3.05Å; Y366-A370 PolarHBondContact O-N 2.8Å; V367-A370 PolarHBondContact O-N 2.78Å; A370-F373 PolarHBondContact O-N 2.81Å; A370-L374 WeakPolarHBondContact O-CB 3.32Å; A370-L374 VanDerWaalsContact O-CG 3.23Å; A370-L374 WeakPolarHBondContact O-CG 3.24Å; A370-L374 PolarHBondContact O-N 2.81Å |
| 371 | R | 82.1 | Confident | 80.1 | Confident | 158 Ų | 158 | 100.9 Ų | 100.9 | 60% | 0.596 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.4 | -47.4 | 173.3 | -81.2 | 178.4 | 178.4 | -106.7 | 2.9 | 111.6 | V367 T368 F373 L374 E375 | V367-R371 WeakPolarHBondContact O-CB 3.24Å; V367-R371 WeakPolarHBondContact O-CG 3.06Å; V367-R371 PolarHBondContact O-N 3.09Å; T368-R371 PolarHBondContact O-N 3.34Å; R371-F373 VanDerWaalsContact C-N 3.3Å; R371-F373 PolarHBondContact O-N 3.23Å; R371-L374 PolarHBondContact O-N 3.3Å; R371-E375 WeakPolarHBondContact O-CB 3.41Å; R371-E375 VanDerWaalsContact O-CG 3.32Å; R371-E375 WeakPolarHBondContact O-CG 3.4Å; R371-E375 PolarHBondContact O-N 3.05Å |
| 372 | G | 83.9 | Confident | 78.7 | Confident | 39 Ų | 39 | 99 Ų | 99 | 40% | 0.402 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.6 | -38.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | T368 N369 G376 | T368-G372 PolarHBondContact O-N 3.02Å; N369-G372 PolarHBondContact O-N 3.47Å; G372-G376 PolarHBondContact O-N 3.22Å |
| 373 | F | 82.1 | Confident | 76.9 | Confident | 115 Ų | 115 | 103.5 Ų | 103.5 | 50% | 0.504 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.9 | -42.1 | 174 | 180 | -107.6 | 0 | 0 | 0 | 112.6 | N369 A370 R371 G376 L377 | N369-F373 WeakPolarHBondContact O-CB 3.29Å; N369-F373 PolarHBondContact O-N 3.14Å; A370-F373 PolarHBondContact O-N 2.81Å; R371-F373 VanDerWaalsContact C-N 3.3Å; R371-F373 PolarHBondContact O-N 3.23Å; F373-G376 PolarHBondContact O-N 3.17Å; F373-L377 HydrophobicContact CD1-CD1 3.72Å; F373-L377 HydrophobicContact CD1-CG 4.41Å; F373-L377 HydrophobicContact CE1-CD1 3.2Å; F373-L377 HydrophobicContact CE1-CG 4.07Å; F373-L377 HydrophobicContact CE2-CD1 4.24Å; F373-L377 HydrophobicContact CE2-CG 4.26Å; F373-L377 HydrophobicContact CG-CD1 4.44Å; F373-L377 HydrophobicContact CZ-CD1 3.5Å; F373-L377 VanDerWaalsContact CZ-CD1 3.5Å; F373-L377 HydrophobicContact CZ-CD2 4.31Å; F373-L377 HydrophobicContact CZ-CG 3.98Å; F373-L377 WeakPolarHBondContact O-CB 3.22Å; F373-L377 WeakPolarHBondContact O-CG 3.49Å; F373-L377 PolarHBondContact O-N 3.25Å |
| 374 | L | 79.8 | Confident | 75 | Confident | 114 Ų | 114 | 110.3 Ų | 110.3 | 60% | 0.597 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -67.8 | -37.5 | 176.6 | -73 | 170.2 | 0 | 0 | 0 | 112.6 | A370 R371 L377 G378 | A370-L374 WeakPolarHBondContact O-CB 3.32Å; A370-L374 VanDerWaalsContact O-CG 3.23Å; A370-L374 WeakPolarHBondContact O-CG 3.24Å; A370-L374 PolarHBondContact O-N 2.81Å; R371-L374 PolarHBondContact O-N 3.3Å; L374-L377 PolarHBondContact O-N 3.4Å; L374-G378 PolarHBondContact O-N 3.09Å |
| 375 | E | 83.6 | Confident | 72.7 | Confident | 124 Ų | 124 | 114.1 Ų | 114.1 | 58% | 0.579 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.8 | -41.2 | 173.4 | -74.3 | 172.6 | -170 | 0 | 0 | 111.1 | R371 G378 Q379 | R371-E375 WeakPolarHBondContact O-CB 3.41Å; R371-E375 VanDerWaalsContact O-CG 3.32Å; R371-E375 WeakPolarHBondContact O-CG 3.4Å; R371-E375 PolarHBondContact O-N 3.05Å; E375-G378 PolarHBondContact O-N 3.01Å; E375-Q379 WeakPolarHBondContact O-CG 3.12Å; E375-Q379 PolarHBondContact O-N 3.23Å |
| 376 | G | 79.8 | Confident | 72.1 | Confident | 23 Ų | 23 | 112.9 Ų | 112.9 | 24% | 0.237 | 60% | 0.597 | C | S | . | * | H | α-helix | trans | -58.8 | -52.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | G372 F373 G378 Q379 W380 | G372-G376 PolarHBondContact O-N 3.22Å; F373-G376 PolarHBondContact O-N 3.17Å; G376-G378 VanDerWaalsContact C-N 3.29Å; G376-G378 PolarHBondContact O-N 3.4Å; G376-Q379 WeakPolarHBondContact O-CB 3.44Å; G376-Q379 PolarHBondContact O-N 3.31Å; G376-Q379 VanDerWaalsContact O-N 3.09Å; G376-W380 PolarHBondContact O-N 2.78Å |
| 377 | L | 76.9 | Confident | 71.4 | Confident | 68 Ų | 68 | 113.3 Ų | 113.3 | 36% | 0.356 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -61.2 | -35.4 | 176.8 | -76.4 | 175.6 | 0 | 0 | 0 | 113.1 | F373 L374 Q379 W380 L381 | F373-L377 HydrophobicContact CD1-CD1 3.72Å; F373-L377 HydrophobicContact CD1-CG 4.41Å; F373-L377 HydrophobicContact CE1-CD1 3.2Å; F373-L377 HydrophobicContact CE1-CG 4.07Å; F373-L377 HydrophobicContact CE2-CD1 4.24Å; F373-L377 HydrophobicContact CE2-CG 4.26Å; F373-L377 HydrophobicContact CG-CD1 4.44Å; F373-L377 HydrophobicContact CZ-CD1 3.5Å; F373-L377 VanDerWaalsContact CZ-CD1 3.5Å; F373-L377 HydrophobicContact CZ-CD2 4.31Å; F373-L377 HydrophobicContact CZ-CG 3.98Å; F373-L377 WeakPolarHBondContact O-CB 3.22Å; F373-L377 WeakPolarHBondContact O-CG 3.49Å; F373-L377 PolarHBondContact O-N 3.25Å; L374-L377 PolarHBondContact O-N 3.4Å; L377-Q379 PolarHBondContact O-N 3.12Å; L377-W380 PolarHBondContact O-N 3.31Å; L377-L381 PolarHBondContact O-N 3.06Å |
| 378 | G | 74.3 | Confident | 70.8 | Confident | 48 Ų | 48 | 115.8 Ų | 115.8 | 50% | 0.495 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -63.4 | -25.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | L374 E375 G376 | L374-G378 PolarHBondContact O-N 3.09Å; E375-G378 PolarHBondContact O-N 3.01Å; G376-G378 VanDerWaalsContact C-N 3.29Å; G376-G378 PolarHBondContact O-N 3.4Å |
| 379 | Q | 74.6 | Confident | 69.9 | Low | 158 Ų | 158 | 117.8 Ų | 117.8 | 74% | 0.738 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -78.4 | -26.8 | 173.3 | -64.8 | 161.5 | 9.3 | 0 | 0 | 112.4 | E375 G376 L377 | E375-Q379 WeakPolarHBondContact O-CG 3.12Å; E375-Q379 PolarHBondContact O-N 3.23Å; G376-Q379 WeakPolarHBondContact O-CB 3.44Å; G376-Q379 PolarHBondContact O-N 3.31Å; G376-Q379 VanDerWaalsContact O-N 3.09Å; L377-Q379 PolarHBondContact O-N 3.12Å |
| 380 | W | 68.4 | Low | 69 | Low | 215 Ų | 215 | 118.5 Ų | 118.5 | 81% | 0.814 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -88.1 | -20.8 | 178 | -69.9 | 98.6 | 0 | 0 | 0 | 113.8 | G376 L377 P382 | G376-W380 PolarHBondContact O-N 2.78Å; L377-W380 PolarHBondContact O-N 3.31Å; W380-P382 WeakPolarHBondContact O-CD 3.5Å |
| 381 | L | 56.2 | Low | 68.1 | Low | 122 Ų | 122 | 123.2 Ų | 123.2 | 64% | 0.639 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -89.2 | 99.5 | 173.2 | -76.2 | 162.8 | 0 | 0 | 0 | 109.1 | L377 L383 | L377-L381 PolarHBondContact O-N 3.06Å; L381-L383 PolarHBondContact O-N 3.5Å |
| 382 | P | 53.6 | Low | 67.1 | Low | 116 Ų | 116 | 120.7 Ų | 120.7 | 75% | 0.753 | 65% | 0.646 | S | S | * | * | trans | -64.6 | 106.3 | 171.4 | 27.9 | -32.6 | 0 | 0 | 0 | 107.3 | W380 Q384 | W380-P382 WeakPolarHBondContact O-CD 3.5Å; P382-Q384 PolarHBondContact O-N 3.36Å | ||
| 383 | L | 45.5 | Very low | 65.8 | Low | 158 Ų | 158 | 127 Ų | 127 | 83% | 0.827 | 67% | 0.665 | S | S | * | * | trans | -63.9 | 91.8 | 169 | -157.1 | 77.3 | 0 | 0 | 0 | 106.8 | L381 T385 | L381-L383 PolarHBondContact O-N 3.5Å; L383-T385 PolarHBondContact O-N 3.13Å | ||
| 384 | Q | 43.8 | Very low | 64.5 | Low | 195 Ų | 195 | 128 Ų | 128 | 91% | 0.911 | 68% | 0.679 | S | S | * | * | trans | -64.9 | 106.3 | 179.3 | -144.2 | 178.7 | 1.5 | 0 | 0 | 107.1 | P382 | P382-Q384 PolarHBondContact O-N 3.36Š| ||
| 385 | T | 37.3 | Very low | 63.1 | Low | 195 Ų | 195 | 129.3 Ų | 129.3 | 100% | 1.196 | 69% | 0.686 | S | S | * | * | trans | -94.8 | 0 | 177.2 | 35.4 | 0 | 0 | 0 | 0 | 111.1 | L383 | L383-T385 PolarHBondContact O-N 3.13Š|
Retrieved 385 of 385 residues in 49 ms
(Link to these results)