| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.3 | Very low | 42.7 | Very low | 248 Ų | 248 | 126.4 Ų | 126.4 | 100% | 1.222 | 86% | 0.855 | S | S | * | * | 0 | 105.6 | 0 | -65.7 | 169.6 | 177.3 | 0 | 0 | 105.5 | |||||
| 2 | T | 40.2 | Very low | 43.2 | Very low | 133 Ų | 133 | 125.9 Ų | 125.9 | 82% | 0.816 | 85% | 0.85 | S | S | * | * | trans | -83.6 | 129.5 | -167.4 | 43.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 3 | E | 40.4 | Very low | 42.8 | Very low | 154 Ų | 154 | 124.2 Ų | 124.2 | 72% | 0.72 | 85% | 0.85 | S | S | * | * | trans | 51.5 | 118.4 | 137.1 | -50.7 | -59.3 | 89 | 0 | 0 | 123.1 | ||||
| 4 | L | 46.9 | Very low | 42.5 | Very low | 150 Ų | 150 | 119.9 Ų | 119.9 | 79% | 0.785 | 84% | 0.837 | S | S | * | * | 58.2 | 120.4 | 120.2 | -50.9 | 171.8 | 0 | 0 | 0 | 121.1 | |||||
| 5 | A | 40.2 | Very low | 41.8 | Very low | 100 Ų | 100 | 123.3 Ų | 123.3 | 83% | 0.826 | 84% | 0.842 | S | S | * | * | 169.7 | 122.4 | 105.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 6 | S | 49.9 | Very low | 41.9 | Very low | 127 Ų | 127 | 119.3 Ų | 119.3 | 89% | 0.888 | 83% | 0.827 | S | S | * | * | trans | -88.6 | 140.6 | 161.2 | -63.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 7 | S | 52.5 | Low | 41.7 | Very low | 116 Ų | 116 | 123.2 Ų | 123.2 | 81% | 0.811 | 83% | 0.83 | S | S | * | * | trans | -165.8 | 120.2 | 155.9 | 34.3 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 8 | G | 42.4 | Very low | 41.3 | Very low | 83 Ų | 83 | 127.7 Ų | 127.7 | 86% | 0.856 | 84% | 0.837 | S | S | * | * | 72.7 | 122.2 | 69.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 9 | G | 35.7 | Very low | 41.2 | Very low | 81 Ų | 81 | 124.5 Ų | 124.5 | 84% | 0.835 | 83% | 0.829 | S | S | * | * | cis | 170 | -179.9 | 10 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 10 | G | 36.1 | Very low | 41.1 | Very low | 80 Ų | 80 | 127.7 Ų | 127.7 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | trans | 96.8 | 99.3 | 155.2 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 11 | S | 38.3 | Very low | 40.9 | Very low | 118 Ų | 118 | 125 Ų | 125 | 83% | 0.825 | 83% | 0.831 | S | S | * | * | -96 | 160.6 | 128.9 | -60.1 | 0 | 0 | 0 | 0 | 106.5 | |||||
| 12 | P | 49 | Very low | 40.9 | Very low | 121 Ų | 121 | 121.3 Ų | 121.3 | 79% | 0.786 | 82% | 0.817 | S | S | * | * | cis | -151 | -177.3 | 31.4 | 41.1 | -18.6 | 0 | 0 | 0 | 117.5 | ||||
| 13 | A | 37.2 | Very low | 41.1 | Very low | 103 Ų | 103 | 123.6 Ų | 123.6 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | trans | 67.2 | 144.4 | 140.2 | 0 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 14 | G | 38.8 | Very low | 41.8 | Very low | 65 Ų | 65 | 128.7 Ų | 128.7 | 67% | 0.67 | 83% | 0.831 | S | S | * | * | trans | 117.7 | 92.8 | 164.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 15 | D | 31.4 | Very low | 41.6 | Very low | 171 Ų | 171 | 124.9 Ų | 124.9 | 91% | 0.914 | 83% | 0.828 | S | S | * | * | 80.9 | 130.8 | 64.7 | -68.3 | -71.4 | 0 | 0 | 0 | 114.8 | |||||
| 16 | G | 43.9 | Very low | 42.3 | Very low | 59 Ų | 59 | 127.4 Ų | 127.4 | 61% | 0.608 | 83% | 0.826 | S | S | * | * | trans | 125 | 83 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 17 | E | 38.6 | Very low | 42.4 | Very low | 185 Ų | 185 | 126.6 Ų | 126.6 | 86% | 0.864 | 82% | 0.816 | S | S | * | * | 84.4 | 104.6 | 74.3 | 82.8 | -165.8 | 81.3 | 0 | 0 | 113.9 | |||||
| 18 | E | 34.8 | Very low | 42.3 | Very low | 205 Ų | 205 | 126.3 Ų | 126.3 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | trans | -132.5 | 109 | 146.6 | -65.2 | -153.2 | 129.9 | 0 | 0 | 106.5 | ||||
| 19 | G | 38.4 | Very low | 42.3 | Very low | 66 Ų | 66 | 130.5 Ų | 130.5 | 68% | 0.68 | 80% | 0.801 | S | S | * | * | trans | -85.9 | -170.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 20 | L | 40.8 | Very low | 42.6 | Very low | 188 Ų | 188 | 133.8 Ų | 133.8 | 98% | 0.984 | 80% | 0.795 | S | S | * | * | trans | 115.7 | 100.3 | 156.5 | -57.9 | 164.8 | 0 | 0 | 0 | 113.7 | ||||
| 21 | G | 36.5 | Very low | 43 | Very low | 71 Ų | 71 | 135.7 Ų | 135.7 | 73% | 0.732 | 79% | 0.792 | S | S | * | * | trans | 156 | 45.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 118 | E23 | G21-E23 PolarHBondContact O-N 3.2Š| ||
| 22 | D | 46.9 | Very low | 43.3 | Very low | 171 Ų | 171 | 134.9 Ų | 134.9 | 91% | 0.914 | 79% | 0.793 | S | S | * | * | trans | -76.5 | 90.4 | 163.7 | -78 | -75.8 | 0 | 0 | 0 | 110.7 | ||||
| 23 | E | 45 | Very low | 43.5 | Very low | 181 Ų | 181 | 137 Ų | 137 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -135 | 112.4 | 161.1 | -34.3 | -142.9 | 107.5 | 0 | 0 | 109.4 | G21 G25 | G21-E23 PolarHBondContact O-N 3.2Å; E23-G25 PolarHBondContact O-N 3.14Å | ||
| 24 | R | 54.6 | Low | 43.9 | Very low | 262 Ų | 262 | 140.9 Ų | 140.9 | 99% | 0.989 | 79% | 0.793 | S | S | * | * | trans | -65.1 | 82.6 | 176.4 | -63.3 | 164.7 | 85.3 | 156.1 | 4.3 | 108.7 | ||||
| 25 | G | 42.1 | Very low | 44.8 | Very low | 70 Ų | 70 | 142.3 Ų | 142.3 | 72% | 0.722 | 78% | 0.782 | S | S | * | * | trans | -81 | 112.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | E23 | E23-G25 PolarHBondContact O-N 3.14Š| ||
| 26 | L | 54.6 | Low | 46.4 | Very low | 152 Ų | 152 | 138.5 Ų | 138.5 | 80% | 0.796 | 77% | 0.767 | S | S | * | * | trans | -35.4 | 128 | 174.7 | -171 | 67.5 | 0 | 0 | 0 | 114.6 | I28 | L26-I28 PolarHBondContact O-N 3.13Å; L26-I28 VanDerWaalsContact O-N 3.13Å | ||
| 27 | V | 52.3 | Low | 47.4 | Very low | 110 Ų | 110 | 139.2 Ų | 139.2 | 67% | 0.667 | 75% | 0.752 | S | S | * | * | trans | -53.3 | 114.7 | 166 | 171.1 | 0 | 0 | 0 | 0 | 109.9 | H29 | V27-H29 VanDerWaalsContact CG1-CD2 3.41Å; V27-H29 WeakPolarHBondContact CG1-CD2 3.5Å | ||
| 28 | I | 51.8 | Low | 48.6 | Very low | 111 Ų | 111 | 138.7 Ų | 138.7 | 57% | 0.569 | 74% | 0.742 | S | S | * | * | trans | -121 | 88.8 | 151.1 | -50.2 | -167.3 | 0 | 0 | 0 | 107.7 | L26 H30 | L26-I28 PolarHBondContact O-N 3.13Å; L26-I28 VanDerWaalsContact O-N 3.13Å; I28-H30 WeakPolarHBondContact CG2-CE1 3.4Å; I28-H30 WeakPolarHBondContact CG2-ND1 3.33Å; I28-H30 PolarHBondContact O-N 2.75Å; I28-H30 PolarHBondContact O-ND1 3.05Å | ||
| 29 | H | 40.7 | Very low | 50.6 | Low | 171 Ų | 171 | 128.9 Ų | 128.9 | 79% | 0.792 | 70% | 0.696 | S | S | * | * | trans | -62.8 | 93.8 | 155.5 | -80.9 | -78.2 | 0 | 0 | 0 | 107.3 | V27 P31 | V27-H29 VanDerWaalsContact CG1-CD2 3.41Å; V27-H29 WeakPolarHBondContact CG1-CD2 3.5Å; H29-P31 WeakPolarHBondContact O-CD 3.5Å | ||
| 30 | H | 43.4 | Very low | 51.8 | Low | 150 Ų | 150 | 130.4 Ų | 130.4 | 69% | 0.694 | 69% | 0.694 | S | S | * | * | trans | -66.2 | 118.3 | 166.5 | -66.3 | 81.2 | 0 | 0 | 0 | 107 | I28 A32 | I28-H30 WeakPolarHBondContact CG2-CE1 3.4Å; I28-H30 WeakPolarHBondContact CG2-ND1 3.33Å; I28-H30 PolarHBondContact O-N 2.75Å; I28-H30 PolarHBondContact O-ND1 3.05Å; H30-A32 PolarHBondContact O-N 2.92Å | ||
| 31 | P | 44.7 | Very low | 52.8 | Low | 119 Ų | 119 | 127.4 Ų | 127.4 | 77% | 0.773 | 68% | 0.678 | S | S | * | * | trans | -68 | 103.2 | -178.5 | 24.9 | -30.3 | 0 | 0 | 0 | 109.8 | H29 E33 | H29-P31 WeakPolarHBondContact O-CD 3.5Å; P31-E33 PolarHBondContact O-N 2.93Å | ||
| 32 | A | 44.5 | Very low | 54.4 | Low | 102 Ų | 102 | 126.9 Ų | 126.9 | 84% | 0.843 | 66% | 0.662 | S | S | * | * | trans | -73.3 | 70.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | H30 | H30-A32 PolarHBondContact O-N 2.92Š| ||
| 33 | E | 53 | Low | 55.2 | Low | 165 Ų | 165 | 120 Ų | 120 | 77% | 0.771 | 63% | 0.632 | S | S | * | * | trans | -131.3 | 48.4 | 175.8 | -57.4 | -156.6 | 145.7 | 0 | 0 | 112.3 | P31 Q35 | P31-E33 PolarHBondContact O-N 2.93Å; E33-Q35 VanDerWaalsContact C-N 3.31Å; E33-Q35 PolarHBondContact O-N 3.05Å; E33-Q35 VanDerWaalsContact O-N 3.1Å | ||
| 34 | E | 45.7 | Very low | 56 | Low | 185 Ų | 185 | 116.4 Ų | 116.4 | 86% | 0.864 | 62% | 0.616 | S | S | * | * | trans | -80.1 | 83 | 162.8 | -67.4 | -164.1 | 108.2 | 0 | 0 | 109.1 | P36 | E34-P36 WeakPolarHBondContact O-CD 3.41Å; E34-P36 WeakPolarHBondContact O-CG 3.33Å | ||
| 35 | Q | 57.5 | Low | 56.5 | Low | 94 Ų | 94 | 107.5 Ų | 107.5 | 44% | 0.439 | 59% | 0.59 | S | S | . | * | trans | -76.7 | 100 | 162.3 | -72.8 | -171.3 | 16.3 | 0 | 0 | 108.6 | E33 Y37 T45 | E33-Q35 VanDerWaalsContact C-N 3.31Å; E33-Q35 PolarHBondContact O-N 3.05Å; E33-Q35 VanDerWaalsContact O-N 3.1Å; Q35-Y37 VanDerWaalsContact C-N 3.27Å; Q35-Y37 PolarHBondContact O-N 3.27Å; Q35-T45 PolarHBondContact OE1-OG1 3.45Å; Q35-T45 VanDerWaalsContact OE1-OG1 3.04Å | ||
| 36 | P | 65.5 | Low | 58.1 | Low | 92 Ų | 92 | 105.7 Ų | 105.7 | 60% | 0.597 | 56% | 0.563 | S | S | * | * | trans | -78.5 | -13.3 | -163.9 | -11 | 29.1 | 0 | 0 | 0 | 113.1 | E34 R38 | E34-P36 WeakPolarHBondContact O-CD 3.41Å; E34-P36 WeakPolarHBondContact O-CG 3.33Å; P36-R38 PolarHBondContact O-N 3.18Å | ||
| 37 | Y | 63.3 | Low | 58.8 | Low | 74 Ų | 74 | 102.1 Ų | 102.1 | 29% | 0.29 | 55% | 0.55 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -106.1 | 82.1 | -167.1 | -55.6 | -73.4 | 0 | 0 | 0 | 110.8 | Q35 F46 Q49 | Q35-Y37 VanDerWaalsContact C-N 3.27Å; Q35-Y37 PolarHBondContact O-N 3.27Å; Y37-F46 WeakPolarHBondContact O-CD2 3.23Å; Y37-F46 PolarHBondContact O-N 3.32Å; Y37-Q49 HydrophobicContact CD1-CB 3.78Å; Y37-Q49 HydrophobicContact CD1-CG 3.87Å; Y37-Q49 HydrophobicContact CD2-CB 4.45Å; Y37-Q49 HydrophobicContact CE1-CB 3.48Å; Y37-Q49 VanDerWaalsContact CE1-CB 3.48Å; Y37-Q49 HydrophobicContact CE1-CG 3.65Å; Y37-Q49 HydrophobicContact CE2-CB 4.21Å; Y37-Q49 HydrophobicContact CG-CB 4.26Å |
| 38 | R | 64 | Low | 59.7 | Low | 173 Ų | 173 | 102.2 Ų | 102.2 | 65% | 0.653 | 54% | 0.543 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.2 | 133.4 | 176.2 | -167.3 | 175.3 | -175.2 | -173.9 | -1.9 | 111.5 | P36 G43 Q44 T45 | P36-R38 PolarHBondContact O-N 3.18Å; R38-G43 WeakPolarHBondContact CG-O 3.43Å; R38-G43 PolarHBondContact NE-O 3.19Å; R38-Q44 CarbonylContact C-O 3.15Å; R38-Q44 WeakPolarHBondContact CA-O 3.19Å; R38-T45 HydrophobicContact CB-CG2 4.25Å; R38-T45 HydrophobicContact CG-CG2 3.99Å |
| 39 | C | 76.6 | Confident | 60.5 | Low | 0 Ų | 0 | 101.5 Ų | 101.5 | 0% | 0 | 54% | 0.538 | C | S | . | . | trans | -75.5 | 125.1 | 173.9 | -175.4 | 0 | 0 | 0 | 0 | 110.4 | L41 C42 G43 Q44 F46 L52 | C39-L41 VanDerWaalsContact C-N 3.28Å; C39-L41 PolarHBondContact O-N 3.06Å; C39-C42 VanDerWaalsContact SG-SG 3.62Å; C39-G43 WeakPolarHBondContact O-CA 3.32Å; C39-G43 PolarHBondContact O-N 2.94Å; C39-Q44 PolarHBondContact N-O 3.1Å; C39-F46 HydrophobicContact CB-CE2 4.33Å; C39-L52 HydrophobicContact CB-CD1 3.63Å | ||
| 40 | P | 63.6 | Low | 62.3 | Low | 97 Ų | 97 | 97.7 Ų | 97.7 | 63% | 0.63 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.3 | -18.4 | 179.7 | 29.7 | -34.9 | 0 | 0 | 0 | 113.3 | ||
| 41 | L | 62.9 | Low | 63.8 | Low | 126 Ų | 126 | 92.3 Ų | 92.3 | 66% | 0.66 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | -33.2 | -177.1 | -64.9 | 172.7 | 0 | 0 | 0 | 113 | C39 H59 | C39-L41 VanDerWaalsContact C-N 3.28Å; C39-L41 PolarHBondContact O-N 3.06Å; L41-H59 HydrophobicContact CD1-CB 3.79Å |
| 42 | C | 70.7 | Confident | 65.3 | Low | 59 Ų | 59 | 87.3 Ų | 87.3 | 40% | 0.399 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -130.9 | -4.4 | -175.2 | 71.2 | 0 | 0 | 0 | 0 | 113.8 | C39 Q44 H55 | C39-C42 VanDerWaalsContact SG-SG 3.62Å; C42-Q44 VanDerWaalsContact C-N 3.25Å; C42-Q44 PolarHBondContact O-N 3.48Å; C42-H55 PolarHBondContact SG-NE2 3.34Å |
| 43 | G | 62.1 | Low | 66.8 | Low | 28 Ų | 28 | 85.1 Ų | 85.1 | 29% | 0.289 | 45% | 0.45 | S | S | . | . | trans | 75.8 | -0.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | R38 C39 | R38-G43 WeakPolarHBondContact CG-O 3.43Å; R38-G43 PolarHBondContact NE-O 3.19Å; C39-G43 WeakPolarHBondContact O-CA 3.32Å; C39-G43 PolarHBondContact O-N 2.94Å | ||
| 44 | Q | 62 | Low | 68 | Low | 105 Ų | 105 | 85.7 Ų | 85.7 | 49% | 0.491 | 45% | 0.445 | S | S | . | . | trans | -63 | 134.8 | 179 | -77.7 | -169.6 | 45.8 | 0 | 0 | 111.8 | R38 C39 C42 F46 | R38-Q44 CarbonylContact C-O 3.15Å; R38-Q44 WeakPolarHBondContact CA-O 3.19Å; C39-Q44 PolarHBondContact N-O 3.1Å; C42-Q44 VanDerWaalsContact C-N 3.25Å; C42-Q44 PolarHBondContact O-N 3.48Å; Q44-F46 HydrophobicContact CB-CE2 3.65Å; Q44-F46 HydrophobicContact CB-CZ 3.82Å | ||
| 45 | T | 65.6 | Low | 69.4 | Low | 74 Ų | 74 | 78.7 Ų | 78.7 | 45% | 0.454 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 141.2 | 174.8 | 56.6 | 0 | 0 | 0 | 0 | 110.3 | Q35 R38 | Q35-T45 PolarHBondContact OE1-OG1 3.45Å; Q35-T45 VanDerWaalsContact OE1-OG1 3.04Å; R38-T45 HydrophobicContact CB-CG2 4.25Å; R38-T45 HydrophobicContact CG-CG2 3.99Å |
| 46 | F | 75.6 | Confident | 70.1 | Confident | 33 Ų | 33 | 77.3 Ų | 77.3 | 15% | 0.145 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 142.2 | 178.4 | -61.5 | -88.1 | 0 | 0 | 0 | 108.8 | Y37 C39 Q44 Q48 L52 H55 | Y37-F46 WeakPolarHBondContact O-CD2 3.23Å; Y37-F46 PolarHBondContact O-N 3.32Å; C39-F46 HydrophobicContact CB-CE2 4.33Å; Q44-F46 HydrophobicContact CB-CE2 3.65Å; Q44-F46 HydrophobicContact CB-CZ 3.82Å; F46-Q48 PolarHBondContact O-N 3.05Å; F46-L52 HydrophobicContact CB-CB 4.35Å; F46-L52 HydrophobicContact CD2-CB 3.92Å; F46-L52 HydrophobicContact CD2-CD1 3.7Å; F46-L52 HydrophobicContact CD2-CG 4.39Å; F46-L52 HydrophobicContact CE2-CD1 3.81Å; F46-L52 HydrophobicContact CG-CB 4.24Å; F46-H55 HydrophobicContact CE1-CB 4.15Å; F46-H55 HydrophobicContact CE2-CB 4.16Å; F46-H55 AromaticContact CE2-CD2 3.76Å; F46-H55 AromaticContact CE2-CG 3.8Å; F46-H55 HydrophobicContact CZ-CB 3.68Å; F46-H55 AromaticContact CZ-CD2 3.76Å; F46-H55 AromaticContact CZ-CE1 3.93Å; F46-H55 AromaticContact CZ-CG 3.35Å; F46-H55 AromaticContact CZ-ND1 3.48Å; F46-H55 WeakPolarHBondContact CZ-ND1 3.32Å |
| 47 | S | 69.3 | Low | 70.5 | Confident | 76 Ų | 76 | 80 Ų | 80 | 53% | 0.531 | 41% | 0.408 | S | S | . | . | S | Bend | trans | -73 | -15.5 | 174.5 | 52 | 0 | 0 | 0 | 0 | 113 | ||
| 48 | Q | 70.8 | Confident | 70.7 | Confident | 112 Ų | 112 | 80.3 Ų | 80.3 | 52% | 0.523 | 43% | 0.426 | S | S | . | . | S | Bend | trans | -142.2 | 135.4 | -172.5 | -64.1 | -62.9 | -21.4 | 0 | 0 | 111.8 | F46 P50 S51 L52 | F46-Q48 PolarHBondContact O-N 3.05Å; Q48-P50 HydrophobicContact CB-CG 4.32Å; Q48-S51 WeakPolarHBondContact O-CB 3.38Å; Q48-S51 PolarHBondContact O-N 3.31Å; Q48-L52 PolarHBondContact O-N 3.3Å |
| 49 | Q | 69.3 | Low | 70.6 | Confident | 97 Ų | 97 | 75.4 Ų | 75.4 | 45% | 0.453 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -55.2 | -45.3 | 177.9 | -164.2 | 177.1 | -23.8 | 0 | 0 | 115 | Y37 S51 L52 V53 | Y37-Q49 HydrophobicContact CD1-CB 3.78Å; Y37-Q49 HydrophobicContact CD1-CG 3.87Å; Y37-Q49 HydrophobicContact CD2-CB 4.45Å; Y37-Q49 HydrophobicContact CE1-CB 3.48Å; Y37-Q49 VanDerWaalsContact CE1-CB 3.48Å; Y37-Q49 HydrophobicContact CE1-CG 3.65Å; Y37-Q49 HydrophobicContact CE2-CB 4.21Å; Y37-Q49 HydrophobicContact CG-CB 4.26Å; Q49-S51 PolarHBondContact O-N 2.77Å; Q49-L52 PolarHBondContact O-N 3.21Å; Q49-L52 VanDerWaalsContact O-N 3.11Å; Q49-V53 HydrophobicContact CG-CG2 4.47Å; Q49-V53 WeakPolarHBondContact O-CG2 3.36Å; Q49-V53 PolarHBondContact O-N 3.04Å |
| 50 | P | 77.9 | Confident | 69.8 | Low | 91 Ų | 91 | 78.7 Ų | 78.7 | 59% | 0.591 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -62.8 | -29.2 | 179.5 | 23.3 | -34.8 | 0 | 0 | 0 | 112.8 | Q48 V53 R54 | Q48-P50 HydrophobicContact CB-CG 4.32Å; P50-V53 PolarHBondContact O-N 3.11Å; P50-R54 WeakPolarHBondContact O-CB 3.19Å; P50-R54 PolarHBondContact O-N 3.34Å |
| 51 | S | 76.3 | Confident | 69.2 | Low | 36 Ų | 36 | 77.7 Ų | 77.7 | 25% | 0.252 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -67.1 | -41.6 | 175.1 | -60.8 | 0 | 0 | 0 | 0 | 111.5 | Q48 Q49 H55 | Q48-S51 WeakPolarHBondContact O-CB 3.38Å; Q48-S51 PolarHBondContact O-N 3.31Å; Q49-S51 PolarHBondContact O-N 2.77Å; S51-H55 WeakPolarHBondContact O-CB 3.41Å; S51-H55 PolarHBondContact O-N 3.46Å |
| 52 | L | 75.9 | Confident | 68.6 | Low | 15 Ų | 15 | 75.5 Ų | 75.5 | 8% | 0.079 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -65.8 | -42.7 | 173.5 | 175.3 | 63 | 0 | 0 | 0 | 111.5 | C39 F46 Q48 Q49 H55 Q56 | C39-L52 HydrophobicContact CB-CD1 3.63Å; F46-L52 HydrophobicContact CB-CB 4.35Å; F46-L52 HydrophobicContact CD2-CB 3.92Å; F46-L52 HydrophobicContact CD2-CD1 3.7Å; F46-L52 HydrophobicContact CD2-CG 4.39Å; F46-L52 HydrophobicContact CE2-CD1 3.81Å; F46-L52 HydrophobicContact CG-CB 4.24Å; Q48-L52 PolarHBondContact O-N 3.3Å; Q49-L52 PolarHBondContact O-N 3.21Å; Q49-L52 VanDerWaalsContact O-N 3.11Å; L52-H55 CarbonylContact O-C 3.54Å; L52-H55 WeakPolarHBondContact O-CB 3.48Å; L52-H55 PolarHBondContact O-N 2.78Å; L52-Q56 HydrophobicContact CD1-CG 4.02Å; L52-Q56 HydrophobicContact CG-CG 4.29Å; L52-Q56 WeakPolarHBondContact O-CB 3.43Å; L52-Q56 VanDerWaalsContact O-CG 3.29Å; L52-Q56 WeakPolarHBondContact O-CG 3.24Å; L52-Q56 PolarHBondContact O-N 3.35Å |
| 53 | V | 75.8 | Confident | 67.3 | Low | 56 Ų | 56 | 76.2 Ų | 76.2 | 34% | 0.339 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -64.4 | -43.4 | -179.9 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | Q49 P50 H55 Q56 K57 | Q49-V53 HydrophobicContact CG-CG2 4.47Å; Q49-V53 WeakPolarHBondContact O-CG2 3.36Å; Q49-V53 PolarHBondContact O-N 3.04Å; P50-V53 PolarHBondContact O-N 3.11Å; V53-H55 VanDerWaalsContact C-N 3.31Å; V53-H55 PolarHBondContact O-N 2.99Å; V53-Q56 PolarHBondContact O-N 2.8Å; V53-K57 WeakPolarHBondContact O-CG 3.12Å; V53-K57 PolarHBondContact O-N 3.42Å |
| 54 | R | 78.4 | Confident | 66.2 | Low | 177 Ų | 177 | 85.8 Ų | 85.8 | 67% | 0.668 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.6 | -39.7 | 174 | -177.2 | 176.6 | 62.2 | -170.9 | -3.1 | 111.6 | P50 K57 A58 | P50-R54 WeakPolarHBondContact O-CB 3.19Å; P50-R54 PolarHBondContact O-N 3.34Å; R54-K57 PolarHBondContact O-N 3.28Å; R54-A58 PolarHBondContact O-N 3.46Å |
| 55 | H | 75.3 | Confident | 65.2 | Low | 37 Ų | 37 | 86.3 Ų | 86.3 | 17% | 0.171 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -63.8 | -40.1 | 174.4 | 171.9 | 86.6 | 0 | 0 | 0 | 112 | C42 F46 S51 L52 V53 A58 H59 | C42-H55 PolarHBondContact SG-NE2 3.34Å; F46-H55 HydrophobicContact CE1-CB 4.15Å; F46-H55 HydrophobicContact CE2-CB 4.16Å; F46-H55 AromaticContact CE2-CD2 3.76Å; F46-H55 AromaticContact CE2-CG 3.8Å; F46-H55 HydrophobicContact CZ-CB 3.68Å; F46-H55 AromaticContact CZ-CD2 3.76Å; F46-H55 AromaticContact CZ-CE1 3.93Å; F46-H55 AromaticContact CZ-CG 3.35Å; F46-H55 AromaticContact CZ-ND1 3.48Å; F46-H55 WeakPolarHBondContact CZ-ND1 3.32Å; S51-H55 WeakPolarHBondContact O-CB 3.41Å; S51-H55 PolarHBondContact O-N 3.46Å; L52-H55 CarbonylContact O-C 3.54Å; L52-H55 WeakPolarHBondContact O-CB 3.48Å; L52-H55 PolarHBondContact O-N 2.78Å; V53-H55 VanDerWaalsContact C-N 3.31Å; V53-H55 PolarHBondContact O-N 2.99Å; H55-A58 WeakPolarHBondContact O-CB 3.48Å; H55-A58 PolarHBondContact O-N 2.98Å; H55-H59 AromaticContact CD2-NE2 3.85Å; H55-H59 AromaticContact NE2-NE2 3.25Å; H55-H59 PolarHBondContact NE2-NE2 3.48Å |
| 56 | Q | 71.3 | Confident | 64 | Low | 65 Ų | 65 | 86.7 Ų | 86.7 | 30% | 0.304 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.8 | -37.2 | 177.9 | -77.1 | 173.7 | -16.1 | 0 | 0 | 112.8 | L52 V53 A58 H59 A60 | L52-Q56 HydrophobicContact CD1-CG 4.02Å; L52-Q56 HydrophobicContact CG-CG 4.29Å; L52-Q56 WeakPolarHBondContact O-CB 3.43Å; L52-Q56 VanDerWaalsContact O-CG 3.29Å; L52-Q56 WeakPolarHBondContact O-CG 3.24Å; L52-Q56 PolarHBondContact O-N 3.35Å; V53-Q56 PolarHBondContact O-N 2.8Å; Q56-A58 PolarHBondContact O-N 3.25Å; Q56-H59 WeakPolarHBondContact O-CB 3.38Å; Q56-H59 PolarHBondContact O-N 3.1Å; Q56-A60 PolarHBondContact O-N 3.46Å |
| 57 | K | 73.8 | Confident | 62.6 | Low | 148 Ų | 148 | 90.2 Ų | 90.2 | 64% | 0.643 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.7 | -26.7 | 174 | -71.7 | 175.9 | -178.9 | -174.3 | 0 | 112.7 | V53 R54 H59 A60 G61 | V53-K57 WeakPolarHBondContact O-CG 3.12Å; V53-K57 PolarHBondContact O-N 3.42Å; R54-K57 PolarHBondContact O-N 3.28Å; K57-H59 VanDerWaalsContact C-N 3.27Å; K57-H59 PolarHBondContact O-N 2.94Å; K57-A60 PolarHBondContact O-N 2.69Å; K57-G61 PolarHBondContact O-N 3.49Å |
| 58 | A | 67.3 | Low | 61.1 | Low | 81 Ų | 81 | 94.6 Ų | 94.6 | 67% | 0.669 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -70.5 | -22.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113 | R54 H55 Q56 | R54-A58 PolarHBondContact O-N 3.46Å; H55-A58 WeakPolarHBondContact O-CB 3.48Å; H55-A58 PolarHBondContact O-N 2.98Å; Q56-A58 PolarHBondContact O-N 3.25Å |
| 59 | H | 62.7 | Low | 59.7 | Low | 70 Ų | 70 | 100 Ų | 100 | 32% | 0.324 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -75.1 | -34.5 | 168.4 | -64.9 | -64.7 | 0 | 0 | 0 | 111.5 | L41 H55 Q56 K57 G61 A62 | L41-H59 HydrophobicContact CD1-CB 3.79Å; H55-H59 AromaticContact CD2-NE2 3.85Å; H55-H59 AromaticContact NE2-NE2 3.25Å; H55-H59 PolarHBondContact NE2-NE2 3.48Å; Q56-H59 WeakPolarHBondContact O-CB 3.38Å; Q56-H59 PolarHBondContact O-N 3.1Å; K57-H59 VanDerWaalsContact C-N 3.27Å; K57-H59 PolarHBondContact O-N 2.94Å; H59-G61 PolarHBondContact O-N 2.95Å; H59-A62 PolarHBondContact O-N 2.84Å |
| 60 | A | 59.7 | Low | 58.2 | Low | 70 Ų | 70 | 101 Ų | 101 | 58% | 0.579 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -70.2 | -15.9 | -180 | 0 | 0 | 0 | 0 | 0 | 114 | Q56 K57 A62 G63 | Q56-A60 PolarHBondContact O-N 3.46Å; K57-A60 PolarHBondContact O-N 2.69Å; A60-A62 PolarHBondContact O-N 2.9Å; A60-A62 VanDerWaalsContact O-N 3.11Å; A60-G63 PolarHBondContact O-N 3.39Å |
| 61 | G | 51.4 | Low | 56.3 | Low | 75 Ų | 75 | 101.4 Ų | 101.4 | 77% | 0.773 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.7 | -4.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 115 | K57 H59 | K57-G61 PolarHBondContact O-N 3.49Å; H59-G61 PolarHBondContact O-N 2.95Å |
| 62 | A | 49.6 | Very low | 54.3 | Low | 81 Ų | 81 | 109.7 Ų | 109.7 | 67% | 0.669 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -124.1 | 62.5 | 172 | 0 | 0 | 0 | 0 | 0 | 110.6 | H59 A60 R64 | H59-A62 PolarHBondContact O-N 2.84Å; A60-A62 PolarHBondContact O-N 2.9Å; A60-A62 VanDerWaalsContact O-N 3.11Å; A62-R64 PolarHBondContact O-N 3.02Å |
| 63 | G | 43.3 | Very low | 52.4 | Low | 74 Ų | 74 | 115.5 Ų | 115.5 | 76% | 0.763 | 66% | 0.662 | S | S | * | * | S | Bend | trans | 46.6 | 49.4 | 148.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | A60 | A60-G63 PolarHBondContact O-N 3.39Š|
| 64 | R | 38.2 | Very low | 50.6 | Low | 228 Ų | 228 | 123.2 Ų | 123.2 | 86% | 0.86 | 69% | 0.685 | S | S | * | * | trans | -143.9 | 100.3 | 157.9 | -72.9 | -166 | 149.7 | -140.4 | -6.8 | 109.8 | A62 A66 | A62-R64 PolarHBondContact O-N 3.02Å; R64-A66 PolarHBondContact O-N 3.31Å | ||
| 65 | A | 41.6 | Very low | 49.1 | Very low | 116 Ų | 116 | 124.2 Ų | 124.2 | 96% | 0.959 | 70% | 0.698 | S | S | * | * | trans | -69.3 | 79.9 | 164.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | A67 | A65-A67 PolarHBondContact O-N 3.25Š| ||
| 66 | A | 39.9 | Very low | 47.4 | Very low | 83 Ų | 83 | 126.1 Ų | 126.1 | 69% | 0.686 | 73% | 0.727 | S | S | * | * | trans | -85.3 | 99.3 | 161.2 | 0 | 0 | 0 | 0 | 0 | 106.4 | R64 F68 | R64-A66 PolarHBondContact O-N 3.31Å; A66-F68 PolarHBondContact O-N 2.97Å | ||
| 67 | A | 47.2 | Very low | 46.4 | Very low | 106 Ų | 106 | 130.7 Ų | 130.7 | 88% | 0.876 | 75% | 0.753 | S | S | * | * | trans | -51 | 106.1 | 167 | 0 | 0 | 0 | 0 | 0 | 108.3 | A65 | A65-A67 PolarHBondContact O-N 3.25Š| ||
| 68 | F | 36.6 | Very low | 44.7 | Very low | 169 Ų | 169 | 132.6 Ų | 132.6 | 74% | 0.741 | 76% | 0.764 | S | S | * | * | trans | -128.7 | 111.2 | 175 | -150.1 | -96.7 | 0 | 0 | 0 | 109.4 | A66 | A66-F68 PolarHBondContact O-N 2.97Š| ||
| 69 | R | 41.4 | Very low | 43.3 | Very low | 225 Ų | 225 | 138.9 Ų | 138.9 | 85% | 0.849 | 77% | 0.771 | S | S | * | * | trans | -61.8 | 133.6 | 179.9 | -168.1 | -179.6 | -83.8 | -144.6 | -1.8 | 108.5 | S71 | R69-S71 PolarHBondContact O-N 3.19Š| ||
| 70 | V | 38 | Very low | 42.2 | Very low | 117 Ų | 117 | 143.7 Ų | 143.7 | 71% | 0.709 | 79% | 0.793 | S | S | * | * | trans | -62.4 | 109.2 | 170.3 | 175.9 | 0 | 0 | 0 | 0 | 107.5 | R72 | V70-R72 PolarHBondContact O-N 3.41Š| ||
| 71 | S | 38 | Very low | 40.9 | Very low | 101 Ų | 101 | 144.6 Ų | 144.6 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | trans | -70.1 | 97.2 | 173.8 | -62.8 | 0 | 0 | 0 | 0 | 109.1 | R69 | R69-S71 PolarHBondContact O-N 3.19Š| ||
| 72 | R | 35.4 | Very low | 40.7 | Very low | 210 Ų | 210 | 149.4 Ų | 149.4 | 79% | 0.792 | 80% | 0.803 | S | S | * | * | trans | -82.3 | 115.8 | 162.8 | -160.3 | -178 | -72.7 | -174.1 | -2.6 | 106.1 | V70 R74 | V70-R72 PolarHBondContact O-N 3.41Å; R72-R74 PolarHBondContact O-N 2.82Å; R72-R74 VanDerWaalsContact O-N 3.1Å | ||
| 73 | V | 35.3 | Very low | 40.3 | Very low | 136 Ų | 136 | 151.5 Ų | 151.5 | 82% | 0.824 | 81% | 0.81 | S | S | * | * | trans | -68.1 | 109.3 | 171.5 | 172.9 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 74 | R | 37.4 | Very low | 40.4 | Very low | 219 Ų | 219 | 159 Ų | 159 | 83% | 0.826 | 82% | 0.815 | S | S | * | * | trans | -130.1 | 129.4 | 151.9 | -80.4 | -169.1 | 166.7 | 171.6 | -5 | 107.2 | R72 | R72-R74 PolarHBondContact O-N 2.82Å; R72-R74 VanDerWaalsContact O-N 3.1Å | ||
| 75 | Q | 47.8 | Very low | 40.1 | Very low | 198 Ų | 198 | 152.1 Ų | 152.1 | 93% | 0.925 | 82% | 0.815 | S | S | * | * | trans | -54.7 | 141.4 | 174.9 | -65.1 | 171.7 | 11.1 | 0 | 0 | 110 | ||||
| 76 | G | 39.9 | Very low | 39.8 | Very low | 77 Ų | 77 | 151.3 Ų | 151.3 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | trans | 152.7 | 102.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 77 | L | 49.4 | Very low | 40.3 | Very low | 161 Ų | 161 | 152.9 Ų | 152.9 | 84% | 0.843 | 81% | 0.811 | S | S | * | * | trans | -22 | 132.9 | 170.2 | -151.2 | 81.5 | 0 | 0 | 0 | 117.9 | ||||
| 78 | Q | 39.6 | Very low | 39.4 | Very low | 188 Ų | 188 | 152.8 Ų | 152.8 | 88% | 0.879 | 81% | 0.811 | S | S | * | * | 175.2 | 153.6 | 122 | -96.2 | 165.9 | 14.7 | 0 | 0 | 113.9 | |||||
| 79 | R | 37.7 | Very low | 39.6 | Very low | 213 Ų | 213 | 153.7 Ų | 153.7 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | -85.8 | 167.7 | -161.9 | -63.8 | 172.2 | 72.2 | -120.1 | 5.7 | 114.9 | ||||
| 80 | Q | 37.8 | Very low | 39 | Very low | 170 Ų | 170 | 147.7 Ų | 147.7 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | 93.2 | 135.4 | 156.1 | -53.4 | -158.9 | 62.2 | 0 | 0 | 116.4 | ||||
| 81 | A | 33.2 | Very low | 38.8 | Very low | 90 Ų | 90 | 151.2 Ų | 151.2 | 74% | 0.744 | 82% | 0.823 | S | S | * | * | cis | -147.2 | 156.3 | 9.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 82 | Q | 47.6 | Very low | 38.6 | Very low | 175 Ų | 175 | 158.4 Ų | 158.4 | 82% | 0.818 | 84% | 0.835 | S | S | * | * | trans | -79.7 | 145.4 | 171.3 | -80.4 | 171.3 | 5.8 | 0 | 0 | 111.1 | ||||
| 83 | P | 41.3 | Very low | 38.5 | Very low | 125 Ų | 125 | 151.1 Ų | 151.1 | 81% | 0.812 | 83% | 0.825 | S | S | * | * | trans | -109.9 | 124.7 | 137 | 29.7 | -22.4 | 0 | 0 | 0 | 110.1 | ||||
| 84 | R | 44.6 | Very low | 38.9 | Very low | 233 Ų | 233 | 149.5 Ų | 149.5 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | trans | -70.2 | 136.2 | 162.4 | -77.2 | 174.8 | 161.1 | 171 | -7 | 108.7 | ||||
| 85 | G | 31.7 | Very low | 38.8 | Very low | 82 Ų | 82 | 143.3 Ų | 143.3 | 85% | 0.845 | 82% | 0.822 | S | S | * | * | trans | 154.3 | 94 | 164.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 86 | A | 35.9 | Very low | 38.4 | Very low | 99 Ų | 99 | 141.5 Ų | 141.5 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | -136.4 | 159.8 | 151.4 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 87 | P | 49.9 | Very low | 38.3 | Very low | 117 Ų | 117 | 143 Ų | 143 | 76% | 0.76 | 81% | 0.814 | S | S | * | * | cis | -128.8 | 163 | -9.4 | 35.4 | -18.5 | 0 | 0 | 0 | 112.3 | ||||
| 88 | A | 29.2 | Very low | 37.9 | Very low | 104 Ų | 104 | 143.4 Ų | 143.4 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | -145.9 | 113.8 | 157 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 89 | H | 41.3 | Very low | 38.3 | Very low | 188 Ų | 188 | 139.2 Ų | 139.2 | 87% | 0.87 | 81% | 0.805 | S | S | * | * | trans | -64.2 | 127.2 | 172.2 | -75 | -97.6 | 0 | 0 | 0 | 110.6 | ||||
| 90 | A | 27.3 | Very low | 38.7 | Very low | 98 Ų | 98 | 140.1 Ų | 140.1 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | trans | -161.3 | 83.8 | 152.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | R92 | A90-R92 PolarHBondContact O-N 3.4Š| ||
| 91 | H | 35.5 | Very low | 39 | Very low | 191 Ų | 191 | 134.3 Ų | 134.3 | 88% | 0.884 | 79% | 0.786 | S | S | * | * | trans | -85.5 | 101.5 | 164.4 | -133.5 | -75.5 | 0 | 0 | 0 | 107.3 | ||||
| 92 | R | 32.6 | Very low | 39.7 | Very low | 253 Ų | 253 | 134 Ų | 134 | 96% | 0.955 | 79% | 0.792 | S | S | * | * | trans | -118 | 107.5 | 168.5 | -164.9 | 178.1 | -167.7 | -164.9 | 3.4 | 108.5 | A90 | A90-R92 PolarHBondContact O-N 3.4Š| ||
| 93 | G | 32.8 | Very low | 39.7 | Very low | 57 Ų | 57 | 130.8 Ų | 130.8 | 59% | 0.588 | 77% | 0.772 | S | S | * | * | S | Bend | trans | 139 | 81.6 | -176.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | A95 | G93-A95 PolarHBondContact O-N 3.27Š|
| 94 | A | 44.6 | Very low | 39.8 | Very low | 102 Ų | 102 | 130.9 Ų | 130.9 | 84% | 0.843 | 77% | 0.774 | S | S | * | * | trans | -66.9 | 110.7 | -175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 95 | A | 35.3 | Very low | 40 | Very low | 89 Ų | 89 | 123.7 Ų | 123.7 | 74% | 0.736 | 75% | 0.75 | S | S | * | * | trans | -122.9 | 103 | 146.4 | 0 | 0 | 0 | 0 | 0 | 105.7 | G93 P97 | G93-A95 PolarHBondContact O-N 3.27Å; A95-P97 WeakPolarHBondContact O-CD 3.04Å | ||
| 96 | L | 39.9 | Very low | 40.3 | Very low | 160 Ų | 160 | 130.9 Ų | 130.9 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | trans | -57 | 120.4 | 178.5 | -79 | 138.9 | 0 | 0 | 0 | 108.8 | L98 | L96-L98 PolarHBondContact O-N 2.78Š| ||
| 97 | P | 37.8 | Very low | 40.4 | Very low | 109 Ų | 109 | 130.5 Ų | 130.5 | 71% | 0.708 | 73% | 0.733 | S | S | * | * | trans | -66.9 | 128.5 | 174.7 | 26.3 | -30.3 | 0 | 0 | 0 | 108.7 | A95 P99 | A95-P97 WeakPolarHBondContact O-CD 3.04Å; P97-P99 VanDerWaalsContact O-CD 3.26Å; P97-P99 WeakPolarHBondContact O-CD 3.5Å | ||
| 98 | L | 40.4 | Very low | 40 | Very low | 168 Ų | 168 | 129.9 Ų | 129.9 | 88% | 0.88 | 73% | 0.729 | S | S | * | * | trans | -106.3 | 93.9 | 162.4 | -74.9 | 177.9 | 0 | 0 | 0 | 109.3 | L96 R100 | L96-L98 PolarHBondContact O-N 2.78Å; L98-R100 PolarHBondContact O-N 3.48Å | ||
| 99 | P | 48.3 | Very low | 40.9 | Very low | 101 Ų | 101 | 133.1 Ų | 133.1 | 66% | 0.656 | 72% | 0.719 | S | S | * | * | trans | -82.8 | 104.2 | 171.2 | 31.9 | -26.2 | 0 | 0 | 0 | 107 | P97 | P97-P99 VanDerWaalsContact O-CD 3.26Å; P97-P99 WeakPolarHBondContact O-CD 3.5Å | ||
| 100 | R | 45.4 | Very low | 41.3 | Very low | 231 Ų | 231 | 129.1 Ų | 129.1 | 87% | 0.872 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -178.7 | -4.3 | 152.8 | -102.8 | 150.6 | -177.1 | -170.6 | -0.5 | 119.6 | L98 | L98-R100 PolarHBondContact O-N 3.48Š|
| 101 | C | 44 | Very low | 42.6 | Very low | 48 Ų | 48 | 128.2 Ų | 128.2 | 32% | 0.324 | 68% | 0.68 | S | S | . | * | trans | -90.2 | -41 | -179.8 | -174.1 | 0 | 0 | 0 | 0 | 113.9 | R103 H114 | C101-R103 WeakPolarHBondContact O-CG 3.43Å; C101-R103 PolarHBondContact O-N 2.82Å; C101-H114 PolarHBondContact SG-CE1 3.42Å; C101-H114 PolarHBondContact SG-NE2 2.7Å | ||
| 102 | G | 49.3 | Very low | 43.9 | Very low | 85 Ų | 85 | 124.2 Ų | 124.2 | 88% | 0.876 | 66% | 0.664 | S | S | * | * | trans | 54.7 | 11.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 103 | R | 45.9 | Very low | 44.9 | Very low | 106 Ų | 106 | 117.2 Ų | 117.2 | 40% | 0.4 | 65% | 0.646 | S | S | . | * | trans | -96.6 | 124.3 | 180 | -69.4 | 175.3 | -170.1 | -103 | 1 | 109 | C101 F105 P129 | C101-R103 WeakPolarHBondContact O-CG 3.43Å; C101-R103 PolarHBondContact O-N 2.82Å; R103-F105 HydrophobicContact CB-CE2 3.84Å; R103-F105 HydrophobicContact CB-CZ 4.05Å; R103-P129 VanDerWaalsContact NH2-CD 3.28Å | ||
| 104 | C | 43.8 | Very low | 46 | Very low | 127 Ų | 127 | 116.1 Ų | 116.1 | 86% | 0.858 | 63% | 0.626 | S | S | * | * | trans | -105.8 | 128.5 | 172.1 | -56.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 105 | F | 49.2 | Very low | 46.5 | Very low | 83 Ų | 83 | 116.2 Ų | 116.2 | 36% | 0.364 | 61% | 0.609 | S | S | . | * | trans | -106.7 | 135.7 | 176.6 | -61.6 | -85.8 | 0 | 0 | 0 | 108.6 | R103 E107 F110 L111 H114 | R103-F105 HydrophobicContact CB-CE2 3.84Å; R103-F105 HydrophobicContact CB-CZ 4.05Å; F105-E107 VanDerWaalsContact C-N 3.31Å; F105-F110 HydrophobicContact CB-CB 4.18Å; F105-F110 HydrophobicContact CD1-CB 3.81Å; F105-F110 HydrophobicContact CG-CB 4.16Å; F105-L111 HydrophobicContact CD2-CD1 4.4Å; F105-H114 HydrophobicContact CE2-CB 3.92Å; F105-H114 AromaticContact CE2-CD2 3.77Å; F105-H114 AromaticContact CE2-CG 3.67Å; F105-H114 HydrophobicContact CZ-CB 4.1Å; F105-H114 AromaticContact CZ-CG 3.97Å | ||
| 106 | R | 37.2 | Very low | 47.6 | Very low | 233 Ų | 233 | 120.7 Ų | 120.7 | 88% | 0.879 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -76.5 | -19.9 | 179.2 | -69.4 | -174.9 | 179.1 | -171.1 | 0.9 | 113 | ||
| 107 | E | 38.5 | Very low | 48 | Very low | 91 Ų | 91 | 116.8 Ų | 116.8 | 43% | 0.425 | 59% | 0.589 | S | S | . | * | S | Bend | trans | -121.2 | 134 | -178.9 | -115.4 | 73.6 | -147.8 | 0 | 0 | 112.3 | F105 R109 F110 | F105-E107 VanDerWaalsContact C-N 3.31Å; E107-R109 VanDerWaalsContact C-N 3.31Å; E107-R109 HydrophobicContact CB-CG 4.07Å; E107-R109 HydrophobicContact CG-CG 4.38Å; E107-R109 PolarHBondContact O-N 3.04Å; E107-F110 HydrophobicContact CB-CD2 3.38Å; E107-F110 HydrophobicContact CB-CE2 3.65Å; E107-F110 HydrophobicContact CG-CE2 4.35Å; E107-F110 PolarHBondContact O-N 3.05Å; E107-F110 VanDerWaalsContact O-N 3.14Å |
| 108 | P | 42.3 | Very low | 48.6 | Very low | 104 Ų | 104 | 116.9 Ų | 116.9 | 68% | 0.675 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.2 | -34.4 | -176.4 | -24.6 | 33.1 | 0 | 0 | 0 | 114.6 | F110 L111 L112 | P108-F110 PolarHBondContact O-N 2.99Å; P108-L111 WeakPolarHBondContact O-CB 3.4Å; P108-L111 PolarHBondContact O-N 3.25Å; P108-L111 VanDerWaalsContact O-N 3.09Å; P108-L112 PolarHBondContact O-N 3.48Å |
| 109 | R | 48.3 | Very low | 49.3 | Very low | 172 Ų | 172 | 113.1 Ų | 113.1 | 65% | 0.649 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -57.8 | -32.1 | 177.3 | 56.2 | -178 | 171.2 | -173.6 | -4 | 113.3 | E107 N113 | E107-R109 VanDerWaalsContact C-N 3.31Å; E107-R109 HydrophobicContact CB-CG 4.07Å; E107-R109 HydrophobicContact CG-CG 4.38Å; E107-R109 PolarHBondContact O-N 3.04Å; R109-N113 PolarHBondContact O-N 3.21Å |
| 110 | F | 49.3 | Very low | 49.2 | Very low | 104 Ų | 104 | 119.4 Ų | 119.4 | 46% | 0.456 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -81.3 | -28.8 | 178.7 | -60.2 | -67.3 | 0 | 0 | 0 | 112.2 | F105 E107 P108 H114 | F105-F110 HydrophobicContact CB-CB 4.18Å; F105-F110 HydrophobicContact CD1-CB 3.81Å; F105-F110 HydrophobicContact CG-CB 4.16Å; E107-F110 HydrophobicContact CB-CD2 3.38Å; E107-F110 HydrophobicContact CB-CE2 3.65Å; E107-F110 HydrophobicContact CG-CE2 4.35Å; E107-F110 PolarHBondContact O-N 3.05Å; E107-F110 VanDerWaalsContact O-N 3.14Å; P108-F110 PolarHBondContact O-N 2.99Å; F110-H114 WeakPolarHBondContact O-CB 3.26Å; F110-H114 PolarHBondContact O-N 3.07Å |
| 111 | L | 55.3 | Low | 48.9 | Very low | 78 Ų | 78 | 114.2 Ų | 114.2 | 41% | 0.408 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -69.1 | -43.9 | 172.2 | 179.4 | 63.3 | 0 | 0 | 0 | 111.3 | F105 P108 N113 H114 Q115 | F105-L111 HydrophobicContact CD2-CD1 4.4Å; P108-L111 WeakPolarHBondContact O-CB 3.4Å; P108-L111 PolarHBondContact O-N 3.25Å; P108-L111 VanDerWaalsContact O-N 3.09Å; L111-N113 VanDerWaalsContact C-N 3.34Å; L111-N113 PolarHBondContact O-N 3.36Å; L111-H114 CarbonylContact O-C 3.58Å; L111-H114 WeakPolarHBondContact O-CB 3.29Å; L111-H114 PolarHBondContact O-N 3.37Å; L111-Q115 WeakPolarHBondContact O-CG 3.13Å; L111-Q115 PolarHBondContact O-N 2.93Å |
| 112 | L | 61.3 | Low | 48.7 | Very low | 107 Ų | 107 | 116.9 Ų | 116.9 | 56% | 0.56 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65.3 | -38.2 | 179.5 | -169.5 | 62.2 | 0 | 0 | 0 | 111.7 | P108 Q115 R116 | P108-L112 PolarHBondContact O-N 3.48Å; L112-Q115 PolarHBondContact O-N 3.3Å; L112-R116 WeakPolarHBondContact O-CG 3.33Å; L112-R116 PolarHBondContact O-N 2.89Å |
| 113 | N | 54.1 | Low | 48.2 | Very low | 107 Ų | 107 | 116.8 Ų | 116.8 | 57% | 0.572 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -69.5 | -36.6 | 173.4 | -160 | 16.7 | 0 | 0 | 0 | 112 | R109 L111 R116 | R109-N113 PolarHBondContact O-N 3.21Å; L111-N113 VanDerWaalsContact C-N 3.34Å; L111-N113 PolarHBondContact O-N 3.36Å; N113-R116 PolarHBondContact O-N 3.41Å |
| 114 | H | 55.8 | Low | 48 | Very low | 34 Ų | 34 | 116.6 Ų | 116.6 | 16% | 0.157 | 59% | 0.591 | C | S | . | * | H | α-helix | trans | -64.5 | -38 | 173.7 | 174.8 | 64.9 | 0 | 0 | 0 | 112.6 | C101 F105 F110 L111 R116 T117 H118 | C101-H114 PolarHBondContact SG-CE1 3.42Å; C101-H114 PolarHBondContact SG-NE2 2.7Å; F105-H114 HydrophobicContact CE2-CB 3.92Å; F105-H114 AromaticContact CE2-CD2 3.77Å; F105-H114 AromaticContact CE2-CG 3.67Å; F105-H114 HydrophobicContact CZ-CB 4.1Å; F105-H114 AromaticContact CZ-CG 3.97Å; F110-H114 WeakPolarHBondContact O-CB 3.26Å; F110-H114 PolarHBondContact O-N 3.07Å; L111-H114 CarbonylContact O-C 3.58Å; L111-H114 WeakPolarHBondContact O-CB 3.29Å; L111-H114 PolarHBondContact O-N 3.37Å; H114-R116 VanDerWaalsContact C-N 3.28Å; H114-R116 PolarHBondContact O-N 3.25Å; H114-T117 PolarHBondContact O-N 3.16Å; H114-T117 VanDerWaalsContact O-N 3.1Å; H114-T117 PolarHBondContact O-OG1 3.39Å; H114-H118 AromaticContact CD2-NE2 3.67Å; H114-H118 AromaticContact CE1-CE1 3.91Å; H114-H118 AromaticContact CE1-NE2 3.26Å; H114-H118 PolarHBondContact CE1-NE2 3.24Å; H114-H118 VanDerWaalsContact CE1-NE2 3.26Å; H114-H118 AromaticContact NE2-CD2 3.97Å; H114-H118 AromaticContact NE2-CE1 3.87Å; H114-H118 AromaticContact NE2-NE2 2.98Å; H114-H118 PolarHBondContact NE2-NE2 3.36Å; H114-H118 PolarHBondContact O-CD2 3.11Å; H114-H118 VanDerWaalsContact O-CD2 3.3Å |
| 115 | Q | 54.1 | Low | 47.8 | Very low | 104 Ų | 104 | 117.6 Ų | 117.6 | 49% | 0.486 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.5 | -36.6 | 175.3 | -76 | 171.6 | -19.7 | 0 | 0 | 112.3 | L111 L112 T117 H118 | L111-Q115 WeakPolarHBondContact O-CG 3.13Å; L111-Q115 PolarHBondContact O-N 2.93Å; L112-Q115 PolarHBondContact O-N 3.3Å; Q115-T117 PolarHBondContact O-N 3.22Å; Q115-H118 PolarHBondContact O-N 2.92Å; Q115-H118 VanDerWaalsContact O-N 3.16Å |
| 116 | R | 59.5 | Low | 47.6 | Very low | 182 Ų | 182 | 119.8 Ų | 119.8 | 69% | 0.687 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -67.4 | -21.4 | 176.9 | -62.9 | 173.4 | 101.7 | 154.6 | 6 | 113.3 | L112 N113 H114 H118 A119 | L112-R116 WeakPolarHBondContact O-CG 3.33Å; L112-R116 PolarHBondContact O-N 2.89Å; N113-R116 PolarHBondContact O-N 3.41Å; H114-R116 VanDerWaalsContact C-N 3.28Å; H114-R116 PolarHBondContact O-N 3.25Å; R116-H118 VanDerWaalsContact C-N 3.34Å; R116-A119 PolarHBondContact O-N 3.19Å |
| 117 | T | 48.9 | Very low | 47.9 | Very low | 79 Ų | 79 | 117.3 Ų | 117.3 | 49% | 0.485 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -77.1 | -19.1 | 175.3 | 66.5 | 0 | 0 | 0 | 0 | 113.6 | H114 Q115 | H114-T117 PolarHBondContact O-N 3.16Å; H114-T117 VanDerWaalsContact O-N 3.1Å; H114-T117 PolarHBondContact O-OG1 3.39Å; Q115-T117 PolarHBondContact O-N 3.22Å |
| 118 | H | 50.6 | Low | 47.9 | Very low | 111 Ų | 111 | 122.8 Ų | 122.8 | 51% | 0.514 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -80.9 | -24.5 | 172.3 | -63.1 | -71.5 | 0 | 0 | 0 | 112.4 | H114 Q115 R116 R120 | H114-H118 AromaticContact CD2-NE2 3.67Å; H114-H118 AromaticContact CE1-CE1 3.91Å; H114-H118 AromaticContact CE1-NE2 3.26Å; H114-H118 PolarHBondContact CE1-NE2 3.24Å; H114-H118 VanDerWaalsContact CE1-NE2 3.26Å; H114-H118 AromaticContact NE2-CD2 3.97Å; H114-H118 AromaticContact NE2-CE1 3.87Å; H114-H118 AromaticContact NE2-NE2 2.98Å; H114-H118 PolarHBondContact NE2-NE2 3.36Å; H114-H118 PolarHBondContact O-CD2 3.11Å; H114-H118 VanDerWaalsContact O-CD2 3.3Å; Q115-H118 PolarHBondContact O-N 2.92Å; Q115-H118 VanDerWaalsContact O-N 3.16Å; R116-H118 VanDerWaalsContact C-N 3.34Å; H118-R120 VanDerWaalsContact C-N 3.28Å; H118-R120 PolarHBondContact O-N 2.97Å |
| 119 | A | 53.7 | Low | 48.1 | Very low | 88 Ų | 88 | 122.9 Ų | 122.9 | 73% | 0.727 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -5.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | R116 | R116-A119 PolarHBondContact O-N 3.19Š|
| 120 | R | 46.6 | Very low | 47.5 | Very low | 233 Ų | 233 | 118.1 Ų | 118.1 | 88% | 0.879 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.5 | 14.1 | -178.9 | -87 | -171.6 | 175.6 | -168.4 | -0.7 | 114.5 | H118 | H118-R120 VanDerWaalsContact C-N 3.28Å; H118-R120 PolarHBondContact O-N 2.97Å |
| 121 | M | 38.4 | Very low | 47.1 | Very low | 123 Ų | 123 | 117.6 Ų | 117.6 | 61% | 0.606 | 62% | 0.623 | S | S | * | * | trans | -116.2 | 130.6 | -178.8 | -82.7 | -71.1 | -62.8 | 0 | 0 | 111.9 | ||||
| 122 | P | 41.1 | Very low | 46.2 | Very low | 103 Ų | 103 | 124.6 Ų | 124.6 | 67% | 0.669 | 65% | 0.651 | S | S | * | * | trans | -65.3 | 162 | 159.3 | -5.9 | 22 | 0 | 0 | 0 | 110.3 | ||||
| 123 | A | 38.6 | Very low | 45.5 | Very low | 83 Ų | 83 | 122 Ų | 122 | 69% | 0.686 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -44.8 | 153.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | H125 | A123-H125 PolarHBondContact O-N 3.42Š|
| 124 | P | 41.4 | Very low | 45.2 | Very low | 103 Ų | 103 | 124.3 Ų | 124.3 | 67% | 0.669 | 66% | 0.657 | S | S | * | * | trans | -77.9 | 125.7 | -152.5 | 30.4 | -33.7 | 0 | 0 | 0 | 114 | ||||
| 125 | H | 40.2 | Very low | 45.1 | Very low | 147 Ų | 147 | 132.4 Ų | 132.4 | 68% | 0.681 | 69% | 0.686 | S | S | * | * | trans | -97.1 | 134.5 | 142.4 | -4.4 | 74.5 | 0 | 0 | 0 | 108.1 | A123 R127 | A123-H125 PolarHBondContact O-N 3.42Å; H125-R127 PolarHBondContact O-N 2.96Å | ||
| 126 | P | 45.3 | Very low | 45.2 | Very low | 129 Ų | 129 | 133.1 Ų | 133.1 | 84% | 0.838 | 68% | 0.684 | S | S | * | * | trans | -73.6 | 107.4 | -172 | 29.7 | -31.9 | 0 | 0 | 0 | 110 | ||||
| 127 | R | 42.1 | Very low | 45.6 | Very low | 182 Ų | 182 | 127.3 Ų | 127.3 | 69% | 0.687 | 67% | 0.67 | S | S | * | * | trans | -135.2 | 129.4 | 161.6 | -69.7 | -155.3 | -168.5 | -124.8 | 8.9 | 110.9 | H125 | H125-R127 PolarHBondContact O-N 2.96Š| ||
| 128 | R | 38.6 | Very low | 46.7 | Very low | 206 Ų | 206 | 127.9 Ų | 127.9 | 78% | 0.777 | 66% | 0.664 | S | S | * | * | trans | -90.3 | 155.2 | 164.8 | -100 | -176.1 | 137.2 | -134 | 0.9 | 110.5 | ||||
| 129 | P | 46 | Very low | 47.4 | Very low | 106 Ų | 106 | 127.6 Ų | 127.6 | 69% | 0.688 | 66% | 0.661 | S | S | * | * | trans | -87.9 | 139.5 | -166.8 | 0.4 | 19.6 | 0 | 0 | 0 | 112.4 | R103 | R103-P129 VanDerWaalsContact NH2-CD 3.28Š| ||
| 130 | G | 37.6 | Very low | 48.5 | Very low | 72 Ų | 72 | 123.5 Ų | 123.5 | 74% | 0.742 | 63% | 0.627 | S | S | * | * | trans | -163.1 | 107.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 131 | V | 40.6 | Very low | 49.5 | Very low | 93 Ų | 93 | 117.6 Ų | 117.6 | 56% | 0.564 | 62% | 0.619 | S | S | * | * | trans | -137.6 | 100.8 | 155.5 | -176.5 | 0 | 0 | 0 | 0 | 107.6 | R135 | V131-R135 HydrophobicContact CG2-CG 4.45Š| ||
| 132 | F | 36 | Very low | 50.7 | Low | 225 Ų | 225 | 120.1 Ų | 120.1 | 99% | 0.987 | 62% | 0.622 | S | S | * | * | S | Bend | -150.1 | 114.2 | 129.4 | -115.6 | -85.2 | 0 | 0 | 0 | 105.3 | |||
| 133 | G | 46.2 | Very low | 52.1 | Low | 52 Ų | 52 | 117.8 Ų | 117.8 | 54% | 0.536 | 61% | 0.608 | S | S | . | * | S | Bend | cis | -121.5 | -171.2 | -24.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||
| 134 | E | 47.8 | Very low | 53.4 | Low | 156 Ų | 156 | 116.5 Ų | 116.5 | 73% | 0.729 | 60% | 0.603 | S | S | * | * | trans | 67.6 | 97.2 | -175.8 | -47.8 | 177 | -174.3 | 0 | 0 | 113.5 | R136 | E134-R136 PolarHBondContact O-N 2.85Š| ||
| 135 | R | 52.9 | Low | 54.5 | Low | 204 Ų | 204 | 117.4 Ų | 117.4 | 77% | 0.77 | 60% | 0.596 | S | S | * | * | trans | -56.9 | 113 | 166.1 | -71.6 | -180 | 167.3 | -115.3 | -0.5 | 107.3 | V131 P137 | V131-R135 HydrophobicContact CG2-CG 4.45Å; R135-P137 HydrophobicContact CB-CG 4.42Å; R135-P137 WeakPolarHBondContact O-CD 3.47Å | ||
| 136 | R | 58.1 | Low | 55.9 | Low | 119 Ų | 119 | 112.8 Ų | 112.8 | 45% | 0.449 | 58% | 0.58 | S | S | . | * | trans | -104.6 | 80 | 172.3 | -67.1 | 179.5 | 86.8 | -166.8 | 4.7 | 108.3 | E134 Y138 S146 F147 A148 | E134-R136 PolarHBondContact O-N 2.85Å; R136-Y138 VanDerWaalsContact C-N 3.27Å; R136-Y138 PolarHBondContact O-N 3.48Å; R136-S146 PolarHBondContact NE-O 3.18Å; R136-S146 PolarHBondContact NH1-O 3.47Å; R136-S146 PolarHBondContact NH2-O 3.02Å; R136-F147 CarbonylContact C-O 3.44Å; R136-F147 WeakPolarHBondContact CA-O 3.49Å; R136-F147 VanDerWaalsContact CB-C 3.45Å; R136-F147 VanDerWaalsContact CB-O 3.29Å; R136-F147 WeakPolarHBondContact CB-O 3.33Å; R136-A148 HydrophobicContact CG-CB 4.04Å | ||
| 137 | P | 66.4 | Low | 57.3 | Low | 60 Ų | 60 | 108.1 Ų | 108.1 | 39% | 0.39 | 55% | 0.547 | S | S | . | . | trans | -75.2 | -22.2 | -164.5 | -12 | 31.3 | 0 | 0 | 0 | 112.4 | R135 | R135-P137 HydrophobicContact CB-CG 4.42Å; R135-P137 WeakPolarHBondContact O-CD 3.47Å | ||
| 138 | Y | 73.2 | Confident | 58.9 | Low | 90 Ų | 90 | 101.6 Ų | 101.6 | 35% | 0.353 | 53% | 0.531 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.8 | 129 | -175.8 | -54.3 | -78.3 | 0 | 0 | 0 | 109.4 | R136 S146 F147 E150 | R136-Y138 VanDerWaalsContact C-N 3.27Å; R136-Y138 PolarHBondContact O-N 3.48Å; Y138-S146 CarbonylContact O-C 3.48Å; Y138-S146 WeakPolarHBondContact O-CA 3.29Å; Y138-F147 PolarHBondContact N-O 3.26Å; Y138-F147 PolarHBondContact O-N 3.03Å; Y138-E150 HydrophobicContact CD1-CB 3.79Å; Y138-E150 HydrophobicContact CD1-CG 3.85Å; Y138-E150 HydrophobicContact CD2-CB 4.42Å; Y138-E150 VanDerWaalsContact CD2-N 3.33Å; Y138-E150 HydrophobicContact CE1-CB 3.56Å; Y138-E150 HydrophobicContact CE1-CG 3.79Å; Y138-E150 HydrophobicContact CE2-CB 4.23Å; Y138-E150 HydrophobicContact CG-CB 4.22Å |
| 139 | F | 64.5 | Low | 60.7 | Low | 106 Ų | 106 | 100.7 Ų | 100.7 | 47% | 0.465 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.4 | 151.1 | 178.8 | 62.6 | -86.4 | 0 | 0 | 0 | 111.4 | K145 | F139-K145 CarbonylContact C-O 3.53Å; F139-K145 WeakPolarHBondContact CA-O 3.41Å |
| 140 | C | 77.8 | Confident | 61.9 | Low | 2 Ų | 2 | 99.8 Ų | 99.8 | 1% | 0.014 | 52% | 0.515 | C | S | . | . | trans | -83.2 | 123.1 | 178.3 | -175.6 | 0 | 0 | 0 | 0 | 110.3 | R142 C143 G144 K145 L153 H160 | C140-R142 PolarHBondContact O-N 3.45Å; C140-C143 VanDerWaalsContact CB-SG 3.52Å; C140-G144 WeakPolarHBondContact O-CA 3.44Å; C140-G144 PolarHBondContact O-N 3.34Å; C140-K145 PolarHBondContact N-O 3.18Å; C140-L153 HydrophobicContact CB-CD1 3.8Å; C140-H160 PolarHBondContact SG-NE2 3.3Å | ||
| 141 | P | 66.3 | Low | 63.8 | Low | 109 Ų | 109 | 98.6 Ų | 98.6 | 71% | 0.708 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -22.3 | 179 | 27.9 | -34.2 | 0 | 0 | 0 | 112.8 | ||
| 142 | R | 63.2 | Low | 65.7 | Low | 175 Ų | 175 | 96.7 Ų | 96.7 | 66% | 0.66 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | -33.3 | -177.9 | -162 | 171.9 | -174.7 | -173.9 | -3.6 | 113.3 | C140 H160 | C140-R142 PolarHBondContact O-N 3.45Å; R142-H160 PolarHBondContact NH1-O 3.45Å |
| 143 | C | 72.3 | Confident | 67.9 | Low | 55 Ų | 55 | 86.8 Ų | 86.8 | 37% | 0.372 | 45% | 0.45 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -131 | -0.7 | -175 | 71 | 0 | 0 | 0 | 0 | 114.7 | C140 K145 H156 | C140-C143 VanDerWaalsContact CB-SG 3.52Å; C143-K145 PolarHBondContact O-N 3.46Å; C143-K145 VanDerWaalsContact SG-CG 3.57Å; C143-H156 PolarHBondContact SG-NE2 2.95Å |
| 144 | G | 64.3 | Low | 69.4 | Low | 56 Ų | 56 | 89.3 Ų | 89.3 | 58% | 0.577 | 45% | 0.446 | S | S | * | . | trans | 73.4 | 0.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 116 | C140 S146 | C140-G144 WeakPolarHBondContact O-CA 3.44Å; C140-G144 PolarHBondContact O-N 3.34Å; G144-S146 PolarHBondContact O-N 3.24Å | ||
| 145 | K | 65 | Low | 70.9 | Confident | 122 Ų | 122 | 85.6 Ų | 85.6 | 53% | 0.53 | 44% | 0.435 | S | S | . | . | trans | -65.9 | 128 | -179.2 | -69 | 178 | -175.7 | -176 | 0 | 111.2 | F139 C140 C143 F147 | F139-K145 CarbonylContact C-O 3.53Å; F139-K145 WeakPolarHBondContact CA-O 3.41Å; C140-K145 PolarHBondContact N-O 3.18Å; C143-K145 PolarHBondContact O-N 3.46Å; C143-K145 VanDerWaalsContact SG-CG 3.57Å; K145-F147 HydrophobicContact CB-CE2 3.7Å; K145-F147 HydrophobicContact CB-CZ 3.91Å; K145-F147 WeakPolarHBondContact O-CD2 3.33Å; K145-F147 VanDerWaalsContact O-CE2 3.32Å; K145-F147 WeakPolarHBondContact O-CE2 3.21Å | ||
| 146 | S | 69.7 | Low | 72.2 | Confident | 50 Ų | 50 | 77 Ų | 77 | 35% | 0.35 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 144.8 | 175.5 | 59.3 | 0 | 0 | 0 | 0 | 111.9 | R136 Y138 G144 | R136-S146 PolarHBondContact NE-O 3.18Å; R136-S146 PolarHBondContact NH1-O 3.47Å; R136-S146 PolarHBondContact NH2-O 3.02Å; Y138-S146 CarbonylContact O-C 3.48Å; Y138-S146 WeakPolarHBondContact O-CA 3.29Å; G144-S146 PolarHBondContact O-N 3.24Å |
| 147 | F | 75.3 | Confident | 73.1 | Confident | 31 Ų | 31 | 73.2 Ų | 73.2 | 14% | 0.136 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 147.1 | -177.9 | -62.1 | -88.4 | 0 | 0 | 0 | 111.1 | R136 Y138 K145 L153 H156 | R136-F147 CarbonylContact C-O 3.44Å; R136-F147 WeakPolarHBondContact CA-O 3.49Å; R136-F147 VanDerWaalsContact CB-C 3.45Å; R136-F147 VanDerWaalsContact CB-O 3.29Å; R136-F147 WeakPolarHBondContact CB-O 3.33Å; Y138-F147 PolarHBondContact N-O 3.26Å; Y138-F147 PolarHBondContact O-N 3.03Å; K145-F147 HydrophobicContact CB-CE2 3.7Å; K145-F147 HydrophobicContact CB-CZ 3.91Å; K145-F147 WeakPolarHBondContact O-CD2 3.33Å; K145-F147 VanDerWaalsContact O-CE2 3.32Å; K145-F147 WeakPolarHBondContact O-CE2 3.21Å; F147-L153 HydrophobicContact CB-CB 4.39Å; F147-L153 HydrophobicContact CD2-CB 4.04Å; F147-L153 HydrophobicContact CD2-CD1 3.82Å; F147-L153 HydrophobicContact CE2-CD1 3.99Å; F147-L153 HydrophobicContact CG-CB 4.36Å; F147-H156 HydrophobicContact CE1-CB 3.95Å; F147-H156 HydrophobicContact CE2-CB 3.98Å; F147-H156 AromaticContact CE2-CD2 3.36Å; F147-H156 WeakPolarHBondContact CE2-CD2 3.41Å; F147-H156 AromaticContact CE2-CG 3.67Å; F147-H156 HydrophobicContact CZ-CB 3.47Å; F147-H156 VanDerWaalsContact CZ-CB 3.47Å; F147-H156 AromaticContact CZ-CD2 3.38Å; F147-H156 WeakPolarHBondContact CZ-CD2 3.17Å; F147-H156 AromaticContact CZ-CG 3.2Å; F147-H156 AromaticContact CZ-ND1 3.79Å |
| 148 | A | 76.4 | Confident | 73.6 | Confident | 44 Ų | 44 | 78.6 Ų | 78.6 | 36% | 0.364 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -71.3 | -32 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | R136 | R136-A148 HydrophobicContact CG-CB 4.04Š|
| 149 | R | 75.7 | Confident | 73.6 | Confident | 187 Ų | 187 | 78.5 Ų | 78.5 | 71% | 0.706 | 42% | 0.415 | S | S | * | . | S | Bend | trans | -130.2 | 149.7 | -175.1 | -59 | 178.3 | -170.4 | 139.6 | 1.8 | 110.5 | G151 S152 L153 | R149-G151 PolarHBondContact O-N 2.76Å; R149-S152 WeakPolarHBondContact O-CB 3.33Å; R149-S152 PolarHBondContact O-N 3.21Å; R149-L153 PolarHBondContact O-N 2.97Å |
| 150 | E | 70.7 | Confident | 74 | Confident | 88 Ų | 88 | 75.9 Ų | 75.9 | 41% | 0.411 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -64.3 | -39.1 | 179.5 | -162.3 | -167.8 | 152 | 0 | 0 | 112.3 | Y138 S152 L153 K154 | Y138-E150 HydrophobicContact CD1-CB 3.79Å; Y138-E150 HydrophobicContact CD1-CG 3.85Å; Y138-E150 HydrophobicContact CD2-CB 4.42Å; Y138-E150 VanDerWaalsContact CD2-N 3.33Å; Y138-E150 HydrophobicContact CE1-CB 3.56Å; Y138-E150 HydrophobicContact CE1-CG 3.79Å; Y138-E150 HydrophobicContact CE2-CB 4.23Å; Y138-E150 HydrophobicContact CG-CB 4.22Å; E150-S152 PolarHBondContact O-N 2.98Å; E150-L153 WeakPolarHBondContact O-CA 3.48Å; E150-L153 WeakPolarHBondContact O-CB 3.39Å; E150-L153 PolarHBondContact O-N 3.43Å; E150-K154 PolarHBondContact O-N 3.3Å; E150-K154 VanDerWaalsContact OE1-CE 3.23Å; E150-K154 WeakPolarHBondContact OE1-CE 3.21Å; E150-K154 IonicContact OE1-NZ 2.69Å; E150-K154 PolarHBondContact OE1-NZ 2.98Å |
| 151 | G | 77.8 | Confident | 73.3 | Confident | 46 Ų | 46 | 79 Ų | 79 | 47% | 0.474 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -60.3 | -32.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | R149 T155 | R149-G151 PolarHBondContact O-N 2.76Å; G151-T155 PolarHBondContact O-N 3.26Å; G151-T155 PolarHBondContact O-OG1 3.48Å |
| 152 | S | 80.7 | Confident | 72.6 | Confident | 54 Ų | 54 | 80.7 Ų | 80.7 | 38% | 0.378 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -70 | -38.9 | 174 | -51.9 | 0 | 0 | 0 | 0 | 111.6 | R149 E150 H156 | R149-S152 WeakPolarHBondContact O-CB 3.33Å; R149-S152 PolarHBondContact O-N 3.21Å; E150-S152 PolarHBondContact O-N 2.98Å; S152-H156 VanDerWaalsContact O-CB 3.24Å; S152-H156 WeakPolarHBondContact O-CB 3.33Å; S152-H156 PolarHBondContact O-N 3.34Å |
| 153 | L | 81.3 | Confident | 71.7 | Confident | 17 Ų | 17 | 74.7 Ų | 74.7 | 9% | 0.089 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -65.2 | -45 | 173.5 | 174.1 | 63.7 | 0 | 0 | 0 | 111.4 | C140 F147 R149 E150 T155 H156 Q157 | C140-L153 HydrophobicContact CB-CD1 3.8Å; F147-L153 HydrophobicContact CB-CB 4.39Å; F147-L153 HydrophobicContact CD2-CB 4.04Å; F147-L153 HydrophobicContact CD2-CD1 3.82Å; F147-L153 HydrophobicContact CE2-CD1 3.99Å; F147-L153 HydrophobicContact CG-CB 4.36Å; R149-L153 PolarHBondContact O-N 2.97Å; E150-L153 WeakPolarHBondContact O-CA 3.48Å; E150-L153 WeakPolarHBondContact O-CB 3.39Å; E150-L153 PolarHBondContact O-N 3.43Å; L153-T155 VanDerWaalsContact C-N 3.35Å; L153-T155 PolarHBondContact O-N 3.16Å; L153-H156 CarbonylContact O-C 3.51Å; L153-H156 WeakPolarHBondContact O-CB 3.4Å; L153-H156 PolarHBondContact O-N 3.37Å; L153-Q157 HydrophobicContact CD1-CG 4.25Å; L153-Q157 HydrophobicContact CG-CG 4.44Å; L153-Q157 VanDerWaalsContact O-CG 3.32Å; L153-Q157 WeakPolarHBondContact O-CG 3.42Å; L153-Q157 PolarHBondContact O-N 3.46Å |
| 154 | K | 77.5 | Confident | 70.6 | Confident | 104 Ų | 104 | 76.2 Ų | 76.2 | 45% | 0.452 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.4 | -41 | 178.2 | -82.7 | 170.5 | 166.7 | 159 | 0 | 112.5 | E150 Q157 R158 | E150-K154 PolarHBondContact O-N 3.3Å; E150-K154 VanDerWaalsContact OE1-CE 3.23Å; E150-K154 WeakPolarHBondContact OE1-CE 3.21Å; E150-K154 IonicContact OE1-NZ 2.69Å; E150-K154 PolarHBondContact OE1-NZ 2.98Å; K154-Q157 PolarHBondContact O-N 3.16Å; K154-R158 PolarHBondContact O-N 3.28Å |
| 155 | T | 79.8 | Confident | 69.4 | Low | 78 Ų | 78 | 82.1 Ų | 82.1 | 48% | 0.479 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -68.7 | -39.1 | 175.4 | -55.5 | 0 | 0 | 0 | 0 | 111.6 | G151 L153 Q157 R158 | G151-T155 PolarHBondContact O-N 3.26Å; G151-T155 PolarHBondContact O-OG1 3.48Å; L153-T155 VanDerWaalsContact C-N 3.35Å; L153-T155 PolarHBondContact O-N 3.16Å; T155-Q157 VanDerWaalsContact C-N 3.32Å; T155-Q157 PolarHBondContact O-N 2.6Å; T155-R158 WeakPolarHBondContact O-CB 3.43Å; T155-R158 PolarHBondContact O-N 3.39Å; T155-R158 PolarHBondContact OG1-NH2 3.32Å |
| 156 | H | 80 | Confident | 68.6 | Low | 25 Ų | 25 | 79.4 Ų | 79.4 | 12% | 0.116 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -65 | -32.7 | 171.9 | 174.1 | 62.8 | 0 | 0 | 0 | 113.3 | C143 F147 S152 L153 R158 S159 H160 | C143-H156 PolarHBondContact SG-NE2 2.95Å; F147-H156 HydrophobicContact CE1-CB 3.95Å; F147-H156 HydrophobicContact CE2-CB 3.98Å; F147-H156 AromaticContact CE2-CD2 3.36Å; F147-H156 WeakPolarHBondContact CE2-CD2 3.41Å; F147-H156 AromaticContact CE2-CG 3.67Å; F147-H156 HydrophobicContact CZ-CB 3.47Å; F147-H156 VanDerWaalsContact CZ-CB 3.47Å; F147-H156 AromaticContact CZ-CD2 3.38Å; F147-H156 WeakPolarHBondContact CZ-CD2 3.17Å; F147-H156 AromaticContact CZ-CG 3.2Å; F147-H156 AromaticContact CZ-ND1 3.79Å; S152-H156 VanDerWaalsContact O-CB 3.24Å; S152-H156 WeakPolarHBondContact O-CB 3.33Å; S152-H156 PolarHBondContact O-N 3.34Å; L153-H156 CarbonylContact O-C 3.51Å; L153-H156 WeakPolarHBondContact O-CB 3.4Å; L153-H156 PolarHBondContact O-N 3.37Å; H156-R158 VanDerWaalsContact C-N 3.28Å; H156-R158 PolarHBondContact O-N 3.37Å; H156-S159 PolarHBondContact O-N 3.41Å; H156-S159 PolarHBondContact O-OG 3.36Å; H156-H160 AromaticContact CD2-NE2 3.78Å; H156-H160 AromaticContact CE1-NE2 3.34Å; H156-H160 PolarHBondContact CE1-NE2 3.18Å; H156-H160 VanDerWaalsContact CE1-NE2 3.34Å; H156-H160 AromaticContact NE2-CD2 3.91Å; H156-H160 AromaticContact NE2-CE1 3.92Å; H156-H160 AromaticContact NE2-NE2 2.99Å; H156-H160 PolarHBondContact NE2-NE2 2.98Å; H156-H160 PolarHBondContact O-CD2 2.84Å |
| 157 | Q | 77.4 | Confident | 67.3 | Low | 38 Ų | 38 | 86.7 Ų | 86.7 | 18% | 0.178 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -63.5 | -35.9 | 175.2 | -77.9 | 169.9 | -25 | 0 | 0 | 111.9 | L153 K154 T155 S159 H160 | L153-Q157 HydrophobicContact CD1-CG 4.25Å; L153-Q157 HydrophobicContact CG-CG 4.44Å; L153-Q157 VanDerWaalsContact O-CG 3.32Å; L153-Q157 WeakPolarHBondContact O-CG 3.42Å; L153-Q157 PolarHBondContact O-N 3.46Å; K154-Q157 PolarHBondContact O-N 3.16Å; T155-Q157 VanDerWaalsContact C-N 3.32Å; T155-Q157 PolarHBondContact O-N 2.6Å; Q157-S159 PolarHBondContact O-N 3.11Å; Q157-H160 WeakPolarHBondContact O-CB 3.45Å; Q157-H160 PolarHBondContact O-N 3.1Å |
| 158 | R | 77.2 | Confident | 65.5 | Low | 173 Ų | 173 | 89.5 Ų | 89.5 | 65% | 0.653 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.6 | -26.7 | 175.5 | -67.8 | -176.8 | -76.4 | 177.3 | -0.9 | 113.2 | K154 T155 H156 H160 G161 | K154-R158 PolarHBondContact O-N 3.28Å; T155-R158 WeakPolarHBondContact O-CB 3.43Å; T155-R158 PolarHBondContact O-N 3.39Å; T155-R158 PolarHBondContact OG1-NH2 3.32Å; H156-R158 VanDerWaalsContact C-N 3.28Å; H156-R158 PolarHBondContact O-N 3.37Å; R158-H160 PolarHBondContact O-N 3.01Å; R158-G161 PolarHBondContact O-N 3.46Å |
| 159 | S | 72.9 | Confident | 63.7 | Low | 88 Ų | 88 | 92.1 Ų | 92.1 | 62% | 0.615 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71 | -12.2 | 174.4 | 78.7 | 0 | 0 | 0 | 0 | 113.4 | H156 Q157 G161 | H156-S159 PolarHBondContact O-N 3.41Å; H156-S159 PolarHBondContact O-OG 3.36Å; Q157-S159 PolarHBondContact O-N 3.11Å; S159-G161 VanDerWaalsContact C-N 3.29Å |
| 160 | H | 73.3 | Confident | 61.8 | Low | 51 Ų | 51 | 91.6 Ų | 91.6 | 24% | 0.236 | 54% | 0.541 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | 2 | 173.8 | -66.4 | -70.5 | 0 | 0 | 0 | 113.1 | C140 R142 H156 Q157 R158 H162 | C140-H160 PolarHBondContact SG-NE2 3.3Å; R142-H160 PolarHBondContact NH1-O 3.45Å; H156-H160 AromaticContact CD2-NE2 3.78Å; H156-H160 AromaticContact CE1-NE2 3.34Å; H156-H160 PolarHBondContact CE1-NE2 3.18Å; H156-H160 VanDerWaalsContact CE1-NE2 3.34Å; H156-H160 AromaticContact NE2-CD2 3.91Å; H156-H160 AromaticContact NE2-CE1 3.92Å; H156-H160 AromaticContact NE2-NE2 2.99Å; H156-H160 PolarHBondContact NE2-NE2 2.98Å; H156-H160 PolarHBondContact O-CD2 2.84Å; Q157-H160 WeakPolarHBondContact O-CB 3.45Å; Q157-H160 PolarHBondContact O-N 3.1Å; R158-H160 PolarHBondContact O-N 3.01Å; H160-H162 PolarHBondContact O-N 3.26Å; H160-H162 VanDerWaalsContact O-N 3.14Å |
| 161 | G | 62.9 | Low | 60.7 | Low | 69 Ų | 69 | 95.7 Ų | 95.7 | 71% | 0.711 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69 | 7.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | R158 S159 | R158-G161 PolarHBondContact O-N 3.46Å; S159-G161 VanDerWaalsContact C-N 3.29Å |
| 162 | H | 51.8 | Low | 58.3 | Low | 143 Ų | 143 | 96.3 Ų | 96.3 | 66% | 0.662 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -136.8 | 124.7 | 173.6 | -121.1 | -96.2 | 0 | 0 | 0 | 109 | H160 | H160-H162 PolarHBondContact O-N 3.26Å; H160-H162 VanDerWaalsContact O-N 3.14Å |
| 163 | G | 45 | Very low | 56.1 | Low | 50 Ų | 50 | 104.7 Ų | 104.7 | 52% | 0.515 | 60% | 0.595 | S | S | . | * | trans | -58.2 | 157.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | E165 | G163-E165 PolarHBondContact O-N 3.09Š| ||
| 164 | P | 48.4 | Very low | 54.1 | Low | 86 Ų | 86 | 110.2 Ų | 110.2 | 56% | 0.558 | 63% | 0.629 | S | S | * | * | trans | -69.3 | 98.1 | 176.7 | 29.9 | -31.6 | 0 | 0 | 0 | 108.3 | G166 | P164-G166 PolarHBondContact O-N 3.23Š| ||
| 165 | E | 39.2 | Very low | 52.5 | Low | 181 Ų | 181 | 116.1 Ų | 116.1 | 85% | 0.846 | 66% | 0.664 | S | S | * | * | trans | -63.2 | 111.4 | 162.1 | -69.7 | -150.4 | 114.1 | 0 | 0 | 107.4 | G163 | G163-E165 PolarHBondContact O-N 3.09Š| ||
| 166 | G | 47.4 | Very low | 51.1 | Low | 65 Ų | 65 | 118.1 Ų | 118.1 | 67% | 0.67 | 67% | 0.674 | S | S | * | * | trans | -66 | 141.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | P164 | P164-G166 PolarHBondContact O-N 3.23Š| ||
| 167 | Q | 43.2 | Very low | 49.6 | Very low | 202 Ų | 202 | 122.9 Ų | 122.9 | 94% | 0.944 | 70% | 0.703 | S | S | * | * | trans | -113.8 | 85.4 | 141.4 | -75.6 | 176.9 | 20.4 | 0 | 0 | 106.6 | ||||
| 168 | A | 37.3 | Very low | 48 | Very low | 91 Ų | 91 | 127.7 Ų | 127.7 | 75% | 0.752 | 73% | 0.732 | S | S | * | * | trans | -68.5 | 157 | 152 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 169 | A | 38.5 | Very low | 46.3 | Very low | 98 Ų | 98 | 125 Ų | 125 | 81% | 0.81 | 74% | 0.737 | S | S | * | * | trans | 72.8 | 101.1 | 158.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 170 | H | 36 | Very low | 44.6 | Very low | 176 Ų | 176 | 127.3 Ų | 127.3 | 82% | 0.815 | 75% | 0.745 | S | S | * | * | -145.7 | 91.9 | 105 | -163.9 | 3.8 | 0 | 0 | 0 | 109.6 | G172 | H170-G172 PolarHBondContact O-N 3.26Š| |||
| 171 | L | 46.9 | Very low | 42.7 | Very low | 174 Ų | 174 | 132.4 Ų | 132.4 | 91% | 0.911 | 78% | 0.778 | S | S | * | * | trans | -69.5 | 116 | 148.6 | -69.5 | 170.1 | 0 | 0 | 0 | 105.8 | ||||
| 172 | G | 27.5 | Very low | 41.3 | Very low | 59 Ų | 59 | 136.9 Ų | 136.9 | 61% | 0.608 | 78% | 0.783 | S | S | * | * | trans | -126.1 | 114.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | H170 | H170-G172 PolarHBondContact O-N 3.26Š| ||
| 173 | R | 35.4 | Very low | 40.5 | Very low | 230 Ų | 230 | 136.5 Ų | 136.5 | 87% | 0.868 | 79% | 0.793 | S | S | * | * | trans | -69.7 | 145.3 | -162.4 | -180 | 176.3 | 176.1 | 176.6 | -1 | 113.5 | L175 | R173-L175 PolarHBondContact O-N 3.14Š| ||
| 174 | V | 38.5 | Very low | 40.1 | Very low | 134 Ų | 134 | 143.7 Ų | 143.7 | 81% | 0.812 | 82% | 0.816 | S | S | * | * | trans | -58.2 | 122.7 | 165.2 | -179 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 175 | L | 43.2 | Very low | 39.4 | Very low | 228 Ų | 228 | 148.9 Ų | 148.9 | 100% | 1.194 | 84% | 0.839 | S | S | * | * | trans | -141 | 0 | 150.7 | -79.8 | 174.3 | 0 | 0 | 0 | 108.2 | R173 | R173-L175 PolarHBondContact O-N 3.14Š|
Retrieved 175 of 175 residues in 96.8 ms
(Link to these results)