| 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 | 41 | Very low | 46.1 | Very low | 242 Ų | 242 | 154.7 Ų | 154.7 | 100% | 1.192 | 84% | 0.839 | S | S | * | * | 0 | 120.7 | 0 | -67 | 176.6 | 168.4 | 0 | 0 | 107.5 | |||||
| 2 | K | 46.4 | Very low | 45.8 | Very low | 215 Ų | 215 | 149.8 Ų | 149.8 | 94% | 0.935 | 82% | 0.821 | S | S | * | * | trans | -88.2 | 112.4 | -165 | -169.6 | 156 | 170.2 | 174.7 | 0 | 109 | A4 | K2-A4 PolarHBondContact O-N 3.41Š| ||
| 3 | L | 44 | Very low | 45.8 | Very low | 173 Ų | 173 | 149 Ų | 149 | 91% | 0.906 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 117.6 | 175.4 | -78.6 | 155.7 | 0 | 0 | 0 | 108.9 | ||
| 4 | A | 48.7 | Very low | 45.7 | Very low | 90 Ų | 90 | 143.2 Ų | 143.2 | 74% | 0.744 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 146.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | K2 | K2-A4 PolarHBondContact O-N 3.41Š|
| 5 | P | 51.2 | Low | 45.7 | Very low | 117 Ų | 117 | 141.5 Ų | 141.5 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 139.2 | -174.1 | 27.1 | -32.6 | 0 | 0 | 0 | 111.5 | Q7 | P5-Q7 PolarHBondContact O-N 3.2Š|
| 6 | Q | 52.3 | Low | 45.2 | Very low | 168 Ų | 168 | 146.5 Ų | 146.5 | 79% | 0.785 | 81% | 0.813 | S | S | * | * | trans | -51.3 | 110.9 | 174 | -163.3 | -153.8 | 95.4 | 0 | 0 | 109.6 | Q8 | Q6-Q8 PolarHBondContact O-N 3.12Š| ||
| 7 | Q | 50.6 | Low | 44.8 | Very low | 179 Ų | 179 | 140.6 Ų | 140.6 | 84% | 0.836 | 78% | 0.784 | S | S | * | * | trans | -63.8 | 98.8 | 172.7 | -70.8 | -84.4 | -0.5 | 0 | 0 | 108 | P5 G9 | P5-Q7 PolarHBondContact O-N 3.2Å; Q7-G9 VanDerWaalsContact C-N 3.28Å; Q7-G9 PolarHBondContact O-N 3.49Å | ||
| 8 | Q | 43.6 | Very low | 44.6 | Very low | 163 Ų | 163 | 139.8 Ų | 139.8 | 76% | 0.762 | 79% | 0.79 | S | S | * | * | trans | -64 | 95.2 | 164 | -69 | 175.8 | 20.5 | 0 | 0 | 106.9 | Q6 V10 | Q6-Q8 PolarHBondContact O-N 3.12Å; Q8-V10 VanDerWaalsContact C-N 3.34Å; Q8-V10 PolarHBondContact O-N 3.21Å | ||
| 9 | G | 41.1 | Very low | 44.4 | Very low | 68 Ų | 68 | 142.9 Ų | 142.9 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -62.7 | 96.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | Q7 L11 | Q7-G9 VanDerWaalsContact C-N 3.28Å; Q7-G9 PolarHBondContact O-N 3.49Å; G9-L11 PolarHBondContact O-N 3.3Å | ||
| 10 | V | 42.6 | Very low | 44.3 | Very low | 130 Ų | 130 | 140.7 Ų | 140.7 | 79% | 0.788 | 78% | 0.78 | S | S | * | * | trans | -57 | 109.3 | 164.6 | 176 | 0 | 0 | 0 | 0 | 106.8 | Q8 | Q8-V10 VanDerWaalsContact C-N 3.34Å; Q8-V10 PolarHBondContact O-N 3.21Å | ||
| 11 | L | 45.5 | Very low | 44.1 | Very low | 157 Ų | 157 | 142.1 Ų | 142.1 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | trans | -57.8 | 127.9 | 173.4 | -77.8 | 157.9 | 0 | 0 | 0 | 108.6 | G9 | G9-L11 PolarHBondContact O-N 3.3Š| ||
| 12 | P | 42.7 | Very low | 43.8 | Very low | 96 Ų | 96 | 138.9 Ų | 138.9 | 62% | 0.623 | 76% | 0.76 | S | S | * | * | trans | -64 | 134.3 | -178 | 24.4 | -32.7 | 0 | 0 | 0 | 110.7 | G14 | P12-G14 VanDerWaalsContact C-N 3.3Å; P12-G14 PolarHBondContact O-N 2.93Å | ||
| 13 | P | 45.6 | Very low | 43.3 | Very low | 139 Ų | 139 | 135.5 Ų | 135.5 | 90% | 0.903 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | 83.1 | 173.5 | 32 | -31.7 | 0 | 0 | 0 | 108.4 | ||
| 14 | G | 45.1 | Very low | 42.7 | Very low | 68 Ų | 68 | 130.2 Ų | 130.2 | 70% | 0.701 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -174.3 | -9.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 118.4 | P12 | P12-G14 VanDerWaalsContact C-N 3.3Å; P12-G14 PolarHBondContact O-N 2.93Å |
| 15 | V | 44.8 | Very low | 42.2 | Very low | 118 Ų | 118 | 130.9 Ų | 130.9 | 72% | 0.715 | 73% | 0.728 | S | S | * | * | trans | -112.9 | 74.5 | 180 | -174.6 | 0 | 0 | 0 | 0 | 109.8 | S17 | V15-S17 PolarHBondContact O-N 3.43Å; V15-S17 VanDerWaalsContact O-N 3.07Å | ||
| 16 | W | 38 | Very low | 41.5 | Very low | 221 Ų | 221 | 129.7 Ų | 129.7 | 84% | 0.837 | 73% | 0.728 | S | S | * | * | trans | -76.1 | 89 | 154.6 | -70.7 | -8.9 | 0 | 0 | 0 | 107 | S18 | W16-S18 PolarHBondContact O-N 3.42Š| ||
| 17 | S | 38.5 | Very low | 41 | Very low | 46 Ų | 46 | 133.2 Ų | 133.2 | 32% | 0.322 | 73% | 0.734 | S | S | . | * | trans | -41.4 | 107 | 171.9 | 178.5 | 0 | 0 | 0 | 0 | 110.8 | V15 R19 | V15-S17 PolarHBondContact O-N 3.43Å; V15-S17 VanDerWaalsContact O-N 3.07Å; S17-R19 PolarHBondContact O-N 2.84Å; S17-R19 VanDerWaalsContact OG-CB 3.28Å; S17-R19 WeakPolarHBondContact OG-CB 3.12Å; S17-R19 WeakPolarHBondContact OG-CD 3.1Å; S17-R19 VanDerWaalsContact OG-CG 3.29Å; S17-R19 WeakPolarHBondContact OG-CG 3.42Å; S17-R19 PolarHBondContact OG-N 2.77Å | ||
| 18 | S | 40.6 | Very low | 40.3 | Very low | 127 Ų | 127 | 133.5 Ų | 133.5 | 89% | 0.888 | 74% | 0.735 | S | S | * | * | trans | -67.5 | 22.1 | 165.9 | -60.8 | 0 | 0 | 0 | 0 | 112.8 | W16 | W16-S18 PolarHBondContact O-N 3.42Š| ||
| 19 | R | 42 | Very low | 40.5 | Very low | 198 Ų | 198 | 135.7 Ų | 135.7 | 75% | 0.747 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -83.9 | 132.5 | 174.3 | -64.9 | 178 | 163.3 | -164.2 | -5.5 | 108.4 | S17 F21 | S17-R19 PolarHBondContact O-N 2.84Å; S17-R19 VanDerWaalsContact OG-CB 3.28Å; S17-R19 WeakPolarHBondContact OG-CB 3.12Å; S17-R19 WeakPolarHBondContact OG-CD 3.1Å; S17-R19 VanDerWaalsContact OG-CG 3.29Å; S17-R19 WeakPolarHBondContact OG-CG 3.42Å; S17-R19 PolarHBondContact OG-N 2.77Å; R19-F21 WeakPolarHBondContact O-CD2 3.3Å; R19-F21 PolarHBondContact O-N 2.82Å |
| 20 | P | 42.6 | Very low | 40.7 | Very low | 99 Ų | 99 | 135.7 Ų | 135.7 | 64% | 0.643 | 74% | 0.742 | S | S | * | * | trans | -58.4 | 112.1 | 163.8 | 23.7 | -28.4 | 0 | 0 | 0 | 107 | H22 | P20-H22 PolarHBondContact O-CD2 3.29Å; P20-H22 PolarHBondContact O-N 3.49Å | ||
| 21 | F | 38.6 | Very low | 40.6 | Very low | 171 Ų | 171 | 138.5 Ų | 138.5 | 75% | 0.75 | 75% | 0.747 | S | S | * | * | trans | -66.2 | 89 | 171.7 | -76.4 | -89.8 | 0 | 0 | 0 | 107.4 | R19 F23 | R19-F21 WeakPolarHBondContact O-CD2 3.3Å; R19-F21 PolarHBondContact O-N 2.82Å; F21-F23 VanDerWaalsContact C-N 3.32Å; F21-F23 PolarHBondContact O-N 3.5Å | ||
| 22 | H | 36.2 | Very low | 40.6 | Very low | 173 Ų | 173 | 137.5 Ų | 137.5 | 80% | 0.801 | 74% | 0.738 | S | S | * | * | trans | -67.3 | 93.6 | 167.3 | -81.5 | -88.3 | 0 | 0 | 0 | 107.8 | P20 G24 | P20-H22 PolarHBondContact O-CD2 3.29Å; P20-H22 PolarHBondContact O-N 3.49Å; H22-G24 PolarHBondContact O-N 3.36Å | ||
| 23 | F | 35.5 | Very low | 40.7 | Very low | 144 Ų | 144 | 136.6 Ų | 136.6 | 63% | 0.632 | 73% | 0.732 | S | S | * | * | trans | -80.9 | 107.6 | 159.2 | -158.9 | -94.5 | 0 | 0 | 0 | 105.9 | F21 V25 | F21-F23 VanDerWaalsContact C-N 3.32Å; F21-F23 PolarHBondContact O-N 3.5Å; F23-V25 PolarHBondContact O-N 3.22Å; F23-V25 VanDerWaalsContact O-N 3.16Å | ||
| 24 | G | 31.3 | Very low | 40.9 | Very low | 62 Ų | 62 | 136.8 Ų | 136.8 | 64% | 0.639 | 72% | 0.72 | S | S | * | * | trans | -57.3 | 118.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | H22 A26 | H22-G24 PolarHBondContact O-N 3.36Å; G24-A26 VanDerWaalsContact C-N 3.31Å; G24-A26 PolarHBondContact O-N 3.37Å | ||
| 25 | V | 38.6 | Very low | 41.1 | Very low | 104 Ų | 104 | 138.4 Ų | 138.4 | 63% | 0.63 | 72% | 0.721 | S | S | * | * | trans | -69.4 | 98.6 | 163.6 | 173.5 | 0 | 0 | 0 | 0 | 105.4 | F23 R27 | F23-V25 PolarHBondContact O-N 3.22Å; F23-V25 VanDerWaalsContact O-N 3.16Å; V25-R27 VanDerWaalsContact C-N 3.31Å; V25-R27 PolarHBondContact O-N 2.93Å | ||
| 26 | A | 35.8 | Very low | 41.3 | Very low | 93 Ų | 93 | 137.6 Ų | 137.6 | 77% | 0.769 | 72% | 0.716 | S | S | * | * | trans | -62.1 | 100.9 | 163.6 | 0 | 0 | 0 | 0 | 0 | 106.5 | G24 H28 | G24-A26 VanDerWaalsContact C-N 3.31Å; G24-A26 PolarHBondContact O-N 3.37Å; A26-H28 PolarHBondContact O-N 2.81Å | ||
| 27 | R | 42.1 | Very low | 41.7 | Very low | 241 Ų | 241 | 131.9 Ų | 131.9 | 91% | 0.909 | 70% | 0.702 | S | S | * | * | trans | -62.1 | 100.2 | 172.6 | -117.1 | -156.1 | -177.1 | 167.7 | 1.2 | 107.4 | V25 | V25-R27 VanDerWaalsContact C-N 3.31Å; V25-R27 PolarHBondContact O-N 2.93Å | ||
| 28 | H | 35.9 | Very low | 42.2 | Very low | 185 Ų | 185 | 134 Ų | 134 | 86% | 0.856 | 71% | 0.713 | S | S | * | * | trans | -79.7 | 122.2 | 164.4 | -139.7 | -95.4 | 0 | 0 | 0 | 107.5 | A26 G30 | A26-H28 PolarHBondContact O-N 2.81Å; H28-G30 PolarHBondContact O-N 3.16Å | ||
| 29 | K | 46.9 | Very low | 42.7 | Very low | 210 Ų | 210 | 131.8 Ų | 131.8 | 91% | 0.913 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -74.3 | 116.7 | -176.7 | -168.7 | 174.9 | -176.5 | 178.7 | 0 | 108.2 | ||
| 30 | G | 46.3 | Very low | 43 | Very low | 68 Ų | 68 | 124.8 Ų | 124.8 | 70% | 0.701 | 68% | 0.675 | S | S | * | * | trans | 129.1 | 122.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | H28 | H28-G30 PolarHBondContact O-N 3.16Š| ||
| 31 | H | 40.3 | Very low | 43 | Very low | 189 Ų | 189 | 127.1 Ų | 127.1 | 88% | 0.875 | 68% | 0.676 | S | S | * | * | S | Bend | trans | 101 | 97.2 | 164.1 | -135.9 | -93.9 | 0 | 0 | 0 | 117.3 | ||
| 32 | E | 44.5 | Very low | 43.7 | Very low | 136 Ų | 136 | 123.1 Ų | 123.1 | 64% | 0.636 | 67% | 0.665 | S | S | * | * | trans | 45 | 104.9 | 156.9 | -67.3 | -60.7 | 112.9 | 0 | 0 | 119.6 | E34 | E32-E34 PolarHBondContact O-N 3.44Š| ||
| 33 | P | 45.6 | Very low | 44.4 | Very low | 77 Ų | 77 | 118 Ų | 118 | 50% | 0.5 | 65% | 0.646 | S | S | . | * | trans | -87.6 | 6.3 | -176.1 | 36.6 | -34.3 | 0 | 0 | 0 | 115.4 | S35 V36 D37 | P33-S35 VanDerWaalsContact C-N 3.32Å; P33-S35 PolarHBondContact O-N 2.93Å; P33-V36 PolarHBondContact O-N 3.28Å; P33-D37 PolarHBondContact O-N 3.14Å | ||
| 34 | E | 48.8 | Very low | 44.7 | Very low | 142 Ų | 142 | 118.4 Ų | 118.4 | 66% | 0.664 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -62.5 | -33.6 | -171 | -59.5 | -143.2 | 126.9 | 0 | 0 | 114.1 | E32 V38 | E32-E34 PolarHBondContact O-N 3.44Å; E34-V38 WeakPolarHBondContact O-CB 3.36Å; E34-V38 WeakPolarHBondContact O-CG2 3.22Å; E34-V38 PolarHBondContact O-N 3.36Å; E34-V38 VanDerWaalsContact O-N 3.12Å |
| 35 | S | 49.7 | Very low | 45.2 | Very low | 102 Ų | 102 | 118.3 Ų | 118.3 | 71% | 0.713 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -75 | -30.9 | -176.8 | -61.4 | 0 | 0 | 0 | 0 | 113.6 | P33 L39 | P33-S35 VanDerWaalsContact C-N 3.32Å; P33-S35 PolarHBondContact O-N 2.93Å; S35-L39 WeakPolarHBondContact O-CB 3.48Å; S35-L39 PolarHBondContact O-N 3.25Å |
| 36 | V | 50.1 | Low | 45.3 | Very low | 102 Ų | 102 | 116 Ų | 116 | 62% | 0.618 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -84 | -35 | -177.4 | -161 | 0 | 0 | 0 | 0 | 110.1 | P33 L39 A40 | P33-V36 PolarHBondContact O-N 3.28Å; V36-L39 PolarHBondContact O-N 3.35Å; V36-A40 WeakPolarHBondContact O-CB 3.18Å; V36-A40 PolarHBondContact O-N 3.03Å |
| 37 | D | 46.6 | Very low | 45.6 | Very low | 100 Ų | 100 | 113.9 Ų | 113.9 | 54% | 0.535 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -71.8 | -37.1 | 175.9 | -70.4 | -39.2 | 0 | 0 | 0 | 111.9 | P33 F41 | P33-D37 PolarHBondContact O-N 3.14Å; D37-F41 WeakPolarHBondContact O-CB 3.48Å; D37-F41 PolarHBondContact O-N 2.72Å |
| 38 | V | 48.9 | Very low | 45.3 | Very low | 92 Ų | 92 | 105.8 Ų | 105.8 | 56% | 0.558 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67 | -39.7 | 172.6 | 173.8 | 0 | 0 | 0 | 0 | 111.4 | E34 F41 V42 | E34-V38 WeakPolarHBondContact O-CB 3.36Å; E34-V38 WeakPolarHBondContact O-CG2 3.22Å; E34-V38 PolarHBondContact O-N 3.36Å; E34-V38 VanDerWaalsContact O-N 3.12Å; V38-F41 PolarHBondContact O-N 3Å; V38-V42 WeakPolarHBondContact O-CB 3.45Å; V38-V42 VanDerWaalsContact O-CG2 3.3Å; V38-V42 WeakPolarHBondContact O-CG2 3.44Å; V38-V42 PolarHBondContact O-N 3.2Å |
| 39 | L | 50.4 | Low | 45.7 | Very low | 79 Ų | 79 | 99.9 Ų | 99.9 | 41% | 0.414 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -70.8 | -40.5 | 177.5 | -170.9 | 74.7 | 0 | 0 | 0 | 111.8 | S35 V36 V42 V43 A70 | S35-L39 WeakPolarHBondContact O-CB 3.48Å; S35-L39 PolarHBondContact O-N 3.25Å; V36-L39 PolarHBondContact O-N 3.35Å; L39-V42 PolarHBondContact O-N 3.36Å; L39-V43 WeakPolarHBondContact O-CB 3.42Å; L39-V43 VanDerWaalsContact O-CG2 3.29Å; L39-V43 WeakPolarHBondContact O-CG2 3.06Å; L39-V43 PolarHBondContact O-N 2.79Å; L39-A70 HydrophobicContact CD1-CB 3.75Å; L39-A70 HydrophobicContact CD2-CB 3.57Å; L39-A70 HydrophobicContact CG-CB 4.24Å |
| 40 | A | 48.5 | Very low | 45.4 | Very low | 51 Ų | 51 | 96.7 Ų | 96.7 | 42% | 0.421 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -63.1 | -43 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | V36 V43 H44 | V36-A40 WeakPolarHBondContact O-CB 3.18Å; V36-A40 PolarHBondContact O-N 3.03Å; A40-V43 PolarHBondContact O-N 3.3Å; A40-H44 WeakPolarHBondContact O-CB 3.27Å; A40-H44 PolarHBondContact O-N 2.99Å |
| 41 | F | 41.7 | Very low | 45 | Very low | 149 Ų | 149 | 97.8 Ų | 97.8 | 65% | 0.654 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -62.3 | -42.7 | 174.9 | -179.1 | -97.7 | 0 | 0 | 0 | 112.2 | D37 V38 H44 A45 | D37-F41 WeakPolarHBondContact O-CB 3.48Å; D37-F41 PolarHBondContact O-N 2.72Å; V38-F41 PolarHBondContact O-N 3Å; F41-H44 PolarHBondContact O-N 3.03Å; F41-A45 HydrophobicContact CE1-CB 4.49Å; F41-A45 WeakPolarHBondContact O-CA 3.4Å; F41-A45 WeakPolarHBondContact O-CB 3.38Å; F41-A45 PolarHBondContact O-N 3.47Å |
| 42 | V | 53.5 | Low | 45.3 | Very low | 86 Ų | 86 | 100.5 Ų | 100.5 | 52% | 0.521 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.7 | -42.2 | 175.7 | 166.9 | 0 | 0 | 0 | 0 | 111.6 | V38 L39 A46 | V38-V42 WeakPolarHBondContact O-CB 3.45Å; V38-V42 VanDerWaalsContact O-CG2 3.3Å; V38-V42 WeakPolarHBondContact O-CG2 3.44Å; V38-V42 PolarHBondContact O-N 3.2Å; L39-V42 PolarHBondContact O-N 3.36Å; V42-A46 VanDerWaalsContact O-CB 3.27Å; V42-A46 WeakPolarHBondContact O-CB 3.35Å; V42-A46 PolarHBondContact O-N 2.87Å |
| 43 | V | 52.1 | Low | 45 | Very low | 66 Ų | 66 | 96.6 Ų | 96.6 | 40% | 0.4 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.2 | -37.2 | 176.5 | 172.5 | 0 | 0 | 0 | 0 | 111.4 | L39 A40 A47 | L39-V43 WeakPolarHBondContact O-CB 3.42Å; L39-V43 VanDerWaalsContact O-CG2 3.29Å; L39-V43 WeakPolarHBondContact O-CG2 3.06Å; L39-V43 PolarHBondContact O-N 2.79Å; A40-V43 PolarHBondContact O-N 3.3Å; V43-A47 PolarHBondContact O-N 3.35Å |
| 44 | H | 41.9 | Very low | 44.8 | Very low | 152 Ų | 152 | 97.2 Ų | 97.2 | 70% | 0.704 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -77.5 | -37.8 | 179.1 | -136.5 | 85.4 | 0 | 0 | 0 | 112.6 | A40 F41 A46 A47 G48 | A40-H44 WeakPolarHBondContact O-CB 3.27Å; A40-H44 PolarHBondContact O-N 2.99Å; F41-H44 PolarHBondContact O-N 3.03Å; H44-A46 VanDerWaalsContact C-N 3.32Å; H44-A47 CarbonylContact O-C 3.52Å; H44-A47 WeakPolarHBondContact O-CA 3.47Å; H44-A47 WeakPolarHBondContact O-CB 3.29Å; H44-A47 PolarHBondContact O-N 3.16Å; H44-G48 PolarHBondContact O-N 3.08Å |
| 45 | A | 40.2 | Very low | 44.7 | Very low | 61 Ų | 61 | 93 Ų | 93 | 50% | 0.504 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -65.6 | -36 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | F41 A47 G48 | F41-A45 HydrophobicContact CE1-CB 4.49Å; F41-A45 WeakPolarHBondContact O-CA 3.4Å; F41-A45 WeakPolarHBondContact O-CB 3.38Å; F41-A45 PolarHBondContact O-N 3.47Å; A45-A47 PolarHBondContact O-N 3.32Å; A45-G48 PolarHBondContact O-N 2.92Å |
| 46 | A | 41 | Very low | 44.7 | Very low | 54 Ų | 54 | 94.9 Ų | 94.9 | 45% | 0.446 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67 | -20.4 | 169.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | V42 H44 Q63 | V42-A46 VanDerWaalsContact O-CB 3.27Å; V42-A46 WeakPolarHBondContact O-CB 3.35Å; V42-A46 PolarHBondContact O-N 2.87Å; H44-A46 VanDerWaalsContact C-N 3.32Å; A46-Q63 PolarHBondContact O-NE2 3.23Å |
| 47 | A | 42.9 | Very low | 45 | Very low | 49 Ų | 49 | 92.2 Ų | 92.2 | 41% | 0.405 | 59% | 0.587 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.7 | -11.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | V43 H44 A45 G49 | V43-A47 PolarHBondContact O-N 3.35Å; H44-A47 CarbonylContact O-C 3.52Å; H44-A47 WeakPolarHBondContact O-CA 3.47Å; H44-A47 WeakPolarHBondContact O-CB 3.29Å; H44-A47 PolarHBondContact O-N 3.16Å; A45-A47 PolarHBondContact O-N 3.32Å; A47-G49 VanDerWaalsContact C-N 3.26Å; A47-G49 PolarHBondContact O-N 3.34Å; A47-G49 VanDerWaalsContact O-N 3.16Å |
| 48 | G | 35.8 | Very low | 45.6 | Very low | 72 Ų | 72 | 93 Ų | 93 | 74% | 0.742 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -78.4 | 15 | -175.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | H44 A45 | H44-G48 PolarHBondContact O-N 3.08Å; A45-G48 PolarHBondContact O-N 2.92Å |
| 49 | G | 43.7 | Very low | 46.3 | Very low | 61 Ų | 61 | 91.3 Ų | 91.3 | 63% | 0.629 | 58% | 0.584 | S | S | * | * | trans | -131.4 | 53.6 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | A47 A51 | A47-G49 VanDerWaalsContact C-N 3.26Å; A47-G49 PolarHBondContact O-N 3.34Å; A47-G49 VanDerWaalsContact O-N 3.16Å; G49-A51 VanDerWaalsContact C-N 3.3Å; G49-A51 PolarHBondContact O-N 2.89Å | ||
| 50 | H | 40.8 | Very low | 47.3 | Very low | 143 Ų | 143 | 89.4 Ų | 89.4 | 66% | 0.662 | 58% | 0.58 | S | S | * | * | trans | -86.8 | 71.5 | 171.2 | -91.1 | 39.5 | 0 | 0 | 0 | 111.4 | ||||
| 51 | A | 38.1 | Very low | 48.6 | Very low | 90 Ų | 90 | 88 Ų | 88 | 74% | 0.744 | 57% | 0.566 | S | S | * | * | trans | -76 | 131.6 | 156.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | G49 G53 | G49-A51 VanDerWaalsContact C-N 3.3Å; G49-A51 PolarHBondContact O-N 2.89Å; A51-G53 PolarHBondContact O-N 2.96Å | ||
| 52 | R | 46 | Very low | 50.3 | Low | 246 Ų | 246 | 86.8 Ų | 86.8 | 93% | 0.928 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -62 | 111.5 | -172.6 | -170.6 | 178.3 | 179.2 | 155.7 | -1.3 | 111.7 | ||
| 53 | G | 37.6 | Very low | 51.5 | Low | 54 Ų | 54 | 85.7 Ų | 85.7 | 56% | 0.557 | 55% | 0.547 | S | S | * | . | S | Bend | trans | 156.9 | 115.1 | 164.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | A51 G55 | A51-G53 PolarHBondContact O-N 2.96Å; G53-G55 VanDerWaalsContact C-N 3.32Å; G53-G55 PolarHBondContact O-N 3.44Å |
| 54 | G | 42.5 | Very low | 52.9 | Low | 91 Ų | 91 | 86.6 Ų | 86.6 | 94% | 0.938 | 55% | 0.546 | S | S | * | . | S | Bend | trans | 64.4 | -22 | 143.3 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||
| 55 | G | 45.7 | Very low | 54.9 | Low | 54 Ų | 54 | 79.6 Ų | 79.6 | 56% | 0.557 | 51% | 0.514 | S | S | * | . | trans | -118.7 | 12.9 | -168.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | G53 G57 | G53-G55 VanDerWaalsContact C-N 3.32Å; G53-G55 PolarHBondContact O-N 3.44Å; G55-G57 PolarHBondContact O-N 3.49Å | ||
| 56 | R | 51.1 | Low | 57 | Low | 140 Ų | 140 | 81.9 Ų | 81.9 | 53% | 0.528 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -73.8 | -14.8 | -162.5 | -68.6 | -174.6 | -70.8 | -141.6 | 0.8 | 116.2 | A60 | R56-A60 WeakPolarHBondContact O-CB 3.48Å |
| 57 | G | 55.7 | Low | 59 | Low | 46 Ų | 46 | 81.4 Ų | 81.4 | 47% | 0.474 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -73.8 | -41 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | G55 V61 | G55-G57 PolarHBondContact O-N 3.49Å; G57-V61 WeakPolarHBondContact O-CG2 3.2Å; G57-V61 PolarHBondContact O-N 3.18Å |
| 58 | M | 59.1 | Low | 61 | Low | 116 Ų | 116 | 80.7 Ų | 80.7 | 57% | 0.571 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -74.9 | -46.9 | -171.5 | -151.9 | -175.8 | -164 | 0 | 0 | 111.8 | A60 V61 W62 N98 | M58-A60 VanDerWaalsContact C-N 3.34Å; M58-A60 PolarHBondContact O-N 3.06Å; M58-V61 PolarHBondContact O-N 3.16Å; M58-W62 PolarHBondContact O-N 3.05Å; M58-W62 VanDerWaalsContact O-N 3.15Å; M58-N98 WeakPolarHBondContact CG-ND2 3.33Å |
| 59 | A | 63.5 | Low | 63.4 | Low | 57 Ų | 57 | 78.7 Ų | 78.7 | 47% | 0.471 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V61 W62 Q63 | A59-V61 PolarHBondContact O-N 2.5Å; A59-W62 PolarHBondContact O-N 2.99Å; A59-Q63 VanDerWaalsContact O-CG 3.32Å; A59-Q63 WeakPolarHBondContact O-CG 3Å; A59-Q63 PolarHBondContact O-N 3.07Å |
| 60 | A | 71.7 | Confident | 65.2 | Low | 39 Ų | 39 | 76.8 Ų | 76.8 | 32% | 0.322 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -66.1 | -35.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | R56 M58 Q64 | R56-A60 WeakPolarHBondContact O-CB 3.48Å; M58-A60 VanDerWaalsContact C-N 3.34Å; M58-A60 PolarHBondContact O-N 3.06Å; A60-Q64 WeakPolarHBondContact O-CG 3.32Å; A60-Q64 PolarHBondContact O-N 2.98Å; A60-Q64 VanDerWaalsContact O-N 3.16Å |
| 61 | V | 75.4 | Confident | 67.2 | Low | 21 Ų | 21 | 75.2 Ų | 75.2 | 13% | 0.127 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -70.7 | -40.6 | 176.4 | 176.2 | 0 | 0 | 0 | 0 | 111.1 | G57 M58 A59 Q63 Q64 V65 L94 N98 | G57-V61 WeakPolarHBondContact O-CG2 3.2Å; G57-V61 PolarHBondContact O-N 3.18Å; M58-V61 PolarHBondContact O-N 3.16Å; A59-V61 PolarHBondContact O-N 2.5Å; V61-Q63 VanDerWaalsContact C-N 3.32Å; V61-Q63 PolarHBondContact O-N 3.42Å; V61-Q64 WeakPolarHBondContact O-CB 3.46Å; V61-Q64 PolarHBondContact O-N 3.46Å; V61-Q64 VanDerWaalsContact O-N 3.13Å; V61-V65 HydrophobicContact CG1-CG2 4.46Å; V61-V65 WeakPolarHBondContact O-CG2 3.41Å; V61-V65 PolarHBondContact O-N 3.16Å; V61-L94 HydrophobicContact CG1-CB 4.09Å; V61-L94 HydrophobicContact CG1-CD2 4.47Å; V61-L94 WeakPolarHBondContact CG1-O 3.41Å; V61-N98 HydrophobicContact CB-CB 4.4Å; V61-N98 HydrophobicContact CG1-CB 3.83Å |
| 62 | W | 77.3 | Confident | 69.3 | Low | 124 Ų | 124 | 72.4 Ų | 72.4 | 47% | 0.47 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.5 | -39 | 174.9 | -76.4 | 113 | 0 | 0 | 0 | 112.4 | M58 A59 Q64 V65 L66 L95 | M58-W62 PolarHBondContact O-N 3.05Å; M58-W62 VanDerWaalsContact O-N 3.15Å; A59-W62 PolarHBondContact O-N 2.99Å; W62-Q64 VanDerWaalsContact C-N 3.31Å; W62-Q64 PolarHBondContact O-N 3.46Å; W62-V65 PolarHBondContact O-N 3.13Å; W62-L66 WeakPolarHBondContact O-CG 3.28Å; W62-L66 PolarHBondContact O-N 3.42Å; W62-L95 HydrophobicContact CH2-CD2 4.14Å; W62-L95 HydrophobicContact CZ3-CD2 4.36Å |
| 63 | Q | 79.5 | Confident | 71.1 | Confident | 64 Ų | 64 | 65.3 Ų | 65.3 | 30% | 0.299 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -59 | -42 | 171.8 | -72.4 | 170.7 | -3.7 | 0 | 0 | 112 | A46 A59 V61 L66 A67 | A46-Q63 PolarHBondContact O-NE2 3.23Å; A59-Q63 VanDerWaalsContact O-CG 3.32Å; A59-Q63 WeakPolarHBondContact O-CG 3Å; A59-Q63 PolarHBondContact O-N 3.07Å; V61-Q63 VanDerWaalsContact C-N 3.32Å; V61-Q63 PolarHBondContact O-N 3.42Å; Q63-L66 PolarHBondContact O-N 2.98Å; Q63-A67 WeakPolarHBondContact O-CB 3.17Å; Q63-A67 PolarHBondContact O-N 3.45Å |
| 64 | Q | 81.9 | Confident | 73.1 | Confident | 85 Ų | 85 | 66.2 Ų | 66.2 | 40% | 0.397 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.3 | -39.1 | 176.2 | -69.9 | 179.2 | 42.8 | 0 | 0 | 112.8 | A60 V61 W62 A67 V68 L94 | A60-Q64 WeakPolarHBondContact O-CG 3.32Å; A60-Q64 PolarHBondContact O-N 2.98Å; A60-Q64 VanDerWaalsContact O-N 3.16Å; V61-Q64 WeakPolarHBondContact O-CB 3.46Å; V61-Q64 PolarHBondContact O-N 3.46Å; V61-Q64 VanDerWaalsContact O-N 3.13Å; W62-Q64 VanDerWaalsContact C-N 3.31Å; W62-Q64 PolarHBondContact O-N 3.46Å; Q64-A67 PolarHBondContact O-N 2.96Å; Q64-V68 WeakPolarHBondContact O-CB 3.44Å; Q64-V68 VanDerWaalsContact O-CG2 3.28Å; Q64-V68 WeakPolarHBondContact O-CG2 3.38Å; Q64-V68 PolarHBondContact O-N 2.91Å; Q64-L94 HydrophobicContact CB-CD1 3.93Å; Q64-L94 HydrophobicContact CB-CD2 4.19Å |
| 65 | V | 83.5 | Confident | 74.5 | Confident | 4 Ų | 4 | 67.2 Ų | 67.2 | 2% | 0.024 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.9 | -48.4 | 175.4 | 170.7 | 0 | 0 | 0 | 0 | 110.3 | V61 W62 A67 V68 D69 R91 L94 L95 | V61-V65 HydrophobicContact CG1-CG2 4.46Å; V61-V65 WeakPolarHBondContact O-CG2 3.41Å; V61-V65 PolarHBondContact O-N 3.16Å; W62-V65 PolarHBondContact O-N 3.13Å; V65-A67 PolarHBondContact O-N 3.25Å; V65-V68 PolarHBondContact O-N 3.2Å; V65-D69 PolarHBondContact O-N 2.98Å; V65-R91 HydrophobicContact CG1-CG 4.35Å; V65-L94 HydrophobicContact CG2-CB 3.78Å; V65-L94 HydrophobicContact CG2-CD1 3.97Å; V65-L95 HydrophobicContact CG2-CD2 4.46Å |
| 66 | L | 83.9 | Confident | 75.6 | Confident | 110 Ų | 110 | 72.9 Ų | 72.9 | 58% | 0.576 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -62.8 | -41.2 | 179 | -69.7 | 171.5 | 0 | 0 | 0 | 112.3 | W62 Q63 V68 D69 A70 | W62-L66 WeakPolarHBondContact O-CG 3.28Å; W62-L66 PolarHBondContact O-N 3.42Å; Q63-L66 PolarHBondContact O-N 2.98Å; L66-V68 VanDerWaalsContact C-N 3.32Å; L66-V68 PolarHBondContact O-N 3.49Å; L66-D69 PolarHBondContact O-N 3.23Å; L66-A70 WeakPolarHBondContact O-CB 3.38Å; L66-A70 PolarHBondContact O-N 3.38Å |
| 67 | A | 84 | Confident | 76 | Confident | 43 Ų | 43 | 69.6 Ų | 69.6 | 36% | 0.355 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.9 | -38.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q63 Q64 V65 R71 | Q63-A67 WeakPolarHBondContact O-CB 3.17Å; Q63-A67 PolarHBondContact O-N 3.45Å; Q64-A67 PolarHBondContact O-N 2.96Å; V65-A67 PolarHBondContact O-N 3.25Å; A67-R71 WeakPolarHBondContact O-CB 3.49Å; A67-R71 PolarHBondContact O-N 3.39Å; A67-R71 VanDerWaalsContact O-N 3.08Å |
| 68 | V | 83.5 | Confident | 76.3 | Confident | 34 Ų | 34 | 73.5 Ų | 73.5 | 21% | 0.206 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -68.8 | -41.4 | 176.1 | 168.3 | 0 | 0 | 0 | 0 | 111.5 | Q64 V65 L66 Y72 Y87 R90 L94 | Q64-V68 WeakPolarHBondContact O-CB 3.44Å; Q64-V68 VanDerWaalsContact O-CG2 3.28Å; Q64-V68 WeakPolarHBondContact O-CG2 3.38Å; Q64-V68 PolarHBondContact O-N 2.91Å; V65-V68 PolarHBondContact O-N 3.2Å; L66-V68 VanDerWaalsContact C-N 3.32Å; L66-V68 PolarHBondContact O-N 3.49Å; V68-Y72 WeakPolarHBondContact O-CB 3.48Å; V68-Y72 PolarHBondContact O-N 3.04Å; V68-Y87 HydrophobicContact CG1-CD2 3.67Å; V68-Y87 HydrophobicContact CG1-CE2 4Å; V68-R90 HydrophobicContact CG1-CG 4.28Å; V68-R90 HydrophobicContact CG2-CG 3.99Å; V68-L94 HydrophobicContact CG2-CD1 4.36Å |
| 69 | D | 86 | Confident | 76.5 | Confident | 31 Ų | 31 | 72.6 Ų | 72.6 | 17% | 0.166 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.1 | -48 | 175.3 | -76.4 | -24.7 | 0 | 0 | 0 | 111.3 | V65 L66 R71 Y72 N73 Y87 R91 | V65-D69 PolarHBondContact O-N 2.98Å; L66-D69 PolarHBondContact O-N 3.23Å; D69-R71 PolarHBondContact O-N 2.99Å; D69-Y72 PolarHBondContact O-N 3.33Å; D69-N73 WeakPolarHBondContact O-CB 3.42Å; D69-N73 PolarHBondContact O-N 2.92Å; D69-Y87 WeakPolarHBondContact OD1-CE2 3.33Å; D69-Y87 PolarHBondContact OD1-OH 2.98Å; D69-R91 IonicContact OD1-NE 3.99Å |
| 70 | A | 82.9 | Confident | 76.4 | Confident | 20 Ų | 20 | 75.9 Ų | 75.9 | 17% | 0.165 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -64.4 | -41.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112 | L39 L66 N73 A74 | L39-A70 HydrophobicContact CD1-CB 3.75Å; L39-A70 HydrophobicContact CD2-CB 3.57Å; L39-A70 HydrophobicContact CG-CB 4.24Å; L66-A70 WeakPolarHBondContact O-CB 3.38Å; L66-A70 PolarHBondContact O-N 3.38Å; A70-N73 PolarHBondContact O-N 2.96Å; A70-A74 WeakPolarHBondContact O-CB 3.48Å; A70-A74 PolarHBondContact O-N 3.28Å |
| 71 | R | 82.1 | Confident | 76.3 | Confident | 111 Ų | 111 | 77.9 Ų | 77.9 | 42% | 0.419 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 173.4 | -175.8 | 175.7 | 174.6 | -169.8 | -6.5 | 111.7 | A67 D69 N73 A74 Y75 | A67-R71 WeakPolarHBondContact O-CB 3.49Å; A67-R71 PolarHBondContact O-N 3.39Å; A67-R71 VanDerWaalsContact O-N 3.08Å; D69-R71 PolarHBondContact O-N 2.99Å; R71-N73 VanDerWaalsContact C-N 3.33Å; R71-N73 PolarHBondContact O-N 3.47Å; R71-A74 PolarHBondContact O-N 3.31Å; R71-Y75 HydrophobicContact CG-CD2 3.92Å; R71-Y75 HydrophobicContact CG-CE2 4.08Å; R71-Y75 WeakPolarHBondContact O-CD2 3.36Å; R71-Y75 PolarHBondContact O-N 3.28Å |
| 72 | Y | 82.8 | Confident | 76.1 | Confident | 31 Ų | 31 | 82.3 Ų | 82.3 | 12% | 0.122 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -62.9 | -41.3 | 176.8 | 176.7 | -106.5 | 0 | 0 | 0 | 111.9 | V68 D69 Y75 R76 F83 R84 Y87 | V68-Y72 WeakPolarHBondContact O-CB 3.48Å; V68-Y72 PolarHBondContact O-N 3.04Å; D69-Y72 PolarHBondContact O-N 3.33Å; Y72-Y75 CarbonylContact O-C 3.59Å; Y72-Y75 PolarHBondContact O-N 3.35Å; Y72-R76 HydrophobicContact CD1-CG 4.48Å; Y72-R76 HydrophobicContact CE1-CG 4.06Å; Y72-R76 PolarHBondContact O-N 3.42Å; Y72-R76 VanDerWaalsContact O-N 3.16Å; Y72-F83 HydrophobicContact CD2-CD1 4.19Å; Y72-R84 HydrophobicContact CE2-CB 4.1Å; Y72-Y87 AromaticContact CD1-CD1 3.91Å; Y72-Y87 HydrophobicContact CD1-CD1 3.91Å; Y72-Y87 HydrophobicContact CD1-CD2 4.31Å; Y72-Y87 HydrophobicContact CD1-CE1 4.06Å; Y72-Y87 HydrophobicContact CD1-CE2 4.44Å; Y72-Y87 HydrophobicContact CD1-CG 4.05Å; Y72-Y87 HydrophobicContact CD2-CD1 4.14Å; Y72-Y87 HydrophobicContact CD2-CD2 4.37Å; Y72-Y87 AromaticContact CD2-CG 3.77Å; Y72-Y87 HydrophobicContact CD2-CG 3.77Å; Y72-Y87 HydrophobicContact CE1-CD1 4.06Å; Y72-Y87 HydrophobicContact CE1-CE1 4.26Å; Y72-Y87 HydrophobicContact CE2-CD1 4.3Å; Y72-Y87 HydrophobicContact CE2-CG 4.34Å; Y72-Y87 AromaticContact CG-CD1 3.94Å; Y72-Y87 HydrophobicContact CG-CD1 3.94Å; Y72-Y87 AromaticContact CG-CD2 3.84Å; Y72-Y87 HydrophobicContact CG-CD2 3.84Å; Y72-Y87 HydrophobicContact CG-CE1 4.45Å; Y72-Y87 HydrophobicContact CG-CE2 4.36Å; Y72-Y87 AromaticContact CG-CG 3.62Å; Y72-Y87 HydrophobicContact CG-CG 3.62Å |
| 73 | N | 82.6 | Confident | 76.1 | Confident | 96 Ų | 96 | 78.9 Ų | 78.9 | 51% | 0.513 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.9 | -37.4 | 177.6 | -74.9 | -15.9 | 0 | 0 | 0 | 112.4 | D69 A70 R71 Y75 | D69-N73 WeakPolarHBondContact O-CB 3.42Å; D69-N73 PolarHBondContact O-N 2.92Å; A70-N73 PolarHBondContact O-N 2.96Å; R71-N73 VanDerWaalsContact C-N 3.33Å; R71-N73 PolarHBondContact O-N 3.47Å; N73-Y75 VanDerWaalsContact C-N 3.35Å; N73-Y75 PolarHBondContact O-N 3.48Å |
| 74 | A | 80.8 | Confident | 76.1 | Confident | 74 Ų | 74 | 83.2 Ų | 83.2 | 61% | 0.612 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -68.9 | -29.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | A70 R71 | A70-A74 WeakPolarHBondContact O-CB 3.48Å; A70-A74 PolarHBondContact O-N 3.28Å; R71-A74 PolarHBondContact O-N 3.31Å |
| 75 | Y | 71.8 | Confident | 76.2 | Confident | 112 Ų | 112 | 82.1 Ų | 82.1 | 44% | 0.439 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.4 | 30.8 | -176.5 | -60.1 | -71.6 | 0 | 0 | 0 | 112.7 | R71 Y72 N73 T77 | R71-Y75 HydrophobicContact CG-CD2 3.92Å; R71-Y75 HydrophobicContact CG-CE2 4.08Å; R71-Y75 WeakPolarHBondContact O-CD2 3.36Å; R71-Y75 PolarHBondContact O-N 3.28Å; Y72-Y75 CarbonylContact O-C 3.59Å; Y72-Y75 PolarHBondContact O-N 3.35Å; N73-Y75 VanDerWaalsContact C-N 3.35Å; N73-Y75 PolarHBondContact O-N 3.48Å; Y75-T77 VanDerWaalsContact C-N 3.29Å; Y75-T77 PolarHBondContact O-N 3.37Å; Y75-T77 PolarHBondContact O-OG1 2.81Å |
| 76 | R | 67.8 | Low | 76.3 | Confident | 173 Ų | 173 | 87.6 Ų | 87.6 | 65% | 0.653 | 45% | 0.45 | S | S | * | . | trans | -65.5 | 91.1 | 173 | -96.2 | -161 | -170.2 | 176.8 | 5.1 | 109.7 | Y72 | Y72-R76 HydrophobicContact CD1-CG 4.48Å; Y72-R76 HydrophobicContact CE1-CG 4.06Å; Y72-R76 PolarHBondContact O-N 3.42Å; Y72-R76 VanDerWaalsContact O-N 3.16Å | ||
| 77 | T | 60.6 | Low | 76.4 | Confident | 70 Ų | 70 | 83.9 Ų | 83.9 | 43% | 0.429 | 43% | 0.428 | S | S | . | . | trans | -108.9 | 122.1 | 174.6 | -34.5 | 0 | 0 | 0 | 0 | 109.2 | Y75 T79 F80 | Y75-T77 VanDerWaalsContact C-N 3.29Å; Y75-T77 PolarHBondContact O-N 3.37Å; Y75-T77 PolarHBondContact O-OG1 2.81Å; T77-T79 PolarHBondContact O-N 2.95Å; T77-T79 VanDerWaalsContact O-N 3.14Å; T77-F80 HydrophobicContact CG2-CD2 4.31Å; T77-F80 PolarHBondContact O-N 3.47Å | ||
| 78 | P | 60.9 | Low | 76.6 | Confident | 128 Ų | 128 | 85.6 Ų | 85.6 | 83% | 0.831 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -19.7 | 176.2 | 24.3 | -31.7 | 0 | 0 | 0 | 112.5 | F80 | P78-F80 VanDerWaalsContact C-N 3.34Å; P78-F80 PolarHBondContact O-N 3.01Å |
| 79 | T | 64.8 | Low | 76.8 | Confident | 98 Ų | 98 | 91.9 Ų | 91.9 | 60% | 0.601 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -20.9 | -177.6 | -39.7 | 0 | 0 | 0 | 0 | 114.1 | T77 P81 | T77-T79 PolarHBondContact O-N 2.95Å; T77-T79 VanDerWaalsContact O-N 3.14Å; T79-P81 WeakPolarHBondContact O-CD 3.42Å |
| 80 | F | 61.2 | Low | 76.8 | Confident | 126 Ų | 126 | 95.7 Ų | 95.7 | 55% | 0.553 | 46% | 0.463 | S | S | * | . | trans | -127.5 | 78 | -173.9 | -62.5 | -70 | 0 | 0 | 0 | 112.1 | T77 P78 Q82 F83 | T77-F80 HydrophobicContact CG2-CD2 4.31Å; T77-F80 PolarHBondContact O-N 3.47Å; P78-F80 VanDerWaalsContact C-N 3.34Å; P78-F80 PolarHBondContact O-N 3.01Å; F80-Q82 PolarHBondContact O-N 3.15Å; F80-F83 WeakPolarHBondContact O-CB 3.37Å; F80-F83 PolarHBondContact O-N 3.27Å; F80-F83 VanDerWaalsContact O-N 3.07Å | ||
| 81 | P | 68.6 | Low | 77.1 | Confident | 81 Ų | 81 | 99.6 Ų | 99.6 | 53% | 0.526 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.7 | -21.6 | -176.9 | 24.2 | -34.1 | 0 | 0 | 0 | 113.5 | T79 F83 R84 | T79-P81 WeakPolarHBondContact O-CD 3.42Å; P81-F83 PolarHBondContact O-N 3.35Å; P81-R84 PolarHBondContact O-N 3.36Å |
| 82 | Q | 72.6 | Confident | 77.5 | Confident | 113 Ų | 113 | 96.2 Ų | 96.2 | 53% | 0.528 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.7 | -27.5 | 178.1 | -58.6 | 79.7 | 3.2 | 0 | 0 | 112.1 | F80 T85 Q86 | F80-Q82 PolarHBondContact O-N 3.15Å; Q82-T85 PolarHBondContact O-N 3.02Å; Q82-Q86 WeakPolarHBondContact O-CG 3.35Å; Q82-Q86 PolarHBondContact O-N 3.03Å |
| 83 | F | 75.5 | Confident | 77.7 | Confident | 53 Ų | 53 | 97.9 Ų | 97.9 | 23% | 0.232 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -66.2 | -40 | 179.7 | -138.3 | -100.1 | 0 | 0 | 0 | 111.5 | Y72 F80 P81 T85 Q86 Y87 | Y72-F83 HydrophobicContact CD2-CD1 4.19Å; F80-F83 WeakPolarHBondContact O-CB 3.37Å; F80-F83 PolarHBondContact O-N 3.27Å; F80-F83 VanDerWaalsContact O-N 3.07Å; P81-F83 PolarHBondContact O-N 3.35Å; F83-T85 VanDerWaalsContact C-N 3.34Å; F83-T85 PolarHBondContact O-N 3.31Å; F83-Q86 PolarHBondContact O-N 3.41Å; F83-Y87 WeakPolarHBondContact O-CB 3.34Å; F83-Y87 PolarHBondContact O-N 3.3Å |
| 84 | R | 79.4 | Confident | 77.8 | Confident | 155 Ų | 155 | 93.3 Ų | 93.3 | 59% | 0.585 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -60.5 | -44.2 | 173.2 | -179.8 | 177.1 | 179.5 | 153.3 | 0.4 | 111.4 | Y72 P81 Y87 I88 | Y72-R84 HydrophobicContact CE2-CB 4.1Å; P81-R84 PolarHBondContact O-N 3.36Å; R84-Y87 WeakPolarHBondContact O-CB 3.41Å; R84-Y87 PolarHBondContact O-N 2.98Å; R84-I88 HydrophobicContact CG-CD1 3.9Å; R84-I88 WeakPolarHBondContact O-CG1 3.45Å; R84-I88 PolarHBondContact O-N 3.09Å |
| 85 | T | 84.9 | Confident | 77.9 | Confident | 62 Ų | 62 | 93 Ų | 93 | 38% | 0.38 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -67.1 | -40.3 | -179.2 | -51 | 0 | 0 | 0 | 0 | 111.7 | Q82 F83 R89 | Q82-T85 PolarHBondContact O-N 3.02Å; F83-T85 VanDerWaalsContact C-N 3.34Å; F83-T85 PolarHBondContact O-N 3.31Å; T85-R89 WeakPolarHBondContact O-CB 3.38Å; T85-R89 WeakPolarHBondContact O-CG 3.48Å; T85-R89 PolarHBondContact O-N 2.79Å; T85-R89 VanDerWaalsContact O-N 3.09Å |
| 86 | Q | 84.6 | Confident | 78.5 | Confident | 119 Ų | 119 | 94.2 Ų | 94.2 | 56% | 0.556 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -64.1 | -43 | 174.9 | -69.7 | 175.4 | 37.4 | 0 | 0 | 111.8 | Q82 F83 R89 R90 | Q82-Q86 WeakPolarHBondContact O-CG 3.35Å; Q82-Q86 PolarHBondContact O-N 3.03Å; F83-Q86 PolarHBondContact O-N 3.41Å; Q86-R89 PolarHBondContact O-N 3.29Å; Q86-R90 PolarHBondContact O-N 2.95Å |
| 87 | Y | 87.5 | Confident | 79.1 | Confident | 32 Ų | 32 | 90 Ų | 90 | 13% | 0.125 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -57.1 | -54.1 | 174.7 | 161.9 | -107.8 | 0 | 0 | 0 | 112.3 | V68 D69 Y72 F83 R84 R89 R90 R91 | V68-Y87 HydrophobicContact CG1-CD2 3.67Å; V68-Y87 HydrophobicContact CG1-CE2 4Å; D69-Y87 WeakPolarHBondContact OD1-CE2 3.33Å; D69-Y87 PolarHBondContact OD1-OH 2.98Å; Y72-Y87 AromaticContact CD1-CD1 3.91Å; Y72-Y87 HydrophobicContact CD1-CD1 3.91Å; Y72-Y87 HydrophobicContact CD1-CD2 4.31Å; Y72-Y87 HydrophobicContact CD1-CE1 4.06Å; Y72-Y87 HydrophobicContact CD1-CE2 4.44Å; Y72-Y87 HydrophobicContact CD1-CG 4.05Å; Y72-Y87 HydrophobicContact CD2-CD1 4.14Å; Y72-Y87 HydrophobicContact CD2-CD2 4.37Å; Y72-Y87 AromaticContact CD2-CG 3.77Å; Y72-Y87 HydrophobicContact CD2-CG 3.77Å; Y72-Y87 HydrophobicContact CE1-CD1 4.06Å; Y72-Y87 HydrophobicContact CE1-CE1 4.26Å; Y72-Y87 HydrophobicContact CE2-CD1 4.3Å; Y72-Y87 HydrophobicContact CE2-CG 4.34Å; Y72-Y87 AromaticContact CG-CD1 3.94Å; Y72-Y87 HydrophobicContact CG-CD1 3.94Å; Y72-Y87 AromaticContact CG-CD2 3.84Å; Y72-Y87 HydrophobicContact CG-CD2 3.84Å; Y72-Y87 HydrophobicContact CG-CE1 4.45Å; Y72-Y87 HydrophobicContact CG-CE2 4.36Å; Y72-Y87 AromaticContact CG-CG 3.62Å; Y72-Y87 HydrophobicContact CG-CG 3.62Å; F83-Y87 WeakPolarHBondContact O-CB 3.34Å; F83-Y87 PolarHBondContact O-N 3.3Å; R84-Y87 WeakPolarHBondContact O-CB 3.41Å; R84-Y87 PolarHBondContact O-N 2.98Å; Y87-R89 VanDerWaalsContact C-N 3.29Å; Y87-R89 PolarHBondContact O-N 3.5Å; Y87-R90 PolarHBondContact O-N 3.44Å; Y87-R91 HydrophobicContact CE2-CB 4.33Å; Y87-R91 WeakPolarHBondContact O-CB 3.32Å; Y87-R91 PolarHBondContact O-N 2.98Å; Y87-R91 WeakPolarHBondContact OH-CD 3.45Å; Y87-R91 PolarHBondContact OH-NH1 3.4Å |
| 88 | I | 86.8 | Confident | 79.8 | Confident | 79 Ų | 79 | 87.5 Ų | 87.5 | 41% | 0.405 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -59.4 | -43.3 | -178.9 | -67.6 | 170.5 | 0 | 0 | 0 | 110.2 | R84 S92 | R84-I88 HydrophobicContact CG-CD1 3.9Å; R84-I88 WeakPolarHBondContact O-CG1 3.45Å; R84-I88 PolarHBondContact O-N 3.09Å; I88-S92 VanDerWaalsContact O-CB 3.27Å; I88-S92 WeakPolarHBondContact O-CB 3.27Å; I88-S92 PolarHBondContact O-N 2.79Å; I88-S92 PolarHBondContact O-OG 2.73Å |
| 89 | R | 88.4 | Confident | 80.5 | Confident | 166 Ų | 166 | 84.7 Ų | 84.7 | 63% | 0.626 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -59.6 | -51 | 177.4 | -80.2 | -167.6 | -109.4 | -117.3 | 7.9 | 111.9 | T85 Q86 Y87 S92 Q93 | T85-R89 WeakPolarHBondContact O-CB 3.38Å; T85-R89 WeakPolarHBondContact O-CG 3.48Å; T85-R89 PolarHBondContact O-N 2.79Å; T85-R89 VanDerWaalsContact O-N 3.09Å; Q86-R89 PolarHBondContact O-N 3.29Å; Y87-R89 VanDerWaalsContact C-N 3.29Å; Y87-R89 PolarHBondContact O-N 3.5Å; R89-S92 PolarHBondContact O-N 3.32Å; R89-Q93 WeakPolarHBondContact O-CB 3.28Å; R89-Q93 PolarHBondContact O-N 3.07Å |
| 90 | R | 87.1 | Confident | 80.7 | Confident | 111 Ų | 111 | 88.1 Ų | 88.1 | 42% | 0.419 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.5 | -45.2 | -178.4 | -178.7 | 61.1 | -178.7 | -150.2 | 4.5 | 112 | V68 Q86 Y87 S92 Q93 L94 | V68-R90 HydrophobicContact CG1-CG 4.28Å; V68-R90 HydrophobicContact CG2-CG 3.99Å; Q86-R90 PolarHBondContact O-N 2.95Å; Y87-R90 PolarHBondContact O-N 3.44Å; R90-S92 PolarHBondContact O-N 3.01Å; R90-Q93 PolarHBondContact O-N 3.23Å; R90-L94 HydrophobicContact CG-CD1 4.32Å; R90-L94 WeakPolarHBondContact O-CG 3.47Å; R90-L94 PolarHBondContact O-N 3.48Å |
| 91 | R | 89.1 | Confident | 80.8 | Confident | 101 Ų | 101 | 85.7 Ų | 85.7 | 38% | 0.381 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61 | -45.9 | 177.5 | -178.9 | 172.2 | 173.1 | -151.4 | -4 | 111.6 | V65 D69 Y87 Q93 L94 L95 | V65-R91 HydrophobicContact CG1-CG 4.35Å; D69-R91 IonicContact OD1-NE 3.99Å; Y87-R91 HydrophobicContact CE2-CB 4.33Å; Y87-R91 WeakPolarHBondContact O-CB 3.32Å; Y87-R91 PolarHBondContact O-N 2.98Å; Y87-R91 WeakPolarHBondContact OH-CD 3.45Å; Y87-R91 PolarHBondContact OH-NH1 3.4Å; R91-Q93 VanDerWaalsContact C-N 3.3Å; R91-Q93 PolarHBondContact O-N 3.44Å; R91-L94 PolarHBondContact O-N 2.86Å; R91-L95 HydrophobicContact CG-CD1 4.15Å; R91-L95 WeakPolarHBondContact O-CG 3.09Å; R91-L95 PolarHBondContact O-N 2.9Å |
| 92 | S | 90.7 | Very high | 80.3 | Confident | 40 Ų | 40 | 84.8 Ų | 84.8 | 28% | 0.28 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -64.3 | -36 | 178.6 | -56.4 | 0 | 0 | 0 | 0 | 112.4 | I88 R89 R90 R96 | I88-S92 VanDerWaalsContact O-CB 3.27Å; I88-S92 WeakPolarHBondContact O-CB 3.27Å; I88-S92 PolarHBondContact O-N 2.79Å; I88-S92 PolarHBondContact O-OG 2.73Å; R89-S92 PolarHBondContact O-N 3.32Å; R90-S92 PolarHBondContact O-N 3.01Å; S92-R96 WeakPolarHBondContact O-CG 3.34Å; S92-R96 PolarHBondContact O-N 3.38Å; S92-R96 VanDerWaalsContact O-N 3.08Å |
| 93 | Q | 85.3 | Confident | 79.3 | Confident | 66 Ų | 66 | 86 Ų | 86 | 31% | 0.308 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.2 | -50.5 | 174.6 | 177.4 | 175.2 | 3.2 | 0 | 0 | 111.2 | R89 R90 R91 L95 R96 E97 | R89-Q93 WeakPolarHBondContact O-CB 3.28Å; R89-Q93 PolarHBondContact O-N 3.07Å; R90-Q93 PolarHBondContact O-N 3.23Å; R91-Q93 VanDerWaalsContact C-N 3.3Å; R91-Q93 PolarHBondContact O-N 3.44Å; Q93-L95 VanDerWaalsContact C-N 3.31Å; Q93-L95 PolarHBondContact O-N 3.4Å; Q93-R96 PolarHBondContact O-N 2.87Å; Q93-R96 VanDerWaalsContact O-N 3.17Å; Q93-E97 HydrophobicContact CG-CG 4.36Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.38Å; Q93-E97 PolarHBondContact NE2-OE1 3.07Å; Q93-E97 WeakPolarHBondContact O-CB 3.38Å; Q93-E97 WeakPolarHBondContact O-CG 3.43Å; Q93-E97 PolarHBondContact O-N 3.17Å |
| 94 | L | 84.6 | Confident | 77.9 | Confident | 1 Ų | 1 | 88.2 Ų | 88.2 | 1% | 0.005 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -58.9 | -41.7 | 178.3 | -71.5 | 171.3 | 0 | 0 | 0 | 112.1 | V61 Q64 V65 V68 R90 R91 E97 N98 | V61-L94 HydrophobicContact CG1-CB 4.09Å; V61-L94 HydrophobicContact CG1-CD2 4.47Å; V61-L94 WeakPolarHBondContact CG1-O 3.41Å; Q64-L94 HydrophobicContact CB-CD1 3.93Å; Q64-L94 HydrophobicContact CB-CD2 4.19Å; V65-L94 HydrophobicContact CG2-CB 3.78Å; V65-L94 HydrophobicContact CG2-CD1 3.97Å; V68-L94 HydrophobicContact CG2-CD1 4.36Å; R90-L94 HydrophobicContact CG-CD1 4.32Å; R90-L94 WeakPolarHBondContact O-CG 3.47Å; R90-L94 PolarHBondContact O-N 3.48Å; R91-L94 PolarHBondContact O-N 2.86Å; L94-E97 PolarHBondContact O-N 3.08Å; L94-N98 WeakPolarHBondContact O-CB 3.49Å; L94-N98 PolarHBondContact O-N 3.32Å |
| 95 | L | 84.2 | Confident | 76.3 | Confident | 66 Ų | 66 | 86.4 Ų | 86.4 | 35% | 0.346 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.9 | -38.2 | 177.6 | -68.5 | 173.4 | 0 | 0 | 0 | 112.7 | W62 V65 R91 Q93 N98 A99 | W62-L95 HydrophobicContact CH2-CD2 4.14Å; W62-L95 HydrophobicContact CZ3-CD2 4.36Å; V65-L95 HydrophobicContact CG2-CD2 4.46Å; R91-L95 HydrophobicContact CG-CD1 4.15Å; R91-L95 WeakPolarHBondContact O-CG 3.09Å; R91-L95 PolarHBondContact O-N 2.9Å; Q93-L95 VanDerWaalsContact C-N 3.31Å; Q93-L95 PolarHBondContact O-N 3.4Å; L95-N98 WeakPolarHBondContact O-CB 3.29Å; L95-N98 PolarHBondContact O-N 3.37Å; L95-A99 PolarHBondContact O-N 2.88Å |
| 96 | R | 83.8 | Confident | 74.6 | Confident | 138 Ų | 138 | 87.8 Ų | 87.8 | 52% | 0.521 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -70.2 | -39.5 | 174.5 | -73.7 | -172.6 | -61.3 | -99 | 0.2 | 112.4 | S92 Q93 N98 A99 K100 | S92-R96 WeakPolarHBondContact O-CG 3.34Å; S92-R96 PolarHBondContact O-N 3.38Å; S92-R96 VanDerWaalsContact O-N 3.08Å; Q93-R96 PolarHBondContact O-N 2.87Å; Q93-R96 VanDerWaalsContact O-N 3.17Å; R96-N98 VanDerWaalsContact C-N 3.3Å; R96-A99 PolarHBondContact O-N 2.92Å; R96-K100 WeakPolarHBondContact O-CG 3.46Å; R96-K100 PolarHBondContact O-N 2.93Å |
| 97 | E | 79.4 | Confident | 72.5 | Confident | 85 Ų | 85 | 93.8 Ų | 93.8 | 40% | 0.397 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.6 | -39.9 | 174.3 | -73.3 | 170.1 | -174.1 | 0 | 0 | 110.7 | Q93 L94 K100 A101 | Q93-E97 HydrophobicContact CG-CG 4.36Å; Q93-E97 WeakPolarHBondContact CG-OE1 3.38Å; Q93-E97 PolarHBondContact NE2-OE1 3.07Å; Q93-E97 WeakPolarHBondContact O-CB 3.38Å; Q93-E97 WeakPolarHBondContact O-CG 3.43Å; Q93-E97 PolarHBondContact O-N 3.17Å; L94-E97 PolarHBondContact O-N 3.08Å; E97-K100 PolarHBondContact O-N 2.97Å; E97-A101 WeakPolarHBondContact O-CB 3.32Å; E97-A101 PolarHBondContact O-N 3.44Å |
| 98 | N | 75.4 | Confident | 71.8 | Confident | 18 Ų | 18 | 96.9 Ų | 96.9 | 10% | 0.096 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -60.5 | -47.4 | 172.2 | -167.2 | -103.3 | 0 | 0 | 0 | 112.3 | M58 V61 L94 L95 R96 K100 A101 G102 | M58-N98 WeakPolarHBondContact CG-ND2 3.33Å; V61-N98 HydrophobicContact CB-CB 4.4Å; V61-N98 HydrophobicContact CG1-CB 3.83Å; L94-N98 WeakPolarHBondContact O-CB 3.49Å; L94-N98 PolarHBondContact O-N 3.32Å; L95-N98 WeakPolarHBondContact O-CB 3.29Å; L95-N98 PolarHBondContact O-N 3.37Å; R96-N98 VanDerWaalsContact C-N 3.3Å; N98-K100 VanDerWaalsContact C-N 3.33Å; N98-K100 PolarHBondContact O-N 3.42Å; N98-A101 PolarHBondContact O-N 2.95Å; N98-G102 PolarHBondContact O-N 3.05Å; N98-G102 VanDerWaalsContact O-N 3.07Å |
| 99 | A | 75.9 | Confident | 71 | Confident | 68 Ų | 68 | 97.8 Ų | 97.8 | 56% | 0.562 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.2 | -38.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L95 R96 G102 | L95-A99 PolarHBondContact O-N 2.88Å; R96-A99 PolarHBondContact O-N 2.92Å; A99-G102 PolarHBondContact O-N 2.96Å |
| 100 | K | 68.9 | Low | 70 | Confident | 170 Ų | 170 | 94.1 Ų | 94.1 | 74% | 0.739 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.6 | -38.5 | 174.1 | -75.1 | -177.7 | 176.3 | -171.4 | 0 | 112.5 | R96 E97 N98 G102 H103 | R96-K100 WeakPolarHBondContact O-CG 3.46Å; R96-K100 PolarHBondContact O-N 2.93Å; E97-K100 PolarHBondContact O-N 2.97Å; N98-K100 VanDerWaalsContact C-N 3.33Å; N98-K100 PolarHBondContact O-N 3.42Å; K100-G102 PolarHBondContact O-N 2.92Å; K100-H103 PolarHBondContact O-N 3.06Å |
| 101 | A | 64.6 | Low | 69 | Low | 76 Ų | 76 | 93.1 Ų | 93.1 | 63% | 0.628 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -69.4 | -19.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | E97 N98 | E97-A101 WeakPolarHBondContact O-CB 3.32Å; E97-A101 PolarHBondContact O-N 3.44Å; N98-A101 PolarHBondContact O-N 2.95Å |
| 102 | G | 56.5 | Low | 67.8 | Low | 61 Ų | 61 | 92.6 Ų | 92.6 | 63% | 0.629 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.8 | -4.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | N98 A99 K100 P104 | N98-G102 PolarHBondContact O-N 3.05Å; N98-G102 VanDerWaalsContact O-N 3.07Å; A99-G102 PolarHBondContact O-N 2.96Å; K100-G102 PolarHBondContact O-N 2.92Å; G102-P104 WeakPolarHBondContact O-CD 3.46Å |
| 103 | H | 51.7 | Low | 66.3 | Low | 140 Ų | 140 | 96.1 Ų | 96.1 | 65% | 0.648 | 55% | 0.554 | S | S | * | * | trans | -110.9 | 95.9 | 176.3 | -153.7 | 81.1 | 0 | 0 | 0 | 108.5 | K100 | K100-H103 PolarHBondContact O-N 3.06Š| ||
| 104 | P | 46.8 | Very low | 64.9 | Low | 99 Ų | 99 | 98.2 Ų | 98.2 | 64% | 0.643 | 57% | 0.572 | S | S | * | * | trans | -55.3 | 136.2 | 164.5 | 25.2 | -31.2 | 0 | 0 | 0 | 107 | G102 A106 | G102-P104 WeakPolarHBondContact O-CD 3.46Å; P104-A106 PolarHBondContact O-N 3.35Å | ||
| 105 | P | 45.4 | Very low | 63.4 | Low | 117 Ų | 117 | 105.7 Ų | 105.7 | 76% | 0.76 | 62% | 0.615 | S | S | * | * | trans | -55.2 | 115.7 | 170.5 | 24.4 | -31.1 | 0 | 0 | 0 | 106.1 | L107 | P105-L107 PolarHBondContact O-N 2.99Š| ||
| 106 | A | 49.3 | Very low | 61.6 | Low | 90 Ų | 90 | 109 Ų | 109 | 74% | 0.744 | 64% | 0.638 | S | S | * | * | trans | -53.6 | 113.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 107.1 | P104 | P104-A106 PolarHBondContact O-N 3.35Š| ||
| 107 | L | 42.1 | Very low | 59.6 | Low | 246 Ų | 246 | 106.4 Ų | 106.4 | 100% | 1.288 | 65% | 0.649 | S | S | * | * | trans | -68.5 | 0 | 159.6 | -77.9 | 167.6 | 0 | 0 | 0 | 108.4 | P105 | P105-L107 PolarHBondContact O-N 2.99Š|
Retrieved 107 of 107 residues in 90.8 ms
(Link to these results)