| 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 | 33.1 | Very low | 37.2 | Very low | 240 Ų | 240 | 170.9 Ų | 170.9 | 100% | 1.182 | 86% | 0.859 | S | S | * | * | 0 | 113.2 | 0 | -75.9 | -159.7 | 174.9 | 0 | 0 | 108.8 | |||||
| 2 | L | 40.4 | Very low | 36.6 | Very low | 185 Ų | 185 | 173.3 Ų | 173.3 | 97% | 0.969 | 86% | 0.861 | S | S | * | * | trans | 178.9 | 91 | 159.1 | -99.6 | 149.3 | 0 | 0 | 0 | 107.5 | ||||
| 3 | S | 38 | Very low | 36.5 | Very low | 106 Ų | 106 | 168.5 Ų | 168.5 | 74% | 0.741 | 85% | 0.847 | S | S | * | * | trans | -142.2 | 104.9 | 160.1 | -176.4 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 4 | K | 44 | Very low | 35.9 | Very low | 213 Ų | 213 | 168 Ų | 168 | 93% | 0.926 | 84% | 0.84 | S | S | * | * | trans | -135.5 | 103.8 | 167.7 | -84.8 | -171.7 | 175.9 | 175.3 | 0 | 108.1 | ||||
| 5 | N | 32.8 | Very low | 35.8 | Very low | 155 Ų | 155 | 169.8 Ų | 169.8 | 83% | 0.829 | 84% | 0.841 | S | S | * | * | trans | -63.4 | 134.3 | 164.8 | -73.9 | -29.3 | 0 | 0 | 0 | 111 | ||||
| 6 | K | 38.9 | Very low | 35.4 | Very low | 202 Ų | 202 | 169.3 Ų | 169.3 | 88% | 0.878 | 84% | 0.835 | S | S | * | * | trans | -158.5 | 102.7 | 154.4 | -116.4 | 179.5 | 179.1 | -175.1 | 0 | 106 | ||||
| 7 | C | 29.5 | Very low | 35 | Very low | 125 Ų | 125 | 170 Ų | 170 | 85% | 0.845 | 83% | 0.832 | S | S | * | * | 54.4 | 92.3 | 88.9 | -167.1 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 8 | S | 37.8 | Very low | 34.4 | Very low | 99 Ų | 99 | 166.9 Ų | 166.9 | 69% | 0.692 | 83% | 0.829 | S | S | * | * | trans | -157.1 | 94.8 | 142.4 | -147.2 | 0 | 0 | 0 | 0 | 107.6 | D10 | S8-D10 PolarHBondContact OG-OD2 3.18Š| ||
| 9 | R | 41.2 | Very low | 34.1 | Very low | 252 Ų | 252 | 170.6 Ų | 170.6 | 95% | 0.951 | 83% | 0.832 | S | S | * | * | trans | -120.4 | 87 | 165.6 | -148.3 | 177.5 | -149.8 | 176.1 | 6.2 | 106.7 | ||||
| 10 | D | 37.3 | Very low | 33.8 | Very low | 120 Ų | 120 | 167.6 Ų | 167.6 | 64% | 0.642 | 83% | 0.829 | S | S | * | * | trans | -59.2 | 143.8 | 175.4 | -74.8 | -68.4 | 0 | 0 | 0 | 112.6 | S8 | S8-D10 PolarHBondContact OG-OD2 3.18Š| ||
| 11 | K | 36.3 | Very low | 33.8 | Very low | 183 Ų | 183 | 167.9 Ų | 167.9 | 80% | 0.796 | 83% | 0.828 | S | S | * | * | trans | 66.5 | 105.5 | 156.4 | -61.6 | 168.5 | -175.3 | -174 | 0 | 115.2 | ||||
| 12 | F | 30.1 | Very low | 33.8 | Very low | 200 Ų | 200 | 164.4 Ų | 164.4 | 88% | 0.877 | 81% | 0.809 | S | S | * | * | cis | 38.3 | 68.6 | 39.5 | -149.1 | -92.4 | 0 | 0 | 0 | 115 | ||||
| 13 | T | 34.6 | Very low | 33.5 | Very low | 111 Ų | 111 | 167.1 Ų | 167.1 | 68% | 0.681 | 81% | 0.806 | S | S | * | * | trans | -173.2 | 93.9 | 141.5 | 42.4 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 14 | E | 29.3 | Very low | 33.4 | Very low | 161 Ų | 161 | 168.1 Ų | 168.1 | 75% | 0.752 | 80% | 0.802 | S | S | * | * | 60.8 | 100 | 91.5 | -157.4 | -170.1 | 150.9 | 0 | 0 | 112.2 | |||||
| 15 | K | 33.1 | Very low | 33.2 | Very low | 195 Ų | 195 | 159.5 Ų | 159.5 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | trans | -175.7 | 100.7 | 137.6 | -102.9 | 168 | -175.2 | -179.1 | 0 | 111.4 | ||||
| 16 | H | 29.8 | Very low | 34 | Very low | 161 Ų | 161 | 157.8 Ų | 157.8 | 75% | 0.745 | 77% | 0.769 | S | S | * | * | trans | 46.7 | 111.3 | 130.1 | -82.6 | -96.1 | 0 | 0 | 0 | 120 | ||||
| 17 | K | 28.2 | Very low | 34.6 | Very low | 182 Ų | 182 | 151.5 Ų | 151.5 | 79% | 0.791 | 76% | 0.755 | S | S | * | * | 110.6 | 123.8 | 109.2 | -165.2 | 159 | -174.8 | 174 | 0 | 117.8 | |||||
| 18 | C | 24.9 | Very low | 35.8 | Very low | 114 Ų | 114 | 150.2 Ų | 150.2 | 77% | 0.77 | 74% | 0.739 | S | S | * | * | trans | 68.3 | 84.8 | 157.2 | -75.5 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 19 | R | 28.5 | Very low | 36.5 | Very low | 238 Ų | 238 | 151.4 Ų | 151.4 | 90% | 0.898 | 74% | 0.738 | S | S | * | * | trans | -99 | 115.1 | 143.3 | -169 | 169.3 | -175.8 | 161.8 | -0.9 | 107.9 | E21 | R19-E21 PolarHBondContact O-N 3.26Š| ||
| 20 | S | 28.6 | Very low | 37.1 | Very low | 110 Ų | 110 | 145 Ų | 145 | 77% | 0.769 | 72% | 0.721 | S | S | * | * | trans | -58.5 | 114 | 169.4 | 50.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 21 | E | 32.6 | Very low | 37.9 | Very low | 173 Ų | 173 | 141.9 Ų | 141.9 | 81% | 0.808 | 71% | 0.713 | S | S | * | * | trans | -98.2 | 108.2 | 160.2 | -82.5 | 178.8 | 111.7 | 0 | 0 | 108.6 | R19 | R19-E21 PolarHBondContact O-N 3.26Š| ||
| 22 | E | 33 | Very low | 38.6 | Very low | 167 Ų | 167 | 135.5 Ų | 135.5 | 78% | 0.78 | 69% | 0.694 | S | S | * | * | trans | 52.3 | 86.7 | 139.1 | -69.7 | 168.6 | 122.9 | 0 | 0 | 117.7 | I24 | E22-I24 PolarHBondContact O-N 3.09Š| ||
| 23 | R | 34.9 | Very low | 39.7 | Very low | 242 Ų | 242 | 131.8 Ų | 131.8 | 91% | 0.913 | 68% | 0.679 | S | S | * | * | trans | -55.7 | 96.8 | 155.1 | -173 | -171.3 | -61.1 | -135.4 | 1.4 | 109 | G25 | R23-G25 PolarHBondContact O-N 2.9Å; R23-G25 VanDerWaalsContact O-N 3.15Å | ||
| 24 | I | 35.7 | Very low | 40.6 | Very low | 128 Ų | 128 | 136.5 Ų | 136.5 | 66% | 0.656 | 68% | 0.684 | S | S | * | * | trans | -49.5 | 119.8 | 164.6 | -63.5 | 169.3 | 0 | 0 | 0 | 107.2 | E22 D28 | E22-I24 PolarHBondContact O-N 3.09Å; I24-D28 HydrophobicContact CG2-CB 3.94Å | ||
| 25 | G | 39.5 | Very low | 41.3 | Very low | 32 Ų | 32 | 137.3 Ų | 137.3 | 33% | 0.33 | 69% | 0.685 | S | S | . | * | trans | -63.8 | 145.4 | -169.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | R23 A27 D28 | R23-G25 PolarHBondContact O-N 2.9Å; R23-G25 VanDerWaalsContact O-N 3.15Å; G25-A27 PolarHBondContact O-N 3.29Å; G25-D28 PolarHBondContact O-N 2.8Å | ||
| 26 | T | 49.3 | Very low | 41.9 | Very low | 119 Ų | 119 | 135.5 Ų | 135.5 | 73% | 0.73 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -54.4 | -19.9 | 171.5 | 46.9 | 0 | 0 | 0 | 0 | 113.3 | L30 | T26-L30 PolarHBondContact O-N 2.64Å |
| 27 | A | 53.4 | Low | 42.9 | Very low | 69 Ų | 69 | 133 Ų | 133 | 57% | 0.57 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -65.4 | -36.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | G25 L30 A31 | G25-A27 PolarHBondContact O-N 3.29Å; A27-L30 PolarHBondContact O-N 3.35Å; A27-A31 WeakPolarHBondContact O-CB 3.37Å; A27-A31 PolarHBondContact O-N 2.99Å |
| 28 | D | 52.8 | Low | 43.7 | Very low | 98 Ų | 98 | 126.7 Ų | 126.7 | 52% | 0.524 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -74.8 | -34.1 | -180 | -65.9 | -39.3 | 0 | 0 | 0 | 111.7 | I24 G25 A31 A32 | I24-D28 HydrophobicContact CG2-CB 3.94Å; G25-D28 PolarHBondContact O-N 2.8Å; D28-A31 PolarHBondContact O-N 2.99Å; D28-A32 VanDerWaalsContact O-CB 3.28Å; D28-A32 WeakPolarHBondContact O-CB 3.21Å; D28-A32 PolarHBondContact O-N 2.94Å |
| 29 | L | 53.3 | Low | 44.6 | Very low | 125 Ų | 125 | 128.7 Ų | 128.7 | 65% | 0.654 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -67.1 | -37.5 | 172.2 | -90.7 | 164 | 0 | 0 | 0 | 112.1 | H33 | L29-H33 VanDerWaalsContact O-CB 3.28Å; L29-H33 WeakPolarHBondContact O-CB 3.44Å; L29-H33 PolarHBondContact O-N 2.71Å |
| 30 | L | 53.9 | Low | 45.2 | Very low | 117 Ų | 117 | 120.8 Ų | 120.8 | 61% | 0.613 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -69.4 | -37.2 | 172.8 | -87.5 | 163.2 | 0 | 0 | 0 | 112.1 | T26 A27 H33 R34 | T26-L30 PolarHBondContact O-N 2.64Å; A27-L30 PolarHBondContact O-N 3.35Å; L30-H33 PolarHBondContact O-N 2.75Å; L30-R34 WeakPolarHBondContact O-CG 3.18Å; L30-R34 PolarHBondContact O-N 3.18Å |
| 31 | A | 53.2 | Low | 45.8 | Very low | 55 Ų | 55 | 119.3 Ų | 119.3 | 46% | 0.455 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -65.3 | -44.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | A27 D28 R34 F35 | A27-A31 WeakPolarHBondContact O-CB 3.37Å; A27-A31 PolarHBondContact O-N 2.99Å; D28-A31 PolarHBondContact O-N 2.99Å; A31-R34 PolarHBondContact O-N 3.1Å; A31-F35 PolarHBondContact O-N 3.06Å |
| 32 | A | 51.8 | Low | 45.9 | Very low | 48 Ų | 48 | 119.3 Ų | 119.3 | 40% | 0.397 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.6 | -40.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | D28 R34 F35 M36 | D28-A32 VanDerWaalsContact O-CB 3.28Å; D28-A32 WeakPolarHBondContact O-CB 3.21Å; D28-A32 PolarHBondContact O-N 2.94Å; A32-R34 VanDerWaalsContact C-N 3.35Å; A32-R34 PolarHBondContact O-N 3.07Å; A32-F35 CarbonylContact O-C 3.6Å; A32-F35 PolarHBondContact O-N 3.1Å; A32-F35 VanDerWaalsContact O-N 3.14Å; A32-M36 PolarHBondContact O-N 3.46Å |
| 33 | H | 53.1 | Low | 46.3 | Very low | 122 Ų | 122 | 118.8 Ų | 118.8 | 57% | 0.565 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67 | -33.5 | 176.1 | -167.7 | -89.9 | 0 | 0 | 0 | 112.5 | L29 L30 Q37 | L29-H33 VanDerWaalsContact O-CB 3.28Å; L29-H33 WeakPolarHBondContact O-CB 3.44Å; L29-H33 PolarHBondContact O-N 2.71Å; L30-H33 PolarHBondContact O-N 2.75Å; H33-Q37 WeakPolarHBondContact O-CG 3.42Å |
| 34 | R | 52.9 | Low | 46.7 | Very low | 211 Ų | 211 | 111.2 Ų | 111.2 | 80% | 0.796 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -71.1 | -30.5 | 170.3 | -72.2 | -154.7 | -170.7 | -133.8 | 6.3 | 113 | L30 A31 A32 | L30-R34 WeakPolarHBondContact O-CG 3.18Å; L30-R34 PolarHBondContact O-N 3.18Å; A31-R34 PolarHBondContact O-N 3.1Å; A32-R34 VanDerWaalsContact C-N 3.35Å; A32-R34 PolarHBondContact O-N 3.07Å |
| 35 | F | 45 | Very low | 47.1 | Very low | 177 Ų | 177 | 109 Ų | 109 | 78% | 0.776 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -77.7 | -19 | 176.4 | -122.6 | -88.3 | 0 | 0 | 0 | 114 | A31 A32 P38 | A31-F35 PolarHBondContact O-N 3.06Å; A32-F35 CarbonylContact O-C 3.6Å; A32-F35 PolarHBondContact O-N 3.1Å; A32-F35 VanDerWaalsContact O-N 3.14Å; F35-P38 VanDerWaalsContact C-CD 3.49Å; F35-P38 WeakPolarHBondContact O-CD 3.48Å; F35-P38 VanDerWaalsContact O-CG 3.28Å; F35-P38 WeakPolarHBondContact O-CG 2.99Å |
| 36 | M | 46.7 | Very low | 47.2 | Very low | 157 Ų | 157 | 112.2 Ų | 112.2 | 77% | 0.773 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -94.2 | -7.2 | 178.3 | -78.7 | -177 | 153.8 | 0 | 0 | 115.1 | A32 P38 | A32-M36 PolarHBondContact O-N 3.46Å; M36-P38 VanDerWaalsContact C-N 3.3Å; M36-P38 WeakPolarHBondContact O-CD 2.96Å |
| 37 | Q | 49.4 | Very low | 46.8 | Very low | 109 Ų | 109 | 109.1 Ų | 109.1 | 51% | 0.509 | 58% | 0.575 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.3 | -0.9 | 169.3 | -68.1 | -106.5 | -74.4 | 0 | 0 | 117.2 | H33 L39 T41 | H33-Q37 WeakPolarHBondContact O-CG 3.42Å; Q37-L39 VanDerWaalsContact C-N 3.35Å; Q37-L39 PolarHBondContact O-N 3.21Å; Q37-T41 PolarHBondContact O-OG1 2.9Å; Q37-T41 VanDerWaalsContact O-OG1 3.11Å |
| 38 | P | 46.4 | Very low | 46.4 | Very low | 50 Ų | 50 | 111.8 Ų | 111.8 | 33% | 0.325 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.6 | -24.8 | 175.4 | -26.8 | 36.8 | 0 | 0 | 0 | 115.6 | F35 M36 S40 T41 W42 | F35-P38 VanDerWaalsContact C-CD 3.49Å; F35-P38 WeakPolarHBondContact O-CD 3.48Å; F35-P38 VanDerWaalsContact O-CG 3.28Å; F35-P38 WeakPolarHBondContact O-CG 2.99Å; M36-P38 VanDerWaalsContact C-N 3.3Å; M36-P38 WeakPolarHBondContact O-CD 2.96Å; P38-S40 PolarHBondContact O-N 3.07Å; P38-T41 PolarHBondContact O-OG1 3.4Å; P38-W42 VanDerWaalsContact O-CB 3.25Å; P38-W42 WeakPolarHBondContact O-CB 3.45Å; P38-W42 PolarHBondContact O-N 3.02Å |
| 39 | L | 42.5 | Very low | 46.2 | Very low | 156 Ų | 156 | 109.9 Ų | 109.9 | 82% | 0.817 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -68.5 | -34.8 | -173.7 | -77.1 | 164.8 | 0 | 0 | 0 | 113.8 | Q37 | Q37-L39 VanDerWaalsContact C-N 3.35Å; Q37-L39 PolarHBondContact O-N 3.21Å |
| 40 | S | 42.1 | Very low | 45.9 | Very low | 72 Ų | 72 | 106.9 Ų | 106.9 | 50% | 0.503 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -81.4 | -35.7 | 178.3 | 59.1 | 0 | 0 | 0 | 0 | 113 | P38 | P38-S40 PolarHBondContact O-N 3.07Å |
| 41 | T | 40.8 | Very low | 45.5 | Very low | 78 Ų | 78 | 105.9 Ų | 105.9 | 48% | 0.479 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -77.6 | -28.1 | -178.4 | 53.8 | 0 | 0 | 0 | 0 | 113 | Q37 P38 V44 S45 | Q37-T41 PolarHBondContact O-OG1 2.9Å; Q37-T41 VanDerWaalsContact O-OG1 3.11Å; P38-T41 PolarHBondContact O-OG1 3.4Å; T41-V44 PolarHBondContact O-N 3.48Å; T41-S45 VanDerWaalsContact O-CB 3.28Å; T41-S45 WeakPolarHBondContact O-CB 3.28Å; T41-S45 PolarHBondContact O-N 3.37Å |
| 42 | W | 35 | Very low | 45 | Very low | 174 Ų | 174 | 106.8 Ų | 106.8 | 66% | 0.659 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -68 | -35.6 | 175.6 | -84.5 | 67.3 | 0 | 0 | 0 | 112.9 | P38 S45 M46 | P38-W42 VanDerWaalsContact O-CB 3.25Å; P38-W42 WeakPolarHBondContact O-CB 3.45Å; P38-W42 PolarHBondContact O-N 3.02Å; W42-S45 PolarHBondContact O-N 2.98Å; W42-M46 PolarHBondContact O-N 3.11Å |
| 43 | H | 41.7 | Very low | 44.9 | Very low | 156 Ų | 156 | 108.6 Ų | 108.6 | 72% | 0.722 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.9 | -40 | 176.1 | -123.6 | -92.2 | 0 | 0 | 0 | 112 | S47 | H43-S47 PolarHBondContact O-N 3.47Å; H43-S47 PolarHBondContact O-OG 2.88Å |
| 44 | V | 42.9 | Very low | 44.5 | Very low | 83 Ų | 83 | 106.3 Ų | 106.3 | 50% | 0.503 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -71.2 | -35.3 | 176.8 | 179.4 | 0 | 0 | 0 | 0 | 111.8 | T41 S47 H48 | T41-V44 PolarHBondContact O-N 3.48Å; V44-S47 PolarHBondContact O-OG 2.76Å; V44-H48 WeakPolarHBondContact O-CB 3.32Å; V44-H48 PolarHBondContact O-CD2 2.87Å; V44-H48 PolarHBondContact O-N 3.32Å |
| 45 | S | 43.3 | Very low | 44 | Very low | 81 Ų | 81 | 103 Ų | 103 | 57% | 0.566 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -71.4 | -38.4 | 178.6 | -171 | 0 | 0 | 0 | 0 | 112.3 | T41 W42 S49 | T41-S45 VanDerWaalsContact O-CB 3.28Å; T41-S45 WeakPolarHBondContact O-CB 3.28Å; T41-S45 PolarHBondContact O-N 3.37Å; W42-S45 PolarHBondContact O-N 2.98Å; S45-S49 WeakPolarHBondContact O-CB 3.43Å; S45-S49 PolarHBondContact O-N 2.99Å |
| 46 | M | 41.1 | Very low | 44.2 | Very low | 100 Ų | 100 | 100.4 Ų | 100.4 | 49% | 0.493 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.3 | -46.7 | 175 | -85.3 | 178.1 | 65.3 | 0 | 0 | 111.6 | W42 H48 S49 V50 | W42-M46 PolarHBondContact O-N 3.11Å; M46-H48 PolarHBondContact O-N 3.07Å; M46-S49 PolarHBondContact O-N 2.72Å; M46-S49 PolarHBondContact O-OG 2.71Å; M46-V50 WeakPolarHBondContact O-CG2 3.47Å; M46-V50 PolarHBondContact O-N 2.76Å |
| 47 | S | 41.7 | Very low | 43.9 | Very low | 53 Ų | 53 | 98 Ų | 98 | 37% | 0.371 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.9 | -46.8 | 175.9 | 55 | 0 | 0 | 0 | 0 | 111.6 | H43 V44 S49 V50 D51 | H43-S47 PolarHBondContact O-N 3.47Å; H43-S47 PolarHBondContact O-OG 2.88Å; V44-S47 PolarHBondContact O-OG 2.76Å; S47-S49 PolarHBondContact O-N 3.42Å; S47-V50 PolarHBondContact O-N 3.41Å; S47-V50 VanDerWaalsContact O-N 3.13Å; S47-D51 WeakPolarHBondContact O-CB 3.29Å; S47-D51 VanDerWaalsContact O-CG 3.27Å; S47-D51 PolarHBondContact O-N 2.82Å |
| 48 | H | 44.9 | Very low | 43.5 | Very low | 126 Ų | 126 | 100.6 Ų | 100.6 | 58% | 0.583 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.4 | -32.8 | 173.2 | -96.3 | -104.5 | 0 | 0 | 0 | 113 | V44 M46 C52 | V44-H48 WeakPolarHBondContact O-CB 3.32Å; V44-H48 PolarHBondContact O-CD2 2.87Å; V44-H48 PolarHBondContact O-N 3.32Å; M46-H48 PolarHBondContact O-N 3.07Å; H48-C52 WeakPolarHBondContact O-CA 3.35Å; H48-C52 WeakPolarHBondContact O-CB 3.48Å; H48-C52 PolarHBondContact O-N 3.48Å |
| 49 | S | 48.2 | Very low | 42.7 | Very low | 58 Ų | 58 | 105.3 Ų | 105.3 | 41% | 0.406 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -71.6 | -36 | 177.2 | 75.5 | 0 | 0 | 0 | 0 | 112.8 | S45 M46 S47 M53 | S45-S49 WeakPolarHBondContact O-CB 3.43Å; S45-S49 PolarHBondContact O-N 2.99Å; M46-S49 PolarHBondContact O-N 2.72Å; M46-S49 PolarHBondContact O-OG 2.71Å; S47-S49 PolarHBondContact O-N 3.42Å; S49-M53 WeakPolarHBondContact O-CB 3.37Å; S49-M53 PolarHBondContact O-N 2.93Å |
| 50 | V | 48.2 | Very low | 42.3 | Very low | 61 Ų | 61 | 103 Ų | 103 | 37% | 0.37 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -75.3 | -40.8 | 176 | -156.9 | 0 | 0 | 0 | 0 | 110.5 | M46 S47 M53 S54 M254 | M46-V50 WeakPolarHBondContact O-CG2 3.47Å; M46-V50 PolarHBondContact O-N 2.76Å; S47-V50 PolarHBondContact O-N 3.41Å; S47-V50 VanDerWaalsContact O-N 3.13Å; V50-M53 PolarHBondContact O-N 3.09Å; V50-S54 WeakPolarHBondContact O-CB 3.27Å; V50-S54 PolarHBondContact O-N 3.4Å; V50-M254 HydrophobicContact CG1-CE 4.46Å |
| 51 | D | 44.4 | Very low | 41.8 | Very low | 97 Ų | 97 | 105.7 Ų | 105.7 | 52% | 0.519 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -68.5 | -43.1 | 177.7 | -67.5 | -31.1 | 0 | 0 | 0 | 111.3 | S47 M53 S54 Q55 | S47-D51 WeakPolarHBondContact O-CB 3.29Å; S47-D51 VanDerWaalsContact O-CG 3.27Å; S47-D51 PolarHBondContact O-N 2.82Å; D51-M53 VanDerWaalsContact C-N 3.3Å; D51-M53 PolarHBondContact O-N 3.3Å; D51-S54 CarbonylContact O-C 3.59Å; D51-S54 PolarHBondContact O-N 3.17Å; D51-S54 VanDerWaalsContact O-N 3.17Å; D51-Q55 VanDerWaalsContact O-CB 3.29Å; D51-Q55 WeakPolarHBondContact O-CB 3.18Å; D51-Q55 PolarHBondContact O-N 2.96Å |
| 52 | C | 43.3 | Very low | 41.3 | Very low | 73 Ų | 73 | 105 Ų | 105 | 49% | 0.493 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.6 | -36.4 | 174.9 | -175.8 | 0 | 0 | 0 | 0 | 111.9 | H48 Q55 M56 | H48-C52 WeakPolarHBondContact O-CA 3.35Å; H48-C52 WeakPolarHBondContact O-CB 3.48Å; H48-C52 PolarHBondContact O-N 3.48Å; C52-Q55 PolarHBondContact O-N 3.02Å; C52-M56 PolarHBondContact O-N 3.5Å |
| 53 | M | 49.1 | Very low | 41.2 | Very low | 87 Ų | 87 | 102.2 Ų | 102.2 | 43% | 0.429 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -68.6 | -41 | 174.4 | -147.1 | 91.1 | 70.8 | 0 | 0 | 111.3 | S49 V50 D51 Q55 M254 | S49-M53 WeakPolarHBondContact O-CB 3.37Å; S49-M53 PolarHBondContact O-N 2.93Å; V50-M53 PolarHBondContact O-N 3.09Å; D51-M53 VanDerWaalsContact C-N 3.3Å; D51-M53 PolarHBondContact O-N 3.3Å; M53-Q55 VanDerWaalsContact C-N 3.3Å; M53-Q55 PolarHBondContact O-N 3.36Å; M53-M254 HydrophobicContact CE-SD 3.83Å |
| 54 | S | 45.5 | Very low | 40.9 | Very low | 73 Ų | 73 | 99 Ų | 99 | 51% | 0.51 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -68.2 | -28.8 | 176.8 | -167.8 | 0 | 0 | 0 | 0 | 112.7 | V50 D51 | V50-S54 WeakPolarHBondContact O-CB 3.27Å; V50-S54 PolarHBondContact O-N 3.4Å; D51-S54 CarbonylContact O-C 3.59Å; D51-S54 PolarHBondContact O-N 3.17Å; D51-S54 VanDerWaalsContact O-N 3.17Å |
| 55 | Q | 41.2 | Very low | 40.5 | Very low | 143 Ų | 143 | 100.7 Ų | 100.7 | 67% | 0.668 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -84.5 | -20.6 | -177.3 | -149.2 | 168.3 | 19.5 | 0 | 0 | 112.6 | D51 C52 M53 D57 H58 | D51-Q55 VanDerWaalsContact O-CB 3.29Å; D51-Q55 WeakPolarHBondContact O-CB 3.18Å; D51-Q55 PolarHBondContact O-N 2.96Å; C52-Q55 PolarHBondContact O-N 3.02Å; M53-Q55 VanDerWaalsContact C-N 3.3Å; M53-Q55 PolarHBondContact O-N 3.36Å; Q55-D57 VanDerWaalsContact C-N 3.27Å; Q55-D57 PolarHBondContact O-N 2.85Å; Q55-H58 PolarHBondContact O-N 3.48Å |
| 56 | M | 49.1 | Very low | 39.7 | Very low | 121 Ų | 121 | 100 Ų | 100 | 60% | 0.596 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -70.9 | -17.8 | 173.9 | -90.6 | 179.9 | 109.3 | 0 | 0 | 114 | C52 H58 L59 | C52-M56 PolarHBondContact O-N 3.5Å; M56-H58 PolarHBondContact O-N 3.33Å; M56-L59 PolarHBondContact O-N 3.03Å |
| 57 | D | 40.8 | Very low | 39.3 | Very low | 107 Ų | 107 | 102 Ų | 102 | 57% | 0.572 | 60% | 0.596 | S | S | * | * | G | 310 helix | trans | -64.3 | -17 | 175.1 | -79.7 | -34.9 | 0 | 0 | 0 | 112.9 | Q55 | Q55-D57 VanDerWaalsContact C-N 3.27Å; Q55-D57 PolarHBondContact O-N 2.85Å |
| 58 | H | 41.4 | Very low | 38.7 | Very low | 164 Ų | 164 | 106.3 Ų | 106.3 | 76% | 0.759 | 61% | 0.614 | S | S | * | * | G | 310 helix | trans | -94.2 | -7 | -179.1 | -73.5 | -65.5 | 0 | 0 | 0 | 115.6 | Q55 M56 | Q55-H58 PolarHBondContact O-N 3.48Å; M56-H58 PolarHBondContact O-N 3.33Å |
| 59 | L | 30.3 | Very low | 37.9 | Very low | 149 Ų | 149 | 109.6 Ų | 109.6 | 78% | 0.78 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -115.6 | 8.3 | -170.7 | -70.5 | 176.4 | 0 | 0 | 0 | 115.8 | M56 P61 | M56-L59 PolarHBondContact O-N 3.03Å; L59-P61 WeakPolarHBondContact O-CD 3.48Å |
| 60 | L | 33.8 | Very low | 36.8 | Very low | 108 Ų | 108 | 113.9 Ų | 113.9 | 57% | 0.565 | 65% | 0.648 | S | S | * | * | trans | -89.5 | 117.8 | 168 | -76.9 | 174.6 | 0 | 0 | 0 | 111.1 | G62 | L60-G62 PolarHBondContact O-N 3.33Š| ||
| 61 | P | 31 | Very low | 35.6 | Very low | 128 Ų | 128 | 117 Ų | 117 | 83% | 0.831 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | 127 | 171.4 | 21.1 | -16.1 | 0 | 0 | 0 | 109.4 | L59 | L59-P61 WeakPolarHBondContact O-CD 3.48Š|
| 62 | G | 30.9 | Very low | 34.8 | Very low | 62 Ų | 62 | 120.6 Ų | 120.6 | 64% | 0.639 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 112.6 | 17.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | L60 V64 | L60-G62 PolarHBondContact O-N 3.33Å; G62-V64 PolarHBondContact O-N 3.23Å |
| 63 | I | 33.1 | Very low | 33.9 | Very low | 116 Ų | 116 | 125.8 Ų | 125.8 | 60% | 0.595 | 70% | 0.704 | S | S | * | * | trans | -64.1 | 106.6 | 163.5 | -69.7 | 173.8 | 0 | 0 | 0 | 107.9 | T65 | I63-T65 PolarHBondContact O-N 2.93Š| ||
| 64 | V | 34.8 | Very low | 32.9 | Very low | 90 Ų | 90 | 130.6 Ų | 130.6 | 55% | 0.545 | 73% | 0.725 | S | S | . | * | trans | -64.8 | 102.9 | 160.1 | -177.3 | 0 | 0 | 0 | 0 | 105.9 | G62 K158 | G62-V64 PolarHBondContact O-N 3.23Å; V64-K158 VanDerWaalsContact CG1-NZ 3.28Å | ||
| 65 | T | 33.9 | Very low | 31.9 | Very low | 118 Ų | 118 | 136.6 Ų | 136.6 | 72% | 0.724 | 74% | 0.742 | S | S | * | * | trans | -52.8 | 143 | 168.7 | 45.3 | 0 | 0 | 0 | 0 | 109.5 | I63 | I63-T65 PolarHBondContact O-N 2.93Š| ||
| 66 | G | 26.8 | Very low | 31.1 | Very low | 67 Ų | 67 | 138.2 Ų | 138.2 | 69% | 0.691 | 75% | 0.75 | S | S | * | * | trans | -53.3 | 145.7 | -163.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 67 | V | 32 | Very low | 30 | Very low | 142 Ų | 142 | 138.3 Ų | 138.3 | 86% | 0.861 | 76% | 0.757 | S | S | * | * | trans | -108.9 | 104.4 | 139.3 | -176 | 0 | 0 | 0 | 0 | 103.7 | E69 | V67-E69 PolarHBondContact O-N 3.4Š| ||
| 68 | D | 30.7 | Very low | 29.2 | Very low | 142 Ų | 142 | 140.7 Ų | 140.7 | 76% | 0.759 | 77% | 0.77 | S | S | * | * | trans | -54.7 | 135 | 165.7 | -72.5 | -62.4 | 0 | 0 | 0 | 108.4 | L70 | D68-L70 VanDerWaalsContact C-N 3.3Å; D68-L70 PolarHBondContact O-N 3.47Å | ||
| 69 | E | 26.6 | Very low | 28.5 | Very low | 195 Ų | 195 | 138.1 Ų | 138.1 | 91% | 0.911 | 78% | 0.777 | S | S | * | * | trans | -62.3 | 92.4 | 172.8 | -78.2 | -170.2 | 85.1 | 0 | 0 | 109.2 | V67 | V67-E69 PolarHBondContact O-N 3.4Š| ||
| 70 | L | 25.7 | Very low | 28.4 | Very low | 149 Ų | 149 | 134.9 Ų | 134.9 | 78% | 0.78 | 78% | 0.78 | S | S | * | * | trans | -120.5 | 117.6 | 158.1 | -96.8 | 163.8 | 0 | 0 | 0 | 108.1 | D68 L72 | D68-L70 VanDerWaalsContact C-N 3.3Å; D68-L70 PolarHBondContact O-N 3.47Å; L70-L72 PolarHBondContact O-N 2.99Å; L70-L72 VanDerWaalsContact O-N 3.16Å | ||
| 71 | P | 24.1 | Very low | 28.1 | Very low | 125 Ų | 125 | 138.5 Ų | 138.5 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -63.1 | 115.4 | 179.7 | -19.4 | 31.2 | 0 | 0 | 0 | 110.4 | Q73 | P71-Q73 PolarHBondContact O-N 2.97Š| ||
| 72 | L | 27.6 | Very low | 28 | Very low | 174 Ų | 174 | 142.3 Ų | 142.3 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | -85.6 | 105.8 | 173.1 | -107.3 | 159.2 | 0 | 0 | 0 | 109.4 | L70 | L70-L72 PolarHBondContact O-N 2.99Å; L70-L72 VanDerWaalsContact O-N 3.16Å | ||
| 73 | Q | 23.8 | Very low | 27.7 | Very low | 181 Ų | 181 | 145 Ų | 145 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | trans | -58.4 | 129.2 | 166.6 | -146.1 | 142.4 | -21.3 | 0 | 0 | 109.5 | P71 K75 | P71-Q73 PolarHBondContact O-N 2.97Å; Q73-K75 PolarHBondContact O-N 3.44Å; Q73-K75 VanDerWaalsContact O-N 3.17Å | ||
| 74 | E | 27 | Very low | 27.6 | Very low | 188 Ų | 188 | 145.3 Ų | 145.3 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | trans | -59 | 111.5 | 179.5 | -162.3 | 157.3 | 114.3 | 0 | 0 | 110.4 | ||||
| 75 | K | 25.6 | Very low | 27.2 | Very low | 199 Ų | 199 | 145.4 Ų | 145.4 | 87% | 0.865 | 81% | 0.811 | S | S | * | * | trans | -129.3 | 111.8 | 167.2 | -162.2 | 172.1 | -177 | -178.6 | 0 | 110.2 | Q73 | Q73-K75 PolarHBondContact O-N 3.44Å; Q73-K75 VanDerWaalsContact O-N 3.17Å | ||
| 76 | Q | 23.3 | Very low | 27.3 | Very low | 177 Ų | 177 | 149.7 Ų | 149.7 | 83% | 0.827 | 82% | 0.82 | S | S | * | * | trans | -62 | 128.4 | 177.8 | -57.5 | 169.8 | -45.6 | 0 | 0 | 111.5 | ||||
| 77 | V | 27.8 | Very low | 27.2 | Very low | 124 Ų | 124 | 153.2 Ų | 153.2 | 75% | 0.752 | 83% | 0.828 | S | S | * | * | trans | -152 | 112.4 | 150.8 | -175.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 78 | N | 22.8 | Very low | 27.4 | Very low | 157 Ų | 157 | 151 Ų | 151 | 84% | 0.84 | 83% | 0.825 | S | S | * | * | trans | 33.3 | 119.8 | 144.3 | -60.1 | -24.8 | 0 | 0 | 0 | 122.8 | ||||
| 79 | A | 27.8 | Very low | 27.3 | Very low | 109 Ų | 109 | 152 Ų | 152 | 90% | 0.901 | 83% | 0.83 | S | S | * | * | trans | -70.8 | 129.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 80 | G | 27 | Very low | 27.4 | Very low | 82 Ų | 82 | 152.1 Ų | 152.1 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | -106 | 117 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 81 | Q | 28.8 | Very low | 27.8 | Very low | 184 Ų | 184 | 149.6 Ų | 149.6 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | trans | -72.1 | 143.1 | -175.4 | -171.6 | 164.8 | -0.8 | 0 | 0 | 112.7 | ||||
| 82 | K | 27.6 | Very low | 28 | Very low | 208 Ų | 208 | 151.3 Ų | 151.3 | 90% | 0.904 | 82% | 0.822 | S | S | * | * | trans | -168 | 105.1 | 143.1 | -104.5 | 166.1 | -169.6 | -175.5 | 0 | 111.6 | ||||
| 83 | D | 24.1 | Very low | 28.5 | Very low | 119 Ų | 119 | 148.8 Ų | 148.8 | 64% | 0.636 | 82% | 0.816 | S | S | * | * | trans | -79.2 | 145.3 | 162.3 | -170.2 | -84.7 | 0 | 0 | 0 | 108.9 | S85 | D83-S85 WeakPolarHBondContact OD1-CB 3.16Å; D83-S85 PolarHBondContact OD1-N 3.03Å; D83-S85 PolarHBondContact OD1-OG 3Å | ||
| 84 | P | 31.5 | Very low | 28.9 | Very low | 122 Ų | 122 | 148.3 Ų | 148.3 | 79% | 0.792 | 82% | 0.818 | S | S | * | * | -139.9 | 107 | 113.4 | 30.3 | -12.6 | 0 | 0 | 0 | 112.3 | |||||
| 85 | S | 27.7 | Very low | 29.3 | Very low | 91 Ų | 91 | 145.4 Ų | 145.4 | 64% | 0.636 | 82% | 0.816 | S | S | * | * | 18.2 | 118.7 | 120.4 | -63.8 | 0 | 0 | 0 | 0 | 116.2 | D83 | D83-S85 WeakPolarHBondContact OD1-CB 3.16Å; D83-S85 PolarHBondContact OD1-N 3.03Å; D83-S85 PolarHBondContact OD1-OG 3Å | |||
| 86 | K | 34.5 | Very low | 29.6 | Very low | 208 Ų | 208 | 139.1 Ų | 139.1 | 90% | 0.904 | 81% | 0.807 | S | S | * | * | trans | -163.4 | 116.4 | 132.7 | -106.3 | 167.5 | -171.5 | -174.9 | 0 | 111.7 | ||||
| 87 | T | 25.1 | Very low | 30.2 | Very low | 141 Ų | 141 | 138.7 Ų | 138.7 | 87% | 0.865 | 81% | 0.81 | S | S | * | * | trans | -60.6 | 138.1 | 164.8 | 42.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 88 | A | 35.8 | Very low | 30.4 | Very low | 96 Ų | 96 | 144.6 Ų | 144.6 | 79% | 0.793 | 82% | 0.819 | S | S | * | * | trans | -153.4 | 94.9 | 155.7 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 89 | D | 28.7 | Very low | 31.2 | Very low | 164 Ų | 164 | 142 Ų | 142 | 88% | 0.877 | 82% | 0.82 | S | S | * | * | 75.8 | 128.1 | 93 | -158.2 | -92 | 0 | 0 | 0 | 113.1 | |||||
| 90 | Y | 28.9 | Very low | 31.6 | Very low | 196 Ų | 196 | 142.3 Ų | 142.3 | 77% | 0.769 | 82% | 0.815 | S | S | * | * | trans | -105.3 | 111.9 | -157 | -161.8 | -91.4 | 0 | 0 | 0 | 107.2 | Q92 | Y90-Q92 HydrophobicContact CD1-CB 4.44Å; Y90-Q92 HydrophobicContact CE1-CB 4.4Å | ||
| 91 | A | 35.2 | Very low | 32.3 | Very low | 97 Ų | 97 | 144.4 Ų | 144.4 | 80% | 0.802 | 82% | 0.817 | S | S | * | * | trans | -106.9 | 107.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 92 | Q | 28.7 | Very low | 32.7 | Very low | 161 Ų | 161 | 140.4 Ų | 140.4 | 75% | 0.752 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -97.7 | 124.1 | 174.6 | -172.3 | 179.1 | -71.5 | 0 | 0 | 109.4 | Y90 | Y90-Q92 HydrophobicContact CD1-CB 4.44Å; Y90-Q92 HydrophobicContact CE1-CB 4.4Å |
| 93 | P | 36.8 | Very low | 33.2 | Very low | 121 Ų | 121 | 135.9 Ų | 135.9 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 155.2 | 165.4 | -14.7 | 32.6 | 0 | 0 | 0 | 114.4 | ||
| 94 | L | 33.2 | Very low | 34.1 | Very low | 171 Ų | 171 | 135.5 Ų | 135.5 | 90% | 0.895 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 167.1 | -161.7 | -73.2 | 158.1 | 0 | 0 | 0 | 116.5 | ||
| 95 | P | 35.4 | Very low | 34.5 | Very low | 127 Ų | 127 | 135.8 Ų | 135.8 | 83% | 0.825 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -100 | 144.6 | -173.6 | 37.2 | -29.9 | 0 | 0 | 0 | 115 | ||
| 96 | G | 31.1 | Very low | 35.3 | Very low | 67 Ų | 67 | 141 Ų | 141 | 69% | 0.691 | 83% | 0.83 | S | S | * | * | trans | 165.4 | 130 | 170.1 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 97 | D | 35.9 | Very low | 35.6 | Very low | 167 Ų | 167 | 136.9 Ų | 136.9 | 89% | 0.893 | 83% | 0.827 | S | S | * | * | cis | -151.5 | 158.8 | 37 | -85.3 | -55.1 | 0 | 0 | 0 | 112.5 | ||||
| 98 | R | 32.3 | Very low | 36.4 | Very low | 249 Ų | 249 | 135.5 Ų | 135.5 | 94% | 0.94 | 83% | 0.83 | S | S | * | * | trans | -54.3 | 139.4 | 166.7 | -80.9 | 172.7 | 164.6 | 161.7 | -4.6 | 112.5 | ||||
| 99 | A | 39.7 | Very low | 36.4 | Very low | 102 Ų | 102 | 134.8 Ų | 134.8 | 84% | 0.843 | 83% | 0.831 | S | S | * | * | trans | -163.1 | 137.9 | 130.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 100 | S | 34.8 | Very low | 36.8 | Very low | 116 Ų | 116 | 131.2 Ų | 131.2 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | trans | -55.3 | 146.6 | -176.5 | -48.1 | 0 | 0 | 0 | 0 | 116 | ||||
| 101 | S | 43.4 | Very low | 37.4 | Very low | 126 Ų | 126 | 131 Ų | 131 | 88% | 0.881 | 83% | 0.827 | S | S | * | * | -173.2 | 128.3 | 118.7 | -79.9 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 102 | A | 36.4 | Very low | 38 | Very low | 99 Ų | 99 | 131.3 Ų | 131.3 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | trans | -77.5 | 140.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 103 | S | 38.7 | Very low | 39.6 | Very low | 114 Ų | 114 | 129 Ų | 129 | 80% | 0.797 | 82% | 0.821 | S | S | * | * | 171.9 | 139.8 | 120.5 | 49 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 104 | S | 41.4 | Very low | 41.5 | Very low | 111 Ų | 111 | 125.4 Ų | 125.4 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | 90.9 | 104.3 | 165.8 | -56 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 105 | P | 41.6 | Very low | 44.1 | Very low | 128 Ų | 128 | 121.3 Ų | 121.3 | 83% | 0.831 | 78% | 0.781 | S | S | * | * | trans | -86.7 | 114.9 | 172.1 | 32.7 | -26.3 | 0 | 0 | 0 | 109.8 | ||||
| 106 | K | 43 | Very low | 46.9 | Very low | 201 Ų | 201 | 118.6 Ų | 118.6 | 87% | 0.874 | 76% | 0.758 | S | S | * | * | trans | -129.5 | 106.8 | 154 | -69.9 | -155 | 174.9 | -174.7 | 0 | 109.1 | ||||
| 107 | S | 42.2 | Very low | 50.1 | Low | 121 Ų | 121 | 115.4 Ų | 115.4 | 85% | 0.846 | 73% | 0.726 | S | S | * | * | trans | 58.9 | 78.7 | 157.5 | -50.7 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 108 | A | 41.9 | Very low | 52.9 | Low | 112 Ų | 112 | 109.1 Ų | 109.1 | 93% | 0.926 | 69% | 0.689 | S | S | * | * | trans | -67.4 | 125.9 | 151.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 109 | G | 34.5 | Very low | 56 | Low | 80 Ų | 80 | 100.3 Ų | 100.3 | 83% | 0.825 | 66% | 0.66 | S | S | * | * | trans | 129.4 | 60.3 | 167.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 110 | S | 37.3 | Very low | 58.7 | Low | 89 Ų | 89 | 97.6 Ų | 97.6 | 62% | 0.622 | 64% | 0.635 | S | S | * | * | trans | 169.5 | 80.3 | 130.5 | -166 | 0 | 0 | 0 | 0 | 108.1 | T112 | S110-T112 PolarHBondContact O-N 3.35Å; S110-T112 WeakPolarHBondContact OG-CG2 3.3Å | ||
| 111 | M | 41.2 | Very low | 61.5 | Low | 191 Ų | 191 | 98.8 Ų | 98.8 | 94% | 0.941 | 63% | 0.627 | S | S | * | * | trans | -71.7 | 67.9 | 154.5 | -67.9 | -92.6 | 97.7 | 0 | 0 | 105.8 | S113 | M111-S113 VanDerWaalsContact C-N 3.35Å; M111-S113 PolarHBondContact O-N 3.16Å | ||
| 112 | T | 48.6 | Very low | 64 | Low | 105 Ų | 105 | 96 Ų | 96 | 64% | 0.644 | 61% | 0.607 | S | S | * | * | trans | -54.5 | 115.5 | 155.1 | 49.6 | 0 | 0 | 0 | 0 | 103.5 | S110 A114 | S110-T112 PolarHBondContact O-N 3.35Å; S110-T112 WeakPolarHBondContact OG-CG2 3.3Å; T112-A114 PolarHBondContact O-N 2.9Å | ||
| 113 | S | 61.8 | Low | 66.8 | Low | 112 Ų | 112 | 97.2 Ų | 97.2 | 78% | 0.783 | 60% | 0.596 | S | S | * | * | trans | -56.4 | 84.9 | 175.9 | 52.2 | 0 | 0 | 0 | 0 | 107.9 | M111 D115 | M111-S113 VanDerWaalsContact C-N 3.35Å; M111-S113 PolarHBondContact O-N 3.16Å; S113-D115 PolarHBondContact O-N 3.38Å | ||
| 114 | A | 76.7 | Confident | 69.4 | Low | 45 Ų | 45 | 94.3 Ų | 94.3 | 37% | 0.372 | 58% | 0.578 | S | S | . | * | trans | -65.8 | 130.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 105.6 | T112 I116 E123 | T112-A114 PolarHBondContact O-N 2.9Å; A114-I116 PolarHBondContact O-N 2.78Å; A114-E123 HydrophobicContact CB-CG 4.24Å | ||
| 115 | D | 87.9 | Confident | 71.8 | Confident | 86 Ų | 86 | 92.6 Ų | 92.6 | 46% | 0.46 | 56% | 0.563 | S | S | . | * | trans | -57.4 | 127.1 | 173 | -67.6 | -38.5 | 0 | 0 | 0 | 107.9 | S113 L130 F142 | S113-D115 PolarHBondContact O-N 3.38Å; D115-L130 VanDerWaalsContact C-CD1 3.4Å; D115-L130 HydrophobicContact CB-CD1 3.87Å; D115-L130 WeakPolarHBondContact O-CD1 3.43Å; D115-F142 HydrophobicContact CB-CB 4.48Å; D115-F142 HydrophobicContact CB-CD1 4.31Å; D115-F142 HydrophobicContact CB-CD2 3.65Å; D115-F142 HydrophobicContact CB-CE1 4.46Å; D115-F142 HydrophobicContact CB-CE2 3.83Å; D115-F142 HydrophobicContact CB-CG 3.9Å; D115-F142 HydrophobicContact CB-CZ 4.21Å; D115-F142 VanDerWaalsContact CG-CZ 3.43Å; D115-F142 WeakPolarHBondContact OD1-CD2 3.34Å; D115-F142 WeakPolarHBondContact OD1-CE2 3.17Å; D115-F142 WeakPolarHBondContact OD2-CE2 3.33Å; D115-F142 WeakPolarHBondContact OD2-CZ 3.27Å | ||
| 116 | I | 94.8 | Very high | 74.1 | Confident | 69 Ų | 69 | 94.6 Ų | 94.6 | 35% | 0.354 | 57% | 0.567 | S | S | . | * | B | Isolated β-bridge | trans | -113.8 | 151.2 | 178.8 | 55.7 | 166.2 | 0 | 0 | 0 | 110 | A114 R118 E123 | A114-I116 PolarHBondContact O-N 2.78Å; I116-R118 PolarHBondContact O-N 3.22Å; I116-E123 HydrophobicContact CG2-CG 3.86Å |
| 117 | C | 97.2 | Very high | 76.4 | Confident | 0 Ų | 0 | 92.7 Ų | 92.7 | 0% | 0 | 57% | 0.566 | C | S | . | * | trans | -67.8 | 124.6 | 174.5 | 178.1 | 0 | 0 | 0 | 0 | 110.9 | I119 H121 C122 L130 H144 | C117-I119 PolarHBondContact O-N 3.04Å; C117-I119 VanDerWaalsContact O-N 3.09Å; C117-H121 WeakPolarHBondContact O-CA 3.35Å; C117-H121 PolarHBondContact O-N 3.35Å; C117-C122 WeakPolarHBondContact CB-O 3.43Å; C117-C122 PolarHBondContact N-O 2.93Å; C117-L130 HydrophobicContact CB-CD2 3.64Å; C117-H144 WeakPolarHBondContact CB-CE1 3.36Å; C117-H144 VanDerWaalsContact CB-ND1 3.27Å; C117-H144 WeakPolarHBondContact CB-ND1 3.38Å; C117-H144 PolarHBondContact SG-N 2.88Å; C117-H144 VanDerWaalsContact SG-N 3.41Å; C117-H144 PolarHBondContact SG-ND1 3.49Å; C117-H144 VanDerWaalsContact SG-ND1 3.4Å | ||
| 118 | R | 95.7 | Very high | 78.8 | Confident | 35 Ų | 35 | 87.4 Ų | 87.4 | 13% | 0.132 | 53% | 0.53 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -16 | 178.2 | 82.6 | 179.1 | -174.8 | -129 | -3.2 | 115.4 | I116 H121 S139 L140 F142 | I116-R118 PolarHBondContact O-N 3.22Å; R118-H121 PolarHBondContact O-NE2 3.26Å; R118-S139 VanDerWaalsContact CB-O 3.32Å; R118-S139 WeakPolarHBondContact CB-O 3.41Å; R118-L140 WeakPolarHBondContact CD-O 3.27Å; R118-L140 PolarHBondContact NH1-O 2.96Å; R118-F142 PolarHBondContact N-O 2.84Å |
| 119 | I | 96.1 | Very high | 81.3 | Confident | 65 Ų | 65 | 85.8 Ų | 85.8 | 33% | 0.333 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.4 | -46.8 | -175.1 | -60.3 | -177.7 | 0 | 0 | 0 | 111.1 | C117 V143 C147 W151 | C117-I119 PolarHBondContact O-N 3.04Å; C117-I119 VanDerWaalsContact O-N 3.09Å; I119-V143 HydrophobicContact CD1-CG2 3.5Å; I119-V143 HydrophobicContact CG1-CG2 3.9Å; I119-C147 HydrophobicContact CB-CB 4Å; I119-C147 HydrophobicContact CD1-CB 4.04Å; I119-C147 HydrophobicContact CG2-CB 4.11Å; I119-W151 HydrophobicContact CD1-CB 3.99Å; I119-W151 HydrophobicContact CD1-CG 4.36Å |
| 120 | C | 96.5 | Very high | 84.2 | Confident | 44 Ų | 44 | 83.5 Ų | 83.5 | 30% | 0.297 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.1 | -3.8 | -177.1 | 76.3 | 0 | 0 | 0 | 0 | 114 | C122 H144 | C120-C122 PolarHBondContact O-N 2.9Å; C120-C122 VanDerWaalsContact O-N 3.11Å; C120-C122 PolarHBondContact O-SG 2.78Å; C120-C122 VanDerWaalsContact O-SG 3.36Å; C120-C122 VanDerWaalsContact SG-SG 3.66Å; C120-H144 VanDerWaalsContact SG-CE1 3.51Å; C120-H144 PolarHBondContact SG-ND1 3.48Å |
| 121 | H | 95.3 | Very high | 87 | Confident | 142 Ų | 142 | 80.2 Ų | 80.2 | 66% | 0.657 | 45% | 0.454 | S | S | * | . | trans | 55.3 | 25 | -178.3 | -51 | 142.8 | 0 | 0 | 0 | 114.6 | C117 R118 | C117-H121 WeakPolarHBondContact O-CA 3.35Å; C117-H121 PolarHBondContact O-N 3.35Å; R118-H121 PolarHBondContact O-NE2 3.26Å | ||
| 122 | C | 95.2 | Very high | 89.6 | Confident | 67 Ų | 67 | 71.8 Ų | 71.8 | 45% | 0.453 | 42% | 0.415 | S | S | . | . | P | Polyproline II helix | trans | -101 | 150.5 | 172.3 | -50 | 0 | 0 | 0 | 0 | 110.5 | C117 C120 H144 | C117-C122 WeakPolarHBondContact CB-O 3.43Å; C117-C122 PolarHBondContact N-O 2.93Å; C120-C122 PolarHBondContact O-N 2.9Å; C120-C122 VanDerWaalsContact O-N 3.11Å; C120-C122 PolarHBondContact O-SG 2.78Å; C120-C122 VanDerWaalsContact O-SG 3.36Å; C120-C122 VanDerWaalsContact SG-SG 3.66Å; C122-H144 PolarHBondContact O-CE1 2.72Å |
| 123 | E | 94.7 | Very high | 91.9 | Very high | 125 Ų | 125 | 66.8 Ų | 66.8 | 58% | 0.584 | 38% | 0.384 | S | S | * | . | B | Isolated β-bridge | trans | -65 | 166.9 | 174.3 | -65.3 | 174 | -175.7 | 0 | 0 | 112.4 | A114 I116 H144 | A114-E123 HydrophobicContact CB-CG 4.24Å; I116-E123 HydrophobicContact CG2-CG 3.86Å; E123-H144 PolarHBondContact O-CE1 3.46Å; E123-H144 PolarHBondContact O-NE2 2.86Å |
| 124 | A | 93.1 | Very high | 93.5 | Very high | 52 Ų | 52 | 61.5 Ų | 61.5 | 43% | 0.43 | 35% | 0.347 | S | S | . | . | P | Polyproline II helix | trans | -65.8 | 138.2 | 168 | 0 | 0 | 0 | 0 | 0 | 110.5 | L130 | A124-L130 HydrophobicContact CB-CB 4.39Å; A124-L130 HydrophobicContact CB-CD1 3.84Å; A124-L130 HydrophobicContact CB-CG 3.79Å |
| 125 | T | 92.1 | Very high | 94.4 | Very high | 75 Ų | 75 | 63.6 Ų | 63.6 | 46% | 0.46 | 35% | 0.346 | S | S | . | . | B | Isolated β-bridge | trans | -118.7 | 162.5 | 166.4 | 70.3 | 0 | 0 | 0 | 0 | 109.6 | D127 A128 P129 | T125-D127 PolarHBondContact O-N 3.24Å; T125-A128 PolarHBondContact N-O 3.18Å; T125-A128 CarbonylContact O-C 3.57Å; T125-A128 PolarHBondContact O-N 3.32Å; T125-A128 WeakPolarHBondContact OG1-CB 3.32Å; T125-A128 PolarHBondContact OG1-N 2.98Å; T125-P129 VanDerWaalsContact O-N 3.16Å |
| 126 | N | 89.9 | Confident | 94.8 | Very high | 170 Ų | 170 | 60 Ų | 60 | 91% | 0.909 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | -35 | 175.9 | -70.6 | -47.3 | 0 | 0 | 0 | 112.3 | ||
| 127 | D | 91.6 | Very high | 94.7 | Very high | 161 Ų | 161 | 61.6 Ų | 61.6 | 86% | 0.861 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -20.2 | 177.8 | -60.6 | -49.8 | 0 | 0 | 0 | 113.6 | T125 | T125-D127 PolarHBondContact O-N 3.24Š|
| 128 | A | 92.5 | Very high | 94.5 | Very high | 11 Ų | 11 | 64.4 Ų | 64.4 | 9% | 0.091 | 37% | 0.373 | C | S | . | . | B | Isolated β-bridge | trans | -137.3 | 75.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | T125 H144 | T125-A128 PolarHBondContact N-O 3.18Å; T125-A128 CarbonylContact O-C 3.57Å; T125-A128 PolarHBondContact O-N 3.32Å; T125-A128 WeakPolarHBondContact OG1-CB 3.32Å; T125-A128 PolarHBondContact OG1-N 2.98Å; A128-H144 PolarHBondContact O-CD2 3.45Å; A128-H144 PolarHBondContact O-NE2 2.98Å |
| 129 | P | 94.5 | Very high | 94.2 | Very high | 78 Ų | 78 | 67 Ų | 67 | 51% | 0.506 | 40% | 0.397 | S | S | . | . | trans | -68.4 | 158.3 | 176.3 | 29.2 | -35.4 | 0 | 0 | 0 | 111.2 | T125 | T125-P129 VanDerWaalsContact O-N 3.16Š| ||
| 130 | L | 95.9 | Very high | 94.1 | Very high | 31 Ų | 31 | 67.3 Ų | 67.3 | 16% | 0.162 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 143.8 | 172.6 | -68.4 | 168.8 | 0 | 0 | 0 | 110.6 | D115 C117 A124 F142 | D115-L130 VanDerWaalsContact C-CD1 3.4Å; D115-L130 HydrophobicContact CB-CD1 3.87Å; D115-L130 WeakPolarHBondContact O-CD1 3.43Å; C117-L130 HydrophobicContact CB-CD2 3.64Å; A124-L130 HydrophobicContact CB-CB 4.39Å; A124-L130 HydrophobicContact CB-CD1 3.84Å; A124-L130 HydrophobicContact CB-CG 3.79Å; L130-F142 HydrophobicContact CB-CB 4.24Å; L130-F142 HydrophobicContact CB-CD1 4.37Å; L130-F142 HydrophobicContact CD1-CB 4.12Å; L130-F142 HydrophobicContact CD2-CB 4.34Å; L130-F142 HydrophobicContact CG-CB 4.47Å |
| 131 | I | 96 | Very high | 94 | Very high | 21 Ų | 21 | 68.8 Ų | 68.8 | 11% | 0.108 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 156.2 | 172.3 | 59 | 157 | 0 | 0 | 0 | 110 | P133 F142 V143 L148 V271 N273 | I131-P133 HydrophobicContact CD1-CB 4.31Å; I131-P133 VanDerWaalsContact O-CD 3.3Å; I131-P133 WeakPolarHBondContact O-CD 3.43Å; I131-F142 WeakPolarHBondContact O-CA 3.19Å; I131-V143 HydrophobicContact CG1-CG1 4.11Å; I131-V143 WeakPolarHBondContact CG1-O 3.46Å; I131-V143 PolarHBondContact N-O 3.48Å; I131-V143 PolarHBondContact O-N 2.81Å; I131-L148 HydrophobicContact CD1-CD2 4.01Å; I131-V271 HydrophobicContact CD1-CB 4.21Å; I131-V271 HydrophobicContact CD1-CG1 4.34Å; I131-N273 WeakPolarHBondContact CA-OD1 3.28Å; I131-N273 WeakPolarHBondContact CB-OD1 3.4Å |
| 132 | A | 96.2 | Very high | 94.1 | Very high | 13 Ų | 13 | 63.9 Ų | 63.9 | 11% | 0.107 | 38% | 0.377 | C | S | . | . | trans | -109.5 | 84.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | C134 K141 N273 C274 | A132-C134 VanDerWaalsContact C-N 3.25Å; A132-C134 PolarHBondContact O-N 2.87Å; A132-K141 WeakPolarHBondContact CA-O 3.39Å; A132-K141 HydrophobicContact CB-CD 4.47Å; A132-K141 HydrophobicContact CB-CG 3.9Å; A132-N273 PolarHBondContact N-OD1 3.46Å; A132-N273 CarbonylContact O-C 3.57Å; A132-N273 VanDerWaalsContact O-CA 3.27Å; A132-N273 WeakPolarHBondContact O-CA 2.9Å; A132-C274 PolarHBondContact O-N 2.82Å; A132-C274 PolarHBondContact O-SG 3.35Å | ||
| 133 | P | 96.1 | Very high | 94.2 | Very high | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 36% | 0.356 | C | S | . | . | trans | -77.5 | -9.6 | -171 | 35.8 | -42.4 | 0 | 0 | 0 | 113.4 | I131 V143 L148 F165 F167 V271 | I131-P133 HydrophobicContact CD1-CB 4.31Å; I131-P133 VanDerWaalsContact O-CD 3.3Å; I131-P133 WeakPolarHBondContact O-CD 3.43Å; P133-V143 HydrophobicContact CG-CG1 3.57Å; P133-L148 HydrophobicContact CB-CD2 3.55Å; P133-L148 HydrophobicContact CG-CD2 3.74Å; P133-F165 WeakPolarHBondContact O-CD1 3.5Å; P133-F165 WeakPolarHBondContact O-CE1 3.49Å; P133-F167 HydrophobicContact CB-CD1 3.66Å; P133-F167 HydrophobicContact CB-CE1 3.76Å; P133-F167 HydrophobicContact CG-CD1 4.31Å; P133-F167 HydrophobicContact CG-CE1 3.88Å; P133-F167 VanDerWaalsContact O-CD1 3.32Å; P133-F167 WeakPolarHBondContact O-CD1 3.47Å; P133-V271 HydrophobicContact CB-CG1 3.87Å | ||
| 134 | C | 96.5 | Very high | 94.3 | Very high | 1 Ų | 1 | 54.8 Ų | 54.8 | 1% | 0.007 | 33% | 0.328 | C | S | . | . | S | Bend | trans | -154.6 | 169.1 | -175 | 64.1 | 0 | 0 | 0 | 0 | 112.1 | A132 C136 C160 C163 F165 F167 | A132-C134 VanDerWaalsContact C-N 3.25Å; A132-C134 PolarHBondContact O-N 2.87Å; C134-C136 PolarHBondContact O-N 3.41Å; C134-C136 VanDerWaalsContact SG-SG 3.62Å; C134-C160 HydrophobicContact CB-CB 3.96Å; C134-C163 VanDerWaalsContact CB-SG 3.59Å; C134-F165 HydrophobicContact CB-CB 4.08Å; C134-F165 HydrophobicContact CB-CD1 3.92Å; C134-F165 HydrophobicContact CB-CG 4.4Å; C134-F167 HydrophobicContact CB-CD1 4.44Å; C134-F167 HydrophobicContact CB-CE1 3.94Å |
| 135 | Y | 95.5 | Very high | 94.5 | Very high | 89 Ų | 89 | 54.1 Ų | 54.1 | 35% | 0.349 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -76.2 | 15 | -178.3 | -59.7 | -65.9 | 0 | 0 | 0 | 116 | F165 C274 P275 F277 | Y135-F165 HydrophobicContact CD2-CB 4.24Å; Y135-F165 AromaticContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CE2 4.19Å; Y135-F165 AromaticContact CD2-CG 3.95Å; Y135-F165 HydrophobicContact CD2-CG 3.95Å; Y135-F165 AromaticContact CE2-CD2 3.38Å; Y135-F165 HydrophobicContact CE2-CD2 3.38Å; Y135-F165 AromaticContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CE2 3.46Å; Y135-F165 VanDerWaalsContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CG 4.07Å; Y135-F165 HydrophobicContact CE2-CZ 4.2Å; Y135-C274 HydrophobicContact CE1-CB 4.34Å; Y135-P275 WeakPolarHBondContact CE1-O 3.42Å; Y135-P275 WeakPolarHBondContact OH-CG 3.49Å; Y135-P275 PolarHBondContact OH-O 3.29Å; Y135-F277 AromaticContact CD1-CD2 3.68Å; Y135-F277 HydrophobicContact CD1-CD2 3.68Å; Y135-F277 AromaticContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD1-CE2 3.46Å; Y135-F277 VanDerWaalsContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD2-CE2 4.19Å; Y135-F277 AromaticContact CE1-CD2 3.49Å; Y135-F277 HydrophobicContact CE1-CD2 3.49Å; Y135-F277 VanDerWaalsContact CE1-CD2 3.49Å; Y135-F277 AromaticContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CE2 3.41Å; Y135-F277 VanDerWaalsContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CG 4.5Å; Y135-F277 HydrophobicContact CE1-CZ 4.36Å; Y135-F277 HydrophobicContact CE2-CE2 4.15Å; Y135-F277 HydrophobicContact CG-CD2 4.49Å; Y135-F277 AromaticContact CG-CE2 3.85Å; Y135-F277 HydrophobicContact CG-CE2 3.85Å; Y135-F277 AromaticContact CZ-CE2 3.78Å |
| 136 | C | 95.9 | Very high | 94.7 | Very high | 11 Ų | 11 | 56.4 Ų | 56.4 | 7% | 0.074 | 32% | 0.316 | C | S | . | . | trans | -63.7 | 144.2 | 172.5 | -67.2 | 0 | 0 | 0 | 0 | 110.1 | C134 L140 K141 | C134-C136 PolarHBondContact O-N 3.41Å; C134-C136 VanDerWaalsContact SG-SG 3.62Å; C136-L140 HydrophobicContact CB-CB 3.81Å; C136-K141 VanDerWaalsContact O-CB 3.28Å; C136-K141 WeakPolarHBondContact O-CB 3.12Å; C136-K141 WeakPolarHBondContact O-CG 3.33Å | ||
| 137 | S | 92.7 | Very high | 95 | Very high | 103 Ų | 103 | 49 Ų | 49 | 72% | 0.72 | 28% | 0.278 | S | S | * | . | trans | -100.5 | 166.3 | 177.2 | 56.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 138 | G | 91.6 | Very high | 95.3 | Very high | 58 Ų | 58 | 41.4 Ų | 41.4 | 60% | 0.598 | 24% | 0.237 | S | C | * | . | G | 310 helix | trans | 61.1 | -142.4 | 177 | 0 | 0 | 0 | 0 | 0 | 114.1 | L140 K141 | G138-L140 PolarHBondContact O-N 3.35Å; G138-L140 VanDerWaalsContact O-N 3.1Å; G138-K141 VanDerWaalsContact O-CB 3.29Å; G138-K141 WeakPolarHBondContact O-CB 3.37Å; G138-K141 PolarHBondContact O-N 2.84Å |
| 139 | S | 90.8 | Very high | 95.4 | Very high | 89 Ų | 89 | 43.2 Ų | 43.2 | 62% | 0.622 | 24% | 0.244 | S | C | * | . | G | 310 helix | trans | -62.5 | -16.4 | -177 | 57.1 | 0 | 0 | 0 | 0 | 114.3 | R118 | R118-S139 VanDerWaalsContact CB-O 3.32Å; R118-S139 WeakPolarHBondContact CB-O 3.41Å |
| 140 | L | 93.8 | Very high | 95.5 | Very high | 73 Ų | 73 | 45.3 Ų | 45.3 | 38% | 0.382 | 25% | 0.247 | S | C | . | . | G | 310 helix | trans | -85.8 | -9.7 | 177.7 | -62.8 | 178.2 | 0 | 0 | 0 | 113.3 | R118 C136 G138 V162 | R118-L140 WeakPolarHBondContact CD-O 3.27Å; R118-L140 PolarHBondContact NH1-O 2.96Å; C136-L140 HydrophobicContact CB-CB 3.81Å; G138-L140 PolarHBondContact O-N 3.35Å; G138-L140 VanDerWaalsContact O-N 3.1Å; L140-V162 HydrophobicContact CD1-CG1 4.39Å; L140-V162 HydrophobicContact CD1-CG2 4.32Å |
| 141 | K | 95 | Very high | 95.5 | Very high | 75 Ų | 75 | 46.2 Ų | 46.2 | 33% | 0.326 | 25% | 0.248 | S | C | . | . | S | Bend | trans | -69.8 | -42.9 | -176.3 | -174.7 | 173.4 | 176.8 | -179.7 | 0 | 112.6 | A132 C136 G138 | A132-K141 WeakPolarHBondContact CA-O 3.39Å; A132-K141 HydrophobicContact CB-CD 4.47Å; A132-K141 HydrophobicContact CB-CG 3.9Å; C136-K141 VanDerWaalsContact O-CB 3.28Å; C136-K141 WeakPolarHBondContact O-CB 3.12Å; C136-K141 WeakPolarHBondContact O-CG 3.33Å; G138-K141 VanDerWaalsContact O-CB 3.29Å; G138-K141 WeakPolarHBondContact O-CB 3.37Å; G138-K141 PolarHBondContact O-N 2.84Å |
| 142 | F | 96.5 | Very high | 95.4 | Very high | 39 Ų | 39 | 45.9 Ų | 45.9 | 17% | 0.171 | 25% | 0.246 | C | C | . | . | trans | -101.9 | 138.8 | -164.9 | -60.1 | -75.2 | 0 | 0 | 0 | 113.8 | D115 R118 L130 I131 | D115-F142 HydrophobicContact CB-CB 4.48Å; D115-F142 HydrophobicContact CB-CD1 4.31Å; D115-F142 HydrophobicContact CB-CD2 3.65Å; D115-F142 HydrophobicContact CB-CE1 4.46Å; D115-F142 HydrophobicContact CB-CE2 3.83Å; D115-F142 HydrophobicContact CB-CG 3.9Å; D115-F142 HydrophobicContact CB-CZ 4.21Å; D115-F142 VanDerWaalsContact CG-CZ 3.43Å; D115-F142 WeakPolarHBondContact OD1-CD2 3.34Å; D115-F142 WeakPolarHBondContact OD1-CE2 3.17Å; D115-F142 WeakPolarHBondContact OD2-CE2 3.33Å; D115-F142 WeakPolarHBondContact OD2-CZ 3.27Å; R118-F142 PolarHBondContact N-O 2.84Å; L130-F142 HydrophobicContact CB-CB 4.24Å; L130-F142 HydrophobicContact CB-CD1 4.37Å; L130-F142 HydrophobicContact CD1-CB 4.12Å; L130-F142 HydrophobicContact CD2-CB 4.34Å; L130-F142 HydrophobicContact CG-CB 4.47Å; I131-F142 WeakPolarHBondContact O-CA 3.19Å | ||
| 143 | V | 97.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.7 | 146.1 | 178.5 | 58.7 | 0 | 0 | 0 | 0 | 111.2 | I119 I131 P133 C147 L148 | I119-V143 HydrophobicContact CD1-CG2 3.5Å; I119-V143 HydrophobicContact CG1-CG2 3.9Å; I131-V143 HydrophobicContact CG1-CG1 4.11Å; I131-V143 WeakPolarHBondContact CG1-O 3.46Å; I131-V143 PolarHBondContact N-O 3.48Å; I131-V143 PolarHBondContact O-N 2.81Å; P133-V143 HydrophobicContact CG-CG1 3.57Å; V143-C147 HydrophobicContact CG2-CB 4Å; V143-L148 HydrophobicContact CG1-CB 4.14Å; V143-L148 HydrophobicContact CG1-CD2 4.03Å; V143-L148 HydrophobicContact CG1-CG 4.49Å; V143-L148 HydrophobicContact CG2-CB 3.86Å |
| 144 | H | 97.5 | Very high | 95.2 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.9 | 145.1 | 171.6 | -60.2 | 119.9 | 0 | 0 | 0 | 111.2 | C117 C120 C122 E123 A128 R146 C147 L148 | C117-H144 WeakPolarHBondContact CB-CE1 3.36Å; C117-H144 VanDerWaalsContact CB-ND1 3.27Å; C117-H144 WeakPolarHBondContact CB-ND1 3.38Å; C117-H144 PolarHBondContact SG-N 2.88Å; C117-H144 VanDerWaalsContact SG-N 3.41Å; C117-H144 PolarHBondContact SG-ND1 3.49Å; C117-H144 VanDerWaalsContact SG-ND1 3.4Å; C120-H144 VanDerWaalsContact SG-CE1 3.51Å; C120-H144 PolarHBondContact SG-ND1 3.48Å; C122-H144 PolarHBondContact O-CE1 2.72Å; E123-H144 PolarHBondContact O-CE1 3.46Å; E123-H144 PolarHBondContact O-NE2 2.86Å; A128-H144 PolarHBondContact O-CD2 3.45Å; A128-H144 PolarHBondContact O-NE2 2.98Å; H144-R146 VanDerWaalsContact C-N 3.31Å; H144-R146 HydrophobicContact CB-CG 4.05Å; H144-R146 PolarHBondContact O-N 3.45Å; H144-C147 HydrophobicContact CB-CB 4.1Å; H144-C147 PolarHBondContact O-N 3.16Å; H144-L148 PolarHBondContact O-N 2.83Å |
| 145 | Q | 96.6 | Very high | 95.1 | Very high | 39 Ų | 39 | 59.8 Ų | 59.8 | 18% | 0.182 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -48.3 | -51.4 | 175.7 | -173.9 | 68.4 | -4.2 | 0 | 0 | 113 | C147 L148 Q149 Y270 V271 | Q145-C147 PolarHBondContact O-N 3.06Å; Q145-L148 PolarHBondContact O-N 2.68Å; Q145-Q149 WeakPolarHBondContact O-CB 3.26Å; Q145-Q149 WeakPolarHBondContact O-CG 3.31Å; Q145-Q149 PolarHBondContact O-N 2.72Å; Q145-Y270 HydrophobicContact CG-CD1 4.46Å; Q145-V271 PolarHBondContact NE2-O 3.27Å; Q145-V271 PolarHBondContact OE1-O 3Å |
| 146 | R | 95.7 | Very high | 95 | Very high | 123 Ų | 123 | 63.2 Ų | 63.2 | 46% | 0.464 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -62 | -39.6 | 179.1 | 53.6 | 178.9 | 166.4 | 75.5 | 4.4 | 113.2 | H144 Q150 | H144-R146 VanDerWaalsContact C-N 3.31Å; H144-R146 HydrophobicContact CB-CG 4.05Å; H144-R146 PolarHBondContact O-N 3.45Å; R146-Q150 WeakPolarHBondContact O-CB 3.49Å; R146-Q150 PolarHBondContact O-N 2.98Å |
| 147 | C | 97.2 | Very high | 95 | Very high | 15 Ų | 15 | 65.2 Ų | 65.2 | 10% | 0.101 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -67.7 | -43.6 | -179.9 | -68.5 | 0 | 0 | 0 | 0 | 110.6 | I119 V143 H144 Q145 Q150 W151 | I119-C147 HydrophobicContact CB-CB 4Å; I119-C147 HydrophobicContact CD1-CB 4.04Å; I119-C147 HydrophobicContact CG2-CB 4.11Å; V143-C147 HydrophobicContact CG2-CB 4Å; H144-C147 HydrophobicContact CB-CB 4.1Å; H144-C147 PolarHBondContact O-N 3.16Å; Q145-C147 PolarHBondContact O-N 3.06Å; C147-Q150 PolarHBondContact O-N 3.4Å; C147-W151 WeakPolarHBondContact O-CB 3.35Å; C147-W151 PolarHBondContact O-N 3.25Å |
| 148 | L | 96.9 | Very high | 95.1 | Very high | 0 Ų | 0 | 65.1 Ų | 65.1 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -67.6 | -41.7 | 177.2 | -173.6 | 59.4 | 0 | 0 | 0 | 112 | I131 P133 V143 H144 Q145 Q150 W151 I152 F167 V271 | I131-L148 HydrophobicContact CD1-CD2 4.01Å; P133-L148 HydrophobicContact CB-CD2 3.55Å; P133-L148 HydrophobicContact CG-CD2 3.74Å; V143-L148 HydrophobicContact CG1-CB 4.14Å; V143-L148 HydrophobicContact CG1-CD2 4.03Å; V143-L148 HydrophobicContact CG1-CG 4.49Å; V143-L148 HydrophobicContact CG2-CB 3.86Å; H144-L148 PolarHBondContact O-N 2.83Å; Q145-L148 PolarHBondContact O-N 2.68Å; L148-Q150 VanDerWaalsContact C-N 3.34Å; L148-Q150 PolarHBondContact O-N 2.81Å; L148-W151 HydrophobicContact CD1-CE3 4.17Å; L148-W151 PolarHBondContact O-N 3.18Å; L148-I152 HydrophobicContact CD1-CD1 4.3Å; L148-I152 HydrophobicContact CD1-CG1 4.39Å; L148-I152 HydrophobicContact CG-CD1 3.91Å; L148-I152 HydrophobicContact CG-CG1 4.45Å; L148-I152 VanDerWaalsContact O-CG1 3.31Å; L148-I152 WeakPolarHBondContact O-CG1 3.47Å; L148-I152 PolarHBondContact O-N 3.39Å; L148-F167 HydrophobicContact CD1-CE2 4.03Å; L148-F167 HydrophobicContact CD1-CZ 4.02Å; L148-V271 HydrophobicContact CD2-CB 3.76Å; L148-V271 HydrophobicContact CD2-CG1 3.59Å; L148-V271 HydrophobicContact CD2-CG2 3.85Å; L148-V271 HydrophobicContact CG-CG2 4.23Å |
| 149 | Q | 95.7 | Very high | 95.3 | Very high | 50 Ų | 50 | 63.4 Ų | 63.4 | 23% | 0.234 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -56.8 | -47.1 | 174.1 | -77.1 | 170.5 | -20.7 | 0 | 0 | 112 | Q145 I152 K153 I269 | Q145-Q149 WeakPolarHBondContact O-CB 3.26Å; Q145-Q149 WeakPolarHBondContact O-CG 3.31Å; Q145-Q149 PolarHBondContact O-N 2.72Å; Q149-I152 PolarHBondContact O-N 2.82Å; Q149-K153 WeakPolarHBondContact O-CB 3.27Å; Q149-K153 PolarHBondContact O-N 3.38Å; Q149-I269 VanDerWaalsContact CG-O 3.26Å; Q149-I269 WeakPolarHBondContact CG-O 3.5Å; Q149-I269 PolarHBondContact NE2-O 2.98Å |
| 150 | Q | 95.6 | Very high | 95.6 | Very high | 122 Ų | 122 | 59.2 Ų | 59.2 | 57% | 0.57 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -62.5 | -43.6 | 177.2 | -170.8 | 73.4 | 6.9 | 0 | 0 | 111.1 | R146 C147 L148 K153 S154 | R146-Q150 WeakPolarHBondContact O-CB 3.49Å; R146-Q150 PolarHBondContact O-N 2.98Å; C147-Q150 PolarHBondContact O-N 3.4Å; L148-Q150 VanDerWaalsContact C-N 3.34Å; L148-Q150 PolarHBondContact O-N 2.81Å; Q150-K153 PolarHBondContact O-N 2.77Å; Q150-S154 PolarHBondContact O-N 3.5Å; Q150-S154 PolarHBondContact O-OG 3.29Å |
| 151 | W | 95.9 | Very high | 95.7 | Very high | 50 Ų | 50 | 61.2 Ų | 61.2 | 19% | 0.189 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 178 | -179.6 | 91.8 | 0 | 0 | 0 | 112.1 | I119 C147 L148 K153 S154 S155 T157 A159 E161 F167 | I119-W151 HydrophobicContact CD1-CB 3.99Å; I119-W151 HydrophobicContact CD1-CG 4.36Å; C147-W151 WeakPolarHBondContact O-CB 3.35Å; C147-W151 PolarHBondContact O-N 3.25Å; L148-W151 HydrophobicContact CD1-CE3 4.17Å; L148-W151 PolarHBondContact O-N 3.18Å; W151-K153 VanDerWaalsContact C-N 3.3Å; W151-K153 PolarHBondContact O-N 3.3Å; W151-S154 PolarHBondContact O-N 3.28Å; W151-S155 VanDerWaalsContact O-CB 3.27Å; W151-S155 WeakPolarHBondContact O-CB 3.4Å; W151-S155 PolarHBondContact O-N 2.94Å; W151-S155 PolarHBondContact O-OG 2.97Å; W151-T157 HydrophobicContact CH2-CG2 3.22Å; W151-T157 HydrophobicContact CZ2-CG2 3.94Å; W151-T157 HydrophobicContact CZ3-CG2 3.56Å; W151-A159 WeakPolarHBondContact CH2-O 3.25Å; W151-E161 HydrophobicContact CZ2-CB 4.36Å; W151-E161 WeakPolarHBondContact CZ2-OE2 3.32Å; W151-F167 HydrophobicContact CE3-CE2 4.48Å; W151-F167 HydrophobicContact CH2-CE2 4.49Å; W151-F167 AromaticContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CZ 4.45Å |
| 152 | I | 95.4 | Very high | 95.7 | Very high | 13 Ų | 13 | 61.7 Ų | 61.7 | 7% | 0.067 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.5 | -43.9 | 176.2 | -69.7 | 162.6 | 0 | 0 | 0 | 110.1 | L148 Q149 S154 Q156 F167 M169 V271 | L148-I152 HydrophobicContact CD1-CD1 4.3Å; L148-I152 HydrophobicContact CD1-CG1 4.39Å; L148-I152 HydrophobicContact CG-CD1 3.91Å; L148-I152 HydrophobicContact CG-CG1 4.45Å; L148-I152 VanDerWaalsContact O-CG1 3.31Å; L148-I152 WeakPolarHBondContact O-CG1 3.47Å; L148-I152 PolarHBondContact O-N 3.39Å; Q149-I152 PolarHBondContact O-N 2.82Å; I152-S154 PolarHBondContact O-N 3.07Å; I152-Q156 VanDerWaalsContact O-CA 3.32Å; I152-Q156 WeakPolarHBondContact O-CA 3.18Å; I152-Q156 PolarHBondContact O-N 3.36Å; I152-F167 HydrophobicContact CD1-CD2 4.2Å; I152-F167 HydrophobicContact CG1-CD2 4.44Å; I152-M169 HydrophobicContact CD1-CE 3.48Å; I152-M169 VanDerWaalsContact CD1-CE 3.48Å; I152-M169 HydrophobicContact CG1-CE 4.11Å; I152-M169 HydrophobicContact CG2-CE 4.19Å; I152-V271 HydrophobicContact CD1-CG2 3.52Å |
| 153 | K | 92.5 | Very high | 95.7 | Very high | 165 Ų | 165 | 62.1 Ų | 62.1 | 72% | 0.717 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -62.4 | -42.4 | -180 | -173.5 | 179.2 | 178.8 | -177.3 | 0 | 112 | Q149 Q150 W151 | Q149-K153 WeakPolarHBondContact O-CB 3.27Å; Q149-K153 PolarHBondContact O-N 3.38Å; Q150-K153 PolarHBondContact O-N 2.77Å; W151-K153 VanDerWaalsContact C-N 3.3Å; W151-K153 PolarHBondContact O-N 3.3Å |
| 154 | S | 95 | Very high | 95.6 | Very high | 90 Ų | 90 | 71.2 Ų | 71.2 | 63% | 0.629 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -76.6 | -39.7 | -179.1 | -62.2 | 0 | 0 | 0 | 0 | 113.2 | Q150 W151 I152 | Q150-S154 PolarHBondContact O-N 3.5Å; Q150-S154 PolarHBondContact O-OG 3.29Å; W151-S154 PolarHBondContact O-N 3.28Å; I152-S154 PolarHBondContact O-N 3.07Å |
| 155 | S | 94.5 | Very high | 95.6 | Very high | 51 Ų | 51 | 73.4 Ų | 73.4 | 36% | 0.357 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -86.8 | -17.1 | -175.8 | 64.7 | 0 | 0 | 0 | 0 | 113.8 | W151 T157 | W151-S155 VanDerWaalsContact O-CB 3.27Å; W151-S155 WeakPolarHBondContact O-CB 3.4Å; W151-S155 PolarHBondContact O-N 2.94Å; W151-S155 PolarHBondContact O-OG 2.97Å; S155-T157 PolarHBondContact O-N 3.13Å; S155-T157 WeakPolarHBondContact OG-CG2 3.43Å; S155-T157 PolarHBondContact OG-N 3.16Å |
| 156 | Q | 93.3 | Very high | 95.6 | Very high | 162 Ų | 162 | 75.5 Ų | 75.5 | 76% | 0.757 | 38% | 0.377 | S | S | * | . | trans | 57.6 | 13.5 | -174.2 | -55.4 | 180 | 47.6 | 0 | 0 | 114.5 | I152 | I152-Q156 VanDerWaalsContact O-CA 3.32Å; I152-Q156 WeakPolarHBondContact O-CA 3.18Å; I152-Q156 PolarHBondContact O-N 3.36Å | ||
| 157 | T | 95.2 | Very high | 95.6 | Very high | 53 Ų | 53 | 70.3 Ų | 70.3 | 33% | 0.325 | 36% | 0.358 | S | S | . | . | trans | -99 | 144.4 | 175.1 | 174.9 | 0 | 0 | 0 | 0 | 111.7 | W151 S155 A159 | W151-T157 HydrophobicContact CH2-CG2 3.22Å; W151-T157 HydrophobicContact CZ2-CG2 3.94Å; W151-T157 HydrophobicContact CZ3-CG2 3.56Å; S155-T157 PolarHBondContact O-N 3.13Å; S155-T157 WeakPolarHBondContact OG-CG2 3.43Å; S155-T157 PolarHBondContact OG-N 3.16Å; T157-A159 PolarHBondContact OG1-N 2.82Å; T157-A159 PolarHBondContact OG1-O 3.38Å | ||
| 158 | K | 95.4 | Very high | 95.5 | Very high | 101 Ų | 101 | 73.6 Ų | 73.6 | 44% | 0.439 | 37% | 0.374 | S | S | . | . | trans | -107.6 | 10.2 | 179.3 | -62.2 | -177.1 | -177.8 | 173 | 0 | 113.2 | V64 F167 M169 | V64-K158 VanDerWaalsContact CG1-NZ 3.28Å; K158-F167 WeakPolarHBondContact O-CD2 3.46Å; K158-F167 PolarHBondContact O-N 3.41Å; K158-M169 VanDerWaalsContact CA-CE 3.48Å; K158-M169 HydrophobicContact CB-CE 3.52Å; K158-M169 HydrophobicContact CB-SD 4.17Å; K158-M169 HydrophobicContact CD-CE 4.46Å; K158-M169 HydrophobicContact CD-SD 4.06Å; K158-M169 HydrophobicContact CG-CE 3.71Å; K158-M169 HydrophobicContact CG-SD 3.91Å | ||
| 159 | A | 96.5 | Very high | 95.4 | Very high | 21 Ų | 21 | 76.1 Ų | 76.1 | 17% | 0.174 | 39% | 0.386 | C | S | . | . | B | Isolated β-bridge | trans | -128.6 | 154.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111 | W151 T157 E161 F165 | W151-A159 WeakPolarHBondContact CH2-O 3.25Å; T157-A159 PolarHBondContact OG1-N 2.82Å; T157-A159 PolarHBondContact OG1-O 3.38Å; A159-E161 PolarHBondContact O-N 3.31Å; A159-F165 CarbonylContact C-O 3.01Å; A159-F165 VanDerWaalsContact CA-O 3.27Å; A159-F165 WeakPolarHBondContact CA-O 3.26Å |
| 160 | C | 96.6 | Very high | 95.3 | Very high | 1 Ų | 1 | 79.1 Ų | 79.1 | 1% | 0.007 | 40% | 0.4 | C | S | . | . | trans | -63.7 | 132.6 | 174.4 | 178.7 | 0 | 0 | 0 | 0 | 110.8 | C134 V162 C163 R164 F165 F167 | C134-C160 HydrophobicContact CB-CB 3.96Å; C160-V162 VanDerWaalsContact C-N 3.25Å; C160-V162 PolarHBondContact O-N 3.01Å; C160-V162 PolarHBondContact SG-N 3.44Å; C160-C163 VanDerWaalsContact CB-SG 3.57Å; C160-R164 WeakPolarHBondContact O-CA 3.37Å; C160-R164 PolarHBondContact O-N 2.88Å; C160-F165 PolarHBondContact N-O 3.35Å; C160-F167 HydrophobicContact CB-CE1 3.89Å; C160-F167 HydrophobicContact CB-CZ 3.82Å | ||
| 161 | E | 95.4 | Very high | 95.1 | Very high | 115 Ų | 115 | 77 Ų | 77 | 54% | 0.537 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.3 | -27.7 | 178.9 | 66.7 | -161.8 | 170.6 | 0 | 0 | 113.7 | W151 A159 R164 | W151-E161 HydrophobicContact CZ2-CB 4.36Å; W151-E161 WeakPolarHBondContact CZ2-OE2 3.32Å; A159-E161 PolarHBondContact O-N 3.31Å; E161-R164 PolarHBondContact O-NE 3.02Å |
| 162 | V | 95.6 | Very high | 94.9 | Very high | 85 Ų | 85 | 81.1 Ų | 81.1 | 52% | 0.515 | 41% | 0.411 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.2 | -69 | -176.9 | -176 | 0 | 0 | 0 | 0 | 111.2 | L140 C160 R164 | L140-V162 HydrophobicContact CD1-CG1 4.39Å; L140-V162 HydrophobicContact CD1-CG2 4.32Å; C160-V162 VanDerWaalsContact C-N 3.25Å; C160-V162 PolarHBondContact O-N 3.01Å; C160-V162 PolarHBondContact SG-N 3.44Å; V162-R164 PolarHBondContact O-N 3.19Å |
| 163 | C | 95.6 | Very high | 94.6 | Very high | 49 Ų | 49 | 83.1 Ų | 83.1 | 33% | 0.331 | 42% | 0.423 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.1 | -3.6 | -175.4 | 69.8 | 0 | 0 | 0 | 0 | 114.4 | C134 C160 F165 | C134-C163 VanDerWaalsContact CB-SG 3.59Å; C160-C163 VanDerWaalsContact CB-SG 3.57Å; C163-F165 PolarHBondContact O-N 3.28Å |
| 164 | R | 96.1 | Very high | 94.5 | Very high | 190 Ų | 190 | 77.3 Ų | 77.3 | 72% | 0.717 | 40% | 0.398 | S | S | * | . | trans | 60.5 | 7 | 179.4 | -51.4 | -59.9 | 176.3 | 77.1 | 0 | 116 | C160 E161 V162 S166 | C160-R164 WeakPolarHBondContact O-CA 3.37Å; C160-R164 PolarHBondContact O-N 2.88Å; E161-R164 PolarHBondContact O-NE 3.02Å; V162-R164 PolarHBondContact O-N 3.19Å; R164-S166 PolarHBondContact O-N 2.89Å | ||
| 165 | F | 96.1 | Very high | 94.2 | Very high | 47 Ų | 47 | 76.8 Ų | 76.8 | 21% | 0.206 | 39% | 0.393 | C | S | . | . | P | Polyproline II helix | trans | -60.4 | 130.2 | 172.4 | -179.1 | -104.5 | 0 | 0 | 0 | 110.9 | P133 C134 Y135 A159 C160 C163 I168 C274 | P133-F165 WeakPolarHBondContact O-CD1 3.5Å; P133-F165 WeakPolarHBondContact O-CE1 3.49Å; C134-F165 HydrophobicContact CB-CB 4.08Å; C134-F165 HydrophobicContact CB-CD1 3.92Å; C134-F165 HydrophobicContact CB-CG 4.4Å; Y135-F165 HydrophobicContact CD2-CB 4.24Å; Y135-F165 AromaticContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CD2 3.68Å; Y135-F165 HydrophobicContact CD2-CE2 4.19Å; Y135-F165 AromaticContact CD2-CG 3.95Å; Y135-F165 HydrophobicContact CD2-CG 3.95Å; Y135-F165 AromaticContact CE2-CD2 3.38Å; Y135-F165 HydrophobicContact CE2-CD2 3.38Å; Y135-F165 AromaticContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CE2 3.46Å; Y135-F165 VanDerWaalsContact CE2-CE2 3.46Å; Y135-F165 HydrophobicContact CE2-CG 4.07Å; Y135-F165 HydrophobicContact CE2-CZ 4.2Å; A159-F165 CarbonylContact C-O 3.01Å; A159-F165 VanDerWaalsContact CA-O 3.27Å; A159-F165 WeakPolarHBondContact CA-O 3.26Å; C160-F165 PolarHBondContact N-O 3.35Å; C163-F165 PolarHBondContact O-N 3.28Å; F165-I168 HydrophobicContact CZ-CD1 4.48Å; F165-I168 HydrophobicContact CZ-CG1 4.38Å; F165-C274 HydrophobicContact CD1-CB 4.27Å; F165-C274 HydrophobicContact CE1-CB 3.6Å; F165-C274 HydrophobicContact CZ-CB 3.91Å |
| 166 | S | 96.8 | Very high | 93.8 | Very high | 83 Ų | 83 | 82 Ų | 82 | 58% | 0.58 | 41% | 0.409 | S | S | * | . | B | Isolated β-bridge | trans | -75.6 | 121.7 | 174.5 | -67.1 | 0 | 0 | 0 | 0 | 109.7 | R164 | R164-S166 PolarHBondContact O-N 2.89Å |
| 167 | F | 96.4 | Very high | 93.5 | Very high | 13 Ų | 13 | 86 Ų | 86 | 6% | 0.057 | 42% | 0.418 | C | S | . | . | P | Polyproline II helix | trans | -64.3 | 142.6 | -177.3 | -60.3 | -51.1 | 0 | 0 | 0 | 111.6 | P133 C134 L148 W151 I152 K158 C160 M169 V271 | P133-F167 HydrophobicContact CB-CD1 3.66Å; P133-F167 HydrophobicContact CB-CE1 3.76Å; P133-F167 HydrophobicContact CG-CD1 4.31Å; P133-F167 HydrophobicContact CG-CE1 3.88Å; P133-F167 VanDerWaalsContact O-CD1 3.32Å; P133-F167 WeakPolarHBondContact O-CD1 3.47Å; C134-F167 HydrophobicContact CB-CD1 4.44Å; C134-F167 HydrophobicContact CB-CE1 3.94Å; L148-F167 HydrophobicContact CD1-CE2 4.03Å; L148-F167 HydrophobicContact CD1-CZ 4.02Å; W151-F167 HydrophobicContact CE3-CE2 4.48Å; W151-F167 HydrophobicContact CH2-CE2 4.49Å; W151-F167 AromaticContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CE2 3.78Å; W151-F167 HydrophobicContact CZ3-CZ 4.45Å; I152-F167 HydrophobicContact CD1-CD2 4.2Å; I152-F167 HydrophobicContact CG1-CD2 4.44Å; K158-F167 WeakPolarHBondContact O-CD2 3.46Å; K158-F167 PolarHBondContact O-N 3.41Å; C160-F167 HydrophobicContact CB-CE1 3.89Å; C160-F167 HydrophobicContact CB-CZ 3.82Å; F167-M169 HydrophobicContact CB-CE 3.78Å; F167-M169 HydrophobicContact CB-CG 4.26Å; F167-M169 HydrophobicContact CD2-CE 3.91Å; F167-M169 HydrophobicContact CG-CE 4.35Å; F167-M169 PolarHBondContact O-N 2.89Å; F167-V271 HydrophobicContact CB-CG1 3.86Å; F167-V271 HydrophobicContact CG-CG1 4.33Å |
| 168 | I | 95 | Very high | 93.1 | Very high | 85 Ų | 85 | 90.9 Ų | 90.9 | 44% | 0.436 | 43% | 0.434 | S | S | . | . | trans | -78.5 | 106.6 | 173.9 | -61.5 | 173 | 0 | 0 | 0 | 107.8 | F165 V271 G272 | F165-I168 HydrophobicContact CZ-CD1 4.48Å; F165-I168 HydrophobicContact CZ-CG1 4.38Å; I168-V271 CarbonylContact O-C 3.53Å; I168-V271 WeakPolarHBondContact O-CA 3.42Å; I168-G272 PolarHBondContact O-N 2.9Å | ||
| 169 | M | 94.8 | Very high | 92.9 | Very high | 53 Ų | 53 | 87.7 Ų | 87.7 | 26% | 0.261 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 136.8 | -175.3 | -60.7 | -170.7 | -178.2 | 0 | 0 | 111.8 | I152 K158 F167 I269 Y270 V271 | I152-M169 HydrophobicContact CD1-CE 3.48Å; I152-M169 VanDerWaalsContact CD1-CE 3.48Å; I152-M169 HydrophobicContact CG1-CE 4.11Å; I152-M169 HydrophobicContact CG2-CE 4.19Å; K158-M169 VanDerWaalsContact CA-CE 3.48Å; K158-M169 HydrophobicContact CB-CE 3.52Å; K158-M169 HydrophobicContact CB-SD 4.17Å; K158-M169 HydrophobicContact CD-CE 4.46Å; K158-M169 HydrophobicContact CD-SD 4.06Å; K158-M169 HydrophobicContact CG-CE 3.71Å; K158-M169 HydrophobicContact CG-SD 3.91Å; F167-M169 HydrophobicContact CB-CE 3.78Å; F167-M169 HydrophobicContact CB-CG 4.26Å; F167-M169 HydrophobicContact CD2-CE 3.91Å; F167-M169 HydrophobicContact CG-CE 4.35Å; F167-M169 PolarHBondContact O-N 2.89Å; M169-I269 HydrophobicContact CB-CG2 4.01Å; M169-I269 HydrophobicContact CG-CG2 4.15Å; M169-I269 HydrophobicContact SD-CG2 3.91Å; M169-Y270 CarbonylContact C-O 3.54Å; M169-Y270 WeakPolarHBondContact CA-O 3.37Å; M169-V271 HydrophobicContact CG-CG2 4.36Å |
| 170 | Q | 93.2 | Very high | 92.4 | Very high | 112 Ų | 112 | 91.2 Ų | 91.2 | 52% | 0.523 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.6 | 124.6 | 172 | -154.4 | 177 | 37.7 | 0 | 0 | 109.6 | Y270 | Q170-Y270 PolarHBondContact N-O 3.34Å; Q170-Y270 PolarHBondContact O-N 3.47Å |
| 171 | T | 92.7 | Very high | 92 | Very high | 77 Ų | 77 | 100.2 Ų | 100.2 | 47% | 0.472 | 47% | 0.471 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 126.2 | 178.8 | -57.6 | 0 | 0 | 0 | 0 | 109.7 | K267 | T171-K267 HydrophobicContact CG2-CB 3.84Å; T171-K267 HydrophobicContact CG2-CD 4Å; T171-K267 HydrophobicContact CG2-CG 4.11Å |
| 172 | R | 90.3 | Very high | 91.5 | Very high | 137 Ų | 137 | 95.7 Ų | 95.7 | 52% | 0.517 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.2 | 145.2 | 176.1 | -62.8 | -68.4 | -171.4 | 160 | 0.2 | 109.7 | V268 Y270 | R172-V268 PolarHBondContact N-O 3.14Å; R172-V268 PolarHBondContact O-N 2.93Å; R172-V268 VanDerWaalsContact O-O 3.09Å; R172-Y270 HydrophobicContact CB-CD2 4.05Å; R172-Y270 HydrophobicContact CB-CE2 3.96Å; R172-Y270 HydrophobicContact CG-CD2 4.24Å |
| 173 | V | 90.7 | Very high | 91 | Very high | 55 Ų | 55 | 97.4 Ų | 97.4 | 33% | 0.333 | 46% | 0.457 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 138.2 | 173.4 | -173.6 | 0 | 0 | 0 | 0 | 108.3 | W179 K263 K267 | V173-W179 HydrophobicContact CG1-CZ2 3.45Å; V173-W179 VanDerWaalsContact CG1-CZ2 3.45Å; V173-K263 HydrophobicContact CG2-CG 4.32Å; V173-K267 HydrophobicContact CG2-CG 4.03Å |
| 174 | K | 88.6 | Confident | 90.6 | Very high | 43 Ų | 43 | 96.5 Ų | 96.5 | 19% | 0.187 | 45% | 0.449 | C | S | . | . | P | Polyproline II helix | trans | -52.7 | 148.7 | 172 | -68.2 | 176.3 | -175.7 | 176.9 | 0 | 109.1 | F176 W179 E180 N266 V268 | K174-F176 PolarHBondContact O-N 3.5Å; K174-W179 PolarHBondContact O-NE1 2.87Å; K174-E180 IonicContact NZ-OE1 2.81Å; K174-E180 PolarHBondContact NZ-OE1 2.91Å; K174-E180 IonicContact NZ-OE2 3.05Å; K174-E180 PolarHBondContact NZ-OE2 2.85Å; K174-N266 WeakPolarHBondContact CG-O 3.32Å; K174-N266 PolarHBondContact N-O 3.38Å; K174-V268 HydrophobicContact CD-CG2 4.04Å; K174-V268 HydrophobicContact CG-CG2 3.57Å |
| 175 | P | 88.6 | Confident | 90.3 | Very high | 80 Ų | 80 | 90.6 Ų | 90.6 | 52% | 0.519 | 44% | 0.436 | S | S | . | . | P | Polyproline II helix | trans | -58.9 | 140.5 | 169.5 | 25.3 | -33.2 | 0 | 0 | 0 | 109.5 | R177 K178 W179 | P175-R177 PolarHBondContact O-N 3.05Å; P175-K178 HydrophobicContact CG-CB 4.25Å; P175-K178 HydrophobicContact CG-CD 4.17Å; P175-K178 HydrophobicContact CG-CG 4.18Å; P175-K178 PolarHBondContact O-N 3.46Å; P175-W179 VanDerWaalsContact O-CD1 3.27Å |
| 176 | F | 86.7 | Confident | 90 | Very high | 159 Ų | 159 | 92.5 Ų | 92.5 | 70% | 0.697 | 46% | 0.456 | S | S | * | . | G | 310 helix | trans | -49.5 | -33 | -172.8 | -67.5 | -73.8 | 0 | 0 | 0 | 114.4 | K174 K178 W179 | K174-F176 PolarHBondContact O-N 3.5Å; F176-K178 VanDerWaalsContact C-N 3.28Å; F176-K178 PolarHBondContact O-N 3.39Å; F176-W179 HydrophobicContact CD1-CD2 4.08Å; F176-W179 AromaticContact CD1-CE2 3.59Å; F176-W179 HydrophobicContact CD1-CE3 4.39Å; F176-W179 AromaticContact CD1-CH2 3.85Å; F176-W179 HydrophobicContact CD1-CH2 3.85Å; F176-W179 AromaticContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ2 3.45Å; F176-W179 VanDerWaalsContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ3 4.3Å; F176-W179 AromaticContact CE1-CE2 4Å; F176-W179 AromaticContact CE1-CH2 3.56Å; F176-W179 HydrophobicContact CE1-CH2 3.56Å; F176-W179 AromaticContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ3 4.34Å; F176-W179 HydrophobicContact CZ-CZ2 4.35Å; F176-W179 WeakPolarHBondContact O-CB 3.28Å; F176-W179 PolarHBondContact O-N 3.27Å |
| 177 | R | 87.1 | Confident | 89.7 | Confident | 248 Ų | 248 | 92.6 Ų | 92.6 | 94% | 0.936 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -66.7 | -24.3 | 178.2 | -64 | -176.1 | 179.2 | 179.2 | -0.3 | 114.4 | P175 | P175-R177 PolarHBondContact O-N 3.05Š|
| 178 | K | 87.3 | Confident | 89.4 | Confident | 154 Ų | 154 | 93.4 Ų | 93.4 | 67% | 0.67 | 46% | 0.456 | S | S | * | . | G | 310 helix | trans | -103.7 | 15 | 178.3 | -62 | -171.1 | 178.4 | -175.8 | 0 | 112 | P175 F176 E180 | P175-K178 HydrophobicContact CG-CB 4.25Å; P175-K178 HydrophobicContact CG-CD 4.17Å; P175-K178 HydrophobicContact CG-CG 4.18Å; P175-K178 PolarHBondContact O-N 3.46Å; F176-K178 VanDerWaalsContact C-N 3.28Å; F176-K178 PolarHBondContact O-N 3.39Å; K178-E180 PolarHBondContact O-N 3.32Å |
| 179 | W | 89.9 | Confident | 89.1 | Confident | 35 Ų | 35 | 96.8 Ų | 96.8 | 13% | 0.133 | 46% | 0.463 | C | S | . | . | P | Polyproline II helix | trans | -68.6 | 128.3 | 176.4 | -80.7 | 24.1 | 0 | 0 | 0 | 110.1 | V173 K174 P175 F176 F259 W262 K263 N266 | V173-W179 HydrophobicContact CG1-CZ2 3.45Å; V173-W179 VanDerWaalsContact CG1-CZ2 3.45Å; K174-W179 PolarHBondContact O-NE1 2.87Å; P175-W179 VanDerWaalsContact O-CD1 3.27Å; F176-W179 HydrophobicContact CD1-CD2 4.08Å; F176-W179 AromaticContact CD1-CE2 3.59Å; F176-W179 HydrophobicContact CD1-CE3 4.39Å; F176-W179 AromaticContact CD1-CH2 3.85Å; F176-W179 HydrophobicContact CD1-CH2 3.85Å; F176-W179 AromaticContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ2 3.45Å; F176-W179 VanDerWaalsContact CD1-CZ2 3.45Å; F176-W179 HydrophobicContact CD1-CZ3 4.3Å; F176-W179 AromaticContact CE1-CE2 4Å; F176-W179 AromaticContact CE1-CH2 3.56Å; F176-W179 HydrophobicContact CE1-CH2 3.56Å; F176-W179 AromaticContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ2 3.34Å; F176-W179 HydrophobicContact CE1-CZ3 4.34Å; F176-W179 HydrophobicContact CZ-CZ2 4.35Å; F176-W179 WeakPolarHBondContact O-CB 3.28Å; F176-W179 PolarHBondContact O-N 3.27Å; W179-F259 HydrophobicContact CH2-CE2 4.26Å; W179-F259 HydrophobicContact CH2-CZ 4.19Å; W179-F259 HydrophobicContact CZ3-CE2 4.05Å; W179-F259 HydrophobicContact CZ3-CZ 4.44Å; W179-W262 HydrophobicContact CB-CZ2 4.45Å; W179-W262 AromaticContact CE3-CD2 3.95Å; W179-W262 HydrophobicContact CE3-CD2 3.95Å; W179-W262 AromaticContact CE3-CE2 3.79Å; W179-W262 HydrophobicContact CE3-CE3 4.16Å; W179-W262 HydrophobicContact CE3-CH2 4.1Å; W179-W262 AromaticContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ3 4.23Å; W179-W262 HydrophobicContact CZ3-CD2 4.07Å; W179-W262 HydrophobicContact CZ3-CE3 4.01Å; W179-W262 HydrophobicContact CZ3-CZ3 4.28Å; W179-K263 HydrophobicContact CH2-CB 4.21Å; W179-K263 HydrophobicContact CH2-CG 4.28Å; W179-N266 VanDerWaalsContact CA-OD1 3.25Å; W179-N266 WeakPolarHBondContact CA-OD1 3.47Å; W179-N266 HydrophobicContact CD2-CB 3.98Å; W179-N266 HydrophobicContact CG-CB 4.03Å |
| 180 | E | 87.8 | Confident | 89 | Confident | 94 Ų | 94 | 102.8 Ų | 102.8 | 44% | 0.439 | 48% | 0.483 | S | S | . | . | P | Polyproline II helix | trans | -79.5 | 146.3 | 172.5 | -75.4 | 152.4 | -163.2 | 0 | 0 | 109 | K174 K178 L182 W262 Y265 N266 | K174-E180 IonicContact NZ-OE1 2.81Å; K174-E180 PolarHBondContact NZ-OE1 2.91Å; K174-E180 IonicContact NZ-OE2 3.05Å; K174-E180 PolarHBondContact NZ-OE2 2.85Å; K178-E180 PolarHBondContact O-N 3.32Å; E180-L182 PolarHBondContact O-N 3.06Å; E180-W262 PolarHBondContact O-NE1 3Å; E180-Y265 HydrophobicContact CB-CE1 3.93Å; E180-N266 PolarHBondContact N-OD1 3.09Å; E180-N266 PolarHBondContact O-ND2 3.49Å; E180-N266 VanDerWaalsContact O-ND2 3.16Å |
| 181 | K | 87.3 | Confident | 88.9 | Confident | 191 Ų | 191 | 104.5 Ų | 104.5 | 83% | 0.83 | 49% | 0.489 | S | S | * | . | P | Polyproline II helix | trans | -62.5 | 131.3 | 172.2 | -66.9 | -178 | -179.9 | 177.6 | 0 | 107.8 | D183 | K181-D183 PolarHBondContact O-N 3.01Š|
| 182 | L | 85.7 | Confident | 88.8 | Confident | 20 Ų | 20 | 102.8 Ų | 102.8 | 11% | 0.105 | 48% | 0.477 | C | S | . | . | P | Polyproline II helix | trans | -55.9 | 131.4 | 175.5 | -175.7 | 60.1 | 0 | 0 | 0 | 109 | E180 I184 R261 W262 Y265 | E180-L182 PolarHBondContact O-N 3.06Å; L182-I184 VanDerWaalsContact C-N 3.28Å; L182-I184 HydrophobicContact CB-CD1 4.05Å; L182-I184 HydrophobicContact CB-CG1 3.77Å; L182-I184 HydrophobicContact CD2-CD1 3.86Å; L182-I184 HydrophobicContact CD2-CG1 3.63Å; L182-I184 HydrophobicContact CG-CD1 4.13Å; L182-I184 HydrophobicContact CG-CG1 3.53Å; L182-I184 PolarHBondContact O-N 3.47Å; L182-R261 HydrophobicContact CD1-CG 4.42Å; L182-R261 HydrophobicContact CD2-CB 4.4Å; L182-R261 HydrophobicContact CD2-CG 3.96Å; L182-W262 HydrophobicContact CB-CB 4.48Å; L182-W262 HydrophobicContact CB-CG 4.19Å; L182-W262 HydrophobicContact CD2-CB 4.23Å; L182-Y265 VanDerWaalsContact CD1-CB 3.46Å; L182-Y265 HydrophobicContact CD1-CD1 4.15Å; L182-Y265 HydrophobicContact CD1-CD2 3.74Å; L182-Y265 HydrophobicContact CD1-CG 3.52Å |
| 183 | D | 83.5 | Confident | 88.9 | Confident | 121 Ų | 121 | 103.4 Ų | 103.4 | 65% | 0.647 | 48% | 0.483 | S | S | * | . | trans | -72.2 | 90.3 | 171.5 | -168.9 | 15 | 0 | 0 | 0 | 108.9 | K181 Y265 | K181-D183 PolarHBondContact O-N 3.01Å; D183-Y265 HydrophobicContact CB-CE2 4.36Å | ||
| 184 | I | 87.3 | Confident | 89 | Confident | 30 Ų | 30 | 104.2 Ų | 104.2 | 15% | 0.154 | 49% | 0.49 | C | S | . | . | trans | -104.5 | 133.2 | -178.7 | -60.2 | 176.9 | 0 | 0 | 0 | 107.7 | L182 E188 R189 I192 | L182-I184 VanDerWaalsContact C-N 3.28Å; L182-I184 HydrophobicContact CB-CD1 4.05Å; L182-I184 HydrophobicContact CB-CG1 3.77Å; L182-I184 HydrophobicContact CD2-CD1 3.86Å; L182-I184 HydrophobicContact CD2-CG1 3.63Å; L182-I184 HydrophobicContact CG-CD1 4.13Å; L182-I184 HydrophobicContact CG-CG1 3.53Å; L182-I184 PolarHBondContact O-N 3.47Å; I184-E188 HydrophobicContact CG2-CB 3.53Å; I184-E188 HydrophobicContact CG2-CG 3.54Å; I184-R189 HydrophobicContact CG2-CB 4.25Å; I184-I192 HydrophobicContact CD1-CD1 4.25Å | ||
| 185 | S | 90 | Very high | 89.1 | Confident | 65 Ų | 65 | 103.6 Ų | 103.6 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | trans | -53.6 | 145.9 | 173 | 71.9 | 0 | 0 | 0 | 0 | 111.2 | V187 E188 R189 | S185-V187 PolarHBondContact O-N 2.95Å; S185-V187 VanDerWaalsContact O-N 3.15Å; S185-E188 PolarHBondContact O-N 3.18Å; S185-E188 VanDerWaalsContact O-N 3.14Å; S185-E188 WeakPolarHBondContact OG-CB 3.47Å; S185-E188 PolarHBondContact OG-N 3.14Å; S185-R189 PolarHBondContact O-N 3.34Å | ||
| 186 | S | 91 | Very high | 89.3 | Confident | 88 Ų | 88 | 102.7 Ų | 102.7 | 62% | 0.615 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -56.5 | -34.5 | -179.6 | 56.7 | 0 | 0 | 0 | 0 | 112.7 | R190 | S186-R190 PolarHBondContact O-N 3.44Å; S186-R190 VanDerWaalsContact O-N 3.1Å |
| 187 | V | 90.3 | Very high | 89.6 | Confident | 84 Ų | 84 | 96.8 Ų | 96.8 | 51% | 0.509 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -68.9 | -47.4 | 177.2 | -179.8 | 0 | 0 | 0 | 0 | 111.5 | S185 R189 R190 K191 | S185-V187 PolarHBondContact O-N 2.95Å; S185-V187 VanDerWaalsContact O-N 3.15Å; V187-R189 VanDerWaalsContact C-N 3.32Å; V187-R189 PolarHBondContact O-N 3.19Å; V187-R190 PolarHBondContact O-N 3.15Å; V187-K191 WeakPolarHBondContact O-CG 3.47Å; V187-K191 PolarHBondContact O-N 3.35Å |
| 188 | E | 88.9 | Confident | 89.9 | Confident | 31 Ų | 31 | 90.7 Ų | 90.7 | 15% | 0.145 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -63.1 | -40.8 | 177.4 | -177.6 | -179.6 | -178.2 | 0 | 0 | 110.8 | I184 S185 R190 K191 I192 R261 | I184-E188 HydrophobicContact CG2-CB 3.53Å; I184-E188 HydrophobicContact CG2-CG 3.54Å; S185-E188 PolarHBondContact O-N 3.18Å; S185-E188 VanDerWaalsContact O-N 3.14Å; S185-E188 WeakPolarHBondContact OG-CB 3.47Å; S185-E188 PolarHBondContact OG-N 3.14Å; E188-R190 VanDerWaalsContact C-N 3.34Å; E188-R190 PolarHBondContact O-N 3.32Å; E188-K191 PolarHBondContact O-N 3.39Å; E188-I192 HydrophobicContact CG-CD1 4.12Å; E188-I192 VanDerWaalsContact O-CG1 3.32Å; E188-I192 WeakPolarHBondContact O-CG1 3.32Å; E188-I192 PolarHBondContact O-N 3.26Å; E188-R261 VanDerWaalsContact CD-NH1 3.33Å; E188-R261 IonicContact OE1-NH1 2.7Å; E188-R261 PolarHBondContact OE1-NH1 3.03Å; E188-R261 IonicContact OE2-CZ 2.77Å; E188-R261 IonicContact OE2-NH1 2.85Å; E188-R261 PolarHBondContact OE2-NH1 2.93Å |
| 189 | R | 89.9 | Confident | 90.1 | Very high | 155 Ų | 155 | 83.9 Ų | 83.9 | 59% | 0.585 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -59.3 | -43.1 | 174.7 | -169.6 | -174.9 | -57.4 | 175.6 | 4.5 | 112.3 | I184 S185 V187 I192 F193 | I184-R189 HydrophobicContact CG2-CB 4.25Å; S185-R189 PolarHBondContact O-N 3.34Å; V187-R189 VanDerWaalsContact C-N 3.32Å; V187-R189 PolarHBondContact O-N 3.19Å; R189-I192 PolarHBondContact O-N 3.45Å; R189-F193 WeakPolarHBondContact O-CB 3.42Å; R189-F193 PolarHBondContact O-N 2.92Å |
| 190 | R | 92.4 | Very high | 90.3 | Very high | 179 Ų | 179 | 86.3 Ų | 86.3 | 68% | 0.675 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -63.5 | -44.9 | 176.9 | -173.3 | -178.8 | -61 | 166.3 | 1.6 | 111.4 | S186 V187 E188 I192 F193 C194 | S186-R190 PolarHBondContact O-N 3.44Å; S186-R190 VanDerWaalsContact O-N 3.1Å; V187-R190 PolarHBondContact O-N 3.15Å; E188-R190 VanDerWaalsContact C-N 3.34Å; E188-R190 PolarHBondContact O-N 3.32Å; R190-I192 VanDerWaalsContact C-N 3.33Å; R190-I192 PolarHBondContact O-N 2.76Å; R190-F193 PolarHBondContact O-N 3.09Å; R190-C194 WeakPolarHBondContact O-CB 3.32Å; R190-C194 PolarHBondContact O-N 3.22Å; R190-C194 PolarHBondContact O-SG 3.23Å |
| 191 | K | 90.3 | Very high | 90.6 | Very high | 148 Ų | 148 | 87 Ų | 87 | 64% | 0.643 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -58.1 | -45.1 | 176.8 | -70.4 | 176 | 178.7 | -178.1 | 0 | 111.6 | V187 E188 S195 | V187-K191 WeakPolarHBondContact O-CG 3.47Å; V187-K191 PolarHBondContact O-N 3.35Å; E188-K191 PolarHBondContact O-N 3.39Å; K191-S195 WeakPolarHBondContact O-CB 3.16Å; K191-S195 PolarHBondContact O-N 3.27Å |
| 192 | I | 91.2 | Very high | 90.8 | Very high | 42 Ų | 42 | 79.5 Ų | 79.5 | 22% | 0.215 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 177.3 | -65.3 | 164.6 | 0 | 0 | 0 | 110.4 | I184 E188 R189 R190 S195 V196 L258 | I184-I192 HydrophobicContact CD1-CD1 4.25Å; E188-I192 HydrophobicContact CG-CD1 4.12Å; E188-I192 VanDerWaalsContact O-CG1 3.32Å; E188-I192 WeakPolarHBondContact O-CG1 3.32Å; E188-I192 PolarHBondContact O-N 3.26Å; R189-I192 PolarHBondContact O-N 3.45Å; R190-I192 VanDerWaalsContact C-N 3.33Å; R190-I192 PolarHBondContact O-N 2.76Å; I192-S195 PolarHBondContact O-N 3.48Å; I192-V196 HydrophobicContact CG2-CG2 4.28Å; I192-V196 VanDerWaalsContact O-CG2 3.32Å; I192-V196 WeakPolarHBondContact O-CG2 3.41Å; I192-V196 PolarHBondContact O-N 3.35Å; I192-L258 HydrophobicContact CD1-CD1 3.73Å; I192-L258 HydrophobicContact CD1-CD2 3.92Å; I192-L258 HydrophobicContact CD1-CG 4.49Å; I192-L258 HydrophobicContact CG1-CD1 3.83Å |
| 193 | F | 92.4 | Very high | 91 | Very high | 149 Ų | 149 | 82.5 Ų | 82.5 | 65% | 0.654 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -61 | -47.4 | 179.6 | -178.7 | -95.7 | 0 | 0 | 0 | 112.2 | R189 R190 S195 V196 A197 | R189-F193 WeakPolarHBondContact O-CB 3.42Å; R189-F193 PolarHBondContact O-N 2.92Å; R190-F193 PolarHBondContact O-N 3.09Å; F193-S195 VanDerWaalsContact C-N 3.31Å; F193-S195 PolarHBondContact O-N 3.38Å; F193-V196 PolarHBondContact O-N 2.72Å; F193-A197 WeakPolarHBondContact O-CB 3.43Å; F193-A197 PolarHBondContact O-N 3.27Å |
| 194 | C | 92.3 | Very high | 91.5 | Very high | 72 Ų | 72 | 80.5 Ų | 80.5 | 49% | 0.486 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -59.4 | -42.4 | 175.4 | -69.5 | 0 | 0 | 0 | 0 | 111.6 | R190 A197 F198 | R190-C194 WeakPolarHBondContact O-CB 3.32Å; R190-C194 PolarHBondContact O-N 3.22Å; R190-C194 PolarHBondContact O-SG 3.23Å; C194-A197 PolarHBondContact O-N 3Å; C194-F198 VanDerWaalsContact O-CB 3.32Å; C194-F198 WeakPolarHBondContact O-CB 3.07Å; C194-F198 PolarHBondContact O-N 3.41Å |
| 195 | S | 91.4 | Very high | 91.8 | Very high | 30 Ų | 30 | 82.3 Ų | 82.3 | 21% | 0.21 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -61.3 | -50.8 | 175.5 | -179.6 | 0 | 0 | 0 | 0 | 111.2 | K191 I192 F193 A197 F198 H199 Y255 | K191-S195 WeakPolarHBondContact O-CB 3.16Å; K191-S195 PolarHBondContact O-N 3.27Å; I192-S195 PolarHBondContact O-N 3.48Å; F193-S195 VanDerWaalsContact C-N 3.31Å; F193-S195 PolarHBondContact O-N 3.38Å; S195-A197 VanDerWaalsContact C-N 3.35Å; S195-A197 PolarHBondContact O-N 3.3Å; S195-F198 WeakPolarHBondContact O-CB 3.48Å; S195-F198 PolarHBondContact O-N 3.42Å; S195-H199 PolarHBondContact O-N 3.23Å; S195-H199 PolarHBondContact O-ND1 3.22Å; S195-H199 PolarHBondContact OG-CE1 3.3Å; S195-Y255 PolarHBondContact OG-OH 3.2Å |
| 196 | V | 92 | Very high | 91.8 | Very high | 62 Ų | 62 | 82.9 Ų | 82.9 | 38% | 0.376 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -59.1 | -45.4 | 178.8 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | I192 F193 F198 H199 V200 Y255 | I192-V196 HydrophobicContact CG2-CG2 4.28Å; I192-V196 VanDerWaalsContact O-CG2 3.32Å; I192-V196 WeakPolarHBondContact O-CG2 3.41Å; I192-V196 PolarHBondContact O-N 3.35Å; F193-V196 PolarHBondContact O-N 2.72Å; V196-F198 PolarHBondContact O-N 3.02Å; V196-H199 PolarHBondContact O-N 2.7Å; V196-V200 WeakPolarHBondContact O-CG2 3.46Å; V196-V200 PolarHBondContact O-N 2.85Å; V196-Y255 HydrophobicContact CG2-CE1 3.85Å; V196-Y255 WeakPolarHBondContact CG2-OH 3.35Å |
| 197 | A | 92.9 | Very high | 91.8 | Very high | 35 Ų | 35 | 83 Ų | 83 | 29% | 0.289 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.6 | -44.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F193 C194 S195 H199 V200 I201 | F193-A197 WeakPolarHBondContact O-CB 3.43Å; F193-A197 PolarHBondContact O-N 3.27Å; C194-A197 PolarHBondContact O-N 3Å; S195-A197 VanDerWaalsContact C-N 3.35Å; S195-A197 PolarHBondContact O-N 3.3Å; A197-H199 VanDerWaalsContact C-N 3.29Å; A197-H199 PolarHBondContact O-N 3.39Å; A197-V200 PolarHBondContact O-N 3.22Å; A197-I201 WeakPolarHBondContact O-CG1 3.37Å; A197-I201 PolarHBondContact O-N 2.92Å |
| 198 | F | 93.6 | Very high | 92 | Very high | 119 Ų | 119 | 87.6 Ų | 87.6 | 52% | 0.522 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -57.4 | -42.1 | 175.1 | 177.8 | -95.7 | 0 | 0 | 0 | 111.7 | C194 S195 V196 I201 A202 F247 | C194-F198 VanDerWaalsContact O-CB 3.32Å; C194-F198 WeakPolarHBondContact O-CB 3.07Å; C194-F198 PolarHBondContact O-N 3.41Å; S195-F198 WeakPolarHBondContact O-CB 3.48Å; S195-F198 PolarHBondContact O-N 3.42Å; V196-F198 PolarHBondContact O-N 3.02Å; F198-I201 PolarHBondContact O-N 2.84Å; F198-A202 VanDerWaalsContact O-CB 3.27Å; F198-A202 WeakPolarHBondContact O-CB 3.18Å; F198-A202 PolarHBondContact O-N 3.27Å; F198-F247 HydrophobicContact CD1-CE1 4.11Å; F198-F247 AromaticContact CD1-CZ 3.91Å; F198-F247 HydrophobicContact CD1-CZ 3.91Å; F198-F247 AromaticContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE2 4.42Å; F198-F247 AromaticContact CE1-CZ 3.47Å; F198-F247 HydrophobicContact CE1-CZ 3.47Å; F198-F247 VanDerWaalsContact CE1-CZ 3.47Å |
| 199 | H | 92.8 | Very high | 92 | Very high | 12 Ų | 12 | 89.9 Ų | 89.9 | 6% | 0.056 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -66.6 | -43.8 | 177.3 | -74.4 | 81.1 | 0 | 0 | 0 | 112.9 | S195 V196 A197 I201 A202 I203 F247 Q251 | S195-H199 PolarHBondContact O-N 3.23Å; S195-H199 PolarHBondContact O-ND1 3.22Å; S195-H199 PolarHBondContact OG-CE1 3.3Å; V196-H199 PolarHBondContact O-N 2.7Å; A197-H199 VanDerWaalsContact C-N 3.29Å; A197-H199 PolarHBondContact O-N 3.39Å; H199-I201 VanDerWaalsContact C-N 3.28Å; H199-I201 PolarHBondContact O-N 3.49Å; H199-A202 PolarHBondContact O-N 2.89Å; H199-I203 WeakPolarHBondContact O-CB 3.37Å; H199-I203 WeakPolarHBondContact O-CD1 3.28Å; H199-I203 WeakPolarHBondContact O-CG1 3.26Å; H199-I203 PolarHBondContact O-N 3.48Å; H199-F247 AromaticContact CD2-CE1 3.74Å; H199-F247 AromaticContact CE1-CE1 3.7Å; H199-F247 AromaticContact CE1-CZ 3.95Å; H199-F247 AromaticContact NE2-CD1 3.87Å; H199-F247 AromaticContact NE2-CE1 3.19Å; H199-F247 WeakPolarHBondContact NE2-CE1 3.42Å; H199-F247 AromaticContact NE2-CZ 3.84Å; H199-Q251 VanDerWaalsContact CE1-CG 3.48Å; H199-Q251 WeakPolarHBondContact CE1-CG 3.3Å; H199-Q251 VanDerWaalsContact NE2-CB 3.26Å; H199-Q251 WeakPolarHBondContact NE2-CB 3.17Å; H199-Q251 WeakPolarHBondContact NE2-CG 3.46Å |
| 200 | V | 92.8 | Very high | 92 | Very high | 85 Ų | 85 | 85.1 Ų | 85.1 | 52% | 0.515 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.4 | -44.5 | 178 | 172.1 | 0 | 0 | 0 | 0 | 110.2 | V196 A197 T204 | V196-V200 WeakPolarHBondContact O-CG2 3.46Å; V196-V200 PolarHBondContact O-N 2.85Å; A197-V200 PolarHBondContact O-N 3.22Å; V200-T204 WeakPolarHBondContact O-CB 3.35Å; V200-T204 PolarHBondContact O-N 3.01Å; V200-T204 PolarHBondContact O-OG1 3.24Å |
| 201 | I | 95.1 | Very high | 91.9 | Very high | 110 Ų | 110 | 84.5 Ų | 84.5 | 56% | 0.564 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -64.1 | -50.3 | 176.6 | -64.5 | 166 | 0 | 0 | 0 | 110.4 | A197 F198 H199 I203 T204 C205 | A197-I201 WeakPolarHBondContact O-CG1 3.37Å; A197-I201 PolarHBondContact O-N 2.92Å; F198-I201 PolarHBondContact O-N 2.84Å; H199-I201 VanDerWaalsContact C-N 3.28Å; H199-I201 PolarHBondContact O-N 3.49Å; I201-I203 PolarHBondContact O-N 2.97Å; I201-T204 PolarHBondContact O-N 3.43Å; I201-C205 PolarHBondContact O-N 3.43Å; I201-C205 PolarHBondContact O-SG 3.42Å |
| 202 | A | 91.2 | Very high | 91.9 | Very high | 32 Ų | 32 | 79.8 Ų | 79.8 | 26% | 0.264 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -59.2 | -45.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F198 H199 C205 V206 | F198-A202 VanDerWaalsContact O-CB 3.27Å; F198-A202 WeakPolarHBondContact O-CB 3.18Å; F198-A202 PolarHBondContact O-N 3.27Å; H199-A202 PolarHBondContact O-N 2.89Å; A202-C205 PolarHBondContact O-N 2.99Å; A202-V206 VanDerWaalsContact O-CG2 3.31Å; A202-V206 WeakPolarHBondContact O-CG2 3.33Å; A202-V206 PolarHBondContact O-N 3.25Å |
| 203 | I | 90.4 | Very high | 91.7 | Very high | 83 Ų | 83 | 80.1 Ų | 80.1 | 43% | 0.426 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 176.5 | -67.3 | 165.1 | 0 | 0 | 0 | 110.1 | H199 I201 C205 V206 V207 M248 | H199-I203 WeakPolarHBondContact O-CB 3.37Å; H199-I203 WeakPolarHBondContact O-CD1 3.28Å; H199-I203 WeakPolarHBondContact O-CG1 3.26Å; H199-I203 PolarHBondContact O-N 3.48Å; I201-I203 PolarHBondContact O-N 2.97Å; I203-C205 VanDerWaalsContact C-N 3.32Å; I203-C205 PolarHBondContact O-N 3.24Å; I203-V206 PolarHBondContact O-N 3.03Å; I203-V207 HydrophobicContact CG2-CG2 4.25Å; I203-V207 WeakPolarHBondContact O-CB 3.4Å; I203-V207 VanDerWaalsContact O-CG2 3.28Å; I203-V207 WeakPolarHBondContact O-CG2 3.46Å; I203-V207 PolarHBondContact O-N 3.1Å; I203-M248 HydrophobicContact CD1-CE 3.88Å; I203-M248 HydrophobicContact CG1-CE 4.29Å |
| 204 | T | 94.1 | Very high | 91.4 | Very high | 80 Ų | 80 | 78.3 Ų | 78.3 | 49% | 0.491 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.8 | -44 | 178.2 | -56.9 | 0 | 0 | 0 | 0 | 111.1 | V200 I201 V207 W208 | V200-T204 WeakPolarHBondContact O-CB 3.35Å; V200-T204 PolarHBondContact O-N 3.01Å; V200-T204 PolarHBondContact O-OG1 3.24Å; I201-T204 PolarHBondContact O-N 3.43Å; T204-V207 PolarHBondContact O-N 3.35Å; T204-W208 WeakPolarHBondContact O-CB 3.47Å; T204-W208 PolarHBondContact O-N 3.39Å |
| 205 | C | 93.6 | Very high | 91.1 | Very high | 68 Ų | 68 | 79.7 Ų | 79.7 | 46% | 0.459 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.6 | -46.5 | 175.9 | -68.5 | 0 | 0 | 0 | 0 | 112.1 | I201 A202 I203 V207 W208 S209 | I201-C205 PolarHBondContact O-N 3.43Å; I201-C205 PolarHBondContact O-SG 3.42Å; A202-C205 PolarHBondContact O-N 2.99Å; I203-C205 VanDerWaalsContact C-N 3.32Å; I203-C205 PolarHBondContact O-N 3.24Å; C205-V207 PolarHBondContact O-N 2.87Å; C205-W208 PolarHBondContact O-N 3.32Å; C205-S209 WeakPolarHBondContact O-CB 3.36Å; C205-S209 PolarHBondContact O-N 3.04Å; C205-S209 PolarHBondContact O-OG 3.39Å; C205-S209 VanDerWaalsContact O-OG 3.07Å |
| 206 | V | 89.2 | Confident | 90.8 | Very high | 76 Ų | 76 | 85.6 Ų | 85.6 | 46% | 0.461 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.4 | -46.4 | 178.5 | 170.7 | 0 | 0 | 0 | 0 | 110.7 | A202 I203 W208 S209 L210 | A202-V206 VanDerWaalsContact O-CG2 3.31Å; A202-V206 WeakPolarHBondContact O-CG2 3.33Å; A202-V206 PolarHBondContact O-N 3.25Å; I203-V206 PolarHBondContact O-N 3.03Å; V206-W208 PolarHBondContact O-N 3.36Å; V206-S209 PolarHBondContact O-N 2.88Å; V206-L210 HydrophobicContact CG1-CD1 3.83Å; V206-L210 HydrophobicContact CG1-CG 4.3Å; V206-L210 WeakPolarHBondContact O-CB 3.43Å; V206-L210 WeakPolarHBondContact O-CG 3.33Å; V206-L210 PolarHBondContact O-N 3.3Å |
| 207 | V | 90 | Very high | 90.3 | Very high | 90 Ų | 90 | 84 Ų | 84 | 55% | 0.545 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.1 | -44.9 | 178.4 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | I203 T204 C205 L210 Y211 | I203-V207 HydrophobicContact CG2-CG2 4.25Å; I203-V207 WeakPolarHBondContact O-CB 3.4Å; I203-V207 VanDerWaalsContact O-CG2 3.28Å; I203-V207 WeakPolarHBondContact O-CG2 3.46Å; I203-V207 PolarHBondContact O-N 3.1Å; T204-V207 PolarHBondContact O-N 3.35Å; C205-V207 PolarHBondContact O-N 2.87Å; V207-L210 PolarHBondContact O-N 2.87Å; V207-Y211 WeakPolarHBondContact O-CB 3.39Å; V207-Y211 PolarHBondContact O-N 3.4Å |
| 208 | W | 94.6 | Very high | 89.8 | Confident | 182 Ų | 182 | 85 Ų | 85 | 69% | 0.689 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -62.3 | -47.7 | 176.7 | -173.4 | -63.6 | 0 | 0 | 0 | 111.9 | T204 C205 V206 L210 Y211 V212 | T204-W208 WeakPolarHBondContact O-CB 3.47Å; T204-W208 PolarHBondContact O-N 3.39Å; C205-W208 PolarHBondContact O-N 3.32Å; V206-W208 PolarHBondContact O-N 3.36Å; W208-L210 VanDerWaalsContact C-N 3.34Å; W208-L210 PolarHBondContact O-N 2.86Å; W208-Y211 WeakPolarHBondContact O-CB 3.44Å; W208-Y211 PolarHBondContact O-N 3.1Å; W208-V212 WeakPolarHBondContact O-CG2 3.35Å; W208-V212 PolarHBondContact O-N 3.14Å |
| 209 | S | 90.2 | Very high | 89.3 | Confident | 78 Ų | 78 | 82.7 Ų | 82.7 | 55% | 0.545 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.7 | -41.9 | 178.6 | -67.1 | 0 | 0 | 0 | 0 | 111.8 | C205 V206 L213 | C205-S209 WeakPolarHBondContact O-CB 3.36Å; C205-S209 PolarHBondContact O-N 3.04Å; C205-S209 PolarHBondContact O-OG 3.39Å; C205-S209 VanDerWaalsContact O-OG 3.07Å; V206-S209 PolarHBondContact O-N 2.88Å; S209-L213 VanDerWaalsContact O-CB 3.28Å; S209-L213 WeakPolarHBondContact O-CB 3.41Å; S209-L213 PolarHBondContact O-N 2.95Å |
| 210 | L | 89 | Confident | 88.8 | Confident | 56 Ų | 56 | 84.3 Ų | 84.3 | 29% | 0.293 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64 | -43 | 174.9 | -72.2 | 175 | 0 | 0 | 0 | 111.6 | V206 V207 W208 L213 I214 V237 | V206-L210 HydrophobicContact CG1-CD1 3.83Å; V206-L210 HydrophobicContact CG1-CG 4.3Å; V206-L210 WeakPolarHBondContact O-CB 3.43Å; V206-L210 WeakPolarHBondContact O-CG 3.33Å; V206-L210 PolarHBondContact O-N 3.3Å; V207-L210 PolarHBondContact O-N 2.87Å; W208-L210 VanDerWaalsContact C-N 3.34Å; W208-L210 PolarHBondContact O-N 2.86Å; L210-L213 PolarHBondContact O-N 3.45Å; L210-I214 WeakPolarHBondContact O-CB 3.48Å; L210-I214 WeakPolarHBondContact O-CD1 3.46Å; L210-I214 WeakPolarHBondContact O-CG1 3.3Å; L210-I214 PolarHBondContact O-N 3Å; L210-V237 HydrophobicContact CD2-CG1 3.73Å; L210-V237 HydrophobicContact CD2-CG2 4.31Å |
| 211 | Y | 91.2 | Very high | 88.2 | Confident | 165 Ų | 165 | 84.7 Ų | 84.7 | 65% | 0.647 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -56.9 | -51.9 | 176.1 | 174.4 | -95 | 0 | 0 | 0 | 111.7 | V207 W208 L213 I214 D215 | V207-Y211 WeakPolarHBondContact O-CB 3.39Å; V207-Y211 PolarHBondContact O-N 3.4Å; W208-Y211 WeakPolarHBondContact O-CB 3.44Å; W208-Y211 PolarHBondContact O-N 3.1Å; Y211-L213 VanDerWaalsContact C-N 3.26Å; Y211-L213 PolarHBondContact O-N 3.13Å; Y211-I214 PolarHBondContact O-N 3.18Å; Y211-D215 PolarHBondContact O-N 3.35Å |
| 212 | V | 90 | Very high | 87.6 | Confident | 50 Ų | 50 | 88.5 Ų | 88.5 | 30% | 0.303 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.7 | -36.6 | 178.7 | 173.1 | 0 | 0 | 0 | 0 | 111.6 | W208 R216 | W208-V212 WeakPolarHBondContact O-CG2 3.35Å; W208-V212 PolarHBondContact O-N 3.14Å; V212-R216 WeakPolarHBondContact O-CG 3.44Å; V212-R216 PolarHBondContact O-N 2.84Å |
| 213 | L | 85.9 | Confident | 87.2 | Confident | 48 Ų | 48 | 93.6 Ų | 93.6 | 25% | 0.251 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -73.9 | -39.7 | -179.7 | -175.2 | 60.6 | 0 | 0 | 0 | 112.6 | S209 L210 Y211 R216 T217 K233 V237 | S209-L213 VanDerWaalsContact O-CB 3.28Å; S209-L213 WeakPolarHBondContact O-CB 3.41Å; S209-L213 PolarHBondContact O-N 2.95Å; L210-L213 PolarHBondContact O-N 3.45Å; Y211-L213 VanDerWaalsContact C-N 3.26Å; Y211-L213 PolarHBondContact O-N 3.13Å; L213-R216 PolarHBondContact O-N 3.39Å; L213-T217 VanDerWaalsContact O-CB 3.28Å; L213-T217 WeakPolarHBondContact O-CB 3.11Å; L213-T217 PolarHBondContact O-N 3.17Å; L213-T217 PolarHBondContact O-OG1 3.42Å; L213-K233 HydrophobicContact CD1-CB 4.3Å; L213-K233 HydrophobicContact CD1-CD 4.21Å; L213-K233 HydrophobicContact CD1-CG 4.29Å; L213-V237 HydrophobicContact CD2-CG2 3.01Å; L213-V237 HydrophobicContact CG-CG2 4.36Å |
| 214 | I | 86.7 | Confident | 86.7 | Confident | 112 Ų | 112 | 92.2 Ų | 92.2 | 57% | 0.574 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -63.8 | -44.2 | 176.8 | -69.6 | 162.8 | 0 | 0 | 0 | 110.3 | L210 Y211 R216 T217 A218 | L210-I214 WeakPolarHBondContact O-CB 3.48Å; L210-I214 WeakPolarHBondContact O-CD1 3.46Å; L210-I214 WeakPolarHBondContact O-CG1 3.3Å; L210-I214 PolarHBondContact O-N 3Å; Y211-I214 PolarHBondContact O-N 3.18Å; I214-R216 PolarHBondContact O-N 3.47Å; I214-T217 PolarHBondContact O-N 3.38Å; I214-T217 VanDerWaalsContact O-N 3.16Å; I214-A218 WeakPolarHBondContact O-CB 3.5Å; I214-A218 PolarHBondContact O-N 3.07Å |
| 215 | D | 86.3 | Confident | 85.8 | Confident | 101 Ų | 101 | 93.8 Ų | 93.8 | 54% | 0.54 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -56.5 | -48.7 | 177 | -175.2 | 62.2 | 0 | 0 | 0 | 111.5 | Y211 T217 A218 E219 | Y211-D215 PolarHBondContact O-N 3.35Å; D215-T217 VanDerWaalsContact C-N 3.34Å; D215-T217 PolarHBondContact O-N 2.8Å; D215-A218 PolarHBondContact O-N 3.34Å; D215-E219 PolarHBondContact O-N 3.02Å |
| 216 | R | 84.6 | Confident | 85 | Confident | 153 Ų | 153 | 95.2 Ų | 95.2 | 58% | 0.577 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -63.5 | -38.6 | 175.9 | -66.4 | -92 | 170 | 68.1 | 1.8 | 112.7 | V212 L213 I214 E219 E220 | V212-R216 WeakPolarHBondContact O-CG 3.44Å; V212-R216 PolarHBondContact O-N 2.84Å; L213-R216 PolarHBondContact O-N 3.39Å; I214-R216 PolarHBondContact O-N 3.47Å; R216-E219 PolarHBondContact O-N 3.26Å; R216-E220 PolarHBondContact O-N 3.47Å |
| 217 | T | 82.2 | Confident | 84.6 | Confident | 28 Ų | 28 | 95.3 Ų | 95.3 | 17% | 0.172 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -71.4 | -37.4 | -179 | -57 | 0 | 0 | 0 | 0 | 111.6 | L213 I214 D215 E219 E220 I221 F230 | L213-T217 VanDerWaalsContact O-CB 3.28Å; L213-T217 WeakPolarHBondContact O-CB 3.11Å; L213-T217 PolarHBondContact O-N 3.17Å; L213-T217 PolarHBondContact O-OG1 3.42Å; I214-T217 PolarHBondContact O-N 3.38Å; I214-T217 VanDerWaalsContact O-N 3.16Å; D215-T217 VanDerWaalsContact C-N 3.34Å; D215-T217 PolarHBondContact O-N 2.8Å; T217-E219 VanDerWaalsContact C-N 3.29Å; T217-E219 PolarHBondContact O-N 2.9Å; T217-E220 PolarHBondContact O-N 3.24Å; T217-I221 HydrophobicContact CG2-CD1 4.02Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.39Å; T217-I221 PolarHBondContact O-N 2.83Å; T217-F230 HydrophobicContact CG2-CD2 3.98Å; T217-F230 HydrophobicContact CG2-CE2 3.46Å; T217-F230 VanDerWaalsContact CG2-CE2 3.46Å |
| 218 | A | 83.2 | Confident | 84.2 | Confident | 57 Ų | 57 | 101.4 Ų | 101.4 | 47% | 0.471 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.1 | -37.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | I214 D215 R222 | I214-A218 WeakPolarHBondContact O-CB 3.5Å; I214-A218 PolarHBondContact O-N 3.07Å; D215-A218 PolarHBondContact O-N 3.34Å; A218-R222 PolarHBondContact O-N 3.5Å; A218-R222 VanDerWaalsContact O-N 3.15Å |
| 219 | E | 82.4 | Confident | 83.6 | Confident | 71 Ų | 71 | 96.1 Ų | 96.1 | 33% | 0.332 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.7 | -47.5 | 173.9 | -169.1 | 59.5 | -129.5 | 0 | 0 | 112 | D215 R216 T217 I221 R222 E223 | D215-E219 PolarHBondContact O-N 3.02Å; R216-E219 PolarHBondContact O-N 3.26Å; T217-E219 VanDerWaalsContact C-N 3.29Å; T217-E219 PolarHBondContact O-N 2.9Å; E219-I221 VanDerWaalsContact C-N 3.35Å; E219-I221 PolarHBondContact O-N 3.5Å; E219-R222 WeakPolarHBondContact O-CA 3.45Å; E219-R222 VanDerWaalsContact O-CB 3.3Å; E219-R222 WeakPolarHBondContact O-CB 3.29Å; E219-R222 PolarHBondContact O-N 3.49Å; E219-R222 IonicContact OE1-CZ 3.01Å; E219-R222 IonicContact OE1-NE 3.94Å; E219-R222 PolarHBondContact OE1-NE 2.88Å; E219-R222 IonicContact OE1-NH2 3.16Å; E219-R222 PolarHBondContact OE1-NH2 3.07Å; E219-R222 IonicContact OE2-CZ 3.95Å; E219-R222 IonicContact OE2-NE 2.6Å; E219-R222 IonicContact OE2-NH1 2.66Å; E219-R222 IonicContact OE2-NH2 3.21Å; E219-R222 PolarHBondContact OE2-NH2 2.86Å; E219-E223 PolarHBondContact O-N 3.27Å |
| 220 | E | 81.5 | Confident | 83.4 | Confident | 45 Ų | 45 | 93.8 Ų | 93.8 | 21% | 0.21 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.4 | -37 | -179.8 | -72.9 | 167.8 | -160.3 | 0 | 0 | 113.1 | R216 T217 R222 E223 G224 H225 K233 | R216-E220 PolarHBondContact O-N 3.47Å; T217-E220 PolarHBondContact O-N 3.24Å; E220-R222 VanDerWaalsContact C-N 3.29Å; E220-R222 PolarHBondContact O-N 2.89Å; E220-E223 PolarHBondContact O-N 2.9Å; E220-G224 PolarHBondContact O-N 3.42Å; E220-G224 VanDerWaalsContact O-N 3.09Å; E220-H225 PolarHBondContact O-N 3.32Å; E220-K233 IonicContact OE1-NZ 3.64Å; E220-K233 PolarHBondContact OE1-NZ 3.22Å; E220-K233 IonicContact OE2-NZ 2.56Å; E220-K233 PolarHBondContact OE2-NZ 3.44Å |
| 221 | I | 80.1 | Confident | 83.2 | Confident | 94 Ų | 94 | 97.5 Ų | 97.5 | 48% | 0.482 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 173.2 | -68.2 | 167.3 | 0 | 0 | 0 | 110.2 | T217 E219 E223 G224 F230 | T217-I221 HydrophobicContact CG2-CD1 4.02Å; T217-I221 VanDerWaalsContact O-CG1 3.29Å; T217-I221 WeakPolarHBondContact O-CG1 3.39Å; T217-I221 PolarHBondContact O-N 2.83Å; E219-I221 VanDerWaalsContact C-N 3.35Å; E219-I221 PolarHBondContact O-N 3.5Å; I221-E223 VanDerWaalsContact C-N 3.31Å; I221-E223 PolarHBondContact O-N 3.37Å; I221-G224 PolarHBondContact O-N 2.95Å; I221-F230 HydrophobicContact CD1-CE2 4.17Å; I221-F230 HydrophobicContact CG1-CE2 4.14Å |
| 222 | R | 82.5 | Confident | 83.1 | Confident | 189 Ų | 189 | 93.3 Ų | 93.3 | 71% | 0.713 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -65.2 | -35.8 | 176.2 | -173.4 | 174.3 | 71.1 | 178 | 5.7 | 112 | A218 E219 E220 G224 | A218-R222 PolarHBondContact O-N 3.5Å; A218-R222 VanDerWaalsContact O-N 3.15Å; E219-R222 WeakPolarHBondContact O-CA 3.45Å; E219-R222 VanDerWaalsContact O-CB 3.3Å; E219-R222 WeakPolarHBondContact O-CB 3.29Å; E219-R222 PolarHBondContact O-N 3.49Å; E219-R222 IonicContact OE1-CZ 3.01Å; E219-R222 IonicContact OE1-NE 3.94Å; E219-R222 PolarHBondContact OE1-NE 2.88Å; E219-R222 IonicContact OE1-NH2 3.16Å; E219-R222 PolarHBondContact OE1-NH2 3.07Å; E219-R222 IonicContact OE2-CZ 3.95Å; E219-R222 IonicContact OE2-NE 2.6Å; E219-R222 IonicContact OE2-NH1 2.66Å; E219-R222 IonicContact OE2-NH2 3.21Å; E219-R222 PolarHBondContact OE2-NH2 2.86Å; E220-R222 VanDerWaalsContact C-N 3.29Å; E220-R222 PolarHBondContact O-N 2.89Å; R222-G224 VanDerWaalsContact C-N 3.27Å; R222-G224 PolarHBondContact O-N 3.39Å |
| 223 | E | 83.4 | Confident | 83 | Confident | 139 Ų | 139 | 93.8 Ų | 93.8 | 65% | 0.65 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -76.4 | -11.9 | 175.2 | -67.1 | -176.8 | 166.8 | 0 | 0 | 113.4 | E219 E220 I221 H225 | E219-E223 PolarHBondContact O-N 3.27Å; E220-E223 PolarHBondContact O-N 2.9Å; I221-E223 VanDerWaalsContact C-N 3.31Å; I221-E223 PolarHBondContact O-N 3.37Å; E223-H225 VanDerWaalsContact C-N 3.34Å; E223-H225 PolarHBondContact O-N 2.87Å |
| 224 | G | 79.6 | Confident | 83 | Confident | 55 Ų | 55 | 95.6 Ų | 95.6 | 57% | 0.567 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78 | 12.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115 | E220 I221 R222 L226 | E220-G224 PolarHBondContact O-N 3.42Å; E220-G224 VanDerWaalsContact O-N 3.09Å; I221-G224 PolarHBondContact O-N 2.95Å; R222-G224 VanDerWaalsContact C-N 3.27Å; R222-G224 PolarHBondContact O-N 3.39Å; G224-L226 PolarHBondContact O-N 3.19Å |
| 225 | H | 76 | Confident | 83.3 | Confident | 112 Ų | 112 | 94.7 Ų | 94.7 | 52% | 0.519 | 46% | 0.464 | S | S | . | . | trans | -96.1 | 73.2 | -175.1 | -162.9 | 61.1 | 0 | 0 | 0 | 111.7 | E220 E223 D227 | E220-H225 PolarHBondContact O-N 3.32Å; E223-H225 VanDerWaalsContact C-N 3.34Å; E223-H225 PolarHBondContact O-N 2.87Å; H225-D227 IonicContact CE1-OD1 3.56Å; H225-D227 IonicContact CE1-OD2 2.83Å; H225-D227 PolarHBondContact CE1-OD2 2.87Å; H225-D227 IonicContact ND1-OD1 3.63Å; H225-D227 IonicContact ND1-OD2 3.7Å; H225-D227 IonicContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact NE2-OD2 3.37Å; H225-D227 VanDerWaalsContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact O-N 3.42Å | ||
| 226 | L | 75.7 | Confident | 83.5 | Confident | 99 Ų | 99 | 94.8 Ų | 94.8 | 52% | 0.518 | 47% | 0.468 | S | S | . | . | trans | -79.9 | 53.8 | 176.7 | -73.4 | 89.4 | 0 | 0 | 0 | 112.6 | G224 | G224-L226 PolarHBondContact O-N 3.19Š| ||
| 227 | D | 81.2 | Confident | 83.7 | Confident | 77 Ų | 77 | 89.9 Ų | 89.9 | 41% | 0.412 | 46% | 0.455 | S | S | . | . | trans | -80.5 | 173.3 | -178.5 | -84.3 | 16.3 | 0 | 0 | 0 | 112.6 | H225 P229 F230 | H225-D227 IonicContact CE1-OD1 3.56Å; H225-D227 IonicContact CE1-OD2 2.83Å; H225-D227 PolarHBondContact CE1-OD2 2.87Å; H225-D227 IonicContact ND1-OD1 3.63Å; H225-D227 IonicContact ND1-OD2 3.7Å; H225-D227 IonicContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact NE2-OD2 3.37Å; H225-D227 VanDerWaalsContact NE2-OD2 3.09Å; H225-D227 PolarHBondContact O-N 3.42Å; D227-P229 WeakPolarHBondContact O-CD 3.19Å; D227-F230 VanDerWaalsContact O-CB 3.32Å; D227-F230 WeakPolarHBondContact O-CB 3.44Å; D227-F230 PolarHBondContact O-N 3.27Å | ||
| 228 | W | 82 | Confident | 84.1 | Confident | 219 Ų | 219 | 90.8 Ų | 90.8 | 83% | 0.83 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -43.5 | -37.3 | 173.6 | -73 | 99.4 | 0 | 0 | 0 | 115.5 | F230 W231 T232 | W228-F230 VanDerWaalsContact C-N 3.26Å; W228-F230 PolarHBondContact O-N 2.93Å; W228-W231 PolarHBondContact O-N 2.84Å; W228-T232 PolarHBondContact O-N 3.46Å; W228-T232 VanDerWaalsContact O-N 3.16Å |
| 229 | P | 82.8 | Confident | 84.6 | Confident | 70 Ų | 70 | 93.6 Ų | 93.6 | 46% | 0.455 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.9 | -27 | 175.5 | -24.3 | 36.5 | 0 | 0 | 0 | 114.8 | D227 T232 K233 | D227-P229 WeakPolarHBondContact O-CD 3.19Å; P229-T232 WeakPolarHBondContact CA-OG1 3.41Å; P229-T232 PolarHBondContact O-OG1 3.46Å; P229-K233 VanDerWaalsContact O-CG 3.32Å; P229-K233 WeakPolarHBondContact O-CG 3.13Å; P229-K233 PolarHBondContact O-N 2.94Å |
| 230 | F | 84.5 | Confident | 84.9 | Confident | 29 Ų | 29 | 92.5 Ų | 92.5 | 13% | 0.127 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -68.7 | -47.4 | 174.8 | 169.6 | -94.6 | 0 | 0 | 0 | 110.8 | T217 I221 D227 W228 T232 K233 L234 | T217-F230 HydrophobicContact CG2-CD2 3.98Å; T217-F230 HydrophobicContact CG2-CE2 3.46Å; T217-F230 VanDerWaalsContact CG2-CE2 3.46Å; I221-F230 HydrophobicContact CD1-CE2 4.17Å; I221-F230 HydrophobicContact CG1-CE2 4.14Å; D227-F230 VanDerWaalsContact O-CB 3.32Å; D227-F230 WeakPolarHBondContact O-CB 3.44Å; D227-F230 PolarHBondContact O-N 3.27Å; W228-F230 VanDerWaalsContact C-N 3.26Å; W228-F230 PolarHBondContact O-N 2.93Å; F230-T232 VanDerWaalsContact C-N 3.34Å; F230-T232 PolarHBondContact O-N 2.71Å; F230-K233 WeakPolarHBondContact O-CB 3.36Å; F230-K233 PolarHBondContact O-N 3.18Å; F230-L234 PolarHBondContact O-N 3.5Å; F230-L234 VanDerWaalsContact O-N 3.14Å |
| 231 | W | 86.2 | Confident | 85.4 | Confident | 135 Ų | 135 | 96 Ų | 96 | 51% | 0.511 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.6 | -37.8 | 179.7 | -71.6 | 102.8 | 0 | 0 | 0 | 112.7 | W228 L234 I235 | W228-W231 PolarHBondContact O-N 2.84Å; W231-L234 PolarHBondContact O-N 2.95Å; W231-I235 VanDerWaalsContact O-CG1 3.3Å; W231-I235 WeakPolarHBondContact O-CG1 3.48Å; W231-I235 PolarHBondContact O-N 3.34Å |
| 232 | T | 88.6 | Confident | 86 | Confident | 77 Ų | 77 | 94.7 Ų | 94.7 | 47% | 0.472 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.4 | -39.1 | 176.7 | 57.9 | 0 | 0 | 0 | 0 | 112.1 | W228 P229 F230 I235 V236 | W228-T232 PolarHBondContact O-N 3.46Å; W228-T232 VanDerWaalsContact O-N 3.16Å; P229-T232 WeakPolarHBondContact CA-OG1 3.41Å; P229-T232 PolarHBondContact O-OG1 3.46Å; F230-T232 VanDerWaalsContact C-N 3.34Å; F230-T232 PolarHBondContact O-N 2.71Å; T232-I235 PolarHBondContact O-N 2.84Å; T232-V236 VanDerWaalsContact O-CG2 3.28Å; T232-V236 WeakPolarHBondContact O-CG2 3.22Å; T232-V236 PolarHBondContact O-N 3.03Å |
| 233 | K | 86.9 | Confident | 86.4 | Confident | 60 Ų | 60 | 87.8 Ų | 87.8 | 26% | 0.261 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.7 | -45.9 | 173 | -69.9 | 167.2 | -166.5 | 166.9 | 0 | 111.5 | L213 E220 P229 F230 I235 V236 V237 | L213-K233 HydrophobicContact CD1-CB 4.3Å; L213-K233 HydrophobicContact CD1-CD 4.21Å; L213-K233 HydrophobicContact CD1-CG 4.29Å; E220-K233 IonicContact OE1-NZ 3.64Å; E220-K233 PolarHBondContact OE1-NZ 3.22Å; E220-K233 IonicContact OE2-NZ 2.56Å; E220-K233 PolarHBondContact OE2-NZ 3.44Å; P229-K233 VanDerWaalsContact O-CG 3.32Å; P229-K233 WeakPolarHBondContact O-CG 3.13Å; P229-K233 PolarHBondContact O-N 2.94Å; F230-K233 WeakPolarHBondContact O-CB 3.36Å; F230-K233 PolarHBondContact O-N 3.18Å; K233-I235 PolarHBondContact O-N 3.13Å; K233-V236 PolarHBondContact O-N 3.41Å; K233-V237 WeakPolarHBondContact O-CG2 3.31Å; K233-V237 PolarHBondContact O-N 3.25Å |
| 234 | L | 87.6 | Confident | 86.8 | Confident | 86 Ų | 86 | 83 Ų | 83 | 45% | 0.45 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 178.7 | -171.2 | 147.8 | 0 | 0 | 0 | 111.8 | F230 W231 V237 A238 | F230-L234 PolarHBondContact O-N 3.5Å; F230-L234 VanDerWaalsContact O-N 3.14Å; W231-L234 PolarHBondContact O-N 2.95Å; L234-V237 PolarHBondContact O-N 3.46Å; L234-A238 WeakPolarHBondContact O-CB 3.19Å; L234-A238 PolarHBondContact O-N 2.92Å |
| 235 | I | 91.8 | Very high | 87.4 | Confident | 93 Ų | 93 | 84.8 Ų | 84.8 | 48% | 0.477 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.7 | -45.2 | 176.3 | -70 | 166.8 | 0 | 0 | 0 | 111.1 | W231 T232 K233 V237 A238 I239 | W231-I235 VanDerWaalsContact O-CG1 3.3Å; W231-I235 WeakPolarHBondContact O-CG1 3.48Å; W231-I235 PolarHBondContact O-N 3.34Å; T232-I235 PolarHBondContact O-N 2.84Å; K233-I235 PolarHBondContact O-N 3.13Å; I235-V237 VanDerWaalsContact C-N 3.29Å; I235-V237 PolarHBondContact O-N 3.01Å; I235-A238 PolarHBondContact O-N 2.68Å; I235-I239 HydrophobicContact CG2-CD1 3.85Å; I235-I239 HydrophobicContact CG2-CG1 4.47Å; I235-I239 WeakPolarHBondContact O-CG1 3.47Å; I235-I239 PolarHBondContact O-N 3.15Å |
| 236 | V | 90.1 | Very high | 88.2 | Confident | 103 Ų | 103 | 84 Ų | 84 | 62% | 0.624 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -60.6 | -40.1 | 178.2 | 170.5 | 0 | 0 | 0 | 0 | 111.2 | T232 K233 G240 | T232-V236 VanDerWaalsContact O-CG2 3.28Å; T232-V236 WeakPolarHBondContact O-CG2 3.22Å; T232-V236 PolarHBondContact O-N 3.03Å; K233-V236 PolarHBondContact O-N 3.41Å; V236-G240 PolarHBondContact O-N 3.48Å |
| 237 | V | 89.8 | Confident | 88.9 | Confident | 49 Ų | 49 | 82.7 Ų | 82.7 | 30% | 0.297 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.3 | -47.2 | 174 | 172.1 | 0 | 0 | 0 | 0 | 111.8 | L210 L213 K233 L234 I235 I239 G240 F241 | L210-V237 HydrophobicContact CD2-CG1 3.73Å; L210-V237 HydrophobicContact CD2-CG2 4.31Å; L213-V237 HydrophobicContact CD2-CG2 3.01Å; L213-V237 HydrophobicContact CG-CG2 4.36Å; K233-V237 WeakPolarHBondContact O-CG2 3.31Å; K233-V237 PolarHBondContact O-N 3.25Å; L234-V237 PolarHBondContact O-N 3.46Å; I235-V237 VanDerWaalsContact C-N 3.29Å; I235-V237 PolarHBondContact O-N 3.01Å; V237-I239 VanDerWaalsContact C-N 3.32Å; V237-I239 PolarHBondContact O-N 3.23Å; V237-G240 PolarHBondContact O-N 3.21Å; V237-F241 WeakPolarHBondContact O-CB 3.41Å; V237-F241 PolarHBondContact O-N 3.5Å |
| 238 | A | 90.3 | Very high | 89.4 | Confident | 47 Ų | 47 | 82.2 Ų | 82.2 | 39% | 0.388 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.6 | -41.8 | -179 | 0 | 0 | 0 | 0 | 0 | 111.7 | L234 I235 S242 | L234-A238 WeakPolarHBondContact O-CB 3.19Å; L234-A238 PolarHBondContact O-N 2.92Å; I235-A238 PolarHBondContact O-N 2.68Å; A238-S242 VanDerWaalsContact O-CB 3.3Å; A238-S242 WeakPolarHBondContact O-CB 3.45Å; A238-S242 PolarHBondContact O-N 3.05Å; A238-S242 PolarHBondContact O-OG 3.46Å |
| 239 | I | 93 | Very high | 90 | Very high | 117 Ų | 117 | 79.6 Ų | 79.6 | 60% | 0.6 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -65.3 | -46.9 | 175.5 | -66.7 | 170.1 | 0 | 0 | 0 | 110.8 | I235 V237 F241 S242 G243 | I235-I239 HydrophobicContact CG2-CD1 3.85Å; I235-I239 HydrophobicContact CG2-CG1 4.47Å; I235-I239 WeakPolarHBondContact O-CG1 3.47Å; I235-I239 PolarHBondContact O-N 3.15Å; V237-I239 VanDerWaalsContact C-N 3.32Å; V237-I239 PolarHBondContact O-N 3.23Å; I239-F241 PolarHBondContact O-N 3.05Å; I239-S242 PolarHBondContact O-N 3.46Å; I239-G243 PolarHBondContact O-N 3.27Å |
| 240 | G | 90.3 | Very high | 90.4 | Very high | 47 Ų | 47 | 79.3 Ų | 79.3 | 49% | 0.485 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -60.6 | -43.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | V236 V237 G244 | V236-G240 PolarHBondContact O-N 3.48Å; V237-G240 PolarHBondContact O-N 3.21Å; G240-G244 PolarHBondContact O-N 2.82Å |
| 241 | F | 90.5 | Very high | 90.6 | Very high | 119 Ų | 119 | 79.6 Ų | 79.6 | 52% | 0.522 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.1 | -46.4 | 176.3 | -176 | -105 | 0 | 0 | 0 | 111.8 | V237 I239 G243 G244 L245 | V237-F241 WeakPolarHBondContact O-CB 3.41Å; V237-F241 PolarHBondContact O-N 3.5Å; I239-F241 PolarHBondContact O-N 3.05Å; F241-G243 PolarHBondContact O-N 3.4Å; F241-G244 PolarHBondContact O-N 3.35Å; F241-L245 HydrophobicContact CD1-CD1 3.82Å; F241-L245 HydrophobicContact CD1-CG 4.21Å; F241-L245 HydrophobicContact CE1-CD1 3.29Å; F241-L245 HydrophobicContact CE1-CD2 4.43Å; F241-L245 HydrophobicContact CE1-CG 3.88Å; F241-L245 HydrophobicContact CE2-CD2 4.42Å; F241-L245 HydrophobicContact CE2-CG 4.4Å; F241-L245 HydrophobicContact CZ-CD1 3.75Å; F241-L245 HydrophobicContact CZ-CD2 4.05Å; F241-L245 HydrophobicContact CZ-CG 3.97Å; F241-L245 WeakPolarHBondContact O-CG 3.36Å; F241-L245 PolarHBondContact O-N 3.03Å |
| 242 | S | 92.7 | Very high | 90.9 | Very high | 67 Ų | 67 | 75.9 Ų | 75.9 | 47% | 0.469 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.8 | -46.2 | 178 | -58.7 | 0 | 0 | 0 | 0 | 111.7 | A238 I239 L245 V246 | A238-S242 VanDerWaalsContact O-CB 3.3Å; A238-S242 WeakPolarHBondContact O-CB 3.45Å; A238-S242 PolarHBondContact O-N 3.05Å; A238-S242 PolarHBondContact O-OG 3.46Å; I239-S242 PolarHBondContact O-N 3.46Å; S242-L245 PolarHBondContact O-N 2.64Å; S242-V246 WeakPolarHBondContact O-CG2 3.34Å; S242-V246 PolarHBondContact O-N 3.16Å; S242-V246 VanDerWaalsContact O-N 3.1Å |
| 243 | G | 91.4 | Very high | 91.1 | Very high | 43 Ų | 43 | 77.7 Ų | 77.7 | 44% | 0.443 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -62 | -42.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | I239 F241 V246 F247 | I239-G243 PolarHBondContact O-N 3.27Å; F241-G243 PolarHBondContact O-N 3.4Å; G243-V246 PolarHBondContact O-N 2.91Å; G243-F247 WeakPolarHBondContact O-CB 3.27Å; G243-F247 PolarHBondContact O-N 3.43Å |
| 244 | G | 91.2 | Very high | 91.2 | Very high | 39 Ų | 39 | 76.3 Ų | 76.3 | 40% | 0.402 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.7 | -40.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G240 F241 F247 M248 | G240-G244 PolarHBondContact O-N 2.82Å; F241-G244 PolarHBondContact O-N 3.35Å; G244-F247 PolarHBondContact O-N 3.44Å; G244-M248 VanDerWaalsContact O-CB 3.3Å; G244-M248 WeakPolarHBondContact O-CB 3.29Å; G244-M248 PolarHBondContact O-N 3.35Å |
| 245 | L | 92.4 | Very high | 91.5 | Very high | 92 Ų | 92 | 75.6 Ų | 75.6 | 48% | 0.482 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.2 | -44 | 176.1 | -75.5 | -176.2 | 0 | 0 | 0 | 112.5 | F241 S242 F247 M248 Y249 | F241-L245 HydrophobicContact CD1-CD1 3.82Å; F241-L245 HydrophobicContact CD1-CG 4.21Å; F241-L245 HydrophobicContact CE1-CD1 3.29Å; F241-L245 HydrophobicContact CE1-CD2 4.43Å; F241-L245 HydrophobicContact CE1-CG 3.88Å; F241-L245 HydrophobicContact CE2-CD2 4.42Å; F241-L245 HydrophobicContact CE2-CG 4.4Å; F241-L245 HydrophobicContact CZ-CD1 3.75Å; F241-L245 HydrophobicContact CZ-CD2 4.05Å; F241-L245 HydrophobicContact CZ-CG 3.97Å; F241-L245 WeakPolarHBondContact O-CG 3.36Å; F241-L245 PolarHBondContact O-N 3.03Å; S242-L245 PolarHBondContact O-N 2.64Å; L245-F247 VanDerWaalsContact C-N 3.35Å; L245-M248 PolarHBondContact O-N 3.45Å; L245-Y249 WeakPolarHBondContact O-CB 3.34Å; L245-Y249 PolarHBondContact O-N 3.02Å |
| 246 | V | 93.2 | Very high | 91.5 | Very high | 97 Ų | 97 | 74.4 Ų | 74.4 | 59% | 0.588 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -62.3 | -44.8 | 176.5 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | S242 G243 Y249 V250 | S242-V246 WeakPolarHBondContact O-CG2 3.34Å; S242-V246 PolarHBondContact O-N 3.16Å; S242-V246 VanDerWaalsContact O-N 3.1Å; G243-V246 PolarHBondContact O-N 2.91Å; V246-Y249 PolarHBondContact O-N 2.66Å; V246-V250 WeakPolarHBondContact O-CG2 3.47Å; V246-V250 PolarHBondContact O-N 3.38Å; V246-V250 VanDerWaalsContact O-N 3.14Å |
| 247 | F | 91 | Very high | 91.6 | Very high | 70 Ų | 70 | 72.8 Ų | 72.8 | 31% | 0.307 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61 | -47.4 | 175.9 | -177.6 | -103 | 0 | 0 | 0 | 111.7 | F198 H199 G243 G244 L245 Y249 V250 Q251 | F198-F247 HydrophobicContact CD1-CE1 4.11Å; F198-F247 AromaticContact CD1-CZ 3.91Å; F198-F247 HydrophobicContact CD1-CZ 3.91Å; F198-F247 AromaticContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE1 3.71Å; F198-F247 HydrophobicContact CE1-CE2 4.42Å; F198-F247 AromaticContact CE1-CZ 3.47Å; F198-F247 HydrophobicContact CE1-CZ 3.47Å; F198-F247 VanDerWaalsContact CE1-CZ 3.47Å; H199-F247 AromaticContact CD2-CE1 3.74Å; H199-F247 AromaticContact CE1-CE1 3.7Å; H199-F247 AromaticContact CE1-CZ 3.95Å; H199-F247 AromaticContact NE2-CD1 3.87Å; H199-F247 AromaticContact NE2-CE1 3.19Å; H199-F247 WeakPolarHBondContact NE2-CE1 3.42Å; H199-F247 AromaticContact NE2-CZ 3.84Å; G243-F247 WeakPolarHBondContact O-CB 3.27Å; G243-F247 PolarHBondContact O-N 3.43Å; G244-F247 PolarHBondContact O-N 3.44Å; L245-F247 VanDerWaalsContact C-N 3.35Å; F247-Y249 VanDerWaalsContact C-N 3.32Å; F247-Y249 PolarHBondContact O-N 2.6Å; F247-V250 PolarHBondContact O-N 3.5Å; F247-Q251 HydrophobicContact CD1-CG 4.34Å; F247-Q251 HydrophobicContact CE1-CG 4.07Å; F247-Q251 HydrophobicContact CE2-CG 4.25Å; F247-Q251 HydrophobicContact CZ-CG 4.01Å; F247-Q251 VanDerWaalsContact CZ-NE2 3.26Å; F247-Q251 WeakPolarHBondContact O-CB 3.32Å; F247-Q251 WeakPolarHBondContact O-CG 3.3Å; F247-Q251 PolarHBondContact O-N 3.41Å; F247-Q251 VanDerWaalsContact O-N 3.13Å |
| 248 | M | 92 | Very high | 91.6 | Very high | 67 Ų | 67 | 72.3 Ų | 72.3 | 33% | 0.33 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -58.4 | -43.1 | 176.2 | -177 | 59.4 | 69.4 | 0 | 0 | 111.6 | I203 G244 L245 Q251 C252 | I203-M248 HydrophobicContact CD1-CE 3.88Å; I203-M248 HydrophobicContact CG1-CE 4.29Å; G244-M248 VanDerWaalsContact O-CB 3.3Å; G244-M248 WeakPolarHBondContact O-CB 3.29Å; G244-M248 PolarHBondContact O-N 3.35Å; L245-M248 PolarHBondContact O-N 3.45Å; M248-Q251 PolarHBondContact O-N 2.9Å; M248-C252 WeakPolarHBondContact O-CB 3.39Å; M248-C252 PolarHBondContact O-N 3.49Å; M248-C252 PolarHBondContact O-SG 2.96Å |
| 249 | Y | 92.9 | Very high | 91.7 | Very high | 164 Ų | 164 | 74.9 Ų | 74.9 | 64% | 0.643 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -60.1 | -48.1 | 178.6 | 170.5 | -102.6 | 0 | 0 | 0 | 112.8 | L245 V246 F247 Q251 C252 K253 | L245-Y249 WeakPolarHBondContact O-CB 3.34Å; L245-Y249 PolarHBondContact O-N 3.02Å; V246-Y249 PolarHBondContact O-N 2.66Å; F247-Y249 VanDerWaalsContact C-N 3.32Å; F247-Y249 PolarHBondContact O-N 2.6Å; Y249-Q251 PolarHBondContact O-N 3.05Å; Y249-C252 PolarHBondContact O-N 3.29Å; Y249-K253 PolarHBondContact O-N 2.99Å |
| 250 | V | 91.3 | Very high | 91.7 | Very high | 64 Ų | 64 | 77.4 Ų | 77.4 | 39% | 0.388 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59 | -39.6 | 177.6 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | V246 F247 K253 M254 | V246-V250 WeakPolarHBondContact O-CG2 3.47Å; V246-V250 PolarHBondContact O-N 3.38Å; V246-V250 VanDerWaalsContact O-N 3.14Å; F247-V250 PolarHBondContact O-N 3.5Å; V250-K253 WeakPolarHBondContact O-CB 3.28Å; V250-K253 PolarHBondContact O-N 3.35Å; V250-M254 PolarHBondContact O-N 3.04Å |
| 251 | Q | 89.5 | Confident | 91.7 | Very high | 35 Ų | 35 | 79.5 Ų | 79.5 | 16% | 0.164 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -77 | -37.5 | -177.4 | -62.1 | -79.8 | 14.7 | 0 | 0 | 111.7 | H199 F247 M248 Y249 K253 M254 Y255 | H199-Q251 VanDerWaalsContact CE1-CG 3.48Å; H199-Q251 WeakPolarHBondContact CE1-CG 3.3Å; H199-Q251 VanDerWaalsContact NE2-CB 3.26Å; H199-Q251 WeakPolarHBondContact NE2-CB 3.17Å; H199-Q251 WeakPolarHBondContact NE2-CG 3.46Å; F247-Q251 HydrophobicContact CD1-CG 4.34Å; F247-Q251 HydrophobicContact CE1-CG 4.07Å; F247-Q251 HydrophobicContact CE2-CG 4.25Å; F247-Q251 HydrophobicContact CZ-CG 4.01Å; F247-Q251 VanDerWaalsContact CZ-NE2 3.26Å; F247-Q251 WeakPolarHBondContact O-CB 3.32Å; F247-Q251 WeakPolarHBondContact O-CG 3.3Å; F247-Q251 PolarHBondContact O-N 3.41Å; F247-Q251 VanDerWaalsContact O-N 3.13Å; M248-Q251 PolarHBondContact O-N 2.9Å; Y249-Q251 PolarHBondContact O-N 3.05Å; Q251-K253 VanDerWaalsContact C-N 3.27Å; Q251-K253 PolarHBondContact O-N 3.31Å; Q251-M254 WeakPolarHBondContact O-CB 3.36Å; Q251-M254 PolarHBondContact O-N 3.25Å; Q251-M254 VanDerWaalsContact O-N 3.09Å; Q251-Y255 HydrophobicContact CB-CE2 4.27Å; Q251-Y255 WeakPolarHBondContact O-CD2 2.89Å; Q251-Y255 PolarHBondContact O-N 3.14Å |
| 252 | C | 92.5 | Very high | 91.8 | Very high | 57 Ų | 57 | 78.3 Ų | 78.3 | 39% | 0.385 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -55.8 | -42.2 | 168.7 | -75.2 | 0 | 0 | 0 | 0 | 111.4 | M248 Y249 M254 Y255 V256 | M248-C252 WeakPolarHBondContact O-CB 3.39Å; M248-C252 PolarHBondContact O-N 3.49Å; M248-C252 PolarHBondContact O-SG 2.96Å; Y249-C252 PolarHBondContact O-N 3.29Å; C252-M254 VanDerWaalsContact C-N 3.33Å; C252-M254 PolarHBondContact O-N 3.36Å; C252-Y255 PolarHBondContact O-N 2.96Å; C252-V256 WeakPolarHBondContact O-CB 3.35Å; C252-V256 VanDerWaalsContact O-CG2 3.28Å; C252-V256 WeakPolarHBondContact O-CG2 3.19Å; C252-V256 PolarHBondContact O-N 3.39Å |
| 253 | K | 92.5 | Very high | 91.7 | Very high | 115 Ų | 115 | 79.8 Ų | 79.8 | 50% | 0.5 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -58.9 | -45 | 174.9 | -174.2 | -176.2 | 175.5 | -176.2 | 0 | 111.5 | Y249 V250 Q251 V256 Q257 | Y249-K253 PolarHBondContact O-N 2.99Å; V250-K253 WeakPolarHBondContact O-CB 3.28Å; V250-K253 PolarHBondContact O-N 3.35Å; Q251-K253 VanDerWaalsContact C-N 3.27Å; Q251-K253 PolarHBondContact O-N 3.31Å; K253-V256 PolarHBondContact O-N 3Å; K253-Q257 WeakPolarHBondContact O-CG 3.49Å; K253-Q257 PolarHBondContact O-N 3.18Å |
| 254 | M | 90.4 | Very high | 91.7 | Very high | 31 Ų | 31 | 80.3 Ų | 80.3 | 15% | 0.153 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -59.5 | -47.1 | 175.1 | -66.8 | -71.1 | 101.4 | 0 | 0 | 111.8 | V50 M53 V250 Q251 C252 V256 Q257 L258 | V50-M254 HydrophobicContact CG1-CE 4.46Å; M53-M254 HydrophobicContact CE-SD 3.83Å; V250-M254 PolarHBondContact O-N 3.04Å; Q251-M254 WeakPolarHBondContact O-CB 3.36Å; Q251-M254 PolarHBondContact O-N 3.25Å; Q251-M254 VanDerWaalsContact O-N 3.09Å; C252-M254 VanDerWaalsContact C-N 3.33Å; C252-M254 PolarHBondContact O-N 3.36Å; M254-V256 PolarHBondContact O-N 2.98Å; M254-Q257 PolarHBondContact O-N 3.01Å; M254-L258 WeakPolarHBondContact O-CG 3.28Å; M254-L258 PolarHBondContact O-N 3.33Å |
| 255 | Y | 91.9 | Very high | 91.6 | Very high | 71 Ų | 71 | 83.4 Ų | 83.4 | 28% | 0.278 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.2 | -38 | 178.6 | -66.5 | -55 | 0 | 0 | 0 | 113.2 | S195 V196 Q251 C252 Q257 L258 F259 | S195-Y255 PolarHBondContact OG-OH 3.2Å; V196-Y255 HydrophobicContact CG2-CE1 3.85Å; V196-Y255 WeakPolarHBondContact CG2-OH 3.35Å; Q251-Y255 HydrophobicContact CB-CE2 4.27Å; Q251-Y255 WeakPolarHBondContact O-CD2 2.89Å; Q251-Y255 PolarHBondContact O-N 3.14Å; C252-Y255 PolarHBondContact O-N 2.96Å; Y255-Q257 VanDerWaalsContact C-N 3.34Å; Y255-Q257 PolarHBondContact O-N 3.5Å; Y255-L258 HydrophobicContact CD1-CD1 4.29Å; Y255-L258 PolarHBondContact O-N 2.98Å; Y255-F259 WeakPolarHBondContact O-CB 3.34Å; Y255-F259 PolarHBondContact O-N 3.5Å |
| 256 | V | 93 | Very high | 91.5 | Very high | 69 Ų | 69 | 79 Ų | 79 | 42% | 0.418 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.5 | -40.3 | 175.3 | 168.8 | 0 | 0 | 0 | 0 | 111 | C252 K253 M254 F259 R260 | C252-V256 WeakPolarHBondContact O-CB 3.35Å; C252-V256 VanDerWaalsContact O-CG2 3.28Å; C252-V256 WeakPolarHBondContact O-CG2 3.19Å; C252-V256 PolarHBondContact O-N 3.39Å; K253-V256 PolarHBondContact O-N 3Å; M254-V256 PolarHBondContact O-N 2.98Å; V256-F259 PolarHBondContact O-N 3.09Å; V256-R260 HydrophobicContact CG1-CG 4.45Å; V256-R260 WeakPolarHBondContact O-CB 3.39Å; V256-R260 VanDerWaalsContact O-CG 3.26Å; V256-R260 WeakPolarHBondContact O-CG 3.28Å; V256-R260 PolarHBondContact O-N 3.39Å |
| 257 | Q | 91.4 | Very high | 91.5 | Very high | 68 Ų | 68 | 79.7 Ų | 79.7 | 32% | 0.318 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 174.6 | -74 | 174.9 | -32.1 | 0 | 0 | 111.7 | K253 M254 Y255 F259 R260 R261 | K253-Q257 WeakPolarHBondContact O-CG 3.49Å; K253-Q257 PolarHBondContact O-N 3.18Å; M254-Q257 PolarHBondContact O-N 3.01Å; Y255-Q257 VanDerWaalsContact C-N 3.34Å; Y255-Q257 PolarHBondContact O-N 3.5Å; Q257-F259 VanDerWaalsContact C-N 3.32Å; Q257-F259 PolarHBondContact O-N 3.28Å; Q257-R260 WeakPolarHBondContact O-CB 3.32Å; Q257-R260 PolarHBondContact O-N 2.7Å; Q257-R261 PolarHBondContact O-N 3.22Å |
| 258 | L | 91 | Very high | 91.4 | Very high | 40 Ų | 40 | 77.7 Ų | 77.7 | 21% | 0.209 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -59.3 | -43.2 | 175 | -70.2 | 170.9 | 0 | 0 | 0 | 111.9 | I192 M254 Y255 R261 W262 | I192-L258 HydrophobicContact CD1-CD1 3.73Å; I192-L258 HydrophobicContact CD1-CD2 3.92Å; I192-L258 HydrophobicContact CD1-CG 4.49Å; I192-L258 HydrophobicContact CG1-CD1 3.83Å; M254-L258 WeakPolarHBondContact O-CG 3.28Å; M254-L258 PolarHBondContact O-N 3.33Å; Y255-L258 HydrophobicContact CD1-CD1 4.29Å; Y255-L258 PolarHBondContact O-N 2.98Å; L258-R261 PolarHBondContact O-N 3.48Å; L258-W262 WeakPolarHBondContact O-CB 3.47Å; L258-W262 PolarHBondContact O-N 3.45Å |
| 259 | F | 91.9 | Very high | 91.4 | Very high | 100 Ų | 100 | 77.2 Ų | 77.2 | 44% | 0.439 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -64.6 | -40.3 | 176.4 | -177.6 | -102.7 | 0 | 0 | 0 | 112.2 | W179 Y255 V256 Q257 W262 K263 | W179-F259 HydrophobicContact CH2-CE2 4.26Å; W179-F259 HydrophobicContact CH2-CZ 4.19Å; W179-F259 HydrophobicContact CZ3-CE2 4.05Å; W179-F259 HydrophobicContact CZ3-CZ 4.44Å; Y255-F259 WeakPolarHBondContact O-CB 3.34Å; Y255-F259 PolarHBondContact O-N 3.5Å; V256-F259 PolarHBondContact O-N 3.09Å; Q257-F259 VanDerWaalsContact C-N 3.32Å; Q257-F259 PolarHBondContact O-N 3.28Å; F259-W262 HydrophobicContact CD2-CE3 4.17Å; F259-W262 HydrophobicContact CE2-CE3 4.45Å; F259-W262 PolarHBondContact O-N 2.98Å; F259-K263 WeakPolarHBondContact O-CB 3.3Å; F259-K263 PolarHBondContact O-N 3.16Å |
| 260 | R | 92.9 | Very high | 91.5 | Very high | 171 Ų | 171 | 74.3 Ų | 74.3 | 65% | 0.645 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -61.7 | -44 | 174.8 | -74 | 172.5 | -178.4 | -178 | 1.4 | 111.5 | V256 Q257 W262 K263 A264 | V256-R260 HydrophobicContact CG1-CG 4.45Å; V256-R260 WeakPolarHBondContact O-CB 3.39Å; V256-R260 VanDerWaalsContact O-CG 3.26Å; V256-R260 WeakPolarHBondContact O-CG 3.28Å; V256-R260 PolarHBondContact O-N 3.39Å; Q257-R260 WeakPolarHBondContact O-CB 3.32Å; Q257-R260 PolarHBondContact O-N 2.7Å; R260-W262 VanDerWaalsContact C-N 3.35Å; R260-K263 PolarHBondContact O-N 3.28Å; R260-A264 WeakPolarHBondContact O-CB 3.25Å; R260-A264 PolarHBondContact O-N 3.32Å |
| 261 | R | 90.8 | Very high | 91.6 | Very high | 91 Ų | 91 | 71.6 Ų | 71.6 | 34% | 0.343 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 174.3 | -174.2 | 177.3 | 176.7 | -167.6 | -1.5 | 111.3 | L182 E188 Q257 L258 A264 Y265 | L182-R261 HydrophobicContact CD1-CG 4.42Å; L182-R261 HydrophobicContact CD2-CB 4.4Å; L182-R261 HydrophobicContact CD2-CG 3.96Å; E188-R261 VanDerWaalsContact CD-NH1 3.33Å; E188-R261 IonicContact OE1-NH1 2.7Å; E188-R261 PolarHBondContact OE1-NH1 3.03Å; E188-R261 IonicContact OE2-CZ 2.77Å; E188-R261 IonicContact OE2-NH1 2.85Å; E188-R261 PolarHBondContact OE2-NH1 2.93Å; Q257-R261 PolarHBondContact O-N 3.22Å; L258-R261 PolarHBondContact O-N 3.48Å; R261-A264 PolarHBondContact O-N 3.37Å; R261-Y265 PolarHBondContact O-N 2.56Å |
| 262 | W | 91.3 | Very high | 91.8 | Very high | 94 Ų | 94 | 71.4 Ų | 71.4 | 36% | 0.356 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -67.1 | -39.9 | 178.4 | -171.4 | 27.7 | 0 | 0 | 0 | 113 | W179 E180 L182 L258 F259 R260 A264 Y265 N266 | W179-W262 HydrophobicContact CB-CZ2 4.45Å; W179-W262 AromaticContact CE3-CD2 3.95Å; W179-W262 HydrophobicContact CE3-CD2 3.95Å; W179-W262 AromaticContact CE3-CE2 3.79Å; W179-W262 HydrophobicContact CE3-CE3 4.16Å; W179-W262 HydrophobicContact CE3-CH2 4.1Å; W179-W262 AromaticContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ2 3.88Å; W179-W262 HydrophobicContact CE3-CZ3 4.23Å; W179-W262 HydrophobicContact CZ3-CD2 4.07Å; W179-W262 HydrophobicContact CZ3-CE3 4.01Å; W179-W262 HydrophobicContact CZ3-CZ3 4.28Å; E180-W262 PolarHBondContact O-NE1 3Å; L182-W262 HydrophobicContact CB-CB 4.48Å; L182-W262 HydrophobicContact CB-CG 4.19Å; L182-W262 HydrophobicContact CD2-CB 4.23Å; L258-W262 WeakPolarHBondContact O-CB 3.47Å; L258-W262 PolarHBondContact O-N 3.45Å; F259-W262 HydrophobicContact CD2-CE3 4.17Å; F259-W262 HydrophobicContact CE2-CE3 4.45Å; F259-W262 PolarHBondContact O-N 2.98Å; R260-W262 VanDerWaalsContact C-N 3.35Å; W262-A264 VanDerWaalsContact C-N 3.33Å; W262-Y265 PolarHBondContact O-N 3.33Å; W262-N266 PolarHBondContact NE1-ND2 3.11Å; W262-N266 VanDerWaalsContact NE1-ND2 3.13Å; W262-N266 PolarHBondContact O-N 2.99Å; W262-N266 PolarHBondContact O-ND2 2.88Å |
| 263 | K | 91.3 | Very high | 92 | Very high | 98 Ų | 98 | 73.1 Ų | 73.1 | 43% | 0.426 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | 172.7 | -175.9 | 179.7 | 178.9 | -178.7 | 0 | 110.9 | V173 W179 F259 R260 N266 K267 | V173-K263 HydrophobicContact CG2-CG 4.32Å; W179-K263 HydrophobicContact CH2-CB 4.21Å; W179-K263 HydrophobicContact CH2-CG 4.28Å; F259-K263 WeakPolarHBondContact O-CB 3.3Å; F259-K263 PolarHBondContact O-N 3.16Å; R260-K263 PolarHBondContact O-N 3.28Å; K263-N266 PolarHBondContact O-N 3.02Å; K263-K267 PolarHBondContact O-N 2.83Å |
| 264 | A | 90.6 | Very high | 92 | Very high | 53 Ų | 53 | 68.3 Ų | 68.3 | 44% | 0.438 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | R260 R261 W262 N266 K267 | R260-A264 WeakPolarHBondContact O-CB 3.25Å; R260-A264 PolarHBondContact O-N 3.32Å; R261-A264 PolarHBondContact O-N 3.37Å; W262-A264 VanDerWaalsContact C-N 3.33Å; A264-N266 PolarHBondContact O-N 3.36Å; A264-K267 WeakPolarHBondContact O-CB 3.28Å; A264-K267 PolarHBondContact O-N 2.98Å; A264-K267 VanDerWaalsContact O-N 3.16Å |
| 265 | Y | 89.5 | Confident | 92 | Very high | 104 Ų | 104 | 70.1 Ų | 70.1 | 41% | 0.408 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -59.5 | -33.6 | 175.2 | -176.2 | -96.5 | 0 | 0 | 0 | 113 | E180 L182 D183 R261 W262 K267 | E180-Y265 HydrophobicContact CB-CE1 3.93Å; L182-Y265 VanDerWaalsContact CD1-CB 3.46Å; L182-Y265 HydrophobicContact CD1-CD1 4.15Å; L182-Y265 HydrophobicContact CD1-CD2 3.74Å; L182-Y265 HydrophobicContact CD1-CG 3.52Å; D183-Y265 HydrophobicContact CB-CE2 4.36Å; R261-Y265 PolarHBondContact O-N 2.56Å; W262-Y265 PolarHBondContact O-N 3.33Å; Y265-K267 VanDerWaalsContact C-N 3.35Å |
| 266 | N | 91.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 73.7 Ų | 73.7 | 0% | 0 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.2 | 11.7 | 179.2 | -77.3 | -74.3 | 0 | 0 | 0 | 114.7 | K174 W179 E180 W262 K263 A264 | K174-N266 WeakPolarHBondContact CG-O 3.32Å; K174-N266 PolarHBondContact N-O 3.38Å; W179-N266 VanDerWaalsContact CA-OD1 3.25Å; W179-N266 WeakPolarHBondContact CA-OD1 3.47Å; W179-N266 HydrophobicContact CD2-CB 3.98Å; W179-N266 HydrophobicContact CG-CB 4.03Å; E180-N266 PolarHBondContact N-OD1 3.09Å; E180-N266 PolarHBondContact O-ND2 3.49Å; E180-N266 VanDerWaalsContact O-ND2 3.16Å; W262-N266 PolarHBondContact NE1-ND2 3.11Å; W262-N266 VanDerWaalsContact NE1-ND2 3.13Å; W262-N266 PolarHBondContact O-N 2.99Å; W262-N266 PolarHBondContact O-ND2 2.88Å; K263-N266 PolarHBondContact O-N 3.02Å; A264-N266 PolarHBondContact O-N 3.36Å |
| 267 | K | 92.1 | Very high | 90.7 | Very high | 111 Ų | 111 | 77.5 Ų | 77.5 | 48% | 0.483 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 139.2 | 171.2 | -73.3 | 177.2 | -179.4 | -176.7 | 0 | 110.7 | T171 V173 K263 A264 Y265 | T171-K267 HydrophobicContact CG2-CB 3.84Å; T171-K267 HydrophobicContact CG2-CD 4Å; T171-K267 HydrophobicContact CG2-CG 4.11Å; V173-K267 HydrophobicContact CG2-CG 4.03Å; K263-K267 PolarHBondContact O-N 2.83Å; A264-K267 WeakPolarHBondContact O-CB 3.28Å; A264-K267 PolarHBondContact O-N 2.98Å; A264-K267 VanDerWaalsContact O-N 3.16Å; Y265-K267 VanDerWaalsContact C-N 3.35Å |
| 268 | V | 90.4 | Very high | 89.1 | Confident | 28 Ų | 28 | 79.5 Ų | 79.5 | 17% | 0.17 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 133.7 | 174.7 | 178 | 0 | 0 | 0 | 0 | 108.7 | R172 K174 Y270 | R172-V268 PolarHBondContact N-O 3.14Å; R172-V268 PolarHBondContact O-N 2.93Å; R172-V268 VanDerWaalsContact O-O 3.09Å; K174-V268 HydrophobicContact CD-CG2 4.04Å; K174-V268 HydrophobicContact CG-CG2 3.57Å; V268-Y270 HydrophobicContact CB-CE2 3.9Å; V268-Y270 HydrophobicContact CG1-CD2 4.2Å; V268-Y270 HydrophobicContact CG1-CE2 3.72Å |
| 269 | I | 91.8 | Very high | 87.2 | Confident | 57 Ų | 57 | 88.8 Ų | 88.8 | 29% | 0.292 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.3 | 121.8 | 177.3 | -60.4 | 169.7 | 0 | 0 | 0 | 107.8 | Q149 M169 | Q149-I269 VanDerWaalsContact CG-O 3.26Å; Q149-I269 WeakPolarHBondContact CG-O 3.5Å; Q149-I269 PolarHBondContact NE2-O 2.98Å; M169-I269 HydrophobicContact CB-CG2 4.01Å; M169-I269 HydrophobicContact CG-CG2 4.15Å; M169-I269 HydrophobicContact SD-CG2 3.91Å |
| 270 | Y | 94.1 | Very high | 85.1 | Confident | 104 Ų | 104 | 91.4 Ų | 91.4 | 41% | 0.408 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.6 | 133.4 | 171.7 | -69.6 | -98.1 | 0 | 0 | 0 | 109.7 | Q145 M169 Q170 R172 V268 | Q145-Y270 HydrophobicContact CG-CD1 4.46Å; M169-Y270 CarbonylContact C-O 3.54Å; M169-Y270 WeakPolarHBondContact CA-O 3.37Å; Q170-Y270 PolarHBondContact N-O 3.34Å; Q170-Y270 PolarHBondContact O-N 3.47Å; R172-Y270 HydrophobicContact CB-CD2 4.05Å; R172-Y270 HydrophobicContact CB-CE2 3.96Å; R172-Y270 HydrophobicContact CG-CD2 4.24Å; V268-Y270 HydrophobicContact CB-CE2 3.9Å; V268-Y270 HydrophobicContact CG1-CD2 4.2Å; V268-Y270 HydrophobicContact CG1-CE2 3.72Å |
| 271 | V | 94.7 | Very high | 82.7 | Confident | 7 Ų | 7 | 90.4 Ų | 90.4 | 4% | 0.042 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 133.8 | 172.6 | -174 | 0 | 0 | 0 | 0 | 109.5 | I131 P133 Q145 L148 I152 F167 I168 M169 | I131-V271 HydrophobicContact CD1-CB 4.21Å; I131-V271 HydrophobicContact CD1-CG1 4.34Å; P133-V271 HydrophobicContact CB-CG1 3.87Å; Q145-V271 PolarHBondContact NE2-O 3.27Å; Q145-V271 PolarHBondContact OE1-O 3Å; L148-V271 HydrophobicContact CD2-CB 3.76Å; L148-V271 HydrophobicContact CD2-CG1 3.59Å; L148-V271 HydrophobicContact CD2-CG2 3.85Å; L148-V271 HydrophobicContact CG-CG2 4.23Å; I152-V271 HydrophobicContact CD1-CG2 3.52Å; F167-V271 HydrophobicContact CB-CG1 3.86Å; F167-V271 HydrophobicContact CG-CG1 4.33Å; I168-V271 CarbonylContact O-C 3.53Å; I168-V271 WeakPolarHBondContact O-CA 3.42Å; M169-V271 HydrophobicContact CG-CG2 4.36Å |
| 272 | G | 93.5 | Very high | 80.9 | Confident | 30 Ų | 30 | 94.8 Ų | 94.8 | 31% | 0.309 | 46% | 0.464 | S | S | . | . | P | Polyproline II helix | trans | -93.8 | 171.8 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | I168 | I168-G272 PolarHBondContact O-N 2.9Š|
| 273 | N | 95 | Very high | 79 | Confident | 93 Ų | 93 | 98.6 Ų | 98.6 | 50% | 0.497 | 49% | 0.486 | S | S | . | . | P | Polyproline II helix | trans | -68 | 145.8 | 169.9 | -66.2 | -51.8 | 0 | 0 | 0 | 110.4 | I131 A132 | I131-N273 WeakPolarHBondContact CA-OD1 3.28Å; I131-N273 WeakPolarHBondContact CB-OD1 3.4Å; A132-N273 PolarHBondContact N-OD1 3.46Å; A132-N273 CarbonylContact O-C 3.57Å; A132-N273 VanDerWaalsContact O-CA 3.27Å; A132-N273 WeakPolarHBondContact O-CA 2.9Å |
| 274 | C | 93.4 | Very high | 77.2 | Confident | 15 Ų | 15 | 99.4 Ų | 99.4 | 10% | 0.101 | 50% | 0.501 | C | S | . | . | P | Polyproline II helix | trans | -65.5 | 147.6 | 165.5 | 63.8 | 0 | 0 | 0 | 0 | 109.4 | A132 Y135 F165 | A132-C274 PolarHBondContact O-N 2.82Å; A132-C274 PolarHBondContact O-SG 3.35Å; Y135-C274 HydrophobicContact CE1-CB 4.34Å; F165-C274 HydrophobicContact CD1-CB 4.27Å; F165-C274 HydrophobicContact CE1-CB 3.6Å; F165-C274 HydrophobicContact CZ-CB 3.91Å |
| 275 | P | 90.5 | Very high | 75.5 | Confident | 69 Ų | 69 | 102.4 Ų | 102.4 | 45% | 0.448 | 52% | 0.517 | S | S | . | . | P | Polyproline II helix | trans | -62.9 | 146.9 | 175.8 | 26.7 | -32.2 | 0 | 0 | 0 | 109.6 | Y135 | Y135-P275 WeakPolarHBondContact CE1-O 3.42Å; Y135-P275 WeakPolarHBondContact OH-CG 3.49Å; Y135-P275 PolarHBondContact OH-O 3.29Å |
| 276 | D | 84 | Confident | 74.1 | Confident | 145 Ų | 145 | 102.9 Ų | 102.9 | 78% | 0.775 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -68.4 | 137.8 | 171.8 | -67.2 | -54.7 | 0 | 0 | 0 | 109.3 | ||
| 277 | F | 74.4 | Confident | 73 | Confident | 149 Ų | 149 | 110 Ų | 110 | 65% | 0.654 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 131 | 165.8 | -89.3 | -83.2 | 0 | 0 | 0 | 107.7 | Y135 R279 | Y135-F277 AromaticContact CD1-CD2 3.68Å; Y135-F277 HydrophobicContact CD1-CD2 3.68Å; Y135-F277 AromaticContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD1-CE2 3.46Å; Y135-F277 VanDerWaalsContact CD1-CE2 3.46Å; Y135-F277 HydrophobicContact CD2-CE2 4.19Å; Y135-F277 AromaticContact CE1-CD2 3.49Å; Y135-F277 HydrophobicContact CE1-CD2 3.49Å; Y135-F277 VanDerWaalsContact CE1-CD2 3.49Å; Y135-F277 AromaticContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CE2 3.41Å; Y135-F277 VanDerWaalsContact CE1-CE2 3.41Å; Y135-F277 HydrophobicContact CE1-CG 4.5Å; Y135-F277 HydrophobicContact CE1-CZ 4.36Å; Y135-F277 HydrophobicContact CE2-CE2 4.15Å; Y135-F277 HydrophobicContact CG-CD2 4.49Å; Y135-F277 AromaticContact CG-CE2 3.85Å; Y135-F277 HydrophobicContact CG-CE2 3.85Å; Y135-F277 AromaticContact CZ-CE2 3.78Å; F277-R279 PolarHBondContact O-N 2.93Å |
| 278 | P | 56.9 | Low | 71.7 | Confident | 111 Ų | 111 | 111.7 Ų | 111.7 | 72% | 0.721 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 116.9 | 162.9 | -14.4 | 26.3 | 0 | 0 | 0 | 105.2 | Q280 | P278-Q280 VanDerWaalsContact C-N 3.29Å; P278-Q280 PolarHBondContact O-N 3.43Å |
| 279 | R | 50.5 | Low | 70.8 | Confident | 234 Ų | 234 | 119.9 Ų | 119.9 | 88% | 0.883 | 64% | 0.64 | S | S | * | * | trans | -53.5 | 104 | 171 | -75.9 | -173.7 | 175.3 | 170.3 | -1.1 | 105.4 | F277 N281 | F277-R279 PolarHBondContact O-N 2.93Å; R279-N281 PolarHBondContact O-N 3.2Å | ||
| 280 | Q | 48.8 | Very low | 69.7 | Low | 155 Ų | 155 | 123 Ų | 123 | 72% | 0.724 | 66% | 0.658 | S | S | * | * | trans | -57.2 | 115.9 | 161.3 | -75.7 | 180 | -14 | 0 | 0 | 103.3 | P278 F282 | P278-Q280 VanDerWaalsContact C-N 3.29Å; P278-Q280 PolarHBondContact O-N 3.43Å; Q280-F282 WeakPolarHBondContact O-CD2 3.28Å; Q280-F282 PolarHBondContact O-N 2.9Å | ||
| 281 | N | 41.3 | Very low | 68.4 | Low | 150 Ų | 150 | 124 Ų | 124 | 80% | 0.802 | 67% | 0.671 | S | S | * | * | trans | -55.9 | 92.7 | 166.5 | -84.4 | -20.7 | 0 | 0 | 0 | 105.2 | R279 Q283 | R279-N281 PolarHBondContact O-N 3.2Å; N281-Q283 PolarHBondContact O-N 2.97Å | ||
| 282 | F | 53.4 | Low | 67 | Low | 183 Ų | 183 | 130.5 Ų | 130.5 | 80% | 0.803 | 71% | 0.706 | S | S | * | * | trans | -63.9 | 88.8 | 160.5 | -78.7 | -84.1 | 0 | 0 | 0 | 104 | Q280 P284 | Q280-F282 WeakPolarHBondContact O-CD2 3.28Å; Q280-F282 PolarHBondContact O-N 2.9Å; F282-P284 WeakPolarHBondContact O-CD 3.28Å | ||
| 283 | Q | 52 | Low | 65.4 | Low | 174 Ų | 174 | 136.4 Ų | 136.4 | 81% | 0.813 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 123.6 | 160.5 | -85.7 | -179.8 | -75.2 | 0 | 0 | 105.3 | N281 C285 | N281-Q283 PolarHBondContact O-N 2.97Å; Q283-C285 PolarHBondContact O-N 3Å |
| 284 | P | 52.8 | Low | 63.6 | Low | 116 Ų | 116 | 139.1 Ų | 139.1 | 75% | 0.753 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 132.2 | 171.4 | -20.7 | 31.4 | 0 | 0 | 0 | 108.1 | F282 | F282-P284 WeakPolarHBondContact O-CD 3.28Š|
| 285 | C | 56.1 | Low | 61.6 | Low | 115 Ų | 115 | 147.4 Ų | 147.4 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 130.8 | 167.3 | -97.2 | 0 | 0 | 0 | 0 | 107.6 | Q283 D287 | Q283-C285 PolarHBondContact O-N 3Å; C285-D287 PolarHBondContact O-N 3.4Å |
| 286 | P | 59.4 | Low | 59.5 | Low | 114 Ų | 114 | 153 Ų | 153 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -59 | 129.4 | 176 | 23.1 | -30.5 | 0 | 0 | 0 | 108.8 | V288 | P286-V288 PolarHBondContact O-N 3.15Å; P286-V288 VanDerWaalsContact O-N 3.09Å |
| 287 | D | 67.7 | Low | 57.6 | Low | 151 Ų | 151 | 153.6 Ų | 153.6 | 81% | 0.807 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 116.6 | 175.1 | -64.6 | -55.5 | 0 | 0 | 0 | 108.7 | C285 V289 | C285-D287 PolarHBondContact O-N 3.4Å; D287-V289 PolarHBondContact O-N 3.37Å |
| 288 | V | 64.5 | Low | 56.2 | Low | 146 Ų | 146 | 154 Ų | 154 | 89% | 0.885 | 83% | 0.826 | S | S | * | * | trans | -76 | 103 | 167.3 | -176.4 | 0 | 0 | 0 | 0 | 105.5 | P286 | P286-V288 PolarHBondContact O-N 3.15Å; P286-V288 VanDerWaalsContact O-N 3.09Å | ||
| 289 | V | 71.2 | Confident | 56.2 | Low | 199 Ų | 199 | 157.9 Ų | 157.9 | 100% | 1.206 | 84% | 0.836 | S | S | * | * | trans | -68.7 | 0 | 170.6 | -176.4 | 0 | 0 | 0 | 0 | 110 | D287 | D287-V289 PolarHBondContact O-N 3.37Š|
Retrieved 289 of 289 residues in 114.1 ms
(Link to these results)