| 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 | 35.8 | Very low | 32.9 | Very low | 247 Ų | 247 | 157.7 Ų | 157.7 | 100% | 1.217 | 82% | 0.824 | S | S | * | * | 0 | 113.9 | 0 | -162.2 | 170.1 | -176.7 | 0 | 0 | 107 | |||||
| 2 | I | 31.2 | Very low | 33.1 | Very low | 157 Ų | 157 | 164.2 Ų | 164.2 | 81% | 0.805 | 83% | 0.829 | S | S | * | * | trans | -76.7 | 124.9 | -167.9 | -64.5 | 163.3 | 0 | 0 | 0 | 109.8 | ||||
| 3 | L | 32.6 | Very low | 33.6 | Very low | 172 Ų | 172 | 162.7 Ų | 162.7 | 90% | 0.901 | 81% | 0.809 | S | S | * | * | trans | -145.2 | 64.8 | 149.6 | -89.4 | 174.2 | 0 | 0 | 0 | 108 | N5 | L3-N5 VanDerWaalsContact C-N 3.27Å; L3-N5 PolarHBondContact O-N 2.86Å | ||
| 4 | L | 33.5 | Very low | 34.9 | Very low | 163 Ų | 163 | 155.6 Ų | 155.6 | 85% | 0.853 | 78% | 0.78 | S | S | * | * | trans | -75.2 | 90.8 | 162.3 | -89.3 | 161.3 | 0 | 0 | 0 | 107.1 | S6 | L4-S6 PolarHBondContact O-N 2.84Š| ||
| 5 | N | 30.3 | Very low | 35.8 | Very low | 157 Ų | 157 | 151.3 Ų | 151.3 | 84% | 0.84 | 77% | 0.768 | S | S | * | * | trans | -68.1 | 74.4 | 169.1 | -165.7 | 15.9 | 0 | 0 | 0 | 108.3 | L3 G7 | L3-N5 VanDerWaalsContact C-N 3.27Å; L3-N5 PolarHBondContact O-N 2.86Å; N5-G7 VanDerWaalsContact C-N 3.31Å; N5-G7 PolarHBondContact O-N 2.72Å | ||
| 6 | S | 30.7 | Very low | 36.5 | Very low | 90 Ų | 90 | 151.8 Ų | 151.8 | 63% | 0.629 | 77% | 0.766 | S | S | * | * | trans | -71.6 | 94.7 | 173.5 | -168.3 | 0 | 0 | 0 | 0 | 106.9 | L4 Y8 | L4-S6 PolarHBondContact O-N 2.84Å; S6-Y8 WeakPolarHBondContact O-CD2 3.45Å; S6-Y8 PolarHBondContact O-N 3.11Å | ||
| 7 | G | 31.8 | Very low | 37.2 | Very low | 56 Ų | 56 | 148.1 Ų | 148.1 | 58% | 0.577 | 75% | 0.745 | S | S | * | * | trans | -51.5 | 105.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | N5 T9 | N5-G7 VanDerWaalsContact C-N 3.31Å; N5-G7 PolarHBondContact O-N 2.72Å; G7-T9 PolarHBondContact O-N 3.46Å | ||
| 8 | Y | 29 | Very low | 37.6 | Very low | 220 Ų | 220 | 145.9 Ų | 145.9 | 86% | 0.863 | 73% | 0.732 | S | S | * | * | trans | -63.7 | 93.8 | 162.8 | -72.4 | -89.9 | 0 | 0 | 0 | 106 | S6 M10 | S6-Y8 WeakPolarHBondContact O-CD2 3.45Å; S6-Y8 PolarHBondContact O-N 3.11Å; Y8-M10 PolarHBondContact O-N 3.26Å | ||
| 9 | T | 31.1 | Very low | 38.1 | Very low | 119 Ų | 119 | 143.3 Ų | 143.3 | 73% | 0.73 | 72% | 0.72 | S | S | * | * | trans | -62 | 91.5 | 161.7 | 45.3 | 0 | 0 | 0 | 0 | 106.3 | G7 F11 | G7-T9 PolarHBondContact O-N 3.46Å; T9-F11 PolarHBondContact O-N 3.38Å | ||
| 10 | M | 34.2 | Very low | 38.5 | Very low | 170 Ų | 170 | 140.2 Ų | 140.2 | 84% | 0.837 | 71% | 0.713 | S | S | * | * | trans | -59.4 | 103.4 | 169.9 | -167.7 | -165 | -75.2 | 0 | 0 | 105.7 | Y8 R12 | Y8-M10 PolarHBondContact O-N 3.26Å; M10-R12 PolarHBondContact O-N 3.18Å | ||
| 11 | F | 41.5 | Very low | 38.5 | Very low | 184 Ų | 184 | 141.7 Ų | 141.7 | 81% | 0.807 | 71% | 0.711 | S | S | * | * | trans | -57.8 | 116.4 | 174 | -99.9 | -90.8 | 0 | 0 | 0 | 107.4 | T9 Y13 | T9-F11 PolarHBondContact O-N 3.38Å; F11-Y13 PolarHBondContact O-N 3.29Å | ||
| 12 | R | 35.8 | Very low | 38.9 | Very low | 235 Ų | 235 | 135.7 Ų | 135.7 | 89% | 0.887 | 68% | 0.68 | S | S | * | * | trans | -61.2 | 115.4 | -176 | -142.9 | -179.7 | -159.7 | 179.7 | 4.4 | 108.1 | M10 | M10-R12 PolarHBondContact O-N 3.18Š| ||
| 13 | Y | 39.6 | Very low | 39.7 | Very low | 145 Ų | 145 | 137.4 Ų | 137.4 | 57% | 0.569 | 68% | 0.676 | S | S | * | * | trans | -64.8 | 148.9 | 171.5 | -78.6 | -84.7 | 0 | 0 | 0 | 110.5 | F11 E17 | F11-Y13 PolarHBondContact O-N 3.29Å; Y13-E17 HydrophobicContact CD1-CB 4.47Å; Y13-E17 WeakPolarHBondContact CD1-OE2 3.46Å | ||
| 14 | P | 52.2 | Low | 40.2 | Very low | 63 Ų | 63 | 132.1 Ų | 132.1 | 41% | 0.409 | 65% | 0.653 | S | S | . | * | trans | -64.6 | 151.5 | 169.8 | 25 | -30.4 | 0 | 0 | 0 | 111.3 | H16 E17 | P14-H16 VanDerWaalsContact C-N 3.27Å; P14-H16 PolarHBondContact O-N 3.45Å; P14-H16 VanDerWaalsContact O-N 3.12Å; P14-E17 PolarHBondContact O-N 3.28Å; P14-E17 VanDerWaalsContact O-N 3.11Å | ||
| 15 | P | 48 | Very low | 40.8 | Very low | 91 Ų | 91 | 128.3 Ų | 128.3 | 59% | 0.591 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -58.9 | -31.1 | -168.1 | -23.8 | 32.4 | 0 | 0 | 0 | 115.1 | E17 Q18 L19 | P15-E17 VanDerWaalsContact C-N 3.25Å; P15-E17 PolarHBondContact O-N 2.82Å; P15-Q18 PolarHBondContact O-N 3.05Å; P15-L19 PolarHBondContact O-N 3.45Å |
| 16 | H | 46 | Very low | 41.3 | Very low | 159 Ų | 159 | 128.2 Ų | 128.2 | 74% | 0.736 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -65.4 | -26.5 | -179.2 | -80.7 | -67.7 | 0 | 0 | 0 | 113.3 | P14 S20 | P14-H16 VanDerWaalsContact C-N 3.27Å; P14-H16 PolarHBondContact O-N 3.45Å; P14-H16 VanDerWaalsContact O-N 3.12Å; H16-S20 PolarHBondContact O-OG 3.27Å |
| 17 | E | 49.8 | Very low | 41.7 | Very low | 89 Ų | 89 | 128.4 Ų | 128.4 | 42% | 0.416 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -83.5 | -28.3 | 175.2 | -81.8 | -175.8 | 139.5 | 0 | 0 | 112.6 | Y13 P14 P15 L19 S20 Y21 | Y13-E17 HydrophobicContact CD1-CB 4.47Å; Y13-E17 WeakPolarHBondContact CD1-OE2 3.46Å; P14-E17 PolarHBondContact O-N 3.28Å; P14-E17 VanDerWaalsContact O-N 3.11Å; P15-E17 VanDerWaalsContact C-N 3.25Å; P15-E17 PolarHBondContact O-N 2.82Å; E17-L19 VanDerWaalsContact C-N 3.35Å; E17-S20 WeakPolarHBondContact O-CB 3.2Å; E17-S20 PolarHBondContact O-N 3.26Å; E17-Y21 PolarHBondContact O-N 3.37Å |
| 18 | Q | 43.6 | Very low | 42.1 | Very low | 109 Ų | 109 | 131.6 Ų | 131.6 | 51% | 0.509 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -63.5 | -41.4 | 172.5 | -70.4 | -173.2 | -52.2 | 0 | 0 | 111.6 | P15 S20 Y21 E22 | P15-Q18 PolarHBondContact O-N 3.05Å; Q18-S20 PolarHBondContact O-N 3.46Å; Q18-Y21 WeakPolarHBondContact O-CA 3.21Å; Q18-Y21 WeakPolarHBondContact O-CB 3.12Å; Q18-Y21 PolarHBondContact O-N 2.97Å; Q18-E22 PolarHBondContact O-N 3.24Å |
| 19 | L | 46.6 | Very low | 42.2 | Very low | 97 Ų | 97 | 130.4 Ų | 130.4 | 51% | 0.508 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -60.8 | -33.7 | 174.6 | -80.6 | 160 | 0 | 0 | 0 | 112.8 | P15 E17 R23 | P15-L19 PolarHBondContact O-N 3.45Å; E17-L19 VanDerWaalsContact C-N 3.35Å; L19-R23 WeakPolarHBondContact O-CB 3.24Å; L19-R23 PolarHBondContact O-N 3.2Å; L19-R23 VanDerWaalsContact O-N 3.17Å |
| 20 | S | 46 | Very low | 42.4 | Very low | 81 Ų | 81 | 133.9 Ų | 133.9 | 57% | 0.566 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -72.2 | -33.2 | 175.8 | -57.5 | 0 | 0 | 0 | 0 | 111.7 | H16 E17 Q18 S24 | H16-S20 PolarHBondContact O-OG 3.27Å; E17-S20 WeakPolarHBondContact O-CB 3.2Å; E17-S20 PolarHBondContact O-N 3.26Å; Q18-S20 PolarHBondContact O-N 3.46Å; S20-S24 PolarHBondContact O-N 3.4Å |
| 21 | Y | 39 | Very low | 42.4 | Very low | 171 Ų | 171 | 132.4 Ų | 132.4 | 67% | 0.671 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -70.7 | -48.1 | 175 | -170.4 | -99.5 | 0 | 0 | 0 | 111.9 | E17 Q18 R23 S24 T25 | E17-Y21 PolarHBondContact O-N 3.37Å; Q18-Y21 WeakPolarHBondContact O-CA 3.21Å; Q18-Y21 WeakPolarHBondContact O-CB 3.12Å; Q18-Y21 PolarHBondContact O-N 2.97Å; Y21-R23 PolarHBondContact O-N 3.42Å; Y21-S24 WeakPolarHBondContact O-CB 3.43Å; Y21-S24 PolarHBondContact O-N 2.99Å; Y21-S24 VanDerWaalsContact O-N 3.09Å; Y21-S24 PolarHBondContact O-OG 3.08Å; Y21-T25 PolarHBondContact O-N 3.37Å |
| 22 | E | 44.9 | Very low | 42.1 | Very low | 122 Ų | 122 | 129 Ų | 129 | 57% | 0.57 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -63.8 | -39.6 | 179.5 | -76.4 | 177.9 | 146.2 | 0 | 0 | 112.4 | Q18 S24 T25 E26 | Q18-E22 PolarHBondContact O-N 3.24Å; E22-S24 PolarHBondContact O-N 2.88Å; E22-T25 PolarHBondContact O-N 3.2Å; E22-T25 VanDerWaalsContact O-N 3.14Å; E22-T25 PolarHBondContact O-OG1 2.96Å; E22-E26 PolarHBondContact O-N 3.46Å |
| 23 | R | 46.5 | Very low | 42.1 | Very low | 192 Ų | 192 | 123.4 Ų | 123.4 | 73% | 0.725 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -62.7 | -30.6 | 175.1 | -168.8 | 177.1 | -64.8 | -165 | -0.8 | 112.4 | L19 Y21 | L19-R23 WeakPolarHBondContact O-CB 3.24Å; L19-R23 PolarHBondContact O-N 3.2Å; L19-R23 VanDerWaalsContact O-N 3.17Å; Y21-R23 PolarHBondContact O-N 3.42Å |
| 24 | S | 43.1 | Very low | 42.1 | Very low | 61 Ų | 61 | 123.4 Ų | 123.4 | 43% | 0.427 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -73.7 | -26.5 | 177.8 | 74.1 | 0 | 0 | 0 | 0 | 113.2 | S20 Y21 E22 S27 | S20-S24 PolarHBondContact O-N 3.4Å; Y21-S24 WeakPolarHBondContact O-CB 3.43Å; Y21-S24 PolarHBondContact O-N 2.99Å; Y21-S24 VanDerWaalsContact O-N 3.09Å; Y21-S24 PolarHBondContact O-OG 3.08Å; E22-S24 PolarHBondContact O-N 2.88Å; S24-S27 PolarHBondContact O-OG 2.86Å; S24-S27 VanDerWaalsContact O-OG 3.06Å |
| 25 | T | 46.1 | Very low | 41.2 | Very low | 83 Ų | 83 | 123 Ų | 123 | 51% | 0.509 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -79.4 | -30.2 | 175.2 | 40.1 | 0 | 0 | 0 | 0 | 113.5 | Y21 E22 | Y21-T25 PolarHBondContact O-N 3.37Å; E22-T25 PolarHBondContact O-N 3.2Å; E22-T25 VanDerWaalsContact O-N 3.14Å; E22-T25 PolarHBondContact O-OG1 2.96Å |
| 26 | E | 42.3 | Very low | 40.8 | Very low | 156 Ų | 156 | 123.4 Ų | 123.4 | 73% | 0.729 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -71.8 | -31.5 | 176.7 | -76.7 | -174 | 154.6 | 0 | 0 | 112.9 | E22 V28 K29 | E22-E26 PolarHBondContact O-N 3.46Å; E26-V28 PolarHBondContact O-N 3.24Å; E26-K29 PolarHBondContact O-N 3.01Å |
| 27 | S | 39.4 | Very low | 40.4 | Very low | 93 Ų | 93 | 123.7 Ų | 123.7 | 65% | 0.65 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | -1.5 | -179.4 | 56.4 | 0 | 0 | 0 | 0 | 115.3 | S24 | S24-S27 PolarHBondContact O-OG 2.86Å; S24-S27 VanDerWaalsContact O-OG 3.06Å |
| 28 | V | 39.3 | Very low | 39.7 | Very low | 123 Ų | 123 | 129.1 Ų | 129.1 | 75% | 0.745 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | -5 | 179.8 | -176 | 0 | 0 | 0 | 0 | 113 | E26 | E26-V28 PolarHBondContact O-N 3.24Š|
| 29 | K | 31.1 | Very low | 39.4 | Very low | 196 Ų | 196 | 129.6 Ų | 129.6 | 85% | 0.852 | 69% | 0.693 | S | S | * | * | trans | -105.8 | 69.3 | 171.6 | -81 | -175.4 | 177.5 | 177.6 | 0 | 111.4 | E26 | E26-K29 PolarHBondContact O-N 3.01Š| ||
| 30 | F | 35.9 | Very low | 39 | Very low | 191 Ų | 191 | 135.4 Ų | 135.4 | 84% | 0.838 | 71% | 0.71 | S | S | * | * | trans | -112.2 | 94 | 159 | -138.3 | -92.8 | 0 | 0 | 0 | 107.4 | C32 | F30-C32 PolarHBondContact O-N 3.24Š| ||
| 31 | D | 33.2 | Very low | 38.7 | Very low | 139 Ų | 139 | 136.6 Ų | 136.6 | 74% | 0.743 | 72% | 0.718 | S | S | * | * | trans | -72.2 | 114.3 | 177.9 | -145.2 | -10.5 | 0 | 0 | 0 | 107.7 | T33 | D31-T33 PolarHBondContact O-N 3.34Š| ||
| 32 | C | 35.3 | Very low | 38.8 | Very low | 114 Ų | 114 | 133.6 Ų | 133.6 | 77% | 0.77 | 72% | 0.722 | S | S | * | * | trans | -75.6 | 67.1 | 177 | -73.2 | 0 | 0 | 0 | 0 | 110 | F30 V34 | F30-C32 PolarHBondContact O-N 3.24Å; C32-V34 PolarHBondContact O-N 3.49Å | ||
| 33 | T | 36.4 | Very low | 38.6 | Very low | 117 Ų | 117 | 133 Ų | 133 | 72% | 0.718 | 73% | 0.729 | S | S | * | * | trans | -78 | 104.5 | 164.3 | 46.4 | 0 | 0 | 0 | 0 | 108.5 | D31 G35 | D31-T33 PolarHBondContact O-N 3.34Å; T33-G35 PolarHBondContact O-N 2.56Å | ||
| 34 | V | 39.1 | Very low | 38.5 | Very low | 144 Ų | 144 | 129.7 Ų | 129.7 | 87% | 0.873 | 73% | 0.732 | S | S | * | * | trans | -58 | 99.9 | 170.5 | 179.2 | 0 | 0 | 0 | 0 | 108.4 | C32 | C32-V34 PolarHBondContact O-N 3.49Š| ||
| 35 | G | 33.6 | Very low | 38.4 | Very low | 55 Ų | 55 | 134.9 Ų | 134.9 | 57% | 0.567 | 75% | 0.754 | S | S | * | * | trans | -78.4 | 148.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111 | T33 | T33-G35 PolarHBondContact O-N 2.56Š| ||
| 36 | P | 39.6 | Very low | 38.1 | Very low | 100 Ų | 100 | 136.2 Ų | 136.2 | 65% | 0.649 | 77% | 0.767 | S | S | * | * | trans | -71.7 | 144.5 | -169.1 | 28 | -33.5 | 0 | 0 | 0 | 113.4 | Y38 | P36-Y38 HydrophobicContact CG-CE2 4.49Å; P36-Y38 WeakPolarHBondContact O-CD2 3.27Å; P36-Y38 PolarHBondContact O-N 3.01Å; P36-Y38 VanDerWaalsContact O-N 3.12Å | ||
| 37 | D | 38.6 | Very low | 38.1 | Very low | 164 Ų | 164 | 135.3 Ų | 135.3 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | trans | -58.1 | 104.6 | 178 | -69.7 | -51.4 | 0 | 0 | 0 | 111.7 | P39 | D37-P39 WeakPolarHBondContact O-CD 3.47Š| ||
| 38 | Y | 33.6 | Very low | 37.9 | Very low | 204 Ų | 204 | 134.3 Ų | 134.3 | 80% | 0.8 | 78% | 0.78 | S | S | * | * | trans | -85.3 | 117 | 164.6 | -71.1 | -80.5 | 0 | 0 | 0 | 109 | P36 Y40 | P36-Y38 HydrophobicContact CG-CE2 4.49Å; P36-Y38 WeakPolarHBondContact O-CD2 3.27Å; P36-Y38 PolarHBondContact O-N 3.01Å; P36-Y38 VanDerWaalsContact O-N 3.12Å; Y38-Y40 PolarHBondContact O-N 2.94Å | ||
| 39 | P | 37.5 | Very low | 37.7 | Very low | 118 Ų | 118 | 133.7 Ų | 133.7 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | trans | -69.3 | 107.5 | 177.5 | 25.6 | -30.6 | 0 | 0 | 0 | 109.4 | D37 S41 | D37-P39 WeakPolarHBondContact O-CD 3.47Å; P39-S41 PolarHBondContact O-N 3.4Å | ||
| 40 | Y | 38 | Very low | 37.9 | Very low | 219 Ų | 219 | 136.8 Ų | 136.8 | 86% | 0.859 | 79% | 0.787 | S | S | * | * | trans | -77.9 | 101.7 | 178.4 | -145.1 | -89.4 | 0 | 0 | 0 | 109.5 | Y38 S42 | Y38-Y40 PolarHBondContact O-N 2.94Å; Y40-S42 PolarHBondContact O-N 3.21Å; Y40-S42 VanDerWaalsContact O-N 3.17Å | ||
| 41 | S | 40.3 | Very low | 38.1 | Very low | 107 Ų | 107 | 131.9 Ų | 131.9 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | trans | -63.3 | 109.4 | 171.4 | -38.7 | 0 | 0 | 0 | 0 | 109.4 | P39 P43 | P39-S41 PolarHBondContact O-N 3.4Å; S41-P43 WeakPolarHBondContact O-CD 3.14Å | ||
| 42 | S | 41.8 | Very low | 38.5 | Very low | 107 Ų | 107 | 131.8 Ų | 131.8 | 75% | 0.748 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 126.8 | 175.6 | 41.2 | 0 | 0 | 0 | 0 | 110.6 | Y40 | Y40-S42 PolarHBondContact O-N 3.21Å; Y40-S42 VanDerWaalsContact O-N 3.17Å |
| 43 | P | 39.7 | Very low | 38.6 | Very low | 111 Ų | 111 | 136.8 Ų | 136.8 | 72% | 0.721 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 149 | 173.9 | -16.8 | 29.3 | 0 | 0 | 0 | 111.7 | S41 L45 | S41-P43 WeakPolarHBondContact O-CD 3.14Å; P43-L45 PolarHBondContact O-N 2.93Å |
| 44 | P | 44.3 | Very low | 38.8 | Very low | 122 Ų | 122 | 136.6 Ų | 136.6 | 79% | 0.792 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 132.2 | -177.4 | 23.7 | -31.1 | 0 | 0 | 0 | 112.5 | S46 | P44-S46 PolarHBondContact O-N 2.87Š|
| 45 | L | 42.4 | Very low | 38.9 | Very low | 169 Ų | 169 | 134.6 Ų | 134.6 | 89% | 0.885 | 78% | 0.78 | S | S | * | * | trans | -66.7 | 108.9 | -177.2 | -160.8 | 78.8 | 0 | 0 | 0 | 110.7 | P43 | P43-L45 PolarHBondContact O-N 2.93Š| ||
| 46 | S | 39.3 | Very low | 39.1 | Very low | 111 Ų | 111 | 135.3 Ų | 135.3 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | trans | -70.9 | 126.9 | 172.9 | -55.8 | 0 | 0 | 0 | 0 | 110.8 | P44 G48 | P44-S46 PolarHBondContact O-N 2.87Å; S46-G48 PolarHBondContact O-N 3.32Å | ||
| 47 | P | 41.2 | Very low | 39.4 | Very low | 137 Ų | 137 | 135.5 Ų | 135.5 | 89% | 0.89 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -84.8 | 94.8 | -178.7 | 31.7 | -30.3 | 0 | 0 | 0 | 109.8 | ||
| 48 | G | 35.7 | Very low | 39.6 | Very low | 73 Ų | 73 | 136.5 Ų | 136.5 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | trans | 164.1 | 66.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | S46 | S46-G48 PolarHBondContact O-N 3.32Š| ||
| 49 | S | 35 | Very low | 40.3 | Very low | 109 Ų | 109 | 135.2 Ų | 135.2 | 76% | 0.762 | 79% | 0.788 | S | S | * | * | trans | -164.4 | 111.9 | 147.6 | 40.5 | 0 | 0 | 0 | 0 | 109.7 | S51 | S49-S51 PolarHBondContact O-N 3.42Š| ||
| 50 | R | 35 | Very low | 40.8 | Very low | 261 Ų | 261 | 136.5 Ų | 136.5 | 99% | 0.985 | 78% | 0.783 | S | S | * | * | trans | -67.4 | 71.9 | 160.9 | -84.9 | 175.6 | -156.8 | 170.4 | 6.6 | 108.2 | T52 | R50-T52 PolarHBondContact O-N 3.01Š| ||
| 51 | S | 41.3 | Very low | 41.7 | Very low | 88 Ų | 88 | 130.6 Ų | 130.6 | 62% | 0.615 | 77% | 0.769 | S | S | * | * | trans | -84.4 | 101.9 | 161.7 | 169.5 | 0 | 0 | 0 | 0 | 106 | S49 R53 | S49-S51 PolarHBondContact O-N 3.42Å; S51-R53 PolarHBondContact O-N 3.14Å | ||
| 52 | T | 41 | Very low | 42.7 | Very low | 138 Ų | 138 | 133.6 Ų | 133.6 | 85% | 0.847 | 77% | 0.772 | S | S | * | * | trans | -51.5 | 94.5 | 158.2 | 36.7 | 0 | 0 | 0 | 0 | 107 | R50 S54 | R50-T52 PolarHBondContact O-N 3.01Å; T52-S54 PolarHBondContact O-N 3.19Å | ||
| 53 | R | 37.3 | Very low | 43.8 | Very low | 218 Ų | 218 | 131 Ų | 131 | 82% | 0.823 | 75% | 0.749 | S | S | * | * | trans | -68.4 | 91.9 | -175.5 | -152.8 | 170.7 | 172.3 | 175.1 | -3.7 | 106.1 | S51 S55 | S51-R53 PolarHBondContact O-N 3.14Å; R53-S55 PolarHBondContact O-N 3.24Å | ||
| 54 | S | 39.7 | Very low | 45.8 | Very low | 114 Ų | 114 | 130.5 Ų | 130.5 | 80% | 0.797 | 74% | 0.744 | S | S | * | * | trans | -57.3 | 83.3 | 159.1 | 174.5 | 0 | 0 | 0 | 0 | 106.6 | T52 G56 | T52-S54 PolarHBondContact O-N 3.19Å; S54-G56 PolarHBondContact O-N 2.93Å | ||
| 55 | S | 41.9 | Very low | 47.2 | Very low | 102 Ų | 102 | 128.5 Ų | 128.5 | 71% | 0.713 | 74% | 0.738 | S | S | * | * | trans | -73 | 74.2 | 166.9 | -69.5 | 0 | 0 | 0 | 0 | 107 | R53 C57 | R53-S55 PolarHBondContact O-N 3.24Å; S55-C57 VanDerWaalsContact C-N 3.34Å; S55-C57 PolarHBondContact O-N 2.83Å; S55-C57 VanDerWaalsContact O-N 3.08Å | ||
| 56 | G | 37.7 | Very low | 49 | Very low | 69 Ų | 69 | 127 Ų | 127 | 71% | 0.711 | 73% | 0.73 | S | S | * | * | trans | -68.4 | 94.5 | 163.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | S54 | S54-G56 PolarHBondContact O-N 2.93Š| ||
| 57 | C | 45.9 | Very low | 51 | Low | 105 Ų | 105 | 123.2 Ų | 123.2 | 71% | 0.709 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -172.4 | 128.1 | 151.8 | -155.3 | 0 | 0 | 0 | 0 | 107.6 | S55 | S55-C57 VanDerWaalsContact C-N 3.34Å; S55-C57 PolarHBondContact O-N 2.83Å; S55-C57 VanDerWaalsContact O-N 3.08Å |
| 58 | F | 43.3 | Very low | 52.9 | Low | 184 Ų | 184 | 122.8 Ų | 122.8 | 81% | 0.807 | 69% | 0.689 | S | S | * | * | trans | 65.9 | 45.4 | 178.1 | -80.5 | -88.3 | 0 | 0 | 0 | 116.8 | H60 | F58-H60 PolarHBondContact O-N 3.25Š| ||
| 59 | Q | 48 | Very low | 55 | Low | 178 Ų | 178 | 122.3 Ų | 122.3 | 83% | 0.832 | 67% | 0.674 | S | S | * | * | trans | -69.6 | 91.5 | 140.8 | -149.5 | 138.8 | 34.7 | 0 | 0 | 105.5 | V61 | Q59-V61 HydrophobicContact CB-CG2 4.23Å; Q59-V61 HydrophobicContact CG-CG2 4.16Å; Q59-V61 PolarHBondContact O-N 3.19Å | ||
| 60 | H | 48.3 | Very low | 57.3 | Low | 144 Ų | 144 | 120.6 Ų | 120.6 | 67% | 0.667 | 66% | 0.662 | S | S | * | * | trans | -62.8 | 74.6 | 161.1 | -169.5 | -80.3 | 0 | 0 | 0 | 105.2 | F58 Q62 | F58-H60 PolarHBondContact O-N 3.25Å; H60-Q62 VanDerWaalsContact C-N 3.29Å; H60-Q62 PolarHBondContact O-N 3.41Å | ||
| 61 | V | 56.5 | Low | 59.7 | Low | 95 Ų | 95 | 115 Ų | 115 | 58% | 0.576 | 64% | 0.641 | S | S | * | * | trans | -53.5 | 106.5 | 174.8 | 174.7 | 0 | 0 | 0 | 0 | 102.8 | Q59 L63 | Q59-V61 HydrophobicContact CB-CG2 4.23Å; Q59-V61 HydrophobicContact CG-CG2 4.16Å; Q59-V61 PolarHBondContact O-N 3.19Å; V61-L63 PolarHBondContact O-N 2.9Å | ||
| 62 | Q | 60.8 | Low | 61.7 | Low | 171 Ų | 171 | 114.1 Ų | 114.1 | 80% | 0.799 | 62% | 0.624 | S | S | * | * | trans | -64.9 | 91.6 | 176.9 | -72.5 | -156.7 | -11.1 | 0 | 0 | 105 | H60 T64 | H60-Q62 VanDerWaalsContact C-N 3.29Å; H60-Q62 PolarHBondContact O-N 3.41Å; Q62-T64 PolarHBondContact O-N 2.88Å; Q62-T64 VanDerWaalsContact O-N 3.09Å | ||
| 63 | L | 66.1 | Low | 63.7 | Low | 51 Ų | 51 | 113.4 Ų | 113.4 | 27% | 0.267 | 61% | 0.61 | S | S | . | * | trans | -56.8 | 122.3 | 177.2 | -71.9 | 168.6 | 0 | 0 | 0 | 106 | V61 A67 K68 | V61-L63 PolarHBondContact O-N 2.9Å; L63-A67 HydrophobicContact CB-CB 4.2Å; L63-A67 HydrophobicContact CD2-CB 4.05Å; L63-K68 HydrophobicContact CB-CG 3.81Å; L63-K68 WeakPolarHBondContact O-CE 3.33Å | ||
| 64 | T | 81.4 | Confident | 66 | Low | 102 Ų | 102 | 112.6 Ų | 112.6 | 63% | 0.626 | 61% | 0.607 | S | S | * | * | trans | -49.1 | 147.2 | 170.7 | -46.5 | 0 | 0 | 0 | 0 | 108.7 | Q62 L66 A67 K68 | Q62-T64 PolarHBondContact O-N 2.88Å; Q62-T64 VanDerWaalsContact O-N 3.09Å; T64-L66 HydrophobicContact CG2-CB 4.3Å; T64-L66 PolarHBondContact O-N 3.42Å; T64-L66 VanDerWaalsContact O-N 3.08Å; T64-A67 WeakPolarHBondContact O-CA 3.37Å; T64-A67 WeakPolarHBondContact O-CB 3.48Å; T64-A67 PolarHBondContact O-N 2.82Å; T64-K68 PolarHBondContact O-N 3.38Å | ||
| 65 | A | 74.6 | Confident | 68.1 | Low | 79 Ų | 79 | 112.8 Ų | 112.8 | 65% | 0.653 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -50 | -38.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | A67 K68 C69 | A65-A67 PolarHBondContact O-N 3.14Å; A65-K68 PolarHBondContact O-N 2.95Å; A65-C69 VanDerWaalsContact O-CB 3.24Å; A65-C69 WeakPolarHBondContact O-CB 3.13Å; A65-C69 PolarHBondContact O-N 3.35Å |
| 66 | L | 78.7 | Confident | 70.1 | Confident | 139 Ų | 139 | 109.6 Ų | 109.6 | 73% | 0.728 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.6 | -41.9 | 173.6 | -170.1 | 114.2 | 0 | 0 | 0 | 113.2 | T64 C69 S70 | T64-L66 HydrophobicContact CG2-CB 4.3Å; T64-L66 PolarHBondContact O-N 3.42Å; T64-L66 VanDerWaalsContact O-N 3.08Å; L66-C69 PolarHBondContact O-N 3.01Å; L66-S70 VanDerWaalsContact O-CB 3.26Å; L66-S70 WeakPolarHBondContact O-CB 3.09Å; L66-S70 PolarHBondContact O-N 3.16Å |
| 67 | A | 81.5 | Confident | 72.3 | Confident | 30 Ų | 30 | 113.3 Ų | 113.3 | 25% | 0.248 | 57% | 0.567 | C | S | . | * | H | α-helix | trans | -68.5 | -36.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L63 T64 A65 R71 | L63-A67 HydrophobicContact CB-CB 4.2Å; L63-A67 HydrophobicContact CD2-CB 4.05Å; T64-A67 WeakPolarHBondContact O-CA 3.37Å; T64-A67 WeakPolarHBondContact O-CB 3.48Å; T64-A67 PolarHBondContact O-N 2.82Å; A65-A67 PolarHBondContact O-N 3.14Å; A67-R71 WeakPolarHBondContact O-CB 3.48Å; A67-R71 VanDerWaalsContact O-CG 3.24Å; A67-R71 WeakPolarHBondContact O-CG 3.35Å; A67-R71 PolarHBondContact O-N 3.38Å |
| 68 | K | 80.9 | Confident | 74.1 | Confident | 129 Ų | 129 | 111.8 Ų | 111.8 | 56% | 0.561 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.2 | -46.7 | 172.5 | -65.8 | -176 | -179.9 | -178.1 | 0 | 111.1 | L63 T64 A65 R71 Y72 | L63-K68 HydrophobicContact CB-CG 3.81Å; L63-K68 WeakPolarHBondContact O-CE 3.33Å; T64-K68 PolarHBondContact O-N 3.38Å; A65-K68 PolarHBondContact O-N 2.95Å; K68-R71 PolarHBondContact O-N 3.41Å; K68-Y72 PolarHBondContact O-N 2.93Å |
| 69 | C | 80.3 | Confident | 75.9 | Confident | 63 Ų | 63 | 110.3 Ų | 110.3 | 43% | 0.426 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.3 | -49.8 | 178 | -169.7 | 0 | 0 | 0 | 0 | 111.8 | A65 L66 R71 Y72 F73 | A65-C69 VanDerWaalsContact O-CB 3.24Å; A65-C69 WeakPolarHBondContact O-CB 3.13Å; A65-C69 PolarHBondContact O-N 3.35Å; L66-C69 PolarHBondContact O-N 3.01Å; C69-R71 VanDerWaalsContact C-N 3.33Å; C69-R71 PolarHBondContact O-N 2.95Å; C69-Y72 PolarHBondContact O-N 3.41Å; C69-Y72 VanDerWaalsContact O-N 3.1Å; C69-F73 VanDerWaalsContact O-CD2 3.28Å; C69-F73 WeakPolarHBondContact O-CD2 3.32Å; C69-F73 PolarHBondContact O-N 3.29Å; C69-F73 WeakPolarHBondContact SG-CE2 3.48Å |
| 70 | S | 83.9 | Confident | 77.4 | Confident | 73 Ų | 73 | 113.3 Ų | 113.3 | 51% | 0.51 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -59.1 | -40.9 | 176.2 | 175.8 | 0 | 0 | 0 | 0 | 112.5 | L66 Y72 F73 R74 | L66-S70 VanDerWaalsContact O-CB 3.26Å; L66-S70 WeakPolarHBondContact O-CB 3.09Å; L66-S70 PolarHBondContact O-N 3.16Å; S70-Y72 PolarHBondContact O-N 2.99Å; S70-F73 PolarHBondContact O-N 2.87Å; S70-R74 WeakPolarHBondContact O-CB 3.36Å; S70-R74 PolarHBondContact O-N 3.14Å |
| 71 | R | 84.1 | Confident | 78.9 | Confident | 144 Ų | 144 | 112.1 Ų | 112.1 | 54% | 0.543 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.4 | -41.5 | 174.5 | -76.5 | 176.4 | -174.1 | -139.9 | 1.5 | 112.1 | A67 K68 C69 R75 | A67-R71 WeakPolarHBondContact O-CB 3.48Å; A67-R71 VanDerWaalsContact O-CG 3.24Å; A67-R71 WeakPolarHBondContact O-CG 3.35Å; A67-R71 PolarHBondContact O-N 3.38Å; K68-R71 PolarHBondContact O-N 3.41Å; C69-R71 VanDerWaalsContact C-N 3.33Å; C69-R71 PolarHBondContact O-N 2.95Å; R71-R75 WeakPolarHBondContact O-CG 3.45Å; R71-R75 PolarHBondContact O-N 2.91Å |
| 72 | Y | 83.3 | Confident | 80.4 | Confident | 69 Ų | 69 | 108.4 Ų | 108.4 | 27% | 0.271 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.5 | -45.9 | 177.1 | -172.3 | -99.4 | 0 | 0 | 0 | 111.6 | K68 C69 S70 R74 R75 L76 L123 | K68-Y72 PolarHBondContact O-N 2.93Å; C69-Y72 PolarHBondContact O-N 3.41Å; C69-Y72 VanDerWaalsContact O-N 3.1Å; S70-Y72 PolarHBondContact O-N 2.99Å; Y72-R74 VanDerWaalsContact C-N 3.33Å; Y72-R74 PolarHBondContact O-N 3.38Å; Y72-R75 WeakPolarHBondContact O-CA 3.49Å; Y72-R75 WeakPolarHBondContact O-CB 3.41Å; Y72-R75 PolarHBondContact O-N 3.47Å; Y72-L76 HydrophobicContact CD1-CD1 3.94Å; Y72-L76 HydrophobicContact CD1-CG 4.28Å; Y72-L76 HydrophobicContact CE1-CD1 3.74Å; Y72-L76 HydrophobicContact CE1-CD2 4.25Å; Y72-L76 HydrophobicContact CE1-CG 4.02Å; Y72-L76 PolarHBondContact O-N 2.81Å; Y72-L123 HydrophobicContact CE1-CD2 4.17Å |
| 73 | F | 83.3 | Confident | 81.8 | Confident | 122 Ų | 122 | 104.4 Ų | 104.4 | 54% | 0.535 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.3 | -39.8 | 175.1 | -82.8 | -66.1 | 0 | 0 | 0 | 113.2 | C69 S70 R75 L76 I77 | C69-F73 VanDerWaalsContact O-CD2 3.28Å; C69-F73 WeakPolarHBondContact O-CD2 3.32Å; C69-F73 PolarHBondContact O-N 3.29Å; C69-F73 WeakPolarHBondContact SG-CE2 3.48Å; S70-F73 PolarHBondContact O-N 2.87Å; F73-R75 VanDerWaalsContact C-N 3.26Å; F73-R75 PolarHBondContact O-N 3.46Å; F73-L76 HydrophobicContact CD1-CD1 3.88Å; F73-L76 HydrophobicContact CE1-CD1 4.23Å; F73-L76 WeakPolarHBondContact O-CB 3.25Å; F73-L76 PolarHBondContact O-N 3.3Å; F73-L76 VanDerWaalsContact O-N 3.12Å; F73-I77 PolarHBondContact O-N 3.46Å |
| 74 | R | 85.1 | Confident | 83.1 | Confident | 201 Ų | 201 | 103.9 Ų | 103.9 | 76% | 0.758 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.8 | -39.1 | 173.7 | -177.9 | 176.3 | 174.7 | 177.2 | -0.8 | 111.8 | S70 Y72 L76 I77 D78 | S70-R74 WeakPolarHBondContact O-CB 3.36Å; S70-R74 PolarHBondContact O-N 3.14Å; Y72-R74 VanDerWaalsContact C-N 3.33Å; Y72-R74 PolarHBondContact O-N 3.38Å; R74-L76 VanDerWaalsContact C-N 3.34Å; R74-I77 PolarHBondContact O-N 2.87Å; R74-D78 PolarHBondContact O-N 2.85Å |
| 75 | R | 84.9 | Confident | 83.7 | Confident | 118 Ų | 118 | 105 Ų | 105 | 45% | 0.445 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.7 | -33.4 | 175.5 | -69.2 | 174.3 | 179.8 | -178 | -0.1 | 112.3 | R71 Y72 F73 I77 D78 M82 P120 | R71-R75 WeakPolarHBondContact O-CG 3.45Å; R71-R75 PolarHBondContact O-N 2.91Å; Y72-R75 WeakPolarHBondContact O-CA 3.49Å; Y72-R75 WeakPolarHBondContact O-CB 3.41Å; Y72-R75 PolarHBondContact O-N 3.47Å; F73-R75 VanDerWaalsContact C-N 3.26Å; F73-R75 PolarHBondContact O-N 3.46Å; R75-I77 VanDerWaalsContact C-N 3.27Å; R75-I77 PolarHBondContact O-N 2.81Å; R75-D78 PolarHBondContact O-N 3.37Å; R75-M82 WeakPolarHBondContact O-CE 3.29Å; R75-P120 HydrophobicContact CB-CG 4.47Å |
| 76 | L | 84 | Confident | 84.5 | Confident | 35 Ų | 35 | 103.5 Ų | 103.5 | 18% | 0.183 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -65.3 | -28.3 | 175.4 | -72.3 | 171.6 | 0 | 0 | 0 | 113.5 | Y72 F73 R74 M82 P120 L123 V124 | Y72-L76 HydrophobicContact CD1-CD1 3.94Å; Y72-L76 HydrophobicContact CD1-CG 4.28Å; Y72-L76 HydrophobicContact CE1-CD1 3.74Å; Y72-L76 HydrophobicContact CE1-CD2 4.25Å; Y72-L76 HydrophobicContact CE1-CG 4.02Å; Y72-L76 PolarHBondContact O-N 2.81Å; F73-L76 HydrophobicContact CD1-CD1 3.88Å; F73-L76 HydrophobicContact CE1-CD1 4.23Å; F73-L76 WeakPolarHBondContact O-CB 3.25Å; F73-L76 PolarHBondContact O-N 3.3Å; F73-L76 VanDerWaalsContact O-N 3.12Å; R74-L76 VanDerWaalsContact C-N 3.34Å; L76-M82 VanDerWaalsContact C-CE 3.44Å; L76-M82 WeakPolarHBondContact O-CE 3.27Å; L76-P120 HydrophobicContact CD2-CB 3.62Å; L76-P120 HydrophobicContact CG-CB 4.31Å; L76-L123 HydrophobicContact CD1-CD2 4.01Å; L76-L123 HydrophobicContact CD2-CB 4.17Å; L76-L123 HydrophobicContact CD2-CD2 3.87Å; L76-L123 HydrophobicContact CD2-CG 4.49Å; L76-V124 HydrophobicContact CD2-CG2 4.24Å |
| 77 | I | 84.2 | Confident | 85.3 | Confident | 148 Ų | 148 | 96.9 Ų | 96.9 | 76% | 0.759 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -83.6 | -27.1 | 178.4 | -64.2 | 167.8 | 0 | 0 | 0 | 111.1 | F73 R74 R75 Y79 | F73-I77 PolarHBondContact O-N 3.46Å; R74-I77 PolarHBondContact O-N 2.87Å; R75-I77 VanDerWaalsContact C-N 3.27Å; R75-I77 PolarHBondContact O-N 2.81Å; I77-Y79 PolarHBondContact O-N 2.95Å |
| 78 | D | 83.2 | Confident | 85.9 | Confident | 72 Ų | 72 | 100.4 Ų | 100.4 | 39% | 0.385 | 45% | 0.453 | S | S | . | . | trans | -82.3 | 84 | -177.9 | -170.8 | -1.4 | 0 | 0 | 0 | 112 | R74 R75 R80 Q81 | R74-D78 PolarHBondContact O-N 2.85Å; R75-D78 PolarHBondContact O-N 3.37Å; D78-R80 VanDerWaalsContact C-N 3.28Å; D78-R80 PolarHBondContact O-N 3.45Å; D78-R80 PolarHBondContact OD1-N 2.86Å; D78-Q81 HydrophobicContact CB-CG 4.38Å; D78-Q81 WeakPolarHBondContact O-CG 3.19Å; D78-Q81 PolarHBondContact OD2-NE2 3.28Å | ||
| 79 | Y | 79.7 | Confident | 86.6 | Confident | 154 Ų | 154 | 100 Ų | 100 | 60% | 0.604 | 45% | 0.448 | S | S | * | . | G | 310 helix | trans | -61.8 | -28.6 | -178.2 | -174.3 | -90.6 | 0 | 0 | 0 | 113.8 | I77 Q81 M82 F84 | I77-Y79 PolarHBondContact O-N 2.95Å; Y79-Q81 VanDerWaalsContact C-N 3.29Å; Y79-Q81 PolarHBondContact O-N 3.35Å; Y79-M82 WeakPolarHBondContact O-CB 3.26Å; Y79-M82 PolarHBondContact O-N 3.5Å; Y79-F84 HydrophobicContact CD1-CE2 4.38Å; Y79-F84 AromaticContact CD2-CE2 3.43Å; Y79-F84 HydrophobicContact CD2-CE2 3.43Å; Y79-F84 VanDerWaalsContact CD2-CE2 3.43Å; Y79-F84 AromaticContact CD2-CZ 3.55Å; Y79-F84 HydrophobicContact CD2-CZ 3.55Å; Y79-F84 HydrophobicContact CE1-CE2 4.05Å; Y79-F84 AromaticContact CE2-CD2 3.96Å; Y79-F84 HydrophobicContact CE2-CD2 3.96Å; Y79-F84 HydrophobicContact CE2-CE1 4.28Å; Y79-F84 AromaticContact CE2-CE2 3.01Å; Y79-F84 HydrophobicContact CE2-CE2 3.01Å; Y79-F84 AromaticContact CE2-CZ 3.22Å; Y79-F84 HydrophobicContact CE2-CZ 3.22Å; Y79-F84 HydrophobicContact CG-CE2 4.1Å; Y79-F84 AromaticContact CZ-CD2 3.88Å; Y79-F84 AromaticContact CZ-CE2 3.34Å |
| 80 | R | 80.1 | Confident | 87.3 | Confident | 240 Ų | 240 | 97.1 Ų | 97.1 | 91% | 0.906 | 43% | 0.428 | S | S | * | . | G | 310 helix | trans | -69.8 | -23.7 | -168.5 | -67.9 | -154.9 | 72.4 | 156.7 | 3.4 | 114.4 | D78 | D78-R80 VanDerWaalsContact C-N 3.28Å; D78-R80 PolarHBondContact O-N 3.45Å; D78-R80 PolarHBondContact OD1-N 2.86Å |
| 81 | Q | 80.9 | Confident | 87.9 | Confident | 119 Ų | 119 | 94.1 Ų | 94.1 | 56% | 0.556 | 41% | 0.406 | S | S | * | . | G | 310 helix | trans | -99.8 | 4 | -179.1 | 64 | -177.4 | -13.1 | 0 | 0 | 113.1 | D78 Y79 | D78-Q81 HydrophobicContact CB-CG 4.38Å; D78-Q81 WeakPolarHBondContact O-CG 3.19Å; D78-Q81 PolarHBondContact OD2-NE2 3.28Å; Y79-Q81 VanDerWaalsContact C-N 3.29Å; Y79-Q81 PolarHBondContact O-N 3.35Å |
| 82 | M | 87.5 | Confident | 88.5 | Confident | 17 Ų | 17 | 91.4 Ų | 91.4 | 8% | 0.084 | 40% | 0.402 | C | S | . | . | trans | -84.6 | 126 | -176.2 | -65 | -163.4 | -177 | 0 | 0 | 111.7 | R75 L76 Y79 F84 P120 A121 V124 | R75-M82 WeakPolarHBondContact O-CE 3.29Å; L76-M82 VanDerWaalsContact C-CE 3.44Å; L76-M82 WeakPolarHBondContact O-CE 3.27Å; Y79-M82 WeakPolarHBondContact O-CB 3.26Å; Y79-M82 PolarHBondContact O-N 3.5Å; M82-F84 HydrophobicContact CB-CD2 3.88Å; M82-F84 HydrophobicContact CB-CE2 3.41Å; M82-F84 VanDerWaalsContact CB-CE2 3.41Å; M82-F84 HydrophobicContact CB-CZ 3.88Å; M82-F84 HydrophobicContact CG-CE2 4.23Å; M82-F84 HydrophobicContact CG-CZ 4.35Å; M82-F84 PolarHBondContact O-N 3.43Å; M82-F84 VanDerWaalsContact O-N 3.14Å; M82-F84 HydrophobicContact SD-CE1 4.35Å; M82-F84 HydrophobicContact SD-CE2 3.99Å; M82-F84 HydrophobicContact SD-CZ 3.54Å; M82-F84 VanDerWaalsContact SD-CZ 3.54Å; M82-P120 HydrophobicContact CE-CB 3.73Å; M82-P120 HydrophobicContact CE-CG 4.01Å; M82-P120 HydrophobicContact CG-CG 4.07Å; M82-P120 HydrophobicContact SD-CB 4.32Å; M82-P120 HydrophobicContact SD-CG 4.38Å; M82-A121 HydrophobicContact CB-CB 3.95Å; M82-V124 HydrophobicContact CE-CG2 3.99Å; M82-V124 HydrophobicContact SD-CB 4.42Å; M82-V124 HydrophobicContact SD-CG2 3.9Å | ||
| 83 | D | 89.9 | Confident | 89.1 | Confident | 88 Ų | 88 | 91.3 Ų | 91.3 | 47% | 0.471 | 40% | 0.401 | S | S | . | . | trans | -86.1 | 78.7 | 174.9 | -167.8 | -19 | 0 | 0 | 0 | 110.5 | E85 F86 A87 | D83-E85 VanDerWaalsContact C-N 3.28Å; D83-E85 PolarHBondContact O-N 2.87Å; D83-E85 PolarHBondContact OD1-N 3.27Å; D83-F86 HydrophobicContact CB-CB 4.21Å; D83-F86 VanDerWaalsContact CG-CB 3.44Å; D83-F86 PolarHBondContact O-N 3.33Å; D83-F86 WeakPolarHBondContact OD1-CB 3.46Å; D83-F86 PolarHBondContact OD1-N 2.92Å; D83-A87 PolarHBondContact O-N 2.88Å; D83-A87 VanDerWaalsContact O-N 3.14Å | ||
| 84 | F | 92.9 | Very high | 89.8 | Confident | 40 Ų | 40 | 85.5 Ų | 85.5 | 18% | 0.175 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -65.9 | -30.1 | 178.1 | -74 | -75 | 0 | 0 | 0 | 113.1 | Y79 M82 A87 L88 A121 V124 | Y79-F84 HydrophobicContact CD1-CE2 4.38Å; Y79-F84 AromaticContact CD2-CE2 3.43Å; Y79-F84 HydrophobicContact CD2-CE2 3.43Å; Y79-F84 VanDerWaalsContact CD2-CE2 3.43Å; Y79-F84 AromaticContact CD2-CZ 3.55Å; Y79-F84 HydrophobicContact CD2-CZ 3.55Å; Y79-F84 HydrophobicContact CE1-CE2 4.05Å; Y79-F84 AromaticContact CE2-CD2 3.96Å; Y79-F84 HydrophobicContact CE2-CD2 3.96Å; Y79-F84 HydrophobicContact CE2-CE1 4.28Å; Y79-F84 AromaticContact CE2-CE2 3.01Å; Y79-F84 HydrophobicContact CE2-CE2 3.01Å; Y79-F84 AromaticContact CE2-CZ 3.22Å; Y79-F84 HydrophobicContact CE2-CZ 3.22Å; Y79-F84 HydrophobicContact CG-CE2 4.1Å; Y79-F84 AromaticContact CZ-CD2 3.88Å; Y79-F84 AromaticContact CZ-CE2 3.34Å; M82-F84 HydrophobicContact CB-CD2 3.88Å; M82-F84 HydrophobicContact CB-CE2 3.41Å; M82-F84 VanDerWaalsContact CB-CE2 3.41Å; M82-F84 HydrophobicContact CB-CZ 3.88Å; M82-F84 HydrophobicContact CG-CE2 4.23Å; M82-F84 HydrophobicContact CG-CZ 4.35Å; M82-F84 PolarHBondContact O-N 3.43Å; M82-F84 VanDerWaalsContact O-N 3.14Å; M82-F84 HydrophobicContact SD-CE1 4.35Å; M82-F84 HydrophobicContact SD-CE2 3.99Å; M82-F84 HydrophobicContact SD-CZ 3.54Å; M82-F84 VanDerWaalsContact SD-CZ 3.54Å; F84-A87 PolarHBondContact O-N 2.93Å; F84-L88 WeakPolarHBondContact O-CB 3.49Å; F84-L88 VanDerWaalsContact O-CG 3.22Å; F84-L88 WeakPolarHBondContact O-CG 3.24Å; F84-L88 PolarHBondContact O-N 2.91Å; F84-A121 HydrophobicContact CD1-CB 4.24Å; F84-A121 HydrophobicContact CE1-CB 4.37Å; F84-V124 HydrophobicContact CE1-CB 4.04Å; F84-V124 HydrophobicContact CE1-CG1 3.82Å; F84-V124 HydrophobicContact CZ-CB 4.33Å; F84-V124 HydrophobicContact CZ-CG1 3.97Å |
| 85 | E | 94.1 | Very high | 90.3 | Very high | 124 Ų | 124 | 77.8 Ų | 77.8 | 58% | 0.579 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -61.1 | -51.1 | 177.8 | -174.7 | -176.7 | 160.4 | 0 | 0 | 109.6 | D83 A87 L88 W89 | D83-E85 VanDerWaalsContact C-N 3.28Å; D83-E85 PolarHBondContact O-N 2.87Å; D83-E85 PolarHBondContact OD1-N 3.27Å; E85-A87 PolarHBondContact O-N 3.48Å; E85-L88 PolarHBondContact O-N 2.75Å; E85-W89 PolarHBondContact O-N 2.97Å |
| 86 | F | 92.4 | Very high | 90.8 | Very high | 49 Ų | 49 | 77.3 Ų | 77.3 | 22% | 0.215 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 176.2 | -178.8 | -110.3 | 0 | 0 | 0 | 112.3 | D83 L88 W89 Q90 | D83-F86 HydrophobicContact CB-CB 4.21Å; D83-F86 VanDerWaalsContact CG-CB 3.44Å; D83-F86 PolarHBondContact O-N 3.33Å; D83-F86 WeakPolarHBondContact OD1-CB 3.46Å; D83-F86 PolarHBondContact OD1-N 2.92Å; F86-L88 PolarHBondContact O-N 3.33Å; F86-W89 PolarHBondContact O-N 2.95Å; F86-Q90 HydrophobicContact CD1-CG 4.45Å; F86-Q90 VanDerWaalsContact CE1-CD 3.45Å; F86-Q90 HydrophobicContact CE1-CG 4.2Å; F86-Q90 HydrophobicContact CE2-CG 4.46Å; F86-Q90 HydrophobicContact CZ-CG 4.21Å; F86-Q90 WeakPolarHBondContact O-CG 3.48Å; F86-Q90 PolarHBondContact O-N 3.39Å |
| 87 | A | 94.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 76.8 Ų | 76.8 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61.6 | -43.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | D83 F84 E85 Q90 M91 A121 F122 | D83-A87 PolarHBondContact O-N 2.88Å; D83-A87 VanDerWaalsContact O-N 3.14Å; F84-A87 PolarHBondContact O-N 2.93Å; E85-A87 PolarHBondContact O-N 3.48Å; A87-Q90 WeakPolarHBondContact O-CB 3.35Å; A87-Q90 PolarHBondContact O-N 3.45Å; A87-M91 WeakPolarHBondContact O-CG 3.31Å; A87-M91 PolarHBondContact O-N 3.09Å; A87-A121 HydrophobicContact CB-CB 3.79Å; A87-F122 HydrophobicContact CB-CB 4.41Å |
| 88 | L | 95.4 | Very high | 91.9 | Very high | 104 Ų | 104 | 70.2 Ų | 70.2 | 55% | 0.545 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -67.3 | -40.4 | 178 | -71 | 172.1 | 0 | 0 | 0 | 111.6 | F84 E85 F86 Q90 M91 L92 | F84-L88 WeakPolarHBondContact O-CB 3.49Å; F84-L88 VanDerWaalsContact O-CG 3.22Å; F84-L88 WeakPolarHBondContact O-CG 3.24Å; F84-L88 PolarHBondContact O-N 2.91Å; E85-L88 PolarHBondContact O-N 2.75Å; F86-L88 PolarHBondContact O-N 3.33Å; L88-Q90 VanDerWaalsContact C-N 3.3Å; L88-Q90 PolarHBondContact O-N 3.15Å; L88-M91 PolarHBondContact O-N 3.07Å; L88-L92 PolarHBondContact O-N 2.95Å |
| 89 | W | 95.1 | Very high | 92.5 | Very high | 121 Ų | 121 | 75 Ų | 75 | 46% | 0.458 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -61 | -39.9 | 171.9 | -79.9 | 120 | 0 | 0 | 0 | 112.1 | E85 F86 L92 Y93 | E85-W89 PolarHBondContact O-N 2.97Å; F86-W89 PolarHBondContact O-N 2.95Å; W89-L92 HydrophobicContact CE3-CD2 3.83Å; W89-L92 HydrophobicContact CZ3-CD2 3.6Å; W89-L92 PolarHBondContact O-N 2.93Å; W89-Y93 HydrophobicContact CB-CE2 4.29Å; W89-Y93 HydrophobicContact CE3-CE2 4.49Å; W89-Y93 WeakPolarHBondContact O-CB 3.45Å; W89-Y93 WeakPolarHBondContact O-CD2 3.49Å; W89-Y93 VanDerWaalsContact O-CG 3.27Å; W89-Y93 PolarHBondContact O-N 3.24Å |
| 90 | Q | 94.8 | Very high | 93.2 | Very high | 2 Ų | 2 | 71.6 Ų | 71.6 | 1% | 0.009 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.5 | -46.2 | 174.7 | -75.6 | -173.2 | -22.3 | 0 | 0 | 111.8 | F86 A87 L88 Y93 L94 | F86-Q90 HydrophobicContact CD1-CG 4.45Å; F86-Q90 VanDerWaalsContact CE1-CD 3.45Å; F86-Q90 HydrophobicContact CE1-CG 4.2Å; F86-Q90 HydrophobicContact CE2-CG 4.46Å; F86-Q90 HydrophobicContact CZ-CG 4.21Å; F86-Q90 WeakPolarHBondContact O-CG 3.48Å; F86-Q90 PolarHBondContact O-N 3.39Å; A87-Q90 WeakPolarHBondContact O-CB 3.35Å; A87-Q90 PolarHBondContact O-N 3.45Å; L88-Q90 VanDerWaalsContact C-N 3.3Å; L88-Q90 PolarHBondContact O-N 3.15Å; Q90-Y93 CarbonylContact O-C 3.56Å; Q90-Y93 PolarHBondContact O-N 3.1Å; Q90-L94 WeakPolarHBondContact O-CG 3.43Å; Q90-L94 PolarHBondContact O-N 3.3Å |
| 91 | M | 96.4 | Very high | 93.9 | Very high | 9 Ų | 9 | 60.2 Ų | 60.2 | 4% | 0.044 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.5 | -46.3 | 176.5 | -75.2 | -175.2 | 159.4 | 0 | 0 | 112.2 | A87 L88 Y93 L94 M95 F122 A125 L126 F201 | A87-M91 WeakPolarHBondContact O-CG 3.31Å; A87-M91 PolarHBondContact O-N 3.09Å; L88-M91 PolarHBondContact O-N 3.07Å; M91-Y93 VanDerWaalsContact C-N 3.31Å; M91-Y93 PolarHBondContact O-N 3.25Å; M91-L94 WeakPolarHBondContact O-CB 3.46Å; M91-L94 PolarHBondContact O-N 3.29Å; M91-M95 PolarHBondContact O-N 3.01Å; M91-F122 HydrophobicContact CE-CD2 4Å; M91-F122 HydrophobicContact CE-CE2 3.85Å; M91-F122 HydrophobicContact CE-CG 4.44Å; M91-F122 HydrophobicContact CE-CZ 4.16Å; M91-F122 WeakPolarHBondContact CE-O 3.4Å; M91-F122 HydrophobicContact CG-CD2 4.03Å; M91-F122 HydrophobicContact CG-CE2 3.69Å; M91-A125 HydrophobicContact CE-CB 3.77Å; M91-A125 HydrophobicContact SD-CB 3.79Å; M91-L126 HydrophobicContact CE-CB 3.67Å; M91-L126 HydrophobicContact CE-CD1 4.28Å; M91-L126 VanDerWaalsContact CE-N 3.31Å; M91-F201 HydrophobicContact CB-CD1 4.23Å; M91-F201 HydrophobicContact CB-CE1 3.68Å; M91-F201 HydrophobicContact CB-CE2 4.26Å; M91-F201 HydrophobicContact CB-CZ 3.7Å; M91-F201 HydrophobicContact CE-CD2 4.04Å; M91-F201 HydrophobicContact CE-CE2 4.14Å; M91-F201 HydrophobicContact CG-CD1 4.43Å; M91-F201 HydrophobicContact CG-CD2 4.35Å; M91-F201 HydrophobicContact CG-CE1 4.25Å; M91-F201 HydrophobicContact CG-CE2 4.15Å; M91-F201 HydrophobicContact CG-CG 4.48Å; M91-F201 HydrophobicContact CG-CZ 4.1Å; M91-F201 VanDerWaalsContact O-CE1 3.26Å; M91-F201 WeakPolarHBondContact O-CE1 3.41Å; M91-F201 HydrophobicContact SD-CD2 4.24Å; M91-F201 HydrophobicContact SD-CE2 3.8Å; M91-F201 HydrophobicContact SD-CZ 4.13Å |
| 92 | L | 96.3 | Very high | 94.5 | Very high | 87 Ų | 87 | 54.9 Ų | 54.9 | 46% | 0.455 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -61.2 | -41.5 | 174.9 | -178.4 | 63.2 | 0 | 0 | 0 | 111.6 | L88 W89 L94 M95 V96 | L88-L92 PolarHBondContact O-N 2.95Å; W89-L92 HydrophobicContact CE3-CD2 3.83Å; W89-L92 HydrophobicContact CZ3-CD2 3.6Å; W89-L92 PolarHBondContact O-N 2.93Å; L92-L94 VanDerWaalsContact C-N 3.34Å; L92-L94 PolarHBondContact O-N 2.81Å; L92-M95 WeakPolarHBondContact O-CB 2.97Å; L92-M95 PolarHBondContact O-N 3.26Å; L92-M95 VanDerWaalsContact O-N 3.15Å; L92-V96 HydrophobicContact CD1-CG2 4.1Å; L92-V96 PolarHBondContact O-N 2.99Å |
| 93 | Y | 97.3 | Very high | 94.7 | Very high | 67 Ų | 67 | 59.4 Ų | 59.4 | 26% | 0.263 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -69.4 | -28.5 | 176.7 | -70.9 | -38.5 | 0 | 0 | 0 | 113.3 | W89 Q90 M91 M95 V96 A97 P98 K100 V101 | W89-Y93 HydrophobicContact CB-CE2 4.29Å; W89-Y93 HydrophobicContact CE3-CE2 4.49Å; W89-Y93 WeakPolarHBondContact O-CB 3.45Å; W89-Y93 WeakPolarHBondContact O-CD2 3.49Å; W89-Y93 VanDerWaalsContact O-CG 3.27Å; W89-Y93 PolarHBondContact O-N 3.24Å; Q90-Y93 CarbonylContact O-C 3.56Å; Q90-Y93 PolarHBondContact O-N 3.1Å; M91-Y93 VanDerWaalsContact C-N 3.31Å; M91-Y93 PolarHBondContact O-N 3.25Å; Y93-M95 PolarHBondContact O-N 3.48Å; Y93-V96 PolarHBondContact O-N 3.23Å; Y93-A97 CarbonylContact O-C 2.89Å; Y93-A97 WeakPolarHBondContact O-CA 3.47Å; Y93-A97 PolarHBondContact O-N 3.43Å; Y93-P98 VanDerWaalsContact O-CA 3.26Å; Y93-P98 WeakPolarHBondContact O-CA 3.32Å; Y93-P98 WeakPolarHBondContact O-CD 3.39Å; Y93-K100 HydrophobicContact CD1-CD 4.02Å; Y93-K100 HydrophobicContact CE1-CD 3.9Å; Y93-K100 HydrophobicContact CG-CB 4.47Å; Y93-K100 HydrophobicContact CG-CD 4.47Å; Y93-V101 VanDerWaalsContact CB-CG2 3.47Å |
| 94 | L | 96.7 | Very high | 94.7 | Very high | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.8 | -32.3 | 170.9 | -71.6 | 169.5 | 0 | 0 | 0 | 111.6 | Q90 M91 L92 V101 F122 N198 F201 P202 I243 | Q90-L94 WeakPolarHBondContact O-CG 3.43Å; Q90-L94 PolarHBondContact O-N 3.3Å; M91-L94 WeakPolarHBondContact O-CB 3.46Å; M91-L94 PolarHBondContact O-N 3.29Å; L92-L94 VanDerWaalsContact C-N 3.34Å; L92-L94 PolarHBondContact O-N 2.81Å; L94-V101 HydrophobicContact CD2-CB 4.41Å; L94-V101 HydrophobicContact CD2-CG1 4.3Å; L94-V101 HydrophobicContact CD2-CG2 4.22Å; L94-V101 HydrophobicContact CG-CG2 4.25Å; L94-F122 HydrophobicContact CD1-CE2 3.85Å; L94-F122 HydrophobicContact CD1-CZ 4.02Å; L94-N198 HydrophobicContact CD1-CB 4.17Å; L94-N198 HydrophobicContact CD2-CB 3.93Å; L94-F201 HydrophobicContact CB-CD1 4.27Å; L94-F201 HydrophobicContact CD1-CB 4.3Å; L94-F201 HydrophobicContact CD1-CD1 4.35Å; L94-P202 HydrophobicContact CB-CG 4.31Å; L94-I243 HydrophobicContact CD2-CD1 4.26Å; L94-I243 HydrophobicContact CD2-CG2 4.41Å |
| 95 | M | 96.3 | Very high | 94.5 | Very high | 40 Ų | 40 | 55.3 Ų | 55.3 | 20% | 0.197 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -79 | -48 | 175.6 | -61.1 | -61.4 | -64.7 | 0 | 0 | 112.7 | M91 L92 Y93 F201 P202 V205 F206 Y239 | M91-M95 PolarHBondContact O-N 3.01Å; L92-M95 WeakPolarHBondContact O-CB 2.97Å; L92-M95 PolarHBondContact O-N 3.26Å; L92-M95 VanDerWaalsContact O-N 3.15Å; Y93-M95 PolarHBondContact O-N 3.48Å; M95-F201 HydrophobicContact CG-CD1 4.34Å; M95-F201 HydrophobicContact CG-CE1 3.81Å; M95-F201 HydrophobicContact SD-CD1 4.28Å; M95-F201 HydrophobicContact SD-CE1 4.15Å; M95-P202 VanDerWaalsContact SD-CA 3.55Å; M95-P202 HydrophobicContact SD-CB 3.8Å; M95-P202 HydrophobicContact SD-CG 3.99Å; M95-V205 HydrophobicContact CE-CB 3.75Å; M95-V205 HydrophobicContact CE-CG1 3.56Å; M95-V205 HydrophobicContact CE-CG2 4.17Å; M95-V205 HydrophobicContact SD-CB 4.03Å; M95-V205 HydrophobicContact SD-CG1 4.4Å; M95-V205 HydrophobicContact SD-CG2 3.91Å; M95-F206 HydrophobicContact CE-CE2 4.01Å; M95-F206 HydrophobicContact CE-CZ 4.27Å; M95-Y239 PolarHBondContact O-OH 2.69Å |
| 96 | V | 95.4 | Very high | 94.3 | Very high | 108 Ų | 108 | 53.5 Ų | 53.5 | 66% | 0.655 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -95.9 | -37.7 | -167.3 | 179.9 | 0 | 0 | 0 | 0 | 113 | L92 Y93 | L92-V96 HydrophobicContact CD1-CG2 4.1Å; L92-V96 PolarHBondContact O-N 2.99Å; Y93-V96 PolarHBondContact O-N 3.23Å |
| 97 | A | 95.5 | Very high | 94.1 | Very high | 24 Ų | 24 | 57.6 Ų | 57.6 | 20% | 0.198 | 26% | 0.263 | C | S | . | . | trans | -155.3 | 66.9 | -171 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y93 R99 K100 | Y93-A97 CarbonylContact O-C 2.89Å; Y93-A97 WeakPolarHBondContact O-CA 3.47Å; Y93-A97 PolarHBondContact O-N 3.43Å; A97-R99 PolarHBondContact O-N 3.39Å; A97-R99 VanDerWaalsContact O-N 3.07Å; A97-K100 HydrophobicContact CB-CD 3.93Å; A97-K100 HydrophobicContact CB-CG 4.06Å; A97-K100 WeakPolarHBondContact O-CB 3.16Å; A97-K100 PolarHBondContact O-N 2.95Å | ||
| 98 | P | 96.1 | Very high | 93.7 | Very high | 9 Ų | 9 | 60 Ų | 60 | 6% | 0.058 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.9 | -22.3 | -169.2 | 23.6 | -35.7 | 0 | 0 | 0 | 114 | Y93 K100 V101 Y102 Y242 I243 L246 | Y93-P98 VanDerWaalsContact O-CA 3.26Å; Y93-P98 WeakPolarHBondContact O-CA 3.32Å; Y93-P98 WeakPolarHBondContact O-CD 3.39Å; P98-K100 PolarHBondContact O-N 3.23Å; P98-V101 WeakPolarHBondContact O-CB 3.47Å; P98-V101 PolarHBondContact O-N 3.28Å; P98-V101 VanDerWaalsContact O-N 3.08Å; P98-Y102 PolarHBondContact O-N 3.26Å; P98-Y242 HydrophobicContact CG-CD1 4.17Å; P98-Y242 HydrophobicContact CG-CE1 3.8Å; P98-I243 HydrophobicContact CB-CD1 3.06Å; P98-I243 HydrophobicContact CG-CD1 3.56Å; P98-L246 HydrophobicContact CB-CD1 3.91Å; P98-L246 HydrophobicContact CG-CD1 3.88Å |
| 99 | R | 95.6 | Very high | 93.3 | Very high | 174 Ų | 174 | 56.6 Ų | 56.6 | 66% | 0.657 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -55.4 | -33.7 | 171 | -61.5 | -175.3 | -172.7 | -166.9 | -1.4 | 112.3 | A97 R103 Y242 L246 | A97-R99 PolarHBondContact O-N 3.39Å; A97-R99 VanDerWaalsContact O-N 3.07Å; R99-R103 WeakPolarHBondContact O-CB 2.88Å; R99-R103 PolarHBondContact O-N 3.05Å; R99-Y242 PolarHBondContact NE-OH 2.76Å; R99-Y242 PolarHBondContact NH2-OH 2.77Å; R99-L246 HydrophobicContact CG-CD1 3.97Å; R99-L246 HydrophobicContact CG-CD2 4.11Å |
| 100 | K | 94.3 | Very high | 93 | Very high | 82 Ų | 82 | 61.1 Ų | 61.1 | 36% | 0.357 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -66.1 | -41.1 | 177.6 | -65.4 | -175.4 | 179.4 | 178.1 | 0 | 111.2 | Y93 A97 P98 R103 N104 | Y93-K100 HydrophobicContact CD1-CD 4.02Å; Y93-K100 HydrophobicContact CE1-CD 3.9Å; Y93-K100 HydrophobicContact CG-CB 4.47Å; Y93-K100 HydrophobicContact CG-CD 4.47Å; A97-K100 HydrophobicContact CB-CD 3.93Å; A97-K100 HydrophobicContact CB-CG 4.06Å; A97-K100 WeakPolarHBondContact O-CB 3.16Å; A97-K100 PolarHBondContact O-N 2.95Å; P98-K100 PolarHBondContact O-N 3.23Å; K100-R103 PolarHBondContact O-N 2.85Å; K100-N104 PolarHBondContact O-N 2.86Å; K100-N104 VanDerWaalsContact O-N 3.13Å; K100-N104 PolarHBondContact O-OD1 3.12Å |
| 101 | V | 93.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 66.4 Ų | 66.4 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.2 | -52.1 | 178.1 | -178.2 | 0 | 0 | 0 | 0 | 109.6 | Y93 L94 P98 R103 N104 F105 | Y93-V101 VanDerWaalsContact CB-CG2 3.47Å; L94-V101 HydrophobicContact CD2-CB 4.41Å; L94-V101 HydrophobicContact CD2-CG1 4.3Å; L94-V101 HydrophobicContact CD2-CG2 4.22Å; L94-V101 HydrophobicContact CG-CG2 4.25Å; P98-V101 WeakPolarHBondContact O-CB 3.47Å; P98-V101 PolarHBondContact O-N 3.28Å; P98-V101 VanDerWaalsContact O-N 3.08Å; V101-R103 VanDerWaalsContact C-N 3.34Å; V101-R103 PolarHBondContact O-N 3.42Å; V101-N104 WeakPolarHBondContact O-CA 3.47Å; V101-N104 WeakPolarHBondContact O-CB 3.19Å; V101-N104 PolarHBondContact O-N 2.98Å; V101-F105 HydrophobicContact CG1-CD2 4.27Å; V101-F105 HydrophobicContact CG1-CE2 3.8Å; V101-F105 VanDerWaalsContact O-CD2 3.3Å; V101-F105 WeakPolarHBondContact O-CD2 3.26Å; V101-F105 PolarHBondContact O-N 3.41Å |
| 102 | Y | 93.5 | Very high | 92.1 | Very high | 7 Ų | 7 | 72.9 Ų | 72.9 | 3% | 0.027 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -70.4 | -27 | -178.4 | -74.2 | -68 | 0 | 0 | 0 | 114.4 | P98 N104 F105 M106 V195 I243 L246 G247 A250 | P98-Y102 PolarHBondContact O-N 3.26Å; Y102-N104 VanDerWaalsContact C-N 3.29Å; Y102-N104 PolarHBondContact O-N 3Å; Y102-F105 HydrophobicContact CD1-CD2 4.39Å; Y102-F105 HydrophobicContact CD1-CG 4.37Å; Y102-F105 WeakPolarHBondContact O-CB 3.42Å; Y102-F105 PolarHBondContact O-N 2.89Å; Y102-M106 PolarHBondContact O-N 3.47Å; Y102-V195 HydrophobicContact CE1-CG2 4.47Å; Y102-I243 HydrophobicContact CE2-CG2 3.93Å; Y102-I243 WeakPolarHBondContact CE2-O 3.29Å; Y102-I243 WeakPolarHBondContact OH-CG2 3.5Å; Y102-I243 PolarHBondContact OH-O 3.27Å; Y102-L246 HydrophobicContact CD2-CB 3.49Å; Y102-L246 VanDerWaalsContact CD2-CB 3.49Å; Y102-L246 HydrophobicContact CD2-CD1 4.34Å; Y102-L246 HydrophobicContact CE2-CB 3.76Å; Y102-L246 HydrophobicContact CG-CB 4.25Å; Y102-G247 VanDerWaalsContact CZ-CA 3.41Å; Y102-A250 HydrophobicContact CD1-CB 4.46Å |
| 103 | R | 92.2 | Very high | 91.5 | Very high | 113 Ų | 113 | 74.3 Ų | 74.3 | 43% | 0.426 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.2 | -39.9 | 167.5 | -172.8 | 178.3 | 60.9 | -134.6 | 2.4 | 111.5 | R99 K100 V101 F105 M106 Y107 | R99-R103 WeakPolarHBondContact O-CB 2.88Å; R99-R103 PolarHBondContact O-N 3.05Å; K100-R103 PolarHBondContact O-N 2.85Å; V101-R103 VanDerWaalsContact C-N 3.34Å; V101-R103 PolarHBondContact O-N 3.42Å; R103-F105 VanDerWaalsContact C-N 3.28Å; R103-F105 PolarHBondContact O-N 3.15Å; R103-M106 WeakPolarHBondContact O-CB 3.4Å; R103-M106 PolarHBondContact O-N 2.88Å; R103-M106 VanDerWaalsContact O-N 3.17Å; R103-Y107 HydrophobicContact CG-CD2 4.27Å; R103-Y107 HydrophobicContact CG-CE2 3.63Å; R103-Y107 WeakPolarHBondContact O-CD2 3.2Å; R103-Y107 PolarHBondContact O-N 3.27Å; R103-Y107 VanDerWaalsContact O-N 3.16Å |
| 104 | N | 90.3 | Very high | 90.8 | Very high | 38 Ų | 38 | 74 Ų | 74 | 20% | 0.203 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.3 | -31.3 | 175.3 | -66 | -5.8 | 0 | 0 | 0 | 112.3 | K100 V101 Y102 Y107 R108 | K100-N104 PolarHBondContact O-N 2.86Å; K100-N104 VanDerWaalsContact O-N 3.13Å; K100-N104 PolarHBondContact O-OD1 3.12Å; V101-N104 WeakPolarHBondContact O-CA 3.47Å; V101-N104 WeakPolarHBondContact O-CB 3.19Å; V101-N104 PolarHBondContact O-N 2.98Å; Y102-N104 VanDerWaalsContact C-N 3.29Å; Y102-N104 PolarHBondContact O-N 3Å; N104-Y107 PolarHBondContact O-N 2.88Å; N104-R108 WeakPolarHBondContact O-CG 3.42Å; N104-R108 PolarHBondContact O-N 3.39Å |
| 105 | F | 89 | Confident | 90 | Very high | 3 Ų | 3 | 74.8 Ų | 74.8 | 1% | 0.013 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 171.5 | -82 | -119.1 | 0 | 0 | 0 | 111.7 | V101 Y102 R103 Y107 R108 K109 Y191 D194 | V101-F105 HydrophobicContact CG1-CD2 4.27Å; V101-F105 HydrophobicContact CG1-CE2 3.8Å; V101-F105 VanDerWaalsContact O-CD2 3.3Å; V101-F105 WeakPolarHBondContact O-CD2 3.26Å; V101-F105 PolarHBondContact O-N 3.41Å; Y102-F105 HydrophobicContact CD1-CD2 4.39Å; Y102-F105 HydrophobicContact CD1-CG 4.37Å; Y102-F105 WeakPolarHBondContact O-CB 3.42Å; Y102-F105 PolarHBondContact O-N 2.89Å; R103-F105 VanDerWaalsContact C-N 3.28Å; R103-F105 PolarHBondContact O-N 3.15Å; F105-Y107 VanDerWaalsContact C-N 3.28Å; F105-Y107 PolarHBondContact O-N 3.1Å; F105-R108 VanDerWaalsContact CZ-NH2 3.34Å; F105-R108 PolarHBondContact O-N 2.86Å; F105-K109 PolarHBondContact O-N 2.62Å; F105-Y191 HydrophobicContact CD1-CE2 4.02Å; F105-Y191 HydrophobicContact CE1-CE2 4.15Å; F105-D194 VanDerWaalsContact CE1-OD2 3.28Å; F105-D194 WeakPolarHBondContact CE1-OD2 3.35Å; F105-D194 VanDerWaalsContact CZ-OD2 3.29Å; F105-D194 WeakPolarHBondContact CZ-OD2 3.23Å |
| 106 | M | 88.9 | Confident | 89.2 | Confident | 86 Ų | 86 | 73.8 Ų | 73.8 | 42% | 0.424 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.2 | -37.8 | 176.6 | -59.5 | 179.1 | 92.3 | 0 | 0 | 111.9 | Y102 R103 R110 A250 | Y102-M106 PolarHBondContact O-N 3.47Å; R103-M106 WeakPolarHBondContact O-CB 3.4Å; R103-M106 PolarHBondContact O-N 2.88Å; R103-M106 VanDerWaalsContact O-N 3.17Å; M106-R110 PolarHBondContact O-N 3.42Å; M106-A250 HydrophobicContact CG-CB 4.17Å |
| 107 | Y | 88.8 | Confident | 88.5 | Confident | 135 Ų | 135 | 69.6 Ų | 69.6 | 53% | 0.529 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -67.7 | -42.5 | 174 | -66.7 | -50.6 | 0 | 0 | 0 | 112.6 | R103 N104 F105 K109 R110 T111 | R103-Y107 HydrophobicContact CG-CD2 4.27Å; R103-Y107 HydrophobicContact CG-CE2 3.63Å; R103-Y107 WeakPolarHBondContact O-CD2 3.2Å; R103-Y107 PolarHBondContact O-N 3.27Å; R103-Y107 VanDerWaalsContact O-N 3.16Å; N104-Y107 PolarHBondContact O-N 2.88Å; F105-Y107 VanDerWaalsContact C-N 3.28Å; F105-Y107 PolarHBondContact O-N 3.1Å; Y107-K109 VanDerWaalsContact C-N 3.3Å; Y107-K109 PolarHBondContact O-N 3.24Å; Y107-R110 PolarHBondContact O-N 2.88Å; Y107-R110 VanDerWaalsContact O-N 3.1Å; Y107-T111 PolarHBondContact O-N 3.33Å; Y107-T111 PolarHBondContact O-OG1 3.4Å |
| 108 | R | 86 | Confident | 87.6 | Confident | 50 Ų | 50 | 72 Ų | 72 | 19% | 0.189 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -62.6 | -36.1 | 176.1 | -73.3 | -171.9 | -68.8 | -168 | 3.9 | 112.5 | N104 F105 R110 T111 K112 | N104-R108 WeakPolarHBondContact O-CG 3.42Å; N104-R108 PolarHBondContact O-N 3.39Å; F105-R108 VanDerWaalsContact CZ-NH2 3.34Å; F105-R108 PolarHBondContact O-N 2.86Å; R108-R110 VanDerWaalsContact C-N 3.27Å; R108-R110 PolarHBondContact O-N 3.4Å; R108-T111 PolarHBondContact O-N 3.41Å; R108-T111 PolarHBondContact O-OG1 3.21Å; R108-K112 PolarHBondContact O-N 2.84Å |
| 109 | K | 87.3 | Confident | 86.9 | Confident | 34 Ų | 34 | 72.8 Ų | 72.8 | 15% | 0.148 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.2 | -37.9 | 173.6 | -179.3 | 60.7 | 176.4 | 164 | 0 | 111.6 | F105 Y107 T111 D113 W115 | F105-K109 PolarHBondContact O-N 2.62Å; Y107-K109 VanDerWaalsContact C-N 3.3Å; Y107-K109 PolarHBondContact O-N 3.24Å; K109-T111 VanDerWaalsContact C-N 3.32Å; K109-T111 PolarHBondContact O-N 3.26Å; K109-D113 WeakPolarHBondContact CE-OD1 3.29Å; K109-D113 PolarHBondContact NZ-O 2.87Å; K109-D113 IonicContact NZ-OD1 3.46Å; K109-D113 PolarHBondContact NZ-OD1 3.23Å; K109-D113 WeakPolarHBondContact O-CA 3.29Å; K109-D113 PolarHBondContact O-N 3.5Å; K109-W115 HydrophobicContact CB-CD2 4.38Å; K109-W115 HydrophobicContact CB-CE3 4.15Å; K109-W115 HydrophobicContact CB-CH2 4.1Å; K109-W115 HydrophobicContact CB-CZ2 4.33Å; K109-W115 HydrophobicContact CB-CZ3 4Å; K109-W115 HydrophobicContact CD-CD2 3.99Å; K109-W115 HydrophobicContact CD-CG 4.26Å; K109-W115 HydrophobicContact CD-CZ2 4.1Å; K109-W115 HydrophobicContact CG-CD2 4.15Å; K109-W115 HydrophobicContact CG-CE3 4.36Å; K109-W115 HydrophobicContact CG-CH2 3.91Å; K109-W115 HydrophobicContact CG-CZ2 3.67Å; K109-W115 HydrophobicContact CG-CZ3 4.25Å |
| 110 | R | 88.2 | Confident | 86.5 | Confident | 215 Ų | 215 | 65.1 Ų | 65.1 | 81% | 0.811 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -69.6 | -25.8 | 177.8 | -64.8 | -175.6 | -172.7 | -139.5 | 1.8 | 113.8 | M106 Y107 R108 | M106-R110 PolarHBondContact O-N 3.42Å; Y107-R110 PolarHBondContact O-N 2.88Å; Y107-R110 VanDerWaalsContact O-N 3.1Å; R108-R110 VanDerWaalsContact C-N 3.27Å; R108-R110 PolarHBondContact O-N 3.4Å |
| 111 | T | 87.9 | Confident | 86.5 | Confident | 113 Ų | 113 | 61.2 Ų | 61.2 | 69% | 0.693 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -104.2 | -29.5 | -174.8 | 55.5 | 0 | 0 | 0 | 0 | 114.4 | Y107 R108 K109 | Y107-T111 PolarHBondContact O-N 3.33Å; Y107-T111 PolarHBondContact O-OG1 3.4Å; R108-T111 PolarHBondContact O-N 3.41Å; R108-T111 PolarHBondContact O-OG1 3.21Å; K109-T111 VanDerWaalsContact C-N 3.32Å; K109-T111 PolarHBondContact O-N 3.26Å |
| 112 | K | 84 | Confident | 86.5 | Confident | 146 Ų | 146 | 61.4 Ų | 61.4 | 64% | 0.635 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -120.9 | -2.5 | -176.8 | -63.6 | -174.3 | 177.8 | -177.5 | 0 | 114 | R108 Q114 | R108-K112 PolarHBondContact O-N 2.84Å; K112-Q114 HydrophobicContact CB-CG 4.15Å; K112-Q114 PolarHBondContact O-N 2.9Å; K112-Q114 VanDerWaalsContact O-N 3.09Å |
| 113 | D | 83.6 | Confident | 86.4 | Confident | 117 Ų | 117 | 63.5 Ų | 63.5 | 63% | 0.626 | 29% | 0.294 | S | S | * | . | trans | 54.1 | 24.9 | 179.6 | -158.4 | 33 | 0 | 0 | 0 | 116.4 | K109 | K109-D113 WeakPolarHBondContact CE-OD1 3.29Å; K109-D113 PolarHBondContact NZ-O 2.87Å; K109-D113 IonicContact NZ-OD1 3.46Å; K109-D113 PolarHBondContact NZ-OD1 3.23Å; K109-D113 WeakPolarHBondContact O-CA 3.29Å; K109-D113 PolarHBondContact O-N 3.5Å | ||
| 114 | Q | 82.8 | Confident | 86.5 | Confident | 60 Ų | 60 | 60 Ų | 60 | 28% | 0.28 | 29% | 0.285 | S | S | . | . | trans | -130 | 145.9 | 177.4 | 61.1 | -177.9 | -4 | 0 | 0 | 112.6 | K112 D118 | K112-Q114 HydrophobicContact CB-CG 4.15Å; K112-Q114 PolarHBondContact O-N 2.9Å; K112-Q114 VanDerWaalsContact O-N 3.09Å; Q114-D118 VanDerWaalsContact CD-OD2 3.29Å; Q114-D118 PolarHBondContact NE2-OD2 3.07Å; Q114-D118 PolarHBondContact OE1-OD2 3.37Å | ||
| 115 | W | 80.4 | Confident | 86.7 | Confident | 17 Ų | 17 | 58.7 Ų | 58.7 | 6% | 0.064 | 28% | 0.28 | C | S | . | . | trans | -94 | -40.6 | 178.1 | -67.8 | 111.3 | 0 | 0 | 0 | 112.3 | K109 Q185 Y191 A250 L251 F253 | K109-W115 HydrophobicContact CB-CD2 4.38Å; K109-W115 HydrophobicContact CB-CE3 4.15Å; K109-W115 HydrophobicContact CB-CH2 4.1Å; K109-W115 HydrophobicContact CB-CZ2 4.33Å; K109-W115 HydrophobicContact CB-CZ3 4Å; K109-W115 HydrophobicContact CD-CD2 3.99Å; K109-W115 HydrophobicContact CD-CG 4.26Å; K109-W115 HydrophobicContact CD-CZ2 4.1Å; K109-W115 HydrophobicContact CG-CD2 4.15Å; K109-W115 HydrophobicContact CG-CE3 4.36Å; K109-W115 HydrophobicContact CG-CH2 3.91Å; K109-W115 HydrophobicContact CG-CZ2 3.67Å; K109-W115 HydrophobicContact CG-CZ3 4.25Å; W115-Q185 VanDerWaalsContact NE1-NE2 3.13Å; W115-Y191 HydrophobicContact CB-CD2 3.63Å; W115-Y191 HydrophobicContact CB-CE2 4.09Å; W115-Y191 HydrophobicContact CB-CG 4.16Å; W115-Y191 WeakPolarHBondContact O-CD2 3.36Å; W115-A250 VanDerWaalsContact CH2-O 3.24Å; W115-A250 WeakPolarHBondContact CH2-O 3.24Å; W115-L251 HydrophobicContact CD2-CD2 4.42Å; W115-L251 HydrophobicContact CG-CD2 4.43Å; W115-F253 HydrophobicContact CZ2-CE1 4.47Å; W115-F253 AromaticContact NE1-CE1 3.66Å | ||
| 116 | A | 79 | Confident | 87.1 | Confident | 19 Ų | 19 | 58.6 Ų | 58.6 | 16% | 0.157 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -62.5 | 143.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | D118 | A116-D118 PolarHBondContact O-N 3.41Š|
| 117 | R | 81.5 | Confident | 87.3 | Confident | 19 Ų | 19 | 57.6 Ų | 57.6 | 7% | 0.072 | 28% | 0.281 | C | S | . | . | trans | -80.5 | 117.3 | 178.7 | -179.1 | -178.6 | -67.1 | 160.1 | -25.5 | 110.5 | D119 D194 N198 | R117-D119 VanDerWaalsContact C-N 3.32Å; R117-D119 HydrophobicContact CG-CB 3.77Å; R117-D119 PolarHBondContact O-N 3.16Å; R117-D194 HydrophobicContact CB-CB 4.45Å; R117-D194 VanDerWaalsContact CB-CG 3.47Å; R117-D194 WeakPolarHBondContact CB-OD2 3.2Å; R117-D194 IonicContact CZ-OD1 3.81Å; R117-D194 IonicContact CZ-OD2 3.39Å; R117-D194 IonicContact NE-OD1 2.65Å; R117-D194 IonicContact NE-OD2 3.55Å; R117-D194 IonicContact NH1-OD1 3.61Å; R117-D194 PolarHBondContact NH1-OD1 2.81Å; R117-D194 IonicContact NH1-OD2 2.75Å; R117-N198 VanDerWaalsContact NH1-CG 3.33Å; R117-N198 PolarHBondContact NH1-ND2 3.47Å; R117-N198 PolarHBondContact NH1-OD1 3.07Å; R117-N198 PolarHBondContact NH2-OD1 2.77Å | ||
| 118 | D | 76.1 | Confident | 87.7 | Confident | 75 Ų | 75 | 53.9 Ų | 53.9 | 40% | 0.401 | 28% | 0.278 | S | S | . | . | trans | -92.1 | 23 | 174.1 | -88.2 | -6.5 | 0 | 0 | 0 | 113.7 | Q114 A116 P120 | Q114-D118 VanDerWaalsContact CD-OD2 3.29Å; Q114-D118 PolarHBondContact NE2-OD2 3.07Å; Q114-D118 PolarHBondContact OE1-OD2 3.37Å; A116-D118 PolarHBondContact O-N 3.41Å; D118-P120 WeakPolarHBondContact O-CD 3.36Å | ||
| 119 | D | 81.5 | Confident | 88.3 | Confident | 25 Ų | 25 | 52.9 Ų | 52.9 | 13% | 0.134 | 28% | 0.28 | C | S | . | . | trans | -104.5 | 110.4 | -172.6 | -167.7 | -9.7 | 0 | 0 | 0 | 111.8 | R117 A121 | R117-D119 VanDerWaalsContact C-N 3.32Å; R117-D119 HydrophobicContact CG-CB 3.77Å; R117-D119 PolarHBondContact O-N 3.16Å; D119-A121 VanDerWaalsContact C-N 3.3Å; D119-A121 PolarHBondContact O-N 2.89Å; D119-A121 VanDerWaalsContact OD1-CB 3.3Å; D119-A121 WeakPolarHBondContact OD1-CB 3.49Å; D119-A121 PolarHBondContact OD1-N 2.96Å | ||
| 120 | P | 88.1 | Confident | 88.7 | Confident | 14 Ų | 14 | 51.6 Ų | 51.6 | 9% | 0.091 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -69.9 | -24 | 178.3 | 29.6 | -35.6 | 0 | 0 | 0 | 113.3 | R75 L76 M82 D118 F122 L123 V124 | R75-P120 HydrophobicContact CB-CG 4.47Å; L76-P120 HydrophobicContact CD2-CB 3.62Å; L76-P120 HydrophobicContact CG-CB 4.31Å; M82-P120 HydrophobicContact CE-CB 3.73Å; M82-P120 HydrophobicContact CE-CG 4.01Å; M82-P120 HydrophobicContact CG-CG 4.07Å; M82-P120 HydrophobicContact SD-CB 4.32Å; M82-P120 HydrophobicContact SD-CG 4.38Å; D118-P120 WeakPolarHBondContact O-CD 3.36Å; P120-F122 PolarHBondContact O-N 3.47Å; P120-L123 PolarHBondContact O-N 3.45Å; P120-V124 WeakPolarHBondContact O-CG2 3.28Å; P120-V124 PolarHBondContact O-N 2.9Å; P120-V124 VanDerWaalsContact O-N 3.1Å |
| 121 | A | 93.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -64.5 | -40.4 | -173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | M82 F84 A87 D119 L123 V124 A125 | M82-A121 HydrophobicContact CB-CB 3.95Å; F84-A121 HydrophobicContact CD1-CB 4.24Å; F84-A121 HydrophobicContact CE1-CB 4.37Å; A87-A121 HydrophobicContact CB-CB 3.79Å; D119-A121 VanDerWaalsContact C-N 3.3Å; D119-A121 PolarHBondContact O-N 2.89Å; D119-A121 VanDerWaalsContact OD1-CB 3.3Å; D119-A121 WeakPolarHBondContact OD1-CB 3.49Å; D119-A121 PolarHBondContact OD1-N 2.96Å; A121-L123 VanDerWaalsContact C-N 3.34Å; A121-L123 PolarHBondContact O-N 3.43Å; A121-V124 PolarHBondContact O-N 3.27Å; A121-A125 WeakPolarHBondContact O-CB 3.25Å; A121-A125 PolarHBondContact O-N 3.44Å |
| 122 | F | 93.6 | Very high | 89.7 | Confident | 3 Ų | 3 | 46.2 Ų | 46.2 | 1% | 0.013 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 176.6 | -179.2 | -89.6 | 0 | 0 | 0 | 111.9 | A87 M91 L94 P120 A125 L126 L197 | A87-F122 HydrophobicContact CB-CB 4.41Å; M91-F122 HydrophobicContact CE-CD2 4Å; M91-F122 HydrophobicContact CE-CE2 3.85Å; M91-F122 HydrophobicContact CE-CG 4.44Å; M91-F122 HydrophobicContact CE-CZ 4.16Å; M91-F122 WeakPolarHBondContact CE-O 3.4Å; M91-F122 HydrophobicContact CG-CD2 4.03Å; M91-F122 HydrophobicContact CG-CE2 3.69Å; L94-F122 HydrophobicContact CD1-CE2 3.85Å; L94-F122 HydrophobicContact CD1-CZ 4.02Å; P120-F122 PolarHBondContact O-N 3.47Å; F122-A125 PolarHBondContact O-N 3.24Å; F122-L126 HydrophobicContact CE1-CD2 4.16Å; F122-L126 VanDerWaalsContact O-CB 3.29Å; F122-L126 WeakPolarHBondContact O-CB 3.23Å; F122-L126 PolarHBondContact O-N 3.47Å; F122-L197 HydrophobicContact CE1-CB 4.16Å |
| 123 | L | 93 | Very high | 90.3 | Very high | 51 Ų | 51 | 39.3 Ų | 39.3 | 27% | 0.267 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -68.8 | -39.9 | -179 | -167.3 | 67.7 | 0 | 0 | 0 | 111.4 | Y72 L76 P120 A121 L126 S127 L197 | Y72-L123 HydrophobicContact CE1-CD2 4.17Å; L76-L123 HydrophobicContact CD1-CD2 4.01Å; L76-L123 HydrophobicContact CD2-CB 4.17Å; L76-L123 HydrophobicContact CD2-CD2 3.87Å; L76-L123 HydrophobicContact CD2-CG 4.49Å; P120-L123 PolarHBondContact O-N 3.45Å; A121-L123 VanDerWaalsContact C-N 3.34Å; A121-L123 PolarHBondContact O-N 3.43Å; L123-L126 PolarHBondContact O-N 3.39Å; L123-S127 WeakPolarHBondContact O-CB 3.49Å; L123-S127 PolarHBondContact O-N 2.81Å; L123-L197 HydrophobicContact CD1-CD1 3.85Å |
| 124 | V | 93.3 | Very high | 91 | Very high | 40 Ų | 40 | 33.8 Ų | 33.8 | 24% | 0.242 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.9 | -46.8 | 174.4 | 175.1 | 0 | 0 | 0 | 0 | 110.6 | L76 M82 F84 P120 A121 L126 S127 A128 | L76-V124 HydrophobicContact CD2-CG2 4.24Å; M82-V124 HydrophobicContact CE-CG2 3.99Å; M82-V124 HydrophobicContact SD-CB 4.42Å; M82-V124 HydrophobicContact SD-CG2 3.9Å; F84-V124 HydrophobicContact CE1-CB 4.04Å; F84-V124 HydrophobicContact CE1-CG1 3.82Å; F84-V124 HydrophobicContact CZ-CB 4.33Å; F84-V124 HydrophobicContact CZ-CG1 3.97Å; P120-V124 WeakPolarHBondContact O-CG2 3.28Å; P120-V124 PolarHBondContact O-N 2.9Å; P120-V124 VanDerWaalsContact O-N 3.1Å; A121-V124 PolarHBondContact O-N 3.27Å; V124-L126 VanDerWaalsContact C-N 3.28Å; V124-L126 PolarHBondContact O-N 3.21Å; V124-S127 PolarHBondContact O-N 3.45Å; V124-S127 PolarHBondContact O-OG 2.86Å; V124-A128 PolarHBondContact O-N 3.37Å |
| 125 | A | 95 | Very high | 91.6 | Very high | 11 Ų | 11 | 32.9 Ų | 32.9 | 9% | 0.091 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.7 | -38.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | M91 A121 F122 A128 A129 | M91-A125 HydrophobicContact CE-CB 3.77Å; M91-A125 HydrophobicContact SD-CB 3.79Å; A121-A125 WeakPolarHBondContact O-CB 3.25Å; A121-A125 PolarHBondContact O-N 3.44Å; F122-A125 PolarHBondContact O-N 3.24Å; A125-A128 PolarHBondContact O-N 3.05Å; A125-A129 PolarHBondContact O-N 3.35Å |
| 126 | L | 95.8 | Very high | 92.4 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.005 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -67.8 | -40 | 177.5 | -176.7 | 62.5 | 0 | 0 | 0 | 111 | M91 F122 L123 V124 A128 A129 L130 L197 F201 L204 | M91-L126 HydrophobicContact CE-CB 3.67Å; M91-L126 HydrophobicContact CE-CD1 4.28Å; M91-L126 VanDerWaalsContact CE-N 3.31Å; F122-L126 HydrophobicContact CE1-CD2 4.16Å; F122-L126 VanDerWaalsContact O-CB 3.29Å; F122-L126 WeakPolarHBondContact O-CB 3.23Å; F122-L126 PolarHBondContact O-N 3.47Å; L123-L126 PolarHBondContact O-N 3.39Å; V124-L126 VanDerWaalsContact C-N 3.28Å; V124-L126 PolarHBondContact O-N 3.21Å; L126-A128 VanDerWaalsContact C-N 3.33Å; L126-A128 PolarHBondContact O-N 2.86Å; L126-A129 PolarHBondContact O-N 3.48Å; L126-L130 HydrophobicContact CG-CD1 4.45Å; L126-L130 WeakPolarHBondContact O-CB 3.26Å; L126-L130 WeakPolarHBondContact O-CG 3.47Å; L126-L130 PolarHBondContact O-N 3.25Å; L126-L197 HydrophobicContact CD2-CB 4.2Å; L126-L197 HydrophobicContact CD2-CD2 3.95Å; L126-F201 HydrophobicContact CD1-CB 4.28Å; L126-F201 HydrophobicContact CD1-CD2 3.83Å; L126-L204 HydrophobicContact CD1-CD2 4.15Å |
| 127 | S | 95 | Very high | 93.1 | Very high | 65 Ų | 65 | 34.3 Ų | 34.3 | 46% | 0.455 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -63.5 | -38.4 | 175.3 | 75.9 | 0 | 0 | 0 | 0 | 112.3 | L123 V124 L130 F131 | L123-S127 WeakPolarHBondContact O-CB 3.49Å; L123-S127 PolarHBondContact O-N 2.81Å; V124-S127 PolarHBondContact O-N 3.45Å; V124-S127 PolarHBondContact O-OG 2.86Å; S127-L130 PolarHBondContact O-N 3.26Å; S127-F131 PolarHBondContact O-N 3.44Å |
| 128 | A | 96.1 | Very high | 93.7 | Very high | 57 Ų | 57 | 34 Ų | 34 | 47% | 0.471 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -66.5 | -42.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | V124 A125 L126 F131 L132 | V124-A128 PolarHBondContact O-N 3.37Å; A125-A128 PolarHBondContact O-N 3.05Å; L126-A128 VanDerWaalsContact C-N 3.33Å; L126-A128 PolarHBondContact O-N 2.86Å; A128-F131 PolarHBondContact O-N 3.33Å; A128-L132 WeakPolarHBondContact O-CB 3.36Å; A128-L132 PolarHBondContact O-N 3.38Å |
| 129 | A | 97.8 | Very high | 94.4 | Very high | 28 Ų | 28 | 37.6 Ų | 37.6 | 23% | 0.231 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -62.7 | -41.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | A125 L126 L132 S133 F201 L204 | A125-A129 PolarHBondContact O-N 3.35Å; L126-A129 PolarHBondContact O-N 3.48Å; A129-L132 PolarHBondContact O-N 3.1Å; A129-S133 VanDerWaalsContact O-CB 3.28Å; A129-S133 WeakPolarHBondContact O-CB 3.47Å; A129-S133 PolarHBondContact O-N 2.88Å; A129-S133 PolarHBondContact O-OG 2.92Å; A129-F201 HydrophobicContact CB-CE2 4.31Å; A129-L204 HydrophobicContact CB-CD2 3.92Å |
| 130 | L | 97.5 | Very high | 94.9 | Very high | 8 Ų | 8 | 37.4 Ų | 37.4 | 4% | 0.042 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -57.7 | -53.5 | 174.1 | -79.6 | 169 | 0 | 0 | 0 | 110.7 | L126 S127 L132 S133 S134 V155 C160 F200 L204 | L126-L130 HydrophobicContact CG-CD1 4.45Å; L126-L130 WeakPolarHBondContact O-CB 3.26Å; L126-L130 WeakPolarHBondContact O-CG 3.47Å; L126-L130 PolarHBondContact O-N 3.25Å; S127-L130 PolarHBondContact O-N 3.26Å; L130-L132 PolarHBondContact O-N 2.67Å; L130-S133 PolarHBondContact O-N 2.99Å; L130-S133 PolarHBondContact O-OG 3.5Å; L130-S134 PolarHBondContact O-N 3.01Å; L130-S134 PolarHBondContact O-OG 2.88Å; L130-S134 VanDerWaalsContact O-OG 3.05Å; L130-V155 HydrophobicContact CD2-CG1 3.58Å; L130-C160 HydrophobicContact CD1-CB 4.24Å; L130-F200 HydrophobicContact CD2-CE1 3.64Å; L130-F200 HydrophobicContact CD2-CZ 4.03Å; L130-F200 HydrophobicContact CG-CE1 4.45Å; L130-L204 HydrophobicContact CD2-CD1 3.49Å; L130-L204 VanDerWaalsContact CD2-CD1 3.49Å; L130-L204 HydrophobicContact CD2-CD2 4Å; L130-L204 HydrophobicContact CD2-CG 4.39Å; L130-L204 HydrophobicContact CG-CD1 4.5Å; L130-L204 HydrophobicContact CG-CD2 4.17Å |
| 131 | F | 98.2 | Very high | 95.1 | Very high | 100 Ų | 100 | 37.3 Ų | 37.3 | 44% | 0.439 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -55.6 | -48.5 | 178 | 176.8 | -96.2 | 0 | 0 | 0 | 112.2 | S127 A128 S133 S134 V135 F148 L152 | S127-F131 PolarHBondContact O-N 3.44Å; A128-F131 PolarHBondContact O-N 3.33Å; F131-S133 PolarHBondContact O-N 3.34Å; F131-S134 WeakPolarHBondContact O-CB 3.28Å; F131-S134 PolarHBondContact O-N 3.08Å; F131-S134 VanDerWaalsContact O-N 3.14Å; F131-V135 HydrophobicContact CD1-CG2 4.44Å; F131-V135 HydrophobicContact CE1-CG2 4.04Å; F131-V135 HydrophobicContact CZ-CG2 4.16Å; F131-V135 WeakPolarHBondContact O-CG2 3.38Å; F131-V135 PolarHBondContact O-N 2.82Å; F131-F148 HydrophobicContact CD2-CZ 4.21Å; F131-F148 HydrophobicContact CE2-CE1 4.29Å; F131-F148 AromaticContact CE2-CZ 3.68Å; F131-F148 HydrophobicContact CE2-CZ 3.68Å; F131-F148 HydrophobicContact CZ-CZ 4.28Å; F131-L152 HydrophobicContact CD2-CD1 4.26Å; F131-L152 HydrophobicContact CD2-CD2 4.04Å; F131-L152 HydrophobicContact CE2-CD2 4.42Å |
| 132 | L | 97.9 | Very high | 95 | Very high | 115 Ų | 115 | 48.5 Ų | 48.5 | 60% | 0.602 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -66.7 | -38.5 | -177.4 | -151 | 66.5 | 0 | 0 | 0 | 111.9 | A128 A129 L130 S134 V135 L136 | A128-L132 WeakPolarHBondContact O-CB 3.36Å; A128-L132 PolarHBondContact O-N 3.38Å; A129-L132 PolarHBondContact O-N 3.1Å; L130-L132 PolarHBondContact O-N 2.67Å; L132-S134 VanDerWaalsContact C-N 3.32Å; L132-V135 PolarHBondContact O-N 3.48Å; L132-L136 PolarHBondContact O-N 3.21Å; L132-L136 VanDerWaalsContact O-N 3.16Å |
| 133 | S | 97.7 | Very high | 94.8 | Very high | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.007 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.6 | -33.4 | 173 | 76.9 | 0 | 0 | 0 | 0 | 112.4 | A129 L130 F131 L136 Y137 L204 | A129-S133 VanDerWaalsContact O-CB 3.28Å; A129-S133 WeakPolarHBondContact O-CB 3.47Å; A129-S133 PolarHBondContact O-N 2.88Å; A129-S133 PolarHBondContact O-OG 2.92Å; L130-S133 PolarHBondContact O-N 2.99Å; L130-S133 PolarHBondContact O-OG 3.5Å; F131-S133 PolarHBondContact O-N 3.34Å; S133-L136 WeakPolarHBondContact O-CB 3.27Å; S133-L136 PolarHBondContact O-N 2.92Å; S133-Y137 PolarHBondContact O-N 3.03Å; S133-L204 WeakPolarHBondContact OG-CD1 3.27Å |
| 134 | S | 97 | Very high | 94.9 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -67.7 | -36.7 | 174.5 | -62.1 | 0 | 0 | 0 | 0 | 112.7 | L130 F131 L132 Y137 A138 | L130-S134 PolarHBondContact O-N 3.01Å; L130-S134 PolarHBondContact O-OG 2.88Å; L130-S134 VanDerWaalsContact O-OG 3.05Å; F131-S134 WeakPolarHBondContact O-CB 3.28Å; F131-S134 PolarHBondContact O-N 3.08Å; F131-S134 VanDerWaalsContact O-N 3.14Å; L132-S134 VanDerWaalsContact C-N 3.32Å; S134-Y137 PolarHBondContact O-N 2.96Å; S134-A138 WeakPolarHBondContact O-CB 3.43Å; S134-A138 PolarHBondContact O-N 2.82Å |
| 135 | V | 96.7 | Very high | 94.8 | Very high | 42 Ų | 42 | 51.4 Ų | 51.4 | 26% | 0.255 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.5 | -45.6 | 172 | 171.9 | 0 | 0 | 0 | 0 | 110.4 | F131 L132 Y137 A138 F139 F148 | F131-V135 HydrophobicContact CD1-CG2 4.44Å; F131-V135 HydrophobicContact CE1-CG2 4.04Å; F131-V135 HydrophobicContact CZ-CG2 4.16Å; F131-V135 WeakPolarHBondContact O-CG2 3.38Å; F131-V135 PolarHBondContact O-N 2.82Å; L132-V135 PolarHBondContact O-N 3.48Å; V135-Y137 PolarHBondContact O-N 3.32Å; V135-A138 PolarHBondContact O-N 3.04Å; V135-F139 HydrophobicContact CG1-CD2 3.76Å; V135-F139 HydrophobicContact CG1-CE2 3.39Å; V135-F139 HydrophobicContact CG1-CZ 4.5Å; V135-F139 WeakPolarHBondContact O-CD2 3.31Å; V135-F139 PolarHBondContact O-N 2.96Å; V135-F148 HydrophobicContact CG2-CE2 3.78Å; V135-F148 HydrophobicContact CG2-CZ 4.02Å |
| 136 | L | 95.5 | Very high | 94.7 | Very high | 62 Ų | 62 | 57.7 Ų | 57.7 | 33% | 0.325 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59.6 | -44.6 | 176.3 | -71.2 | 172.5 | 0 | 0 | 0 | 112.5 | L132 S133 F139 S140 V209 | L132-L136 PolarHBondContact O-N 3.21Å; L132-L136 VanDerWaalsContact O-N 3.16Å; S133-L136 WeakPolarHBondContact O-CB 3.27Å; S133-L136 PolarHBondContact O-N 2.92Å; L136-F139 PolarHBondContact O-N 3.37Å; L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 2.87Å; L136-V209 HydrophobicContact CD1-CB 4.41Å; L136-V209 HydrophobicContact CD1-CG1 3.91Å; L136-V209 HydrophobicContact CD1-CG2 4.41Å |
| 137 | Y | 93.9 | Very high | 94.6 | Very high | 3 Ų | 3 | 57.7 Ų | 57.7 | 1% | 0.012 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.3 | -39.7 | 176.6 | -113.4 | -65 | 0 | 0 | 0 | 112.5 | S133 S134 V135 F139 S140 L141 F151 L207 H208 P212 F286 Y289 | S133-Y137 PolarHBondContact O-N 3.03Å; S134-Y137 PolarHBondContact O-N 2.96Å; V135-Y137 PolarHBondContact O-N 3.32Å; Y137-F139 VanDerWaalsContact C-N 3.32Å; Y137-F139 PolarHBondContact O-N 2.67Å; Y137-S140 PolarHBondContact O-N 3.46Å; Y137-L141 HydrophobicContact CD1-CD1 3.94Å; Y137-L141 HydrophobicContact CD1-CG 4.18Å; Y137-L141 WeakPolarHBondContact O-CB 3.24Å; Y137-L141 WeakPolarHBondContact O-CG 3.47Å; Y137-L141 PolarHBondContact O-N 2.92Å; Y137-F151 VanDerWaalsContact CB-CE1 3.47Å; Y137-F151 HydrophobicContact CD1-CZ 4.26Å; Y137-F151 HydrophobicContact CD2-CE1 4.18Å; Y137-F151 AromaticContact CD2-CZ 3.76Å; Y137-F151 HydrophobicContact CD2-CZ 3.76Å; Y137-F151 HydrophobicContact CE2-CZ 4.43Å; Y137-F151 AromaticContact CG-CE1 3.97Å; Y137-F151 HydrophobicContact CG-CE1 3.97Å; Y137-F151 AromaticContact CG-CZ 3.65Å; Y137-F151 HydrophobicContact CG-CZ 3.65Å; Y137-L207 VanDerWaalsContact CE2-O 3.23Å; Y137-L207 WeakPolarHBondContact CE2-O 3.45Å; Y137-L207 PolarHBondContact OH-O 3.06Å; Y137-H208 HydrophobicContact CD2-CB 4.05Å; Y137-H208 AromaticContact CD2-CD2 3.96Å; Y137-H208 HydrophobicContact CE2-CB 3.97Å; Y137-H208 AromaticContact CE2-CD2 3.83Å; Y137-H208 AromaticContact CE2-CG 3.88Å; Y137-P212 HydrophobicContact CD1-CB 4.09Å; Y137-P212 HydrophobicContact CD2-CB 4.32Å; Y137-P212 HydrophobicContact CD2-CG 3.98Å; Y137-P212 HydrophobicContact CE1-CB 4.09Å; Y137-P212 HydrophobicContact CE2-CB 4.38Å; Y137-P212 HydrophobicContact CE2-CG 4.01Å; Y137-P212 HydrophobicContact CG-CB 4.18Å; Y137-P212 HydrophobicContact CG-CG 4.31Å; Y137-F286 HydrophobicContact CE1-CE1 4.31Å; Y137-F286 AromaticContact CE1-CE2 3.87Å; Y137-F286 HydrophobicContact CE1-CE2 3.87Å; Y137-F286 AromaticContact CE1-CZ 3.74Å; Y137-F286 HydrophobicContact CE1-CZ 3.74Å; Y137-Y289 HydrophobicContact CE1-CD2 4.4Å |
| 138 | A | 93.7 | Very high | 94.6 | Very high | 12 Ų | 12 | 56 Ų | 56 | 10% | 0.099 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.1 | -38.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | S134 V135 W142 L143 F148 | S134-A138 WeakPolarHBondContact O-CB 3.43Å; S134-A138 PolarHBondContact O-N 2.82Å; V135-A138 PolarHBondContact O-N 3.04Å; A138-W142 WeakPolarHBondContact O-CA 3.44Å; A138-W142 PolarHBondContact O-N 3.27Å; A138-L143 HydrophobicContact CB-CB 4.21Å; A138-L143 HydrophobicContact CB-CD1 4.16Å; A138-L143 HydrophobicContact CB-CG 4.5Å; A138-L143 PolarHBondContact O-N 3.46Å; A138-F148 HydrophobicContact CB-CB 4.25Å; A138-F148 HydrophobicContact CB-CD2 3.81Å; A138-F148 HydrophobicContact CB-CG 4.48Å |
| 139 | F | 92.4 | Very high | 94.6 | Very high | 152 Ų | 152 | 59 Ų | 59 | 67% | 0.667 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -65.6 | -44.6 | 171 | -75.6 | -62.4 | 0 | 0 | 0 | 112.3 | V135 L136 Y137 L141 W142 | V135-F139 HydrophobicContact CG1-CD2 3.76Å; V135-F139 HydrophobicContact CG1-CE2 3.39Å; V135-F139 HydrophobicContact CG1-CZ 4.5Å; V135-F139 WeakPolarHBondContact O-CD2 3.31Å; V135-F139 PolarHBondContact O-N 2.96Å; L136-F139 PolarHBondContact O-N 3.37Å; Y137-F139 VanDerWaalsContact C-N 3.32Å; Y137-F139 PolarHBondContact O-N 2.67Å; F139-L141 VanDerWaalsContact C-N 3.29Å; F139-L141 PolarHBondContact O-N 3.37Å; F139-W142 PolarHBondContact O-N 3.27Å |
| 140 | S | 91.8 | Very high | 94.5 | Very high | 20 Ų | 20 | 61 Ų | 61 | 14% | 0.14 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.2 | -36.1 | 179.8 | -168.3 | 0 | 0 | 0 | 0 | 112.7 | L136 Y137 P212 P216 | L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 2.87Å; Y137-S140 PolarHBondContact O-N 3.46Å; S140-P212 PolarHBondContact OG-O 3.44Å; S140-P216 VanDerWaalsContact OG-CG 3.24Å; S140-P216 WeakPolarHBondContact OG-CG 3.29Å |
| 141 | L | 90.7 | Very high | 94.4 | Very high | 13 Ų | 13 | 60.6 Ų | 60.6 | 7% | 0.068 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -92.8 | -3.9 | 180 | -69.2 | 177.6 | 0 | 0 | 0 | 114.2 | Y137 F139 L143 F286 R290 | Y137-L141 HydrophobicContact CD1-CD1 3.94Å; Y137-L141 HydrophobicContact CD1-CG 4.18Å; Y137-L141 WeakPolarHBondContact O-CB 3.24Å; Y137-L141 WeakPolarHBondContact O-CG 3.47Å; Y137-L141 PolarHBondContact O-N 2.92Å; F139-L141 VanDerWaalsContact C-N 3.29Å; F139-L141 PolarHBondContact O-N 3.37Å; L141-L143 VanDerWaalsContact C-N 3.33Å; L141-L143 HydrophobicContact CB-CD1 4.35Å; L141-L143 HydrophobicContact CB-CD2 3.92Å; L141-L143 HydrophobicContact CB-CG 3.76Å; L141-L143 HydrophobicContact CD1-CD1 4.34Å; L141-L143 PolarHBondContact O-N 2.85Å; L141-F286 HydrophobicContact CD2-CD1 3.44Å; L141-F286 VanDerWaalsContact CD2-CD1 3.44Å; L141-F286 HydrophobicContact CD2-CE1 3.85Å; L141-F286 HydrophobicContact CD2-CG 4.29Å; L141-R290 HydrophobicContact CD2-CG 3.91Å |
| 142 | W | 91.5 | Very high | 94.3 | Very high | 235 Ų | 235 | 56.7 Ų | 56.7 | 89% | 0.89 | 28% | 0.28 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 46.2 | -174 | -60.1 | 88.9 | 0 | 0 | 0 | 113.3 | A138 F139 | A138-W142 WeakPolarHBondContact O-CA 3.44Å; A138-W142 PolarHBondContact O-N 3.27Å; F139-W142 PolarHBondContact O-N 3.27Å |
| 143 | L | 90.5 | Very high | 94.2 | Very high | 34 Ų | 34 | 55.4 Ų | 55.4 | 18% | 0.178 | 27% | 0.271 | C | S | . | . | trans | -74.9 | 146.6 | -177.6 | -61.2 | 179.7 | 0 | 0 | 0 | 112.4 | A138 L141 F151 V293 | A138-L143 HydrophobicContact CB-CB 4.21Å; A138-L143 HydrophobicContact CB-CD1 4.16Å; A138-L143 HydrophobicContact CB-CG 4.5Å; A138-L143 PolarHBondContact O-N 3.46Å; L141-L143 VanDerWaalsContact C-N 3.33Å; L141-L143 HydrophobicContact CB-CD1 4.35Å; L141-L143 HydrophobicContact CB-CD2 3.92Å; L141-L143 HydrophobicContact CB-CG 3.76Å; L141-L143 HydrophobicContact CD1-CD1 4.34Å; L141-L143 PolarHBondContact O-N 2.85Å; L143-F151 HydrophobicContact CD1-CB 4.22Å; L143-V293 HydrophobicContact CD1-CG1 3.69Å; L143-V293 HydrophobicContact CD2-CB 4.45Å; L143-V293 HydrophobicContact CD2-CG1 3.93Å; L143-V293 HydrophobicContact CG-CG1 4.42Å | ||
| 144 | S | 93.9 | Very high | 94.1 | Very high | 46 Ų | 46 | 58.2 Ų | 58.2 | 32% | 0.322 | 28% | 0.282 | S | S | . | . | trans | -66.1 | 168 | 165.6 | 74.7 | 0 | 0 | 0 | 0 | 111.3 | F146 G147 F148 D295 | S144-F146 VanDerWaalsContact C-N 3.26Å; S144-F146 PolarHBondContact O-N 2.93Å; S144-F146 PolarHBondContact OG-N 3.49Å; S144-G147 PolarHBondContact O-N 3.33Å; S144-G147 PolarHBondContact OG-N 3.15Å; S144-G147 VanDerWaalsContact OG-N 3.08Å; S144-F148 PolarHBondContact O-N 3.38Å; S144-D295 WeakPolarHBondContact CB-OD2 3.34Å; S144-D295 PolarHBondContact OG-OD2 3.37Å | ||
| 145 | A | 92.4 | Very high | 94 | Very high | 75 Ų | 75 | 58.2 Ų | 58.2 | 62% | 0.62 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -59 | -38.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F148 F149 | A145-F148 PolarHBondContact O-N 3.31Å; A145-F149 WeakPolarHBondContact O-CD2 3.46Å; A145-F149 PolarHBondContact O-N 3.46Å |
| 146 | F | 93.4 | Very high | 94 | Very high | 142 Ų | 142 | 58 Ų | 58 | 62% | 0.623 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -68.6 | -43.9 | 176.8 | -177.4 | -106.2 | 0 | 0 | 0 | 111.5 | S144 F148 F149 K150 | S144-F146 VanDerWaalsContact C-N 3.26Å; S144-F146 PolarHBondContact O-N 2.93Å; S144-F146 PolarHBondContact OG-N 3.49Å; F146-F148 VanDerWaalsContact C-N 3.31Å; F146-F148 PolarHBondContact O-N 3.48Å; F146-F149 PolarHBondContact O-N 2.86Å; F146-K150 WeakPolarHBondContact O-CB 3.45Å; F146-K150 PolarHBondContact O-N 3.43Å |
| 147 | G | 93.5 | Very high | 94.1 | Very high | 1 Ų | 1 | 60.6 Ų | 60.6 | 1% | 0.01 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -55.9 | -44.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | S144 F149 K150 F151 V293 | S144-G147 PolarHBondContact O-N 3.33Å; S144-G147 PolarHBondContact OG-N 3.15Å; S144-G147 VanDerWaalsContact OG-N 3.08Å; G147-F149 PolarHBondContact O-N 3.19Å; G147-K150 PolarHBondContact O-N 3.48Å; G147-F151 WeakPolarHBondContact O-CB 3.43Å; G147-F151 PolarHBondContact O-N 2.94Å; G147-V293 WeakPolarHBondContact O-CG1 3.38Å |
| 148 | F | 95.3 | Very high | 94.2 | Very high | 30 Ų | 30 | 64.3 Ų | 64.3 | 13% | 0.132 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -56.7 | -49.7 | 175.5 | 165.4 | -103.7 | 0 | 0 | 0 | 112.6 | F131 V135 A138 S144 A145 F146 K150 F151 L152 | F131-F148 HydrophobicContact CD2-CZ 4.21Å; F131-F148 HydrophobicContact CE2-CE1 4.29Å; F131-F148 AromaticContact CE2-CZ 3.68Å; F131-F148 HydrophobicContact CE2-CZ 3.68Å; F131-F148 HydrophobicContact CZ-CZ 4.28Å; V135-F148 HydrophobicContact CG2-CE2 3.78Å; V135-F148 HydrophobicContact CG2-CZ 4.02Å; A138-F148 HydrophobicContact CB-CB 4.25Å; A138-F148 HydrophobicContact CB-CD2 3.81Å; A138-F148 HydrophobicContact CB-CG 4.48Å; S144-F148 PolarHBondContact O-N 3.38Å; A145-F148 PolarHBondContact O-N 3.31Å; F146-F148 VanDerWaalsContact C-N 3.31Å; F146-F148 PolarHBondContact O-N 3.48Å; F148-K150 VanDerWaalsContact C-N 3.33Å; F148-K150 PolarHBondContact O-N 3.18Å; F148-F151 PolarHBondContact O-N 2.83Å; F148-L152 HydrophobicContact CE1-CD2 4.42Å; F148-L152 HydrophobicContact CZ-CD2 4.21Å; F148-L152 WeakPolarHBondContact O-CB 3.42Å; F148-L152 PolarHBondContact O-N 3.41Å |
| 149 | F | 95.4 | Very high | 94.3 | Very high | 120 Ų | 120 | 65.1 Ų | 65.1 | 53% | 0.526 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.2 | -40.7 | 179.1 | -74.7 | -66.3 | 0 | 0 | 0 | 112 | A145 F146 G147 F151 L152 M153 | A145-F149 WeakPolarHBondContact O-CD2 3.46Å; A145-F149 PolarHBondContact O-N 3.46Å; F146-F149 PolarHBondContact O-N 2.86Å; G147-F149 PolarHBondContact O-N 3.19Å; F149-F151 PolarHBondContact O-N 2.91Å; F149-L152 PolarHBondContact O-N 3.28Å; F149-M153 VanDerWaalsContact O-CG 3.26Å; F149-M153 WeakPolarHBondContact O-CG 3.49Å; F149-M153 PolarHBondContact O-N 2.88Å |
| 150 | K | 95.1 | Very high | 94.5 | Very high | 69 Ų | 69 | 58.2 Ų | 58.2 | 30% | 0.3 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62 | -42.2 | 176.2 | -175.4 | 177.4 | 174.3 | -164.3 | 0 | 111.9 | F146 G147 F148 W154 R292 V293 | F146-K150 WeakPolarHBondContact O-CB 3.45Å; F146-K150 PolarHBondContact O-N 3.43Å; G147-K150 PolarHBondContact O-N 3.48Å; F148-K150 VanDerWaalsContact C-N 3.33Å; F148-K150 PolarHBondContact O-N 3.18Å; K150-W154 WeakPolarHBondContact O-CB 3.49Å; K150-W154 PolarHBondContact O-N 3.32Å; K150-W154 VanDerWaalsContact O-N 3.1Å; K150-R292 WeakPolarHBondContact CE-O 3.44Å; K150-R292 PolarHBondContact NZ-O 3.17Å; K150-V293 HydrophobicContact CB-CG1 4.49Å |
| 151 | F | 95.1 | Very high | 94.8 | Very high | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -64.6 | -47.3 | 174 | -177.4 | -108 | 0 | 0 | 0 | 112.1 | Y137 L143 G147 F148 F149 M153 W154 V155 Y289 V293 | Y137-F151 VanDerWaalsContact CB-CE1 3.47Å; Y137-F151 HydrophobicContact CD1-CZ 4.26Å; Y137-F151 HydrophobicContact CD2-CE1 4.18Å; Y137-F151 AromaticContact CD2-CZ 3.76Å; Y137-F151 HydrophobicContact CD2-CZ 3.76Å; Y137-F151 HydrophobicContact CE2-CZ 4.43Å; Y137-F151 AromaticContact CG-CE1 3.97Å; Y137-F151 HydrophobicContact CG-CE1 3.97Å; Y137-F151 AromaticContact CG-CZ 3.65Å; Y137-F151 HydrophobicContact CG-CZ 3.65Å; L143-F151 HydrophobicContact CD1-CB 4.22Å; G147-F151 WeakPolarHBondContact O-CB 3.43Å; G147-F151 PolarHBondContact O-N 2.94Å; F148-F151 PolarHBondContact O-N 2.83Å; F149-F151 PolarHBondContact O-N 2.91Å; F151-M153 VanDerWaalsContact C-N 3.34Å; F151-M153 PolarHBondContact O-N 3.49Å; F151-W154 WeakPolarHBondContact O-CB 3.18Å; F151-W154 PolarHBondContact O-N 3.36Å; F151-W154 VanDerWaalsContact O-N 3.12Å; F151-V155 HydrophobicContact CD1-CG2 4.09Å; F151-V155 HydrophobicContact CD2-CG2 4.2Å; F151-V155 HydrophobicContact CE1-CG2 3.65Å; F151-V155 HydrophobicContact CE2-CG2 3.81Å; F151-V155 HydrophobicContact CG-CG2 4.35Å; F151-V155 HydrophobicContact CZ-CG2 3.51Å; F151-V155 WeakPolarHBondContact O-CG2 3.29Å; F151-V155 PolarHBondContact O-N 3.14Å; F151-Y289 HydrophobicContact CD2-CD1 4.1Å; F151-Y289 HydrophobicContact CD2-CE1 4.37Å; F151-Y289 HydrophobicContact CD2-CG 4.45Å; F151-Y289 AromaticContact CE2-CD1 3.72Å; F151-Y289 HydrophobicContact CE2-CD1 3.72Å; F151-Y289 HydrophobicContact CE2-CD2 4.08Å; F151-Y289 AromaticContact CE2-CE1 3.76Å; F151-Y289 HydrophobicContact CE2-CE1 3.76Å; F151-Y289 HydrophobicContact CE2-CE2 4.11Å; F151-Y289 AromaticContact CE2-CG 3.89Å; F151-Y289 HydrophobicContact CE2-CG 3.89Å; F151-Y289 AromaticContact CE2-CZ 3.96Å; F151-V293 HydrophobicContact CB-CG1 3.98Å; F151-V293 HydrophobicContact CB-CG2 4.02Å; F151-V293 HydrophobicContact CD2-CG2 3.95Å; F151-V293 HydrophobicContact CG-CG2 4.49Å |
| 152 | L | 96.8 | Very high | 95.1 | Very high | 19 Ų | 19 | 61 Ų | 61 | 10% | 0.099 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.1 | -46.7 | 179 | 179 | 66.6 | 0 | 0 | 0 | 111.4 | F131 F148 F149 W154 V155 V156 | F131-L152 HydrophobicContact CD2-CD1 4.26Å; F131-L152 HydrophobicContact CD2-CD2 4.04Å; F131-L152 HydrophobicContact CE2-CD2 4.42Å; F148-L152 HydrophobicContact CE1-CD2 4.42Å; F148-L152 HydrophobicContact CZ-CD2 4.21Å; F148-L152 WeakPolarHBondContact O-CB 3.42Å; F148-L152 PolarHBondContact O-N 3.41Å; F149-L152 PolarHBondContact O-N 3.28Å; L152-W154 VanDerWaalsContact C-N 3.3Å; L152-W154 PolarHBondContact O-N 2.95Å; L152-V155 PolarHBondContact O-N 3.36Å; L152-V156 HydrophobicContact CD1-CG2 4.22Å; L152-V156 WeakPolarHBondContact O-CB 3.25Å; L152-V156 VanDerWaalsContact O-CG2 3.31Å; L152-V156 WeakPolarHBondContact O-CG2 3.22Å; L152-V156 PolarHBondContact O-N 3.02Å |
| 153 | M | 95.9 | Very high | 95.4 | Very high | 87 Ų | 87 | 52.3 Ų | 52.3 | 43% | 0.429 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -62.1 | -38.8 | 176.9 | -67.2 | -60.8 | 99.5 | 0 | 0 | 111.7 | F149 F151 F157 | F149-M153 VanDerWaalsContact O-CG 3.26Å; F149-M153 WeakPolarHBondContact O-CG 3.49Å; F149-M153 PolarHBondContact O-N 2.88Å; F151-M153 VanDerWaalsContact C-N 3.34Å; F151-M153 PolarHBondContact O-N 3.49Å; M153-F157 HydrophobicContact CB-CD2 4.35Å; M153-F157 WeakPolarHBondContact O-CB 3.37Å; M153-F157 WeakPolarHBondContact O-CD2 3.36Å; M153-F157 PolarHBondContact O-N 2.98Å; M153-F157 HydrophobicContact SD-CD2 4.12Å; M153-F157 HydrophobicContact SD-CE2 3.63Å |
| 154 | W | 95.4 | Very high | 95.8 | Very high | 60 Ų | 60 | 50.7 Ų | 50.7 | 23% | 0.227 | 27% | 0.266 | C | S | . | . | I | π-helix | trans | -62.7 | -52.5 | 175.7 | -174.9 | -77.2 | 0 | 0 | 0 | 111.7 | K150 F151 L152 V156 I158 D159 F288 R292 | K150-W154 WeakPolarHBondContact O-CB 3.49Å; K150-W154 PolarHBondContact O-N 3.32Å; K150-W154 VanDerWaalsContact O-N 3.1Å; F151-W154 WeakPolarHBondContact O-CB 3.18Å; F151-W154 PolarHBondContact O-N 3.36Å; F151-W154 VanDerWaalsContact O-N 3.12Å; L152-W154 VanDerWaalsContact C-N 3.3Å; L152-W154 PolarHBondContact O-N 2.95Å; W154-V156 VanDerWaalsContact C-N 3.29Å; W154-V156 PolarHBondContact O-N 3.39Å; W154-I158 HydrophobicContact CD2-CB 4.17Å; W154-I158 HydrophobicContact CD2-CG1 3.96Å; W154-I158 HydrophobicContact CD2-CG2 4.49Å; W154-I158 HydrophobicContact CE3-CG1 4.06Å; W154-I158 HydrophobicContact CG-CB 4.31Å; W154-I158 HydrophobicContact CG-CG1 4.33Å; W154-I158 HydrophobicContact CZ2-CG2 3.94Å; W154-I158 HydrophobicContact CZ3-CG1 4.42Å; W154-I158 WeakPolarHBondContact O-CA 3.3Å; W154-I158 VanDerWaalsContact O-CB 3.23Å; W154-I158 WeakPolarHBondContact O-CB 3.49Å; W154-I158 PolarHBondContact O-N 3.45Å; W154-D159 PolarHBondContact NE1-OD1 3.38Å; W154-D159 PolarHBondContact O-N 2.92Å; W154-D159 VanDerWaalsContact O-N 3.08Å; W154-F288 HydrophobicContact CH2-CZ 4.32Å; W154-F288 HydrophobicContact CZ2-CE1 4.17Å; W154-F288 AromaticContact CZ2-CZ 3.86Å; W154-F288 HydrophobicContact CZ2-CZ 3.86Å; W154-R292 HydrophobicContact CE3-CG 4.26Å; W154-R292 HydrophobicContact CH2-CG 4.43Å; W154-R292 HydrophobicContact CZ3-CG 4.09Å |
| 155 | V | 95.9 | Very high | 96 | Very high | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 27% | 0.274 | C | S | . | . | I | π-helix | trans | -60.6 | -40.8 | -178.4 | 172 | 0 | 0 | 0 | 0 | 111.1 | L130 F151 L152 D159 C160 | L130-V155 HydrophobicContact CD2-CG1 3.58Å; F151-V155 HydrophobicContact CD1-CG2 4.09Å; F151-V155 HydrophobicContact CD2-CG2 4.2Å; F151-V155 HydrophobicContact CE1-CG2 3.65Å; F151-V155 HydrophobicContact CE2-CG2 3.81Å; F151-V155 HydrophobicContact CG-CG2 4.35Å; F151-V155 HydrophobicContact CZ-CG2 3.51Å; F151-V155 WeakPolarHBondContact O-CG2 3.29Å; F151-V155 PolarHBondContact O-N 3.14Å; L152-V155 PolarHBondContact O-N 3.36Å; V155-D159 WeakPolarHBondContact O-CB 3.31Å; V155-D159 PolarHBondContact O-N 3.49Å; V155-C160 WeakPolarHBondContact O-CB 3.35Å; V155-C160 PolarHBondContact O-N 2.95Å |
| 156 | V | 96.7 | Very high | 96.3 | Very high | 39 Ų | 39 | 53.8 Ų | 53.8 | 24% | 0.236 | 27% | 0.269 | C | S | . | . | I | π-helix | trans | -72.2 | -55.4 | 179.6 | 173.3 | 0 | 0 | 0 | 0 | 111.7 | L152 W154 C160 I161 | L152-V156 HydrophobicContact CD1-CG2 4.22Å; L152-V156 WeakPolarHBondContact O-CB 3.25Å; L152-V156 VanDerWaalsContact O-CG2 3.31Å; L152-V156 WeakPolarHBondContact O-CG2 3.22Å; L152-V156 PolarHBondContact O-N 3.02Å; W154-V156 VanDerWaalsContact C-N 3.29Å; W154-V156 PolarHBondContact O-N 3.39Å; V156-C160 WeakPolarHBondContact O-CB 3.49Å; V156-I161 HydrophobicContact CG1-CD1 4.2Å; V156-I161 WeakPolarHBondContact O-CG1 3.48Å; V156-I161 PolarHBondContact O-N 2.88Å |
| 157 | F | 97.3 | Very high | 96.5 | Very high | 116 Ų | 116 | 49 Ų | 49 | 51% | 0.509 | 25% | 0.25 | S | C | . | . | I | π-helix | trans | -83.9 | -38.7 | -170.3 | -71.1 | -66.6 | 0 | 0 | 0 | 113.5 | M153 I161 G162 | M153-F157 HydrophobicContact CB-CD2 4.35Å; M153-F157 WeakPolarHBondContact O-CB 3.37Å; M153-F157 WeakPolarHBondContact O-CD2 3.36Å; M153-F157 PolarHBondContact O-N 2.98Å; M153-F157 HydrophobicContact SD-CD2 4.12Å; M153-F157 HydrophobicContact SD-CE2 3.63Å; F157-I161 HydrophobicContact CD1-CD1 3.96Å; F157-I161 HydrophobicContact CE1-CD1 4.28Å; F157-G162 WeakPolarHBondContact O-CA 3.47Å; F157-G162 PolarHBondContact O-N 3.29Å |
| 158 | I | 96.1 | Very high | 96.7 | Very high | 81 Ų | 81 | 49 Ų | 49 | 42% | 0.415 | 25% | 0.249 | S | C | . | . | I | π-helix | trans | -87.8 | -60.2 | -178.6 | -53 | -57.4 | 0 | 0 | 0 | 109.4 | W154 G162 T163 | W154-I158 HydrophobicContact CD2-CB 4.17Å; W154-I158 HydrophobicContact CD2-CG1 3.96Å; W154-I158 HydrophobicContact CD2-CG2 4.49Å; W154-I158 HydrophobicContact CE3-CG1 4.06Å; W154-I158 HydrophobicContact CG-CB 4.31Å; W154-I158 HydrophobicContact CG-CG1 4.33Å; W154-I158 HydrophobicContact CZ2-CG2 3.94Å; W154-I158 HydrophobicContact CZ3-CG1 4.42Å; W154-I158 WeakPolarHBondContact O-CA 3.3Å; W154-I158 VanDerWaalsContact O-CB 3.23Å; W154-I158 WeakPolarHBondContact O-CB 3.49Å; W154-I158 PolarHBondContact O-N 3.45Å; I158-G162 CarbonylContact O-C 3.6Å; I158-G162 WeakPolarHBondContact O-CA 3.48Å; I158-G162 PolarHBondContact O-N 3.25Å; I158-T163 WeakPolarHBondContact O-CG2 3.5Å; I158-T163 PolarHBondContact O-N 3.12Å |
| 159 | D | 95.2 | Very high | 96.9 | Very high | 28 Ų | 28 | 50.7 Ų | 50.7 | 15% | 0.15 | 26% | 0.262 | C | S | . | . | I | π-helix | trans | -73.5 | -39.9 | -168.9 | -61.1 | -18.1 | 0 | 0 | 0 | 112.4 | W154 V155 T163 Y289 | W154-D159 PolarHBondContact NE1-OD1 3.38Å; W154-D159 PolarHBondContact O-N 2.92Å; W154-D159 VanDerWaalsContact O-N 3.08Å; V155-D159 WeakPolarHBondContact O-CB 3.31Å; V155-D159 PolarHBondContact O-N 3.49Å; D159-T163 WeakPolarHBondContact O-CB 3.45Å; D159-T163 WeakPolarHBondContact O-CG2 3.46Å; D159-T163 PolarHBondContact O-OG1 3.5Å; D159-Y289 PolarHBondContact OD2-OH 3.22Å |
| 160 | C | 97 | Very high | 97 | Very high | 8 Ų | 8 | 50 Ų | 50 | 5% | 0.054 | 26% | 0.262 | C | S | . | . | I | π-helix | trans | -89.1 | -58.9 | 178.5 | -174.4 | 0 | 0 | 0 | 0 | 112.7 | L130 V155 V156 G164 H196 F200 | L130-C160 HydrophobicContact CD1-CB 4.24Å; V155-C160 WeakPolarHBondContact O-CB 3.35Å; V155-C160 PolarHBondContact O-N 2.95Å; V156-C160 WeakPolarHBondContact O-CB 3.49Å; C160-G164 PolarHBondContact O-N 3.49Å; C160-H196 PolarHBondContact O-NE2 2.75Å; C160-F200 HydrophobicContact CB-CE1 4.02Å; C160-F200 HydrophobicContact CB-CZ 4.02Å |
| 161 | I | 97 | Very high | 97.1 | Very high | 65 Ų | 65 | 48.6 Ų | 48.6 | 33% | 0.333 | 26% | 0.257 | S | S | . | . | I | π-helix | trans | -76 | -50.8 | -173.4 | -64.5 | 169.1 | 0 | 0 | 0 | 111 | V156 F157 G164 M165 | V156-I161 HydrophobicContact CG1-CD1 4.2Å; V156-I161 WeakPolarHBondContact O-CG1 3.48Å; V156-I161 PolarHBondContact O-N 2.88Å; F157-I161 HydrophobicContact CD1-CD1 3.96Å; F157-I161 HydrophobicContact CE1-CD1 4.28Å; I161-G164 PolarHBondContact O-N 3.14Å; I161-M165 HydrophobicContact CG2-CG 4.42Å; I161-M165 HydrophobicContact CG2-SD 4.08Å; I161-M165 WeakPolarHBondContact O-CG 3.04Å; I161-M165 PolarHBondContact O-N 3.19Å |
| 162 | G | 98.2 | Very high | 97.2 | Very high | 26 Ų | 26 | 53.9 Ų | 53.9 | 27% | 0.268 | 28% | 0.277 | S | S | . | . | I | π-helix | trans | -61.8 | -55 | -176 | 0 | 0 | 0 | 0 | 0 | 112.5 | F157 I158 G164 M165 V166 | F157-G162 WeakPolarHBondContact O-CA 3.47Å; F157-G162 PolarHBondContact O-N 3.29Å; I158-G162 CarbonylContact O-C 3.6Å; I158-G162 WeakPolarHBondContact O-CA 3.48Å; I158-G162 PolarHBondContact O-N 3.25Å; G162-G164 PolarHBondContact O-N 3.42Å; G162-M165 PolarHBondContact O-N 3.45Å; G162-V166 WeakPolarHBondContact O-CG2 3.38Å; G162-V166 PolarHBondContact O-N 3.24Å |
| 163 | T | 97.6 | Very high | 97.2 | Very high | 53 Ų | 53 | 55.3 Ų | 55.3 | 33% | 0.325 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.3 | -38 | 175.8 | 78 | 0 | 0 | 0 | 0 | 111.2 | I158 D159 M165 V166 I167 H196 | I158-T163 WeakPolarHBondContact O-CG2 3.5Å; I158-T163 PolarHBondContact O-N 3.12Å; D159-T163 WeakPolarHBondContact O-CB 3.45Å; D159-T163 WeakPolarHBondContact O-CG2 3.46Å; D159-T163 PolarHBondContact O-OG1 3.5Å; T163-M165 PolarHBondContact O-N 3.47Å; T163-V166 PolarHBondContact O-N 3.01Å; T163-I167 WeakPolarHBondContact O-CB 3.38Å; T163-I167 VanDerWaalsContact O-CG1 3.29Å; T163-I167 WeakPolarHBondContact O-CG1 3.29Å; T163-I167 PolarHBondContact O-N 2.76Å; T163-H196 PolarHBondContact OG1-CE1 2.83Å |
| 164 | G | 98.2 | Very high | 97.2 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | C160 I161 G162 A168 H196 | C160-G164 PolarHBondContact O-N 3.49Å; I161-G164 PolarHBondContact O-N 3.14Å; G162-G164 PolarHBondContact O-N 3.42Å; G164-A168 WeakPolarHBondContact O-CB 3.23Å; G164-A168 PolarHBondContact O-N 3.43Å; G164-H196 WeakPolarHBondContact CA-CD2 3.39Å; G164-H196 WeakPolarHBondContact CA-NE2 3.48Å |
| 165 | M | 98.2 | Very high | 97.2 | Very high | 99 Ų | 99 | 51.7 Ų | 51.7 | 49% | 0.488 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 175.3 | -73.1 | -179.8 | 68.3 | 0 | 0 | 111.9 | I161 G162 T163 T169 W189 F193 | I161-M165 HydrophobicContact CG2-CG 4.42Å; I161-M165 HydrophobicContact CG2-SD 4.08Å; I161-M165 WeakPolarHBondContact O-CG 3.04Å; I161-M165 PolarHBondContact O-N 3.19Å; G162-M165 PolarHBondContact O-N 3.45Å; T163-M165 PolarHBondContact O-N 3.47Å; M165-T169 VanDerWaalsContact O-CB 3.3Å; M165-T169 WeakPolarHBondContact O-CB 3.35Å; M165-T169 PolarHBondContact O-N 2.96Å; M165-T169 PolarHBondContact O-OG1 3Å; M165-W189 HydrophobicContact CB-CZ2 4.49Å; M165-W189 HydrophobicContact CG-CH2 4.37Å; M165-W189 HydrophobicContact CG-CZ2 4.23Å; M165-F193 HydrophobicContact CG-CE2 4.46Å |
| 166 | V | 98.7 | Very high | 97.2 | Very high | 87 Ų | 87 | 53.1 Ų | 53.1 | 53% | 0.527 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -63.3 | -52.8 | 177.7 | 173 | 0 | 0 | 0 | 0 | 110.2 | G162 T163 A168 T169 M170 | G162-V166 WeakPolarHBondContact O-CG2 3.38Å; G162-V166 PolarHBondContact O-N 3.24Å; T163-V166 PolarHBondContact O-N 3.01Å; V166-A168 PolarHBondContact O-N 3.19Å; V166-T169 PolarHBondContact O-N 3.27Å; V166-M170 HydrophobicContact CG1-SD 4.05Å; V166-M170 WeakPolarHBondContact O-CG 3.36Å; V166-M170 PolarHBondContact O-N 3.32Å |
| 167 | I | 98.2 | Very high | 97 | Very high | 42 Ų | 42 | 54 Ų | 54 | 22% | 0.215 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.2 | -44.5 | -178.3 | -64.4 | 169.7 | 0 | 0 | 0 | 110.5 | T163 T169 M170 M171 Y240 | T163-I167 WeakPolarHBondContact O-CB 3.38Å; T163-I167 VanDerWaalsContact O-CG1 3.29Å; T163-I167 WeakPolarHBondContact O-CG1 3.29Å; T163-I167 PolarHBondContact O-N 2.76Å; I167-T169 VanDerWaalsContact C-N 3.29Å; I167-T169 PolarHBondContact O-N 3.01Å; I167-M170 PolarHBondContact O-N 3.33Å; I167-M171 HydrophobicContact CG2-CE 4.21Å; I167-M171 HydrophobicContact CG2-CG 3.95Å; I167-M171 WeakPolarHBondContact O-CB 3.16Å; I167-M171 VanDerWaalsContact O-CG 3.23Å; I167-M171 WeakPolarHBondContact O-CG 3.48Å; I167-M171 PolarHBondContact O-N 2.82Å; I167-Y240 WeakPolarHBondContact CD1-OH 3.38Å |
| 168 | A | 98.2 | Very high | 96.8 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.2 | -41.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | G164 V166 M171 W172 W189 C192 F193 | G164-A168 WeakPolarHBondContact O-CB 3.23Å; G164-A168 PolarHBondContact O-N 3.43Å; V166-A168 PolarHBondContact O-N 3.19Å; A168-M171 PolarHBondContact O-N 3.05Å; A168-W172 WeakPolarHBondContact O-CB 3.25Å; A168-W172 PolarHBondContact O-N 2.55Å; A168-W189 HydrophobicContact CB-CZ2 4.16Å; A168-C192 HydrophobicContact CB-CB 3.98Å; A168-C192 WeakPolarHBondContact O-CB 3.46Å; A168-F193 HydrophobicContact CB-CB 3.91Å; A168-F193 HydrophobicContact CB-CD2 4.22Å |
| 169 | T | 98.5 | Very high | 96.7 | Very high | 66 Ų | 66 | 52.6 Ų | 52.6 | 41% | 0.405 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -66.6 | -44.3 | 178.2 | -56.6 | 0 | 0 | 0 | 0 | 111.5 | M165 V166 I167 W172 A173 W189 | M165-T169 VanDerWaalsContact O-CB 3.3Å; M165-T169 WeakPolarHBondContact O-CB 3.35Å; M165-T169 PolarHBondContact O-N 2.96Å; M165-T169 PolarHBondContact O-OG1 3Å; V166-T169 PolarHBondContact O-N 3.27Å; I167-T169 VanDerWaalsContact C-N 3.29Å; I167-T169 PolarHBondContact O-N 3.01Å; T169-W172 PolarHBondContact O-N 3.37Å; T169-A173 WeakPolarHBondContact O-CB 3.42Å; T169-A173 PolarHBondContact O-N 3.38Å; T169-W189 PolarHBondContact OG1-NE1 3.1Å; T169-W189 VanDerWaalsContact OG1-NE1 3.17Å |
| 170 | M | 97.8 | Very high | 96.5 | Very high | 106 Ų | 106 | 53.3 Ų | 53.3 | 52% | 0.522 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.8 | -48.8 | 175 | -71 | 177.6 | 67.9 | 0 | 0 | 111.4 | V166 I167 W172 A173 L174 | V166-M170 HydrophobicContact CG1-SD 4.05Å; V166-M170 WeakPolarHBondContact O-CG 3.36Å; V166-M170 PolarHBondContact O-N 3.32Å; I167-M170 PolarHBondContact O-N 3.33Å; M170-W172 PolarHBondContact O-N 3.42Å; M170-A173 PolarHBondContact O-N 3.03Å; M170-L174 WeakPolarHBondContact O-CB 3.38Å; M170-L174 VanDerWaalsContact O-CG 3.25Å; M170-L174 WeakPolarHBondContact O-CG 3.13Å; M170-L174 PolarHBondContact O-N 3.12Å |
| 171 | M | 97.1 | Very high | 96.2 | Very high | 38 Ų | 38 | 60.1 Ų | 60.1 | 19% | 0.187 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -69.3 | -34.4 | -177.9 | -62.7 | -60.9 | 160.4 | 0 | 0 | 112.4 | I167 A168 L174 S175 Y248 F260 | I167-M171 HydrophobicContact CG2-CE 4.21Å; I167-M171 HydrophobicContact CG2-CG 3.95Å; I167-M171 WeakPolarHBondContact O-CB 3.16Å; I167-M171 VanDerWaalsContact O-CG 3.23Å; I167-M171 WeakPolarHBondContact O-CG 3.48Å; I167-M171 PolarHBondContact O-N 2.82Å; A168-M171 PolarHBondContact O-N 3.05Å; M171-L174 HydrophobicContact SD-CD1 4.29Å; M171-S175 WeakPolarHBondContact O-CB 3.44Å; M171-S175 PolarHBondContact O-N 3.2Å; M171-S175 PolarHBondContact O-OG 3.06Å; M171-Y248 HydrophobicContact CB-CE2 4.16Å; M171-Y248 WeakPolarHBondContact CB-OH 3.47Å; M171-Y248 HydrophobicContact CG-CE2 4.35Å; M171-F260 HydrophobicContact SD-CD1 3.83Å; M171-F260 HydrophobicContact SD-CE1 3.47Å; M171-F260 WeakPolarHBondContact SD-CE1 3.42Å |
| 172 | W | 96.9 | Very high | 95.7 | Very high | 111 Ų | 111 | 60.1 Ų | 60.1 | 42% | 0.42 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60.9 | -49.3 | 171.3 | 174.7 | 78.5 | 0 | 0 | 0 | 111.2 | A168 T169 M170 S175 N176 V187 W189 C192 | A168-W172 WeakPolarHBondContact O-CB 3.25Å; A168-W172 PolarHBondContact O-N 2.55Å; T169-W172 PolarHBondContact O-N 3.37Å; M170-W172 PolarHBondContact O-N 3.42Å; W172-S175 PolarHBondContact O-N 3.39Å; W172-N176 PolarHBondContact NE1-ND2 2.9Å; W172-N176 WeakPolarHBondContact O-CB 3.44Å; W172-N176 PolarHBondContact O-N 2.84Å; W172-N176 PolarHBondContact O-ND2 2.96Å; W172-V187 PolarHBondContact NE1-O 3.26Å; W172-V187 VanDerWaalsContact NE1-O 3.09Å; W172-W189 HydrophobicContact CG-CB 4.32Å; W172-C192 HydrophobicContact CB-CB 4.5Å |
| 173 | A | 96.9 | Very high | 94.9 | Very high | 50 Ų | 50 | 65.5 Ų | 65.5 | 41% | 0.413 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.4 | -45.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | T169 M170 G177 | T169-A173 WeakPolarHBondContact O-CB 3.42Å; T169-A173 PolarHBondContact O-N 3.38Å; M170-A173 PolarHBondContact O-N 3.03Å; A173-G177 WeakPolarHBondContact O-CA 3.26Å; A173-G177 PolarHBondContact O-N 2.8Å |
| 174 | L | 95.7 | Very high | 94.3 | Very high | 71 Ų | 71 | 69.9 Ų | 69.9 | 37% | 0.372 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.4 | -47.2 | 177.8 | -72.1 | 172.1 | 0 | 0 | 0 | 111.7 | M170 M171 F178 L179 | M170-L174 WeakPolarHBondContact O-CB 3.38Å; M170-L174 VanDerWaalsContact O-CG 3.25Å; M170-L174 WeakPolarHBondContact O-CG 3.13Å; M170-L174 PolarHBondContact O-N 3.12Å; M171-L174 HydrophobicContact SD-CD1 4.29Å; L174-F178 HydrophobicContact CD2-CD2 4.2Å; L174-F178 HydrophobicContact CD2-CE2 4.28Å; L174-F178 PolarHBondContact O-N 3.26Å; L174-L179 VanDerWaalsContact O-CD1 3.24Å; L174-L179 WeakPolarHBondContact O-CD1 3.26Å |
| 175 | S | 95.5 | Very high | 93.7 | Very high | 0 Ų | 0 | 72.9 Ų | 72.9 | 0% | 0 | 38% | 0.38 | C | S | . | . | I | π-helix | trans | -64.7 | -47.8 | -177.1 | -58 | 0 | 0 | 0 | 0 | 111.6 | M171 W172 L179 R180 Y248 | M171-S175 WeakPolarHBondContact O-CB 3.44Å; M171-S175 PolarHBondContact O-N 3.2Å; M171-S175 PolarHBondContact O-OG 3.06Å; W172-S175 PolarHBondContact O-N 3.39Å; S175-L179 PolarHBondContact O-N 3.18Å; S175-R180 PolarHBondContact O-N 2.91Å; S175-Y248 WeakPolarHBondContact OG-CE1 3.39Å |
| 176 | N | 95.7 | Very high | 93.3 | Very high | 30 Ų | 30 | 72.6 Ų | 72.6 | 16% | 0.16 | 38% | 0.38 | C | S | . | . | I | π-helix | trans | -75.4 | -29.1 | -178.2 | -71.1 | -36 | 0 | 0 | 0 | 113.1 | W172 R180 V187 | W172-N176 PolarHBondContact NE1-ND2 2.9Å; W172-N176 WeakPolarHBondContact O-CB 3.44Å; W172-N176 PolarHBondContact O-N 2.84Å; W172-N176 PolarHBondContact O-ND2 2.96Å; N176-R180 WeakPolarHBondContact O-CD 3.49Å; N176-R180 WeakPolarHBondContact OD1-CD 3.33Å; N176-V187 PolarHBondContact ND2-O 2.85Å; N176-V187 WeakPolarHBondContact OD1-CB 3.42Å; N176-V187 PolarHBondContact OD1-N 3.08Å |
| 177 | G | 92.6 | Very high | 93 | Very high | 56 Ų | 56 | 68.5 Ų | 68.5 | 58% | 0.577 | 36% | 0.356 | S | S | * | . | I | π-helix | trans | -77 | -41.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | A173 | A173-G177 WeakPolarHBondContact O-CA 3.26Å; A173-G177 PolarHBondContact O-N 2.8Å |
| 178 | F | 93.1 | Very high | 92.8 | Very high | 158 Ų | 158 | 70.6 Ų | 70.6 | 69% | 0.693 | 36% | 0.364 | S | S | * | . | I | π-helix | trans | -124.4 | -25.3 | -167.3 | -56.7 | -75.2 | 0 | 0 | 0 | 115.1 | L174 | L174-F178 HydrophobicContact CD2-CD2 4.2Å; L174-F178 HydrophobicContact CD2-CE2 4.28Å; L174-F178 PolarHBondContact O-N 3.26Å |
| 179 | L | 93.6 | Very high | 92.6 | Very high | 10 Ų | 10 | 75.2 Ų | 75.2 | 5% | 0.052 | 38% | 0.382 | C | S | . | . | I | π-helix | trans | -102.3 | -6.9 | -169.1 | -71.9 | 86.1 | 0 | 0 | 0 | 114.1 | L174 S175 L254 K255 V257 F260 | L174-L179 VanDerWaalsContact O-CD1 3.24Å; L174-L179 WeakPolarHBondContact O-CD1 3.26Å; S175-L179 PolarHBondContact O-N 3.18Å; L179-L254 HydrophobicContact CB-CD2 4.07Å; L179-L254 CarbonylContact O-C 3.46Å; L179-L254 VanDerWaalsContact O-CA 3.27Å; L179-L254 WeakPolarHBondContact O-CA 3.34Å; L179-K255 VanDerWaalsContact O-CG 3.27Å; L179-K255 WeakPolarHBondContact O-CG 3.47Å; L179-K255 PolarHBondContact O-N 3.41Å; L179-V257 HydrophobicContact CD2-CG1 4.49Å; L179-F260 HydrophobicContact CD2-CD2 4.24Å; L179-F260 HydrophobicContact CD2-CE2 3.43Å; L179-F260 VanDerWaalsContact CD2-CE2 3.43Å; L179-F260 HydrophobicContact CD2-CZ 3.79Å |
| 180 | R | 93 | Very high | 92.3 | Very high | 43 Ų | 43 | 73.6 Ų | 73.6 | 16% | 0.162 | 38% | 0.378 | C | S | . | . | B | Isolated β-bridge | trans | -67.9 | 138.2 | 179.4 | -70.8 | 172.2 | 67.9 | -163.2 | 13.8 | 112.5 | S175 N176 T182 N183 Q185 D186 L254 K255 | S175-R180 PolarHBondContact O-N 2.91Å; N176-R180 WeakPolarHBondContact O-CD 3.49Å; N176-R180 WeakPolarHBondContact OD1-CD 3.33Å; R180-T182 PolarHBondContact NE-O 3.07Å; R180-N183 PolarHBondContact NH2-O 2.86Å; R180-Q185 PolarHBondContact NE-O 3.03Å; R180-Q185 PolarHBondContact NH2-O 3.41Å; R180-D186 IonicContact CZ-OD1 2.81Å; R180-D186 IonicContact NE-OD1 3.76Å; R180-D186 PolarHBondContact NE-OD1 2.91Å; R180-D186 IonicContact NH1-OD1 2.94Å; R180-D186 PolarHBondContact NH1-OD1 3.11Å; R180-D186 IonicContact NH2-OD1 2.82Å; R180-D186 PolarHBondContact NH2-OD1 3.12Å; R180-L254 HydrophobicContact CG-CD2 4.14Å; R180-K255 VanDerWaalsContact O-CE 3.24Å; R180-K255 WeakPolarHBondContact O-CE 3.5Å |
| 181 | R | 89.9 | Confident | 92.2 | Very high | 151 Ų | 151 | 68.6 Ų | 68.6 | 57% | 0.57 | 35% | 0.354 | S | S | * | . | S | Bend | trans | -82.9 | -44.7 | 171.9 | -70.4 | 179.7 | -164.5 | 175.9 | 7.9 | 111.8 | S252 F253 L254 K255 | R181-S252 PolarHBondContact NE-O 3.38Å; R181-S252 PolarHBondContact NH1-O 3.35Å; R181-F253 VanDerWaalsContact CB-O 3.26Å; R181-F253 WeakPolarHBondContact CB-O 3.44Å; R181-F253 WeakPolarHBondContact CG-O 3.48Å; R181-F253 PolarHBondContact N-O 3.1Å; R181-L254 VanDerWaalsContact NE-C 3.34Å; R181-L254 PolarHBondContact NE-O 3.34Å; R181-L254 PolarHBondContact NH2-O 3.44Å; R181-K255 HydrophobicContact CG-CB 3.68Å; R181-K255 HydrophobicContact CG-CD 4.43Å; R181-K255 HydrophobicContact CG-CG 4.03Å |
| 182 | T | 86.1 | Confident | 92.2 | Very high | 65 Ų | 65 | 66.9 Ų | 66.9 | 40% | 0.399 | 35% | 0.345 | S | S | . | . | trans | -128.7 | 159.3 | 179.7 | 69.1 | 0 | 0 | 0 | 0 | 110.3 | R180 D184 | R180-T182 PolarHBondContact NE-O 3.07Å; T182-D184 VanDerWaalsContact C-N 3.29Å; T182-D184 WeakPolarHBondContact CB-OD2 3.35Å; T182-D184 PolarHBondContact OG1-OD2 2.85Å | ||
| 183 | N | 81.1 | Confident | 92.2 | Very high | 140 Ų | 140 | 63.6 Ų | 63.6 | 75% | 0.749 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -87.6 | 3.9 | -179.2 | -67.2 | -42 | 0 | 0 | 0 | 113.3 | R180 | R180-N183 PolarHBondContact NH2-O 2.86Š|
| 184 | D | 84.7 | Confident | 92.1 | Very high | 145 Ų | 145 | 61.7 Ų | 61.7 | 78% | 0.775 | 32% | 0.317 | S | S | * | . | S | Bend | trans | -81.1 | -26.2 | -173 | -46.3 | -52.1 | 0 | 0 | 0 | 112.8 | T182 | T182-D184 VanDerWaalsContact C-N 3.29Å; T182-D184 WeakPolarHBondContact CB-OD2 3.35Å; T182-D184 PolarHBondContact OG1-OD2 2.85Å |
| 185 | Q | 85.9 | Confident | 92.2 | Very high | 62 Ų | 62 | 58.4 Ų | 58.4 | 29% | 0.29 | 30% | 0.3 | S | S | . | . | trans | -132.3 | 133.2 | -177.1 | -172.9 | 169 | -0.7 | 0 | 0 | 111.4 | W115 R180 F253 | W115-Q185 VanDerWaalsContact NE1-NE2 3.13Å; R180-Q185 PolarHBondContact NE-O 3.03Å; R180-Q185 PolarHBondContact NH2-O 3.41Å; Q185-F253 HydrophobicContact CB-CD2 4.44Å; Q185-F253 HydrophobicContact CB-CG 4.43Å; Q185-F253 HydrophobicContact CG-CD1 4.21Å; Q185-F253 HydrophobicContact CG-CD2 4.49Å; Q185-F253 HydrophobicContact CG-CE1 3.96Å; Q185-F253 HydrophobicContact CG-CE2 4.25Å; Q185-F253 HydrophobicContact CG-CG 4.47Å; Q185-F253 HydrophobicContact CG-CZ 3.97Å | ||
| 186 | D | 90.5 | Very high | 92.3 | Very high | 93 Ų | 93 | 58.6 Ų | 58.6 | 50% | 0.497 | 30% | 0.301 | S | S | . | . | P | Polyproline II helix | trans | -100.2 | 151.7 | 174.4 | -67.8 | -32.6 | 0 | 0 | 0 | 110.8 | R180 | R180-D186 IonicContact CZ-OD1 2.81Å; R180-D186 IonicContact NE-OD1 3.76Å; R180-D186 PolarHBondContact NE-OD1 2.91Å; R180-D186 IonicContact NH1-OD1 2.94Å; R180-D186 PolarHBondContact NH1-OD1 3.11Å; R180-D186 IonicContact NH2-OD1 2.82Å; R180-D186 PolarHBondContact NH2-OD1 3.12Å |
| 187 | V | 93.1 | Very high | 92.4 | Very high | 2 Ų | 2 | 57.6 Ų | 57.6 | 1% | 0.012 | 30% | 0.296 | C | S | . | . | P | Polyproline II helix | trans | -74.8 | 123.8 | 165.1 | -174.6 | 0 | 0 | 0 | 0 | 108.3 | W172 N176 Y191 Y248 L251 F253 L254 | W172-V187 PolarHBondContact NE1-O 3.26Å; W172-V187 VanDerWaalsContact NE1-O 3.09Å; N176-V187 PolarHBondContact ND2-O 2.85Å; N176-V187 WeakPolarHBondContact OD1-CB 3.42Å; N176-V187 PolarHBondContact OD1-N 3.08Å; V187-Y191 HydrophobicContact CG1-CD1 4.14Å; V187-Y248 HydrophobicContact CG1-CE1 4.25Å; V187-L251 HydrophobicContact CG1-CD2 4.46Å; V187-L251 HydrophobicContact CG2-CD2 4.35Å; V187-F253 HydrophobicContact CG2-CE2 3.67Å; V187-F253 HydrophobicContact CG2-CZ 3.96Å; V187-L254 HydrophobicContact CG2-CD1 4.04Å; V187-L254 HydrophobicContact CG2-CD2 3.83Å; V187-L254 HydrophobicContact CG2-CG 4.31Å |
| 188 | E | 93.1 | Very high | 92.6 | Very high | 85 Ų | 85 | 55 Ų | 55 | 40% | 0.397 | 27% | 0.268 | S | S | . | . | P | Polyproline II helix | trans | -71.8 | 136.8 | 176.8 | -65.6 | 168.3 | -151.9 | 0 | 0 | 110.9 | G190 Y191 C192 | E188-G190 VanDerWaalsContact C-N 3.27Å; E188-G190 PolarHBondContact O-N 2.94Å; E188-Y191 WeakPolarHBondContact O-CB 3.36Å; E188-Y191 PolarHBondContact O-N 3.5Å; E188-Y191 VanDerWaalsContact O-N 3.1Å; E188-C192 PolarHBondContact O-N 3.24Å |
| 189 | W | 94.5 | Very high | 92.9 | Very high | 97 Ų | 97 | 47.4 Ų | 47.4 | 37% | 0.367 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -59.8 | -38.8 | 176.5 | -179.3 | 92.6 | 0 | 0 | 0 | 112.3 | M165 A168 T169 W172 Y191 C192 F193 | M165-W189 HydrophobicContact CB-CZ2 4.49Å; M165-W189 HydrophobicContact CG-CH2 4.37Å; M165-W189 HydrophobicContact CG-CZ2 4.23Å; A168-W189 HydrophobicContact CB-CZ2 4.16Å; T169-W189 PolarHBondContact OG1-NE1 3.1Å; T169-W189 VanDerWaalsContact OG1-NE1 3.17Å; W172-W189 HydrophobicContact CG-CB 4.32Å; W189-Y191 PolarHBondContact O-N 3.35Å; W189-C192 WeakPolarHBondContact O-CB 3.45Å; W189-C192 PolarHBondContact O-N 3.07Å; W189-F193 HydrophobicContact CE3-CB 4.47Å; W189-F193 HydrophobicContact CH2-CB 4.23Å; W189-F193 HydrophobicContact CH2-CD2 4.13Å; W189-F193 HydrophobicContact CH2-CG 4.18Å; W189-F193 HydrophobicContact CZ2-CD2 4.48Å; W189-F193 HydrophobicContact CZ3-CB 4.15Å; W189-F193 HydrophobicContact CZ3-CG 4.39Å; W189-F193 PolarHBondContact O-N 3.29Å |
| 190 | G | 92.7 | Very high | 93.1 | Very high | 32 Ų | 32 | 47.5 Ų | 47.5 | 33% | 0.33 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.1 | -32.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.9 | E188 D194 | E188-G190 VanDerWaalsContact C-N 3.27Å; E188-G190 PolarHBondContact O-N 2.94Å; G190-D194 WeakPolarHBondContact O-CB 3.4Å; G190-D194 PolarHBondContact O-N 3.3Å |
| 191 | Y | 94.6 | Very high | 93.3 | Very high | 1 Ų | 1 | 46.6 Ų | 46.6 | 0% | 0.004 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -67.7 | -43.9 | 172.2 | 178.5 | -95.5 | 0 | 0 | 0 | 111.7 | F105 W115 V187 E188 W189 F193 D194 V195 G247 Y248 L251 | F105-Y191 HydrophobicContact CD1-CE2 4.02Å; F105-Y191 HydrophobicContact CE1-CE2 4.15Å; W115-Y191 HydrophobicContact CB-CD2 3.63Å; W115-Y191 HydrophobicContact CB-CE2 4.09Å; W115-Y191 HydrophobicContact CB-CG 4.16Å; W115-Y191 WeakPolarHBondContact O-CD2 3.36Å; V187-Y191 HydrophobicContact CG1-CD1 4.14Å; E188-Y191 WeakPolarHBondContact O-CB 3.36Å; E188-Y191 PolarHBondContact O-N 3.5Å; E188-Y191 VanDerWaalsContact O-N 3.1Å; W189-Y191 PolarHBondContact O-N 3.35Å; Y191-F193 VanDerWaalsContact C-N 3.29Å; Y191-F193 PolarHBondContact O-N 3.47Å; Y191-D194 PolarHBondContact O-N 2.98Å; Y191-V195 HydrophobicContact CD1-CG2 4.06Å; Y191-V195 HydrophobicContact CE1-CG2 3.46Å; Y191-V195 VanDerWaalsContact CE1-CG2 3.46Å; Y191-V195 HydrophobicContact CE2-CG2 4.2Å; Y191-V195 WeakPolarHBondContact O-CG2 3.3Å; Y191-V195 PolarHBondContact O-N 2.73Å; Y191-G247 WeakPolarHBondContact OH-CA 3.23Å; Y191-G247 PolarHBondContact OH-O 2.83Å; Y191-Y248 HydrophobicContact CE1-CE1 4.37Å; Y191-L251 HydrophobicContact CD1-CD1 4.34Å; Y191-L251 HydrophobicContact CD1-CD2 4.3Å; Y191-L251 HydrophobicContact CE1-CD1 3.47Å; Y191-L251 VanDerWaalsContact CE1-CD1 3.47Å; Y191-L251 HydrophobicContact CE1-CD2 4.15Å; Y191-L251 HydrophobicContact CE1-CG 4.29Å |
| 192 | C | 97 | Very high | 93.7 | Very high | 2 Ų | 2 | 39.4 Ų | 39.4 | 1% | 0.014 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.6 | -40.4 | 175.7 | -60.6 | 0 | 0 | 0 | 0 | 112.1 | A168 W172 E188 W189 V195 H196 Y248 | A168-C192 HydrophobicContact CB-CB 3.98Å; A168-C192 WeakPolarHBondContact O-CB 3.46Å; W172-C192 HydrophobicContact CB-CB 4.5Å; E188-C192 PolarHBondContact O-N 3.24Å; W189-C192 WeakPolarHBondContact O-CB 3.45Å; W189-C192 PolarHBondContact O-N 3.07Å; C192-V195 PolarHBondContact O-N 2.94Å; C192-H196 PolarHBondContact O-N 2.8Å; C192-Y248 WeakPolarHBondContact CA-OH 3.14Å; C192-Y248 WeakPolarHBondContact CB-OH 3.09Å; C192-Y248 PolarHBondContact SG-OH 3.32Å |
| 193 | F | 96.7 | Very high | 94.3 | Very high | 42 Ų | 42 | 37.3 Ų | 37.3 | 18% | 0.184 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.8 | -41.3 | 175.4 | -171.8 | -104.2 | 0 | 0 | 0 | 112.2 | M165 A168 W189 Y191 V195 H196 L197 | M165-F193 HydrophobicContact CG-CE2 4.46Å; A168-F193 HydrophobicContact CB-CB 3.91Å; A168-F193 HydrophobicContact CB-CD2 4.22Å; W189-F193 HydrophobicContact CE3-CB 4.47Å; W189-F193 HydrophobicContact CH2-CB 4.23Å; W189-F193 HydrophobicContact CH2-CD2 4.13Å; W189-F193 HydrophobicContact CH2-CG 4.18Å; W189-F193 HydrophobicContact CZ2-CD2 4.48Å; W189-F193 HydrophobicContact CZ3-CB 4.15Å; W189-F193 HydrophobicContact CZ3-CG 4.39Å; W189-F193 PolarHBondContact O-N 3.29Å; Y191-F193 VanDerWaalsContact C-N 3.29Å; Y191-F193 PolarHBondContact O-N 3.47Å; F193-V195 VanDerWaalsContact C-N 3.34Å; F193-V195 PolarHBondContact O-N 3.1Å; F193-H196 WeakPolarHBondContact O-CB 3.45Å; F193-H196 PolarHBondContact O-N 3.01Å; F193-L197 HydrophobicContact CD1-CD1 4.01Å; F193-L197 HydrophobicContact CD1-CG 4.29Å; F193-L197 HydrophobicContact CE1-CD1 3.66Å; F193-L197 HydrophobicContact CE1-CD2 4.24Å; F193-L197 HydrophobicContact CE1-CG 4Å; F193-L197 HydrophobicContact CZ-CD1 4.4Å; F193-L197 HydrophobicContact CZ-CD2 4.17Å; F193-L197 HydrophobicContact CZ-CG 4.36Å; F193-L197 WeakPolarHBondContact O-CG 3.46Å; F193-L197 PolarHBondContact O-N 3.35Å |
| 194 | D | 95.6 | Very high | 95.1 | Very high | 11 Ų | 11 | 30.7 Ų | 30.7 | 6% | 0.059 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.7 | -38.4 | 174.6 | -176.2 | 45.3 | 0 | 0 | 0 | 112.1 | F105 R117 G190 Y191 H196 L197 N198 | F105-D194 VanDerWaalsContact CE1-OD2 3.28Å; F105-D194 WeakPolarHBondContact CE1-OD2 3.35Å; F105-D194 VanDerWaalsContact CZ-OD2 3.29Å; F105-D194 WeakPolarHBondContact CZ-OD2 3.23Å; R117-D194 HydrophobicContact CB-CB 4.45Å; R117-D194 VanDerWaalsContact CB-CG 3.47Å; R117-D194 WeakPolarHBondContact CB-OD2 3.2Å; R117-D194 IonicContact CZ-OD1 3.81Å; R117-D194 IonicContact CZ-OD2 3.39Å; R117-D194 IonicContact NE-OD1 2.65Å; R117-D194 IonicContact NE-OD2 3.55Å; R117-D194 IonicContact NH1-OD1 3.61Å; R117-D194 PolarHBondContact NH1-OD1 2.81Å; R117-D194 IonicContact NH1-OD2 2.75Å; G190-D194 WeakPolarHBondContact O-CB 3.4Å; G190-D194 PolarHBondContact O-N 3.3Å; Y191-D194 PolarHBondContact O-N 2.98Å; D194-H196 VanDerWaalsContact C-N 3.33Å; D194-H196 PolarHBondContact O-N 3.25Å; D194-L197 PolarHBondContact O-N 2.95Å; D194-N198 PolarHBondContact O-N 3.33Å; D194-N198 PolarHBondContact O-ND2 3.18Å |
| 195 | V | 97.3 | Very high | 95.7 | Very high | 1 Ų | 1 | 25.2 Ų | 25.2 | 1% | 0.006 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60.7 | -42.6 | 172.5 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | Y102 Y191 C192 F193 N198 A199 T244 Y248 | Y102-V195 HydrophobicContact CE1-CG2 4.47Å; Y191-V195 HydrophobicContact CD1-CG2 4.06Å; Y191-V195 HydrophobicContact CE1-CG2 3.46Å; Y191-V195 VanDerWaalsContact CE1-CG2 3.46Å; Y191-V195 HydrophobicContact CE2-CG2 4.2Å; Y191-V195 WeakPolarHBondContact O-CG2 3.3Å; Y191-V195 PolarHBondContact O-N 2.73Å; C192-V195 PolarHBondContact O-N 2.94Å; F193-V195 VanDerWaalsContact C-N 3.34Å; F193-V195 PolarHBondContact O-N 3.1Å; V195-N198 PolarHBondContact O-N 3.27Å; V195-A199 WeakPolarHBondContact O-CB 3.36Å; V195-A199 PolarHBondContact O-N 3.38Å; V195-T244 HydrophobicContact CG1-CG2 4.36Å; V195-Y248 HydrophobicContact CG1-CE2 4.12Å |
| 196 | H | 98 | Very high | 96.3 | Very high | 4 Ų | 4 | 23.9 Ų | 23.9 | 2% | 0.019 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58.6 | -49.3 | 173.3 | 165.3 | 79.4 | 0 | 0 | 0 | 111.6 | C160 T163 G164 C192 F193 D194 N198 A199 F200 Y240 | C160-H196 PolarHBondContact O-NE2 2.75Å; T163-H196 PolarHBondContact OG1-CE1 2.83Å; G164-H196 WeakPolarHBondContact CA-CD2 3.39Å; G164-H196 WeakPolarHBondContact CA-NE2 3.48Å; C192-H196 PolarHBondContact O-N 2.8Å; F193-H196 WeakPolarHBondContact O-CB 3.45Å; F193-H196 PolarHBondContact O-N 3.01Å; D194-H196 VanDerWaalsContact C-N 3.33Å; D194-H196 PolarHBondContact O-N 3.25Å; H196-N198 VanDerWaalsContact C-N 3.29Å; H196-N198 PolarHBondContact O-N 2.98Å; H196-A199 CarbonylContact O-C 3.57Å; H196-A199 PolarHBondContact O-N 3.5Å; H196-A199 VanDerWaalsContact O-N 3.1Å; H196-F200 VanDerWaalsContact O-CB 3.23Å; H196-F200 WeakPolarHBondContact O-CB 3.09Å; H196-F200 PolarHBondContact O-N 2.85Å; H196-Y240 AromaticContact ND1-CE2 3.83Å; H196-Y240 AromaticContact ND1-CZ 3.71Å; H196-Y240 PolarHBondContact ND1-OH 3.04Å |
| 197 | L | 97.3 | Very high | 96.7 | Very high | 10 Ų | 10 | 19.6 Ų | 19.6 | 5% | 0.052 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -61.5 | -37.4 | 179.8 | -65.9 | 180 | 0 | 0 | 0 | 112.4 | F122 L123 L126 F193 D194 F200 F201 | F122-L197 HydrophobicContact CE1-CB 4.16Å; L123-L197 HydrophobicContact CD1-CD1 3.85Å; L126-L197 HydrophobicContact CD2-CB 4.2Å; L126-L197 HydrophobicContact CD2-CD2 3.95Å; F193-L197 HydrophobicContact CD1-CD1 4.01Å; F193-L197 HydrophobicContact CD1-CG 4.29Å; F193-L197 HydrophobicContact CE1-CD1 3.66Å; F193-L197 HydrophobicContact CE1-CD2 4.24Å; F193-L197 HydrophobicContact CE1-CG 4Å; F193-L197 HydrophobicContact CZ-CD1 4.4Å; F193-L197 HydrophobicContact CZ-CD2 4.17Å; F193-L197 HydrophobicContact CZ-CG 4.36Å; F193-L197 WeakPolarHBondContact O-CG 3.46Å; F193-L197 PolarHBondContact O-N 3.35Å; D194-L197 PolarHBondContact O-N 2.95Å; L197-F200 PolarHBondContact O-N 3.47Å; L197-F201 PolarHBondContact O-N 3.3Å |
| 198 | N | 97.1 | Very high | 96.9 | Very high | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -64.2 | -42.8 | 173.4 | -73.7 | -53.1 | 0 | 0 | 0 | 112.2 | L94 R117 D194 V195 H196 F200 P202 I243 | L94-N198 HydrophobicContact CD1-CB 4.17Å; L94-N198 HydrophobicContact CD2-CB 3.93Å; R117-N198 VanDerWaalsContact NH1-CG 3.33Å; R117-N198 PolarHBondContact NH1-ND2 3.47Å; R117-N198 PolarHBondContact NH1-OD1 3.07Å; R117-N198 PolarHBondContact NH2-OD1 2.77Å; D194-N198 PolarHBondContact O-N 3.33Å; D194-N198 PolarHBondContact O-ND2 3.18Å; V195-N198 PolarHBondContact O-N 3.27Å; H196-N198 VanDerWaalsContact C-N 3.29Å; H196-N198 PolarHBondContact O-N 2.98Å; N198-F200 VanDerWaalsContact C-N 3.35Å; N198-P202 WeakPolarHBondContact O-CD 3.49Å; N198-I243 HydrophobicContact CB-CG2 4.04Å |
| 199 | A | 98.3 | Very high | 97.1 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -73.2 | -29.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V195 H196 P202 Y240 I243 | V195-A199 WeakPolarHBondContact O-CB 3.36Å; V195-A199 PolarHBondContact O-N 3.38Å; H196-A199 CarbonylContact O-C 3.57Å; H196-A199 PolarHBondContact O-N 3.5Å; H196-A199 VanDerWaalsContact O-N 3.1Å; A199-P202 WeakPolarHBondContact O-CD 3.42Å; A199-Y240 VanDerWaalsContact C-CD2 3.47Å; A199-Y240 HydrophobicContact CB-CD1 4.29Å; A199-Y240 HydrophobicContact CB-CD2 3.48Å; A199-Y240 VanDerWaalsContact CB-CD2 3.48Å; A199-Y240 HydrophobicContact CB-CE1 4.3Å; A199-Y240 HydrophobicContact CB-CE2 3.5Å; A199-Y240 HydrophobicContact CB-CG 3.87Å; A199-Y240 WeakPolarHBondContact O-CD2 3.48Å; A199-I243 HydrophobicContact CB-CB 3.85Å; A199-I243 HydrophobicContact CB-CG2 3.74Å |
| 200 | F | 98.2 | Very high | 97.2 | Very high | 12 Ų | 12 | 16.3 Ų | 16.3 | 5% | 0.053 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -69.4 | -33.3 | 177.8 | -177.8 | -101.7 | 0 | 0 | 0 | 112.2 | L130 C160 H196 L197 N198 V203 L204 | L130-F200 HydrophobicContact CD2-CE1 3.64Å; L130-F200 HydrophobicContact CD2-CZ 4.03Å; L130-F200 HydrophobicContact CG-CE1 4.45Å; C160-F200 HydrophobicContact CB-CE1 4.02Å; C160-F200 HydrophobicContact CB-CZ 4.02Å; H196-F200 VanDerWaalsContact O-CB 3.23Å; H196-F200 WeakPolarHBondContact O-CB 3.09Å; H196-F200 PolarHBondContact O-N 2.85Å; L197-F200 PolarHBondContact O-N 3.47Å; N198-F200 VanDerWaalsContact C-N 3.35Å; F200-V203 CarbonylContact O-C 3.59Å; F200-V203 WeakPolarHBondContact O-CB 3.46Å; F200-V203 PolarHBondContact O-N 3.17Å; F200-V203 VanDerWaalsContact O-N 3.12Å; F200-L204 HydrophobicContact CE1-CB 4.38Å; F200-L204 HydrophobicContact CE1-CD1 4.21Å; F200-L204 HydrophobicContact CZ-CD1 4.36Å; F200-L204 WeakPolarHBondContact O-CB 3.44Å; F200-L204 PolarHBondContact O-N 2.84Å |
| 201 | F | 97.9 | Very high | 97.4 | Very high | 23 Ų | 23 | 14.8 Ų | 14.8 | 10% | 0.101 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -59.4 | -48.4 | -178.5 | 178.9 | -99.8 | 0 | 0 | 0 | 113.7 | M91 L94 M95 L126 A129 L197 V203 L204 V205 | M91-F201 HydrophobicContact CB-CD1 4.23Å; M91-F201 HydrophobicContact CB-CE1 3.68Å; M91-F201 HydrophobicContact CB-CE2 4.26Å; M91-F201 HydrophobicContact CB-CZ 3.7Å; M91-F201 HydrophobicContact CE-CD2 4.04Å; M91-F201 HydrophobicContact CE-CE2 4.14Å; M91-F201 HydrophobicContact CG-CD1 4.43Å; M91-F201 HydrophobicContact CG-CD2 4.35Å; M91-F201 HydrophobicContact CG-CE1 4.25Å; M91-F201 HydrophobicContact CG-CE2 4.15Å; M91-F201 HydrophobicContact CG-CG 4.48Å; M91-F201 HydrophobicContact CG-CZ 4.1Å; M91-F201 VanDerWaalsContact O-CE1 3.26Å; M91-F201 WeakPolarHBondContact O-CE1 3.41Å; M91-F201 HydrophobicContact SD-CD2 4.24Å; M91-F201 HydrophobicContact SD-CE2 3.8Å; M91-F201 HydrophobicContact SD-CZ 4.13Å; L94-F201 HydrophobicContact CB-CD1 4.27Å; L94-F201 HydrophobicContact CD1-CB 4.3Å; L94-F201 HydrophobicContact CD1-CD1 4.35Å; M95-F201 HydrophobicContact CG-CD1 4.34Å; M95-F201 HydrophobicContact CG-CE1 3.81Å; M95-F201 HydrophobicContact SD-CD1 4.28Å; M95-F201 HydrophobicContact SD-CE1 4.15Å; L126-F201 HydrophobicContact CD1-CB 4.28Å; L126-F201 HydrophobicContact CD1-CD2 3.83Å; A129-F201 HydrophobicContact CB-CE2 4.31Å; L197-F201 PolarHBondContact O-N 3.3Å; F201-V203 VanDerWaalsContact C-N 3.32Å; F201-V203 PolarHBondContact O-N 2.81Å; F201-L204 VanDerWaalsContact O-CB 3.3Å; F201-L204 WeakPolarHBondContact O-CB 3.35Å; F201-L204 PolarHBondContact O-N 3.29Å; F201-V205 HydrophobicContact CE1-CG2 4.11Å; F201-V205 HydrophobicContact CE2-CG2 4.36Å; F201-V205 HydrophobicContact CZ-CG2 3.99Å; F201-V205 WeakPolarHBondContact O-CG2 3.34Å; F201-V205 PolarHBondContact O-N 3.44Å |
| 202 | P | 98.4 | Very high | 97.4 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -59.5 | -39 | 171.7 | -27.2 | 35.4 | 0 | 0 | 0 | 114.2 | L94 M95 N198 A199 L204 V205 F206 Y239 I243 | L94-P202 HydrophobicContact CB-CG 4.31Å; M95-P202 VanDerWaalsContact SD-CA 3.55Å; M95-P202 HydrophobicContact SD-CB 3.8Å; M95-P202 HydrophobicContact SD-CG 3.99Å; N198-P202 WeakPolarHBondContact O-CD 3.49Å; A199-P202 WeakPolarHBondContact O-CD 3.42Å; P202-L204 VanDerWaalsContact C-N 3.31Å; P202-L204 PolarHBondContact O-N 3.36Å; P202-V205 PolarHBondContact O-N 3.26Å; P202-F206 WeakPolarHBondContact O-CD2 3.2Å; P202-F206 PolarHBondContact O-N 3.04Å; P202-Y239 HydrophobicContact CB-CD1 4.09Å; P202-Y239 HydrophobicContact CB-CG 4.38Å; P202-Y239 HydrophobicContact CG-CD1 4.32Å; P202-I243 HydrophobicContact CG-CG1 4.49Å |
| 203 | V | 98.3 | Very high | 97.3 | Very high | 21 Ų | 21 | 19.4 Ų | 19.4 | 13% | 0.127 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -61.4 | -42.6 | 175.6 | 176.8 | 0 | 0 | 0 | 0 | 110.9 | F200 F201 V205 F206 L207 A236 Y240 | F200-V203 CarbonylContact O-C 3.59Å; F200-V203 WeakPolarHBondContact O-CB 3.46Å; F200-V203 PolarHBondContact O-N 3.17Å; F200-V203 VanDerWaalsContact O-N 3.12Å; F201-V203 VanDerWaalsContact C-N 3.32Å; F201-V203 PolarHBondContact O-N 2.81Å; V203-V205 VanDerWaalsContact C-N 3.35Å; V203-V205 PolarHBondContact O-N 2.91Å; V203-F206 PolarHBondContact O-N 3.1Å; V203-L207 HydrophobicContact CG1-CD1 3.7Å; V203-L207 HydrophobicContact CG1-CG 4.24Å; V203-L207 VanDerWaalsContact O-CB 3.31Å; V203-L207 WeakPolarHBondContact O-CB 3.41Å; V203-L207 PolarHBondContact O-N 3.32Å; V203-A236 HydrophobicContact CG2-CB 4.37Å; V203-A236 WeakPolarHBondContact CG2-O 3.48Å; V203-Y240 HydrophobicContact CG2-CD2 3.79Å; V203-Y240 HydrophobicContact CG2-CG 4.22Å |
| 204 | L | 98 | Very high | 97.1 | Very high | 2 Ų | 2 | 19.6 Ų | 19.6 | 1% | 0.01 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -57.3 | -48.2 | 174.6 | -173.7 | 69.2 | 0 | 0 | 0 | 110.8 | L126 A129 L130 S133 F200 F201 P202 H208 V209 | L126-L204 HydrophobicContact CD1-CD2 4.15Å; A129-L204 HydrophobicContact CB-CD2 3.92Å; L130-L204 HydrophobicContact CD2-CD1 3.49Å; L130-L204 VanDerWaalsContact CD2-CD1 3.49Å; L130-L204 HydrophobicContact CD2-CD2 4Å; L130-L204 HydrophobicContact CD2-CG 4.39Å; L130-L204 HydrophobicContact CG-CD1 4.5Å; L130-L204 HydrophobicContact CG-CD2 4.17Å; S133-L204 WeakPolarHBondContact OG-CD1 3.27Å; F200-L204 HydrophobicContact CE1-CB 4.38Å; F200-L204 HydrophobicContact CE1-CD1 4.21Å; F200-L204 HydrophobicContact CZ-CD1 4.36Å; F200-L204 WeakPolarHBondContact O-CB 3.44Å; F200-L204 PolarHBondContact O-N 2.84Å; F201-L204 VanDerWaalsContact O-CB 3.3Å; F201-L204 WeakPolarHBondContact O-CB 3.35Å; F201-L204 PolarHBondContact O-N 3.29Å; P202-L204 VanDerWaalsContact C-N 3.31Å; P202-L204 PolarHBondContact O-N 3.36Å; L204-H208 HydrophobicContact CD1-CB 3.75Å; L204-H208 HydrophobicContact CG-CB 4.42Å; L204-H208 CarbonylContact O-C 3.56Å; L204-H208 VanDerWaalsContact O-CA 3.28Å; L204-H208 WeakPolarHBondContact O-CA 3.26Å; L204-H208 VanDerWaalsContact O-CB 3.25Å; L204-H208 WeakPolarHBondContact O-CB 3.5Å; L204-H208 PolarHBondContact O-N 3.37Å; L204-V209 PolarHBondContact O-N 2.82Å |
| 205 | V | 98.2 | Very high | 96.9 | Very high | 30 Ų | 30 | 19.8 Ų | 19.8 | 18% | 0.182 | 10% | 0.104 | C | C | . | . | I | π-helix | trans | -62.7 | -50.1 | 179.3 | 177.1 | 0 | 0 | 0 | 0 | 111.4 | M95 F201 P202 V203 V209 I210 | M95-V205 HydrophobicContact CE-CB 3.75Å; M95-V205 HydrophobicContact CE-CG1 3.56Å; M95-V205 HydrophobicContact CE-CG2 4.17Å; M95-V205 HydrophobicContact SD-CB 4.03Å; M95-V205 HydrophobicContact SD-CG1 4.4Å; M95-V205 HydrophobicContact SD-CG2 3.91Å; F201-V205 HydrophobicContact CE1-CG2 4.11Å; F201-V205 HydrophobicContact CE2-CG2 4.36Å; F201-V205 HydrophobicContact CZ-CG2 3.99Å; F201-V205 WeakPolarHBondContact O-CG2 3.34Å; F201-V205 PolarHBondContact O-N 3.44Å; P202-V205 PolarHBondContact O-N 3.26Å; V203-V205 VanDerWaalsContact C-N 3.35Å; V203-V205 PolarHBondContact O-N 2.91Å; V205-V209 VanDerWaalsContact O-CB 3.29Å; V205-V209 WeakPolarHBondContact O-CB 3.39Å; V205-V209 PolarHBondContact O-N 3.49Å; V205-I210 HydrophobicContact CG1-CD1 4.24Å; V205-I210 PolarHBondContact O-N 3.29Å |
| 206 | F | 98.4 | Very high | 96.5 | Very high | 33 Ų | 33 | 22.8 Ų | 22.8 | 15% | 0.145 | 12% | 0.124 | C | C | . | . | I | π-helix | trans | -67.4 | -42.2 | -177.9 | -75.8 | -66.8 | 0 | 0 | 0 | 112.8 | M95 P202 V203 I210 L211 L232 I235 A236 Y239 | M95-F206 HydrophobicContact CE-CE2 4.01Å; M95-F206 HydrophobicContact CE-CZ 4.27Å; P202-F206 WeakPolarHBondContact O-CD2 3.2Å; P202-F206 PolarHBondContact O-N 3.04Å; V203-F206 PolarHBondContact O-N 3.1Å; F206-I210 HydrophobicContact CD1-CD1 3.8Å; F206-I210 HydrophobicContact CE1-CD1 4.09Å; F206-L211 WeakPolarHBondContact O-CB 3.32Å; F206-L211 PolarHBondContact O-N 2.8Å; F206-L232 HydrophobicContact CD1-CD2 3.98Å; F206-I235 HydrophobicContact CD1-CG2 4.25Å; F206-I235 HydrophobicContact CD2-CG2 4.2Å; F206-I235 HydrophobicContact CE1-CG2 3.84Å; F206-I235 HydrophobicContact CE2-CG2 3.79Å; F206-I235 HydrophobicContact CG-CG2 4.44Å; F206-I235 HydrophobicContact CZ-CG2 3.6Å; F206-A236 HydrophobicContact CB-CB 3.85Å; F206-A236 HydrophobicContact CD2-CB 4.45Å; F206-A236 HydrophobicContact CG-CB 4.46Å; F206-Y239 HydrophobicContact CE2-CD2 4.26Å; F206-Y239 HydrophobicContact CE2-CG 4.49Å |
| 207 | L | 97.7 | Very high | 96.1 | Very high | 4 Ų | 4 | 28.4 Ų | 28.4 | 2% | 0.021 | 16% | 0.159 | C | C | . | . | I | π-helix | trans | -100.7 | -20.3 | -169.2 | -55.8 | -174.2 | 0 | 0 | 0 | 114.8 | Y137 V203 L211 P212 L232 W233 A236 | Y137-L207 VanDerWaalsContact CE2-O 3.23Å; Y137-L207 WeakPolarHBondContact CE2-O 3.45Å; Y137-L207 PolarHBondContact OH-O 3.06Å; V203-L207 HydrophobicContact CG1-CD1 3.7Å; V203-L207 HydrophobicContact CG1-CG 4.24Å; V203-L207 VanDerWaalsContact O-CB 3.31Å; V203-L207 WeakPolarHBondContact O-CB 3.41Å; V203-L207 PolarHBondContact O-N 3.32Å; L207-L211 HydrophobicContact CD2-CD2 4.29Å; L207-P212 WeakPolarHBondContact O-CD 3.44Å; L207-L232 HydrophobicContact CD2-CB 4.48Å; L207-W233 HydrophobicContact CD1-CD2 3.87Å; L207-W233 HydrophobicContact CD1-CE3 3.55Å; L207-W233 HydrophobicContact CD1-CH2 3.6Å; L207-W233 HydrophobicContact CD1-CZ2 3.87Å; L207-W233 HydrophobicContact CD1-CZ3 3.43Å; L207-W233 VanDerWaalsContact CD1-CZ3 3.43Å; L207-W233 HydrophobicContact CD2-CD2 3.96Å; L207-W233 HydrophobicContact CD2-CE3 4.42Å; L207-W233 HydrophobicContact CD2-CG 4.09Å; L207-A236 HydrophobicContact CD1-CB 3.96Å; L207-A236 HydrophobicContact CD2-CB 3.92Å; L207-A236 HydrophobicContact CG-CB 3.74Å |
| 208 | H | 96.5 | Very high | 95.8 | Very high | 12 Ų | 12 | 29.1 Ų | 29.1 | 6% | 0.056 | 16% | 0.162 | C | C | . | . | I | π-helix | trans | -116.1 | -7.8 | 179.6 | -56.7 | 65 | 0 | 0 | 0 | 114.3 | Y137 L204 P212 | Y137-H208 HydrophobicContact CD2-CB 4.05Å; Y137-H208 AromaticContact CD2-CD2 3.96Å; Y137-H208 HydrophobicContact CE2-CB 3.97Å; Y137-H208 AromaticContact CE2-CD2 3.83Å; Y137-H208 AromaticContact CE2-CG 3.88Å; L204-H208 HydrophobicContact CD1-CB 3.75Å; L204-H208 HydrophobicContact CG-CB 4.42Å; L204-H208 CarbonylContact O-C 3.56Å; L204-H208 VanDerWaalsContact O-CA 3.28Å; L204-H208 WeakPolarHBondContact O-CA 3.26Å; L204-H208 VanDerWaalsContact O-CB 3.25Å; L204-H208 WeakPolarHBondContact O-CB 3.5Å; L204-H208 PolarHBondContact O-N 3.37Å; H208-P212 VanDerWaalsContact O-CG 3.31Å; H208-P212 WeakPolarHBondContact O-CG 3.32Å |
| 209 | V | 97.4 | Very high | 94.9 | Very high | 45 Ų | 45 | 34.6 Ų | 34.6 | 27% | 0.273 | 19% | 0.191 | S | C | . | . | I | π-helix | trans | -113.9 | -60.9 | 170.8 | -175.4 | 0 | 0 | 0 | 0 | 110.1 | L136 L204 V205 I213 | L136-V209 HydrophobicContact CD1-CB 4.41Å; L136-V209 HydrophobicContact CD1-CG1 3.91Å; L136-V209 HydrophobicContact CD1-CG2 4.41Å; L204-V209 PolarHBondContact O-N 2.82Å; V205-V209 VanDerWaalsContact O-CB 3.29Å; V205-V209 WeakPolarHBondContact O-CB 3.39Å; V205-V209 PolarHBondContact O-N 3.49Å; V209-I213 HydrophobicContact CG1-CD1 4.38Å; V209-I213 VanDerWaalsContact O-CD1 3.27Å; V209-I213 WeakPolarHBondContact O-CD1 3.45Å; V209-I213 VanDerWaalsContact O-CG1 3.26Å; V209-I213 WeakPolarHBondContact O-CG1 3.34Å |
| 210 | I | 97.5 | Very high | 94.2 | Very high | 57 Ų | 57 | 38.1 Ų | 38.1 | 29% | 0.292 | 23% | 0.228 | S | C | . | . | I | π-helix | trans | -71.2 | -49.4 | -173.7 | -61.3 | 172.9 | 0 | 0 | 0 | 111.3 | V205 F206 I213 V214 L232 | V205-I210 HydrophobicContact CG1-CD1 4.24Å; V205-I210 PolarHBondContact O-N 3.29Å; F206-I210 HydrophobicContact CD1-CD1 3.8Å; F206-I210 HydrophobicContact CE1-CD1 4.09Å; I210-I213 PolarHBondContact O-N 2.86Å; I210-V214 HydrophobicContact CG2-CG2 3.87Å; I210-V214 WeakPolarHBondContact O-CB 3.38Å; I210-V214 WeakPolarHBondContact O-CG2 3.38Å; I210-V214 PolarHBondContact O-N 3.22Å; I210-L232 HydrophobicContact CG2-CD1 4.14Å; I210-L232 HydrophobicContact CG2-CD2 3.85Å |
| 211 | L | 96.2 | Very high | 93.9 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -56.8 | -50.3 | -177.7 | -177.9 | 66.9 | 0 | 0 | 0 | 113.8 | F206 L207 I213 V214 Y215 L232 S282 F286 | F206-L211 WeakPolarHBondContact O-CB 3.32Å; F206-L211 PolarHBondContact O-N 2.8Å; L207-L211 HydrophobicContact CD2-CD2 4.29Å; L211-I213 PolarHBondContact O-N 3.13Å; L211-V214 PolarHBondContact O-N 3.31Å; L211-Y215 HydrophobicContact CD1-CD2 4.29Å; L211-Y215 HydrophobicContact CD1-CG 4.49Å; L211-Y215 WeakPolarHBondContact O-CB 3.38Å; L211-Y215 PolarHBondContact O-N 3.27Å; L211-L232 HydrophobicContact CB-CD1 4.2Å; L211-L232 HydrophobicContact CD1-CD1 3.83Å; L211-S282 VanDerWaalsContact CD1-OG 3.29Å; L211-S282 WeakPolarHBondContact CD1-OG 3.35Å; L211-F286 HydrophobicContact CD2-CE2 4.33Å; L211-F286 HydrophobicContact CG-CE2 4.27Å |
| 212 | P | 94.9 | Very high | 93.4 | Very high | 5 Ų | 5 | 45.3 Ų | 45.3 | 3% | 0.032 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -68 | -16.8 | 179.4 | 25.6 | -34.6 | 0 | 0 | 0 | 115.1 | Y137 S140 L207 H208 P216 F286 | Y137-P212 HydrophobicContact CD1-CB 4.09Å; Y137-P212 HydrophobicContact CD2-CB 4.32Å; Y137-P212 HydrophobicContact CD2-CG 3.98Å; Y137-P212 HydrophobicContact CE1-CB 4.09Å; Y137-P212 HydrophobicContact CE2-CB 4.38Å; Y137-P212 HydrophobicContact CE2-CG 4.01Å; Y137-P212 HydrophobicContact CG-CB 4.18Å; Y137-P212 HydrophobicContact CG-CG 4.31Å; S140-P212 PolarHBondContact OG-O 3.44Å; L207-P212 WeakPolarHBondContact O-CD 3.44Å; H208-P212 VanDerWaalsContact O-CG 3.31Å; H208-P212 WeakPolarHBondContact O-CG 3.32Å; P212-P216 WeakPolarHBondContact O-CD 3.48Å; P212-P216 VanDerWaalsContact O-CG 3.27Å; P212-P216 WeakPolarHBondContact O-CG 3.44Å; P212-F286 HydrophobicContact CB-CZ 4.31Å |
| 213 | I | 94.8 | Very high | 93.1 | Very high | 95 Ų | 95 | 49.1 Ų | 49.1 | 49% | 0.487 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -81.3 | -47 | 171.1 | -65.9 | 170 | 0 | 0 | 0 | 110.3 | V209 I210 L211 | V209-I213 HydrophobicContact CG1-CD1 4.38Å; V209-I213 VanDerWaalsContact O-CD1 3.27Å; V209-I213 WeakPolarHBondContact O-CD1 3.45Å; V209-I213 VanDerWaalsContact O-CG1 3.26Å; V209-I213 WeakPolarHBondContact O-CG1 3.34Å; I210-I213 PolarHBondContact O-N 2.86Å; L211-I213 PolarHBondContact O-N 3.13Å |
| 214 | V | 93.8 | Very high | 92.8 | Very high | 45 Ų | 45 | 51.4 Ų | 51.4 | 27% | 0.273 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -76.7 | -41.7 | -173.3 | 172.9 | 0 | 0 | 0 | 0 | 111.9 | I210 L211 V217 L218 V228 | I210-V214 HydrophobicContact CG2-CG2 3.87Å; I210-V214 WeakPolarHBondContact O-CB 3.38Å; I210-V214 WeakPolarHBondContact O-CG2 3.38Å; I210-V214 PolarHBondContact O-N 3.22Å; L211-V214 PolarHBondContact O-N 3.31Å; V214-V217 WeakPolarHBondContact O-CB 3.5Å; V214-V217 PolarHBondContact O-N 3.22Å; V214-L218 HydrophobicContact CG1-CD1 3.61Å; V214-L218 HydrophobicContact CG1-CG 4.08Å; V214-L218 WeakPolarHBondContact O-CG 3.47Å; V214-L218 PolarHBondContact O-N 3.2Å; V214-V228 HydrophobicContact CG1-CG1 3.77Å |
| 215 | Y | 90.9 | Very high | 92.5 | Very high | 15 Ų | 15 | 51.6 Ų | 51.6 | 6% | 0.059 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.6 | -44.8 | -169.9 | -161.7 | -108.4 | 0 | 0 | 0 | 114.1 | L211 V217 L218 N219 S280 S282 E283 F286 | L211-Y215 HydrophobicContact CD1-CD2 4.29Å; L211-Y215 HydrophobicContact CD1-CG 4.49Å; L211-Y215 WeakPolarHBondContact O-CB 3.38Å; L211-Y215 PolarHBondContact O-N 3.27Å; Y215-V217 VanDerWaalsContact C-N 3.26Å; Y215-V217 PolarHBondContact O-N 3.05Å; Y215-L218 PolarHBondContact O-N 3.42Å; Y215-L218 VanDerWaalsContact O-N 3.11Å; Y215-N219 PolarHBondContact O-N 3.39Å; Y215-S280 PolarHBondContact OH-OG 2.89Å; Y215-S282 VanDerWaalsContact CE2-CB 3.49Å; Y215-E283 WeakPolarHBondContact OH-CA 3.18Å; Y215-E283 VanDerWaalsContact OH-CB 3.29Å; Y215-E283 WeakPolarHBondContact OH-CB 3.38Å; Y215-E283 PolarHBondContact OH-N 3.05Å; Y215-E283 PolarHBondContact OH-OE2 3.3Å; Y215-F286 HydrophobicContact CD1-CD1 4.27Å; Y215-F286 HydrophobicContact CD1-CD2 4.01Å; Y215-F286 HydrophobicContact CD1-CE1 4.27Å; Y215-F286 AromaticContact CD1-CE2 3.99Å; Y215-F286 HydrophobicContact CD1-CE2 3.99Å; Y215-F286 HydrophobicContact CD1-CG 4.15Å; Y215-F286 HydrophobicContact CD1-CZ 4.13Å; Y215-F286 HydrophobicContact CE1-CD2 4.4Å; Y215-F286 HydrophobicContact CE1-CG 4.38Å; Y215-F286 HydrophobicContact CG-CE2 4.31Å; Y215-F286 HydrophobicContact CG-CZ 4.5Å |
| 216 | P | 88.2 | Confident | 92.3 | Very high | 64 Ų | 64 | 50.3 Ų | 50.3 | 42% | 0.416 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.8 | -33.5 | 176 | -24.1 | 35.5 | 0 | 0 | 0 | 113.4 | S140 P212 L218 N219 | S140-P216 VanDerWaalsContact OG-CG 3.24Å; S140-P216 WeakPolarHBondContact OG-CG 3.29Å; P212-P216 WeakPolarHBondContact O-CD 3.48Å; P212-P216 VanDerWaalsContact O-CG 3.27Å; P212-P216 WeakPolarHBondContact O-CG 3.44Å; P216-L218 VanDerWaalsContact C-N 3.29Å; P216-L218 PolarHBondContact O-N 3.13Å; P216-N219 WeakPolarHBondContact O-CB 3.41Å; P216-N219 PolarHBondContact O-N 3.39Å |
| 217 | V | 90.2 | Very high | 92.1 | Very high | 123 Ų | 123 | 52.1 Ų | 52.1 | 75% | 0.745 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -68.6 | -31.1 | 178.4 | 179.3 | 0 | 0 | 0 | 0 | 111.3 | V214 Y215 | V214-V217 WeakPolarHBondContact O-CB 3.5Å; V214-V217 PolarHBondContact O-N 3.22Å; Y215-V217 VanDerWaalsContact C-N 3.26Å; Y215-V217 PolarHBondContact O-N 3.05Å |
| 218 | L | 90.3 | Very high | 92 | Very high | 25 Ų | 25 | 54.1 Ų | 54.1 | 13% | 0.131 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -86.9 | -10.9 | -178.5 | -61.3 | -179.2 | 0 | 0 | 0 | 113.7 | V214 Y215 P216 G220 I221 L224 S225 V228 | V214-L218 HydrophobicContact CG1-CD1 3.61Å; V214-L218 HydrophobicContact CG1-CG 4.08Å; V214-L218 WeakPolarHBondContact O-CG 3.47Å; V214-L218 PolarHBondContact O-N 3.2Å; Y215-L218 PolarHBondContact O-N 3.42Å; Y215-L218 VanDerWaalsContact O-N 3.11Å; P216-L218 VanDerWaalsContact C-N 3.29Å; P216-L218 PolarHBondContact O-N 3.13Å; L218-G220 PolarHBondContact O-N 3.02Å; L218-I221 PolarHBondContact O-N 3.02Å; L218-L224 HydrophobicContact CD2-CD2 3.76Å; L218-L224 HydrophobicContact CD2-CG 4.04Å; L218-S225 WeakPolarHBondContact CB-OG 3.05Å; L218-S225 PolarHBondContact O-OG 3.45Å; L218-V228 HydrophobicContact CD1-CB 3.55Å; L218-V228 HydrophobicContact CD1-CG1 3.7Å; L218-V228 HydrophobicContact CD1-CG2 3.87Å |
| 219 | N | 79 | Confident | 92 | Very high | 114 Ų | 114 | 53.6 Ų | 53.6 | 61% | 0.61 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49 | -29.1 | -170.8 | -168 | 31.2 | 0 | 0 | 0 | 114.8 | Y215 P216 I221 | Y215-N219 PolarHBondContact O-N 3.39Å; P216-N219 WeakPolarHBondContact O-CB 3.41Å; P216-N219 PolarHBondContact O-N 3.39Å; N219-I221 VanDerWaalsContact C-N 3.31Å; N219-I221 PolarHBondContact O-N 3.22Å |
| 220 | G | 83.8 | Confident | 92 | Very high | 74 Ų | 74 | 51.6 Ų | 51.6 | 76% | 0.763 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | -9.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | L218 | L218-G220 PolarHBondContact O-N 3.02Š|
| 221 | I | 92 | Very high | 92 | Very high | 93 Ų | 93 | 50.4 Ų | 50.4 | 48% | 0.477 | 30% | 0.304 | S | S | . | . | trans | -131.8 | 86.7 | -172.8 | -48.9 | 176.1 | 0 | 0 | 0 | 110 | L218 N219 L223 L224 S225 | L218-I221 PolarHBondContact O-N 3.02Å; N219-I221 VanDerWaalsContact C-N 3.31Å; N219-I221 PolarHBondContact O-N 3.22Å; I221-L223 VanDerWaalsContact C-N 3.31Å; I221-L223 PolarHBondContact O-N 3.43Å; I221-L223 VanDerWaalsContact O-N 3.14Å; I221-L224 HydrophobicContact CB-CB 3.96Å; I221-L224 HydrophobicContact CD1-CD2 4.13Å; I221-L224 HydrophobicContact CG2-CB 3.57Å; I221-L224 PolarHBondContact O-N 2.91Å; I221-S225 PolarHBondContact O-N 3.05Å; I221-S225 PolarHBondContact O-OG 3.22Å | ||
| 222 | P | 87.8 | Confident | 92.1 | Very high | 94 Ų | 94 | 51.2 Ų | 51.2 | 61% | 0.61 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -56.7 | -39.3 | -168.5 | -28.3 | 34.6 | 0 | 0 | 0 | 114.7 | C226 | P222-C226 VanDerWaalsContact O-CB 3.25Å; P222-C226 WeakPolarHBondContact O-CB 3.39Å; P222-C226 PolarHBondContact O-N 3.2Å |
| 223 | L | 90.6 | Very high | 92.2 | Very high | 80 Ų | 80 | 54 Ų | 54 | 42% | 0.419 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66.8 | -42.9 | 178.3 | 178.7 | 57.7 | 0 | 0 | 0 | 111.7 | I221 C226 L227 | I221-L223 VanDerWaalsContact C-N 3.31Å; I221-L223 PolarHBondContact O-N 3.43Å; I221-L223 VanDerWaalsContact O-N 3.14Å; L223-C226 PolarHBondContact O-N 2.91Å; L223-L227 HydrophobicContact CD1-CD1 4.04Å; L223-L227 HydrophobicContact CD1-CG 4.21Å; L223-L227 HydrophobicContact CG-CD1 3.98Å; L223-L227 WeakPolarHBondContact O-CB 3.33Å; L223-L227 VanDerWaalsContact O-CG 3.32Å; L223-L227 WeakPolarHBondContact O-CG 3.34Å; L223-L227 PolarHBondContact O-N 3.35Å |
| 224 | L | 92.4 | Very high | 92.4 | Very high | 69 Ų | 69 | 51.4 Ų | 51.4 | 36% | 0.361 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -69.6 | -41.9 | -179.6 | -174.5 | 62.4 | 0 | 0 | 0 | 110.9 | L218 I221 C226 L227 V228 | L218-L224 HydrophobicContact CD2-CD2 3.76Å; L218-L224 HydrophobicContact CD2-CG 4.04Å; I221-L224 HydrophobicContact CB-CB 3.96Å; I221-L224 HydrophobicContact CD1-CD2 4.13Å; I221-L224 HydrophobicContact CG2-CB 3.57Å; I221-L224 PolarHBondContact O-N 2.91Å; L224-C226 VanDerWaalsContact C-N 3.3Å; L224-C226 PolarHBondContact O-N 3.49Å; L224-L227 PolarHBondContact O-N 3.33Å; L224-V228 HydrophobicContact CD1-CG2 3.88Å; L224-V228 HydrophobicContact CG-CG2 4.24Å; L224-V228 WeakPolarHBondContact O-CB 3.28Å; L224-V228 WeakPolarHBondContact O-CG2 3.36Å; L224-V228 PolarHBondContact O-N 3.02Å |
| 225 | S | 91.7 | Very high | 92.6 | Very high | 5 Ų | 5 | 52.4 Ų | 52.4 | 4% | 0.035 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -57.2 | -43.9 | 172.7 | -60.3 | 0 | 0 | 0 | 0 | 112.3 | L218 I221 G229 | L218-S225 WeakPolarHBondContact CB-OG 3.05Å; L218-S225 PolarHBondContact O-OG 3.45Å; I221-S225 PolarHBondContact O-N 3.05Å; I221-S225 PolarHBondContact O-OG 3.22Å; S225-G229 WeakPolarHBondContact O-CA 3.24Å; S225-G229 PolarHBondContact O-N 3.38Å |
| 226 | C | 93.3 | Very high | 93 | Very high | 4 Ų | 4 | 51.7 Ų | 51.7 | 3% | 0.027 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64 | -49.9 | 177.3 | -176.7 | 0 | 0 | 0 | 0 | 111.1 | P222 L223 L224 N230 | P222-C226 VanDerWaalsContact O-CB 3.25Å; P222-C226 WeakPolarHBondContact O-CB 3.39Å; P222-C226 PolarHBondContact O-N 3.2Å; L223-C226 PolarHBondContact O-N 2.91Å; L224-C226 VanDerWaalsContact C-N 3.3Å; L224-C226 PolarHBondContact O-N 3.49Å; C226-N230 WeakPolarHBondContact O-CB 3.26Å; C226-N230 PolarHBondContact O-N 2.9Å; C226-N230 PolarHBondContact O-OD1 3.37Å |
| 227 | L | 95.1 | Very high | 93.5 | Very high | 70 Ų | 70 | 50.6 Ų | 50.6 | 37% | 0.366 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.6 | -52.2 | 179.4 | -74.1 | 166.9 | 0 | 0 | 0 | 112.3 | L223 L224 A231 L275 | L223-L227 HydrophobicContact CD1-CD1 4.04Å; L223-L227 HydrophobicContact CD1-CG 4.21Å; L223-L227 HydrophobicContact CG-CD1 3.98Å; L223-L227 WeakPolarHBondContact O-CB 3.33Å; L223-L227 VanDerWaalsContact O-CG 3.32Å; L223-L227 WeakPolarHBondContact O-CG 3.34Å; L223-L227 PolarHBondContact O-N 3.35Å; L224-L227 PolarHBondContact O-N 3.33Å; L227-A231 WeakPolarHBondContact O-CB 3.13Å; L227-A231 PolarHBondContact O-N 2.96Å; L227-L275 HydrophobicContact CD2-CD1 3.8Å; L227-L275 HydrophobicContact CD2-CD2 3.67Å; L227-L275 HydrophobicContact CD2-CG 4.29Å; L227-L275 HydrophobicContact CG-CD2 4.43Å |
| 228 | V | 95.8 | Very high | 93.9 | Very high | 47 Ų | 47 | 45.6 Ų | 45.6 | 29% | 0.285 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -69.5 | -43.1 | -177 | 176.2 | 0 | 0 | 0 | 0 | 111.1 | V214 L218 L224 A231 L232 | V214-V228 HydrophobicContact CG1-CG1 3.77Å; L218-V228 HydrophobicContact CD1-CB 3.55Å; L218-V228 HydrophobicContact CD1-CG1 3.7Å; L218-V228 HydrophobicContact CD1-CG2 3.87Å; L224-V228 HydrophobicContact CD1-CG2 3.88Å; L224-V228 HydrophobicContact CG-CG2 4.24Å; L224-V228 WeakPolarHBondContact O-CB 3.28Å; L224-V228 WeakPolarHBondContact O-CG2 3.36Å; L224-V228 PolarHBondContact O-N 3.02Å; V228-A231 PolarHBondContact O-N 2.91Å; V228-L232 HydrophobicContact CG1-CD1 4.4Å; V228-L232 WeakPolarHBondContact O-CG 3.48Å; V228-L232 PolarHBondContact O-N 3.23Å |
| 229 | G | 96 | Very high | 94.2 | Very high | 1 Ų | 1 | 47.8 Ų | 47.8 | 1% | 0.01 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.9 | -51 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S225 A231 L232 W233 S282 | S225-G229 WeakPolarHBondContact O-CA 3.24Å; S225-G229 PolarHBondContact O-N 3.38Å; G229-A231 VanDerWaalsContact C-N 3.3Å; G229-A231 PolarHBondContact O-N 3.38Å; G229-L232 PolarHBondContact O-N 3.43Å; G229-W233 VanDerWaalsContact O-CD1 3.3Å; G229-W233 PolarHBondContact O-N 3.09Å; G229-W233 VanDerWaalsContact O-N 3.09Å; G229-S282 WeakPolarHBondContact CA-OG 3.3Å |
| 230 | N | 97.1 | Very high | 95.2 | Very high | 3 Ų | 3 | 44.1 Ų | 44.1 | 2% | 0.016 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.2 | -32.3 | 179.4 | -65.3 | -1.5 | 0 | 0 | 0 | 111.8 | C226 W233 F234 F271 S274 L275 W279 V281 | C226-N230 WeakPolarHBondContact O-CB 3.26Å; C226-N230 PolarHBondContact O-N 2.9Å; C226-N230 PolarHBondContact O-OD1 3.37Å; N230-W233 PolarHBondContact O-N 3.46Å; N230-F234 WeakPolarHBondContact O-CB 3.38Å; N230-F234 PolarHBondContact O-N 3.43Å; N230-F271 HydrophobicContact CB-CD2 4.04Å; N230-F271 HydrophobicContact CB-CE2 3.9Å; N230-S274 WeakPolarHBondContact ND2-CB 3.4Å; N230-S274 PolarHBondContact ND2-OG 3.31Å; N230-L275 HydrophobicContact CB-CD2 4.22Å; N230-W279 PolarHBondContact ND2-O 3.21Å; N230-V281 PolarHBondContact OD1-N 3.46Å |
| 231 | A | 97.8 | Very high | 95.9 | Very high | 32 Ų | 32 | 41.3 Ų | 41.3 | 26% | 0.264 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -65.6 | -41.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L227 V228 G229 F234 I235 F271 | L227-A231 WeakPolarHBondContact O-CB 3.13Å; L227-A231 PolarHBondContact O-N 2.96Å; V228-A231 PolarHBondContact O-N 2.91Å; G229-A231 VanDerWaalsContact C-N 3.3Å; G229-A231 PolarHBondContact O-N 3.38Å; A231-F234 PolarHBondContact O-N 3.01Å; A231-I235 WeakPolarHBondContact O-CB 3.47Å; A231-I235 VanDerWaalsContact O-CG1 3.24Å; A231-I235 WeakPolarHBondContact O-CG1 3.41Å; A231-I235 PolarHBondContact O-N 2.76Å; A231-F271 HydrophobicContact CB-CE2 4.35Å |
| 232 | L | 98 | Very high | 96.2 | Very high | 17 Ų | 17 | 39.9 Ų | 39.9 | 9% | 0.089 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.9 | -43.6 | 174.3 | -75.2 | 171.1 | 0 | 0 | 0 | 111.7 | F206 L207 I210 L211 V228 G229 I235 A236 | F206-L232 HydrophobicContact CD1-CD2 3.98Å; L207-L232 HydrophobicContact CD2-CB 4.48Å; I210-L232 HydrophobicContact CG2-CD1 4.14Å; I210-L232 HydrophobicContact CG2-CD2 3.85Å; L211-L232 HydrophobicContact CB-CD1 4.2Å; L211-L232 HydrophobicContact CD1-CD1 3.83Å; V228-L232 HydrophobicContact CG1-CD1 4.4Å; V228-L232 WeakPolarHBondContact O-CG 3.48Å; V228-L232 PolarHBondContact O-N 3.23Å; G229-L232 PolarHBondContact O-N 3.43Å; L232-I235 PolarHBondContact O-N 3.06Å; L232-A236 VanDerWaalsContact O-CB 3.25Å; L232-A236 WeakPolarHBondContact O-CB 3.41Å; L232-A236 PolarHBondContact O-N 2.98Å |
| 233 | W | 98 | Very high | 96.7 | Very high | 65 Ų | 65 | 35.4 Ų | 35.4 | 25% | 0.246 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.9 | -48 | 173.2 | -85.1 | 98.2 | 0 | 0 | 0 | 112.3 | L207 G229 N230 I235 A236 V237 V281 S282 V285 | L207-W233 HydrophobicContact CD1-CD2 3.87Å; L207-W233 HydrophobicContact CD1-CE3 3.55Å; L207-W233 HydrophobicContact CD1-CH2 3.6Å; L207-W233 HydrophobicContact CD1-CZ2 3.87Å; L207-W233 HydrophobicContact CD1-CZ3 3.43Å; L207-W233 VanDerWaalsContact CD1-CZ3 3.43Å; L207-W233 HydrophobicContact CD2-CD2 3.96Å; L207-W233 HydrophobicContact CD2-CE3 4.42Å; L207-W233 HydrophobicContact CD2-CG 4.09Å; G229-W233 VanDerWaalsContact O-CD1 3.3Å; G229-W233 PolarHBondContact O-N 3.09Å; G229-W233 VanDerWaalsContact O-N 3.09Å; N230-W233 PolarHBondContact O-N 3.46Å; W233-I235 PolarHBondContact O-N 3.27Å; W233-A236 PolarHBondContact O-N 3.1Å; W233-V237 HydrophobicContact CE3-CG2 4.44Å; W233-V237 WeakPolarHBondContact O-CG2 3.46Å; W233-V237 PolarHBondContact O-N 3.27Å; W233-V281 HydrophobicContact CD2-CG1 3.75Å; W233-V281 HydrophobicContact CE3-CG1 4.37Å; W233-V281 HydrophobicContact CG-CB 4.19Å; W233-V281 HydrophobicContact CG-CG1 3.87Å; W233-V281 HydrophobicContact CZ2-CG1 4.32Å; W233-S282 PolarHBondContact NE1-OG 2.99Å; W233-V285 HydrophobicContact CH2-CG2 4.1Å; W233-V285 HydrophobicContact CZ2-CB 4.26Å; W233-V285 HydrophobicContact CZ2-CG1 4.21Å; W233-V285 HydrophobicContact CZ2-CG2 3.49Å; W233-V285 VanDerWaalsContact CZ2-CG2 3.49Å |
| 234 | F | 98.5 | Very high | 97 | Very high | 40 Ų | 40 | 31.9 Ų | 31.9 | 18% | 0.175 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.2 | -46.9 | 178.1 | 176.3 | -104.3 | 0 | 0 | 0 | 111.6 | N230 A231 S238 F264 I267 F268 F271 | N230-F234 WeakPolarHBondContact O-CB 3.38Å; N230-F234 PolarHBondContact O-N 3.43Å; A231-F234 PolarHBondContact O-N 3.01Å; F234-S238 WeakPolarHBondContact O-CB 3.48Å; F234-S238 PolarHBondContact O-N 2.98Å; F234-S238 PolarHBondContact O-OG 2.96Å; F234-F264 HydrophobicContact CE2-CE2 4.41Å; F234-F264 AromaticContact CZ-CE2 3.96Å; F234-F264 HydrophobicContact CZ-CE2 3.96Å; F234-F264 AromaticContact CZ-CZ 3.85Å; F234-F264 HydrophobicContact CZ-CZ 3.85Å; F234-I267 HydrophobicContact CD2-CG2 3.85Å; F234-I267 HydrophobicContact CE2-CG2 4.18Å; F234-F268 HydrophobicContact CE2-CB 4.09Å; F234-F268 HydrophobicContact CE2-CD2 4.02Å; F234-F268 AromaticContact CZ-CD2 3.76Å; F234-F268 HydrophobicContact CZ-CD2 3.76Å; F234-F271 HydrophobicContact CB-CB 4.32Å; F234-F271 HydrophobicContact CB-CD2 3.73Å; F234-F271 HydrophobicContact CB-CE2 4.24Å; F234-F271 HydrophobicContact CB-CG 4.03Å; F234-F271 HydrophobicContact CD2-CB 3.77Å; F234-F271 HydrophobicContact CD2-CG 4.09Å; F234-F271 HydrophobicContact CG-CB 4.2Å; F234-F271 HydrophobicContact CG-CD1 4.44Å; F234-F271 HydrophobicContact CG-CD2 4.21Å; F234-F271 HydrophobicContact CG-CG 4.02Å |
| 235 | I | 98.3 | Very high | 97.3 | Very high | 66 Ų | 66 | 29.9 Ų | 29.9 | 34% | 0.338 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -62.6 | -46.6 | 177.7 | -69.4 | 166 | 0 | 0 | 0 | 110.8 | F206 A231 L232 W233 S238 Y239 | F206-I235 HydrophobicContact CD1-CG2 4.25Å; F206-I235 HydrophobicContact CD2-CG2 4.2Å; F206-I235 HydrophobicContact CE1-CG2 3.84Å; F206-I235 HydrophobicContact CE2-CG2 3.79Å; F206-I235 HydrophobicContact CG-CG2 4.44Å; F206-I235 HydrophobicContact CZ-CG2 3.6Å; A231-I235 WeakPolarHBondContact O-CB 3.47Å; A231-I235 VanDerWaalsContact O-CG1 3.24Å; A231-I235 WeakPolarHBondContact O-CG1 3.41Å; A231-I235 PolarHBondContact O-N 2.76Å; L232-I235 PolarHBondContact O-N 3.06Å; W233-I235 PolarHBondContact O-N 3.27Å; I235-S238 PolarHBondContact O-N 3.29Å; I235-Y239 HydrophobicContact CG2-CD2 4.1Å; I235-Y239 HydrophobicContact CG2-CE2 4.44Å; I235-Y239 WeakPolarHBondContact O-CB 3.33Å; I235-Y239 PolarHBondContact O-N 3.35Å |
| 236 | A | 98.6 | Very high | 97.5 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.1 | -50.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | V203 F206 L207 L232 W233 S238 Y239 Y240 | V203-A236 HydrophobicContact CG2-CB 4.37Å; V203-A236 WeakPolarHBondContact CG2-O 3.48Å; F206-A236 HydrophobicContact CB-CB 3.85Å; F206-A236 HydrophobicContact CD2-CB 4.45Å; F206-A236 HydrophobicContact CG-CB 4.46Å; L207-A236 HydrophobicContact CD1-CB 3.96Å; L207-A236 HydrophobicContact CD2-CB 3.92Å; L207-A236 HydrophobicContact CG-CB 3.74Å; L232-A236 VanDerWaalsContact O-CB 3.25Å; L232-A236 WeakPolarHBondContact O-CB 3.41Å; L232-A236 PolarHBondContact O-N 2.98Å; W233-A236 PolarHBondContact O-N 3.1Å; A236-S238 VanDerWaalsContact C-N 3.34Å; A236-S238 PolarHBondContact O-N 2.84Å; A236-Y239 PolarHBondContact O-N 3.28Å; A236-Y240 PolarHBondContact O-N 3.49Å |
| 237 | V | 98.4 | Very high | 97.7 | Very high | 40 Ų | 40 | 30.5 Ų | 30.5 | 24% | 0.242 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -66.2 | -38.9 | 179.6 | 177.4 | 0 | 0 | 0 | 0 | 111 | W233 Y239 Y240 I241 I267 | W233-V237 HydrophobicContact CE3-CG2 4.44Å; W233-V237 WeakPolarHBondContact O-CG2 3.46Å; W233-V237 PolarHBondContact O-N 3.27Å; V237-Y239 PolarHBondContact O-N 3.04Å; V237-Y240 WeakPolarHBondContact O-CB 3.37Å; V237-Y240 PolarHBondContact O-N 3.17Å; V237-I241 HydrophobicContact CG1-CD1 3.9Å; V237-I241 HydrophobicContact CG1-CG1 4.48Å; V237-I241 WeakPolarHBondContact O-CG1 3.15Å; V237-I241 PolarHBondContact O-N 3.31Å; V237-I267 HydrophobicContact CB-CG2 4.24Å; V237-I267 HydrophobicContact CG1-CB 4.42Å; V237-I267 HydrophobicContact CG1-CD1 3.99Å; V237-I267 HydrophobicContact CG1-CG1 3.79Å; V237-I267 HydrophobicContact CG1-CG2 3.92Å |
| 238 | S | 98.5 | Very high | 97.8 | Very high | 18 Ų | 18 | 27.2 Ų | 27.2 | 13% | 0.126 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.9 | -43.5 | 174.7 | -63.8 | 0 | 0 | 0 | 0 | 112 | F234 I235 A236 I241 Y242 F264 | F234-S238 WeakPolarHBondContact O-CB 3.48Å; F234-S238 PolarHBondContact O-N 2.98Å; F234-S238 PolarHBondContact O-OG 2.96Å; I235-S238 PolarHBondContact O-N 3.29Å; A236-S238 VanDerWaalsContact C-N 3.34Å; A236-S238 PolarHBondContact O-N 2.84Å; S238-I241 PolarHBondContact O-N 3.48Å; S238-Y242 WeakPolarHBondContact O-CB 3.12Å; S238-Y242 PolarHBondContact O-N 3.17Å; S238-F264 VanDerWaalsContact OG-CE2 3.25Å; S238-F264 WeakPolarHBondContact OG-CE2 3.37Å |
| 239 | Y | 98.1 | Very high | 97.7 | Very high | 71 Ų | 71 | 27.1 Ų | 27.1 | 28% | 0.278 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -61.6 | -46.7 | 173.6 | -103.9 | -96.8 | 0 | 0 | 0 | 111.1 | M95 P202 F206 I235 A236 V237 I241 Y242 I243 | M95-Y239 PolarHBondContact O-OH 2.69Å; P202-Y239 HydrophobicContact CB-CD1 4.09Å; P202-Y239 HydrophobicContact CB-CG 4.38Å; P202-Y239 HydrophobicContact CG-CD1 4.32Å; F206-Y239 HydrophobicContact CE2-CD2 4.26Å; F206-Y239 HydrophobicContact CE2-CG 4.49Å; I235-Y239 HydrophobicContact CG2-CD2 4.1Å; I235-Y239 HydrophobicContact CG2-CE2 4.44Å; I235-Y239 WeakPolarHBondContact O-CB 3.33Å; I235-Y239 PolarHBondContact O-N 3.35Å; A236-Y239 PolarHBondContact O-N 3.28Å; V237-Y239 PolarHBondContact O-N 3.04Å; Y239-I241 VanDerWaalsContact C-N 3.32Å; Y239-I241 PolarHBondContact O-N 2.82Å; Y239-Y242 PolarHBondContact O-N 3.43Å; Y239-Y242 VanDerWaalsContact O-N 3.1Å; Y239-I243 VanDerWaalsContact O-CG1 3.26Å; Y239-I243 WeakPolarHBondContact O-CG1 3.28Å; Y239-I243 PolarHBondContact O-N 3.14Å |
| 240 | Y | 98.7 | Very high | 97.5 | Very high | 37 Ų | 37 | 27.3 Ų | 27.3 | 15% | 0.145 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -55.1 | -48.4 | 178.5 | -172.5 | -80 | 0 | 0 | 0 | 112 | I167 H196 A199 V203 A236 V237 Y242 T244 | I167-Y240 WeakPolarHBondContact CD1-OH 3.38Å; H196-Y240 AromaticContact ND1-CE2 3.83Å; H196-Y240 AromaticContact ND1-CZ 3.71Å; H196-Y240 PolarHBondContact ND1-OH 3.04Å; A199-Y240 VanDerWaalsContact C-CD2 3.47Å; A199-Y240 HydrophobicContact CB-CD1 4.29Å; A199-Y240 HydrophobicContact CB-CD2 3.48Å; A199-Y240 VanDerWaalsContact CB-CD2 3.48Å; A199-Y240 HydrophobicContact CB-CE1 4.3Å; A199-Y240 HydrophobicContact CB-CE2 3.5Å; A199-Y240 HydrophobicContact CB-CG 3.87Å; A199-Y240 WeakPolarHBondContact O-CD2 3.48Å; V203-Y240 HydrophobicContact CG2-CD2 3.79Å; V203-Y240 HydrophobicContact CG2-CG 4.22Å; A236-Y240 PolarHBondContact O-N 3.49Å; V237-Y240 WeakPolarHBondContact O-CB 3.37Å; V237-Y240 PolarHBondContact O-N 3.17Å; Y240-Y242 PolarHBondContact O-N 3.27Å; Y240-T244 WeakPolarHBondContact O-CB 3.3Å; Y240-T244 PolarHBondContact O-N 3.4Å; Y240-T244 PolarHBondContact O-OG1 2.9Å |
| 241 | I | 98.6 | Very high | 97.3 | Very high | 15 Ų | 15 | 27.3 Ų | 27.3 | 8% | 0.077 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60.9 | -45.2 | 176.4 | -68.1 | 165.2 | 0 | 0 | 0 | 110.7 | V237 S238 Y239 T244 F245 F260 L261 P263 F264 I267 | V237-I241 HydrophobicContact CG1-CD1 3.9Å; V237-I241 HydrophobicContact CG1-CG1 4.48Å; V237-I241 WeakPolarHBondContact O-CG1 3.15Å; V237-I241 PolarHBondContact O-N 3.31Å; S238-I241 PolarHBondContact O-N 3.48Å; Y239-I241 VanDerWaalsContact C-N 3.32Å; Y239-I241 PolarHBondContact O-N 2.82Å; I241-T244 WeakPolarHBondContact O-CB 3.47Å; I241-T244 PolarHBondContact O-N 3.08Å; I241-F245 PolarHBondContact O-N 3.33Å; I241-F260 WeakPolarHBondContact CG2-O 3.36Å; I241-L261 HydrophobicContact CG2-CD2 4.26Å; I241-P263 HydrophobicContact CD1-CB 3.96Å; I241-P263 HydrophobicContact CG1-CB 4.43Å; I241-F264 HydrophobicContact CD1-CB 4.4Å; I241-F264 HydrophobicContact CG2-CB 4.42Å; I241-I267 HydrophobicContact CD1-CG1 4.27Å |
| 242 | Y | 98.3 | Very high | 96.9 | Very high | 63 Ų | 63 | 29.6 Ų | 29.6 | 25% | 0.247 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.6 | -44 | -179.1 | -178.5 | -122.4 | 0 | 0 | 0 | 113 | P98 R99 S238 Y239 Y240 T244 F245 L246 | P98-Y242 HydrophobicContact CG-CD1 4.17Å; P98-Y242 HydrophobicContact CG-CE1 3.8Å; R99-Y242 PolarHBondContact NE-OH 2.76Å; R99-Y242 PolarHBondContact NH2-OH 2.77Å; S238-Y242 WeakPolarHBondContact O-CB 3.12Å; S238-Y242 PolarHBondContact O-N 3.17Å; Y239-Y242 PolarHBondContact O-N 3.43Å; Y239-Y242 VanDerWaalsContact O-N 3.1Å; Y240-Y242 PolarHBondContact O-N 3.27Å; Y242-T244 VanDerWaalsContact C-N 3.32Å; Y242-F245 HydrophobicContact CD2-CD1 4.17Å; Y242-F245 HydrophobicContact CE2-CD1 4.16Å; Y242-F245 HydrophobicContact CE2-CE1 4.48Å; Y242-F245 PolarHBondContact O-N 3.09Å; Y242-L246 HydrophobicContact CD1-CD1 4.09Å; Y242-L246 HydrophobicContact CD2-CG 4.4Å; Y242-L246 HydrophobicContact CE1-CD1 3.53Å; Y242-L246 HydrophobicContact CE1-CG 4.18Å; Y242-L246 HydrophobicContact CE2-CD1 4.21Å; Y242-L246 HydrophobicContact CE2-CD2 4.1Å; Y242-L246 HydrophobicContact CE2-CG 3.95Å; Y242-L246 WeakPolarHBondContact O-CG 3.44Å; Y242-L246 PolarHBondContact O-N 3.18Å |
| 243 | I | 98.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.3 | -43.1 | 175.7 | -62.9 | -59.4 | 0 | 0 | 0 | 110.3 | L94 P98 Y102 N198 A199 P202 Y239 F245 L246 G247 | L94-I243 HydrophobicContact CD2-CD1 4.26Å; L94-I243 HydrophobicContact CD2-CG2 4.41Å; P98-I243 HydrophobicContact CB-CD1 3.06Å; P98-I243 HydrophobicContact CG-CD1 3.56Å; Y102-I243 HydrophobicContact CE2-CG2 3.93Å; Y102-I243 WeakPolarHBondContact CE2-O 3.29Å; Y102-I243 WeakPolarHBondContact OH-CG2 3.5Å; Y102-I243 PolarHBondContact OH-O 3.27Å; N198-I243 HydrophobicContact CB-CG2 4.04Å; A199-I243 HydrophobicContact CB-CB 3.85Å; A199-I243 HydrophobicContact CB-CG2 3.74Å; P202-I243 HydrophobicContact CG-CG1 4.49Å; Y239-I243 VanDerWaalsContact O-CG1 3.26Å; Y239-I243 WeakPolarHBondContact O-CG1 3.28Å; Y239-I243 PolarHBondContact O-N 3.14Å; I243-F245 PolarHBondContact O-N 3.16Å; I243-L246 PolarHBondContact O-N 3.18Å; I243-G247 PolarHBondContact O-N 3.41Å |
| 244 | T | 98.2 | Very high | 96.4 | Very high | 6 Ų | 6 | 26.5 Ų | 26.5 | 4% | 0.037 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.9 | -49.7 | 176.5 | -59.6 | 0 | 0 | 0 | 0 | 110.5 | V195 Y240 I241 Y242 L246 G247 Y248 F260 | V195-T244 HydrophobicContact CG1-CG2 4.36Å; Y240-T244 WeakPolarHBondContact O-CB 3.3Å; Y240-T244 PolarHBondContact O-N 3.4Å; Y240-T244 PolarHBondContact O-OG1 2.9Å; I241-T244 WeakPolarHBondContact O-CB 3.47Å; I241-T244 PolarHBondContact O-N 3.08Å; Y242-T244 VanDerWaalsContact C-N 3.32Å; T244-L246 PolarHBondContact O-N 3.22Å; T244-G247 PolarHBondContact O-N 3.01Å; T244-Y248 HydrophobicContact CG2-CD2 3.86Å; T244-Y248 HydrophobicContact CG2-CE2 3.69Å; T244-Y248 WeakPolarHBondContact O-CD2 3.4Å; T244-Y248 PolarHBondContact O-N 2.63Å; T244-Y248 VanDerWaalsContact O-N 3.09Å; T244-F260 HydrophobicContact CG2-CD1 4.5Å |
| 245 | F | 97.8 | Very high | 96.1 | Very high | 28 Ų | 28 | 29 Ų | 29 | 12% | 0.123 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.2 | -47.4 | 174.3 | 161.7 | -103 | 0 | 0 | 0 | 112.4 | I241 Y242 I243 G247 Y248 A249 V257 H258 F260 L261 | I241-F245 PolarHBondContact O-N 3.33Å; Y242-F245 HydrophobicContact CD2-CD1 4.17Å; Y242-F245 HydrophobicContact CE2-CD1 4.16Å; Y242-F245 HydrophobicContact CE2-CE1 4.48Å; Y242-F245 PolarHBondContact O-N 3.09Å; I243-F245 PolarHBondContact O-N 3.16Å; F245-G247 VanDerWaalsContact C-N 3.29Å; F245-G247 PolarHBondContact O-N 3.17Å; F245-Y248 PolarHBondContact O-N 3.4Å; F245-A249 HydrophobicContact CE2-CB 4.23Å; F245-A249 HydrophobicContact CZ-CB 4.23Å; F245-A249 WeakPolarHBondContact O-CB 3.37Å; F245-A249 PolarHBondContact O-N 3.39Å; F245-V257 HydrophobicContact CE2-CG2 4.07Å; F245-H258 AromaticContact CE2-ND1 3.63Å; F245-H258 AromaticContact CZ-ND1 3.93Å; F245-F260 HydrophobicContact CB-CB 4.29Å; F245-L261 HydrophobicContact CB-CD2 3.78Å; F245-L261 HydrophobicContact CB-CG 4.04Å; F245-L261 HydrophobicContact CD1-CD1 4.29Å; F245-L261 HydrophobicContact CD1-CD2 4.16Å; F245-L261 HydrophobicContact CD1-CG 4.38Å; F245-L261 HydrophobicContact CD2-CD1 3.97Å; F245-L261 HydrophobicContact CD2-CD2 4.44Å; F245-L261 HydrophobicContact CD2-CG 3.89Å; F245-L261 HydrophobicContact CE1-CD1 4.39Å; F245-L261 HydrophobicContact CE2-CD1 4.07Å; F245-L261 HydrophobicContact CE2-CG 4.48Å; F245-L261 HydrophobicContact CG-CD1 4.07Å; F245-L261 HydrophobicContact CG-CD2 3.86Å; F245-L261 HydrophobicContact CG-CG 3.82Å; F245-L261 HydrophobicContact CZ-CD1 4.28Å |
| 246 | L | 97.1 | Very high | 95.9 | Very high | 21 Ų | 21 | 31.3 Ų | 31.3 | 11% | 0.11 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.3 | -37 | 179.5 | -74.6 | -179.2 | 0 | 0 | 0 | 112.5 | P98 R99 Y102 Y242 I243 T244 A250 | P98-L246 HydrophobicContact CB-CD1 3.91Å; P98-L246 HydrophobicContact CG-CD1 3.88Å; R99-L246 HydrophobicContact CG-CD1 3.97Å; R99-L246 HydrophobicContact CG-CD2 4.11Å; Y102-L246 HydrophobicContact CD2-CB 3.49Å; Y102-L246 VanDerWaalsContact CD2-CB 3.49Å; Y102-L246 HydrophobicContact CD2-CD1 4.34Å; Y102-L246 HydrophobicContact CE2-CB 3.76Å; Y102-L246 HydrophobicContact CG-CB 4.25Å; Y242-L246 HydrophobicContact CD1-CD1 4.09Å; Y242-L246 HydrophobicContact CD2-CG 4.4Å; Y242-L246 HydrophobicContact CE1-CD1 3.53Å; Y242-L246 HydrophobicContact CE1-CG 4.18Å; Y242-L246 HydrophobicContact CE2-CD1 4.21Å; Y242-L246 HydrophobicContact CE2-CD2 4.1Å; Y242-L246 HydrophobicContact CE2-CG 3.95Å; Y242-L246 WeakPolarHBondContact O-CG 3.44Å; Y242-L246 PolarHBondContact O-N 3.18Å; I243-L246 PolarHBondContact O-N 3.18Å; T244-L246 PolarHBondContact O-N 3.22Å; L246-A250 PolarHBondContact O-N 3.08Å |
| 247 | G | 96.5 | Very high | 95.7 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -58 | -59.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y102 Y191 I243 T244 F245 A249 A250 L251 | Y102-G247 VanDerWaalsContact CZ-CA 3.41Å; Y191-G247 WeakPolarHBondContact OH-CA 3.23Å; Y191-G247 PolarHBondContact OH-O 2.83Å; I243-G247 PolarHBondContact O-N 3.41Å; T244-G247 PolarHBondContact O-N 3.01Å; F245-G247 VanDerWaalsContact C-N 3.29Å; F245-G247 PolarHBondContact O-N 3.17Å; G247-A249 VanDerWaalsContact C-N 3.27Å; G247-A249 PolarHBondContact O-N 3.18Å; G247-A250 VanDerWaalsContact O-CB 3.29Å; G247-A250 WeakPolarHBondContact O-CB 3.3Å; G247-A250 PolarHBondContact O-N 3.13Å; G247-L251 VanDerWaalsContact O-CD1 3.22Å; G247-L251 WeakPolarHBondContact O-CD1 3.44Å |
| 248 | Y | 96.4 | Very high | 95.6 | Very high | 2 Ų | 2 | 35.8 Ų | 35.8 | 1% | 0.008 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -66.5 | -27.9 | -177.7 | -68 | -71.8 | 0 | 0 | 0 | 114 | M171 S175 V187 Y191 C192 V195 T244 F245 A250 L251 L254 V257 F260 | M171-Y248 HydrophobicContact CB-CE2 4.16Å; M171-Y248 WeakPolarHBondContact CB-OH 3.47Å; M171-Y248 HydrophobicContact CG-CE2 4.35Å; S175-Y248 WeakPolarHBondContact OG-CE1 3.39Å; V187-Y248 HydrophobicContact CG1-CE1 4.25Å; Y191-Y248 HydrophobicContact CE1-CE1 4.37Å; C192-Y248 WeakPolarHBondContact CA-OH 3.14Å; C192-Y248 WeakPolarHBondContact CB-OH 3.09Å; C192-Y248 PolarHBondContact SG-OH 3.32Å; V195-Y248 HydrophobicContact CG1-CE2 4.12Å; T244-Y248 HydrophobicContact CG2-CD2 3.86Å; T244-Y248 HydrophobicContact CG2-CE2 3.69Å; T244-Y248 WeakPolarHBondContact O-CD2 3.4Å; T244-Y248 PolarHBondContact O-N 2.63Å; T244-Y248 VanDerWaalsContact O-N 3.09Å; F245-Y248 PolarHBondContact O-N 3.4Å; Y248-A250 VanDerWaalsContact C-N 3.26Å; Y248-A250 PolarHBondContact O-N 2.94Å; Y248-L251 VanDerWaalsContact CA-CD1 3.47Å; Y248-L251 HydrophobicContact CD1-CD1 4.17Å; Y248-L251 WeakPolarHBondContact O-CD1 3.42Å; Y248-L251 PolarHBondContact O-N 3.26Å; Y248-L254 HydrophobicContact CD1-CD1 3.84Å; Y248-V257 WeakPolarHBondContact O-CG1 3.21Å; Y248-F260 HydrophobicContact CD1-CE2 4.02Å; Y248-F260 HydrophobicContact CD1-CZ 4.09Å; Y248-F260 HydrophobicContact CD2-CD1 4.3Å; Y248-F260 AromaticContact CD2-CD2 3.84Å; Y248-F260 HydrophobicContact CD2-CD2 3.84Å; Y248-F260 HydrophobicContact CD2-CE1 4.07Å; Y248-F260 AromaticContact CD2-CE2 3.58Å; Y248-F260 HydrophobicContact CD2-CE2 3.58Å; Y248-F260 HydrophobicContact CD2-CG 4.2Å; Y248-F260 AromaticContact CD2-CZ 3.71Å; Y248-F260 HydrophobicContact CD2-CZ 3.71Å; Y248-F260 HydrophobicContact CE2-CE1 4.3Å; Y248-F260 HydrophobicContact CE2-CE2 4.48Å; Y248-F260 HydrophobicContact CE2-CZ 4.18Å; Y248-F260 AromaticContact CG-CD2 3.89Å; Y248-F260 HydrophobicContact CG-CD2 3.89Å; Y248-F260 HydrophobicContact CG-CE1 4.5Å; Y248-F260 AromaticContact CG-CE2 3.33Å; Y248-F260 HydrophobicContact CG-CE2 3.33Å; Y248-F260 AromaticContact CG-CZ 3.69Å; Y248-F260 HydrophobicContact CG-CZ 3.69Å |
| 249 | A | 95 | Very high | 95.4 | Very high | 44 Ų | 44 | 37.8 Ų | 37.8 | 36% | 0.364 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -69.2 | -21.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | F245 G247 L251 V257 | F245-A249 HydrophobicContact CE2-CB 4.23Å; F245-A249 HydrophobicContact CZ-CB 4.23Å; F245-A249 WeakPolarHBondContact O-CB 3.37Å; F245-A249 PolarHBondContact O-N 3.39Å; G247-A249 VanDerWaalsContact C-N 3.27Å; G247-A249 PolarHBondContact O-N 3.18Å; A249-L251 PolarHBondContact O-N 3.14Å; A249-V257 HydrophobicContact CB-CG2 4.01Å |
| 250 | A | 92.6 | Very high | 95.3 | Very high | 6 Ų | 6 | 35.2 Ų | 35.2 | 5% | 0.05 | 19% | 0.186 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -20.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y102 M106 W115 L246 G247 Y248 S252 | Y102-A250 HydrophobicContact CD1-CB 4.46Å; M106-A250 HydrophobicContact CG-CB 4.17Å; W115-A250 VanDerWaalsContact CH2-O 3.24Å; W115-A250 WeakPolarHBondContact CH2-O 3.24Å; L246-A250 PolarHBondContact O-N 3.08Å; G247-A250 VanDerWaalsContact O-CB 3.29Å; G247-A250 WeakPolarHBondContact O-CB 3.3Å; G247-A250 PolarHBondContact O-N 3.13Å; Y248-A250 VanDerWaalsContact C-N 3.26Å; Y248-A250 PolarHBondContact O-N 2.94Å; A250-S252 PolarHBondContact O-N 3.19Å |
| 251 | L | 92.5 | Very high | 95.2 | Very high | 3 Ų | 3 | 36.2 Ų | 36.2 | 2% | 0.016 | 19% | 0.194 | C | C | . | . | trans | -85.2 | 107.2 | 178.3 | -57.1 | 98.2 | 0 | 0 | 0 | 110.1 | W115 V187 Y191 G247 Y248 A249 F253 L254 | W115-L251 HydrophobicContact CD2-CD2 4.42Å; W115-L251 HydrophobicContact CG-CD2 4.43Å; V187-L251 HydrophobicContact CG1-CD2 4.46Å; V187-L251 HydrophobicContact CG2-CD2 4.35Å; Y191-L251 HydrophobicContact CD1-CD1 4.34Å; Y191-L251 HydrophobicContact CD1-CD2 4.3Å; Y191-L251 HydrophobicContact CE1-CD1 3.47Å; Y191-L251 VanDerWaalsContact CE1-CD1 3.47Å; Y191-L251 HydrophobicContact CE1-CD2 4.15Å; Y191-L251 HydrophobicContact CE1-CG 4.29Å; G247-L251 VanDerWaalsContact O-CD1 3.22Å; G247-L251 WeakPolarHBondContact O-CD1 3.44Å; Y248-L251 VanDerWaalsContact CA-CD1 3.47Å; Y248-L251 HydrophobicContact CD1-CD1 4.17Å; Y248-L251 WeakPolarHBondContact O-CD1 3.42Å; Y248-L251 PolarHBondContact O-N 3.26Å; A249-L251 PolarHBondContact O-N 3.14Å; L251-F253 HydrophobicContact CB-CD1 4.16Å; L251-F253 HydrophobicContact CB-CE1 3.8Å; L251-F253 HydrophobicContact CB-CZ 4.14Å; L251-F253 HydrophobicContact CD2-CE1 3.54Å; L251-F253 HydrophobicContact CD2-CE2 4.33Å; L251-F253 HydrophobicContact CD2-CZ 3.35Å; L251-F253 HydrophobicContact CG-CE1 4.16Å; L251-F253 HydrophobicContact CG-CZ 4.32Å; L251-F253 PolarHBondContact O-N 3.19Å; L251-L254 HydrophobicContact CB-CD1 4.01Å; L251-L254 HydrophobicContact CB-CG 4Å; L251-L254 HydrophobicContact CD1-CD1 4.09Å; L251-L254 HydrophobicContact CG-CD1 4.48Å; L251-L254 PolarHBondContact O-N 3.07Å; L251-L254 VanDerWaalsContact O-N 3.16Å | ||
| 252 | S | 89.4 | Confident | 95.1 | Very high | 80 Ų | 80 | 42.5 Ų | 42.5 | 56% | 0.559 | 22% | 0.217 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -22.5 | -178.1 | 53.5 | 0 | 0 | 0 | 0 | 114.1 | R181 A250 L254 | R181-S252 PolarHBondContact NE-O 3.38Å; R181-S252 PolarHBondContact NH1-O 3.35Å; A250-S252 PolarHBondContact O-N 3.19Å; S252-L254 VanDerWaalsContact C-N 3.33Å |
| 253 | F | 91.4 | Very high | 95.1 | Very high | 15 Ų | 15 | 42.4 Ų | 42.4 | 7% | 0.066 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | -0.4 | 179.5 | 64.3 | -90.9 | 0 | 0 | 0 | 113.7 | W115 R181 Q185 V187 L251 | W115-F253 HydrophobicContact CZ2-CE1 4.47Å; W115-F253 AromaticContact NE1-CE1 3.66Å; R181-F253 VanDerWaalsContact CB-O 3.26Å; R181-F253 WeakPolarHBondContact CB-O 3.44Å; R181-F253 WeakPolarHBondContact CG-O 3.48Å; R181-F253 PolarHBondContact N-O 3.1Å; Q185-F253 HydrophobicContact CB-CD2 4.44Å; Q185-F253 HydrophobicContact CB-CG 4.43Å; Q185-F253 HydrophobicContact CG-CD1 4.21Å; Q185-F253 HydrophobicContact CG-CD2 4.49Å; Q185-F253 HydrophobicContact CG-CE1 3.96Å; Q185-F253 HydrophobicContact CG-CE2 4.25Å; Q185-F253 HydrophobicContact CG-CG 4.47Å; Q185-F253 HydrophobicContact CG-CZ 3.97Å; V187-F253 HydrophobicContact CG2-CE2 3.67Å; V187-F253 HydrophobicContact CG2-CZ 3.96Å; L251-F253 HydrophobicContact CB-CD1 4.16Å; L251-F253 HydrophobicContact CB-CE1 3.8Å; L251-F253 HydrophobicContact CB-CZ 4.14Å; L251-F253 HydrophobicContact CD2-CE1 3.54Å; L251-F253 HydrophobicContact CD2-CE2 4.33Å; L251-F253 HydrophobicContact CD2-CZ 3.35Å; L251-F253 HydrophobicContact CG-CE1 4.16Å; L251-F253 HydrophobicContact CG-CZ 4.32Å; L251-F253 PolarHBondContact O-N 3.19Å |
| 254 | L | 93.1 | Very high | 95 | Very high | 1 Ų | 1 | 46.1 Ų | 46.1 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | B | Isolated β-bridge | trans | -96.2 | 134.6 | 173.4 | -63 | -177.2 | 0 | 0 | 0 | 111.7 | L179 R180 R181 V187 Y248 L251 S252 V257 | L179-L254 HydrophobicContact CB-CD2 4.07Å; L179-L254 CarbonylContact O-C 3.46Å; L179-L254 VanDerWaalsContact O-CA 3.27Å; L179-L254 WeakPolarHBondContact O-CA 3.34Å; R180-L254 HydrophobicContact CG-CD2 4.14Å; R181-L254 VanDerWaalsContact NE-C 3.34Å; R181-L254 PolarHBondContact NE-O 3.34Å; R181-L254 PolarHBondContact NH2-O 3.44Å; V187-L254 HydrophobicContact CG2-CD1 4.04Å; V187-L254 HydrophobicContact CG2-CD2 3.83Å; V187-L254 HydrophobicContact CG2-CG 4.31Å; Y248-L254 HydrophobicContact CD1-CD1 3.84Å; L251-L254 HydrophobicContact CB-CD1 4.01Å; L251-L254 HydrophobicContact CB-CG 4Å; L251-L254 HydrophobicContact CD1-CD1 4.09Å; L251-L254 HydrophobicContact CG-CD1 4.48Å; L251-L254 PolarHBondContact O-N 3.07Å; L251-L254 VanDerWaalsContact O-N 3.16Å; S252-L254 VanDerWaalsContact C-N 3.33Å; L254-V257 HydrophobicContact CB-CG1 3.66Å |
| 255 | K | 92.9 | Very high | 95 | Very high | 94 Ų | 94 | 49.4 Ų | 49.4 | 41% | 0.409 | 26% | 0.261 | S | S | . | . | S | Bend | trans | -100.4 | 157.6 | 170.5 | 55.2 | 179.3 | -174.8 | -164.9 | 0 | 110.2 | L179 R180 R181 V257 | L179-K255 VanDerWaalsContact O-CG 3.27Å; L179-K255 WeakPolarHBondContact O-CG 3.47Å; L179-K255 PolarHBondContact O-N 3.41Å; R180-K255 VanDerWaalsContact O-CE 3.24Å; R180-K255 WeakPolarHBondContact O-CE 3.5Å; R181-K255 HydrophobicContact CG-CB 3.68Å; R181-K255 HydrophobicContact CG-CD 4.43Å; R181-K255 HydrophobicContact CG-CG 4.03Å; K255-V257 PolarHBondContact O-N 2.91Å; K255-V257 VanDerWaalsContact O-N 3.13Å |
| 256 | N | 93.4 | Very high | 94.9 | Very high | 114 Ų | 114 | 55.3 Ų | 55.3 | 61% | 0.61 | 29% | 0.287 | S | S | * | . | trans | 53 | 35.4 | 173.2 | -58.3 | -22.9 | 0 | 0 | 0 | 114.4 | H258 V259 | N256-H258 PolarHBondContact O-N 3.3Å; N256-V259 HydrophobicContact CB-CG2 4.49Å; N256-V259 VanDerWaalsContact O-CG2 3.3Å; N256-V259 WeakPolarHBondContact O-CG2 3.43Å; N256-V259 PolarHBondContact O-N 2.81Å; N256-V259 VanDerWaalsContact O-N 3.07Å | ||
| 257 | V | 95.1 | Very high | 94.9 | Very high | 17 Ų | 17 | 57.2 Ų | 57.2 | 10% | 0.103 | 30% | 0.297 | C | S | . | . | G | 310 helix | trans | -58.5 | -17.8 | 178.7 | -64.3 | 0 | 0 | 0 | 0 | 113.5 | L179 F245 Y248 A249 L254 K255 V259 F260 | L179-V257 HydrophobicContact CD2-CG1 4.49Å; F245-V257 HydrophobicContact CE2-CG2 4.07Å; Y248-V257 WeakPolarHBondContact O-CG1 3.21Å; A249-V257 HydrophobicContact CB-CG2 4.01Å; L254-V257 HydrophobicContact CB-CG1 3.66Å; K255-V257 PolarHBondContact O-N 2.91Å; K255-V257 VanDerWaalsContact O-N 3.13Å; V257-V259 PolarHBondContact O-N 3.37Å; V257-V259 VanDerWaalsContact O-N 3.14Å; V257-F260 VanDerWaalsContact O-CD2 3.23Å; V257-F260 WeakPolarHBondContact O-CD2 3.4Å; V257-F260 PolarHBondContact O-N 3.41Å |
| 258 | H | 95.4 | Very high | 95 | Very high | 117 Ų | 117 | 61.7 Ų | 61.7 | 54% | 0.542 | 32% | 0.316 | S | S | . | . | G | 310 helix | trans | -59.6 | -19.4 | 173.5 | -59 | -69.5 | 0 | 0 | 0 | 113.8 | F245 N256 F260 L261 | F245-H258 AromaticContact CE2-ND1 3.63Å; F245-H258 AromaticContact CZ-ND1 3.93Å; N256-H258 PolarHBondContact O-N 3.3Å; H258-F260 PolarHBondContact O-N 2.84Å; H258-L261 WeakPolarHBondContact O-CB 3.22Å; H258-L261 PolarHBondContact O-N 3.29Å |
| 259 | V | 95.5 | Very high | 95.1 | Very high | 60 Ų | 60 | 67 Ų | 67 | 36% | 0.364 | 34% | 0.343 | S | S | . | . | G | 310 helix | trans | -55.9 | -32.1 | 174.2 | 172.4 | 0 | 0 | 0 | 0 | 111.8 | N256 V257 L261 Y262 | N256-V259 HydrophobicContact CB-CG2 4.49Å; N256-V259 VanDerWaalsContact O-CG2 3.3Å; N256-V259 WeakPolarHBondContact O-CG2 3.43Å; N256-V259 PolarHBondContact O-N 2.81Å; N256-V259 VanDerWaalsContact O-N 3.07Å; V257-V259 PolarHBondContact O-N 3.37Å; V257-V259 VanDerWaalsContact O-N 3.14Å; V259-L261 PolarHBondContact O-N 3.19Å; V259-L261 VanDerWaalsContact O-N 3.13Å; V259-Y262 HydrophobicContact CG1-CD2 4.27Å; V259-Y262 HydrophobicContact CG1-CE2 4.47Å; V259-Y262 HydrophobicContact CG2-CE2 4.17Å; V259-Y262 WeakPolarHBondContact O-CB 3.23Å; V259-Y262 PolarHBondContact O-N 3.15Å; V259-Y262 VanDerWaalsContact O-N 3.08Å |
| 260 | F | 96.1 | Very high | 95.1 | Very high | 16 Ų | 16 | 66.7 Ų | 66.7 | 7% | 0.07 | 35% | 0.345 | C | S | . | . | G | 310 helix | trans | -64.3 | -16 | 176.4 | -65.3 | -62.2 | 0 | 0 | 0 | 113.8 | M171 L179 I241 T244 F245 Y248 V257 H258 P263 | M171-F260 HydrophobicContact SD-CD1 3.83Å; M171-F260 HydrophobicContact SD-CE1 3.47Å; M171-F260 WeakPolarHBondContact SD-CE1 3.42Å; L179-F260 HydrophobicContact CD2-CD2 4.24Å; L179-F260 HydrophobicContact CD2-CE2 3.43Å; L179-F260 VanDerWaalsContact CD2-CE2 3.43Å; L179-F260 HydrophobicContact CD2-CZ 3.79Å; I241-F260 WeakPolarHBondContact CG2-O 3.36Å; T244-F260 HydrophobicContact CG2-CD1 4.5Å; F245-F260 HydrophobicContact CB-CB 4.29Å; Y248-F260 HydrophobicContact CD1-CE2 4.02Å; Y248-F260 HydrophobicContact CD1-CZ 4.09Å; Y248-F260 HydrophobicContact CD2-CD1 4.3Å; Y248-F260 AromaticContact CD2-CD2 3.84Å; Y248-F260 HydrophobicContact CD2-CD2 3.84Å; Y248-F260 HydrophobicContact CD2-CE1 4.07Å; Y248-F260 AromaticContact CD2-CE2 3.58Å; Y248-F260 HydrophobicContact CD2-CE2 3.58Å; Y248-F260 HydrophobicContact CD2-CG 4.2Å; Y248-F260 AromaticContact CD2-CZ 3.71Å; Y248-F260 HydrophobicContact CD2-CZ 3.71Å; Y248-F260 HydrophobicContact CE2-CE1 4.3Å; Y248-F260 HydrophobicContact CE2-CE2 4.48Å; Y248-F260 HydrophobicContact CE2-CZ 4.18Å; Y248-F260 AromaticContact CG-CD2 3.89Å; Y248-F260 HydrophobicContact CG-CD2 3.89Å; Y248-F260 HydrophobicContact CG-CE1 4.5Å; Y248-F260 AromaticContact CG-CE2 3.33Å; Y248-F260 HydrophobicContact CG-CE2 3.33Å; Y248-F260 AromaticContact CG-CZ 3.69Å; Y248-F260 HydrophobicContact CG-CZ 3.69Å; V257-F260 VanDerWaalsContact O-CD2 3.23Å; V257-F260 WeakPolarHBondContact O-CD2 3.4Å; V257-F260 PolarHBondContact O-N 3.41Å; H258-F260 PolarHBondContact O-N 2.84Å; F260-P263 WeakPolarHBondContact O-CD 3.29Å |
| 261 | L | 96.7 | Very high | 95.3 | Very high | 59 Ų | 59 | 68.1 Ų | 68.1 | 31% | 0.309 | 35% | 0.35 | S | S | . | . | G | 310 helix | trans | -85.5 | -14.2 | 175.6 | -66.3 | 169.8 | 0 | 0 | 0 | 113.1 | I241 F245 H258 V259 P263 F264 | I241-L261 HydrophobicContact CG2-CD2 4.26Å; F245-L261 HydrophobicContact CB-CD2 3.78Å; F245-L261 HydrophobicContact CB-CG 4.04Å; F245-L261 HydrophobicContact CD1-CD1 4.29Å; F245-L261 HydrophobicContact CD1-CD2 4.16Å; F245-L261 HydrophobicContact CD1-CG 4.38Å; F245-L261 HydrophobicContact CD2-CD1 3.97Å; F245-L261 HydrophobicContact CD2-CD2 4.44Å; F245-L261 HydrophobicContact CD2-CG 3.89Å; F245-L261 HydrophobicContact CE1-CD1 4.39Å; F245-L261 HydrophobicContact CE2-CD1 4.07Å; F245-L261 HydrophobicContact CE2-CG 4.48Å; F245-L261 HydrophobicContact CG-CD1 4.07Å; F245-L261 HydrophobicContact CG-CD2 3.86Å; F245-L261 HydrophobicContact CG-CG 3.82Å; F245-L261 HydrophobicContact CZ-CD1 4.28Å; H258-L261 WeakPolarHBondContact O-CB 3.22Å; H258-L261 PolarHBondContact O-N 3.29Å; V259-L261 PolarHBondContact O-N 3.19Å; V259-L261 VanDerWaalsContact O-N 3.13Å; L261-P263 VanDerWaalsContact C-CD 3.47Å; L261-F264 WeakPolarHBondContact O-CB 3.47Å; L261-F264 PolarHBondContact O-N 3.09Å |
| 262 | Y | 96.4 | Very high | 95.5 | Very high | 146 Ų | 146 | 72.8 Ų | 72.8 | 57% | 0.573 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.8 | -37.9 | -177 | -68.2 | -5.2 | 0 | 0 | 0 | 114.3 | V259 F264 T265 | V259-Y262 HydrophobicContact CG1-CD2 4.27Å; V259-Y262 HydrophobicContact CG1-CE2 4.47Å; V259-Y262 HydrophobicContact CG2-CE2 4.17Å; V259-Y262 WeakPolarHBondContact O-CB 3.23Å; V259-Y262 PolarHBondContact O-N 3.15Å; V259-Y262 VanDerWaalsContact O-N 3.08Å; Y262-F264 PolarHBondContact O-N 2.88Å; Y262-T265 PolarHBondContact O-N 3.49Å; Y262-T265 VanDerWaalsContact O-N 3.13Å; Y262-T265 PolarHBondContact O-OG1 3.3Å |
| 263 | P | 97.1 | Very high | 95.8 | Very high | 61 Ų | 61 | 71.2 Ų | 71.2 | 40% | 0.396 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -55.4 | -25.4 | 174.2 | -28.2 | 37.4 | 0 | 0 | 0 | 114.2 | I241 F260 L261 T265 F266 I267 | I241-P263 HydrophobicContact CD1-CB 3.96Å; I241-P263 HydrophobicContact CG1-CB 4.43Å; F260-P263 WeakPolarHBondContact O-CD 3.29Å; L261-P263 VanDerWaalsContact C-CD 3.47Å; P263-T265 VanDerWaalsContact C-N 3.27Å; P263-T265 PolarHBondContact O-N 2.86Å; P263-F266 PolarHBondContact O-N 2.69Å; P263-I267 WeakPolarHBondContact O-CG1 3.37Å; P263-I267 PolarHBondContact O-N 3.48Å; P263-I267 VanDerWaalsContact O-N 3.07Å |
| 264 | F | 97.2 | Very high | 96 | Very high | 78 Ų | 78 | 71.1 Ų | 71.1 | 34% | 0.342 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.3 | -37.8 | 178.6 | -178.6 | -91 | 0 | 0 | 0 | 112.1 | F234 S238 I241 L261 Y262 I267 F268 | F234-F264 HydrophobicContact CE2-CE2 4.41Å; F234-F264 AromaticContact CZ-CE2 3.96Å; F234-F264 HydrophobicContact CZ-CE2 3.96Å; F234-F264 AromaticContact CZ-CZ 3.85Å; F234-F264 HydrophobicContact CZ-CZ 3.85Å; S238-F264 VanDerWaalsContact OG-CE2 3.25Å; S238-F264 WeakPolarHBondContact OG-CE2 3.37Å; I241-F264 HydrophobicContact CD1-CB 4.4Å; I241-F264 HydrophobicContact CG2-CB 4.42Å; L261-F264 WeakPolarHBondContact O-CB 3.47Å; L261-F264 PolarHBondContact O-N 3.09Å; Y262-F264 PolarHBondContact O-N 2.88Å; F264-I267 PolarHBondContact O-N 2.84Å; F264-F268 WeakPolarHBondContact O-CB 3.36Å; F264-F268 PolarHBondContact O-N 2.97Å |
| 265 | T | 96.7 | Very high | 96 | Very high | 75 Ų | 75 | 72.9 Ų | 72.9 | 46% | 0.46 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -65.5 | -42.5 | -178.9 | 61.4 | 0 | 0 | 0 | 0 | 111.3 | Y262 P263 F268 I269 | Y262-T265 PolarHBondContact O-N 3.49Å; Y262-T265 VanDerWaalsContact O-N 3.13Å; Y262-T265 PolarHBondContact O-OG1 3.3Å; P263-T265 VanDerWaalsContact C-N 3.27Å; P263-T265 PolarHBondContact O-N 2.86Å; T265-F268 PolarHBondContact O-N 2.69Å; T265-I269 VanDerWaalsContact O-CG1 3.32Å; T265-I269 WeakPolarHBondContact O-CG1 3.32Å; T265-I269 PolarHBondContact O-N 3.06Å |
| 266 | F | 97.1 | Very high | 96.1 | Very high | 152 Ų | 152 | 73.8 Ų | 73.8 | 67% | 0.667 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -65.8 | -40.7 | 176.4 | -63 | -78.1 | 0 | 0 | 0 | 112.1 | P263 I269 G270 | P263-F266 PolarHBondContact O-N 2.69Å; F266-I269 PolarHBondContact O-N 3.41Å; F266-G270 PolarHBondContact O-N 2.99Å |
| 267 | I | 97.3 | Very high | 96.1 | Very high | 62 Ų | 62 | 73.8 Ų | 73.8 | 32% | 0.318 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -67.2 | -37.7 | 176.9 | -64.7 | -62.3 | 0 | 0 | 0 | 111.5 | F234 V237 I241 P263 F264 G270 F271 | F234-I267 HydrophobicContact CD2-CG2 3.85Å; F234-I267 HydrophobicContact CE2-CG2 4.18Å; V237-I267 HydrophobicContact CB-CG2 4.24Å; V237-I267 HydrophobicContact CG1-CB 4.42Å; V237-I267 HydrophobicContact CG1-CD1 3.99Å; V237-I267 HydrophobicContact CG1-CG1 3.79Å; V237-I267 HydrophobicContact CG1-CG2 3.92Å; I241-I267 HydrophobicContact CD1-CG1 4.27Å; P263-I267 WeakPolarHBondContact O-CG1 3.37Å; P263-I267 PolarHBondContact O-N 3.48Å; P263-I267 VanDerWaalsContact O-N 3.07Å; F264-I267 PolarHBondContact O-N 2.84Å; I267-G270 PolarHBondContact O-N 3.33Å; I267-F271 WeakPolarHBondContact O-CB 3.4Å; I267-F271 PolarHBondContact O-N 3.49Å |
| 268 | F | 97.8 | Very high | 96 | Very high | 93 Ų | 93 | 79.9 Ų | 79.9 | 41% | 0.408 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.1 | -47.4 | 174 | -175.8 | -96.6 | 0 | 0 | 0 | 111.5 | F234 F264 T265 G270 F271 F272 | F234-F268 HydrophobicContact CE2-CB 4.09Å; F234-F268 HydrophobicContact CE2-CD2 4.02Å; F234-F268 AromaticContact CZ-CD2 3.76Å; F234-F268 HydrophobicContact CZ-CD2 3.76Å; F264-F268 WeakPolarHBondContact O-CB 3.36Å; F264-F268 PolarHBondContact O-N 2.97Å; T265-F268 PolarHBondContact O-N 2.69Å; F268-G270 PolarHBondContact O-N 3.09Å; F268-F271 WeakPolarHBondContact O-CB 3.19Å; F268-F271 PolarHBondContact O-N 3.38Å; F268-F272 HydrophobicContact CD1-CD2 4.18Å; F268-F272 HydrophobicContact CD1-CE2 4.08Å; F268-F272 HydrophobicContact CD2-CE2 4.05Å; F268-F272 AromaticContact CE1-CD2 3.97Å; F268-F272 HydrophobicContact CE1-CD2 3.97Å; F268-F272 AromaticContact CE1-CE2 3.58Å; F268-F272 HydrophobicContact CE1-CE2 3.58Å; F268-F272 AromaticContact CE2-CE2 3.56Å; F268-F272 HydrophobicContact CE2-CE2 3.56Å; F268-F272 HydrophobicContact CE2-CZ 4.34Å; F268-F272 HydrophobicContact CG-CE2 4.31Å; F268-F272 HydrophobicContact CZ-CD2 4.17Å; F268-F272 AromaticContact CZ-CE2 3.32Å; F268-F272 HydrophobicContact CZ-CE2 3.32Å; F268-F272 HydrophobicContact CZ-CZ 4.06Å; F268-F272 VanDerWaalsContact O-CD2 3.29Å; F268-F272 WeakPolarHBondContact O-CD2 3.45Å; F268-F272 PolarHBondContact O-N 3.43Å |
| 269 | I | 97.7 | Very high | 95.9 | Very high | 113 Ų | 113 | 81.2 Ų | 81.2 | 58% | 0.579 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -61.5 | -45.8 | 175.2 | -65.4 | 164.7 | 0 | 0 | 0 | 110.5 | T265 F266 F271 F272 A273 | T265-I269 VanDerWaalsContact O-CG1 3.32Å; T265-I269 WeakPolarHBondContact O-CG1 3.32Å; T265-I269 PolarHBondContact O-N 3.06Å; F266-I269 PolarHBondContact O-N 3.41Å; I269-F271 VanDerWaalsContact C-N 3.29Å; I269-F271 PolarHBondContact O-N 3.4Å; I269-F272 PolarHBondContact O-N 2.65Å; I269-A273 WeakPolarHBondContact O-CB 3.09Å; I269-A273 PolarHBondContact O-N 3.45Å |
| 270 | G | 95.9 | Very high | 95.8 | Very high | 38 Ų | 38 | 79.1 Ų | 79.1 | 39% | 0.392 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -60 | -36.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | F266 I267 F268 A273 S274 | F266-G270 PolarHBondContact O-N 2.99Å; I267-G270 PolarHBondContact O-N 3.33Å; F268-G270 PolarHBondContact O-N 3.09Å; G270-A273 PolarHBondContact O-N 3.13Å; G270-S274 WeakPolarHBondContact O-CB 3.38Å; G270-S274 PolarHBondContact O-N 2.75Å |
| 271 | F | 96.4 | Very high | 95.7 | Very high | 36 Ų | 36 | 79.8 Ų | 79.8 | 16% | 0.158 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -60.4 | -53.9 | 173.9 | 171.7 | -108.9 | 0 | 0 | 0 | 111.2 | N230 A231 F234 I267 F268 I269 A273 S274 L275 | N230-F271 HydrophobicContact CB-CD2 4.04Å; N230-F271 HydrophobicContact CB-CE2 3.9Å; A231-F271 HydrophobicContact CB-CE2 4.35Å; F234-F271 HydrophobicContact CB-CB 4.32Å; F234-F271 HydrophobicContact CB-CD2 3.73Å; F234-F271 HydrophobicContact CB-CE2 4.24Å; F234-F271 HydrophobicContact CB-CG 4.03Å; F234-F271 HydrophobicContact CD2-CB 3.77Å; F234-F271 HydrophobicContact CD2-CG 4.09Å; F234-F271 HydrophobicContact CG-CB 4.2Å; F234-F271 HydrophobicContact CG-CD1 4.44Å; F234-F271 HydrophobicContact CG-CD2 4.21Å; F234-F271 HydrophobicContact CG-CG 4.02Å; I267-F271 WeakPolarHBondContact O-CB 3.4Å; I267-F271 PolarHBondContact O-N 3.49Å; F268-F271 WeakPolarHBondContact O-CB 3.19Å; F268-F271 PolarHBondContact O-N 3.38Å; I269-F271 VanDerWaalsContact C-N 3.29Å; I269-F271 PolarHBondContact O-N 3.4Å; F271-A273 VanDerWaalsContact C-N 3.34Å; F271-A273 PolarHBondContact O-N 3.16Å; F271-S274 PolarHBondContact O-N 3.19Å; F271-S274 PolarHBondContact O-OG 2.86Å; F271-L275 HydrophobicContact CE1-CD1 3.93Å; F271-L275 HydrophobicContact CE2-CD1 4.15Å; F271-L275 HydrophobicContact CE2-CD2 4.45Å; F271-L275 HydrophobicContact CE2-CG 4.39Å; F271-L275 HydrophobicContact CZ-CD1 3.71Å; F271-L275 HydrophobicContact CZ-CG 4.43Å; F271-L275 WeakPolarHBondContact O-CG 3.49Å; F271-L275 PolarHBondContact O-N 3.05Å |
| 272 | F | 96.4 | Very high | 95.5 | Very high | 101 Ų | 101 | 77 Ų | 77 | 44% | 0.443 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.7 | -38.4 | 178.1 | -74.2 | -79.4 | 0 | 0 | 0 | 112.8 | F268 I269 S274 L275 T276 | F268-F272 HydrophobicContact CD1-CD2 4.18Å; F268-F272 HydrophobicContact CD1-CE2 4.08Å; F268-F272 HydrophobicContact CD2-CE2 4.05Å; F268-F272 AromaticContact CE1-CD2 3.97Å; F268-F272 HydrophobicContact CE1-CD2 3.97Å; F268-F272 AromaticContact CE1-CE2 3.58Å; F268-F272 HydrophobicContact CE1-CE2 3.58Å; F268-F272 AromaticContact CE2-CE2 3.56Å; F268-F272 HydrophobicContact CE2-CE2 3.56Å; F268-F272 HydrophobicContact CE2-CZ 4.34Å; F268-F272 HydrophobicContact CG-CE2 4.31Å; F268-F272 HydrophobicContact CZ-CD2 4.17Å; F268-F272 AromaticContact CZ-CE2 3.32Å; F268-F272 HydrophobicContact CZ-CE2 3.32Å; F268-F272 HydrophobicContact CZ-CZ 4.06Å; F268-F272 VanDerWaalsContact O-CD2 3.29Å; F268-F272 WeakPolarHBondContact O-CD2 3.45Å; F268-F272 PolarHBondContact O-N 3.43Å; I269-F272 PolarHBondContact O-N 2.65Å; F272-S274 VanDerWaalsContact C-N 3.33Å; F272-S274 PolarHBondContact O-N 3Å; F272-L275 PolarHBondContact O-N 3.47Å; F272-L275 VanDerWaalsContact O-N 3.16Å; F272-T276 PolarHBondContact O-N 3Å |
| 273 | A | 96.3 | Very high | 95.3 | Very high | 48 Ų | 48 | 73.1 Ų | 73.1 | 40% | 0.397 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.4 | -38.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | I269 G270 F271 L275 T276 V277 | I269-A273 WeakPolarHBondContact O-CB 3.09Å; I269-A273 PolarHBondContact O-N 3.45Å; G270-A273 PolarHBondContact O-N 3.13Å; F271-A273 VanDerWaalsContact C-N 3.34Å; F271-A273 PolarHBondContact O-N 3.16Å; A273-L275 VanDerWaalsContact C-N 3.26Å; A273-L275 PolarHBondContact O-N 2.97Å; A273-T276 PolarHBondContact O-N 3.09Å; A273-T276 PolarHBondContact O-OG1 2.8Å; A273-V277 WeakPolarHBondContact O-CG2 3.25Å; A273-V277 PolarHBondContact O-N 3Å |
| 274 | S | 95.2 | Very high | 95.1 | Very high | 12 Ų | 12 | 72 Ų | 72 | 8% | 0.084 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.5 | -35.3 | 175.2 | 74.7 | 0 | 0 | 0 | 0 | 112.1 | N230 G270 F271 F272 R278 W279 | N230-S274 WeakPolarHBondContact ND2-CB 3.4Å; N230-S274 PolarHBondContact ND2-OG 3.31Å; G270-S274 WeakPolarHBondContact O-CB 3.38Å; G270-S274 PolarHBondContact O-N 2.75Å; F271-S274 PolarHBondContact O-N 3.19Å; F271-S274 PolarHBondContact O-OG 2.86Å; F272-S274 VanDerWaalsContact C-N 3.33Å; F272-S274 PolarHBondContact O-N 3Å; S274-R278 PolarHBondContact O-N 2.69Å; S274-R278 VanDerWaalsContact O-N 3.07Å; S274-W279 PolarHBondContact O-N 3.3Å |
| 275 | L | 93.5 | Very high | 94.8 | Very high | 38 Ų | 38 | 69.4 Ų | 69.4 | 20% | 0.199 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -73.5 | -39 | 179.4 | -62 | -175.1 | 0 | 0 | 0 | 112.5 | L227 N230 F271 F272 A273 V277 R278 | L227-L275 HydrophobicContact CD2-CD1 3.8Å; L227-L275 HydrophobicContact CD2-CD2 3.67Å; L227-L275 HydrophobicContact CD2-CG 4.29Å; L227-L275 HydrophobicContact CG-CD2 4.43Å; N230-L275 HydrophobicContact CB-CD2 4.22Å; F271-L275 HydrophobicContact CE1-CD1 3.93Å; F271-L275 HydrophobicContact CE2-CD1 4.15Å; F271-L275 HydrophobicContact CE2-CD2 4.45Å; F271-L275 HydrophobicContact CE2-CG 4.39Å; F271-L275 HydrophobicContact CZ-CD1 3.71Å; F271-L275 HydrophobicContact CZ-CG 4.43Å; F271-L275 WeakPolarHBondContact O-CG 3.49Å; F271-L275 PolarHBondContact O-N 3.05Å; F272-L275 PolarHBondContact O-N 3.47Å; F272-L275 VanDerWaalsContact O-N 3.16Å; A273-L275 VanDerWaalsContact C-N 3.26Å; A273-L275 PolarHBondContact O-N 2.97Å; L275-V277 VanDerWaalsContact C-N 3.34Å; L275-V277 PolarHBondContact O-N 3.35Å; L275-R278 PolarHBondContact O-N 2.78Å; L275-R278 VanDerWaalsContact O-N 3.15Å |
| 276 | T | 94.2 | Very high | 94.6 | Very high | 113 Ų | 113 | 66 Ų | 66 | 69% | 0.693 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -65.5 | -38.1 | 178.1 | 56.4 | 0 | 0 | 0 | 0 | 111.8 | F272 A273 R278 | F272-T276 PolarHBondContact O-N 3Å; A273-T276 PolarHBondContact O-N 3.09Å; A273-T276 PolarHBondContact O-OG1 2.8Å; T276-R278 VanDerWaalsContact C-N 3.28Å |
| 277 | V | 94.5 | Very high | 94.3 | Very high | 114 Ų | 114 | 62 Ų | 62 | 69% | 0.691 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | -7.7 | 175.9 | -175.4 | 0 | 0 | 0 | 0 | 112.2 | A273 L275 W279 | A273-V277 WeakPolarHBondContact O-CG2 3.25Å; A273-V277 PolarHBondContact O-N 3Å; L275-V277 VanDerWaalsContact C-N 3.34Å; L275-V277 PolarHBondContact O-N 3.35Å; V277-W279 HydrophobicContact CG1-CB 4.45Å; V277-W279 PolarHBondContact O-N 2.98Å |
| 278 | R | 92.5 | Very high | 94 | Very high | 146 Ų | 146 | 63.5 Ų | 63.5 | 55% | 0.551 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.4 | 31.7 | -174.5 | -54.2 | 172.9 | 59.3 | 93.7 | 0.4 | 113.1 | S274 L275 T276 | S274-R278 PolarHBondContact O-N 2.69Å; S274-R278 VanDerWaalsContact O-N 3.07Å; L275-R278 PolarHBondContact O-N 2.78Å; L275-R278 VanDerWaalsContact O-N 3.15Å; T276-R278 VanDerWaalsContact C-N 3.28Å |
| 279 | W | 93.4 | Very high | 93.6 | Very high | 145 Ų | 145 | 60 Ų | 60 | 55% | 0.549 | 32% | 0.317 | S | S | . | . | trans | -88.6 | 121.3 | 179.2 | -178.7 | 64.5 | 0 | 0 | 0 | 110.9 | N230 S274 V277 V281 A284 | N230-W279 PolarHBondContact ND2-O 3.21Å; S274-W279 PolarHBondContact O-N 3.3Å; V277-W279 HydrophobicContact CG1-CB 4.45Å; V277-W279 PolarHBondContact O-N 2.98Å; W279-V281 HydrophobicContact CE3-CG2 4.08Å; W279-V281 HydrophobicContact CH2-CG2 4.19Å; W279-V281 HydrophobicContact CZ3-CG2 3.68Å; W279-A284 HydrophobicContact CZ2-CB 3.89Å | ||
| 280 | S | 93.5 | Very high | 93.2 | Very high | 15 Ų | 15 | 60.3 Ų | 60.3 | 11% | 0.105 | 31% | 0.31 | C | S | . | . | trans | -90.7 | 112.8 | 179.2 | 174.5 | 0 | 0 | 0 | 0 | 110.3 | Y215 S282 E283 A284 | Y215-S280 PolarHBondContact OH-OG 2.89Å; S280-S282 VanDerWaalsContact C-N 3.27Å; S280-S282 PolarHBondContact O-N 2.84Å; S280-E283 PolarHBondContact O-N 2.77Å; S280-E283 WeakPolarHBondContact OG-CB 3.49Å; S280-E283 PolarHBondContact OG-N 2.9Å; S280-E283 VanDerWaalsContact OG-N 3.1Å; S280-A284 PolarHBondContact O-N 2.93Å | ||
| 281 | V | 93.6 | Very high | 92.9 | Very high | 31 Ų | 31 | 68 Ų | 68 | 19% | 0.188 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.5 | -40.3 | 175.3 | -178.2 | 0 | 0 | 0 | 0 | 110.2 | N230 W233 W279 E283 A284 V285 | N230-V281 PolarHBondContact OD1-N 3.46Å; W233-V281 HydrophobicContact CD2-CG1 3.75Å; W233-V281 HydrophobicContact CE3-CG1 4.37Å; W233-V281 HydrophobicContact CG-CB 4.19Å; W233-V281 HydrophobicContact CG-CG1 3.87Å; W233-V281 HydrophobicContact CZ2-CG1 4.32Å; W279-V281 HydrophobicContact CE3-CG2 4.08Å; W279-V281 HydrophobicContact CH2-CG2 4.19Å; W279-V281 HydrophobicContact CZ3-CG2 3.68Å; V281-E283 VanDerWaalsContact C-N 3.33Å; V281-E283 PolarHBondContact O-N 2.94Å; V281-A284 WeakPolarHBondContact O-CB 3.24Å; V281-A284 PolarHBondContact O-N 2.82Å; V281-V285 HydrophobicContact CG1-CG2 4.33Å; V281-V285 VanDerWaalsContact O-CG2 3.26Å; V281-V285 WeakPolarHBondContact O-CG2 3.22Å; V281-V285 PolarHBondContact O-N 2.94Å |
| 282 | S | 93.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 71.3 Ų | 71.3 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.3 | -39.6 | 178.2 | -57.5 | 0 | 0 | 0 | 0 | 112.3 | L211 Y215 G229 W233 S280 A284 V285 F286 | L211-S282 VanDerWaalsContact CD1-OG 3.29Å; L211-S282 WeakPolarHBondContact CD1-OG 3.35Å; Y215-S282 VanDerWaalsContact CE2-CB 3.49Å; G229-S282 WeakPolarHBondContact CA-OG 3.3Å; W233-S282 PolarHBondContact NE1-OG 2.99Å; S280-S282 VanDerWaalsContact C-N 3.27Å; S280-S282 PolarHBondContact O-N 2.84Å; S282-A284 VanDerWaalsContact C-N 3.34Å; S282-A284 PolarHBondContact O-N 2.74Å; S282-V285 PolarHBondContact O-N 3.06Å; S282-F286 WeakPolarHBondContact O-CB 3.49Å; S282-F286 VanDerWaalsContact O-CD2 3.24Å; S282-F286 WeakPolarHBondContact O-CD2 3.27Å; S282-F286 PolarHBondContact O-N 3.08Å |
| 283 | E | 91.2 | Very high | 91.9 | Very high | 64 Ų | 64 | 66.6 Ų | 66.6 | 30% | 0.299 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62 | -45.3 | 176.2 | -173.6 | 57.6 | -153.5 | 0 | 0 | 110.5 | Y215 S280 V281 V285 F286 N287 | Y215-E283 WeakPolarHBondContact OH-CA 3.18Å; Y215-E283 VanDerWaalsContact OH-CB 3.29Å; Y215-E283 WeakPolarHBondContact OH-CB 3.38Å; Y215-E283 PolarHBondContact OH-N 3.05Å; Y215-E283 PolarHBondContact OH-OE2 3.3Å; S280-E283 PolarHBondContact O-N 2.77Å; S280-E283 WeakPolarHBondContact OG-CB 3.49Å; S280-E283 PolarHBondContact OG-N 2.9Å; S280-E283 VanDerWaalsContact OG-N 3.1Å; V281-E283 VanDerWaalsContact C-N 3.33Å; V281-E283 PolarHBondContact O-N 2.94Å; E283-V285 VanDerWaalsContact C-N 3.3Å; E283-V285 PolarHBondContact O-N 3.37Å; E283-F286 PolarHBondContact O-N 2.9Å; E283-N287 WeakPolarHBondContact O-CB 3.24Å; E283-N287 VanDerWaalsContact O-CG 3.28Å; E283-N287 PolarHBondContact O-N 3.46Å; E283-N287 PolarHBondContact O-ND2 2.77Å; E283-N287 VanDerWaalsContact O-ND2 3.14Å; E283-N287 PolarHBondContact OE1-ND2 3.41Å |
| 284 | A | 92.4 | Very high | 90.7 | Very high | 38 Ų | 38 | 65.7 Ų | 65.7 | 31% | 0.314 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.3 | -40.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | W279 S280 V281 S282 F288 | W279-A284 HydrophobicContact CZ2-CB 3.89Å; S280-A284 PolarHBondContact O-N 2.93Å; V281-A284 WeakPolarHBondContact O-CB 3.24Å; V281-A284 PolarHBondContact O-N 2.82Å; S282-A284 VanDerWaalsContact C-N 3.34Å; S282-A284 PolarHBondContact O-N 2.74Å; A284-F288 VanDerWaalsContact O-CB 3.27Å; A284-F288 WeakPolarHBondContact O-CB 3.26Å; A284-F288 PolarHBondContact O-N 2.9Å |
| 285 | V | 92 | Very high | 88.9 | Confident | 24 Ų | 24 | 73.1 Ų | 73.1 | 15% | 0.145 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -71.4 | -43.3 | 180 | 171.1 | 0 | 0 | 0 | 0 | 111.8 | W233 V281 S282 E283 N287 F288 Y289 | W233-V285 HydrophobicContact CH2-CG2 4.1Å; W233-V285 HydrophobicContact CZ2-CB 4.26Å; W233-V285 HydrophobicContact CZ2-CG1 4.21Å; W233-V285 HydrophobicContact CZ2-CG2 3.49Å; W233-V285 VanDerWaalsContact CZ2-CG2 3.49Å; V281-V285 HydrophobicContact CG1-CG2 4.33Å; V281-V285 VanDerWaalsContact O-CG2 3.26Å; V281-V285 WeakPolarHBondContact O-CG2 3.22Å; V281-V285 PolarHBondContact O-N 2.94Å; S282-V285 PolarHBondContact O-N 3.06Å; E283-V285 VanDerWaalsContact C-N 3.3Å; E283-V285 PolarHBondContact O-N 3.37Å; V285-N287 VanDerWaalsContact C-N 3.32Å; V285-N287 PolarHBondContact O-N 3.16Å; V285-F288 WeakPolarHBondContact O-CB 3.2Å; V285-F288 PolarHBondContact O-N 2.87Å; V285-Y289 HydrophobicContact CG1-CD2 3.66Å; V285-Y289 HydrophobicContact CG1-CE2 3.39Å; V285-Y289 WeakPolarHBondContact O-CD2 3.24Å; V285-Y289 PolarHBondContact O-N 2.83Å |
| 286 | F | 91 | Very high | 88.7 | Confident | 3 Ų | 3 | 74.9 Ų | 74.9 | 1% | 0.013 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 175.1 | -90.6 | -111 | 0 | 0 | 0 | 111 | Y137 L141 L211 P212 Y215 S282 E283 Y289 R290 | Y137-F286 HydrophobicContact CE1-CE1 4.31Å; Y137-F286 AromaticContact CE1-CE2 3.87Å; Y137-F286 HydrophobicContact CE1-CE2 3.87Å; Y137-F286 AromaticContact CE1-CZ 3.74Å; Y137-F286 HydrophobicContact CE1-CZ 3.74Å; L141-F286 HydrophobicContact CD2-CD1 3.44Å; L141-F286 VanDerWaalsContact CD2-CD1 3.44Å; L141-F286 HydrophobicContact CD2-CE1 3.85Å; L141-F286 HydrophobicContact CD2-CG 4.29Å; L211-F286 HydrophobicContact CD2-CE2 4.33Å; L211-F286 HydrophobicContact CG-CE2 4.27Å; P212-F286 HydrophobicContact CB-CZ 4.31Å; Y215-F286 HydrophobicContact CD1-CD1 4.27Å; Y215-F286 HydrophobicContact CD1-CD2 4.01Å; Y215-F286 HydrophobicContact CD1-CE1 4.27Å; Y215-F286 AromaticContact CD1-CE2 3.99Å; Y215-F286 HydrophobicContact CD1-CE2 3.99Å; Y215-F286 HydrophobicContact CD1-CG 4.15Å; Y215-F286 HydrophobicContact CD1-CZ 4.13Å; Y215-F286 HydrophobicContact CE1-CD2 4.4Å; Y215-F286 HydrophobicContact CE1-CG 4.38Å; Y215-F286 HydrophobicContact CG-CE2 4.31Å; Y215-F286 HydrophobicContact CG-CZ 4.5Å; S282-F286 WeakPolarHBondContact O-CB 3.49Å; S282-F286 VanDerWaalsContact O-CD2 3.24Å; S282-F286 WeakPolarHBondContact O-CD2 3.27Å; S282-F286 PolarHBondContact O-N 3.08Å; E283-F286 PolarHBondContact O-N 2.9Å; F286-Y289 PolarHBondContact O-N 2.87Å; F286-R290 WeakPolarHBondContact O-CB 3.39Å; F286-R290 WeakPolarHBondContact O-CG 3.36Å; F286-R290 PolarHBondContact O-N 3.37Å |
| 287 | N | 90.8 | Very high | 88.4 | Confident | 68 Ų | 68 | 72.8 Ų | 72.8 | 36% | 0.364 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -67.5 | -37.5 | 176.7 | -70.1 | -28.8 | 0 | 0 | 0 | 112.1 | E283 V285 R290 Y291 | E283-N287 WeakPolarHBondContact O-CB 3.24Å; E283-N287 VanDerWaalsContact O-CG 3.28Å; E283-N287 PolarHBondContact O-N 3.46Å; E283-N287 PolarHBondContact O-ND2 2.77Å; E283-N287 VanDerWaalsContact O-ND2 3.14Å; E283-N287 PolarHBondContact OE1-ND2 3.41Å; V285-N287 VanDerWaalsContact C-N 3.32Å; V285-N287 PolarHBondContact O-N 3.16Å; N287-R290 PolarHBondContact O-N 2.8Å; N287-R290 PolarHBondContact OD1-NH1 3.12Å; N287-Y291 WeakPolarHBondContact O-CB 3.35Å; N287-Y291 PolarHBondContact O-N 2.77Å |
| 288 | F | 91.7 | Very high | 88 | Confident | 93 Ų | 93 | 70.6 Ų | 70.6 | 41% | 0.408 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -59.8 | -48.6 | 172.3 | 173.6 | -99.9 | 0 | 0 | 0 | 111.7 | W154 A284 V285 Y291 R292 | W154-F288 HydrophobicContact CH2-CZ 4.32Å; W154-F288 HydrophobicContact CZ2-CE1 4.17Å; W154-F288 AromaticContact CZ2-CZ 3.86Å; W154-F288 HydrophobicContact CZ2-CZ 3.86Å; A284-F288 VanDerWaalsContact O-CB 3.27Å; A284-F288 WeakPolarHBondContact O-CB 3.26Å; A284-F288 PolarHBondContact O-N 2.9Å; V285-F288 WeakPolarHBondContact O-CB 3.2Å; V285-F288 PolarHBondContact O-N 2.87Å; F288-Y291 PolarHBondContact O-N 3.07Å; F288-R292 VanDerWaalsContact O-CB 3.27Å; F288-R292 WeakPolarHBondContact O-CB 3.49Å; F288-R292 PolarHBondContact O-N 3.18Å |
| 289 | Y | 90.3 | Very high | 87.8 | Confident | 20 Ų | 20 | 66.1 Ų | 66.1 | 8% | 0.078 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -68.2 | -39.7 | 178.9 | -72.1 | -47.6 | 0 | 0 | 0 | 112.3 | Y137 F151 D159 V285 F286 Y291 R292 V293 | Y137-Y289 HydrophobicContact CE1-CD2 4.4Å; F151-Y289 HydrophobicContact CD2-CD1 4.1Å; F151-Y289 HydrophobicContact CD2-CE1 4.37Å; F151-Y289 HydrophobicContact CD2-CG 4.45Å; F151-Y289 AromaticContact CE2-CD1 3.72Å; F151-Y289 HydrophobicContact CE2-CD1 3.72Å; F151-Y289 HydrophobicContact CE2-CD2 4.08Å; F151-Y289 AromaticContact CE2-CE1 3.76Å; F151-Y289 HydrophobicContact CE2-CE1 3.76Å; F151-Y289 HydrophobicContact CE2-CE2 4.11Å; F151-Y289 AromaticContact CE2-CG 3.89Å; F151-Y289 HydrophobicContact CE2-CG 3.89Å; F151-Y289 AromaticContact CE2-CZ 3.96Å; D159-Y289 PolarHBondContact OD2-OH 3.22Å; V285-Y289 HydrophobicContact CG1-CD2 3.66Å; V285-Y289 HydrophobicContact CG1-CE2 3.39Å; V285-Y289 WeakPolarHBondContact O-CD2 3.24Å; V285-Y289 PolarHBondContact O-N 2.83Å; F286-Y289 PolarHBondContact O-N 2.87Å; Y289-Y291 VanDerWaalsContact C-N 3.34Å; Y289-Y291 PolarHBondContact O-N 3.25Å; Y289-R292 PolarHBondContact O-N 2.99Å; Y289-V293 WeakPolarHBondContact O-CA 3.27Å; Y289-V293 WeakPolarHBondContact O-CB 3.35Å; Y289-V293 WeakPolarHBondContact O-CG2 3.38Å; Y289-V293 PolarHBondContact O-N 3.47Å |
| 290 | R | 88.4 | Confident | 87.4 | Confident | 119 Ų | 119 | 61.2 Ų | 61.2 | 45% | 0.449 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -58.3 | -46.4 | 172.4 | -75.5 | -176 | -173.1 | 133.1 | -1.6 | 111.7 | L141 F286 N287 G294 | L141-R290 HydrophobicContact CD2-CG 3.91Å; F286-R290 WeakPolarHBondContact O-CB 3.39Å; F286-R290 WeakPolarHBondContact O-CG 3.36Å; F286-R290 PolarHBondContact O-N 3.37Å; N287-R290 PolarHBondContact O-N 2.8Å; N287-R290 PolarHBondContact OD1-NH1 3.12Å; R290-G294 WeakPolarHBondContact O-CA 3.5Å; R290-G294 PolarHBondContact O-N 3.25Å |
| 291 | Y | 89.6 | Confident | 87 | Confident | 199 Ų | 199 | 64.3 Ų | 64.3 | 78% | 0.78 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -65.5 | -41.1 | 178.1 | 176.2 | -102.9 | 0 | 0 | 0 | 112.2 | N287 F288 Y289 | N287-Y291 WeakPolarHBondContact O-CB 3.35Å; N287-Y291 PolarHBondContact O-N 2.77Å; F288-Y291 PolarHBondContact O-N 3.07Å; Y289-Y291 VanDerWaalsContact C-N 3.34Å; Y289-Y291 PolarHBondContact O-N 3.25Å |
| 292 | R | 86.8 | Confident | 86.6 | Confident | 106 Ų | 106 | 66.6 Ų | 66.6 | 40% | 0.4 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -79 | -37.5 | -173.5 | -169.3 | 64.2 | -174.2 | 92.9 | -6.5 | 112.6 | K150 W154 F288 Y289 | K150-R292 WeakPolarHBondContact CE-O 3.44Å; K150-R292 PolarHBondContact NZ-O 3.17Å; W154-R292 HydrophobicContact CE3-CG 4.26Å; W154-R292 HydrophobicContact CH2-CG 4.43Å; W154-R292 HydrophobicContact CZ3-CG 4.09Å; F288-R292 VanDerWaalsContact O-CB 3.27Å; F288-R292 WeakPolarHBondContact O-CB 3.49Å; F288-R292 PolarHBondContact O-N 3.18Å; Y289-R292 PolarHBondContact O-N 2.99Å |
| 293 | V | 84.7 | Confident | 86 | Confident | 2 Ų | 2 | 71.8 Ų | 71.8 | 1% | 0.012 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -101.6 | -34 | -172.5 | -178.2 | 0 | 0 | 0 | 0 | 112.4 | L143 G147 K150 F151 Y289 | L143-V293 HydrophobicContact CD1-CG1 3.69Å; L143-V293 HydrophobicContact CD2-CB 4.45Å; L143-V293 HydrophobicContact CD2-CG1 3.93Å; L143-V293 HydrophobicContact CG-CG1 4.42Å; G147-V293 WeakPolarHBondContact O-CG1 3.38Å; K150-V293 HydrophobicContact CB-CG1 4.49Å; F151-V293 HydrophobicContact CB-CG1 3.98Å; F151-V293 HydrophobicContact CB-CG2 4.02Å; F151-V293 HydrophobicContact CD2-CG2 3.95Å; F151-V293 HydrophobicContact CG-CG2 4.49Å; Y289-V293 WeakPolarHBondContact O-CA 3.27Å; Y289-V293 WeakPolarHBondContact O-CB 3.35Å; Y289-V293 WeakPolarHBondContact O-CG2 3.38Å; Y289-V293 PolarHBondContact O-N 3.47Å |
| 294 | G | 71.7 | Confident | 85.6 | Confident | 29 Ų | 29 | 72.4 Ų | 72.4 | 30% | 0.299 | 35% | 0.347 | S | S | . | . | trans | -49.9 | 144.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.4 | R290 | R290-G294 WeakPolarHBondContact O-CA 3.5Å; R290-G294 PolarHBondContact O-N 3.25Å | ||
| 295 | D | 57.4 | Low | 84.9 | Confident | 168 Ų | 168 | 75.5 Ų | 75.5 | 90% | 0.898 | 35% | 0.35 | S | S | * | . | trans | -75.3 | 0 | 174.1 | -61.4 | -42.2 | 0 | 0 | 0 | 110.6 | S144 | S144-D295 WeakPolarHBondContact CB-OD2 3.34Å; S144-D295 PolarHBondContact OG-OD2 3.37Å |
Retrieved 295 of 295 residues in 194.3 ms
(Link to these results)