| 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 | 51.3 | Low | 44.1 | Very low | 241 Ų | 241 | 134.4 Ų | 134.4 | 100% | 1.187 | 72% | 0.718 | S | S | * | * | 0 | 32.4 | 0 | -135.1 | 171.3 | 87.8 | 0 | 0 | 113.4 | |||||
| 2 | A | 47.2 | Very low | 44.2 | Very low | 84 Ų | 84 | 129.6 Ų | 129.6 | 69% | 0.694 | 70% | 0.7 | S | S | * | * | trans | -123.1 | 3.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 3 | M | 41.5 | Very low | 44 | Very low | 168 Ų | 168 | 124.5 Ų | 124.5 | 83% | 0.828 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -99.4 | -12.3 | 179.5 | -125 | -163.9 | 173.1 | 0 | 0 | 114.1 | ||
| 4 | A | 42.2 | Very low | 43.9 | Very low | 85 Ų | 85 | 123.7 Ų | 123.7 | 70% | 0.702 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -83 | -22.7 | 180 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 5 | Q | 44.1 | Very low | 43.4 | Very low | 151 Ų | 151 | 129.3 Ų | 129.3 | 71% | 0.706 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -84.7 | -15.2 | -179.3 | -95.4 | 175.3 | -32.4 | 0 | 0 | 114.5 | S8 | Q5-S8 PolarHBondContact O-OG 3.04Š|
| 6 | K | 41.4 | Very low | 43.2 | Very low | 177 Ų | 177 | 130.9 Ų | 130.9 | 77% | 0.77 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -82.6 | -17.8 | 177 | -96.4 | -175.8 | 174.9 | -177.3 | 0 | 113.8 | ||
| 7 | L | 42.2 | Very low | 43.2 | Very low | 122 Ų | 122 | 130 Ų | 130 | 64% | 0.639 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -85.9 | -20.7 | 178.6 | -100.4 | 129.1 | 0 | 0 | 0 | 113.6 | H9 | L7-H9 VanDerWaalsContact C-N 3.34Å; L7-H9 PolarHBondContact O-N 3.3Å |
| 8 | S | 41.3 | Very low | 43.2 | Very low | 65 Ų | 65 | 130.3 Ų | 130.3 | 46% | 0.455 | 69% | 0.685 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75 | -21.5 | -179.8 | 57.2 | 0 | 0 | 0 | 0 | 113.9 | Q5 | Q5-S8 PolarHBondContact O-OG 3.04Š|
| 9 | H | 44.8 | Very low | 43 | Very low | 155 Ų | 155 | 132.1 Ų | 132.1 | 72% | 0.718 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | -10.8 | 179.2 | -74.8 | -74.1 | 0 | 0 | 0 | 114.3 | L7 P12 | L7-H9 VanDerWaalsContact C-N 3.34Å; L7-H9 PolarHBondContact O-N 3.3Å; H9-P12 WeakPolarHBondContact O-CD 3.47Å |
| 10 | L | 43.8 | Very low | 43 | Very low | 113 Ų | 113 | 133.7 Ų | 133.7 | 59% | 0.592 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -14 | 177.3 | -72.8 | 167.9 | 0 | 0 | 0 | 113.4 | S13 | L10-S13 PolarHBondContact O-OG 3.47Š|
| 11 | L | 45.8 | Very low | 42.8 | Very low | 117 Ų | 117 | 132.6 Ų | 132.6 | 61% | 0.613 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -73.1 | -32 | 177.7 | -83.2 | 153.8 | 0 | 0 | 0 | 115.1 | ||
| 12 | P | 44.6 | Very low | 42.3 | Very low | 77 Ų | 77 | 130.6 Ų | 130.6 | 50% | 0.5 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -72.5 | -31.7 | 179.2 | -16.6 | 30.2 | 0 | 0 | 0 | 113.6 | H9 R15 Q16 | H9-P12 WeakPolarHBondContact O-CD 3.47Å; P12-R15 PolarHBondContact O-N 3.48Å; P12-Q16 PolarHBondContact O-N 3.29Å |
| 13 | S | 41.9 | Very low | 42.1 | Very low | 63 Ų | 63 | 133.8 Ų | 133.8 | 44% | 0.441 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -73.2 | -30.9 | -177.4 | 65.1 | 0 | 0 | 0 | 0 | 112.7 | L10 Q16 V17 | L10-S13 PolarHBondContact O-OG 3.47Å; S13-Q16 PolarHBondContact O-N 2.84Å; S13-V17 WeakPolarHBondContact O-CG2 3.15Å; S13-V17 PolarHBondContact O-N 3.11Å |
| 14 | L | 42.3 | Very low | 42 | Very low | 114 Ų | 114 | 130.1 Ų | 130.1 | 60% | 0.597 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -71.8 | -28.2 | 173.5 | -89.4 | 157.2 | 0 | 0 | 0 | 112.8 | I18 | L14-I18 WeakPolarHBondContact O-CD1 3.4Å; L14-I18 VanDerWaalsContact O-CG1 3.31Å; L14-I18 WeakPolarHBondContact O-CG1 3.44Å; L14-I18 PolarHBondContact O-N 3.24Å |
| 15 | R | 37.2 | Very low | 42.2 | Very low | 207 Ų | 207 | 134.3 Ų | 134.3 | 78% | 0.781 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -71.9 | -29.9 | 174.5 | -96.3 | -174.5 | 176.8 | -174.2 | -1.2 | 113.2 | P12 | P12-R15 PolarHBondContact O-N 3.48Å |
| 16 | Q | 39.5 | Very low | 42.3 | Very low | 156 Ų | 156 | 134 Ų | 134 | 73% | 0.729 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -79.5 | -24.5 | 177.8 | -75.1 | -178.2 | -23.5 | 0 | 0 | 113.2 | P12 S13 I18 | P12-Q16 PolarHBondContact O-N 3.29Å; S13-Q16 PolarHBondContact O-N 2.84Å; Q16-I18 VanDerWaalsContact C-N 3.33Å |
| 17 | V | 43.5 | Very low | 42.7 | Very low | 115 Ų | 115 | 131.2 Ų | 131.2 | 70% | 0.697 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -78.9 | -17.8 | 174.1 | 177.6 | 0 | 0 | 0 | 0 | 112.3 | S13 Q19 | S13-V17 WeakPolarHBondContact O-CG2 3.15Å; S13-V17 PolarHBondContact O-N 3.11Å; V17-Q19 VanDerWaalsContact C-N 3.35Å |
| 18 | I | 43.7 | Very low | 43.2 | Very low | 135 Ų | 135 | 133.5 Ų | 133.5 | 69% | 0.692 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | 2.2 | 178.4 | -63.9 | 167.6 | 0 | 0 | 0 | 112.1 | L14 Q16 E20 | L14-I18 WeakPolarHBondContact O-CD1 3.4Å; L14-I18 VanDerWaalsContact O-CG1 3.31Å; L14-I18 WeakPolarHBondContact O-CG1 3.44Å; L14-I18 PolarHBondContact O-N 3.24Å; Q16-I18 VanDerWaalsContact C-N 3.33Å; I18-E20 VanDerWaalsContact C-N 3.26Å; I18-E20 PolarHBondContact O-N 2.94Å |
| 19 | Q | 38.2 | Very low | 44 | Very low | 165 Ų | 165 | 134.3 Ų | 134.3 | 77% | 0.771 | 70% | 0.697 | S | S | * | * | trans | -94.3 | 58.2 | 172.9 | -147.1 | 159.3 | 16.8 | 0 | 0 | 110.2 | V17 | V17-Q19 VanDerWaalsContact C-N 3.35Š| ||
| 20 | E | 44.4 | Very low | 44.8 | Very low | 163 Ų | 163 | 128.8 Ų | 128.8 | 76% | 0.762 | 67% | 0.674 | S | S | * | * | trans | -58.6 | 144 | 153.8 | -80.3 | -159 | 157.3 | 0 | 0 | 108.1 | I18 Q22 | I18-E20 VanDerWaalsContact C-N 3.26Å; I18-E20 PolarHBondContact O-N 2.94Å; E20-Q22 PolarHBondContact O-N 3.31Å; E20-Q22 VanDerWaalsContact O-N 3.07Å | ||
| 21 | P | 37.8 | Very low | 46.3 | Very low | 111 Ų | 111 | 130.7 Ų | 130.7 | 72% | 0.721 | 68% | 0.678 | S | S | * | * | trans | -54.8 | 125 | 173.8 | 25.4 | -32.7 | 0 | 0 | 0 | 107.1 | L23 | P21-L23 PolarHBondContact O-N 2.94Š| ||
| 22 | Q | 41.2 | Very low | 48.5 | Very low | 199 Ų | 199 | 127.8 Ų | 127.8 | 93% | 0.93 | 67% | 0.666 | S | S | * | * | trans | -58.7 | 83.7 | 168.9 | -87.3 | -177.6 | -27.7 | 0 | 0 | 107.9 | E20 S24 | E20-Q22 PolarHBondContact O-N 3.31Å; E20-Q22 VanDerWaalsContact O-N 3.07Å; Q22-S24 PolarHBondContact O-N 3.1Å; Q22-S24 VanDerWaalsContact O-N 3.12Å | ||
| 23 | L | 42 | Very low | 50.9 | Low | 151 Ų | 151 | 125.2 Ų | 125.2 | 79% | 0.791 | 65% | 0.648 | S | S | * | * | trans | -62.9 | 112.1 | 156.4 | -137.2 | 91.7 | 0 | 0 | 0 | 103.5 | P21 L25 | P21-L23 PolarHBondContact O-N 2.94Å; L23-L25 PolarHBondContact O-N 3.13Å | ||
| 24 | S | 40 | Very low | 53.4 | Low | 92 Ų | 92 | 126.5 Ų | 126.5 | 64% | 0.643 | 65% | 0.65 | S | S | * | * | trans | -30.1 | 103.4 | 172.7 | 168.7 | 0 | 0 | 0 | 0 | 110.6 | Q22 Q26 | Q22-S24 PolarHBondContact O-N 3.1Å; Q22-S24 VanDerWaalsContact O-N 3.12Å; S24-Q26 PolarHBondContact O-N 3.32Å | ||
| 25 | L | 46 | Very low | 55.9 | Low | 172 Ų | 172 | 123.6 Ų | 123.6 | 90% | 0.901 | 63% | 0.631 | S | S | * | * | trans | -78.3 | 29.5 | 175.1 | -114 | 154 | 0 | 0 | 0 | 110.3 | L23 P27 | L23-L25 PolarHBondContact O-N 3.13Å; L25-P27 WeakPolarHBondContact O-CD 3.27Å | ||
| 26 | Q | 46.1 | Very low | 58.7 | Low | 146 Ų | 146 | 118.2 Ų | 118.2 | 68% | 0.682 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -68.9 | 121.9 | 160.3 | -69.1 | -146.9 | -17.2 | 0 | 0 | 106.4 | S24 E28 | S24-Q26 PolarHBondContact O-N 3.32Å; Q26-E28 PolarHBondContact O-N 3.27Å |
| 27 | P | 49.5 | Very low | 61.3 | Low | 118 Ų | 118 | 116.8 Ų | 116.8 | 77% | 0.766 | 62% | 0.624 | S | S | * | * | trans | -54.9 | 115.7 | 166.7 | 23.5 | -30.4 | 0 | 0 | 0 | 105.8 | L25 P29 | L25-P27 WeakPolarHBondContact O-CD 3.27Å; P27-P29 WeakPolarHBondContact O-CD 3.27Å | ||
| 28 | E | 54.3 | Low | 63.8 | Low | 170 Ų | 170 | 111.7 Ų | 111.7 | 79% | 0.794 | 59% | 0.594 | S | S | * | * | trans | -51.2 | 123.1 | 177.3 | -80.6 | -154.9 | 156.6 | 0 | 0 | 107.6 | Q26 V30 | Q26-E28 PolarHBondContact O-N 3.27Å; E28-V30 PolarHBondContact O-N 3.23Å | ||
| 29 | P | 58 | Low | 66.3 | Low | 81 Ų | 81 | 107 Ų | 107 | 53% | 0.526 | 57% | 0.572 | S | S | . | * | trans | -58.4 | 116 | 175.1 | 18.5 | -25.1 | 0 | 0 | 0 | 106.4 | P27 F31 | P27-P29 WeakPolarHBondContact O-CD 3.27Å; P29-F31 HydrophobicContact CB-CE2 4.06Å; P29-F31 HydrophobicContact CB-CZ 4.22Å; P29-F31 HydrophobicContact CG-CD2 4.47Å; P29-F31 HydrophobicContact CG-CE2 3.62Å; P29-F31 HydrophobicContact CG-CZ 3.84Å; P29-F31 WeakPolarHBondContact O-CD2 3.13Å; P29-F31 WeakPolarHBondContact O-CE2 3.49Å; P29-F31 PolarHBondContact O-N 3.35Å | ||
| 30 | V | 60.6 | Low | 68.9 | Low | 39 Ų | 39 | 103.4 Ų | 103.4 | 24% | 0.236 | 56% | 0.563 | C | S | . | * | trans | -74.7 | 104 | 174.3 | 169.3 | 0 | 0 | 0 | 0 | 106.4 | E28 T32 F60 T64 Q67 | E28-V30 PolarHBondContact O-N 3.23Å; V30-T32 PolarHBondContact O-N 3.25Å; V30-F60 HydrophobicContact CB-CE2 4.15Å; V30-F60 HydrophobicContact CG1-CD2 4.5Å; V30-F60 HydrophobicContact CG1-CE1 4.37Å; V30-F60 HydrophobicContact CG1-CE2 3.43Å; V30-F60 VanDerWaalsContact CG1-CE2 3.43Å; V30-F60 HydrophobicContact CG1-CZ 3.35Å; V30-F60 HydrophobicContact CG2-CD2 4.21Å; V30-F60 HydrophobicContact CG2-CE2 3.74Å; V30-F60 HydrophobicContact CG2-CZ 4.49Å; V30-T64 HydrophobicContact CG1-CG2 4.02Å; V30-Q67 VanDerWaalsContact CG1-OE1 3.25Å; V30-Q67 VanDerWaalsContact CG2-OE1 3.27Å | ||
| 31 | F | 75.9 | Confident | 71.3 | Confident | 154 Ų | 154 | 97 Ų | 97 | 68% | 0.675 | 53% | 0.533 | S | S | * | . | trans | -72 | 114.8 | 176.9 | -70.4 | -85.8 | 0 | 0 | 0 | 109 | P29 P53 | P29-F31 HydrophobicContact CB-CE2 4.06Å; P29-F31 HydrophobicContact CB-CZ 4.22Å; P29-F31 HydrophobicContact CG-CD2 4.47Å; P29-F31 HydrophobicContact CG-CE2 3.62Å; P29-F31 HydrophobicContact CG-CZ 3.84Å; P29-F31 WeakPolarHBondContact O-CD2 3.13Å; P29-F31 WeakPolarHBondContact O-CE2 3.49Å; P29-F31 PolarHBondContact O-N 3.35Å; F31-P53 WeakPolarHBondContact O-CD 3.21Å | ||
| 32 | T | 92.7 | Very high | 74 | Confident | 56 Ų | 56 | 92.1 Ų | 92.1 | 34% | 0.344 | 50% | 0.501 | S | S | . | . | trans | -66 | 147.7 | 155.6 | 55.2 | 0 | 0 | 0 | 0 | 109.1 | V30 Y51 Q68 H69 | V30-T32 PolarHBondContact O-N 3.25Å; T32-Y51 CarbonylContact C-O 3.32Å; T32-Y51 WeakPolarHBondContact CA-O 3.19Å; T32-Y51 VanDerWaalsContact CB-O 3.27Å; T32-Y51 WeakPolarHBondContact CB-O 3.19Å; T32-Q68 WeakPolarHBondContact CG2-O 3.38Å; T32-H69 HydrophobicContact CG2-CB 3.87Å | ||
| 33 | V | 94.7 | Very high | 76.5 | Confident | 22 Ų | 22 | 87.6 Ų | 87.6 | 13% | 0.133 | 48% | 0.475 | C | S | . | . | B | Isolated β-bridge | trans | -106.6 | 160.1 | 179.3 | -63 | 0 | 0 | 0 | 0 | 111 | E37 V38 G50 Y51 P53 | V33-E37 HydrophobicContact CB-CB 4Å; V33-E37 HydrophobicContact CB-CG 4.46Å; V33-E37 WeakPolarHBondContact CB-OE1 3.4Å; V33-E37 HydrophobicContact CG2-CB 4.25Å; V33-V38 HydrophobicContact CG2-CG1 3.69Å; V33-G50 PolarHBondContact O-N 2.91Å; V33-Y51 PolarHBondContact N-O 3.24Å; V33-Y51 PolarHBondContact O-N 3.18Å; V33-P53 HydrophobicContact CG1-CB 4.22Å |
| 34 | D | 94.5 | Very high | 78.8 | Confident | 91 Ų | 91 | 82.2 Ų | 82.2 | 49% | 0.487 | 45% | 0.446 | S | S | . | . | trans | -72.1 | 156.5 | 172.3 | -81.2 | -52.8 | 0 | 0 | 0 | 111 | A36 E37 A49 | D34-A36 PolarHBondContact O-N 2.99Å; D34-A36 VanDerWaalsContact O-N 3.12Å; D34-E37 PolarHBondContact N-OE1 3.49Å; D34-E37 WeakPolarHBondContact O-CB 3.45Å; D34-E37 PolarHBondContact O-N 3.19Å; D34-A49 WeakPolarHBondContact OD1-CB 3.42Å | ||
| 35 | R | 94.9 | Very high | 81.2 | Confident | 53 Ų | 53 | 81.2 Ų | 81.2 | 20% | 0.2 | 44% | 0.437 | C | S | . | . | G | 310 helix | trans | -54.4 | -33.8 | 178.4 | 178.8 | 178.2 | 172.2 | 165.2 | -3.6 | 112.6 | E37 V38 W43 K44 I47 Y48 Y51 | R35-E37 PolarHBondContact O-N 3.32Å; R35-V38 WeakPolarHBondContact O-CG2 3.41Å; R35-V38 PolarHBondContact O-N 2.79Å; R35-W43 VanDerWaalsContact CG-CD1 3.45Å; R35-W43 HydrophobicContact CG-CD2 3.97Å; R35-W43 HydrophobicContact CG-CG 3.77Å; R35-W43 HydrophobicContact CG-CZ2 4.43Å; R35-W43 PolarHBondContact O-NE1 2.97Å; R35-K44 PolarHBondContact NH1-O 3.42Å; R35-I47 WeakPolarHBondContact CD-O 3.36Å; R35-Y48 WeakPolarHBondContact CB-O 3.32Å; R35-Y48 PolarHBondContact N-O 3.32Å; R35-Y51 HydrophobicContact CB-CD2 4.19Å; R35-Y51 HydrophobicContact CB-CE2 3.69Å; R35-Y51 HydrophobicContact CG-CE2 4.16Å |
| 36 | A | 94.8 | Very high | 83.3 | Confident | 93 Ų | 93 | 76.5 Ų | 76.5 | 77% | 0.769 | 41% | 0.408 | S | S | * | . | G | 310 helix | trans | -64.2 | -22.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113 | D34 | D34-A36 PolarHBondContact O-N 2.99Å; D34-A36 VanDerWaalsContact O-N 3.12Å |
| 37 | E | 94.9 | Very high | 85.6 | Confident | 127 Ų | 127 | 69.6 Ų | 69.6 | 59% | 0.593 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -90.3 | -6.6 | -177.9 | -58 | 178.5 | -96.8 | 0 | 0 | 113 | V33 D34 R35 | V33-E37 HydrophobicContact CB-CB 4Å; V33-E37 HydrophobicContact CB-CG 4.46Å; V33-E37 WeakPolarHBondContact CB-OE1 3.4Å; V33-E37 HydrophobicContact CG2-CB 4.25Å; D34-E37 PolarHBondContact N-OE1 3.49Å; D34-E37 WeakPolarHBondContact O-CB 3.45Å; D34-E37 PolarHBondContact O-N 3.19Å; R35-E37 PolarHBondContact O-N 3.32Å |
| 38 | V | 95.9 | Very high | 87.7 | Confident | 8 Ų | 8 | 69 Ų | 69 | 5% | 0.048 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -113.9 | 147.6 | 176.8 | -63 | 0 | 0 | 0 | 0 | 111.6 | V33 R35 F42 W43 Y51 | V33-V38 HydrophobicContact CG2-CG1 3.69Å; R35-V38 WeakPolarHBondContact O-CG2 3.41Å; R35-V38 PolarHBondContact O-N 2.79Å; V38-F42 HydrophobicContact CB-CB 4.36Å; V38-F42 HydrophobicContact CG2-CB 4.2Å; V38-W43 PolarHBondContact O-NE1 3.27Å; V38-Y51 HydrophobicContact CG2-CD1 3.98Å; V38-Y51 HydrophobicContact CG2-CD2 4.4Å; V38-Y51 HydrophobicContact CG2-CE1 4.47Å; V38-Y51 HydrophobicContact CG2-CG 3.94Å |
| 39 | P | 95 | Very high | 89.6 | Confident | 36 Ų | 36 | 62 Ų | 62 | 23% | 0.234 | 33% | 0.33 | C | S | . | . | trans | -57.4 | 150.4 | 177.4 | -23.3 | 32.5 | 0 | 0 | 0 | 112.7 | L41 F42 L54 | P39-L41 PolarHBondContact O-N 2.85Å; P39-F42 HydrophobicContact CB-CD2 4.01Å; P39-F42 HydrophobicContact CB-CE2 4.27Å; P39-F42 HydrophobicContact CG-CD2 4.08Å; P39-F42 HydrophobicContact CG-CE2 4.06Å; P39-F42 PolarHBondContact O-N 2.99Å; P39-L54 VanDerWaalsContact CD-CD1 3.4Å; P39-L54 HydrophobicContact CG-CD1 3.76Å | ||
| 40 | P | 93.6 | Very high | 91.3 | Very high | 89 Ų | 89 | 58.5 Ų | 58.5 | 58% | 0.578 | 31% | 0.308 | S | S | * | . | G | 310 helix | trans | -53.3 | -26.5 | 179 | -29.7 | 36.2 | 0 | 0 | 0 | 115.5 | F42 W43 | P40-F42 PolarHBondContact O-N 2.79Å; P40-W43 HydrophobicContact CB-CD2 4.05Å; P40-W43 HydrophobicContact CB-CE3 4.01Å; P40-W43 HydrophobicContact CB-CZ3 4.33Å; P40-W43 HydrophobicContact CG-CD2 4.46Å; P40-W43 HydrophobicContact CG-CE3 4.45Å; P40-W43 HydrophobicContact CG-CH2 4.22Å; P40-W43 HydrophobicContact CG-CZ2 4.13Å; P40-W43 HydrophobicContact CG-CZ3 4.36Å; P40-W43 WeakPolarHBondContact O-CB 3.43Å; P40-W43 PolarHBondContact O-N 3.12Å; P40-W43 VanDerWaalsContact O-N 3.11Å |
| 41 | L | 93.8 | Very high | 93 | Very high | 28 Ų | 28 | 56.9 Ų | 56.9 | 15% | 0.147 | 30% | 0.298 | C | S | . | . | G | 310 helix | trans | -49.8 | -38.6 | 172.6 | 173.9 | 62.5 | 0 | 0 | 0 | 113.3 | P39 E132 H135 Y136 | P39-L41 PolarHBondContact O-N 2.85Å; L41-E132 HydrophobicContact CD2-CB 3.75Å; L41-E132 HydrophobicContact CD2-CG 3.77Å; L41-H135 HydrophobicContact CD2-CB 4.33Å; L41-Y136 HydrophobicContact CD1-CE1 4.24Å; L41-Y136 HydrophobicContact CD1-CE2 4.11Å; L41-Y136 WeakPolarHBondContact CD1-OH 3.15Å; L41-Y136 HydrophobicContact CD2-CD2 4.49Å; L41-Y136 HydrophobicContact CD2-CE2 3.79Å |
| 42 | F | 95.2 | Very high | 94 | Very high | 9 Ų | 9 | 49.9 Ų | 49.9 | 4% | 0.039 | 27% | 0.267 | C | S | . | . | G | 310 helix | trans | -87.7 | -11.5 | -174.2 | -64.2 | -89 | 0 | 0 | 0 | 112.6 | V38 P39 P40 K44 Y51 L54 Q128 E132 H135 | V38-F42 HydrophobicContact CB-CB 4.36Å; V38-F42 HydrophobicContact CG2-CB 4.2Å; P39-F42 HydrophobicContact CB-CD2 4.01Å; P39-F42 HydrophobicContact CB-CE2 4.27Å; P39-F42 HydrophobicContact CG-CD2 4.08Å; P39-F42 HydrophobicContact CG-CE2 4.06Å; P39-F42 PolarHBondContact O-N 2.99Å; P40-F42 PolarHBondContact O-N 2.79Å; F42-K44 PolarHBondContact O-N 2.92Å; F42-Y51 VanDerWaalsContact O-CE1 3.27Å; F42-Y51 WeakPolarHBondContact O-CE1 3.48Å; F42-L54 HydrophobicContact CD1-CD2 4.2Å; F42-L54 HydrophobicContact CD2-CD1 4.24Å; F42-L54 HydrophobicContact CD2-CD2 4.36Å; F42-L54 HydrophobicContact CE1-CD2 3.74Å; F42-L54 HydrophobicContact CE2-CD1 3.66Å; F42-L54 HydrophobicContact CE2-CD2 3.93Å; F42-L54 HydrophobicContact CE2-CG 4.47Å; F42-L54 HydrophobicContact CG-CD2 4.5Å; F42-L54 HydrophobicContact CZ-CD1 4.04Å; F42-L54 HydrophobicContact CZ-CD2 3.6Å; F42-Q128 VanDerWaalsContact CE1-OE1 3.25Å; F42-E132 HydrophobicContact CE2-CG 4.15Å; F42-H135 AromaticContact CD1-ND1 3.57Å; F42-H135 HydrophobicContact CE1-CB 3.77Å; F42-H135 AromaticContact CE1-CG 3.86Å; F42-H135 AromaticContact CE1-ND1 3.45Å; F42-H135 WeakPolarHBondContact CE1-ND1 3.22Å; F42-H135 HydrophobicContact CZ-CB 3.99Å |
| 43 | W | 93.9 | Very high | 94.1 | Very high | 104 Ų | 104 | 48.4 Ų | 48.4 | 39% | 0.394 | 26% | 0.259 | S | S | . | . | P | Polyproline II helix | trans | -66.3 | 125 | -171.9 | -68.3 | 1.9 | 0 | 0 | 0 | 111.5 | R35 V38 P40 | R35-W43 VanDerWaalsContact CG-CD1 3.45Å; R35-W43 HydrophobicContact CG-CD2 3.97Å; R35-W43 HydrophobicContact CG-CG 3.77Å; R35-W43 HydrophobicContact CG-CZ2 4.43Å; R35-W43 PolarHBondContact O-NE1 2.97Å; V38-W43 PolarHBondContact O-NE1 3.27Å; P40-W43 HydrophobicContact CB-CD2 4.05Å; P40-W43 HydrophobicContact CB-CE3 4.01Å; P40-W43 HydrophobicContact CB-CZ3 4.33Å; P40-W43 HydrophobicContact CG-CD2 4.46Å; P40-W43 HydrophobicContact CG-CE3 4.45Å; P40-W43 HydrophobicContact CG-CH2 4.22Å; P40-W43 HydrophobicContact CG-CZ2 4.13Å; P40-W43 HydrophobicContact CG-CZ3 4.36Å; P40-W43 WeakPolarHBondContact O-CB 3.43Å; P40-W43 PolarHBondContact O-N 3.12Å; P40-W43 VanDerWaalsContact O-N 3.11Å |
| 44 | K | 91.1 | Very high | 94.2 | Very high | 39 Ų | 39 | 48.7 Ų | 48.7 | 17% | 0.17 | 26% | 0.259 | C | S | . | . | P | Polyproline II helix | trans | -94.4 | 139.3 | 166.6 | -68 | -169.7 | 178.3 | -175.7 | 0 | 110.4 | R35 F42 Y46 I47 Y51 E71 N74 | R35-K44 PolarHBondContact NH1-O 3.42Å; F42-K44 PolarHBondContact O-N 2.92Å; K44-Y46 PolarHBondContact O-N 2.9Å; K44-I47 HydrophobicContact CB-CB 3.95Å; K44-I47 HydrophobicContact CB-CG1 3.75Å; K44-I47 PolarHBondContact O-N 2.92Å; K44-Y51 PolarHBondContact N-OH 2.74Å; K44-E71 WeakPolarHBondContact CE-OE1 3.08Å; K44-E71 IonicContact NZ-OE1 3.52Å; K44-E71 PolarHBondContact NZ-OE1 3.24Å; K44-E71 IonicContact NZ-OE2 3.43Å; K44-E71 PolarHBondContact NZ-OE2 3.32Å; K44-N74 PolarHBondContact NZ-ND2 3.29Å |
| 45 | P | 89.1 | Confident | 94.3 | Very high | 71 Ų | 71 | 50.5 Ų | 50.5 | 46% | 0.461 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | 136.9 | 173.5 | -25.4 | 34.8 | 0 | 0 | 0 | 111.3 | I47 M259 | P45-I47 PolarHBondContact O-N 3.28Å; P45-M259 HydrophobicContact CB-CE 3.89Å; P45-M259 HydrophobicContact CG-CE 4.12Å |
| 46 | Y | 91.1 | Very high | 94.3 | Very high | 72 Ų | 72 | 51.8 Ų | 51.8 | 28% | 0.282 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.6 | 3.9 | 177.3 | -45.6 | -73.1 | 0 | 0 | 0 | 117.2 | K44 Y48 M259 E261 R262 P265 G266 | K44-Y46 PolarHBondContact O-N 2.9Å; Y46-Y48 WeakPolarHBondContact O-CE2 3.33Å; Y46-M259 HydrophobicContact CD2-CE 4.4Å; Y46-M259 HydrophobicContact CE2-CE 4.43Å; Y46-E261 WeakPolarHBondContact CB-O 3.23Å; Y46-E261 HydrophobicContact CD2-CG 4Å; Y46-E261 HydrophobicContact CG-CG 4.45Å; Y46-R262 HydrophobicContact CD2-CB 4.13Å; Y46-R262 HydrophobicContact CE1-CG 4.32Å; Y46-R262 HydrophobicContact CE2-CB 3.74Å; Y46-R262 HydrophobicContact CE2-CG 3.99Å; Y46-P265 HydrophobicContact CD1-CB 4.24Å; Y46-P265 HydrophobicContact CD1-CG 4.2Å; Y46-G266 PolarHBondContact O-N 3.39Å |
| 47 | I | 93.5 | Very high | 94.3 | Very high | 1 Ų | 1 | 51.8 Ų | 51.8 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | trans | -105 | 114.3 | 175.6 | -52 | -51.9 | 0 | 0 | 0 | 109.4 | R35 K44 P45 Y51 N70 E261 C268 Q273 | R35-I47 WeakPolarHBondContact CD-O 3.36Å; K44-I47 HydrophobicContact CB-CB 3.95Å; K44-I47 HydrophobicContact CB-CG1 3.75Å; K44-I47 PolarHBondContact O-N 2.92Å; P45-I47 PolarHBondContact O-N 3.28Å; I47-Y51 HydrophobicContact CG2-CE2 4.04Å; I47-Y51 PolarHBondContact O-OH 2.86Å; I47-N70 HydrophobicContact CG2-CB 4.11Å; I47-E261 HydrophobicContact CD1-CB 4.4Å; I47-C268 HydrophobicContact CD1-CB 4.39Å; I47-C268 WeakPolarHBondContact CD1-O 3.14Å; I47-Q273 HydrophobicContact CD1-CG 4.01Å | ||
| 48 | Y | 94 | Very high | 94.4 | Very high | 106 Ų | 106 | 50.3 Ų | 50.3 | 42% | 0.416 | 25% | 0.252 | S | S | . | . | trans | -108.3 | -19.7 | -173.2 | -55.4 | -77.8 | 0 | 0 | 0 | 114.5 | R35 Y46 P265 H269 | R35-Y48 WeakPolarHBondContact CB-O 3.32Å; R35-Y48 PolarHBondContact N-O 3.32Å; Y46-Y48 WeakPolarHBondContact O-CE2 3.33Å; Y48-P265 HydrophobicContact CE2-CB 4.28Å; Y48-H269 PolarHBondContact N-CD2 3.47Å; Y48-H269 PolarHBondContact N-NE2 2.97Å | ||
| 49 | A | 93.8 | Very high | 94.4 | Very high | 24 Ų | 24 | 58 Ų | 58 | 20% | 0.198 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -137.8 | 174.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | D34 H269 | D34-A49 WeakPolarHBondContact OD1-CB 3.42Å; A49-H269 PolarHBondContact N-CD2 3.47Å; A49-H269 PolarHBondContact N-NE2 3.35Å |
| 50 | G | 94.3 | Very high | 94.3 | Very high | 6 Ų | 6 | 57.7 Ų | 57.7 | 6% | 0.062 | 28% | 0.276 | C | S | . | . | trans | 90.4 | 11.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | V33 H69 N70 | V33-G50 PolarHBondContact O-N 2.91Å; G50-H69 WeakPolarHBondContact O-CB 3.05Å; G50-N70 WeakPolarHBondContact O-CB 3.49Å; G50-N70 PolarHBondContact O-N 3.4Å; G50-N70 PolarHBondContact O-OD1 3.03Å; G50-N70 VanDerWaalsContact O-OD1 3.1Å | ||
| 51 | Y | 96.8 | Very high | 94.5 | Very high | 6 Ų | 6 | 53.5 Ų | 53.5 | 2% | 0.024 | 25% | 0.248 | C | C | . | . | B | Isolated β-bridge | trans | -76 | 151.9 | 177.6 | -66.8 | -90.4 | 0 | 0 | 0 | 110.5 | T32 V33 R35 V38 F42 K44 I47 N70 | T32-Y51 CarbonylContact C-O 3.32Å; T32-Y51 WeakPolarHBondContact CA-O 3.19Å; T32-Y51 VanDerWaalsContact CB-O 3.27Å; T32-Y51 WeakPolarHBondContact CB-O 3.19Å; V33-Y51 PolarHBondContact N-O 3.24Å; V33-Y51 PolarHBondContact O-N 3.18Å; R35-Y51 HydrophobicContact CB-CD2 4.19Å; R35-Y51 HydrophobicContact CB-CE2 3.69Å; R35-Y51 HydrophobicContact CG-CE2 4.16Å; V38-Y51 HydrophobicContact CG2-CD1 3.98Å; V38-Y51 HydrophobicContact CG2-CD2 4.4Å; V38-Y51 HydrophobicContact CG2-CE1 4.47Å; V38-Y51 HydrophobicContact CG2-CG 3.94Å; F42-Y51 VanDerWaalsContact O-CE1 3.27Å; F42-Y51 WeakPolarHBondContact O-CE1 3.48Å; K44-Y51 PolarHBondContact N-OH 2.74Å; I47-Y51 HydrophobicContact CG2-CE2 4.04Å; I47-Y51 PolarHBondContact O-OH 2.86Å; Y51-N70 WeakPolarHBondContact CD1-ND2 3.38Å; Y51-N70 WeakPolarHBondContact CE1-ND2 3.46Å |
| 52 | R | 96.1 | Very high | 94.5 | Very high | 6 Ų | 6 | 57.1 Ų | 57.1 | 2% | 0.023 | 26% | 0.263 | C | S | . | . | P | Polyproline II helix | trans | -91.4 | 139.8 | 174.7 | -72.5 | 169.7 | -65.7 | 171.6 | 6.2 | 110 | T64 H69 H125 L126 A129 | R52-T64 WeakPolarHBondContact CD-OG1 3.48Å; R52-T64 HydrophobicContact CG-CG2 4.47Å; R52-T64 PolarHBondContact NH1-OG1 3.19Å; R52-H69 HydrophobicContact CG-CB 4.04Å; R52-H125 PolarHBondContact NH2-O 3.32Å; R52-L126 PolarHBondContact NH1-O 3.31Å; R52-L126 PolarHBondContact NH2-O 3.1Å; R52-A129 HydrophobicContact CB-CB 4.03Å |
| 53 | P | 95.5 | Very high | 94.5 | Very high | 26 Ų | 26 | 63.5 Ų | 63.5 | 17% | 0.169 | 29% | 0.287 | C | S | . | . | P | Polyproline II helix | trans | -61.7 | 141.4 | 177.1 | 25.7 | -34.5 | 0 | 0 | 0 | 110.7 | F31 V33 Q56 F60 Y61 | F31-P53 WeakPolarHBondContact O-CD 3.21Å; V33-P53 HydrophobicContact CG1-CB 4.22Å; P53-Q56 HydrophobicContact CB-CG 4.36Å; P53-Q56 HydrophobicContact CG-CG 4.05Å; P53-F60 HydrophobicContact CG-CE1 4.07Å; P53-F60 HydrophobicContact CG-CE2 4.4Å; P53-F60 HydrophobicContact CG-CZ 3.56Å; P53-Y61 PolarHBondContact O-OH 2.76Å; P53-Y61 VanDerWaalsContact O-OH 3.1Å |
| 54 | L | 96.3 | Very high | 94.5 | Very high | 27 Ų | 27 | 58.6 Ų | 58.6 | 14% | 0.141 | 27% | 0.268 | C | S | . | . | S | Bend | trans | -77.7 | 169.3 | -179.6 | -56.7 | -175.7 | 0 | 0 | 0 | 112 | P39 F42 Q56 A129 | P39-L54 VanDerWaalsContact CD-CD1 3.4Å; P39-L54 HydrophobicContact CG-CD1 3.76Å; F42-L54 HydrophobicContact CD1-CD2 4.2Å; F42-L54 HydrophobicContact CD2-CD1 4.24Å; F42-L54 HydrophobicContact CD2-CD2 4.36Å; F42-L54 HydrophobicContact CE1-CD2 3.74Å; F42-L54 HydrophobicContact CE2-CD1 3.66Å; F42-L54 HydrophobicContact CE2-CD2 3.93Å; F42-L54 HydrophobicContact CE2-CG 4.47Å; F42-L54 HydrophobicContact CG-CD2 4.5Å; F42-L54 HydrophobicContact CZ-CD1 4.04Å; F42-L54 HydrophobicContact CZ-CD2 3.6Å; L54-Q56 PolarHBondContact O-N 2.86Å; L54-Q56 PolarHBondContact O-NE2 3.24Å; L54-A129 WeakPolarHBondContact CA-O 3.47Å; L54-A129 HydrophobicContact CD2-CB 4.43Å; L54-A129 WeakPolarHBondContact CD2-O 3.19Å |
| 55 | H | 96 | Very high | 94.7 | Very high | 130 Ų | 130 | 58 Ų | 58 | 60% | 0.602 | 27% | 0.267 | S | S | * | . | S | Bend | trans | 62.5 | 6.2 | 170.9 | -57.3 | -73.9 | 0 | 0 | 0 | 116.7 | Y61 K130 | H55-Y61 PolarHBondContact N-OH 3.32Å; H55-K130 WeakPolarHBondContact CA-O 3.1Å; H55-K130 PolarHBondContact N-O 3.15Å |
| 56 | Q | 95.5 | Very high | 94.9 | Very high | 79 Ų | 79 | 62.4 Ų | 62.4 | 37% | 0.369 | 28% | 0.279 | S | S | . | . | trans | -62.9 | 170.4 | 172.6 | -55 | -54.7 | -40.1 | 0 | 0 | 113.4 | P53 L54 F60 Y61 K130 | P53-Q56 HydrophobicContact CB-CG 4.36Å; P53-Q56 HydrophobicContact CG-CG 4.05Å; L54-Q56 PolarHBondContact O-N 2.86Å; L54-Q56 PolarHBondContact O-NE2 3.24Å; Q56-F60 HydrophobicContact CB-CB 3.8Å; Q56-F60 HydrophobicContact CB-CD1 3.44Å; Q56-F60 VanDerWaalsContact CB-CD1 3.44Å; Q56-F60 HydrophobicContact CB-CD2 4.27Å; Q56-F60 HydrophobicContact CB-CE1 4.02Å; Q56-F60 HydrophobicContact CB-CG 3.59Å; Q56-F60 HydrophobicContact CG-CD1 3.73Å; Q56-F60 HydrophobicContact CG-CD2 4.26Å; Q56-F60 HydrophobicContact CG-CE1 3.78Å; Q56-F60 HydrophobicContact CG-CE2 4.29Å; Q56-F60 HydrophobicContact CG-CG 3.99Å; Q56-F60 HydrophobicContact CG-CZ 4.06Å; Q56-Y61 HydrophobicContact CB-CE2 3.87Å; Q56-Y61 PolarHBondContact N-OH 3.11Å; Q56-Y61 VanDerWaalsContact N-OH 3.17Å; Q56-Y61 WeakPolarHBondContact O-CE2 3.16Å; Q56-K130 WeakPolarHBondContact O-CD 3.27Å; Q56-K130 WeakPolarHBondContact O-CE 3.07Å; Q56-K130 PolarHBondContact O-NZ 3.29Å | ||
| 57 | T | 95.9 | Very high | 94.9 | Very high | 93 Ų | 93 | 62 Ų | 62 | 57% | 0.571 | 28% | 0.28 | S | S | * | . | trans | -67 | 157.3 | 175.1 | 65.1 | 0 | 0 | 0 | 0 | 111.6 | R59 F60 Y61 | T57-R59 VanDerWaalsContact C-N 3.25Å; T57-R59 PolarHBondContact O-N 2.97Å; T57-F60 VanDerWaalsContact O-CB 3.27Å; T57-F60 WeakPolarHBondContact O-CB 3.38Å; T57-F60 PolarHBondContact O-N 3.32Å; T57-F60 VanDerWaalsContact O-N 3.13Å; T57-F60 PolarHBondContact OG1-N 2.81Å; T57-Y61 WeakPolarHBondContact O-CD2 3.25Å; T57-Y61 WeakPolarHBondContact O-CE2 3.21Å | ||
| 58 | W | 96.1 | Very high | 94.9 | Very high | 96 Ų | 96 | 68.9 Ų | 68.9 | 36% | 0.364 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.8 | -38.9 | 174.4 | -68.4 | 109.6 | 0 | 0 | 0 | 112.7 | F60 Y61 F62 L127 K130 W134 F138 | W58-F60 PolarHBondContact O-N 3.23Å; W58-Y61 PolarHBondContact O-N 3.31Å; W58-Y61 VanDerWaalsContact O-N 3.12Å; W58-F62 HydrophobicContact CB-CE2 4.47Å; W58-F62 VanDerWaalsContact O-CD2 3.22Å; W58-F62 WeakPolarHBondContact O-CD2 3.35Å; W58-F62 PolarHBondContact O-N 2.97Å; W58-L127 HydrophobicContact CE3-CD2 4.26Å; W58-L127 HydrophobicContact CZ3-CB 4.28Å; W58-L127 HydrophobicContact CZ3-CD1 4.25Å; W58-L127 HydrophobicContact CZ3-CD2 4.31Å; W58-K130 HydrophobicContact CD2-CD 4.37Å; W58-K130 HydrophobicContact CE3-CD 4.42Å; W58-K130 HydrophobicContact CH2-CB 4.34Å; W58-K130 HydrophobicContact CH2-CD 4.49Å; W58-K130 HydrophobicContact CH2-CG 3.9Å; W58-K130 HydrophobicContact CZ2-CD 4.42Å; W58-K130 HydrophobicContact CZ2-CG 4.08Å; W58-K130 HydrophobicContact CZ3-CB 4.29Å; W58-K130 HydrophobicContact CZ3-CD 4.47Å; W58-K130 HydrophobicContact CZ3-CG 4.15Å; W58-W134 AromaticContact CH2-CD2 3.6Å; W58-W134 HydrophobicContact CH2-CD2 3.6Å; W58-W134 AromaticContact CH2-CE2 3.64Å; W58-W134 AromaticContact CH2-CE3 3.92Å; W58-W134 HydrophobicContact CH2-CE3 3.92Å; W58-W134 AromaticContact CH2-CG 4Å; W58-W134 HydrophobicContact CH2-CG 4Å; W58-W134 HydrophobicContact CH2-CH2 4.29Å; W58-W134 HydrophobicContact CH2-CZ2 4.02Å; W58-W134 HydrophobicContact CH2-CZ3 4.25Å; W58-W134 HydrophobicContact CZ2-CD2 4.03Å; W58-W134 AromaticContact CZ2-CE2 3.54Å; W58-W134 HydrophobicContact CZ2-CG 4.5Å; W58-W134 HydrophobicContact CZ2-CH2 4.25Å; W58-W134 AromaticContact CZ2-CZ2 3.68Å; W58-W134 HydrophobicContact CZ2-CZ2 3.68Å; W58-W134 AromaticContact CZ2-NE1 3.75Å; W58-F138 AromaticContact CH2-CE2 3.98Å; W58-F138 HydrophobicContact CH2-CE2 3.98Å; W58-F138 HydrophobicContact CH2-CZ 4.27Å; W58-F138 AromaticContact CZ3-CE2 3.97Å; W58-F138 HydrophobicContact CZ3-CE2 3.97Å; W58-F138 HydrophobicContact CZ3-CZ 4.17Å |
| 59 | R | 95.3 | Very high | 95 | Very high | 169 Ų | 169 | 64 Ų | 64 | 64% | 0.638 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -57.5 | -35.4 | 176.8 | -170.5 | 179.2 | -172.8 | -179.4 | 3.7 | 112.2 | T57 R63 | T57-R59 VanDerWaalsContact C-N 3.25Å; T57-R59 PolarHBondContact O-N 2.97Å; R59-R63 VanDerWaalsContact CZ-NH2 3.33Å; R59-R63 VanDerWaalsContact NH2-NH2 3.18Å; R59-R63 WeakPolarHBondContact O-CB 3.44Å; R59-R63 VanDerWaalsContact O-CG 3.32Å; R59-R63 WeakPolarHBondContact O-CG 3.27Å; R59-R63 PolarHBondContact O-N 2.86Å |
| 60 | F | 94.6 | Very high | 95.1 | Very high | 31 Ų | 31 | 62.9 Ų | 62.9 | 14% | 0.136 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -58.9 | -53.1 | 174.6 | 172.4 | -88.8 | 0 | 0 | 0 | 111 | V30 P53 Q56 T57 W58 F62 R63 T64 | V30-F60 HydrophobicContact CB-CE2 4.15Å; V30-F60 HydrophobicContact CG1-CD2 4.5Å; V30-F60 HydrophobicContact CG1-CE1 4.37Å; V30-F60 HydrophobicContact CG1-CE2 3.43Å; V30-F60 VanDerWaalsContact CG1-CE2 3.43Å; V30-F60 HydrophobicContact CG1-CZ 3.35Å; V30-F60 HydrophobicContact CG2-CD2 4.21Å; V30-F60 HydrophobicContact CG2-CE2 3.74Å; V30-F60 HydrophobicContact CG2-CZ 4.49Å; P53-F60 HydrophobicContact CG-CE1 4.07Å; P53-F60 HydrophobicContact CG-CE2 4.4Å; P53-F60 HydrophobicContact CG-CZ 3.56Å; Q56-F60 HydrophobicContact CB-CB 3.8Å; Q56-F60 HydrophobicContact CB-CD1 3.44Å; Q56-F60 VanDerWaalsContact CB-CD1 3.44Å; Q56-F60 HydrophobicContact CB-CD2 4.27Å; Q56-F60 HydrophobicContact CB-CE1 4.02Å; Q56-F60 HydrophobicContact CB-CG 3.59Å; Q56-F60 HydrophobicContact CG-CD1 3.73Å; Q56-F60 HydrophobicContact CG-CD2 4.26Å; Q56-F60 HydrophobicContact CG-CE1 3.78Å; Q56-F60 HydrophobicContact CG-CE2 4.29Å; Q56-F60 HydrophobicContact CG-CG 3.99Å; Q56-F60 HydrophobicContact CG-CZ 4.06Å; T57-F60 VanDerWaalsContact O-CB 3.27Å; T57-F60 WeakPolarHBondContact O-CB 3.38Å; T57-F60 PolarHBondContact O-N 3.32Å; T57-F60 VanDerWaalsContact O-N 3.13Å; T57-F60 PolarHBondContact OG1-N 2.81Å; W58-F60 PolarHBondContact O-N 3.23Å; F60-F62 PolarHBondContact O-N 2.92Å; F60-R63 WeakPolarHBondContact O-CB 3.08Å; F60-R63 PolarHBondContact O-N 2.97Å; F60-R63 VanDerWaalsContact O-N 3.09Å; F60-T64 HydrophobicContact CD1-CG2 4.16Å; F60-T64 HydrophobicContact CE1-CG2 3.89Å; F60-T64 HydrophobicContact CZ-CG2 4.21Å; F60-T64 VanDerWaalsContact O-CG2 3.27Å; F60-T64 WeakPolarHBondContact O-CG2 3.13Å; F60-T64 PolarHBondContact O-N 3.03Å |
| 61 | Y | 96 | Very high | 95.2 | Very high | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.7 | -39.8 | -177.7 | -59.5 | -76.4 | 0 | 0 | 0 | 112.8 | P53 H55 Q56 T57 W58 R63 T64 L126 A129 K130 | P53-Y61 PolarHBondContact O-OH 2.76Å; P53-Y61 VanDerWaalsContact O-OH 3.1Å; H55-Y61 PolarHBondContact N-OH 3.32Å; Q56-Y61 HydrophobicContact CB-CE2 3.87Å; Q56-Y61 PolarHBondContact N-OH 3.11Å; Q56-Y61 VanDerWaalsContact N-OH 3.17Å; Q56-Y61 WeakPolarHBondContact O-CE2 3.16Å; T57-Y61 WeakPolarHBondContact O-CD2 3.25Å; T57-Y61 WeakPolarHBondContact O-CE2 3.21Å; W58-Y61 PolarHBondContact O-N 3.31Å; W58-Y61 VanDerWaalsContact O-N 3.12Å; Y61-R63 VanDerWaalsContact C-N 3.31Å; Y61-R63 PolarHBondContact O-N 2.92Å; Y61-T64 WeakPolarHBondContact O-CB 3.48Å; Y61-T64 PolarHBondContact O-N 3.29Å; Y61-T64 VanDerWaalsContact O-N 3.1Å; Y61-T64 PolarHBondContact O-OG1 2.76Å; Y61-L126 WeakPolarHBondContact O-CD1 3.33Å; Y61-A129 HydrophobicContact CD1-CB 4.24Å; Y61-A129 HydrophobicContact CE1-CB 3.71Å; Y61-A129 PolarHBondContact OH-O 2.94Å; Y61-A129 VanDerWaalsContact OH-O 3.05Å; Y61-K130 HydrophobicContact CD2-CD 4.02Å; Y61-K130 HydrophobicContact CE2-CB 4.06Å; Y61-K130 HydrophobicContact CE2-CD 3.35Å; Y61-K130 HydrophobicContact CE2-CG 4.32Å; Y61-K130 WeakPolarHBondContact OH-CA 3.27Å |
| 62 | F | 95.3 | Very high | 95.2 | Very high | 105 Ų | 105 | 62.9 Ų | 62.9 | 46% | 0.461 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -63.7 | -36 | 174 | -73.1 | -67.5 | 0 | 0 | 0 | 112.8 | W58 F60 T64 L65 L126 L127 | W58-F62 HydrophobicContact CB-CE2 4.47Å; W58-F62 VanDerWaalsContact O-CD2 3.22Å; W58-F62 WeakPolarHBondContact O-CD2 3.35Å; W58-F62 PolarHBondContact O-N 2.97Å; F60-F62 PolarHBondContact O-N 2.92Å; F62-T64 VanDerWaalsContact C-N 3.27Å; F62-T64 PolarHBondContact O-N 3.25Å; F62-L65 WeakPolarHBondContact O-CB 3.32Å; F62-L65 PolarHBondContact O-N 2.85Å; F62-L126 HydrophobicContact CD1-CD2 3.96Å; F62-L126 HydrophobicContact CE1-CD2 4.22Å; F62-L127 HydrophobicContact CE1-CD2 4.29Å; F62-L127 HydrophobicContact CE2-CD2 4.38Å; F62-L127 HydrophobicContact CZ-CD1 4.18Å; F62-L127 HydrophobicContact CZ-CD2 4.15Å |
| 63 | R | 93.8 | Very high | 95.3 | Very high | 142 Ų | 142 | 63.8 Ų | 63.8 | 54% | 0.536 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -65.8 | -30.6 | 173.2 | -76.7 | 175.5 | 167 | -178.7 | -5.9 | 112.5 | R59 F60 Y61 L65 F66 | R59-R63 VanDerWaalsContact CZ-NH2 3.33Å; R59-R63 VanDerWaalsContact NH2-NH2 3.18Å; R59-R63 WeakPolarHBondContact O-CB 3.44Å; R59-R63 VanDerWaalsContact O-CG 3.32Å; R59-R63 WeakPolarHBondContact O-CG 3.27Å; R59-R63 PolarHBondContact O-N 2.86Å; F60-R63 WeakPolarHBondContact O-CB 3.08Å; F60-R63 PolarHBondContact O-N 2.97Å; F60-R63 VanDerWaalsContact O-N 3.09Å; Y61-R63 VanDerWaalsContact C-N 3.31Å; Y61-R63 PolarHBondContact O-N 2.92Å; R63-L65 PolarHBondContact O-N 3.2Å; R63-L65 VanDerWaalsContact O-N 3.14Å; R63-F66 PolarHBondContact O-N 3.38Å |
| 64 | T | 94.6 | Very high | 95.4 | Very high | 1 Ų | 1 | 62.5 Ų | 62.5 | 1% | 0.006 | 28% | 0.282 | C | S | . | . | G | 310 helix | trans | -65.6 | -13.1 | 177.2 | 72.6 | 0 | 0 | 0 | 0 | 114 | V30 R52 F60 Y61 F62 F66 Q67 H69 | V30-T64 HydrophobicContact CG1-CG2 4.02Å; R52-T64 WeakPolarHBondContact CD-OG1 3.48Å; R52-T64 HydrophobicContact CG-CG2 4.47Å; R52-T64 PolarHBondContact NH1-OG1 3.19Å; F60-T64 HydrophobicContact CD1-CG2 4.16Å; F60-T64 HydrophobicContact CE1-CG2 3.89Å; F60-T64 HydrophobicContact CZ-CG2 4.21Å; F60-T64 VanDerWaalsContact O-CG2 3.27Å; F60-T64 WeakPolarHBondContact O-CG2 3.13Å; F60-T64 PolarHBondContact O-N 3.03Å; Y61-T64 WeakPolarHBondContact O-CB 3.48Å; Y61-T64 PolarHBondContact O-N 3.29Å; Y61-T64 VanDerWaalsContact O-N 3.1Å; Y61-T64 PolarHBondContact O-OG1 2.76Å; F62-T64 VanDerWaalsContact C-N 3.27Å; F62-T64 PolarHBondContact O-N 3.25Å; T64-F66 PolarHBondContact O-N 3.46Å; T64-F66 VanDerWaalsContact O-N 3.14Å; T64-Q67 PolarHBondContact O-N 3.32Å; T64-H69 PolarHBondContact O-CD2 2.92Å; T64-H69 PolarHBondContact O-NE2 3.41Å |
| 65 | L | 94.9 | Very high | 95.5 | Very high | 28 Ų | 28 | 61.3 Ų | 61.3 | 15% | 0.147 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -52.4 | -35.9 | 174 | -178.7 | 62.6 | 0 | 0 | 0 | 112.5 | F62 R63 V75 W76 L79 L126 | F62-L65 WeakPolarHBondContact O-CB 3.32Å; F62-L65 PolarHBondContact O-N 2.85Å; R63-L65 PolarHBondContact O-N 3.2Å; R63-L65 VanDerWaalsContact O-N 3.14Å; L65-V75 HydrophobicContact CD1-CG1 3.55Å; L65-W76 HydrophobicContact CD1-CZ2 4.27Å; L65-W76 HydrophobicContact CG-CZ2 4.07Å; L65-W76 PolarHBondContact O-NE1 3.03Å; L65-L79 HydrophobicContact CD1-CD2 3.77Å; L65-L79 HydrophobicContact CD2-CD2 4.1Å; L65-L79 HydrophobicContact CG-CD2 4.5Å; L65-L126 HydrophobicContact CB-CD1 4.18Å; L65-L126 HydrophobicContact CD1-CD1 4.39Å |
| 66 | F | 93.2 | Very high | 95.6 | Very high | 162 Ų | 162 | 59.9 Ų | 59.9 | 71% | 0.711 | 27% | 0.265 | S | S | * | . | G | 310 helix | trans | -100.7 | 22.8 | -179 | -57.1 | -75.8 | 0 | 0 | 0 | 113.1 | R63 T64 W76 | R63-F66 PolarHBondContact O-N 3.38Å; T64-F66 PolarHBondContact O-N 3.46Å; T64-F66 VanDerWaalsContact O-N 3.14Å; F66-W76 HydrophobicContact CD1-CH2 4.3Å; F66-W76 AromaticContact CD1-CZ2 3.76Å; F66-W76 HydrophobicContact CD1-CZ2 3.76Å; F66-W76 AromaticContact CE1-CH2 3.83Å; F66-W76 HydrophobicContact CE1-CH2 3.83Å; F66-W76 AromaticContact CE1-CZ2 3.7Å; F66-W76 HydrophobicContact CE1-CZ2 3.7Å |
| 67 | Q | 92.1 | Very high | 95.7 | Very high | 63 Ų | 63 | 57.4 Ų | 57.4 | 29% | 0.294 | 26% | 0.255 | S | S | . | . | S | Bend | trans | -125.9 | 158.5 | -174.9 | -63.2 | 176.6 | -21.9 | 0 | 0 | 111.3 | V30 T64 H69 | V30-Q67 VanDerWaalsContact CG1-OE1 3.25Å; V30-Q67 VanDerWaalsContact CG2-OE1 3.27Å; T64-Q67 PolarHBondContact O-N 3.32Å; Q67-H69 PolarHBondContact O-CD2 3.35Å |
| 68 | Q | 93.5 | Very high | 95.8 | Very high | 146 Ų | 146 | 53 Ų | 53 | 68% | 0.682 | 23% | 0.228 | S | C | * | . | trans | -82.5 | 121 | 176.8 | -68.3 | -176.7 | -39.4 | 0 | 0 | 110.2 | T32 | T32-Q68 WeakPolarHBondContact CG2-O 3.38Š| ||
| 69 | H | 95.3 | Very high | 95.9 | Very high | 3 Ų | 3 | 50.7 Ų | 50.7 | 1% | 0.014 | 22% | 0.223 | C | C | . | . | trans | -154.9 | 168.1 | 172.8 | 60 | 88.6 | 0 | 0 | 0 | 109.2 | T32 G50 R52 T64 Q67 E71 A72 | T32-H69 HydrophobicContact CG2-CB 3.87Å; G50-H69 WeakPolarHBondContact O-CB 3.05Å; R52-H69 HydrophobicContact CG-CB 4.04Å; T64-H69 PolarHBondContact O-CD2 2.92Å; T64-H69 PolarHBondContact O-NE2 3.41Å; Q67-H69 PolarHBondContact O-CD2 3.35Å; H69-E71 PolarHBondContact ND1-N 3.33Å; H69-E71 PolarHBondContact O-N 3.27Å; H69-A72 PolarHBondContact CE1-N 3.02Å; H69-A72 PolarHBondContact ND1-N 3.29Å; H69-A72 WeakPolarHBondContact O-CB 3.31Å; H69-A72 PolarHBondContact O-N 2.96Å | ||
| 70 | N | 95.4 | Very high | 96.1 | Very high | 1 Ų | 1 | 47.5 Ų | 47.5 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -8 | -172.9 | 70.2 | -22.3 | 0 | 0 | 0 | 115.9 | I47 G50 Y51 H269 Q273 | I47-N70 HydrophobicContact CG2-CB 4.11Å; G50-N70 WeakPolarHBondContact O-CB 3.49Å; G50-N70 PolarHBondContact O-N 3.4Å; G50-N70 PolarHBondContact O-OD1 3.03Å; G50-N70 VanDerWaalsContact O-OD1 3.1Å; Y51-N70 WeakPolarHBondContact CD1-ND2 3.38Å; Y51-N70 WeakPolarHBondContact CE1-ND2 3.46Å; N70-H269 WeakPolarHBondContact CA-O 3.23Å; N70-H269 WeakPolarHBondContact CB-O 3.23Å; N70-Q273 PolarHBondContact O-NE2 2.99Å; N70-Q273 PolarHBondContact O-OE1 3.12Å |
| 71 | E | 97.3 | Very high | 96.2 | Very high | 3 Ų | 3 | 46.3 Ų | 46.3 | 1% | 0.014 | 21% | 0.214 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -110.8 | -4.9 | 176.3 | -60.7 | -68.8 | -177.7 | 0 | 0 | 112.7 | K44 H69 V73 N74 V75 H125 | K44-E71 WeakPolarHBondContact CE-OE1 3.08Å; K44-E71 IonicContact NZ-OE1 3.52Å; K44-E71 PolarHBondContact NZ-OE1 3.24Å; K44-E71 IonicContact NZ-OE2 3.43Å; K44-E71 PolarHBondContact NZ-OE2 3.32Å; H69-E71 PolarHBondContact ND1-N 3.33Å; H69-E71 PolarHBondContact O-N 3.27Å; E71-V73 PolarHBondContact O-N 3.45Å; E71-N74 WeakPolarHBondContact O-CB 3.47Å; E71-N74 PolarHBondContact O-N 3.46Å; E71-N74 PolarHBondContact OE2-ND2 3.01Å; E71-V75 WeakPolarHBondContact O-CG2 3.29Å; E71-V75 PolarHBondContact O-N 3.03Å; E71-H125 HydrophobicContact CB-CB 4.5Å; E71-H125 IonicContact OE1-ND1 2.82Å; E71-H125 IonicContact OE2-CE1 3.41Å; E71-H125 IonicContact OE2-CG 3.04Å; E71-H125 IonicContact OE2-ND1 3.45Å; E71-H125 PolarHBondContact OE2-ND1 2.97Å |
| 72 | A | 96.8 | Very high | 96.3 | Very high | 9 Ų | 9 | 46.5 Ų | 46.5 | 7% | 0.074 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -58.7 | -46.7 | -167.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | H69 N74 V75 W76 | H69-A72 PolarHBondContact CE1-N 3.02Å; H69-A72 PolarHBondContact ND1-N 3.29Å; H69-A72 WeakPolarHBondContact O-CB 3.31Å; H69-A72 PolarHBondContact O-N 2.96Å; A72-N74 VanDerWaalsContact C-N 3.34Å; A72-N74 PolarHBondContact O-N 3.23Å; A72-V75 PolarHBondContact O-N 3.25Å; A72-W76 VanDerWaalsContact O-CD1 3.28Å; A72-W76 PolarHBondContact O-N 3Å |
| 73 | V | 97.3 | Very high | 96.4 | Very high | 25 Ų | 25 | 45.8 Ų | 45.8 | 15% | 0.152 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.2 | -37.2 | 177.4 | -178.1 | 0 | 0 | 0 | 0 | 111.6 | E71 V75 W76 T77 V270 F271 Q276 | E71-V73 PolarHBondContact O-N 3.45Å; V73-V75 VanDerWaalsContact C-N 3.3Å; V73-V75 PolarHBondContact O-N 3.31Å; V73-W76 PolarHBondContact O-N 3Å; V73-T77 HydrophobicContact CG1-CG2 3.98Å; V73-T77 WeakPolarHBondContact O-CB 3.46Å; V73-T77 WeakPolarHBondContact O-CG2 3.33Å; V73-T77 PolarHBondContact O-N 3.4Å; V73-T77 PolarHBondContact O-OG1 3.46Å; V73-V270 WeakPolarHBondContact CG2-O 3.4Å; V73-F271 HydrophobicContact CG2-CD1 3.55Å; V73-F271 HydrophobicContact CG2-CE1 3.53Å; V73-F271 HydrophobicContact CG2-CG 4.49Å; V73-F271 HydrophobicContact CG2-CZ 4.46Å; V73-Q276 HydrophobicContact CB-CG 3.87Å; V73-Q276 HydrophobicContact CG1-CB 3.96Å; V73-Q276 HydrophobicContact CG1-CG 3.74Å |
| 74 | N | 97.9 | Very high | 96.5 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.4 | -37.8 | 177.1 | -60.8 | -33.6 | 0 | 0 | 0 | 111.3 | K44 E71 A72 T77 H125 Q276 H279 | K44-N74 PolarHBondContact NZ-ND2 3.29Å; E71-N74 WeakPolarHBondContact O-CB 3.47Å; E71-N74 PolarHBondContact O-N 3.46Å; E71-N74 PolarHBondContact OE2-ND2 3.01Å; A72-N74 VanDerWaalsContact C-N 3.34Å; A72-N74 PolarHBondContact O-N 3.23Å; N74-T77 PolarHBondContact O-OG1 3.29Å; N74-T77 VanDerWaalsContact O-OG1 3.08Å; N74-H125 HydrophobicContact CB-CB 4.14Å; N74-Q276 WeakPolarHBondContact OD1-CG 3.31Å; N74-H279 PolarHBondContact O-ND1 3.28Å |
| 75 | V | 98.3 | Very high | 96.5 | Very high | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.012 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -67.8 | -53 | 174.4 | 179.8 | 0 | 0 | 0 | 0 | 110.9 | L65 E71 A72 V73 T77 H78 L79 H125 L126 | L65-V75 HydrophobicContact CD1-CG1 3.55Å; E71-V75 WeakPolarHBondContact O-CG2 3.29Å; E71-V75 PolarHBondContact O-N 3.03Å; A72-V75 PolarHBondContact O-N 3.25Å; V73-V75 VanDerWaalsContact C-N 3.3Å; V73-V75 PolarHBondContact O-N 3.31Å; V75-T77 PolarHBondContact O-N 3.41Å; V75-H78 PolarHBondContact O-N 2.89Å; V75-L79 VanDerWaalsContact O-CB 3.23Å; V75-L79 WeakPolarHBondContact O-CB 3.16Å; V75-L79 PolarHBondContact O-N 3.06Å; V75-H125 HydrophobicContact CG2-CB 3.61Å; V75-L126 HydrophobicContact CG1-CB 4.2Å; V75-L126 HydrophobicContact CG1-CD1 4.41Å; V75-L126 HydrophobicContact CG2-CB 3.97Å; V75-L126 HydrophobicContact CG2-CD1 4.47Å |
| 76 | W | 98.4 | Very high | 96.4 | Very high | 99 Ų | 99 | 44.8 Ų | 44.8 | 38% | 0.375 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -67 | -36.3 | -172.4 | -85.9 | 102.2 | 0 | 0 | 0 | 113.9 | L65 F66 A72 V73 H78 L79 L80 | L65-W76 HydrophobicContact CD1-CZ2 4.27Å; L65-W76 HydrophobicContact CG-CZ2 4.07Å; L65-W76 PolarHBondContact O-NE1 3.03Å; F66-W76 HydrophobicContact CD1-CH2 4.3Å; F66-W76 AromaticContact CD1-CZ2 3.76Å; F66-W76 HydrophobicContact CD1-CZ2 3.76Å; F66-W76 AromaticContact CE1-CH2 3.83Å; F66-W76 HydrophobicContact CE1-CH2 3.83Å; F66-W76 AromaticContact CE1-CZ2 3.7Å; F66-W76 HydrophobicContact CE1-CZ2 3.7Å; A72-W76 VanDerWaalsContact O-CD1 3.28Å; A72-W76 PolarHBondContact O-N 3Å; V73-W76 PolarHBondContact O-N 3Å; W76-H78 PolarHBondContact O-N 3.17Å; W76-L79 HydrophobicContact CE3-CD2 4.44Å; W76-L79 HydrophobicContact CZ3-CD2 4.4Å; W76-L80 VanDerWaalsContact O-CB 3.22Å; W76-L80 WeakPolarHBondContact O-CB 3.47Å; W76-L80 PolarHBondContact O-N 2.95Å |
| 77 | T | 98.2 | Very high | 96.3 | Very high | 27 Ų | 27 | 42.6 Ų | 42.6 | 17% | 0.166 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.6 | -48.7 | 177.3 | 44.5 | 0 | 0 | 0 | 0 | 111.6 | V73 N74 V75 A81 I280 | V73-T77 HydrophobicContact CG1-CG2 3.98Å; V73-T77 WeakPolarHBondContact O-CB 3.46Å; V73-T77 WeakPolarHBondContact O-CG2 3.33Å; V73-T77 PolarHBondContact O-N 3.4Å; V73-T77 PolarHBondContact O-OG1 3.46Å; N74-T77 PolarHBondContact O-OG1 3.29Å; N74-T77 VanDerWaalsContact O-OG1 3.08Å; V75-T77 PolarHBondContact O-N 3.41Å; T77-A81 PolarHBondContact O-N 3.42Å; T77-I280 HydrophobicContact CG2-CD1 4.37Å; T77-I280 HydrophobicContact CG2-CG1 3.71Å |
| 78 | H | 98.4 | Very high | 96.2 | Very high | 2 Ų | 2 | 41.6 Ų | 41.6 | 1% | 0.009 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -79.3 | -36.3 | 179 | -75.9 | -168 | 0 | 0 | 0 | 113.3 | V75 W76 A81 A82 L118 S121 A122 H279 | V75-H78 PolarHBondContact O-N 2.89Å; W76-H78 PolarHBondContact O-N 3.17Å; H78-A81 PolarHBondContact O-N 2.77Å; H78-A82 WeakPolarHBondContact O-CB 3.46Å; H78-A82 PolarHBondContact O-N 3.22Å; H78-L118 HydrophobicContact CB-CD2 3.99Å; H78-S121 PolarHBondContact CE1-OG 3.49Å; H78-S121 VanDerWaalsContact CE1-OG 3.32Å; H78-S121 WeakPolarHBondContact ND1-CB 3.38Å; H78-S121 PolarHBondContact ND1-OG 3.07Å; H78-A122 HydrophobicContact CB-CB 4.16Å; H78-H279 AromaticContact CD2-CG 3.79Å; H78-H279 AromaticContact CD2-ND1 3.68Å; H78-H279 AromaticContact CE1-CD2 3.63Å; H78-H279 AromaticContact CE1-CE1 3.54Å; H78-H279 AromaticContact CE1-CG 3.63Å; H78-H279 AromaticContact CE1-ND1 3.58Å; H78-H279 AromaticContact CE1-NE2 3.6Å; H78-H279 AromaticContact CG-ND1 3.88Å; H78-H279 AromaticContact ND1-CE1 3.73Å; H78-H279 AromaticContact ND1-ND1 3.8Å; H78-H279 WeakPolarHBondContact NE2-CB 3.37Å; H78-H279 AromaticContact NE2-CD2 3.6Å; H78-H279 AromaticContact NE2-CE1 3.92Å; H78-H279 AromaticContact NE2-CG 3.26Å; H78-H279 VanDerWaalsContact NE2-CG 3.26Å; H78-H279 AromaticContact NE2-ND1 3.5Å; H78-H279 PolarHBondContact NE2-ND1 3.4Å |
| 79 | L | 98.3 | Very high | 96.1 | Very high | 47 Ų | 47 | 36.5 Ų | 36.5 | 25% | 0.246 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.3 | -46.1 | 177.3 | 179.1 | 62 | 0 | 0 | 0 | 111.6 | L65 V75 W76 A81 A82 L83 A122 | L65-L79 HydrophobicContact CD1-CD2 3.77Å; L65-L79 HydrophobicContact CD2-CD2 4.1Å; L65-L79 HydrophobicContact CG-CD2 4.5Å; V75-L79 VanDerWaalsContact O-CB 3.23Å; V75-L79 WeakPolarHBondContact O-CB 3.16Å; V75-L79 PolarHBondContact O-N 3.06Å; W76-L79 HydrophobicContact CE3-CD2 4.44Å; W76-L79 HydrophobicContact CZ3-CD2 4.4Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.33Å; L79-A82 PolarHBondContact O-N 3.1Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.32Å; L79-A122 HydrophobicContact CB-CB 4.28Å |
| 80 | L | 98.1 | Very high | 95.9 | Very high | 102 Ų | 102 | 38.9 Ų | 38.9 | 53% | 0.534 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -62.1 | -43.4 | 178 | -178.7 | 61.5 | 0 | 0 | 0 | 110.9 | W76 A82 L83 V84 | W76-L80 VanDerWaalsContact O-CB 3.22Å; W76-L80 WeakPolarHBondContact O-CB 3.47Å; W76-L80 PolarHBondContact O-N 2.95Å; L80-A82 PolarHBondContact O-N 3.3Å; L80-L83 PolarHBondContact O-N 2.85Å; L80-V84 WeakPolarHBondContact O-CG2 3.35Å; L80-V84 PolarHBondContact O-N 2.89Å |
| 81 | A | 97.8 | Very high | 95.7 | Very high | 6 Ų | 6 | 43.4 Ų | 43.4 | 5% | 0.05 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.8 | -43.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | T77 H78 L79 L83 V84 L85 L118 V283 | T77-A81 PolarHBondContact O-N 3.42Å; H78-A81 PolarHBondContact O-N 2.77Å; L79-A81 VanDerWaalsContact C-N 3.32Å; L79-A81 PolarHBondContact O-N 3.33Å; A81-L83 VanDerWaalsContact C-N 3.31Å; A81-L83 PolarHBondContact O-N 2.77Å; A81-V84 WeakPolarHBondContact O-CB 2.9Å; A81-V84 PolarHBondContact O-N 2.74Å; A81-L85 WeakPolarHBondContact O-CG 3.33Å; A81-L85 PolarHBondContact O-N 2.8Å; A81-L118 HydrophobicContact CB-CD1 3.76Å; A81-L118 HydrophobicContact CB-CD2 3.94Å; A81-L118 HydrophobicContact CB-CG 4.46Å; A81-V283 HydrophobicContact CB-CB 4.3Å; A81-V283 HydrophobicContact CB-CG1 3.57Å; A81-V283 HydrophobicContact CB-CG2 3.71Å |
| 82 | A | 97.8 | Very high | 95.4 | Very high | 4 Ų | 4 | 44 Ų | 44 | 3% | 0.033 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.9 | -40.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | H78 L79 L80 L85 L86 F115 L118 | H78-A82 WeakPolarHBondContact O-CB 3.46Å; H78-A82 PolarHBondContact O-N 3.22Å; L79-A82 PolarHBondContact O-N 3.1Å; L80-A82 PolarHBondContact O-N 3.3Å; A82-L85 PolarHBondContact O-N 2.97Å; A82-L86 PolarHBondContact O-N 2.98Å; A82-F115 HydrophobicContact CB-CD2 4.09Å; A82-F115 HydrophobicContact CB-CE2 4.07Å; A82-L118 HydrophobicContact CB-CB 3.94Å |
| 83 | L | 96.6 | Very high | 95.1 | Very high | 90 Ų | 90 | 47.9 Ų | 47.9 | 47% | 0.471 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | 175.2 | -66.2 | 173.9 | 0 | 0 | 0 | 112.2 | L79 L80 A81 L85 L86 L87 | L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.32Å; L80-L83 PolarHBondContact O-N 2.85Å; A81-L83 VanDerWaalsContact C-N 3.31Å; A81-L83 PolarHBondContact O-N 2.77Å; L83-L85 VanDerWaalsContact C-N 3.29Å; L83-L85 PolarHBondContact O-N 3.32Å; L83-L86 HydrophobicContact CD2-CD1 4.4Å; L83-L86 PolarHBondContact O-N 2.75Å; L83-L87 PolarHBondContact O-N 2.96Å; L83-L87 VanDerWaalsContact O-N 3.1Å |
| 84 | V | 95.7 | Very high | 94.8 | Very high | 70 Ų | 70 | 54.5 Ų | 54.5 | 42% | 0.424 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.5 | -40.7 | 173.5 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | L80 A81 L87 R88 L287 | L80-V84 WeakPolarHBondContact O-CG2 3.35Å; L80-V84 PolarHBondContact O-N 2.89Å; A81-V84 WeakPolarHBondContact O-CB 2.9Å; A81-V84 PolarHBondContact O-N 2.74Å; V84-L87 PolarHBondContact O-N 2.87Å; V84-R88 WeakPolarHBondContact O-CB 3.44Å; V84-R88 PolarHBondContact O-N 3.39Å; V84-L287 HydrophobicContact CG1-CD2 4.2Å |
| 85 | L | 94.3 | Very high | 94.4 | Very high | 2 Ų | 2 | 59.3 Ų | 59.3 | 1% | 0.01 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -68.9 | -33.8 | 176.8 | -65 | -163.8 | 0 | 0 | 0 | 113.4 | A81 A82 L83 L87 R88 L89 L118 L287 L290 | A81-L85 WeakPolarHBondContact O-CG 3.33Å; A81-L85 PolarHBondContact O-N 2.8Å; A82-L85 PolarHBondContact O-N 2.97Å; L83-L85 VanDerWaalsContact C-N 3.29Å; L83-L85 PolarHBondContact O-N 3.32Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L85-R88 PolarHBondContact O-N 3.21Å; L85-L89 WeakPolarHBondContact O-CB 3.47Å; L85-L89 PolarHBondContact O-N 3.46Å; L85-L118 HydrophobicContact CD1-CD1 3.6Å; L85-L118 HydrophobicContact CG-CD1 4.17Å; L85-L287 HydrophobicContact CD2-CD2 3.94Å; L85-L290 HydrophobicContact CD1-CD1 3.99Å; L85-L290 HydrophobicContact CD2-CD1 3.31Å; L85-L290 HydrophobicContact CG-CD1 4.31Å |
| 86 | L | 92.9 | Very high | 94.2 | Very high | 77 Ų | 77 | 59.7 Ų | 59.7 | 40% | 0.403 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.1 | -42.6 | 172.4 | -74.9 | 175.4 | 0 | 0 | 0 | 111.6 | A82 L83 L89 A90 F115 | A82-L86 PolarHBondContact O-N 2.98Å; L83-L86 HydrophobicContact CD2-CD1 4.4Å; L83-L86 PolarHBondContact O-N 2.75Å; L86-L89 PolarHBondContact O-N 2.88Å; L86-A90 PolarHBondContact O-N 2.98Å; L86-F115 HydrophobicContact CD1-CD2 4.46Å; L86-F115 HydrophobicContact CD1-CE2 3.62Å; L86-F115 HydrophobicContact CD1-CZ 4.16Å; L86-F115 HydrophobicContact CD2-CD2 3.85Å; L86-F115 HydrophobicContact CD2-CE2 3.56Å; L86-F115 HydrophobicContact CD2-CG 4.47Å; L86-F115 HydrophobicContact CD2-CZ 3.93Å; L86-F115 HydrophobicContact CG-CD2 3.79Å; L86-F115 HydrophobicContact CG-CE2 3.42Å; L86-F115 VanDerWaalsContact CG-CE2 3.42Å; L86-F115 HydrophobicContact CG-CZ 4.19Å |
| 87 | L | 92.5 | Very high | 93.8 | Very high | 117 Ų | 117 | 59.4 Ų | 59.4 | 61% | 0.613 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -62.7 | -44.4 | 174.3 | 179 | 60.8 | 0 | 0 | 0 | 111 | L83 V84 L85 L89 A90 L91 | L83-L87 PolarHBondContact O-N 2.96Å; L83-L87 VanDerWaalsContact O-N 3.1Å; V84-L87 PolarHBondContact O-N 2.87Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 3.24Å; L87-A90 WeakPolarHBondContact O-CB 3.44Å; L87-A90 PolarHBondContact O-N 2.79Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 3.44Å; L87-L91 VanDerWaalsContact O-N 3.08Å |
| 88 | R | 90.4 | Very high | 93.5 | Very high | 42 Ų | 42 | 59.9 Ų | 59.9 | 16% | 0.158 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -62.7 | -39.8 | 177.3 | -168.9 | 173.4 | -178.1 | 136.9 | 12.9 | 112.4 | V84 L85 L91 F92 L290 E291 | V84-R88 WeakPolarHBondContact O-CB 3.44Å; V84-R88 PolarHBondContact O-N 3.39Å; L85-R88 PolarHBondContact O-N 3.21Å; R88-L91 PolarHBondContact O-N 2.85Å; R88-F92 HydrophobicContact CG-CD2 4.22Å; R88-F92 HydrophobicContact CG-CE2 3.83Å; R88-F92 HydrophobicContact CG-CZ 4.16Å; R88-F92 PolarHBondContact O-N 3.21Å; R88-L290 PolarHBondContact NH2-O 3.4Å; R88-E291 IonicContact CZ-OE2 2.78Å; R88-E291 IonicContact NH1-OE2 3.46Å; R88-E291 PolarHBondContact NH1-OE2 3.46Å; R88-E291 IonicContact NH2-OE1 2.7Å; R88-E291 IonicContact NH2-OE2 3.27Å; R88-E291 PolarHBondContact NH2-OE2 3.37Å |
| 89 | L | 90.8 | Very high | 92.9 | Very high | 39 Ų | 39 | 71.7 Ų | 71.7 | 20% | 0.204 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -62.8 | -42.5 | 174.2 | 178 | 61.4 | 0 | 0 | 0 | 111.2 | L85 L86 L87 L91 F92 V93 F108 V111 | L85-L89 WeakPolarHBondContact O-CB 3.47Å; L85-L89 PolarHBondContact O-N 3.46Å; L86-L89 PolarHBondContact O-N 2.88Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 3.24Å; L89-L91 VanDerWaalsContact C-N 3.29Å; L89-L91 PolarHBondContact O-N 3.43Å; L89-F92 PolarHBondContact O-N 2.93Å; L89-V93 HydrophobicContact CD1-CG2 4.23Å; L89-V93 HydrophobicContact CG-CG2 4.48Å; L89-V93 WeakPolarHBondContact O-CG2 3.44Å; L89-V93 PolarHBondContact O-N 3.4Å; L89-F108 HydrophobicContact CD1-CD2 4.36Å; L89-F108 HydrophobicContact CD1-CE2 4.35Å; L89-V111 HydrophobicContact CB-CG1 3.97Å; L89-V111 HydrophobicContact CD1-CG1 3.94Å; L89-V111 HydrophobicContact CG-CG1 4.39Å |
| 90 | A | 91.3 | Very high | 92.4 | Very high | 53 Ų | 53 | 72 Ų | 72 | 44% | 0.438 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -58.9 | -42.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | L86 L87 V93 E94 | L86-A90 PolarHBondContact O-N 2.98Å; L87-A90 WeakPolarHBondContact O-CB 3.44Å; L87-A90 PolarHBondContact O-N 2.79Å; A90-V93 PolarHBondContact O-N 2.86Å; A90-E94 PolarHBondContact O-N 2.92Å |
| 91 | L | 90.8 | Very high | 92 | Very high | 96 Ų | 96 | 68 Ų | 68 | 50% | 0.503 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 174.1 | -64.9 | 173.6 | 0 | 0 | 0 | 112.2 | L87 R88 L89 V93 E94 T95 | L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 3.44Å; L87-L91 VanDerWaalsContact O-N 3.08Å; R88-L91 PolarHBondContact O-N 2.85Å; L89-L91 VanDerWaalsContact C-N 3.29Å; L89-L91 PolarHBondContact O-N 3.43Å; L91-V93 VanDerWaalsContact C-N 3.3Å; L91-V93 PolarHBondContact O-N 3.46Å; L91-E94 WeakPolarHBondContact O-CB 3.25Å; L91-E94 PolarHBondContact O-N 2.92Å; L91-E94 VanDerWaalsContact O-N 3.08Å; L91-T95 PolarHBondContact O-N 3.08Å; L91-T95 VanDerWaalsContact O-N 3.15Å; L91-T95 PolarHBondContact O-OG1 3.13Å |
| 92 | F | 90.7 | Very high | 91.5 | Very high | 16 Ų | 16 | 71.7 Ų | 71.7 | 7% | 0.07 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -63 | -34.6 | 177.8 | -74.1 | -34.3 | 0 | 0 | 0 | 113.2 | R88 L89 E94 T95 V96 F98 L107 V111 A294 | R88-F92 HydrophobicContact CG-CD2 4.22Å; R88-F92 HydrophobicContact CG-CE2 3.83Å; R88-F92 HydrophobicContact CG-CZ 4.16Å; R88-F92 PolarHBondContact O-N 3.21Å; L89-F92 PolarHBondContact O-N 2.93Å; F92-E94 PolarHBondContact O-N 3.38Å; F92-T95 PolarHBondContact O-N 2.83Å; F92-V96 HydrophobicContact CB-CG2 4.32Å; F92-V96 HydrophobicContact CD1-CG2 4.13Å; F92-V96 WeakPolarHBondContact O-CA 2.98Å; F92-V96 VanDerWaalsContact O-CB 3.27Å; F92-V96 WeakPolarHBondContact O-CB 3.46Å; F92-V96 PolarHBondContact O-N 2.94Å; F92-F98 HydrophobicContact CB-CE2 3.91Å; F92-F98 HydrophobicContact CB-CZ 3.94Å; F92-L107 HydrophobicContact CE2-CD1 4.38Å; F92-V111 HydrophobicContact CD2-CG2 4.01Å; F92-V111 HydrophobicContact CE2-CG2 3.87Å; F92-A294 HydrophobicContact CE1-CB 4.1Å; F92-A294 HydrophobicContact CZ-CB 3.77Å |
| 93 | V | 91.2 | Very high | 91.2 | Very high | 90 Ų | 90 | 72.5 Ų | 72.5 | 55% | 0.545 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.8 | -26.7 | 176.1 | 168.4 | 0 | 0 | 0 | 0 | 111.7 | L89 A90 L91 F98 | L89-V93 HydrophobicContact CD1-CG2 4.23Å; L89-V93 HydrophobicContact CG-CG2 4.48Å; L89-V93 WeakPolarHBondContact O-CG2 3.44Å; L89-V93 PolarHBondContact O-N 3.4Å; A90-V93 PolarHBondContact O-N 2.86Å; L91-V93 VanDerWaalsContact C-N 3.3Å; L91-V93 PolarHBondContact O-N 3.46Å; V93-F98 HydrophobicContact CG2-CD2 4.26Å; V93-F98 HydrophobicContact CG2-CE2 4.17Å |
| 94 | E | 90.4 | Very high | 91.1 | Very high | 163 Ų | 163 | 68.2 Ų | 68.2 | 76% | 0.762 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -82.2 | -31 | 175 | -65.5 | -178.9 | 174.4 | 0 | 0 | 113 | A90 L91 F92 | A90-E94 PolarHBondContact O-N 2.92Å; L91-E94 WeakPolarHBondContact O-CB 3.25Å; L91-E94 PolarHBondContact O-N 2.92Å; L91-E94 VanDerWaalsContact O-N 3.08Å; F92-E94 PolarHBondContact O-N 3.38Å |
| 95 | T | 90.2 | Very high | 91 | Very high | 102 Ų | 102 | 67.9 Ų | 67.9 | 63% | 0.626 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -104.4 | -19.8 | -172.4 | 64 | 0 | 0 | 0 | 0 | 115 | L91 F92 | L91-T95 PolarHBondContact O-N 3.08Å; L91-T95 VanDerWaalsContact O-N 3.15Å; L91-T95 PolarHBondContact O-OG1 3.13Å; F92-T95 PolarHBondContact O-N 2.83Å |
| 96 | V | 92.7 | Very high | 91 | Very high | 10 Ų | 10 | 67.8 Ų | 67.8 | 6% | 0.061 | 36% | 0.362 | C | S | . | . | S | Bend | trans | -117.7 | 128 | -174.4 | -178.1 | 0 | 0 | 0 | 0 | 110.1 | F92 F98 A104 L107 Y297 | F92-V96 HydrophobicContact CB-CG2 4.32Å; F92-V96 HydrophobicContact CD1-CG2 4.13Å; F92-V96 WeakPolarHBondContact O-CA 2.98Å; F92-V96 VanDerWaalsContact O-CB 3.27Å; F92-V96 WeakPolarHBondContact O-CB 3.46Å; F92-V96 PolarHBondContact O-N 2.94Å; V96-F98 VanDerWaalsContact C-N 3.34Å; V96-F98 HydrophobicContact CB-CD2 4.41Å; V96-F98 HydrophobicContact CB-CE1 4.41Å; V96-F98 HydrophobicContact CB-CE2 4.04Å; V96-F98 HydrophobicContact CB-CZ 4.03Å; V96-F98 HydrophobicContact CG1-CD1 4.08Å; V96-F98 HydrophobicContact CG1-CE1 3.84Å; V96-F98 HydrophobicContact CG1-CE2 4.31Å; V96-F98 HydrophobicContact CG1-CG 4.41Å; V96-F98 HydrophobicContact CG1-CZ 3.97Å; V96-F98 PolarHBondContact O-N 3.19Å; V96-A104 HydrophobicContact CG1-CB 3.61Å; V96-L107 HydrophobicContact CG1-CD2 4.37Å; V96-L107 HydrophobicContact CG2-CD2 4.23Å; V96-Y297 HydrophobicContact CG1-CE1 3.85Å; V96-Y297 HydrophobicContact CG2-CE1 4.12Å |
| 97 | D | 91.8 | Very high | 91.2 | Very high | 93 Ų | 93 | 64.1 Ų | 64.1 | 50% | 0.497 | 34% | 0.343 | S | S | . | . | trans | -79.4 | 78.2 | 176.8 | -175.4 | 10.4 | 0 | 0 | 0 | 112 | W99 G100 D101 | D97-W99 PolarHBondContact O-N 3.46Å; D97-W99 VanDerWaalsContact O-N 3.12Å; D97-W99 PolarHBondContact OD1-N 3.36Å; D97-G100 VanDerWaalsContact CG-N 3.32Å; D97-G100 PolarHBondContact OD1-N 3.27Å; D97-G100 WeakPolarHBondContact OD2-CA 3.37Å; D97-G100 PolarHBondContact OD2-N 3.15Å; D97-D101 HydrophobicContact CB-CB 4.43Å; D97-D101 VanDerWaalsContact O-CB 3.29Å; D97-D101 WeakPolarHBondContact O-CB 3.46Å; D97-D101 PolarHBondContact O-N 3.38Å | ||
| 98 | F | 90.2 | Very high | 91.3 | Very high | 36 Ų | 36 | 62 Ų | 62 | 16% | 0.158 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -14.1 | 178.5 | -70.7 | -62.6 | 0 | 0 | 0 | 114.9 | F92 V93 V96 A104 L107 F108 | F92-F98 HydrophobicContact CB-CE2 3.91Å; F92-F98 HydrophobicContact CB-CZ 3.94Å; V93-F98 HydrophobicContact CG2-CD2 4.26Å; V93-F98 HydrophobicContact CG2-CE2 4.17Å; V96-F98 VanDerWaalsContact C-N 3.34Å; V96-F98 HydrophobicContact CB-CD2 4.41Å; V96-F98 HydrophobicContact CB-CE1 4.41Å; V96-F98 HydrophobicContact CB-CE2 4.04Å; V96-F98 HydrophobicContact CB-CZ 4.03Å; V96-F98 HydrophobicContact CG1-CD1 4.08Å; V96-F98 HydrophobicContact CG1-CE1 3.84Å; V96-F98 HydrophobicContact CG1-CE2 4.31Å; V96-F98 HydrophobicContact CG1-CG 4.41Å; V96-F98 HydrophobicContact CG1-CZ 3.97Å; V96-F98 PolarHBondContact O-N 3.19Å; F98-A104 HydrophobicContact CD1-CB 3.74Å; F98-A104 HydrophobicContact CE1-CB 4.2Å; F98-A104 WeakPolarHBondContact CE1-O 3.46Å; F98-L107 HydrophobicContact CE1-CD2 4.48Å; F98-L107 HydrophobicContact CE1-CG 4.49Å; F98-F108 HydrophobicContact CD1-CB 3.69Å; F98-F108 HydrophobicContact CD1-CD2 4.37Å; F98-F108 HydrophobicContact CD1-CG 4.39Å; F98-F108 HydrophobicContact CE1-CB 3.59Å; F98-F108 HydrophobicContact CE1-CD2 4.36Å; F98-F108 HydrophobicContact CE1-CG 4.46Å; F98-F108 HydrophobicContact CZ-CB 4.42Å |
| 99 | W | 86.7 | Confident | 91.5 | Very high | 250 Ų | 250 | 60.5 Ų | 60.5 | 95% | 0.947 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.1 | -39.5 | -175.7 | -62.6 | 106.2 | 0 | 0 | 0 | 112.6 | D97 | D97-W99 PolarHBondContact O-N 3.46Å; D97-W99 VanDerWaalsContact O-N 3.12Å; D97-W99 PolarHBondContact OD1-N 3.36Å |
| 100 | G | 86.8 | Confident | 91.8 | Very high | 54 Ų | 54 | 58.6 Ų | 58.6 | 56% | 0.557 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.5 | -22.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | D97 | D97-G100 VanDerWaalsContact CG-N 3.32Å; D97-G100 PolarHBondContact OD1-N 3.27Å; D97-G100 WeakPolarHBondContact OD2-CA 3.37Å; D97-G100 PolarHBondContact OD2-N 3.15Å |
| 101 | D | 90.1 | Very high | 92.1 | Very high | 18 Ų | 18 | 56.1 Ų | 56.1 | 10% | 0.096 | 29% | 0.294 | C | S | . | . | trans | -103.9 | 108.2 | 179.3 | -179.3 | 14.9 | 0 | 0 | 0 | 112.4 | D97 H103 A104 Y297 R301 | D97-D101 HydrophobicContact CB-CB 4.43Å; D97-D101 VanDerWaalsContact O-CB 3.29Å; D97-D101 WeakPolarHBondContact O-CB 3.46Å; D97-D101 PolarHBondContact O-N 3.38Å; D101-H103 PolarHBondContact O-N 3.09Å; D101-H103 VanDerWaalsContact O-N 3.17Å; D101-H103 WeakPolarHBondContact OD1-CB 3.27Å; D101-H103 IonicContact OD1-CD2 3.43Å; D101-H103 PolarHBondContact OD1-CD2 3.41Å; D101-H103 IonicContact OD1-CG 3.75Å; D101-H103 PolarHBondContact OD1-N 3.02Å; D101-A104 HydrophobicContact CB-CB 4.21Å; D101-A104 WeakPolarHBondContact O-CB 3.41Å; D101-A104 PolarHBondContact O-N 2.94Å; D101-Y297 PolarHBondContact OD2-OH 3.45Å; D101-R301 IonicContact OD1-NH2 2.8Å; D101-R301 IonicContact OD2-CZ 3.71Å; D101-R301 IonicContact OD2-NH2 3.97Å; D101-R301 PolarHBondContact OD2-NH2 3.39Å | ||
| 102 | P | 87.8 | Confident | 92.3 | Very high | 83 Ų | 83 | 54.6 Ų | 54.6 | 54% | 0.539 | 29% | 0.286 | S | S | . | . | G | 310 helix | trans | -63.9 | -21.4 | 177.6 | 27.5 | -34.6 | 0 | 0 | 0 | 113.2 | A104 | P102-A104 VanDerWaalsContact C-N 3.26Å; P102-A104 PolarHBondContact O-N 2.76Å |
| 103 | H | 92.3 | Very high | 92.7 | Very high | 21 Ų | 21 | 53.9 Ų | 53.9 | 10% | 0.097 | 28% | 0.282 | C | S | . | . | G | 310 helix | trans | -78.4 | -8.7 | 177 | -59.9 | -76.3 | 0 | 0 | 0 | 113 | D101 Y159 Y160 Y297 Y304 | D101-H103 PolarHBondContact O-N 3.09Å; D101-H103 VanDerWaalsContact O-N 3.17Å; D101-H103 WeakPolarHBondContact OD1-CB 3.27Å; D101-H103 IonicContact OD1-CD2 3.43Å; D101-H103 PolarHBondContact OD1-CD2 3.41Å; D101-H103 IonicContact OD1-CG 3.75Å; D101-H103 PolarHBondContact OD1-N 3.02Å; H103-Y159 HydrophobicContact CB-CE1 4.27Å; H103-Y159 PolarHBondContact CE1-OH 3.12Å; H103-Y159 AromaticContact ND1-CE1 3.64Å; H103-Y159 AromaticContact ND1-CZ 3.61Å; H103-Y159 PolarHBondContact ND1-OH 2.84Å; H103-Y160 PolarHBondContact O-OH 3.09Å; H103-Y297 WeakPolarHBondContact O-CE2 3.41Å; H103-Y304 HydrophobicContact CB-CE2 3.82Å; H103-Y304 AromaticContact CG-CE2 3.84Å; H103-Y304 AromaticContact ND1-CE2 3.77Å |
| 104 | A | 94.2 | Very high | 93 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 26% | 0.256 | C | S | . | . | G | 310 helix | trans | -82.6 | -18.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V96 F98 D101 P102 L107 F108 Y297 | V96-A104 HydrophobicContact CG1-CB 3.61Å; F98-A104 HydrophobicContact CD1-CB 3.74Å; F98-A104 HydrophobicContact CE1-CB 4.2Å; F98-A104 WeakPolarHBondContact CE1-O 3.46Å; D101-A104 HydrophobicContact CB-CB 4.21Å; D101-A104 WeakPolarHBondContact O-CB 3.41Å; D101-A104 PolarHBondContact O-N 2.94Å; P102-A104 VanDerWaalsContact C-N 3.26Å; P102-A104 PolarHBondContact O-N 2.76Å; A104-L107 WeakPolarHBondContact O-CB 3.36Å; A104-L107 PolarHBondContact O-N 3.38Å; A104-F108 PolarHBondContact O-N 3.14Å; A104-Y297 HydrophobicContact CB-CE2 4.27Å |
| 105 | L | 93 | Very high | 93.4 | Very high | 63 Ų | 63 | 44.7 Ų | 44.7 | 33% | 0.33 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -62.6 | -42.2 | -175.8 | -178.8 | 60.9 | 0 | 0 | 0 | 113.9 | L107 F108 I109 F315 | L105-L107 VanDerWaalsContact C-N 3.32Å; L105-L107 PolarHBondContact O-N 3.24Å; L105-F108 HydrophobicContact CD1-CD1 4.35Å; L105-F108 WeakPolarHBondContact O-CB 3.3Å; L105-F108 PolarHBondContact O-N 3.36Å; L105-I109 HydrophobicContact CD1-CD1 4.28Å; L105-I109 HydrophobicContact CD1-CG1 4.3Å; L105-I109 HydrophobicContact CG-CD1 4.05Å; L105-I109 WeakPolarHBondContact O-CG1 3.21Å; L105-I109 PolarHBondContact O-N 2.99Å; L105-F315 HydrophobicContact CB-CZ 4.24Å; L105-F315 HydrophobicContact CD2-CE2 3.61Å; L105-F315 HydrophobicContact CD2-CZ 3.77Å; L105-F315 HydrophobicContact CG-CE2 3.84Å; L105-F315 HydrophobicContact CG-CZ 3.99Å |
| 106 | P | 95.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.2 | -39 | 174.5 | -22.6 | 33 | 0 | 0 | 0 | 113.2 | I109 I110 L155 Y159 Y160 F315 | P106-I109 PolarHBondContact O-N 3.14Å; P106-I110 WeakPolarHBondContact O-CG2 3.34Å; P106-I110 PolarHBondContact O-N 3.48Å; P106-L155 HydrophobicContact CB-CD2 4.24Å; P106-L155 HydrophobicContact CB-CG 4.11Å; P106-Y159 HydrophobicContact CB-CD2 4.38Å; P106-Y159 HydrophobicContact CB-CG 4.12Å; P106-Y159 HydrophobicContact CG-CD1 3.99Å; P106-Y159 HydrophobicContact CG-CD2 3.64Å; P106-Y159 HydrophobicContact CG-CE1 4.14Å; P106-Y159 HydrophobicContact CG-CE2 3.82Å; P106-Y159 HydrophobicContact CG-CG 3.71Å; P106-Y160 HydrophobicContact CB-CE2 3.8Å; P106-Y160 WeakPolarHBondContact CB-OH 3.42Å; P106-Y160 WeakPolarHBondContact CD-OH 3.45Å; P106-F315 HydrophobicContact CG-CE1 3.94Å; P106-F315 HydrophobicContact CG-CZ 3.88Å |
| 107 | L | 95.9 | Very high | 94 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.3 | -45.7 | 174 | 178.8 | 65.2 | 0 | 0 | 0 | 111.2 | F92 V96 F98 A104 L105 I109 I110 V111 Y160 V293 Y297 | F92-L107 HydrophobicContact CE2-CD1 4.38Å; V96-L107 HydrophobicContact CG1-CD2 4.37Å; V96-L107 HydrophobicContact CG2-CD2 4.23Å; F98-L107 HydrophobicContact CE1-CD2 4.48Å; F98-L107 HydrophobicContact CE1-CG 4.49Å; A104-L107 WeakPolarHBondContact O-CB 3.36Å; A104-L107 PolarHBondContact O-N 3.38Å; L105-L107 VanDerWaalsContact C-N 3.32Å; L105-L107 PolarHBondContact O-N 3.24Å; L107-I109 VanDerWaalsContact C-N 3.33Å; L107-I109 PolarHBondContact O-N 3.41Å; L107-I110 HydrophobicContact CD1-CG2 4.42Å; L107-I110 WeakPolarHBondContact O-CG2 3.21Å; L107-I110 PolarHBondContact O-N 3.01Å; L107-V111 WeakPolarHBondContact O-CG2 3.37Å; L107-V111 PolarHBondContact O-N 3.26Å; L107-V111 VanDerWaalsContact O-N 3.14Å; L107-Y160 HydrophobicContact CB-CE2 4.21Å; L107-Y160 WeakPolarHBondContact CB-OH 3.5Å; L107-Y160 PolarHBondContact N-OH 2.65Å; L107-V293 HydrophobicContact CD1-CG1 3.91Å; L107-Y297 HydrophobicContact CD2-CD1 3.92Å; L107-Y297 HydrophobicContact CD2-CE1 4.31Å; L107-Y297 HydrophobicContact CD2-CG 4.1Å |
| 108 | F | 94.4 | Very high | 94.3 | Very high | 73 Ų | 73 | 36.5 Ų | 36.5 | 32% | 0.32 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -58.6 | -45.7 | 174.4 | -179.6 | -104.4 | 0 | 0 | 0 | 111.9 | L89 F98 A104 L105 I110 V111 L112 | L89-F108 HydrophobicContact CD1-CD2 4.36Å; L89-F108 HydrophobicContact CD1-CE2 4.35Å; F98-F108 HydrophobicContact CD1-CB 3.69Å; F98-F108 HydrophobicContact CD1-CD2 4.37Å; F98-F108 HydrophobicContact CD1-CG 4.39Å; F98-F108 HydrophobicContact CE1-CB 3.59Å; F98-F108 HydrophobicContact CE1-CD2 4.36Å; F98-F108 HydrophobicContact CE1-CG 4.46Å; F98-F108 HydrophobicContact CZ-CB 4.42Å; A104-F108 PolarHBondContact O-N 3.14Å; L105-F108 HydrophobicContact CD1-CD1 4.35Å; L105-F108 WeakPolarHBondContact O-CB 3.3Å; L105-F108 PolarHBondContact O-N 3.36Å; F108-I110 PolarHBondContact O-N 3.43Å; F108-V111 PolarHBondContact O-N 2.77Å; F108-L112 HydrophobicContact CE1-CD2 4.03Å; F108-L112 HydrophobicContact CZ-CD2 4.4Å; F108-L112 WeakPolarHBondContact O-CB 3.32Å; F108-L112 PolarHBondContact O-N 3.39Å |
| 109 | I | 95.2 | Very high | 94.7 | Very high | 10 Ų | 10 | 36 Ų | 36 | 5% | 0.051 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.6 | -46.5 | -179.4 | -72.3 | 169.3 | 0 | 0 | 0 | 111.2 | L105 P106 L107 V111 L112 A113 L155 F315 F319 | L105-I109 HydrophobicContact CD1-CD1 4.28Å; L105-I109 HydrophobicContact CD1-CG1 4.3Å; L105-I109 HydrophobicContact CG-CD1 4.05Å; L105-I109 WeakPolarHBondContact O-CG1 3.21Å; L105-I109 PolarHBondContact O-N 2.99Å; P106-I109 PolarHBondContact O-N 3.14Å; L107-I109 VanDerWaalsContact C-N 3.33Å; L107-I109 PolarHBondContact O-N 3.41Å; I109-V111 PolarHBondContact O-N 3.08Å; I109-L112 PolarHBondContact O-N 3.42Å; I109-A113 WeakPolarHBondContact O-CB 3.27Å; I109-A113 PolarHBondContact O-N 2.96Å; I109-L155 HydrophobicContact CB-CD2 4.32Å; I109-L155 HydrophobicContact CD1-CD2 3.86Å; I109-L155 HydrophobicContact CG2-CD2 4.05Å; I109-F315 HydrophobicContact CD1-CD2 3.86Å; I109-F315 HydrophobicContact CD1-CE2 3.58Å; I109-F319 HydrophobicContact CG2-CD2 3.7Å; I109-F319 HydrophobicContact CG2-CE2 3.62Å; I109-F319 HydrophobicContact CG2-CG 4.41Å; I109-F319 HydrophobicContact CG2-CZ 4.25Å |
| 110 | I | 97.4 | Very high | 95.3 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -66.6 | -36.9 | 179.6 | -178.2 | 55.8 | 0 | 0 | 0 | 111.9 | P106 L107 F108 S114 Y149 A156 L290 V293 | P106-I110 WeakPolarHBondContact O-CG2 3.34Å; P106-I110 PolarHBondContact O-N 3.48Å; L107-I110 HydrophobicContact CD1-CG2 4.42Å; L107-I110 WeakPolarHBondContact O-CG2 3.21Å; L107-I110 PolarHBondContact O-N 3.01Å; F108-I110 PolarHBondContact O-N 3.43Å; I110-S114 WeakPolarHBondContact O-CB 3.45Å; I110-S114 PolarHBondContact O-N 2.66Å; I110-S114 PolarHBondContact O-OG 3.44Å; I110-Y149 HydrophobicContact CD1-CD2 3.93Å; I110-Y149 HydrophobicContact CD1-CE2 3.74Å; I110-A156 HydrophobicContact CB-CB 4.09Å; I110-A156 HydrophobicContact CG1-CB 4.27Å; I110-A156 HydrophobicContact CG2-CB 4.12Å; I110-L290 HydrophobicContact CG1-CD2 3.83Å; I110-L290 HydrophobicContact CG2-CD2 4.13Å; I110-V293 HydrophobicContact CG2-CG1 4.33Å |
| 111 | V | 96.8 | Very high | 95.9 | Very high | 1 Ų | 1 | 24.2 Ų | 24.2 | 1% | 0.006 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -65.5 | -47 | 176 | 174.8 | 0 | 0 | 0 | 0 | 110.7 | L89 F92 L107 F108 I109 A113 S114 F115 L290 | L89-V111 HydrophobicContact CB-CG1 3.97Å; L89-V111 HydrophobicContact CD1-CG1 3.94Å; L89-V111 HydrophobicContact CG-CG1 4.39Å; F92-V111 HydrophobicContact CD2-CG2 4.01Å; F92-V111 HydrophobicContact CE2-CG2 3.87Å; L107-V111 WeakPolarHBondContact O-CG2 3.37Å; L107-V111 PolarHBondContact O-N 3.26Å; L107-V111 VanDerWaalsContact O-N 3.14Å; F108-V111 PolarHBondContact O-N 2.77Å; I109-V111 PolarHBondContact O-N 3.08Å; V111-A113 PolarHBondContact O-N 2.97Å; V111-S114 PolarHBondContact O-N 3.45Å; V111-F115 PolarHBondContact O-N 3.05Å; V111-L290 HydrophobicContact CG2-CD2 3.98Å |
| 112 | L | 95.6 | Very high | 96.3 | Very high | 64 Ų | 64 | 23.7 Ų | 23.7 | 34% | 0.335 | 13% | 0.125 | S | C | . | . | H | α-helix | trans | -62.3 | -43.5 | 177 | 179.5 | 62.4 | 0 | 0 | 0 | 111.9 | F108 I109 F115 T116 | F108-L112 HydrophobicContact CE1-CD2 4.03Å; F108-L112 HydrophobicContact CZ-CD2 4.4Å; F108-L112 WeakPolarHBondContact O-CB 3.32Å; F108-L112 PolarHBondContact O-N 3.39Å; I109-L112 PolarHBondContact O-N 3.42Å; L112-F115 PolarHBondContact O-N 3.43Å; L112-T116 WeakPolarHBondContact O-CB 3.48Å; L112-T116 PolarHBondContact O-N 3.09Å; L112-T116 PolarHBondContact O-OG1 3.3Å |
| 113 | A | 98.1 | Very high | 96.8 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -64.4 | -41.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | I109 V111 T116 Y117 V148 | I109-A113 WeakPolarHBondContact O-CB 3.27Å; I109-A113 PolarHBondContact O-N 2.96Å; V111-A113 PolarHBondContact O-N 2.97Å; A113-T116 PolarHBondContact O-N 3.26Å; A113-Y117 PolarHBondContact O-N 3.28Å; A113-V148 HydrophobicContact CB-CG1 3.89Å |
| 114 | S | 98.5 | Very high | 97.1 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61.2 | -47.7 | 175.1 | -61.1 | 0 | 0 | 0 | 0 | 111.6 | I110 V111 T116 Y117 L118 Y149 | I110-S114 WeakPolarHBondContact O-CB 3.45Å; I110-S114 PolarHBondContact O-N 2.66Å; I110-S114 PolarHBondContact O-OG 3.44Å; V111-S114 PolarHBondContact O-N 3.45Å; S114-T116 VanDerWaalsContact C-N 3.32Å; S114-T116 PolarHBondContact O-N 2.98Å; S114-Y117 WeakPolarHBondContact O-CD1 3.49Å; S114-Y117 WeakPolarHBondContact O-CE1 3.42Å; S114-L118 WeakPolarHBondContact O-CD1 3.35Å; S114-L118 VanDerWaalsContact O-CG 3.31Å; S114-L118 WeakPolarHBondContact O-CG 3.13Å; S114-L118 PolarHBondContact O-N 3.1Å; S114-Y149 WeakPolarHBondContact OG-CE2 3.25Å |
| 115 | F | 98.1 | Very high | 97.3 | Very high | 61 Ų | 61 | 21.8 Ų | 21.8 | 27% | 0.268 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -61.5 | -41.2 | 175.2 | 174.5 | -100.5 | 0 | 0 | 0 | 112.3 | A82 L86 V111 L112 S119 | A82-F115 HydrophobicContact CB-CD2 4.09Å; A82-F115 HydrophobicContact CB-CE2 4.07Å; L86-F115 HydrophobicContact CD1-CD2 4.46Å; L86-F115 HydrophobicContact CD1-CE2 3.62Å; L86-F115 HydrophobicContact CD1-CZ 4.16Å; L86-F115 HydrophobicContact CD2-CD2 3.85Å; L86-F115 HydrophobicContact CD2-CE2 3.56Å; L86-F115 HydrophobicContact CD2-CG 4.47Å; L86-F115 HydrophobicContact CD2-CZ 3.93Å; L86-F115 HydrophobicContact CG-CD2 3.79Å; L86-F115 HydrophobicContact CG-CE2 3.42Å; L86-F115 VanDerWaalsContact CG-CE2 3.42Å; L86-F115 HydrophobicContact CG-CZ 4.19Å; V111-F115 PolarHBondContact O-N 3.05Å; L112-F115 PolarHBondContact O-N 3.43Å; F115-S119 WeakPolarHBondContact CZ-OG 3.38Å; F115-S119 VanDerWaalsContact O-CB 3.3Å; F115-S119 WeakPolarHBondContact O-CB 3.48Å; F115-S119 PolarHBondContact O-N 2.93Å; F115-S119 PolarHBondContact O-OG 3.12Å |
| 116 | T | 97.6 | Very high | 97.5 | Very high | 29 Ų | 29 | 19.3 Ų | 19.3 | 18% | 0.178 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -63.5 | -49.4 | -177.7 | -60.9 | 0 | 0 | 0 | 0 | 111.6 | L112 A113 S114 S119 F120 | L112-T116 WeakPolarHBondContact O-CB 3.48Å; L112-T116 PolarHBondContact O-N 3.09Å; L112-T116 PolarHBondContact O-OG1 3.3Å; A113-T116 PolarHBondContact O-N 3.26Å; S114-T116 VanDerWaalsContact C-N 3.32Å; S114-T116 PolarHBondContact O-N 2.98Å; T116-S119 PolarHBondContact O-N 3.35Å; T116-F120 HydrophobicContact CG2-CD2 3.87Å; T116-F120 HydrophobicContact CG2-CE1 4.25Å; T116-F120 HydrophobicContact CG2-CE2 3.54Å; T116-F120 HydrophobicContact CG2-CG 4.36Å; T116-F120 HydrophobicContact CG2-CZ 3.75Å; T116-F120 WeakPolarHBondContact O-CB 3.48Å; T116-F120 WeakPolarHBondContact O-CG 3.5Å; T116-F120 PolarHBondContact O-N 3.39Å |
| 117 | Y | 98.4 | Very high | 97.7 | Very high | 2 Ų | 2 | 19.6 Ų | 19.6 | 1% | 0.008 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -65.9 | -41.8 | -178.7 | 93.4 | -99 | 0 | 0 | 0 | 111.9 | A113 S114 S119 F120 S121 G145 Y149 L282 T286 | A113-Y117 PolarHBondContact O-N 3.28Å; S114-Y117 WeakPolarHBondContact O-CD1 3.49Å; S114-Y117 WeakPolarHBondContact O-CE1 3.42Å; Y117-S119 VanDerWaalsContact C-N 3.31Å; Y117-S119 PolarHBondContact O-N 3.44Å; Y117-F120 PolarHBondContact O-N 3.49Å; Y117-S121 VanDerWaalsContact O-CB 3.24Å; Y117-S121 WeakPolarHBondContact O-CB 3.38Å; Y117-S121 PolarHBondContact O-N 3.05Å; Y117-G145 VanDerWaalsContact CB-O 3.27Å; Y117-G145 WeakPolarHBondContact CB-O 3.4Å; Y117-Y149 HydrophobicContact CD1-CD1 4.08Å; Y117-Y149 AromaticContact CD1-CD2 3.68Å; Y117-Y149 HydrophobicContact CD1-CD2 3.68Å; Y117-Y149 HydrophobicContact CD1-CE2 4.42Å; Y117-Y149 AromaticContact CD1-CG 3.49Å; Y117-Y149 HydrophobicContact CD1-CG 3.49Å; Y117-Y149 VanDerWaalsContact CD1-CG 3.49Å; Y117-Y149 HydrophobicContact CE1-CD1 4.09Å; Y117-Y149 AromaticContact CE1-CD2 3.7Å; Y117-Y149 HydrophobicContact CE1-CD2 3.7Å; Y117-Y149 HydrophobicContact CE1-CE1 4.31Å; Y117-Y149 AromaticContact CE1-CE2 3.97Å; Y117-Y149 HydrophobicContact CE1-CE2 3.97Å; Y117-Y149 AromaticContact CE1-CG 3.77Å; Y117-Y149 HydrophobicContact CE1-CG 3.77Å; Y117-Y149 HydrophobicContact CG-CG 4.25Å; Y117-L282 HydrophobicContact CE2-CD2 4.17Å; Y117-T286 HydrophobicContact CE1-CG2 4.1Å; Y117-T286 WeakPolarHBondContact OH-CB 3.49Å; Y117-T286 PolarHBondContact OH-OG1 2.7Å |
| 118 | L | 98.6 | Very high | 97.7 | Very high | 2 Ų | 2 | 19.9 Ų | 19.9 | 1% | 0.01 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -60.9 | -43.7 | 178 | -70.9 | 168.9 | 0 | 0 | 0 | 110.9 | H78 A81 A82 L85 S114 A122 V283 | H78-L118 HydrophobicContact CB-CD2 3.99Å; A81-L118 HydrophobicContact CB-CD1 3.76Å; A81-L118 HydrophobicContact CB-CD2 3.94Å; A81-L118 HydrophobicContact CB-CG 4.46Å; A82-L118 HydrophobicContact CB-CB 3.94Å; L85-L118 HydrophobicContact CD1-CD1 3.6Å; L85-L118 HydrophobicContact CG-CD1 4.17Å; S114-L118 WeakPolarHBondContact O-CD1 3.35Å; S114-L118 VanDerWaalsContact O-CG 3.31Å; S114-L118 WeakPolarHBondContact O-CG 3.13Å; S114-L118 PolarHBondContact O-N 3.1Å; L118-A122 VanDerWaalsContact O-CB 3.3Å; L118-A122 WeakPolarHBondContact O-CB 3.27Å; L118-A122 PolarHBondContact O-N 2.88Å; L118-V283 HydrophobicContact CD2-CG2 3.92Å |
| 119 | S | 98.5 | Very high | 97.8 | Very high | 25 Ų | 25 | 16.6 Ų | 16.6 | 18% | 0.175 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -65.1 | -46.7 | 178.2 | -61.6 | 0 | 0 | 0 | 0 | 112.1 | F115 T116 Y117 S121 A122 L123 | F115-S119 WeakPolarHBondContact CZ-OG 3.38Å; F115-S119 VanDerWaalsContact O-CB 3.3Å; F115-S119 WeakPolarHBondContact O-CB 3.48Å; F115-S119 PolarHBondContact O-N 2.93Å; F115-S119 PolarHBondContact O-OG 3.12Å; T116-S119 PolarHBondContact O-N 3.35Å; Y117-S119 VanDerWaalsContact C-N 3.31Å; Y117-S119 PolarHBondContact O-N 3.44Å; S119-S121 PolarHBondContact O-N 2.84Å; S119-A122 PolarHBondContact O-N 2.91Å; S119-L123 WeakPolarHBondContact O-CB 3.5Å; S119-L123 VanDerWaalsContact O-CG 3.26Å; S119-L123 WeakPolarHBondContact O-CG 3.21Å; S119-L123 PolarHBondContact O-N 2.92Å |
| 120 | F | 98.7 | Very high | 97.9 | Very high | 54 Ų | 54 | 17.6 Ų | 17.6 | 24% | 0.237 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -64.1 | -41.3 | 179.2 | -73.2 | -2.8 | 0 | 0 | 0 | 112.1 | T116 Y117 L123 A124 L141 | T116-F120 HydrophobicContact CG2-CD2 3.87Å; T116-F120 HydrophobicContact CG2-CE1 4.25Å; T116-F120 HydrophobicContact CG2-CE2 3.54Å; T116-F120 HydrophobicContact CG2-CG 4.36Å; T116-F120 HydrophobicContact CG2-CZ 3.75Å; T116-F120 WeakPolarHBondContact O-CB 3.48Å; T116-F120 WeakPolarHBondContact O-CG 3.5Å; T116-F120 PolarHBondContact O-N 3.39Å; Y117-F120 PolarHBondContact O-N 3.49Å; F120-L123 PolarHBondContact O-N 3.41Å; F120-A124 WeakPolarHBondContact O-CB 3.23Å; F120-A124 PolarHBondContact O-N 3.49Å; F120-L141 HydrophobicContact CB-CG 4.14Å; F120-L141 HydrophobicContact CD1-CD1 4.37Å; F120-L141 HydrophobicContact CD1-CD2 3.96Å; F120-L141 HydrophobicContact CD1-CG 3.99Å; F120-L141 HydrophobicContact CD2-CD1 3.7Å; F120-L141 HydrophobicContact CD2-CG 3.67Å; F120-L141 WeakPolarHBondContact CD2-O 3.06Å; F120-L141 HydrophobicContact CE1-CD1 4.17Å; F120-L141 HydrophobicContact CE1-CD2 4.19Å; F120-L141 HydrophobicContact CE1-CG 4.26Å; F120-L141 HydrophobicContact CE2-CD1 3.47Å; F120-L141 VanDerWaalsContact CE2-CD1 3.47Å; F120-L141 HydrophobicContact CE2-CG 3.96Å; F120-L141 HydrophobicContact CG-CD1 4.15Å; F120-L141 HydrophobicContact CG-CD2 4.13Å; F120-L141 HydrophobicContact CG-CG 3.68Å; F120-L141 HydrophobicContact CZ-CD1 3.72Å; F120-L141 HydrophobicContact CZ-CG 4.25Å |
| 121 | S | 98.6 | Very high | 97.9 | Very high | 2 Ų | 2 | 18.5 Ų | 18.5 | 1% | 0.014 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -64.9 | -46.5 | 175.5 | -171.8 | 0 | 0 | 0 | 0 | 112.4 | H78 Y117 S119 L123 A124 H125 D142 | H78-S121 PolarHBondContact CE1-OG 3.49Å; H78-S121 VanDerWaalsContact CE1-OG 3.32Å; H78-S121 WeakPolarHBondContact ND1-CB 3.38Å; H78-S121 PolarHBondContact ND1-OG 3.07Å; Y117-S121 VanDerWaalsContact O-CB 3.24Å; Y117-S121 WeakPolarHBondContact O-CB 3.38Å; Y117-S121 PolarHBondContact O-N 3.05Å; S119-S121 PolarHBondContact O-N 2.84Å; S121-L123 VanDerWaalsContact C-N 3.35Å; S121-L123 PolarHBondContact O-N 2.91Å; S121-A124 PolarHBondContact O-N 3.23Å; S121-A124 VanDerWaalsContact O-N 3.1Å; S121-H125 PolarHBondContact O-CD2 3.31Å; S121-H125 VanDerWaalsContact O-CD2 3.31Å; S121-H125 PolarHBondContact O-N 3.5Å; S121-D142 VanDerWaalsContact CA-OD1 3.22Å; S121-D142 WeakPolarHBondContact CA-OD1 3.36Å; S121-D142 WeakPolarHBondContact CB-OD1 3.41Å; S121-D142 PolarHBondContact OG-OD1 3.41Å |
| 122 | A | 98.7 | Very high | 98 | Very high | 8 Ų | 8 | 20.4 Ų | 20.4 | 7% | 0.066 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.6 | -43.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | H78 L79 L118 S119 A124 H125 L126 | H78-A122 HydrophobicContact CB-CB 4.16Å; L79-A122 HydrophobicContact CB-CB 4.28Å; L118-A122 VanDerWaalsContact O-CB 3.3Å; L118-A122 WeakPolarHBondContact O-CB 3.27Å; L118-A122 PolarHBondContact O-N 2.88Å; S119-A122 PolarHBondContact O-N 2.91Å; A122-A124 VanDerWaalsContact C-N 3.3Å; A122-A124 PolarHBondContact O-N 3.35Å; A122-H125 PolarHBondContact O-N 3.21Å; A122-L126 VanDerWaalsContact O-CB 3.23Å; A122-L126 WeakPolarHBondContact O-CB 3.46Å; A122-L126 PolarHBondContact O-N 3.37Å |
| 123 | L | 98.5 | Very high | 98.1 | Very high | 62 Ų | 62 | 19.5 Ų | 19.5 | 33% | 0.325 | 10% | 0.099 | S | C | . | . | H | α-helix | trans | -61.3 | -39.8 | 174 | -74.8 | 171.2 | 0 | 0 | 0 | 111.5 | S119 F120 S121 L126 L127 | S119-L123 WeakPolarHBondContact O-CB 3.5Å; S119-L123 VanDerWaalsContact O-CG 3.26Å; S119-L123 WeakPolarHBondContact O-CG 3.21Å; S119-L123 PolarHBondContact O-N 2.92Å; F120-L123 PolarHBondContact O-N 3.41Å; S121-L123 VanDerWaalsContact C-N 3.35Å; S121-L123 PolarHBondContact O-N 2.91Å; L123-L126 PolarHBondContact O-N 3.29Å; L123-L127 HydrophobicContact CD2-CD1 3.99Å; L123-L127 VanDerWaalsContact O-CB 3.29Å; L123-L127 WeakPolarHBondContact O-CB 3.27Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 2.69Å |
| 124 | A | 98.5 | Very high | 98 | Very high | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -64.3 | -50.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | F120 S121 A122 L126 L127 Q128 F138 F139 D142 | F120-A124 WeakPolarHBondContact O-CB 3.23Å; F120-A124 PolarHBondContact O-N 3.49Å; S121-A124 PolarHBondContact O-N 3.23Å; S121-A124 VanDerWaalsContact O-N 3.1Å; A122-A124 VanDerWaalsContact C-N 3.3Å; A122-A124 PolarHBondContact O-N 3.35Å; A124-L126 VanDerWaalsContact C-N 3.25Å; A124-L126 PolarHBondContact O-N 2.92Å; A124-L127 PolarHBondContact O-N 3.5Å; A124-Q128 WeakPolarHBondContact O-CB 3.3Å; A124-Q128 WeakPolarHBondContact O-CG 3.45Å; A124-Q128 PolarHBondContact O-N 3.41Å; A124-F138 HydrophobicContact CB-CB 3.92Å; A124-F138 WeakPolarHBondContact CB-O 3.43Å; A124-F139 HydrophobicContact CB-CD1 4.38Å; A124-D142 HydrophobicContact CB-CB 4.01Å |
| 125 | H | 98.3 | Very high | 98 | Very high | 2 Ų | 2 | 24.2 Ų | 24.2 | 1% | 0.009 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -64.4 | -31 | 175.9 | -75.9 | -79.6 | 0 | 0 | 0 | 112.6 | R52 E71 N74 V75 S121 A122 H275 H279 | R52-H125 PolarHBondContact NH2-O 3.32Å; E71-H125 HydrophobicContact CB-CB 4.5Å; E71-H125 IonicContact OE1-ND1 2.82Å; E71-H125 IonicContact OE2-CE1 3.41Å; E71-H125 IonicContact OE2-CG 3.04Å; E71-H125 IonicContact OE2-ND1 3.45Å; E71-H125 PolarHBondContact OE2-ND1 2.97Å; N74-H125 HydrophobicContact CB-CB 4.14Å; V75-H125 HydrophobicContact CG2-CB 3.61Å; S121-H125 PolarHBondContact O-CD2 3.31Å; S121-H125 VanDerWaalsContact O-CD2 3.31Å; S121-H125 PolarHBondContact O-N 3.5Å; A122-H125 PolarHBondContact O-N 3.21Å; H125-H275 AromaticContact CE1-CD2 3.77Å; H125-H275 AromaticContact CE1-NE2 3.42Å; H125-H275 PolarHBondContact CE1-NE2 2.84Å; H125-H275 AromaticContact NE2-NE2 3.32Å; H125-H275 PolarHBondContact NE2-NE2 3.46Å; H125-H279 AromaticContact CD2-CE1 3.6Å; H125-H279 AromaticContact NE2-CE1 3.41Å; H125-H279 PolarHBondContact NE2-CE1 3.05Å; H125-H279 AromaticContact NE2-NE2 3.68Å |
| 126 | L | 98.2 | Very high | 98 | Very high | 10 Ų | 10 | 22 Ų | 22 | 5% | 0.052 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -75.4 | -39.1 | 178.3 | -174.8 | 62.5 | 0 | 0 | 0 | 112.5 | R52 Y61 F62 L65 V75 A122 L123 A124 | R52-L126 PolarHBondContact NH1-O 3.31Å; R52-L126 PolarHBondContact NH2-O 3.1Å; Y61-L126 WeakPolarHBondContact O-CD1 3.33Å; F62-L126 HydrophobicContact CD1-CD2 3.96Å; F62-L126 HydrophobicContact CE1-CD2 4.22Å; L65-L126 HydrophobicContact CB-CD1 4.18Å; L65-L126 HydrophobicContact CD1-CD1 4.39Å; V75-L126 HydrophobicContact CG1-CB 4.2Å; V75-L126 HydrophobicContact CG1-CD1 4.41Å; V75-L126 HydrophobicContact CG2-CB 3.97Å; V75-L126 HydrophobicContact CG2-CD1 4.47Å; A122-L126 VanDerWaalsContact O-CB 3.23Å; A122-L126 WeakPolarHBondContact O-CB 3.46Å; A122-L126 PolarHBondContact O-N 3.37Å; L123-L126 PolarHBondContact O-N 3.29Å; A124-L126 VanDerWaalsContact C-N 3.25Å; A124-L126 PolarHBondContact O-N 2.92Å |
| 127 | L | 98.3 | Very high | 98 | Very high | 7 Ų | 7 | 21.6 Ų | 21.6 | 4% | 0.037 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -111.3 | -10.1 | -165.7 | -58.6 | -179.7 | 0 | 0 | 0 | 114.7 | W58 F62 L123 A124 A129 K130 F138 | W58-L127 HydrophobicContact CE3-CD2 4.26Å; W58-L127 HydrophobicContact CZ3-CB 4.28Å; W58-L127 HydrophobicContact CZ3-CD1 4.25Å; W58-L127 HydrophobicContact CZ3-CD2 4.31Å; F62-L127 HydrophobicContact CE1-CD2 4.29Å; F62-L127 HydrophobicContact CE2-CD2 4.38Å; F62-L127 HydrophobicContact CZ-CD1 4.18Å; F62-L127 HydrophobicContact CZ-CD2 4.15Å; L123-L127 HydrophobicContact CD2-CD1 3.99Å; L123-L127 VanDerWaalsContact O-CB 3.29Å; L123-L127 WeakPolarHBondContact O-CB 3.27Å; L123-L127 WeakPolarHBondContact O-CG 3.43Å; L123-L127 PolarHBondContact O-N 2.69Å; A124-L127 PolarHBondContact O-N 3.5Å; L127-A129 PolarHBondContact O-N 3.35Å; L127-A129 VanDerWaalsContact O-N 3.07Å; L127-K130 WeakPolarHBondContact O-CB 3.4Å; L127-K130 PolarHBondContact O-N 2.72Å; L127-K130 VanDerWaalsContact O-N 3.08Å; L127-F138 HydrophobicContact CB-CD1 4.45Å; L127-F138 HydrophobicContact CB-CD2 3.7Å; L127-F138 HydrophobicContact CB-CE1 4.14Å; L127-F138 HydrophobicContact CB-CE2 3.33Å; L127-F138 HydrophobicContact CB-CG 4.28Å; L127-F138 HydrophobicContact CB-CZ 3.59Å; L127-F138 HydrophobicContact CD1-CE1 3.72Å; L127-F138 HydrophobicContact CD1-CE2 4.03Å; L127-F138 HydrophobicContact CD1-CZ 3.36Å; L127-F138 HydrophobicContact CG-CE2 4.33Å; L127-F138 HydrophobicContact CG-CZ 4.12Å |
| 128 | Q | 97.2 | Very high | 98.1 | Very high | 6 Ų | 6 | 22.6 Ų | 22.6 | 3% | 0.028 | 11% | 0.11 | C | C | . | . | G | 310 helix | trans | -56.3 | -29.6 | -177.4 | 64.1 | 84.6 | 5.1 | 0 | 0 | 113.8 | F42 A124 K130 H135 F139 | F42-Q128 VanDerWaalsContact CE1-OE1 3.25Å; A124-Q128 WeakPolarHBondContact O-CB 3.3Å; A124-Q128 WeakPolarHBondContact O-CG 3.45Å; A124-Q128 PolarHBondContact O-N 3.41Å; Q128-K130 PolarHBondContact O-N 3.05Å; Q128-K130 VanDerWaalsContact O-N 3.09Å; Q128-H135 HydrophobicContact CB-CB 4.5Å; Q128-H135 WeakPolarHBondContact O-CA 3.44Å; Q128-H135 WeakPolarHBondContact O-CB 3.42Å; Q128-H135 PolarHBondContact O-N 2.98Å; Q128-H135 PolarHBondContact OE1-ND1 3.44Å; Q128-F139 HydrophobicContact CB-CD2 4.41Å; Q128-F139 HydrophobicContact CB-CE2 3.89Å; Q128-F139 HydrophobicContact CG-CE2 4.01Å; Q128-F139 HydrophobicContact CG-CZ 4.3Å |
| 129 | A | 96.9 | Very high | 98 | Very high | 3 Ų | 3 | 23.3 Ų | 23.3 | 3% | 0.025 | 11% | 0.113 | C | C | . | . | G | 310 helix | trans | -71.7 | 1 | -179 | 0 | 0 | 0 | 0 | 0 | 113.8 | R52 L54 Y61 L127 | R52-A129 HydrophobicContact CB-CB 4.03Å; L54-A129 WeakPolarHBondContact CA-O 3.47Å; L54-A129 HydrophobicContact CD2-CB 4.43Å; L54-A129 WeakPolarHBondContact CD2-O 3.19Å; Y61-A129 HydrophobicContact CD1-CB 4.24Å; Y61-A129 HydrophobicContact CE1-CB 3.71Å; Y61-A129 PolarHBondContact OH-O 2.94Å; Y61-A129 VanDerWaalsContact OH-O 3.05Å; L127-A129 PolarHBondContact O-N 3.35Å; L127-A129 VanDerWaalsContact O-N 3.07Å |
| 130 | K | 97.4 | Very high | 98 | Very high | 32 Ų | 32 | 22.1 Ų | 22.1 | 14% | 0.139 | 11% | 0.105 | C | C | . | . | G | 310 helix | trans | -62.9 | -45.6 | -177.9 | 178.3 | 67.5 | -176.8 | 98.6 | 0 | 113.8 | H55 Q56 W58 Y61 L127 Q128 W134 | H55-K130 WeakPolarHBondContact CA-O 3.1Å; H55-K130 PolarHBondContact N-O 3.15Å; Q56-K130 WeakPolarHBondContact O-CD 3.27Å; Q56-K130 WeakPolarHBondContact O-CE 3.07Å; Q56-K130 PolarHBondContact O-NZ 3.29Å; W58-K130 HydrophobicContact CD2-CD 4.37Å; W58-K130 HydrophobicContact CE3-CD 4.42Å; W58-K130 HydrophobicContact CH2-CB 4.34Å; W58-K130 HydrophobicContact CH2-CD 4.49Å; W58-K130 HydrophobicContact CH2-CG 3.9Å; W58-K130 HydrophobicContact CZ2-CD 4.42Å; W58-K130 HydrophobicContact CZ2-CG 4.08Å; W58-K130 HydrophobicContact CZ3-CB 4.29Å; W58-K130 HydrophobicContact CZ3-CD 4.47Å; W58-K130 HydrophobicContact CZ3-CG 4.15Å; Y61-K130 HydrophobicContact CD2-CD 4.02Å; Y61-K130 HydrophobicContact CE2-CB 4.06Å; Y61-K130 HydrophobicContact CE2-CD 3.35Å; Y61-K130 HydrophobicContact CE2-CG 4.32Å; Y61-K130 WeakPolarHBondContact OH-CA 3.27Å; L127-K130 WeakPolarHBondContact O-CB 3.4Å; L127-K130 PolarHBondContact O-N 2.72Å; L127-K130 VanDerWaalsContact O-N 3.08Å; Q128-K130 PolarHBondContact O-N 3.05Å; Q128-K130 VanDerWaalsContact O-N 3.09Å; K130-W134 HydrophobicContact CB-CB 3.82Å; K130-W134 HydrophobicContact CB-CG 4.04Å; K130-W134 HydrophobicContact CG-CB 4.24Å; K130-W134 HydrophobicContact CG-CG 3.91Å |
| 131 | S | 97.4 | Very high | 98 | Very high | 19 Ų | 19 | 22 Ų | 22 | 13% | 0.133 | 11% | 0.106 | C | C | . | . | trans | -170.7 | 171.5 | 177 | 69.2 | 0 | 0 | 0 | 0 | 109.6 | F133 W134 H135 | S131-F133 VanDerWaalsContact C-N 3.29Å; S131-F133 PolarHBondContact O-N 3.17Å; S131-F133 PolarHBondContact OG-N 2.86Å; S131-W134 PolarHBondContact O-N 3.37Å; S131-W134 VanDerWaalsContact OG-CD1 3.24Å; S131-W134 PolarHBondContact OG-N 2.92Å; S131-H135 WeakPolarHBondContact O-CB 3.38Å; S131-H135 PolarHBondContact O-N 3.08Å | ||
| 132 | E | 97.2 | Very high | 98 | Very high | 41 Ų | 41 | 22.6 Ų | 22.6 | 19% | 0.192 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -54.7 | -44.1 | 174.3 | -63.2 | -168.5 | -161.7 | 0 | 0 | 111.8 | L41 F42 H135 Y136 L341 K344 | L41-E132 HydrophobicContact CD2-CB 3.75Å; L41-E132 HydrophobicContact CD2-CG 3.77Å; F42-E132 HydrophobicContact CE2-CG 4.15Å; E132-H135 WeakPolarHBondContact O-CB 3.39Å; E132-H135 PolarHBondContact O-N 3.07Å; E132-Y136 WeakPolarHBondContact O-CD2 3.32Å; E132-Y136 PolarHBondContact O-N 2.86Å; E132-L341 HydrophobicContact CB-CD1 4.17Å; E132-L341 HydrophobicContact CB-CD2 4.01Å; E132-L341 WeakPolarHBondContact OE2-CD2 3.29Å; E132-K344 IonicContact OE1-NZ 2.68Å; E132-K344 PolarHBondContact OE1-NZ 3.31Å; E132-K344 IonicContact OE2-NZ 3.03Å; E132-K344 PolarHBondContact OE2-NZ 3.27Å |
| 133 | F | 97.6 | Very high | 98 | Very high | 44 Ų | 44 | 23.8 Ų | 23.8 | 19% | 0.193 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -58.7 | -53 | 178 | 174.2 | -100.2 | 0 | 0 | 0 | 112.2 | S131 H135 Y136 S137 V337 Q338 L341 | S131-F133 VanDerWaalsContact C-N 3.29Å; S131-F133 PolarHBondContact O-N 3.17Å; S131-F133 PolarHBondContact OG-N 2.86Å; F133-H135 VanDerWaalsContact C-N 3.27Å; F133-H135 PolarHBondContact O-N 3.42Å; F133-Y136 PolarHBondContact O-N 3.05Å; F133-Y136 VanDerWaalsContact O-N 3.14Å; F133-S137 WeakPolarHBondContact CZ-OG 3.44Å; F133-S137 PolarHBondContact O-N 3.3Å; F133-S137 PolarHBondContact O-OG 3.06Å; F133-V337 HydrophobicContact CD2-CG1 4.21Å; F133-Q338 HydrophobicContact CD2-CB 4.22Å; F133-Q338 HydrophobicContact CE2-CB 4.04Å; F133-L341 HydrophobicContact CB-CD1 3.74Å |
| 134 | W | 97.8 | Very high | 98 | Very high | 92 Ų | 92 | 21 Ų | 21 | 35% | 0.348 | 10% | 0.098 | S | C | . | . | H | α-helix | trans | -66.2 | -31.5 | -177.7 | -73.4 | 111.2 | 0 | 0 | 0 | 112.3 | W58 K130 S131 Y136 S137 F138 | W58-W134 AromaticContact CH2-CD2 3.6Å; W58-W134 HydrophobicContact CH2-CD2 3.6Å; W58-W134 AromaticContact CH2-CE2 3.64Å; W58-W134 AromaticContact CH2-CE3 3.92Å; W58-W134 HydrophobicContact CH2-CE3 3.92Å; W58-W134 AromaticContact CH2-CG 4Å; W58-W134 HydrophobicContact CH2-CG 4Å; W58-W134 HydrophobicContact CH2-CH2 4.29Å; W58-W134 HydrophobicContact CH2-CZ2 4.02Å; W58-W134 HydrophobicContact CH2-CZ3 4.25Å; W58-W134 HydrophobicContact CZ2-CD2 4.03Å; W58-W134 AromaticContact CZ2-CE2 3.54Å; W58-W134 HydrophobicContact CZ2-CG 4.5Å; W58-W134 HydrophobicContact CZ2-CH2 4.25Å; W58-W134 AromaticContact CZ2-CZ2 3.68Å; W58-W134 HydrophobicContact CZ2-CZ2 3.68Å; W58-W134 AromaticContact CZ2-NE1 3.75Å; K130-W134 HydrophobicContact CB-CB 3.82Å; K130-W134 HydrophobicContact CB-CG 4.04Å; K130-W134 HydrophobicContact CG-CB 4.24Å; K130-W134 HydrophobicContact CG-CG 3.91Å; S131-W134 PolarHBondContact O-N 3.37Å; S131-W134 VanDerWaalsContact OG-CD1 3.24Å; S131-W134 PolarHBondContact OG-N 2.92Å; W134-Y136 PolarHBondContact O-N 3.36Å; W134-S137 PolarHBondContact O-N 3.44Å; W134-F138 HydrophobicContact CB-CD2 4.13Å; W134-F138 HydrophobicContact CB-CE2 4.22Å; W134-F138 HydrophobicContact CD2-CE2 4.15Å; W134-F138 HydrophobicContact CE3-CD2 4.02Å; W134-F138 AromaticContact CE3-CE2 3.48Å; W134-F138 HydrophobicContact CE3-CE2 3.48Å; W134-F138 VanDerWaalsContact CE3-CE2 3.48Å; W134-F138 HydrophobicContact CE3-CZ 4.02Å; W134-F138 HydrophobicContact CG-CE2 4.48Å; W134-F138 HydrophobicContact CZ3-CE2 4.2Å; W134-F138 HydrophobicContact CZ3-CZ 4.28Å; W134-F138 WeakPolarHBondContact O-CB 3.39Å; W134-F138 VanDerWaalsContact O-CD2 3.23Å; W134-F138 WeakPolarHBondContact O-CD2 3.37Å; W134-F138 PolarHBondContact O-N 3.09Å |
| 135 | H | 98 | Very high | 98 | Very high | 7 Ų | 7 | 21 Ų | 21 | 3% | 0.032 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -53.9 | -52.4 | 170.6 | -179.6 | 95.4 | 0 | 0 | 0 | 111.2 | L41 F42 Q128 S131 E132 F133 F139 K193 | L41-H135 HydrophobicContact CD2-CB 4.33Å; F42-H135 AromaticContact CD1-ND1 3.57Å; F42-H135 HydrophobicContact CE1-CB 3.77Å; F42-H135 AromaticContact CE1-CG 3.86Å; F42-H135 AromaticContact CE1-ND1 3.45Å; F42-H135 WeakPolarHBondContact CE1-ND1 3.22Å; F42-H135 HydrophobicContact CZ-CB 3.99Å; Q128-H135 HydrophobicContact CB-CB 4.5Å; Q128-H135 WeakPolarHBondContact O-CA 3.44Å; Q128-H135 WeakPolarHBondContact O-CB 3.42Å; Q128-H135 PolarHBondContact O-N 2.98Å; Q128-H135 PolarHBondContact OE1-ND1 3.44Å; S131-H135 WeakPolarHBondContact O-CB 3.38Å; S131-H135 PolarHBondContact O-N 3.08Å; E132-H135 WeakPolarHBondContact O-CB 3.39Å; E132-H135 PolarHBondContact O-N 3.07Å; F133-H135 VanDerWaalsContact C-N 3.27Å; F133-H135 PolarHBondContact O-N 3.42Å; H135-F139 AromaticContact CD2-CD2 4Å; H135-F139 AromaticContact CE1-CD2 3.87Å; H135-F139 AromaticContact CE1-CE2 3.44Å; H135-F139 VanDerWaalsContact CE1-CE2 3.44Å; H135-F139 WeakPolarHBondContact CE1-CE2 3.17Å; H135-F139 AromaticContact ND1-CE2 3.8Å; H135-F139 AromaticContact NE2-CD2 3.73Å; H135-F139 AromaticContact NE2-CE2 3.75Å; H135-F139 WeakPolarHBondContact O-CD2 3.45Å; H135-F139 PolarHBondContact O-N 3Å; H135-K193 WeakPolarHBondContact NE2-CE 3.23Å; H135-K193 PolarHBondContact NE2-NZ 3.33Å |
| 136 | Y | 98.1 | Very high | 98 | Very high | 16 Ų | 16 | 23.4 Ų | 23.4 | 6% | 0.063 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -64.4 | -51.1 | 177.6 | -70 | -76.9 | 0 | 0 | 0 | 112.3 | L41 E132 F133 W134 F138 F139 F140 K193 Q196 V337 | L41-Y136 HydrophobicContact CD1-CE1 4.24Å; L41-Y136 HydrophobicContact CD1-CE2 4.11Å; L41-Y136 WeakPolarHBondContact CD1-OH 3.15Å; L41-Y136 HydrophobicContact CD2-CD2 4.49Å; L41-Y136 HydrophobicContact CD2-CE2 3.79Å; E132-Y136 WeakPolarHBondContact O-CD2 3.32Å; E132-Y136 PolarHBondContact O-N 2.86Å; F133-Y136 PolarHBondContact O-N 3.05Å; F133-Y136 VanDerWaalsContact O-N 3.14Å; W134-Y136 PolarHBondContact O-N 3.36Å; Y136-F138 VanDerWaalsContact C-N 3.32Å; Y136-F138 PolarHBondContact O-N 3.2Å; Y136-F139 PolarHBondContact O-N 3.33Å; Y136-F140 HydrophobicContact CD1-CE1 4.47Å; Y136-F140 HydrophobicContact CD1-CZ 4.09Å; Y136-F140 HydrophobicContact CG-CZ 4.47Å; Y136-F140 WeakPolarHBondContact O-CD2 3.41Å; Y136-F140 WeakPolarHBondContact O-CG 3.08Å; Y136-F140 PolarHBondContact O-N 3.33Å; Y136-K193 HydrophobicContact CD1-CG 4.11Å; Y136-K193 HydrophobicContact CE1-CG 4.47Å; Y136-K193 WeakPolarHBondContact CE1-O 3.48Å; Y136-Q196 PolarHBondContact OH-NE2 3.34Å; Y136-V337 HydrophobicContact CD1-CG2 4.19Å; Y136-V337 HydrophobicContact CD2-CB 4.44Å; Y136-V337 HydrophobicContact CD2-CG1 3.45Å; Y136-V337 VanDerWaalsContact CD2-CG1 3.45Å; Y136-V337 HydrophobicContact CD2-CG2 4.07Å; Y136-V337 HydrophobicContact CE2-CG1 4.09Å; Y136-V337 HydrophobicContact CG-CG1 3.96Å; Y136-V337 HydrophobicContact CG-CG2 3.83Å |
| 137 | S | 98.1 | Very high | 98.1 | Very high | 19 Ų | 19 | 23 Ų | 23 | 13% | 0.133 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -60.4 | -40.6 | -173.6 | -65.4 | 0 | 0 | 0 | 0 | 112.9 | F133 W134 F140 L141 S334 | F133-S137 WeakPolarHBondContact CZ-OG 3.44Å; F133-S137 PolarHBondContact O-N 3.3Å; F133-S137 PolarHBondContact O-OG 3.06Å; W134-S137 PolarHBondContact O-N 3.44Å; S137-F140 PolarHBondContact O-N 3.35Å; S137-L141 PolarHBondContact O-N 3.38Å; S137-S334 PolarHBondContact OG-OG 3.41Å |
| 138 | F | 98.5 | Very high | 98.1 | Very high | 23 Ų | 23 | 23 Ų | 23 | 10% | 0.101 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -71.1 | -38.4 | 177.5 | -83.3 | -61.7 | 0 | 0 | 0 | 113.1 | W58 A124 L127 W134 Y136 F140 L141 D142 | W58-F138 AromaticContact CH2-CE2 3.98Å; W58-F138 HydrophobicContact CH2-CE2 3.98Å; W58-F138 HydrophobicContact CH2-CZ 4.27Å; W58-F138 AromaticContact CZ3-CE2 3.97Å; W58-F138 HydrophobicContact CZ3-CE2 3.97Å; W58-F138 HydrophobicContact CZ3-CZ 4.17Å; A124-F138 HydrophobicContact CB-CB 3.92Å; A124-F138 WeakPolarHBondContact CB-O 3.43Å; L127-F138 HydrophobicContact CB-CD1 4.45Å; L127-F138 HydrophobicContact CB-CD2 3.7Å; L127-F138 HydrophobicContact CB-CE1 4.14Å; L127-F138 HydrophobicContact CB-CE2 3.33Å; L127-F138 HydrophobicContact CB-CG 4.28Å; L127-F138 HydrophobicContact CB-CZ 3.59Å; L127-F138 HydrophobicContact CD1-CE1 3.72Å; L127-F138 HydrophobicContact CD1-CE2 4.03Å; L127-F138 HydrophobicContact CD1-CZ 3.36Å; L127-F138 HydrophobicContact CG-CE2 4.33Å; L127-F138 HydrophobicContact CG-CZ 4.12Å; W134-F138 HydrophobicContact CB-CD2 4.13Å; W134-F138 HydrophobicContact CB-CE2 4.22Å; W134-F138 HydrophobicContact CD2-CE2 4.15Å; W134-F138 HydrophobicContact CE3-CD2 4.02Å; W134-F138 AromaticContact CE3-CE2 3.48Å; W134-F138 HydrophobicContact CE3-CE2 3.48Å; W134-F138 VanDerWaalsContact CE3-CE2 3.48Å; W134-F138 HydrophobicContact CE3-CZ 4.02Å; W134-F138 HydrophobicContact CG-CE2 4.48Å; W134-F138 HydrophobicContact CZ3-CE2 4.2Å; W134-F138 HydrophobicContact CZ3-CZ 4.28Å; W134-F138 WeakPolarHBondContact O-CB 3.39Å; W134-F138 VanDerWaalsContact O-CD2 3.23Å; W134-F138 WeakPolarHBondContact O-CD2 3.37Å; W134-F138 PolarHBondContact O-N 3.09Å; Y136-F138 VanDerWaalsContact C-N 3.32Å; Y136-F138 PolarHBondContact O-N 3.2Å; F138-F140 VanDerWaalsContact C-N 3.33Å; F138-L141 HydrophobicContact CD1-CD2 4.48Å; F138-L141 WeakPolarHBondContact O-CB 3.21Å; F138-L141 PolarHBondContact O-N 2.94Å; F138-D142 PolarHBondContact O-N 3.31Å |
| 139 | F | 98.3 | Very high | 98.1 | Very high | 18 Ų | 18 | 23.7 Ų | 23.7 | 8% | 0.079 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -68.8 | -31.7 | 173.6 | -81.7 | -61.7 | 0 | 0 | 0 | 112.4 | A124 Q128 H135 Y136 L141 D142 Y143 | A124-F139 HydrophobicContact CB-CD1 4.38Å; Q128-F139 HydrophobicContact CB-CD2 4.41Å; Q128-F139 HydrophobicContact CB-CE2 3.89Å; Q128-F139 HydrophobicContact CG-CE2 4.01Å; Q128-F139 HydrophobicContact CG-CZ 4.3Å; H135-F139 AromaticContact CD2-CD2 4Å; H135-F139 AromaticContact CE1-CD2 3.87Å; H135-F139 AromaticContact CE1-CE2 3.44Å; H135-F139 VanDerWaalsContact CE1-CE2 3.44Å; H135-F139 WeakPolarHBondContact CE1-CE2 3.17Å; H135-F139 AromaticContact ND1-CE2 3.8Å; H135-F139 AromaticContact NE2-CD2 3.73Å; H135-F139 AromaticContact NE2-CE2 3.75Å; H135-F139 WeakPolarHBondContact O-CD2 3.45Å; H135-F139 PolarHBondContact O-N 3Å; Y136-F139 PolarHBondContact O-N 3.33Å; F139-L141 VanDerWaalsContact C-N 3.32Å; F139-D142 WeakPolarHBondContact O-CB 3.46Å; F139-D142 PolarHBondContact O-N 3.47Å; F139-Y143 HydrophobicContact CB-CE2 4.49Å; F139-Y143 WeakPolarHBondContact O-CD2 3.13Å; F139-Y143 PolarHBondContact O-N 3.14Å |
| 140 | F | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -64.7 | -39.6 | 170.3 | -61.4 | -22.7 | 0 | 0 | 0 | 111.5 | Y136 S137 F138 D142 Y143 V144 C190 K193 A330 L333 S334 V337 | Y136-F140 HydrophobicContact CD1-CE1 4.47Å; Y136-F140 HydrophobicContact CD1-CZ 4.09Å; Y136-F140 HydrophobicContact CG-CZ 4.47Å; Y136-F140 WeakPolarHBondContact O-CD2 3.41Å; Y136-F140 WeakPolarHBondContact O-CG 3.08Å; Y136-F140 PolarHBondContact O-N 3.33Å; S137-F140 PolarHBondContact O-N 3.35Å; F138-F140 VanDerWaalsContact C-N 3.33Å; F140-D142 VanDerWaalsContact C-N 3.34Å; F140-Y143 HydrophobicContact CD1-CD2 4.3Å; F140-Y143 HydrophobicContact CD1-CE2 4.43Å; F140-Y143 PolarHBondContact O-N 3.37Å; F140-V144 WeakPolarHBondContact O-CG2 3.19Å; F140-V144 PolarHBondContact O-N 3.47Å; F140-C190 HydrophobicContact CD1-CB 3.78Å; F140-C190 HydrophobicContact CE1-CB 4.06Å; F140-C190 VanDerWaalsContact CE1-O 3.25Å; F140-C190 WeakPolarHBondContact CE1-O 3.22Å; F140-C190 HydrophobicContact CG-CB 4.4Å; F140-K193 HydrophobicContact CE1-CB 4.01Å; F140-K193 HydrophobicContact CE1-CG 4.05Å; F140-A330 HydrophobicContact CB-CB 3.8Å; F140-L333 HydrophobicContact CD2-CB 4.22Å; F140-L333 HydrophobicContact CE2-CB 3.69Å; F140-L333 HydrophobicContact CZ-CB 4.01Å; F140-S334 WeakPolarHBondContact CD2-OG 3.48Å; F140-V337 HydrophobicContact CE2-CG2 4.08Å; F140-V337 HydrophobicContact CZ-CG2 4.19Å |
| 141 | L | 98.5 | Very high | 98.3 | Very high | 51 Ų | 51 | 23 Ų | 23 | 27% | 0.267 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -63.1 | -40.5 | 174.4 | -173.2 | 65 | 0 | 0 | 0 | 111.8 | F120 S137 F138 F139 Y143 V144 G145 | F120-L141 HydrophobicContact CB-CG 4.14Å; F120-L141 HydrophobicContact CD1-CD1 4.37Å; F120-L141 HydrophobicContact CD1-CD2 3.96Å; F120-L141 HydrophobicContact CD1-CG 3.99Å; F120-L141 HydrophobicContact CD2-CD1 3.7Å; F120-L141 HydrophobicContact CD2-CG 3.67Å; F120-L141 WeakPolarHBondContact CD2-O 3.06Å; F120-L141 HydrophobicContact CE1-CD1 4.17Å; F120-L141 HydrophobicContact CE1-CD2 4.19Å; F120-L141 HydrophobicContact CE1-CG 4.26Å; F120-L141 HydrophobicContact CE2-CD1 3.47Å; F120-L141 VanDerWaalsContact CE2-CD1 3.47Å; F120-L141 HydrophobicContact CE2-CG 3.96Å; F120-L141 HydrophobicContact CG-CD1 4.15Å; F120-L141 HydrophobicContact CG-CD2 4.13Å; F120-L141 HydrophobicContact CG-CG 3.68Å; F120-L141 HydrophobicContact CZ-CD1 3.72Å; F120-L141 HydrophobicContact CZ-CG 4.25Å; S137-L141 PolarHBondContact O-N 3.38Å; F138-L141 HydrophobicContact CD1-CD2 4.48Å; F138-L141 WeakPolarHBondContact O-CB 3.21Å; F138-L141 PolarHBondContact O-N 2.94Å; F139-L141 VanDerWaalsContact C-N 3.32Å; L141-Y143 PolarHBondContact O-N 3.34Å; L141-V144 WeakPolarHBondContact O-CB 3.39Å; L141-V144 PolarHBondContact O-N 2.95Å; L141-G145 PolarHBondContact O-N 2.98Å |
| 142 | D | 98.6 | Very high | 98.3 | Very high | 14 Ų | 14 | 22.1 Ų | 22.1 | 8% | 0.075 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -56.7 | -48.4 | 172.5 | -173.4 | 22.4 | 0 | 0 | 0 | 111.5 | S121 A124 F138 F139 F140 V144 G145 V146 | S121-D142 VanDerWaalsContact CA-OD1 3.22Å; S121-D142 WeakPolarHBondContact CA-OD1 3.36Å; S121-D142 WeakPolarHBondContact CB-OD1 3.41Å; S121-D142 PolarHBondContact OG-OD1 3.41Å; A124-D142 HydrophobicContact CB-CB 4.01Å; F138-D142 PolarHBondContact O-N 3.31Å; F139-D142 WeakPolarHBondContact O-CB 3.46Å; F139-D142 PolarHBondContact O-N 3.47Å; F140-D142 VanDerWaalsContact C-N 3.34Å; D142-V144 VanDerWaalsContact C-N 3.32Å; D142-V144 PolarHBondContact O-N 3.32Å; D142-G145 WeakPolarHBondContact O-CA 3.38Å; D142-G145 PolarHBondContact O-N 3.4Å; D142-V146 PolarHBondContact O-N 3.44Å |
| 143 | Y | 98.4 | Very high | 98.4 | Very high | 33 Ų | 33 | 20.8 Ų | 20.8 | 13% | 0.129 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -63.8 | -33.9 | 177.1 | -56.1 | -30.8 | 0 | 0 | 0 | 113.8 | F139 F140 L141 G145 V146 A147 S189 C190 K193 | F139-Y143 HydrophobicContact CB-CE2 4.49Å; F139-Y143 WeakPolarHBondContact O-CD2 3.13Å; F139-Y143 PolarHBondContact O-N 3.14Å; F140-Y143 HydrophobicContact CD1-CD2 4.3Å; F140-Y143 HydrophobicContact CD1-CE2 4.43Å; F140-Y143 PolarHBondContact O-N 3.37Å; L141-Y143 PolarHBondContact O-N 3.34Å; Y143-G145 VanDerWaalsContact C-N 3.35Å; Y143-V146 PolarHBondContact O-N 3.43Å; Y143-A147 PolarHBondContact O-N 3.28Å; Y143-A147 VanDerWaalsContact O-N 3.09Å; Y143-S189 WeakPolarHBondContact CE2-O 3.06Å; Y143-C190 HydrophobicContact CD2-CB 4.4Å; Y143-K193 HydrophobicContact CE2-CB 3.83Å; Y143-K193 HydrophobicContact CE2-CG 4.26Å |
| 144 | V | 98.8 | Very high | 98.4 | Very high | 4 Ų | 4 | 18.7 Ų | 18.7 | 2% | 0.024 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -61.1 | -47.1 | 169.9 | 171.1 | 0 | 0 | 0 | 0 | 109.9 | F140 L141 D142 V146 A147 V148 S326 V327 A330 | F140-V144 WeakPolarHBondContact O-CG2 3.19Å; F140-V144 PolarHBondContact O-N 3.47Å; L141-V144 WeakPolarHBondContact O-CB 3.39Å; L141-V144 PolarHBondContact O-N 2.95Å; D142-V144 VanDerWaalsContact C-N 3.32Å; D142-V144 PolarHBondContact O-N 3.32Å; V144-V146 VanDerWaalsContact C-N 3.33Å; V144-V146 PolarHBondContact O-N 3.45Å; V144-A147 PolarHBondContact O-N 2.91Å; V144-V148 HydrophobicContact CG1-CG2 4.38Å; V144-V148 WeakPolarHBondContact O-CG2 3.42Å; V144-V148 PolarHBondContact O-N 3.32Å; V144-S326 WeakPolarHBondContact CG2-O 3.31Å; V144-V327 HydrophobicContact CG1-CG2 3.8Å; V144-A330 HydrophobicContact CG2-CB 3.71Å |
| 145 | G | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -55.3 | -47.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y117 L141 D142 Y143 A147 V148 Y149 | Y117-G145 VanDerWaalsContact CB-O 3.27Å; Y117-G145 WeakPolarHBondContact CB-O 3.4Å; L141-G145 PolarHBondContact O-N 2.98Å; D142-G145 WeakPolarHBondContact O-CA 3.38Å; D142-G145 PolarHBondContact O-N 3.4Å; Y143-G145 VanDerWaalsContact C-N 3.35Å; G145-A147 PolarHBondContact O-N 3.4Å; G145-V148 PolarHBondContact O-N 3.39Å; G145-Y149 PolarHBondContact O-N 3.27Å |
| 146 | V | 98.3 | Very high | 98.4 | Very high | 53 Ų | 53 | 14 Ų | 14 | 32% | 0.321 | 7% | 0.072 | S | C | . | . | H | α-helix | trans | -58.5 | -44.9 | 177 | 174.7 | 0 | 0 | 0 | 0 | 111.6 | D142 Y143 V144 V148 Y149 Q150 | D142-V146 PolarHBondContact O-N 3.44Å; Y143-V146 PolarHBondContact O-N 3.43Å; V144-V146 VanDerWaalsContact C-N 3.33Å; V144-V146 PolarHBondContact O-N 3.45Å; V146-V148 PolarHBondContact O-N 2.91Å; V146-Y149 PolarHBondContact O-N 3.41Å; V146-Q150 VanDerWaalsContact O-CB 3.31Å; V146-Q150 WeakPolarHBondContact O-CB 3.32Å; V146-Q150 PolarHBondContact O-N 2.97Å |
| 147 | A | 98.6 | Very high | 98.5 | Very high | 0 Ų | 0 | 13.2 Ų | 13.2 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -65.6 | -37.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y143 V144 G145 Q150 F151 A182 C186 | Y143-A147 PolarHBondContact O-N 3.28Å; Y143-A147 VanDerWaalsContact O-N 3.09Å; V144-A147 PolarHBondContact O-N 2.91Å; G145-A147 PolarHBondContact O-N 3.4Å; A147-Q150 PolarHBondContact O-N 3.45Å; A147-F151 PolarHBondContact O-N 3.28Å; A147-F151 VanDerWaalsContact O-N 3.08Å; A147-A182 HydrophobicContact CB-CB 4.32Å; A147-A182 VanDerWaalsContact CB-O 3.29Å; A147-A182 WeakPolarHBondContact CB-O 3.34Å; A147-C186 HydrophobicContact CB-CB 3.69Å |
| 148 | V | 98.5 | Very high | 98.4 | Very high | 7 Ų | 7 | 12.8 Ų | 12.8 | 4% | 0.042 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -63.9 | -44.6 | 175 | 175.2 | 0 | 0 | 0 | 0 | 110.8 | A113 V144 G145 V146 G152 F319 V323 | A113-V148 HydrophobicContact CB-CG1 3.89Å; V144-V148 HydrophobicContact CG1-CG2 4.38Å; V144-V148 WeakPolarHBondContact O-CG2 3.42Å; V144-V148 PolarHBondContact O-N 3.32Å; G145-V148 PolarHBondContact O-N 3.39Å; V146-V148 PolarHBondContact O-N 2.91Å; V148-G152 PolarHBondContact O-N 2.83Å; V148-F319 HydrophobicContact CG1-CE2 3.76Å; V148-F319 HydrophobicContact CG1-CZ 3.87Å; V148-V323 HydrophobicContact CG1-CG2 4.3Å; V148-V323 HydrophobicContact CG2-CB 4.46Å; V148-V323 HydrophobicContact CG2-CG2 3.69Å |
| 149 | Y | 98.6 | Very high | 98.3 | Very high | 22 Ų | 22 | 11.9 Ų | 11.9 | 9% | 0.086 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -62.1 | -43.7 | 173.8 | 173.8 | -112.1 | 0 | 0 | 0 | 112.6 | I110 S114 Y117 G145 V146 F151 G152 S153 T286 Q289 | I110-Y149 HydrophobicContact CD1-CD2 3.93Å; I110-Y149 HydrophobicContact CD1-CE2 3.74Å; S114-Y149 WeakPolarHBondContact OG-CE2 3.25Å; Y117-Y149 HydrophobicContact CD1-CD1 4.08Å; Y117-Y149 AromaticContact CD1-CD2 3.68Å; Y117-Y149 HydrophobicContact CD1-CD2 3.68Å; Y117-Y149 HydrophobicContact CD1-CE2 4.42Å; Y117-Y149 AromaticContact CD1-CG 3.49Å; Y117-Y149 HydrophobicContact CD1-CG 3.49Å; Y117-Y149 VanDerWaalsContact CD1-CG 3.49Å; Y117-Y149 HydrophobicContact CE1-CD1 4.09Å; Y117-Y149 AromaticContact CE1-CD2 3.7Å; Y117-Y149 HydrophobicContact CE1-CD2 3.7Å; Y117-Y149 HydrophobicContact CE1-CE1 4.31Å; Y117-Y149 AromaticContact CE1-CE2 3.97Å; Y117-Y149 HydrophobicContact CE1-CE2 3.97Å; Y117-Y149 AromaticContact CE1-CG 3.77Å; Y117-Y149 HydrophobicContact CE1-CG 3.77Å; Y117-Y149 HydrophobicContact CG-CG 4.25Å; G145-Y149 PolarHBondContact O-N 3.27Å; V146-Y149 PolarHBondContact O-N 3.41Å; Y149-F151 PolarHBondContact O-N 2.86Å; Y149-G152 PolarHBondContact O-N 3Å; Y149-S153 VanDerWaalsContact O-CB 3.26Å; Y149-S153 WeakPolarHBondContact O-CB 3.37Å; Y149-S153 PolarHBondContact O-N 3.5Å; Y149-T286 HydrophobicContact CE2-CG2 4.06Å; Y149-T286 PolarHBondContact OH-OG1 3.36Å; Y149-Q289 PolarHBondContact OH-OE1 3.5Å |
| 150 | Q | 98.4 | Very high | 98.3 | Very high | 20 Ų | 20 | 11.1 Ų | 11.1 | 9% | 0.093 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -57.9 | -49.8 | 179.3 | -166.5 | 170.5 | -67.8 | 0 | 0 | 111.5 | V146 A147 S153 A154 A182 S185 A213 D217 | V146-Q150 VanDerWaalsContact O-CB 3.31Å; V146-Q150 WeakPolarHBondContact O-CB 3.32Å; V146-Q150 PolarHBondContact O-N 2.97Å; A147-Q150 PolarHBondContact O-N 3.45Å; Q150-S153 WeakPolarHBondContact O-CB 3.48Å; Q150-S153 PolarHBondContact O-N 3.46Å; Q150-A154 PolarHBondContact O-N 3.46Å; Q150-A182 HydrophobicContact CB-CB 4.38Å; Q150-A182 VanDerWaalsContact NE2-CA 3.29Å; Q150-S185 PolarHBondContact NE2-OG 3.45Å; Q150-A213 VanDerWaalsContact CD-CB 3.45Å; Q150-A213 HydrophobicContact CG-CB 4.15Å; Q150-D217 WeakPolarHBondContact CG-OD2 3.5Å |
| 151 | F | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 11.1 Ų | 11.1 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -64.2 | -42.7 | 174.7 | 178.7 | -87.1 | 0 | 0 | 0 | 112.7 | A147 Y149 S153 A154 L155 A178 A179 A182 L318 F319 T322 | A147-F151 PolarHBondContact O-N 3.28Å; A147-F151 VanDerWaalsContact O-N 3.08Å; Y149-F151 PolarHBondContact O-N 2.86Å; F151-S153 PolarHBondContact O-N 2.84Å; F151-A154 WeakPolarHBondContact O-CB 3.49Å; F151-A154 PolarHBondContact O-N 2.9Å; F151-L155 HydrophobicContact CE1-CB 4.37Å; F151-L155 HydrophobicContact CE1-CD2 4.35Å; F151-L155 WeakPolarHBondContact O-CB 3.3Å; F151-L155 PolarHBondContact O-N 3.21Å; F151-A178 HydrophobicContact CD2-CB 4.48Å; F151-A179 HydrophobicContact CD2-CB 3.79Å; F151-A179 HydrophobicContact CE2-CB 3.77Å; F151-A182 HydrophobicContact CB-CB 4.22Å; F151-L318 HydrophobicContact CE2-CB 3.85Å; F151-L318 HydrophobicContact CZ-CB 3.63Å; F151-F319 HydrophobicContact CD1-CB 4.21Å; F151-F319 AromaticContact CD1-CD2 3.72Å; F151-F319 HydrophobicContact CD1-CD2 3.72Å; F151-F319 HydrophobicContact CD1-CG 4.47Å; F151-F319 HydrophobicContact CE1-CB 3.71Å; F151-F319 HydrophobicContact CE1-CD2 4.01Å; F151-F319 HydrophobicContact CE1-CG 4.38Å; F151-T322 HydrophobicContact CB-CG2 4.13Å |
| 152 | G | 98.4 | Very high | 98.1 | Very high | 0 Ų | 0 | 8.8 Ų | 8.8 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -58.7 | -38.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V148 Y149 L155 A156 | V148-G152 PolarHBondContact O-N 2.83Å; Y149-G152 PolarHBondContact O-N 3Å; G152-L155 PolarHBondContact O-N 3.41Å; G152-A156 WeakPolarHBondContact O-CB 3.32Å; G152-A156 PolarHBondContact O-N 2.93Å |
| 153 | S | 98.6 | Very high | 98 | Very high | 13 Ų | 13 | 9.5 Ų | 9.5 | 9% | 0.091 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -65.9 | -48 | 177.6 | 165.2 | 0 | 0 | 0 | 0 | 110.7 | Y149 Q150 F151 L155 A156 H157 Q289 | Y149-S153 VanDerWaalsContact O-CB 3.26Å; Y149-S153 WeakPolarHBondContact O-CB 3.37Å; Y149-S153 PolarHBondContact O-N 3.5Å; Q150-S153 WeakPolarHBondContact O-CB 3.48Å; Q150-S153 PolarHBondContact O-N 3.46Å; F151-S153 PolarHBondContact O-N 2.84Å; S153-L155 VanDerWaalsContact C-N 3.31Å; S153-L155 PolarHBondContact O-N 3.38Å; S153-A156 PolarHBondContact O-N 2.82Å; S153-H157 PolarHBondContact O-N 2.88Å; S153-H157 PolarHBondContact O-ND1 3.04Å; S153-Q289 VanDerWaalsContact CB-NE2 3.33Å; S153-Q289 PolarHBondContact OG-NE2 3.42Å |
| 154 | A | 98.5 | Very high | 97.8 | Very high | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -57 | -45.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q150 F151 H157 F158 F174 A178 D217 | Q150-A154 PolarHBondContact O-N 3.46Å; F151-A154 WeakPolarHBondContact O-CB 3.49Å; F151-A154 PolarHBondContact O-N 2.9Å; A154-H157 PolarHBondContact O-N 3.13Å; A154-F158 VanDerWaalsContact O-CB 3.22Å; A154-F158 WeakPolarHBondContact O-CB 3.37Å; A154-F158 PolarHBondContact O-N 3.46Å; A154-F174 HydrophobicContact CB-CE1 4.1Å; A154-F174 WeakPolarHBondContact O-CE1 3.18Å; A154-A178 HydrophobicContact CB-CB 3.57Å; A154-D217 HydrophobicContact CB-CB 4.09Å; A154-D217 WeakPolarHBondContact CB-OD1 3.46Å |
| 155 | L | 98 | Very high | 97.6 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -60.4 | -49.2 | 177.4 | 175.3 | 61.5 | 0 | 0 | 0 | 111.2 | P106 I109 F151 G152 S153 H157 F158 Y159 L175 F315 | P106-L155 HydrophobicContact CB-CD2 4.24Å; P106-L155 HydrophobicContact CB-CG 4.11Å; I109-L155 HydrophobicContact CB-CD2 4.32Å; I109-L155 HydrophobicContact CD1-CD2 3.86Å; I109-L155 HydrophobicContact CG2-CD2 4.05Å; F151-L155 HydrophobicContact CE1-CB 4.37Å; F151-L155 HydrophobicContact CE1-CD2 4.35Å; F151-L155 WeakPolarHBondContact O-CB 3.3Å; F151-L155 PolarHBondContact O-N 3.21Å; G152-L155 PolarHBondContact O-N 3.41Å; S153-L155 VanDerWaalsContact C-N 3.31Å; S153-L155 PolarHBondContact O-N 3.38Å; L155-H157 PolarHBondContact O-N 3.39Å; L155-F158 PolarHBondContact O-N 3.48Å; L155-Y159 VanDerWaalsContact O-CB 3.24Å; L155-Y159 WeakPolarHBondContact O-CB 3.22Å; L155-Y159 PolarHBondContact O-N 3.5Å; L155-L175 HydrophobicContact CB-CD2 4.31Å; L155-L175 HydrophobicContact CD1-CD1 4.16Å; L155-L175 HydrophobicContact CD1-CD2 4.01Å; L155-F315 HydrophobicContact CD1-CB 3.8Å; L155-F315 HydrophobicContact CD1-CD1 3.88Å; L155-F315 HydrophobicContact CD1-CD2 4.36Å; L155-F315 HydrophobicContact CD1-CE1 4.48Å; L155-F315 HydrophobicContact CD1-CG 3.8Å; L155-F315 HydrophobicContact CD2-CB 4.37Å; L155-F315 HydrophobicContact CD2-CD2 3.79Å; L155-F315 HydrophobicContact CD2-CE2 4.3Å; L155-F315 HydrophobicContact CD2-CG 4.08Å |
| 156 | A | 98.1 | Very high | 97.5 | Very high | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -61.6 | -43.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | I110 G152 S153 Y159 Y160 V293 | I110-A156 HydrophobicContact CB-CB 4.09Å; I110-A156 HydrophobicContact CG1-CB 4.27Å; I110-A156 HydrophobicContact CG2-CB 4.12Å; G152-A156 WeakPolarHBondContact O-CB 3.32Å; G152-A156 PolarHBondContact O-N 2.93Å; S153-A156 PolarHBondContact O-N 2.82Å; A156-Y159 PolarHBondContact O-N 2.9Å; A156-Y160 HydrophobicContact CB-CD2 4.44Å; A156-Y160 WeakPolarHBondContact O-CD2 3.48Å; A156-Y160 PolarHBondContact O-N 3.32Å; A156-V293 HydrophobicContact CB-CG1 4.08Å; A156-V293 HydrophobicContact CB-CG2 3.92Å |
| 157 | H | 98.6 | Very high | 97.4 | Very high | 1 Ų | 1 | 14 Ų | 14 | 1% | 0.005 | 7% | 0.074 | C | C | . | . | I | π-helix | trans | -67.3 | -41.5 | 176.9 | -63.6 | 155.8 | 0 | 0 | 0 | 112.7 | S153 A154 L155 Y159 A161 I162 D217 P220 V221 H241 Q244 Q289 | S153-H157 PolarHBondContact O-N 2.88Å; S153-H157 PolarHBondContact O-ND1 3.04Å; A154-H157 PolarHBondContact O-N 3.13Å; L155-H157 PolarHBondContact O-N 3.39Å; H157-Y159 VanDerWaalsContact C-N 3.26Å; H157-Y159 PolarHBondContact O-N 3.29Å; H157-A161 CarbonylContact O-C 3.43Å; H157-A161 PolarHBondContact O-N 3.07Å; H157-I162 PolarHBondContact O-N 3.35Å; H157-D217 PolarHBondContact ND1-O 2.87Å; H157-P220 HydrophobicContact CB-CB 4.27Å; H157-P220 HydrophobicContact CB-CG 4.11Å; H157-V221 HydrophobicContact CB-CG2 4.22Å; H157-V221 VanDerWaalsContact CD2-CG2 3.48Å; H157-V221 WeakPolarHBondContact CD2-CG2 3.24Å; H157-H241 AromaticContact CD2-CE1 3.94Å; H157-Q244 PolarHBondContact CE1-NE2 2.67Å; H157-Q244 PolarHBondContact NE2-NE2 2.86Å; H157-Q289 PolarHBondContact CE1-NE2 2.91Å; H157-Q289 PolarHBondContact NE2-NE2 3.49Å |
| 158 | F | 97.2 | Very high | 97.2 | Very high | 10 Ų | 10 | 17 Ų | 17 | 4% | 0.044 | 10% | 0.1 | C | C | . | . | I | π-helix | trans | -64.2 | -35.3 | 176 | -178 | -96.9 | 0 | 0 | 0 | 111.7 | A154 L155 I162 H167 V170 Q171 F174 L175 H308 | A154-F158 VanDerWaalsContact O-CB 3.22Å; A154-F158 WeakPolarHBondContact O-CB 3.37Å; A154-F158 PolarHBondContact O-N 3.46Å; L155-F158 PolarHBondContact O-N 3.48Å; F158-I162 HydrophobicContact CD2-CD1 3.65Å; F158-I162 HydrophobicContact CE2-CD1 3.87Å; F158-I162 WeakPolarHBondContact O-CB 3.33Å; F158-I162 WeakPolarHBondContact O-CG2 3.32Å; F158-H167 AromaticContact CE2-CD2 3.94Å; F158-H167 AromaticContact CZ-CD2 3.63Å; F158-H167 AromaticContact CZ-NE2 3.6Å; F158-V170 HydrophobicContact CE2-CG2 4.26Å; F158-Q171 HydrophobicContact CZ-CB 4.25Å; F158-F174 HydrophobicContact CB-CD1 3.73Å; F158-F174 HydrophobicContact CB-CE1 3.65Å; F158-F174 HydrophobicContact CB-CZ 4.43Å; F158-F174 HydrophobicContact CD2-CB 3.75Å; F158-F174 AromaticContact CD2-CD1 3.44Å; F158-F174 HydrophobicContact CD2-CD1 3.44Å; F158-F174 VanDerWaalsContact CD2-CD1 3.44Å; F158-F174 HydrophobicContact CD2-CD2 4.21Å; F158-F174 HydrophobicContact CD2-CE1 4.09Å; F158-F174 AromaticContact CD2-CG 3.52Å; F158-F174 HydrophobicContact CD2-CG 3.52Å; F158-F174 HydrophobicContact CE2-CB 3.79Å; F158-F174 HydrophobicContact CE2-CD1 4.33Å; F158-F174 HydrophobicContact CE2-CG 4.08Å; F158-F174 AromaticContact CG-CD1 3.78Å; F158-F174 HydrophobicContact CG-CD1 3.78Å; F158-F174 HydrophobicContact CG-CE1 4.22Å; F158-F174 HydrophobicContact CG-CG 4.32Å; F158-L175 HydrophobicContact CB-CD2 4.19Å; F158-L175 HydrophobicContact CD1-CD1 3.97Å; F158-L175 HydrophobicContact CD1-CD2 4.21Å; F158-L175 HydrophobicContact CD1-CG 3.99Å; F158-L175 HydrophobicContact CE1-CD1 4.13Å; F158-L175 HydrophobicContact CE1-CG 4.33Å; F158-L175 HydrophobicContact CG-CD2 4.25Å; F158-L175 HydrophobicContact CG-CG 4.27Å; F158-H308 AromaticContact CD1-CE1 3.9Å; F158-H308 AromaticContact CE1-CE1 3.53Å; F158-H308 AromaticContact CE1-ND1 3.93Å; F158-H308 PolarHBondContact O-NE2 3.1Å |
| 159 | Y | 96.4 | Very high | 97.1 | Very high | 4 Ų | 4 | 23.7 Ų | 23.7 | 2% | 0.016 | 12% | 0.124 | C | C | . | . | I | π-helix | trans | -79.4 | -55.5 | -176.6 | -151.2 | -84.1 | 0 | 0 | 0 | 111.7 | H103 P106 L155 A156 H157 Y304 H308 W311 F315 | H103-Y159 HydrophobicContact CB-CE1 4.27Å; H103-Y159 PolarHBondContact CE1-OH 3.12Å; H103-Y159 AromaticContact ND1-CE1 3.64Å; H103-Y159 AromaticContact ND1-CZ 3.61Å; H103-Y159 PolarHBondContact ND1-OH 2.84Å; P106-Y159 HydrophobicContact CB-CD2 4.38Å; P106-Y159 HydrophobicContact CB-CG 4.12Å; P106-Y159 HydrophobicContact CG-CD1 3.99Å; P106-Y159 HydrophobicContact CG-CD2 3.64Å; P106-Y159 HydrophobicContact CG-CE1 4.14Å; P106-Y159 HydrophobicContact CG-CE2 3.82Å; P106-Y159 HydrophobicContact CG-CG 3.71Å; L155-Y159 VanDerWaalsContact O-CB 3.24Å; L155-Y159 WeakPolarHBondContact O-CB 3.22Å; L155-Y159 PolarHBondContact O-N 3.5Å; A156-Y159 PolarHBondContact O-N 2.9Å; H157-Y159 VanDerWaalsContact C-N 3.26Å; H157-Y159 PolarHBondContact O-N 3.29Å; Y159-Y304 HydrophobicContact CD1-CD2 4.18Å; Y159-Y304 AromaticContact CE1-CD2 3.79Å; Y159-Y304 HydrophobicContact CE1-CD2 3.79Å; Y159-Y304 HydrophobicContact CE1-CE2 4.15Å; Y159-Y304 WeakPolarHBondContact O-CB 3.47Å; Y159-H308 AromaticContact CD1-CD2 4Å; Y159-H308 AromaticContact CD2-CD2 3.91Å; Y159-H308 HydrophobicContact CE2-CB 3.97Å; Y159-H308 AromaticContact CE2-CD2 3.91Å; Y159-H308 AromaticContact CE2-CG 3.85Å; Y159-H308 AromaticContact CG-CD2 3.97Å; Y159-H308 AromaticContact CZ-CD2 3.97Å; Y159-H308 PolarHBondContact O-NE2 3.11Å; Y159-H308 VanDerWaalsContact O-NE2 3.08Å; Y159-W311 HydrophobicContact CE2-CZ2 4.07Å; Y159-F315 HydrophobicContact CD2-CE1 4.48Å; Y159-F315 HydrophobicContact CE2-CE1 4.11Å |
| 160 | Y | 97.4 | Very high | 96.9 | Very high | 1 Ų | 1 | 23.5 Ų | 23.5 | 0% | 0.004 | 13% | 0.125 | C | C | . | . | I | π-helix | trans | -100.1 | -38.9 | -167.1 | -54.7 | -62.7 | 0 | 0 | 0 | 114.1 | H103 P106 L107 A156 V293 Y297 R300 Y304 | H103-Y160 PolarHBondContact O-OH 3.09Å; P106-Y160 HydrophobicContact CB-CE2 3.8Å; P106-Y160 WeakPolarHBondContact CB-OH 3.42Å; P106-Y160 WeakPolarHBondContact CD-OH 3.45Å; L107-Y160 HydrophobicContact CB-CE2 4.21Å; L107-Y160 WeakPolarHBondContact CB-OH 3.5Å; L107-Y160 PolarHBondContact N-OH 2.65Å; A156-Y160 HydrophobicContact CB-CD2 4.44Å; A156-Y160 WeakPolarHBondContact O-CD2 3.48Å; A156-Y160 PolarHBondContact O-N 3.32Å; Y160-V293 HydrophobicContact CD2-CG1 3.63Å; Y160-V293 HydrophobicContact CE2-CG1 3.94Å; Y160-Y297 HydrophobicContact CD1-CD2 4.39Å; Y160-Y297 AromaticContact CE1-CD2 3.61Å; Y160-Y297 HydrophobicContact CE1-CD2 3.61Å; Y160-Y297 HydrophobicContact CE1-CG 4.36Å; Y160-Y297 AromaticContact CZ-CD2 3.94Å; Y160-R300 PolarHBondContact O-NE 2.8Å; Y160-Y304 AromaticContact CD1-CD1 3.85Å; Y160-Y304 HydrophobicContact CD1-CD1 3.85Å; Y160-Y304 AromaticContact CD1-CE1 3.81Å; Y160-Y304 HydrophobicContact CD1-CE1 3.81Å; Y160-Y304 HydrophobicContact CD1-CG 4.26Å; Y160-Y304 HydrophobicContact CE1-CE1 4.29Å |
| 161 | A | 97.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 14% | 0.139 | C | C | . | . | I | π-helix | trans | -90.7 | -16 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | H157 V221 R224 D296 | H157-A161 CarbonylContact O-C 3.43Å; H157-A161 PolarHBondContact O-N 3.07Å; A161-V221 HydrophobicContact CB-CG2 4.08Å; A161-R224 WeakPolarHBondContact O-CD 3.41Å; A161-D296 WeakPolarHBondContact CB-OD2 3.35Å |
| 162 | I | 96.5 | Very high | 96.3 | Very high | 2 Ų | 2 | 29.3 Ų | 29.3 | 1% | 0.01 | 16% | 0.163 | C | C | . | . | trans | -66.2 | 138.7 | -173.7 | -158.7 | 159.4 | 0 | 0 | 0 | 112 | H157 F158 W166 H167 V170 P220 L307 | H157-I162 PolarHBondContact O-N 3.35Å; F158-I162 HydrophobicContact CD2-CD1 3.65Å; F158-I162 HydrophobicContact CE2-CD1 3.87Å; F158-I162 WeakPolarHBondContact O-CB 3.33Å; F158-I162 WeakPolarHBondContact O-CG2 3.32Å; I162-W166 HydrophobicContact CG1-CB 4.1Å; I162-W166 HydrophobicContact CG1-CG 4.41Å; I162-H167 HydrophobicContact CD1-CB 3.97Å; I162-H167 HydrophobicContact CG1-CB 4.08Å; I162-H167 HydrophobicContact CG2-CB 4.23Å; I162-V170 HydrophobicContact CD1-CG2 3.97Å; I162-P220 HydrophobicContact CB-CB 4.04Å; I162-P220 HydrophobicContact CD1-CB 4.39Å; I162-P220 HydrophobicContact CD1-CG 4.36Å; I162-P220 HydrophobicContact CG1-CB 4Å; I162-L307 HydrophobicContact CG2-CD1 4.1Å | ||
| 163 | E | 95.7 | Very high | 96 | Very high | 29 Ų | 29 | 33.6 Ų | 33.6 | 14% | 0.136 | 19% | 0.189 | C | C | . | . | trans | -86.3 | 145 | 170.7 | -71.9 | -58.8 | 141.9 | 0 | 0 | 110.9 | S165 W166 H167 R224 R300 | E163-S165 PolarHBondContact O-N 3.23Å; E163-S165 VanDerWaalsContact O-N 3.08Å; E163-W166 PolarHBondContact O-N 3.39Å; E163-H167 PolarHBondContact O-N 3.42Å; E163-R224 HydrophobicContact CG-CB 3.94Å; E163-R224 HydrophobicContact CG-CG 4.04Å; E163-R224 WeakPolarHBondContact OE1-CG 3.36Å; E163-R300 IonicContact OE1-CZ 2.8Å; E163-R300 IonicContact OE1-NH1 3.96Å; E163-R300 PolarHBondContact OE1-NH1 2.83Å; E163-R300 IonicContact OE1-NH2 3.98Å; E163-R300 PolarHBondContact OE1-NH2 3.46Å; E163-R300 IonicContact OE2-NH2 3.17Å | ||
| 164 | P | 95.3 | Very high | 95.9 | Very high | 59 Ų | 59 | 33 Ų | 33 | 38% | 0.383 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -52.3 | -36.7 | -178.6 | -29 | 34.7 | 0 | 0 | 0 | 114 | H167 A168 I303 L307 | P164-H167 PolarHBondContact O-N 3.22Å; P164-A168 WeakPolarHBondContact O-CB 3.48Å; P164-A168 PolarHBondContact O-N 2.96Å; P164-I303 HydrophobicContact CG-CG2 4.12Å; P164-L307 HydrophobicContact CB-CD2 4.18Å; P164-L307 HydrophobicContact CG-CD1 4.35Å; P164-L307 HydrophobicContact CG-CD2 4.49Å |
| 165 | S | 95.4 | Very high | 95.8 | Very high | 52 Ų | 52 | 33.5 Ų | 33.5 | 36% | 0.364 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -69 | -34.3 | 178.9 | 62 | 0 | 0 | 0 | 0 | 113.1 | E163 R169 H223 | E163-S165 PolarHBondContact O-N 3.23Å; E163-S165 VanDerWaalsContact O-N 3.08Å; S165-R169 PolarHBondContact O-NE 3.49Å; S165-R169 PolarHBondContact O-NH1 2.96Å; S165-R169 VanDerWaalsContact O-NH1 3.13Å; S165-R169 PolarHBondContact O-NH2 2.89Å; S165-H223 PolarHBondContact OG-CE1 3.36Å |
| 166 | W | 96.6 | Very high | 95.8 | Very high | 61 Ų | 61 | 35.6 Ų | 35.6 | 23% | 0.231 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -75.5 | -43.3 | 172.9 | -167.2 | -115.6 | 0 | 0 | 0 | 110.8 | I162 E163 A168 R169 V170 S219 H223 | I162-W166 HydrophobicContact CG1-CB 4.1Å; I162-W166 HydrophobicContact CG1-CG 4.41Å; E163-W166 PolarHBondContact O-N 3.39Å; W166-A168 VanDerWaalsContact C-N 3.32Å; W166-A168 PolarHBondContact O-N 3.46Å; W166-R169 VanDerWaalsContact CE3-NE 3.32Å; W166-R169 WeakPolarHBondContact O-CB 3.48Å; W166-R169 PolarHBondContact O-N 3.41Å; W166-V170 HydrophobicContact CD2-CG1 4.32Å; W166-V170 HydrophobicContact CZ2-CG1 3.9Å; W166-V170 WeakPolarHBondContact O-CG2 3.17Å; W166-V170 PolarHBondContact O-N 3.36Å; W166-S219 PolarHBondContact NE1-OG 3.38Å; W166-H223 HydrophobicContact CB-CB 4.46Å; W166-H223 HydrophobicContact CD2-CB 4.31Å; W166-H223 HydrophobicContact CE3-CB 4.47Å; W166-H223 AromaticContact CE3-CD2 3.59Å; W166-H223 HydrophobicContact CG-CB 4.27Å |
| 167 | H | 95.6 | Very high | 95.7 | Very high | 12 Ų | 12 | 39.8 Ų | 39.8 | 6% | 0.056 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -52.2 | -49.2 | 176.7 | -176.4 | -92.7 | 0 | 0 | 0 | 111.7 | F158 I162 E163 P164 R169 V170 Q171 L307 H308 | F158-H167 AromaticContact CE2-CD2 3.94Å; F158-H167 AromaticContact CZ-CD2 3.63Å; F158-H167 AromaticContact CZ-NE2 3.6Å; I162-H167 HydrophobicContact CD1-CB 3.97Å; I162-H167 HydrophobicContact CG1-CB 4.08Å; I162-H167 HydrophobicContact CG2-CB 4.23Å; E163-H167 PolarHBondContact O-N 3.42Å; P164-H167 PolarHBondContact O-N 3.22Å; H167-R169 PolarHBondContact O-N 2.89Å; H167-V170 PolarHBondContact O-N 3.48Å; H167-V170 VanDerWaalsContact O-N 3.11Å; H167-Q171 PolarHBondContact CE1-OE1 2.94Å; H167-Q171 VanDerWaalsContact O-CB 3.23Å; H167-Q171 WeakPolarHBondContact O-CB 3.23Å; H167-Q171 WeakPolarHBondContact O-CG 3.2Å; H167-Q171 PolarHBondContact O-N 3.47Å; H167-L307 HydrophobicContact CB-CD1 4.29Å; H167-L307 HydrophobicContact CB-CD2 4.37Å; H167-H308 AromaticContact CD2-CE1 3.86Å; H167-H308 AromaticContact NE2-CE1 3.68Å; H167-H308 AromaticContact NE2-ND1 3.88Å |
| 168 | A | 94.5 | Very high | 95.7 | Very high | 65 Ų | 65 | 39.8 Ų | 39.8 | 54% | 0.537 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -54.8 | -29.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | P164 W166 | P164-A168 WeakPolarHBondContact O-CB 3.48Å; P164-A168 PolarHBondContact O-N 2.96Å; W166-A168 VanDerWaalsContact C-N 3.32Å; W166-A168 PolarHBondContact O-N 3.46Å |
| 169 | R | 95.3 | Very high | 95.8 | Very high | 146 Ų | 146 | 39.6 Ų | 39.6 | 55% | 0.551 | 22% | 0.222 | S | C | * | . | H | α-helix | trans | -83.8 | -34.8 | 179.8 | -69 | -175.8 | -81.5 | -90 | 3.7 | 113.6 | S165 W166 H167 H223 | S165-R169 PolarHBondContact O-NE 3.49Å; S165-R169 PolarHBondContact O-NH1 2.96Å; S165-R169 VanDerWaalsContact O-NH1 3.13Å; S165-R169 PolarHBondContact O-NH2 2.89Å; W166-R169 VanDerWaalsContact CE3-NE 3.32Å; W166-R169 WeakPolarHBondContact O-CB 3.48Å; W166-R169 PolarHBondContact O-N 3.41Å; H167-R169 PolarHBondContact O-N 2.89Å; R169-H223 PolarHBondContact NH2-NE2 3.01Å |
| 170 | V | 95.1 | Very high | 95.8 | Very high | 18 Ų | 18 | 44.2 Ų | 44.2 | 11% | 0.109 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -117.1 | -11.2 | -165.2 | -52.9 | 0 | 0 | 0 | 0 | 114.8 | F158 I162 W166 H167 A172 V173 F174 | F158-V170 HydrophobicContact CE2-CG2 4.26Å; I162-V170 HydrophobicContact CD1-CG2 3.97Å; W166-V170 HydrophobicContact CD2-CG1 4.32Å; W166-V170 HydrophobicContact CZ2-CG1 3.9Å; W166-V170 WeakPolarHBondContact O-CG2 3.17Å; W166-V170 PolarHBondContact O-N 3.36Å; H167-V170 PolarHBondContact O-N 3.48Å; H167-V170 VanDerWaalsContact O-N 3.11Å; V170-A172 PolarHBondContact O-N 3.17Å; V170-V173 PolarHBondContact O-N 3.44Å; V170-F174 HydrophobicContact CB-CB 4.2Å; V170-F174 HydrophobicContact CB-CD2 4.17Å; V170-F174 HydrophobicContact CG2-CB 4.05Å; V170-F174 HydrophobicContact CG2-CD2 3.76Å; V170-F174 HydrophobicContact CG2-CG 4.24Å; V170-F174 WeakPolarHBondContact O-CB 3.22Å; V170-F174 PolarHBondContact O-N 3.05Å |
| 171 | Q | 92.5 | Very high | 95.9 | Very high | 80 Ų | 80 | 44.9 Ų | 44.9 | 37% | 0.374 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -49.3 | -35.4 | -171.3 | 58.2 | -176.7 | -33.4 | 0 | 0 | 115.6 | F158 H167 | F158-Q171 HydrophobicContact CZ-CB 4.25Å; H167-Q171 PolarHBondContact CE1-OE1 2.94Å; H167-Q171 VanDerWaalsContact O-CB 3.23Å; H167-Q171 WeakPolarHBondContact O-CB 3.23Å; H167-Q171 WeakPolarHBondContact O-CG 3.2Å; H167-Q171 PolarHBondContact O-N 3.47Å |
| 172 | A | 90.8 | Very high | 95.9 | Very high | 63 Ų | 63 | 44.9 Ų | 44.9 | 52% | 0.521 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | -17.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | V170 H313 | V170-A172 PolarHBondContact O-N 3.17Å; A172-H313 PolarHBondContact O-NE2 3.25Å; A172-H313 VanDerWaalsContact O-NE2 3.11Å |
| 173 | V | 93.8 | Very high | 96 | Very high | 89 Ų | 89 | 48.8 Ų | 48.8 | 54% | 0.539 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -126.3 | -19.4 | -170.3 | -62.5 | 0 | 0 | 0 | 0 | 113.7 | V170 P176 M177 | V170-V173 PolarHBondContact O-N 3.44Å; V173-P176 WeakPolarHBondContact O-CD 3.27Å; V173-M177 WeakPolarHBondContact O-CB 3.4Å; V173-M177 PolarHBondContact O-N 3.13Å |
| 174 | F | 96.4 | Very high | 96.1 | Very high | 1 Ų | 1 | 50.1 Ų | 50.1 | 0% | 0.004 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.1 | -59.2 | -171.3 | -169.9 | -81.8 | 0 | 0 | 0 | 112.7 | A154 F158 V170 M177 A178 L216 P220 | A154-F174 HydrophobicContact CB-CE1 4.1Å; A154-F174 WeakPolarHBondContact O-CE1 3.18Å; F158-F174 HydrophobicContact CB-CD1 3.73Å; F158-F174 HydrophobicContact CB-CE1 3.65Å; F158-F174 HydrophobicContact CB-CZ 4.43Å; F158-F174 HydrophobicContact CD2-CB 3.75Å; F158-F174 AromaticContact CD2-CD1 3.44Å; F158-F174 HydrophobicContact CD2-CD1 3.44Å; F158-F174 VanDerWaalsContact CD2-CD1 3.44Å; F158-F174 HydrophobicContact CD2-CD2 4.21Å; F158-F174 HydrophobicContact CD2-CE1 4.09Å; F158-F174 AromaticContact CD2-CG 3.52Å; F158-F174 HydrophobicContact CD2-CG 3.52Å; F158-F174 HydrophobicContact CE2-CB 3.79Å; F158-F174 HydrophobicContact CE2-CD1 4.33Å; F158-F174 HydrophobicContact CE2-CG 4.08Å; F158-F174 AromaticContact CG-CD1 3.78Å; F158-F174 HydrophobicContact CG-CD1 3.78Å; F158-F174 HydrophobicContact CG-CE1 4.22Å; F158-F174 HydrophobicContact CG-CG 4.32Å; V170-F174 HydrophobicContact CB-CB 4.2Å; V170-F174 HydrophobicContact CB-CD2 4.17Å; V170-F174 HydrophobicContact CG2-CB 4.05Å; V170-F174 HydrophobicContact CG2-CD2 3.76Å; V170-F174 HydrophobicContact CG2-CG 4.24Å; V170-F174 WeakPolarHBondContact O-CB 3.22Å; V170-F174 PolarHBondContact O-N 3.05Å; F174-M177 PolarHBondContact O-N 3.33Å; F174-A178 WeakPolarHBondContact O-CB 3.41Å; F174-A178 PolarHBondContact O-N 3.33Å; F174-L216 HydrophobicContact CD2-CD1 3.86Å; F174-L216 HydrophobicContact CD2-CG 4.35Å; F174-L216 HydrophobicContact CE2-CD1 3.92Å; F174-L216 HydrophobicContact CE2-CG 4.11Å; F174-L216 VanDerWaalsContact CE2-O 3.29Å; F174-L216 WeakPolarHBondContact CE2-O 3.32Å; F174-L216 HydrophobicContact CZ-CG 4.42Å; F174-L216 WeakPolarHBondContact CZ-O 3.39Å; F174-P220 HydrophobicContact CE2-CG 3.73Å; F174-P220 HydrophobicContact CZ-CG 3.67Å |
| 175 | L | 96.5 | Very high | 96.2 | Very high | 10 Ų | 10 | 47.4 Ų | 47.4 | 5% | 0.052 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.6 | -43.2 | -176.7 | -67 | 178.4 | 0 | 0 | 0 | 113.6 | L155 F158 M177 A178 A179 F315 L318 | L155-L175 HydrophobicContact CB-CD2 4.31Å; L155-L175 HydrophobicContact CD1-CD1 4.16Å; L155-L175 HydrophobicContact CD1-CD2 4.01Å; F158-L175 HydrophobicContact CB-CD2 4.19Å; F158-L175 HydrophobicContact CD1-CD1 3.97Å; F158-L175 HydrophobicContact CD1-CD2 4.21Å; F158-L175 HydrophobicContact CD1-CG 3.99Å; F158-L175 HydrophobicContact CE1-CD1 4.13Å; F158-L175 HydrophobicContact CE1-CG 4.33Å; F158-L175 HydrophobicContact CG-CD2 4.25Å; F158-L175 HydrophobicContact CG-CG 4.27Å; L175-M177 VanDerWaalsContact C-N 3.33Å; L175-M177 PolarHBondContact O-N 2.96Å; L175-A178 PolarHBondContact O-N 3.29Å; L175-A179 PolarHBondContact O-N 3.36Å; L175-F315 HydrophobicContact CD1-CB 4.1Å; L175-L318 HydrophobicContact CB-CD1 3.79Å |
| 176 | P | 96.4 | Very high | 96.3 | Very high | 44 Ų | 44 | 45 Ų | 45 | 29% | 0.286 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -59.3 | -41.4 | 173 | -26.1 | 35 | 0 | 0 | 0 | 113.2 | V173 A179 F180 L318 | V173-P176 WeakPolarHBondContact O-CD 3.27Å; P176-A179 PolarHBondContact O-N 2.91Å; P176-F180 PolarHBondContact O-N 2.9Å; P176-L318 HydrophobicContact CG-CD1 4.34Å |
| 177 | M | 97.6 | Very high | 96.3 | Very high | 89 Ų | 89 | 43.9 Ų | 43.9 | 44% | 0.438 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -68.1 | -40.9 | 177.5 | -173.4 | 64.3 | 71.8 | 0 | 0 | 111.4 | V173 F174 L175 A179 F180 L181 L216 | V173-M177 WeakPolarHBondContact O-CB 3.4Å; V173-M177 PolarHBondContact O-N 3.13Å; F174-M177 PolarHBondContact O-N 3.33Å; L175-M177 VanDerWaalsContact C-N 3.33Å; L175-M177 PolarHBondContact O-N 2.96Å; M177-A179 PolarHBondContact O-N 2.81Å; M177-F180 PolarHBondContact O-N 3.19Å; M177-F180 HydrophobicContact SD-CD1 4.17Å; M177-L181 HydrophobicContact CG-CD1 3.85Å; M177-L181 HydrophobicContact CG-CG 4.22Å; M177-L181 WeakPolarHBondContact O-CB 3.47Å; M177-L181 VanDerWaalsContact O-CG 3.31Å; M177-L181 WeakPolarHBondContact O-CG 3.42Å; M177-L181 PolarHBondContact O-N 2.88Å; M177-L181 HydrophobicContact SD-CD1 4.28Å; M177-L181 HydrophobicContact SD-CG 4.17Å; M177-L216 HydrophobicContact CB-CD2 3.77Å; M177-L216 HydrophobicContact CG-CD2 3.59Å |
| 178 | A | 98.1 | Very high | 96.3 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.1 | -44.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | F151 A154 F174 L175 L181 A182 L216 | F151-A178 HydrophobicContact CD2-CB 4.48Å; A154-A178 HydrophobicContact CB-CB 3.57Å; F174-A178 WeakPolarHBondContact O-CB 3.41Å; F174-A178 PolarHBondContact O-N 3.33Å; L175-A178 PolarHBondContact O-N 3.29Å; A178-L181 PolarHBondContact O-N 3.03Å; A178-A182 VanDerWaalsContact O-CB 3.25Å; A178-A182 WeakPolarHBondContact O-CB 3.38Å; A178-A182 PolarHBondContact O-N 3.41Å; A178-L216 HydrophobicContact CB-CD2 4.15Å |
| 179 | A | 98.1 | Very high | 96.3 | Very high | 6 Ų | 6 | 41 Ų | 41 | 5% | 0.05 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.2 | -46.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | F151 L175 P176 M177 A182 W183 L318 T322 | F151-A179 HydrophobicContact CD2-CB 3.79Å; F151-A179 HydrophobicContact CE2-CB 3.77Å; L175-A179 PolarHBondContact O-N 3.36Å; P176-A179 PolarHBondContact O-N 2.91Å; M177-A179 PolarHBondContact O-N 2.81Å; A179-A182 PolarHBondContact O-N 3.29Å; A179-W183 PolarHBondContact O-N 2.83Å; A179-L318 HydrophobicContact CB-CB 4.44Å; A179-L318 HydrophobicContact CB-CD2 4.31Å; A179-T322 WeakPolarHBondContact CB-OG1 3.42Å |
| 180 | F | 98.1 | Very high | 96.3 | Very high | 102 Ų | 102 | 34.1 Ų | 34.1 | 45% | 0.447 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -61.5 | -47.5 | 177.7 | 173.3 | -102.3 | 0 | 0 | 0 | 112 | P176 M177 W183 L184 | P176-F180 PolarHBondContact O-N 2.9Å; M177-F180 PolarHBondContact O-N 3.19Å; M177-F180 HydrophobicContact SD-CD1 4.17Å; F180-W183 HydrophobicContact CD2-CE3 4.04Å; F180-W183 HydrophobicContact CD2-CZ3 4.13Å; F180-W183 HydrophobicContact CE2-CE3 4.13Å; F180-W183 AromaticContact CE2-CZ3 3.8Å; F180-W183 HydrophobicContact CE2-CZ3 3.8Å; F180-W183 PolarHBondContact O-N 2.94Å; F180-L184 HydrophobicContact CE1-CD2 4.11Å; F180-L184 HydrophobicContact CZ-CD2 4.33Å; F180-L184 VanDerWaalsContact O-CB 3.32Å; F180-L184 WeakPolarHBondContact O-CB 3.11Å; F180-L184 PolarHBondContact O-N 3.43Å |
| 181 | L | 98.3 | Very high | 96.2 | Very high | 15 Ų | 15 | 38.8 Ų | 38.8 | 8% | 0.079 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -68.5 | -34.3 | -179.6 | -69.4 | 175.6 | 0 | 0 | 0 | 112.4 | M177 A178 L184 S185 L212 A213 L216 | M177-L181 HydrophobicContact CG-CD1 3.85Å; M177-L181 HydrophobicContact CG-CG 4.22Å; M177-L181 WeakPolarHBondContact O-CB 3.47Å; M177-L181 VanDerWaalsContact O-CG 3.31Å; M177-L181 WeakPolarHBondContact O-CG 3.42Å; M177-L181 PolarHBondContact O-N 2.88Å; M177-L181 HydrophobicContact SD-CD1 4.28Å; M177-L181 HydrophobicContact SD-CG 4.17Å; A178-L181 PolarHBondContact O-N 3.03Å; L181-L184 HydrophobicContact CD2-CD2 4.45Å; L181-L184 PolarHBondContact O-N 2.92Å; L181-S185 WeakPolarHBondContact O-CB 3.3Å; L181-S185 PolarHBondContact O-N 3.41Å; L181-S185 PolarHBondContact O-OG 3.18Å; L181-L212 HydrophobicContact CD2-CB 4.33Å; L181-A213 HydrophobicContact CB-CB 3.81Å; L181-A213 HydrophobicContact CD1-CB 4.49Å; L181-L216 HydrophobicContact CD1-CB 4.37Å; L181-L216 HydrophobicContact CD1-CD2 3.91Å |
| 182 | A | 98.5 | Very high | 96.2 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60.6 | -51.7 | 171 | 0 | 0 | 0 | 0 | 0 | 111.9 | A147 Q150 F151 A178 A179 L184 S185 C186 T322 | A147-A182 HydrophobicContact CB-CB 4.32Å; A147-A182 VanDerWaalsContact CB-O 3.29Å; A147-A182 WeakPolarHBondContact CB-O 3.34Å; Q150-A182 HydrophobicContact CB-CB 4.38Å; Q150-A182 VanDerWaalsContact NE2-CA 3.29Å; F151-A182 HydrophobicContact CB-CB 4.22Å; A178-A182 VanDerWaalsContact O-CB 3.25Å; A178-A182 WeakPolarHBondContact O-CB 3.38Å; A178-A182 PolarHBondContact O-N 3.41Å; A179-A182 PolarHBondContact O-N 3.29Å; A182-L184 VanDerWaalsContact C-N 3.33Å; A182-L184 PolarHBondContact O-N 3.25Å; A182-S185 WeakPolarHBondContact O-CB 3.23Å; A182-S185 PolarHBondContact O-N 2.69Å; A182-C186 PolarHBondContact O-N 3.01Å; A182-T322 HydrophobicContact CB-CG2 3.81Å |
| 183 | W | 98.4 | Very high | 96.3 | Very high | 83 Ų | 83 | 35.3 Ų | 35.3 | 31% | 0.314 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -61 | -41.5 | 175.1 | 166.9 | 65.9 | 0 | 0 | 0 | 112.3 | A179 F180 S185 C186 T187 T329 | A179-W183 PolarHBondContact O-N 2.83Å; F180-W183 HydrophobicContact CD2-CE3 4.04Å; F180-W183 HydrophobicContact CD2-CZ3 4.13Å; F180-W183 HydrophobicContact CE2-CE3 4.13Å; F180-W183 AromaticContact CE2-CZ3 3.8Å; F180-W183 HydrophobicContact CE2-CZ3 3.8Å; F180-W183 PolarHBondContact O-N 2.94Å; W183-S185 VanDerWaalsContact C-N 3.33Å; W183-S185 PolarHBondContact O-N 3.1Å; W183-C186 PolarHBondContact O-N 3.32Å; W183-T187 PolarHBondContact NE1-OG1 3.44Å; W183-T187 VanDerWaalsContact NE1-OG1 3.14Å; W183-T187 WeakPolarHBondContact O-CB 3.29Å; W183-T187 PolarHBondContact O-N 3.27Å; W183-T187 PolarHBondContact O-OG1 3.21Å; W183-T329 PolarHBondContact NE1-OG1 3.47Å |
| 184 | L | 97.7 | Very high | 96.2 | Very high | 57 Ų | 57 | 32.7 Ų | 32.7 | 30% | 0.298 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -64.1 | -38.5 | 178.1 | -173.5 | 63.2 | 0 | 0 | 0 | 111.7 | F180 L181 A182 T187 G188 P209 | F180-L184 HydrophobicContact CE1-CD2 4.11Å; F180-L184 HydrophobicContact CZ-CD2 4.33Å; F180-L184 VanDerWaalsContact O-CB 3.32Å; F180-L184 WeakPolarHBondContact O-CB 3.11Å; F180-L184 PolarHBondContact O-N 3.43Å; L181-L184 HydrophobicContact CD2-CD2 4.45Å; L181-L184 PolarHBondContact O-N 2.92Å; A182-L184 VanDerWaalsContact C-N 3.33Å; A182-L184 PolarHBondContact O-N 3.25Å; L184-T187 PolarHBondContact O-N 3.46Å; L184-G188 PolarHBondContact O-N 2.92Å; L184-P209 HydrophobicContact CB-CB 4.43Å; L184-P209 HydrophobicContact CD2-CB 4.16Å; L184-P209 HydrophobicContact CD2-CG 4.31Å; L184-P209 HydrophobicContact CG-CB 3.94Å; L184-P209 HydrophobicContact CG-CG 4.09Å |
| 185 | S | 96.9 | Very high | 95.9 | Very high | 3 Ų | 3 | 34.9 Ų | 34.9 | 2% | 0.021 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.4 | -45.1 | 175.1 | -59 | 0 | 0 | 0 | 0 | 112 | Q150 L181 A182 W183 S189 P209 S210 | Q150-S185 PolarHBondContact NE2-OG 3.45Å; L181-S185 WeakPolarHBondContact O-CB 3.3Å; L181-S185 PolarHBondContact O-N 3.41Å; L181-S185 PolarHBondContact O-OG 3.18Å; A182-S185 WeakPolarHBondContact O-CB 3.23Å; A182-S185 PolarHBondContact O-N 2.69Å; W183-S185 VanDerWaalsContact C-N 3.33Å; W183-S185 PolarHBondContact O-N 3.1Å; S185-S189 WeakPolarHBondContact O-CB 3.33Å; S185-S189 PolarHBondContact O-N 2.9Å; S185-S189 PolarHBondContact O-OG 3.36Å; S185-P209 VanDerWaalsContact OG-C 3.3Å; S185-P209 PolarHBondContact OG-O 3.1Å; S185-S210 WeakPolarHBondContact OG-CA 3.29Å; S185-S210 PolarHBondContact OG-N 3.2Å |
| 186 | C | 97.9 | Very high | 95.2 | Very high | 2 Ų | 2 | 38.9 Ų | 38.9 | 1% | 0.014 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.9 | -49.2 | 173 | 172.3 | 0 | 0 | 0 | 0 | 111 | A147 A182 W183 G188 S189 C190 | A147-C186 HydrophobicContact CB-CB 3.69Å; A182-C186 PolarHBondContact O-N 3.01Å; W183-C186 PolarHBondContact O-N 3.32Å; C186-G188 PolarHBondContact O-N 3.2Å; C186-S189 PolarHBondContact O-N 3.02Å; C186-C190 WeakPolarHBondContact O-CB 3.45Å; C186-C190 PolarHBondContact O-N 3.15Å; C186-C190 PolarHBondContact O-SG 2.89Å |
| 187 | T | 96.4 | Very high | 93.9 | Very high | 36 Ų | 36 | 42 Ų | 42 | 22% | 0.221 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.3 | -46.7 | -178.9 | -59.4 | 0 | 0 | 0 | 0 | 111.6 | W183 L184 S189 C190 Y191 T329 | W183-T187 PolarHBondContact NE1-OG1 3.44Å; W183-T187 VanDerWaalsContact NE1-OG1 3.14Å; W183-T187 WeakPolarHBondContact O-CB 3.29Å; W183-T187 PolarHBondContact O-N 3.27Å; W183-T187 PolarHBondContact O-OG1 3.21Å; L184-T187 PolarHBondContact O-N 3.46Å; T187-S189 PolarHBondContact O-N 3.17Å; T187-C190 PolarHBondContact O-N 2.9Å; T187-Y191 WeakPolarHBondContact O-CB 3.37Å; T187-Y191 PolarHBondContact O-N 3.47Å; T187-T329 HydrophobicContact CG2-CG2 4.12Å |
| 188 | G | 94.5 | Very high | 92.4 | Very high | 9 Ų | 9 | 43.6 Ų | 43.6 | 9% | 0.093 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.2 | -45.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L184 C186 N192 C205 | L184-G188 PolarHBondContact O-N 2.92Å; C186-G188 PolarHBondContact O-N 3.2Å; G188-N192 WeakPolarHBondContact O-CB 3.42Å; G188-N192 PolarHBondContact O-N 2.98Å; G188-C205 WeakPolarHBondContact CA-O 3.22Å |
| 189 | S | 94.5 | Very high | 90.9 | Very high | 9 Ų | 9 | 46.1 Ų | 46.1 | 6% | 0.063 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65.7 | -47.7 | 178.7 | -58.6 | 0 | 0 | 0 | 0 | 112.5 | Y143 S185 C186 T187 N192 K193 | Y143-S189 WeakPolarHBondContact CE2-O 3.06Å; S185-S189 WeakPolarHBondContact O-CB 3.33Å; S185-S189 PolarHBondContact O-N 2.9Å; S185-S189 PolarHBondContact O-OG 3.36Å; C186-S189 PolarHBondContact O-N 3.02Å; T187-S189 PolarHBondContact O-N 3.17Å; S189-N192 PolarHBondContact O-N 2.61Å; S189-K193 WeakPolarHBondContact O-CB 3.23Å; S189-K193 PolarHBondContact O-N 3.09Å |
| 190 | C | 95.8 | Very high | 89.4 | Confident | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.2 | -45 | 177.1 | -67.8 | 0 | 0 | 0 | 0 | 111.3 | F140 Y143 C186 T187 K193 Y194 L333 | F140-C190 HydrophobicContact CD1-CB 3.78Å; F140-C190 HydrophobicContact CE1-CB 4.06Å; F140-C190 VanDerWaalsContact CE1-O 3.25Å; F140-C190 WeakPolarHBondContact CE1-O 3.22Å; F140-C190 HydrophobicContact CG-CB 4.4Å; Y143-C190 HydrophobicContact CD2-CB 4.4Å; C186-C190 WeakPolarHBondContact O-CB 3.45Å; C186-C190 PolarHBondContact O-N 3.15Å; C186-C190 PolarHBondContact O-SG 2.89Å; T187-C190 PolarHBondContact O-N 2.9Å; C190-K193 PolarHBondContact O-N 3.1Å; C190-Y194 WeakPolarHBondContact O-CB 3.24Å; C190-Y194 PolarHBondContact O-N 3.27Å; C190-L333 HydrophobicContact CB-CD1 3.31Å |
| 191 | Y | 93.8 | Very high | 88 | Confident | 116 Ų | 116 | 52.2 Ų | 52.2 | 46% | 0.455 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -66.7 | -43.2 | 179.5 | -174.1 | -102.3 | 0 | 0 | 0 | 112.1 | T187 K193 Y194 I195 | T187-Y191 WeakPolarHBondContact O-CB 3.37Å; T187-Y191 PolarHBondContact O-N 3.47Å; Y191-K193 VanDerWaalsContact C-N 3.32Å; Y191-K193 PolarHBondContact O-N 2.91Å; Y191-Y194 PolarHBondContact O-N 3.37Å; Y191-I195 HydrophobicContact CD1-CG1 4.13Å; Y191-I195 HydrophobicContact CD2-CG1 4.19Å; Y191-I195 HydrophobicContact CE1-CG1 3.69Å; Y191-I195 HydrophobicContact CE2-CD1 4.11Å; Y191-I195 HydrophobicContact CE2-CG1 3.75Å; Y191-I195 HydrophobicContact CG-CG1 4.37Å; Y191-I195 VanDerWaalsContact CZ-CG1 3.48Å; Y191-I195 WeakPolarHBondContact O-CB 3.18Å; Y191-I195 WeakPolarHBondContact O-CG1 3.38Å; Y191-I195 PolarHBondContact O-N 2.88Å |
| 192 | N | 91.8 | Very high | 86.6 | Confident | 28 Ų | 28 | 51.7 Ų | 51.7 | 15% | 0.15 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -58.2 | -46.4 | 175.1 | -177.4 | 43.9 | 0 | 0 | 0 | 110.9 | G188 S189 Y194 I195 Q196 G202 Q206 | G188-N192 WeakPolarHBondContact O-CB 3.42Å; G188-N192 PolarHBondContact O-N 2.98Å; S189-N192 PolarHBondContact O-N 2.61Å; N192-Y194 PolarHBondContact O-N 2.94Å; N192-I195 PolarHBondContact O-N 3.45Å; N192-Q196 WeakPolarHBondContact O-CA 3.37Å; N192-Q196 PolarHBondContact O-N 2.93Å; N192-G202 VanDerWaalsContact CG-O 3.27Å; N192-G202 WeakPolarHBondContact OD1-CA 3.37Å; N192-G202 PolarHBondContact OD1-O 3.48Å; N192-Q206 HydrophobicContact CB-CB 4.34Å; N192-Q206 PolarHBondContact ND2-OE1 3.01Å |
| 193 | K | 92.6 | Very high | 85.4 | Confident | 43 Ų | 43 | 58.6 Ų | 58.6 | 19% | 0.187 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.1 | -39.6 | 176.9 | -175.8 | 75.9 | 175.8 | -168.7 | 0 | 112.1 | H135 Y136 F140 Y143 S189 C190 Y191 Q196 | H135-K193 WeakPolarHBondContact NE2-CE 3.23Å; H135-K193 PolarHBondContact NE2-NZ 3.33Å; Y136-K193 HydrophobicContact CD1-CG 4.11Å; Y136-K193 HydrophobicContact CE1-CG 4.47Å; Y136-K193 WeakPolarHBondContact CE1-O 3.48Å; F140-K193 HydrophobicContact CE1-CB 4.01Å; F140-K193 HydrophobicContact CE1-CG 4.05Å; Y143-K193 HydrophobicContact CE2-CB 3.83Å; Y143-K193 HydrophobicContact CE2-CG 4.26Å; S189-K193 WeakPolarHBondContact O-CB 3.23Å; S189-K193 PolarHBondContact O-N 3.09Å; C190-K193 PolarHBondContact O-N 3.1Å; Y191-K193 VanDerWaalsContact C-N 3.32Å; Y191-K193 PolarHBondContact O-N 2.91Å; K193-Q196 WeakPolarHBondContact O-CG 3.31Å |
| 194 | Y | 92.9 | Very high | 84.4 | Confident | 33 Ų | 33 | 57.1 Ų | 57.1 | 13% | 0.129 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 177.4 | 170.3 | -114.3 | 0 | 0 | 0 | 113.5 | C190 Y191 N192 L333 L336 V337 R340 | C190-Y194 WeakPolarHBondContact O-CB 3.24Å; C190-Y194 PolarHBondContact O-N 3.27Å; Y191-Y194 PolarHBondContact O-N 3.37Å; N192-Y194 PolarHBondContact O-N 2.94Å; Y194-L333 HydrophobicContact CD1-CD2 3.96Å; Y194-L333 HydrophobicContact CG-CD2 4.04Å; Y194-L336 HydrophobicContact CE2-CB 4.04Å; Y194-V337 HydrophobicContact CD2-CG2 3.63Å; Y194-V337 HydrophobicContact CE2-CG2 4.06Å; Y194-R340 VanDerWaalsContact CE2-NH2 3.33Å; Y194-R340 PolarHBondContact O-NH1 2.85Å; Y194-R340 PolarHBondContact OH-NH2 3.17Å; Y194-R340 VanDerWaalsContact OH-NH2 3.08Å |
| 195 | I | 89.1 | Confident | 83.3 | Confident | 48 Ų | 48 | 57 Ų | 57 | 25% | 0.246 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -81.6 | -31 | -177.1 | -68.2 | -63.6 | 0 | 0 | 0 | 111.9 | Y191 N192 K197 | Y191-I195 HydrophobicContact CD1-CG1 4.13Å; Y191-I195 HydrophobicContact CD2-CG1 4.19Å; Y191-I195 HydrophobicContact CE1-CG1 3.69Å; Y191-I195 HydrophobicContact CE2-CD1 4.11Å; Y191-I195 HydrophobicContact CE2-CG1 3.75Å; Y191-I195 HydrophobicContact CG-CG1 4.37Å; Y191-I195 VanDerWaalsContact CZ-CG1 3.48Å; Y191-I195 WeakPolarHBondContact O-CB 3.18Å; Y191-I195 WeakPolarHBondContact O-CG1 3.38Å; Y191-I195 PolarHBondContact O-N 2.88Å; N192-I195 PolarHBondContact O-N 3.45Å; I195-K197 HydrophobicContact CG2-CB 3.77Å; I195-K197 HydrophobicContact CG2-CD 3.76Å; I195-K197 HydrophobicContact CG2-CG 3.43Å; I195-K197 VanDerWaalsContact CG2-CG 3.43Å; I195-K197 PolarHBondContact O-N 3.48Å |
| 196 | Q | 81.1 | Confident | 82.6 | Confident | 93 Ų | 93 | 58.1 Ų | 58.1 | 44% | 0.435 | 31% | 0.307 | S | S | . | . | trans | 53.5 | 36.6 | -175.9 | -54.9 | -166.3 | -12.1 | 0 | 0 | 113.3 | Y136 N192 K193 P198 | Y136-Q196 PolarHBondContact OH-NE2 3.34Å; N192-Q196 WeakPolarHBondContact O-CA 3.37Å; N192-Q196 PolarHBondContact O-N 2.93Å; K193-Q196 WeakPolarHBondContact O-CG 3.31Å; Q196-P198 VanDerWaalsContact O-CD 3.27Å; Q196-P198 WeakPolarHBondContact O-CD 3.2Å | ||
| 197 | K | 70.7 | Confident | 82 | Confident | 111 Ų | 111 | 60.7 Ų | 60.7 | 48% | 0.483 | 32% | 0.318 | S | S | . | . | trans | -66 | 118.7 | -177.2 | -108.8 | 177.7 | -165.2 | -165.8 | 0 | 109.1 | I195 L201 | I195-K197 HydrophobicContact CG2-CB 3.77Å; I195-K197 HydrophobicContact CG2-CD 3.76Å; I195-K197 HydrophobicContact CG2-CG 3.43Å; I195-K197 VanDerWaalsContact CG2-CG 3.43Å; I195-K197 PolarHBondContact O-N 3.48Å; K197-L201 HydrophobicContact CD-CD2 4.13Å | ||
| 198 | P | 65.6 | Low | 81.8 | Confident | 122 Ų | 122 | 62.5 Ų | 62.5 | 79% | 0.792 | 33% | 0.329 | S | S | * | . | trans | -69 | 151.3 | 177.8 | 27.8 | -32.4 | 0 | 0 | 0 | 110.6 | Q196 | Q196-P198 VanDerWaalsContact O-CD 3.27Å; Q196-P198 WeakPolarHBondContact O-CD 3.2Å | ||
| 199 | G | 67.1 | Low | 81.7 | Confident | 52 Ų | 52 | 62.8 Ų | 62.8 | 54% | 0.536 | 33% | 0.329 | S | S | . | . | S | Bend | trans | 90.4 | -163.6 | 171 | 0 | 0 | 0 | 0 | 0 | 115.4 | L201 | G199-L201 VanDerWaalsContact C-N 3.3Å; G199-L201 PolarHBondContact O-N 3.09Å |
| 200 | L | 66.8 | Low | 81.6 | Confident | 136 Ų | 136 | 64 Ų | 64 | 71% | 0.712 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -62.7 | -34.6 | -169 | -173.3 | 63.4 | 0 | 0 | 0 | 112.9 | G202 R203 T204 | L200-G202 PolarHBondContact O-N 3.43Å; L200-R203 PolarHBondContact O-N 3.35Å; L200-T204 HydrophobicContact CD1-CG2 4.32Å; L200-T204 HydrophobicContact CG-CG2 4.16Å; L200-T204 WeakPolarHBondContact O-CG2 3.4Å; L200-T204 PolarHBondContact O-N 3.01Å; L200-T204 PolarHBondContact O-OG1 3.3Å |
| 201 | L | 67.4 | Low | 81.6 | Confident | 101 Ų | 101 | 66.8 Ų | 66.8 | 53% | 0.529 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.6 | -42.3 | -174.6 | -167.7 | 70.2 | 0 | 0 | 0 | 112.7 | K197 G199 T204 C205 | K197-L201 HydrophobicContact CD-CD2 4.13Å; G199-L201 VanDerWaalsContact C-N 3.3Å; G199-L201 PolarHBondContact O-N 3.09Å; L201-T204 WeakPolarHBondContact CA-OG1 3.42Å; L201-T204 PolarHBondContact O-N 3.49Å; L201-T204 PolarHBondContact O-OG1 2.93Å; L201-C205 PolarHBondContact O-N 3.2Å; L201-C205 VanDerWaalsContact O-N 3.12Å; L201-C205 PolarHBondContact O-SG 3.44Å; L201-C205 VanDerWaalsContact O-SG 3.4Å |
| 202 | G | 69.3 | Low | 81.8 | Confident | 4 Ų | 4 | 66 Ų | 66 | 4% | 0.041 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.9 | -42.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | N192 L200 C205 Q206 | N192-G202 VanDerWaalsContact CG-O 3.27Å; N192-G202 WeakPolarHBondContact OD1-CA 3.37Å; N192-G202 PolarHBondContact OD1-O 3.48Å; L200-G202 PolarHBondContact O-N 3.43Å; G202-C205 PolarHBondContact O-N 2.95Å; G202-Q206 PolarHBondContact O-N 3.41Å |
| 203 | R | 72.3 | Confident | 82 | Confident | 144 Ų | 144 | 64.7 Ų | 64.7 | 54% | 0.543 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 173.9 | -71.3 | -172.6 | -175.1 | 176.1 | -3 | 112.1 | L200 C205 Q206 E207 | L200-R203 PolarHBondContact O-N 3.35Å; R203-C205 VanDerWaalsContact C-N 3.34Å; R203-C205 PolarHBondContact O-N 3.25Å; R203-Q206 PolarHBondContact O-N 2.99Å; R203-E207 WeakPolarHBondContact CB-OE1 3.29Å; R203-E207 VanDerWaalsContact O-CB 3.3Å; R203-E207 WeakPolarHBondContact O-CB 3.3Å; R203-E207 WeakPolarHBondContact O-CG 3.47Å; R203-E207 PolarHBondContact O-N 3.19Å |
| 204 | T | 77.3 | Confident | 82.2 | Confident | 53 Ų | 53 | 64.6 Ų | 64.6 | 33% | 0.325 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.9 | -37.4 | 178.4 | 50.7 | 0 | 0 | 0 | 0 | 112.9 | L200 L201 Q206 V208 | L200-T204 HydrophobicContact CD1-CG2 4.32Å; L200-T204 HydrophobicContact CG-CG2 4.16Å; L200-T204 WeakPolarHBondContact O-CG2 3.4Å; L200-T204 PolarHBondContact O-N 3.01Å; L200-T204 PolarHBondContact O-OG1 3.3Å; L201-T204 WeakPolarHBondContact CA-OG1 3.42Å; L201-T204 PolarHBondContact O-N 3.49Å; L201-T204 PolarHBondContact O-OG1 2.93Å; T204-Q206 VanDerWaalsContact C-N 3.27Å; T204-Q206 PolarHBondContact O-N 2.98Å; T204-V208 VanDerWaalsContact O-CB 3.27Å; T204-V208 WeakPolarHBondContact O-CB 3.49Å; T204-V208 VanDerWaalsContact O-CG2 3.32Å; T204-V208 WeakPolarHBondContact O-CG2 3.49Å; T204-V208 PolarHBondContact O-N 3.12Å |
| 205 | C | 75.8 | Confident | 82.5 | Confident | 53 Ų | 53 | 65.9 Ų | 65.9 | 36% | 0.358 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.4 | -29.1 | 177.7 | -72.2 | 0 | 0 | 0 | 0 | 113.1 | G188 L201 G202 R203 P209 | G188-C205 WeakPolarHBondContact CA-O 3.22Å; L201-C205 PolarHBondContact O-N 3.2Å; L201-C205 VanDerWaalsContact O-N 3.12Å; L201-C205 PolarHBondContact O-SG 3.44Å; L201-C205 VanDerWaalsContact O-SG 3.4Å; G202-C205 PolarHBondContact O-N 2.95Å; R203-C205 VanDerWaalsContact C-N 3.34Å; R203-C205 PolarHBondContact O-N 3.25Å; C205-P209 WeakPolarHBondContact O-CD 3.41Å; C205-P209 WeakPolarHBondContact O-CG 3.38Å |
| 206 | Q | 81.4 | Confident | 82.9 | Confident | 28 Ų | 28 | 65.5 Ų | 65.5 | 13% | 0.131 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -91 | -50.2 | 179.7 | 176.1 | 168.7 | 3.3 | 0 | 0 | 112.1 | N192 G202 R203 T204 S210 | N192-Q206 HydrophobicContact CB-CB 4.34Å; N192-Q206 PolarHBondContact ND2-OE1 3.01Å; G202-Q206 PolarHBondContact O-N 3.41Å; R203-Q206 PolarHBondContact O-N 2.99Å; T204-Q206 VanDerWaalsContact C-N 3.27Å; T204-Q206 PolarHBondContact O-N 2.98Å; Q206-S210 PolarHBondContact O-OG 3.23Å |
| 207 | E | 86.3 | Confident | 83.7 | Confident | 55 Ų | 55 | 61.2 Ų | 61.2 | 26% | 0.257 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -79.4 | -34.2 | -168.6 | -64.5 | 178.5 | -138.8 | 0 | 0 | 112.7 | R203 S210 A211 F255 S256 | R203-E207 WeakPolarHBondContact CB-OE1 3.29Å; R203-E207 VanDerWaalsContact O-CB 3.3Å; R203-E207 WeakPolarHBondContact O-CB 3.3Å; R203-E207 WeakPolarHBondContact O-CG 3.47Å; R203-E207 PolarHBondContact O-N 3.19Å; E207-S210 PolarHBondContact O-N 2.67Å; E207-A211 VanDerWaalsContact O-CB 3.27Å; E207-A211 WeakPolarHBondContact O-CB 3.38Å; E207-A211 PolarHBondContact O-N 2.82Å; E207-F255 HydrophobicContact CG-CE1 4.36Å; E207-S256 PolarHBondContact OE2-OG 3.24Å |
| 208 | V | 91.3 | Very high | 85 | Confident | 74 Ų | 74 | 56.5 Ų | 56.5 | 45% | 0.448 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -66.4 | -49.6 | -176.5 | 175 | 0 | 0 | 0 | 0 | 112.1 | T204 S210 A211 L212 | T204-V208 VanDerWaalsContact O-CB 3.27Å; T204-V208 WeakPolarHBondContact O-CB 3.49Å; T204-V208 VanDerWaalsContact O-CG2 3.32Å; T204-V208 WeakPolarHBondContact O-CG2 3.49Å; T204-V208 PolarHBondContact O-N 3.12Å; V208-S210 VanDerWaalsContact C-N 3.32Å; V208-S210 PolarHBondContact O-N 2.7Å; V208-A211 PolarHBondContact O-N 3.43Å; V208-L212 HydrophobicContact CG1-CD1 4.02Å; V208-L212 HydrophobicContact CG1-CG 4.35Å; V208-L212 WeakPolarHBondContact O-CG 3.43Å; V208-L212 PolarHBondContact O-N 3.46Å |
| 209 | P | 93.1 | Very high | 86.6 | Confident | 15 Ų | 15 | 51.6 Ų | 51.6 | 10% | 0.097 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.7 | -42.5 | 176.4 | -25.9 | 36.7 | 0 | 0 | 0 | 112.8 | L184 S185 C205 L212 A213 | L184-P209 HydrophobicContact CB-CB 4.43Å; L184-P209 HydrophobicContact CD2-CB 4.16Å; L184-P209 HydrophobicContact CD2-CG 4.31Å; L184-P209 HydrophobicContact CG-CB 3.94Å; L184-P209 HydrophobicContact CG-CG 4.09Å; S185-P209 VanDerWaalsContact OG-C 3.3Å; S185-P209 PolarHBondContact OG-O 3.1Å; C205-P209 WeakPolarHBondContact O-CD 3.41Å; C205-P209 WeakPolarHBondContact O-CG 3.38Å; P209-L212 PolarHBondContact O-N 2.87Å; P209-A213 WeakPolarHBondContact O-CB 3.33Å; P209-A213 PolarHBondContact O-N 3.34Å |
| 210 | S | 93.2 | Very high | 88 | Confident | 35 Ų | 35 | 49.1 Ų | 49.1 | 25% | 0.245 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.9 | -38.7 | 178.3 | -65.3 | 0 | 0 | 0 | 0 | 112.6 | S185 Q206 E207 V208 A213 Y214 | S185-S210 WeakPolarHBondContact OG-CA 3.29Å; S185-S210 PolarHBondContact OG-N 3.2Å; Q206-S210 PolarHBondContact O-OG 3.23Å; E207-S210 PolarHBondContact O-N 2.67Å; V208-S210 VanDerWaalsContact C-N 3.32Å; V208-S210 PolarHBondContact O-N 2.7Å; S210-A213 PolarHBondContact O-N 2.81Å; S210-Y214 WeakPolarHBondContact O-CB 3.41Å; S210-Y214 PolarHBondContact O-N 3.26Å |
| 211 | A | 95.1 | Very high | 89.5 | Confident | 59 Ų | 59 | 42.7 Ų | 42.7 | 49% | 0.488 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -66.8 | -42.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | E207 V208 A213 Y214 A215 | E207-A211 VanDerWaalsContact O-CB 3.27Å; E207-A211 WeakPolarHBondContact O-CB 3.38Å; E207-A211 PolarHBondContact O-N 2.82Å; V208-A211 PolarHBondContact O-N 3.43Å; A211-A213 VanDerWaalsContact C-N 3.33Å; A211-Y214 PolarHBondContact O-N 3.05Å; A211-A215 WeakPolarHBondContact O-CB 3.31Å; A211-A215 PolarHBondContact O-N 2.86Å |
| 212 | L | 97 | Very high | 90.9 | Very high | 99 Ų | 99 | 40.1 Ų | 40.1 | 52% | 0.518 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -63.3 | -41.4 | 175.2 | -70.9 | 175.2 | 0 | 0 | 0 | 111.6 | L181 V208 P209 A215 L216 | L181-L212 HydrophobicContact CD2-CB 4.33Å; V208-L212 HydrophobicContact CG1-CD1 4.02Å; V208-L212 HydrophobicContact CG1-CG 4.35Å; V208-L212 WeakPolarHBondContact O-CG 3.43Å; V208-L212 PolarHBondContact O-N 3.46Å; P209-L212 PolarHBondContact O-N 2.87Å; L212-A215 PolarHBondContact O-N 2.87Å; L212-L216 PolarHBondContact O-N 3.43Å; L212-L216 VanDerWaalsContact O-N 3.1Å |
| 213 | A | 96.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63 | -49.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q150 L181 P209 S210 A211 A215 L216 D217 | Q150-A213 VanDerWaalsContact CD-CB 3.45Å; Q150-A213 HydrophobicContact CG-CB 4.15Å; L181-A213 HydrophobicContact CB-CB 3.81Å; L181-A213 HydrophobicContact CD1-CB 4.49Å; P209-A213 WeakPolarHBondContact O-CB 3.33Å; P209-A213 PolarHBondContact O-N 3.34Å; S210-A213 PolarHBondContact O-N 2.81Å; A211-A213 VanDerWaalsContact C-N 3.33Å; A213-A215 VanDerWaalsContact C-N 3.29Å; A213-A215 PolarHBondContact O-N 3.46Å; A213-L216 WeakPolarHBondContact O-CB 3.4Å; A213-L216 PolarHBondContact O-N 2.86Å; A213-L216 VanDerWaalsContact O-N 3.12Å; A213-D217 WeakPolarHBondContact O-CB 3.44Å; A213-D217 PolarHBondContact O-N 3.39Å |
| 214 | Y | 97.1 | Very high | 93.3 | Very high | 42 Ų | 42 | 34.5 Ų | 34.5 | 17% | 0.165 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -57.4 | -44.1 | 176.9 | 177.5 | -104.7 | 0 | 0 | 0 | 111.9 | S210 A211 L216 D217 I218 F248 | S210-Y214 WeakPolarHBondContact O-CB 3.41Å; S210-Y214 PolarHBondContact O-N 3.26Å; A211-Y214 PolarHBondContact O-N 3.05Å; Y214-L216 VanDerWaalsContact C-N 3.29Å; Y214-L216 PolarHBondContact O-N 3.31Å; Y214-D217 PolarHBondContact O-N 2.95Å; Y214-I218 HydrophobicContact CD1-CG2 4.29Å; Y214-I218 HydrophobicContact CD2-CB 4.44Å; Y214-I218 HydrophobicContact CE1-CB 4.37Å; Y214-I218 HydrophobicContact CE1-CG2 3.94Å; Y214-I218 HydrophobicContact CE2-CB 4.01Å; Y214-I218 HydrophobicContact CE2-CD1 4.29Å; Y214-I218 HydrophobicContact CE2-CG1 4.14Å; Y214-I218 HydrophobicContact CE2-CG2 4.47Å; Y214-I218 WeakPolarHBondContact O-CB 3.46Å; Y214-I218 WeakPolarHBondContact O-CG2 3.43Å; Y214-I218 PolarHBondContact O-N 3.14Å; Y214-F248 AromaticContact CD1-CD1 3.83Å; Y214-F248 HydrophobicContact CD1-CD1 3.83Å; Y214-F248 AromaticContact CD1-CE1 3.38Å; Y214-F248 HydrophobicContact CD1-CE1 3.38Å; Y214-F248 HydrophobicContact CD1-CZ 4.04Å; Y214-F248 AromaticContact CD2-CD1 3.64Å; Y214-F248 HydrophobicContact CD2-CD1 3.64Å; Y214-F248 AromaticContact CD2-CD2 3.84Å; Y214-F248 HydrophobicContact CD2-CD2 3.84Å; Y214-F248 AromaticContact CD2-CE1 3.35Å; Y214-F248 HydrophobicContact CD2-CE1 3.35Å; Y214-F248 AromaticContact CD2-CE2 3.56Å; Y214-F248 HydrophobicContact CD2-CE2 3.56Å; Y214-F248 AromaticContact CD2-CG 3.87Å; Y214-F248 HydrophobicContact CD2-CG 3.87Å; Y214-F248 AromaticContact CD2-CZ 3.3Å; Y214-F248 HydrophobicContact CD2-CZ 3.3Å; Y214-F248 AromaticContact CE1-CD1 3.44Å; Y214-F248 HydrophobicContact CE1-CD1 3.44Å; Y214-F248 VanDerWaalsContact CE1-CD1 3.44Å; Y214-F248 AromaticContact CE1-CE1 3.54Å; Y214-F248 HydrophobicContact CE1-CE1 3.54Å; Y214-F248 HydrophobicContact CE1-CG 4.32Å; Y214-F248 HydrophobicContact CE1-CZ 4.47Å; Y214-F248 HydrophobicContact CE2-CB 3.97Å; Y214-F248 AromaticContact CE2-CD1 3.23Å; Y214-F248 HydrophobicContact CE2-CD1 3.23Å; Y214-F248 AromaticContact CE2-CD2 3.63Å; Y214-F248 HydrophobicContact CE2-CD2 3.63Å; Y214-F248 AromaticContact CE2-CE1 3.51Å; Y214-F248 HydrophobicContact CE2-CE1 3.51Å; Y214-F248 AromaticContact CE2-CE2 3.87Å; Y214-F248 HydrophobicContact CE2-CE2 3.87Å; Y214-F248 AromaticContact CE2-CG 3.29Å; Y214-F248 HydrophobicContact CE2-CG 3.29Å; Y214-F248 AromaticContact CE2-CZ 3.81Å; Y214-F248 HydrophobicContact CE2-CZ 3.81Å; Y214-F248 AromaticContact CG-CD1 3.9Å; Y214-F248 HydrophobicContact CG-CD1 3.9Å; Y214-F248 AromaticContact CG-CE1 3.27Å; Y214-F248 HydrophobicContact CG-CE1 3.27Å; Y214-F248 HydrophobicContact CG-CE2 4.17Å; Y214-F248 AromaticContact CG-CZ 3.42Å; Y214-F248 HydrophobicContact CG-CZ 3.42Å; Y214-F248 VanDerWaalsContact CG-CZ 3.42Å; Y214-F248 AromaticContact CZ-CD1 3.11Å; Y214-F248 AromaticContact CZ-CE1 3.59Å; Y214-F248 AromaticContact CZ-CG 3.55Å |
| 215 | A | 98 | Very high | 94 | Very high | 60 Ų | 60 | 34.1 Ų | 34.1 | 50% | 0.496 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -59.5 | -39.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A211 L212 A213 | A211-A215 WeakPolarHBondContact O-CB 3.31Å; A211-A215 PolarHBondContact O-N 2.86Å; L212-A215 PolarHBondContact O-N 2.87Å; A213-A215 VanDerWaalsContact C-N 3.29Å; A213-A215 PolarHBondContact O-N 3.46Å |
| 216 | L | 98.2 | Very high | 94.8 | Very high | 39 Ų | 39 | 39 Ų | 39 | 20% | 0.204 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -68 | -53.9 | 172.9 | 178.8 | 67.9 | 0 | 0 | 0 | 111.1 | F174 M177 A178 L181 L212 A213 Y214 I218 S219 | F174-L216 HydrophobicContact CD2-CD1 3.86Å; F174-L216 HydrophobicContact CD2-CG 4.35Å; F174-L216 HydrophobicContact CE2-CD1 3.92Å; F174-L216 HydrophobicContact CE2-CG 4.11Å; F174-L216 VanDerWaalsContact CE2-O 3.29Å; F174-L216 WeakPolarHBondContact CE2-O 3.32Å; F174-L216 HydrophobicContact CZ-CG 4.42Å; F174-L216 WeakPolarHBondContact CZ-O 3.39Å; M177-L216 HydrophobicContact CB-CD2 3.77Å; M177-L216 HydrophobicContact CG-CD2 3.59Å; A178-L216 HydrophobicContact CB-CD2 4.15Å; L181-L216 HydrophobicContact CD1-CB 4.37Å; L181-L216 HydrophobicContact CD1-CD2 3.91Å; L212-L216 PolarHBondContact O-N 3.43Å; L212-L216 VanDerWaalsContact O-N 3.1Å; A213-L216 WeakPolarHBondContact O-CB 3.4Å; A213-L216 PolarHBondContact O-N 2.86Å; A213-L216 VanDerWaalsContact O-N 3.12Å; Y214-L216 VanDerWaalsContact C-N 3.29Å; Y214-L216 PolarHBondContact O-N 3.31Å; L216-I218 VanDerWaalsContact C-N 3.32Å; L216-I218 PolarHBondContact O-N 2.86Å; L216-S219 VanDerWaalsContact O-CB 3.3Å; L216-S219 WeakPolarHBondContact O-CB 3.36Å; L216-S219 PolarHBondContact O-N 3.23Å; L216-S219 VanDerWaalsContact O-N 3.09Å; L216-S219 PolarHBondContact O-OG 3.03Å |
| 217 | D | 97.9 | Very high | 95.2 | Very high | 4 Ų | 4 | 41.5 Ų | 41.5 | 2% | 0.021 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.2 | -36.2 | -170.6 | -63.7 | -8 | 0 | 0 | 0 | 112.4 | Q150 A154 H157 A213 Y214 P220 | Q150-D217 WeakPolarHBondContact CG-OD2 3.5Å; A154-D217 HydrophobicContact CB-CB 4.09Å; A154-D217 WeakPolarHBondContact CB-OD1 3.46Å; H157-D217 PolarHBondContact ND1-O 2.87Å; A213-D217 WeakPolarHBondContact O-CB 3.44Å; A213-D217 PolarHBondContact O-N 3.39Å; Y214-D217 PolarHBondContact O-N 2.95Å; D217-P220 WeakPolarHBondContact O-CD 3.49Å |
| 218 | I | 98.1 | Very high | 94.8 | Very high | 11 Ų | 11 | 41.1 Ų | 41.1 | 6% | 0.056 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | -11.8 | 179.4 | -154 | 62.7 | 0 | 0 | 0 | 113 | Y214 L216 P220 V221 V222 V245 | Y214-I218 HydrophobicContact CD1-CG2 4.29Å; Y214-I218 HydrophobicContact CD2-CB 4.44Å; Y214-I218 HydrophobicContact CE1-CB 4.37Å; Y214-I218 HydrophobicContact CE1-CG2 3.94Å; Y214-I218 HydrophobicContact CE2-CB 4.01Å; Y214-I218 HydrophobicContact CE2-CD1 4.29Å; Y214-I218 HydrophobicContact CE2-CG1 4.14Å; Y214-I218 HydrophobicContact CE2-CG2 4.47Å; Y214-I218 WeakPolarHBondContact O-CB 3.46Å; Y214-I218 WeakPolarHBondContact O-CG2 3.43Å; Y214-I218 PolarHBondContact O-N 3.14Å; L216-I218 VanDerWaalsContact C-N 3.32Å; L216-I218 PolarHBondContact O-N 2.86Å; I218-P220 VanDerWaalsContact C-CD 3.41Å; I218-V221 HydrophobicContact CD1-CB 4.06Å; I218-V221 HydrophobicContact CD1-CG1 4.28Å; I218-V221 HydrophobicContact CD1-CG2 4.33Å; I218-V221 HydrophobicContact CG1-CB 4.43Å; I218-V221 WeakPolarHBondContact O-CB 3.4Å; I218-V221 PolarHBondContact O-N 2.75Å; I218-V221 VanDerWaalsContact O-N 3.1Å; I218-V222 HydrophobicContact CG1-CG2 4.07Å; I218-V222 HydrophobicContact CG2-CG2 3.98Å; I218-V222 PolarHBondContact O-N 2.92Å; I218-V245 HydrophobicContact CD1-CG2 3.92Å; I218-V245 HydrophobicContact CG1-CG2 3.88Å |
| 219 | S | 98.3 | Very high | 93.4 | Very high | 20 Ų | 20 | 42 Ų | 42 | 14% | 0.14 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -57.5 | -37.1 | -175.3 | 69.3 | 0 | 0 | 0 | 0 | 115 | W166 L216 V221 H223 | W166-S219 PolarHBondContact NE1-OG 3.38Å; L216-S219 VanDerWaalsContact O-CB 3.3Å; L216-S219 WeakPolarHBondContact O-CB 3.36Å; L216-S219 PolarHBondContact O-N 3.23Å; L216-S219 VanDerWaalsContact O-N 3.09Å; L216-S219 PolarHBondContact O-OG 3.03Å; S219-V221 VanDerWaalsContact C-N 3.35Å; S219-V221 PolarHBondContact O-N 3.14Å; S219-H223 VanDerWaalsContact O-CB 3.23Å; S219-H223 WeakPolarHBondContact O-CB 3.41Å; S219-H223 PolarHBondContact O-N 3.25Å |
| 220 | P | 97.9 | Very high | 92 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 175 | -21.8 | 35.6 | 0 | 0 | 0 | 112.1 | H157 I162 F174 D217 I218 R224 | H157-P220 HydrophobicContact CB-CB 4.27Å; H157-P220 HydrophobicContact CB-CG 4.11Å; I162-P220 HydrophobicContact CB-CB 4.04Å; I162-P220 HydrophobicContact CD1-CB 4.39Å; I162-P220 HydrophobicContact CD1-CG 4.36Å; I162-P220 HydrophobicContact CG1-CB 4Å; F174-P220 HydrophobicContact CE2-CG 3.73Å; F174-P220 HydrophobicContact CZ-CG 3.67Å; D217-P220 WeakPolarHBondContact O-CD 3.49Å; I218-P220 VanDerWaalsContact C-CD 3.41Å; P220-R224 WeakPolarHBondContact O-CB 3.33Å; P220-R224 PolarHBondContact O-N 3.16Å |
| 221 | V | 97.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.6 | -48.7 | 179.7 | 173.5 | 0 | 0 | 0 | 0 | 110.9 | H157 A161 I218 S219 H223 R224 I225 H241 | H157-V221 HydrophobicContact CB-CG2 4.22Å; H157-V221 VanDerWaalsContact CD2-CG2 3.48Å; H157-V221 WeakPolarHBondContact CD2-CG2 3.24Å; A161-V221 HydrophobicContact CB-CG2 4.08Å; I218-V221 HydrophobicContact CD1-CB 4.06Å; I218-V221 HydrophobicContact CD1-CG1 4.28Å; I218-V221 HydrophobicContact CD1-CG2 4.33Å; I218-V221 HydrophobicContact CG1-CB 4.43Å; I218-V221 WeakPolarHBondContact O-CB 3.4Å; I218-V221 PolarHBondContact O-N 2.75Å; I218-V221 VanDerWaalsContact O-N 3.1Å; S219-V221 VanDerWaalsContact C-N 3.35Å; S219-V221 PolarHBondContact O-N 3.14Å; V221-H223 VanDerWaalsContact C-N 3.34Å; V221-H223 PolarHBondContact O-N 3.32Å; V221-R224 PolarHBondContact O-N 3.42Å; V221-I225 HydrophobicContact CG1-CD1 3.87Å; V221-I225 HydrophobicContact CG1-CG1 4.49Å; V221-I225 WeakPolarHBondContact O-CG1 3.47Å; V221-I225 PolarHBondContact O-N 3.26Å; V221-H241 HydrophobicContact CG1-CB 3.57Å |
| 222 | V | 96.9 | Very high | 88.7 | Confident | 48 Ų | 48 | 51.7 Ų | 51.7 | 29% | 0.291 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.9 | -46.1 | 178 | 170.5 | 0 | 0 | 0 | 0 | 110.7 | I218 R224 I225 F226 | I218-V222 HydrophobicContact CG1-CG2 4.07Å; I218-V222 HydrophobicContact CG2-CG2 3.98Å; I218-V222 PolarHBondContact O-N 2.92Å; V222-R224 VanDerWaalsContact C-N 3.35Å; V222-R224 PolarHBondContact O-N 2.99Å; V222-I225 PolarHBondContact O-N 3.2Å; V222-F226 HydrophobicContact CG1-CD2 3.74Å; V222-F226 HydrophobicContact CG1-CE2 3.46Å; V222-F226 VanDerWaalsContact CG1-CE2 3.46Å; V222-F226 WeakPolarHBondContact O-CD2 3.4Å; V222-F226 PolarHBondContact O-N 3.38Å; V222-F226 VanDerWaalsContact O-N 3.15Å |
| 223 | H | 96.5 | Very high | 87.3 | Confident | 29 Ų | 29 | 52.5 Ų | 52.5 | 13% | 0.134 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59 | -46.1 | 176.2 | 177.7 | -80.4 | 0 | 0 | 0 | 111.6 | S165 W166 R169 S219 V221 I225 F226 V227 | S165-H223 PolarHBondContact OG-CE1 3.36Å; W166-H223 HydrophobicContact CB-CB 4.46Å; W166-H223 HydrophobicContact CD2-CB 4.31Å; W166-H223 HydrophobicContact CE3-CB 4.47Å; W166-H223 AromaticContact CE3-CD2 3.59Å; W166-H223 HydrophobicContact CG-CB 4.27Å; R169-H223 PolarHBondContact NH2-NE2 3.01Å; S219-H223 VanDerWaalsContact O-CB 3.23Å; S219-H223 WeakPolarHBondContact O-CB 3.41Å; S219-H223 PolarHBondContact O-N 3.25Å; V221-H223 VanDerWaalsContact C-N 3.34Å; V221-H223 PolarHBondContact O-N 3.32Å; H223-I225 PolarHBondContact O-N 3.21Å; H223-F226 PolarHBondContact O-N 3.45Å; H223-V227 VanDerWaalsContact CE1-CG2 3.48Å; H223-V227 WeakPolarHBondContact CE1-CG2 3.47Å; H223-V227 WeakPolarHBondContact O-CG2 3.49Å; H223-V227 PolarHBondContact O-N 2.93Å |
| 224 | R | 94.5 | Very high | 86.4 | Confident | 1 Ų | 1 | 59.8 Ų | 59.8 | 0% | 0.004 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -60.9 | -42.2 | 176.9 | -176.7 | 177.7 | 157.9 | -166.9 | 5.8 | 112.1 | A161 E163 P220 V221 V222 F226 V227 S228 D235 L238 D296 R300 | A161-R224 WeakPolarHBondContact O-CD 3.41Å; E163-R224 HydrophobicContact CG-CB 3.94Å; E163-R224 HydrophobicContact CG-CG 4.04Å; E163-R224 WeakPolarHBondContact OE1-CG 3.36Å; P220-R224 WeakPolarHBondContact O-CB 3.33Å; P220-R224 PolarHBondContact O-N 3.16Å; V221-R224 PolarHBondContact O-N 3.42Å; V222-R224 VanDerWaalsContact C-N 3.35Å; V222-R224 PolarHBondContact O-N 2.99Å; R224-F226 VanDerWaalsContact C-N 3.25Å; R224-F226 PolarHBondContact O-N 3.1Å; R224-V227 PolarHBondContact O-N 3.12Å; R224-S228 WeakPolarHBondContact CG-OG 3.35Å; R224-S228 WeakPolarHBondContact O-CB 3.49Å; R224-S228 PolarHBondContact O-N 3.18Å; R224-S228 PolarHBondContact O-OG 3.38Å; R224-D235 IonicContact CZ-OD2 3.36Å; R224-D235 IonicContact NE-OD2 3.88Å; R224-D235 PolarHBondContact NE-OD2 3.26Å; R224-D235 VanDerWaalsContact NH2-CG 3.25Å; R224-D235 IonicContact NH2-OD1 2.74Å; R224-D235 PolarHBondContact NH2-OD1 3.25Å; R224-D235 IonicContact NH2-OD2 3.96Å; R224-D235 PolarHBondContact NH2-OD2 2.98Å; R224-L238 HydrophobicContact CG-CD2 4.01Å; R224-D296 IonicContact CZ-OD1 3.91Å; R224-D296 VanDerWaalsContact CZ-OD1 3.27Å; R224-D296 IonicContact CZ-OD2 2.67Å; R224-D296 IonicContact NH1-OD1 2.66Å; R224-D296 PolarHBondContact NH1-OD1 3.4Å; R224-D296 IonicContact NH1-OD2 3.16Å; R224-D296 PolarHBondContact NH1-OD2 3.37Å; R224-D296 IonicContact NH2-OD1 3.82Å; R224-D296 PolarHBondContact NH2-OD1 3.27Å; R224-R300 VanDerWaalsContact CZ-NH1 3.31Å |
| 225 | I | 92.9 | Very high | 86 | Confident | 45 Ų | 45 | 59.5 Ų | 59.5 | 23% | 0.231 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -58.3 | -38 | 176.3 | -71.1 | 165.1 | 0 | 0 | 0 | 111.4 | V221 V222 H223 L238 K242 | V221-I225 HydrophobicContact CG1-CD1 3.87Å; V221-I225 HydrophobicContact CG1-CG1 4.49Å; V221-I225 WeakPolarHBondContact O-CG1 3.47Å; V221-I225 PolarHBondContact O-N 3.26Å; V222-I225 PolarHBondContact O-N 3.2Å; H223-I225 PolarHBondContact O-N 3.21Å; I225-L238 HydrophobicContact CG1-CD2 3.82Å; I225-K242 HydrophobicContact CD1-CG 3.95Å; I225-K242 HydrophobicContact CG1-CG 4.27Å |
| 226 | F | 91.8 | Very high | 85.6 | Confident | 154 Ų | 154 | 59.7 Ų | 59.7 | 68% | 0.675 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -78.1 | -36.6 | 179.4 | -75.8 | -62.9 | 0 | 0 | 0 | 113.7 | V222 H223 R224 S229 | V222-F226 HydrophobicContact CG1-CD2 3.74Å; V222-F226 HydrophobicContact CG1-CE2 3.46Å; V222-F226 VanDerWaalsContact CG1-CE2 3.46Å; V222-F226 WeakPolarHBondContact O-CD2 3.4Å; V222-F226 PolarHBondContact O-N 3.38Å; V222-F226 VanDerWaalsContact O-N 3.15Å; H223-F226 PolarHBondContact O-N 3.45Å; R224-F226 VanDerWaalsContact C-N 3.25Å; R224-F226 PolarHBondContact O-N 3.1Å; F226-S229 PolarHBondContact O-OG 3.25Å |
| 227 | V | 90.3 | Very high | 85.5 | Confident | 82 Ų | 82 | 57.9 Ų | 57.9 | 50% | 0.497 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -84.4 | -28.4 | -177.3 | 176.7 | 0 | 0 | 0 | 0 | 112.2 | H223 R224 S229 | H223-V227 VanDerWaalsContact CE1-CG2 3.48Å; H223-V227 WeakPolarHBondContact CE1-CG2 3.47Å; H223-V227 WeakPolarHBondContact O-CG2 3.49Å; H223-V227 PolarHBondContact O-N 2.93Å; R224-V227 PolarHBondContact O-N 3.12Å; V227-S229 PolarHBondContact O-N 3Å |
| 228 | S | 78.3 | Confident | 85.3 | Confident | 46 Ų | 46 | 58.5 Ų | 58.5 | 32% | 0.322 | 34% | 0.343 | S | S | . | . | trans | -78.1 | 75.1 | 175.4 | -50.3 | 0 | 0 | 0 | 0 | 109.7 | R224 | R224-S228 WeakPolarHBondContact CG-OG 3.35Å; R224-S228 WeakPolarHBondContact O-CB 3.49Å; R224-S228 PolarHBondContact O-N 3.18Å; R224-S228 PolarHBondContact O-OG 3.38Å | ||
| 229 | S | 61.2 | Low | 85.1 | Confident | 93 Ų | 93 | 63.1 Ų | 63.1 | 65% | 0.65 | 37% | 0.367 | S | S | * | . | trans | -99.4 | -4.2 | -177.7 | -65.3 | 0 | 0 | 0 | 0 | 113.7 | F226 V227 P231 | F226-S229 PolarHBondContact O-OG 3.25Å; V227-S229 PolarHBondContact O-N 3Å; S229-P231 WeakPolarHBondContact O-CD 3.3Å | ||
| 230 | D | 64.8 | Low | 85.1 | Confident | 95 Ų | 95 | 66.6 Ų | 66.6 | 51% | 0.508 | 38% | 0.378 | S | S | . | . | trans | -82 | 108.2 | -177.9 | -164.2 | -16 | 0 | 0 | 0 | 110.8 | A232 I233 | D230-A232 PolarHBondContact O-N 3.07Å; D230-A232 VanDerWaalsContact O-N 3.16Å; D230-A232 VanDerWaalsContact OD1-CB 3.24Å; D230-A232 WeakPolarHBondContact OD1-CB 3.35Å; D230-A232 PolarHBondContact OD1-N 2.98Å; D230-I233 HydrophobicContact CB-CD1 4.35Å; D230-I233 HydrophobicContact CB-CG1 4.38Å; D230-I233 PolarHBondContact O-N 3.29Å | ||
| 231 | P | 59.9 | Low | 85.1 | Confident | 131 Ų | 131 | 66.6 Ų | 66.6 | 85% | 0.851 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -9.8 | 179.9 | -10.3 | 27.8 | 0 | 0 | 0 | 112.9 | S229 I233 | S229-P231 WeakPolarHBondContact O-CD 3.3Å; P231-I233 VanDerWaalsContact C-N 3.34Å |
| 232 | A | 59.2 | Low | 85 | Confident | 87 Ų | 87 | 71.7 Ų | 71.7 | 72% | 0.719 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | -14.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | D230 | D230-A232 PolarHBondContact O-N 3.07Å; D230-A232 VanDerWaalsContact O-N 3.16Å; D230-A232 VanDerWaalsContact OD1-CB 3.24Å; D230-A232 WeakPolarHBondContact OD1-CB 3.35Å; D230-A232 PolarHBondContact OD1-N 2.98Å |
| 233 | I | 67.3 | Low | 85.1 | Confident | 116 Ų | 116 | 71.4 Ų | 71.4 | 60% | 0.595 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -97.4 | 109 | 177 | -56.4 | 178.8 | 0 | 0 | 0 | 108.2 | D230 P231 D235 | D230-I233 HydrophobicContact CB-CD1 4.35Å; D230-I233 HydrophobicContact CB-CG1 4.38Å; D230-I233 PolarHBondContact O-N 3.29Å; P231-I233 VanDerWaalsContact C-N 3.34Å; I233-D235 PolarHBondContact O-N 3.47Å; I233-D235 VanDerWaalsContact O-N 3.12Å |
| 234 | D | 77.9 | Confident | 85.2 | Confident | 153 Ų | 153 | 70.2 Ų | 70.2 | 82% | 0.818 | 39% | 0.394 | S | S | * | . | trans | -71.1 | 103.8 | 171.2 | -167 | 22.7 | 0 | 0 | 0 | 108.9 | P236 | D234-P236 WeakPolarHBondContact O-CD 3.45Š| ||
| 235 | D | 87.6 | Confident | 85.3 | Confident | 36 Ų | 36 | 71.6 Ų | 71.6 | 19% | 0.193 | 40% | 0.402 | C | S | . | . | trans | -116.3 | 88.5 | 177.9 | -175.2 | -18.5 | 0 | 0 | 0 | 108.8 | R224 I233 A237 L238 | R224-D235 IonicContact CZ-OD2 3.36Å; R224-D235 IonicContact NE-OD2 3.88Å; R224-D235 PolarHBondContact NE-OD2 3.26Å; R224-D235 VanDerWaalsContact NH2-CG 3.25Å; R224-D235 IonicContact NH2-OD1 2.74Å; R224-D235 PolarHBondContact NH2-OD1 3.25Å; R224-D235 IonicContact NH2-OD2 3.96Å; R224-D235 PolarHBondContact NH2-OD2 2.98Å; I233-D235 PolarHBondContact O-N 3.47Å; I233-D235 VanDerWaalsContact O-N 3.12Å; D235-A237 PolarHBondContact O-N 3.39Å; D235-A237 WeakPolarHBondContact OD1-CB 3.31Å; D235-A237 PolarHBondContact OD1-N 2.87Å; D235-L238 HydrophobicContact CB-CB 4.37Å; D235-L238 HydrophobicContact CB-CD1 3.95Å; D235-L238 HydrophobicContact CB-CG 4.2Å; D235-L238 WeakPolarHBondContact O-CB 3.2Å; D235-L238 PolarHBondContact O-N 3.26Å; D235-L238 PolarHBondContact OD1-N 3.31Å; D235-L238 WeakPolarHBondContact OD2-CD1 3.34Å; D235-L238 WeakPolarHBondContact OD2-CG 3.3Å | ||
| 236 | P | 91.3 | Very high | 85.6 | Confident | 63 Ų | 63 | 73.2 Ų | 73.2 | 41% | 0.409 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.3 | -27.6 | -177.7 | 23.5 | -33.1 | 0 | 0 | 0 | 112.5 | D234 L238 L239 Y240 L295 | D234-P236 WeakPolarHBondContact O-CD 3.45Å; P236-L238 VanDerWaalsContact C-N 3.29Å; P236-L238 PolarHBondContact O-N 3.39Å; P236-L239 PolarHBondContact O-N 3Å; P236-Y240 WeakPolarHBondContact O-CD2 3.26Å; P236-L295 HydrophobicContact CB-CD1 4.15Å; P236-L295 HydrophobicContact CG-CD1 4.34Å |
| 237 | A | 95.4 | Very high | 85.9 | Confident | 2 Ų | 2 | 68.3 Ų | 68.3 | 2% | 0.017 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.1 | -34.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | D235 L239 Y240 H241 L295 D296 | D235-A237 PolarHBondContact O-N 3.39Å; D235-A237 WeakPolarHBondContact OD1-CB 3.31Å; D235-A237 PolarHBondContact OD1-N 2.87Å; A237-L239 VanDerWaalsContact C-N 3.31Å; A237-L239 PolarHBondContact O-N 3.36Å; A237-Y240 PolarHBondContact O-N 2.93Å; A237-H241 PolarHBondContact O-N 3.44Å; A237-L295 HydrophobicContact CB-CB 3.81Å; A237-L295 HydrophobicContact CB-CD1 4.31Å; A237-D296 WeakPolarHBondContact CB-OD1 3.49Å |
| 238 | L | 93.8 | Very high | 86.3 | Confident | 16 Ų | 16 | 67 Ų | 67 | 8% | 0.084 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -62.3 | -34.6 | 177.2 | -83.9 | 178.3 | 0 | 0 | 0 | 113.5 | R224 I225 D235 P236 K242 | R224-L238 HydrophobicContact CG-CD2 4.01Å; I225-L238 HydrophobicContact CG1-CD2 3.82Å; D235-L238 HydrophobicContact CB-CB 4.37Å; D235-L238 HydrophobicContact CB-CD1 3.95Å; D235-L238 HydrophobicContact CB-CG 4.2Å; D235-L238 WeakPolarHBondContact O-CB 3.2Å; D235-L238 PolarHBondContact O-N 3.26Å; D235-L238 PolarHBondContact OD1-N 3.31Å; D235-L238 WeakPolarHBondContact OD2-CD1 3.34Å; D235-L238 WeakPolarHBondContact OD2-CG 3.3Å; P236-L238 VanDerWaalsContact C-N 3.29Å; P236-L238 PolarHBondContact O-N 3.39Å; L238-K242 VanDerWaalsContact O-CG 3.27Å; L238-K242 WeakPolarHBondContact O-CG 3.34Å; L238-K242 PolarHBondContact O-N 2.93Å |
| 239 | L | 94 | Very high | 87.2 | Confident | 108 Ų | 108 | 69.7 Ų | 69.7 | 57% | 0.565 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -63.1 | -48 | 175.2 | 176.4 | 61 | 0 | 0 | 0 | 110.3 | P236 A237 H241 K242 C243 | P236-L239 PolarHBondContact O-N 3Å; A237-L239 VanDerWaalsContact C-N 3.31Å; A237-L239 PolarHBondContact O-N 3.36Å; L239-H241 PolarHBondContact O-N 3.42Å; L239-K242 WeakPolarHBondContact O-CB 3.06Å; L239-K242 PolarHBondContact O-N 2.8Å; L239-C243 PolarHBondContact O-N 3.42Å; L239-C243 PolarHBondContact O-SG 2.81Å; L239-C243 VanDerWaalsContact O-SG 3.35Å |
| 240 | Y | 97.6 | Very high | 88.9 | Confident | 94 Ų | 94 | 68.4 Ų | 68.4 | 37% | 0.369 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65 | -38.6 | 178.7 | -73.2 | -74.3 | 0 | 0 | 0 | 112.4 | P236 A237 C243 Q244 E291 L295 | P236-Y240 WeakPolarHBondContact O-CD2 3.26Å; A237-Y240 PolarHBondContact O-N 2.93Å; Y240-C243 WeakPolarHBondContact O-CB 3.41Å; Y240-C243 PolarHBondContact O-N 2.95Å; Y240-Q244 WeakPolarHBondContact O-CB 3.39Å; Y240-Q244 PolarHBondContact O-N 3.3Å; Y240-E291 HydrophobicContact CD1-CB 3.83Å; Y240-E291 HydrophobicContact CD1-CG 3.8Å; Y240-E291 HydrophobicContact CD2-CB 4.34Å; Y240-E291 HydrophobicContact CD2-CG 3.77Å; Y240-E291 HydrophobicContact CE1-CB 4.1Å; Y240-E291 HydrophobicContact CE1-CG 3.65Å; Y240-E291 HydrophobicContact CE2-CG 3.63Å; Y240-E291 HydrophobicContact CG-CB 3.96Å; Y240-E291 HydrophobicContact CG-CG 3.86Å; Y240-L295 HydrophobicContact CD2-CD1 3.81Å; Y240-L295 HydrophobicContact CE2-CD1 4.02Å |
| 241 | H | 97.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 171.8 | -85.6 | -42.5 | 0 | 0 | 0 | 113.4 | H157 V221 A237 L239 Q244 V245 A292 D296 | H157-H241 AromaticContact CD2-CE1 3.94Å; V221-H241 HydrophobicContact CG1-CB 3.57Å; A237-H241 PolarHBondContact O-N 3.44Å; L239-H241 PolarHBondContact O-N 3.42Å; H241-Q244 PolarHBondContact ND1-OE1 3.06Å; H241-Q244 WeakPolarHBondContact O-CB 3.39Å; H241-Q244 PolarHBondContact O-N 3.5Å; H241-V245 WeakPolarHBondContact O-CG2 3.13Å; H241-V245 PolarHBondContact O-N 2.89Å; H241-A292 VanDerWaalsContact CE1-CB 3.47Å; H241-A292 WeakPolarHBondContact CE1-CB 3.33Å; H241-D296 IonicContact CD2-OD2 2.74Å; H241-D296 IonicContact NE2-OD2 2.77Å; H241-D296 PolarHBondContact NE2-OD2 2.73Å |
| 242 | K | 96.4 | Very high | 92.1 | Very high | 106 Ų | 106 | 59.4 Ų | 59.4 | 46% | 0.461 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.5 | -45.3 | 173.1 | -72.9 | 167.9 | -174.3 | 174.2 | 0 | 110.9 | I225 L238 L239 Q244 V245 V246 | I225-K242 HydrophobicContact CD1-CG 3.95Å; I225-K242 HydrophobicContact CG1-CG 4.27Å; L238-K242 VanDerWaalsContact O-CG 3.27Å; L238-K242 WeakPolarHBondContact O-CG 3.34Å; L238-K242 PolarHBondContact O-N 2.93Å; L239-K242 WeakPolarHBondContact O-CB 3.06Å; L239-K242 PolarHBondContact O-N 2.8Å; K242-Q244 PolarHBondContact O-N 2.83Å; K242-V245 PolarHBondContact O-N 3.33Å; K242-V246 WeakPolarHBondContact O-CG2 3.48Å; K242-V246 PolarHBondContact O-N 3.17Å |
| 243 | C | 97.9 | Very high | 93.7 | Very high | 43 Ų | 43 | 56.5 Ų | 56.5 | 29% | 0.291 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -59.1 | -45.6 | 174.7 | -70.3 | 0 | 0 | 0 | 0 | 111.7 | L239 Y240 V245 V246 F247 A288 | L239-C243 PolarHBondContact O-N 3.42Å; L239-C243 PolarHBondContact O-SG 2.81Å; L239-C243 VanDerWaalsContact O-SG 3.35Å; Y240-C243 WeakPolarHBondContact O-CB 3.41Å; Y240-C243 PolarHBondContact O-N 2.95Å; C243-V245 PolarHBondContact O-N 3.19Å; C243-V246 PolarHBondContact O-N 3.29Å; C243-F247 HydrophobicContact CB-CD2 4.23Å; C243-F247 HydrophobicContact CB-CE2 3.83Å; C243-F247 HydrophobicContact CB-CZ 4.47Å; C243-F247 WeakPolarHBondContact O-CB 3.48Å; C243-F247 WeakPolarHBondContact O-CD2 3.35Å; C243-F247 VanDerWaalsContact O-CG 3.23Å; C243-F247 WeakPolarHBondContact O-CG 3.27Å; C243-F247 PolarHBondContact O-N 3.16Å; C243-A288 HydrophobicContact CB-CB 4.27Å |
| 244 | Q | 98.3 | Very high | 95 | Very high | 4 Ų | 4 | 53 Ų | 53 | 2% | 0.019 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -54.4 | -48.6 | 175.4 | 176.5 | -165.4 | -3.6 | 0 | 0 | 111.6 | H157 Y240 H241 K242 F247 F248 A288 Q289 | H157-Q244 PolarHBondContact CE1-NE2 2.67Å; H157-Q244 PolarHBondContact NE2-NE2 2.86Å; Y240-Q244 WeakPolarHBondContact O-CB 3.39Å; Y240-Q244 PolarHBondContact O-N 3.3Å; H241-Q244 PolarHBondContact ND1-OE1 3.06Å; H241-Q244 WeakPolarHBondContact O-CB 3.39Å; H241-Q244 PolarHBondContact O-N 3.5Å; K242-Q244 PolarHBondContact O-N 2.83Å; Q244-F247 PolarHBondContact O-N 2.95Å; Q244-F248 WeakPolarHBondContact O-CB 3.43Å; Q244-F248 PolarHBondContact O-N 3.45Å; Q244-A288 HydrophobicContact CB-CB 4.13Å; Q244-Q289 HydrophobicContact CG-CB 3.98Å |
| 245 | V | 97.9 | Very high | 95.6 | Very high | 29 Ų | 29 | 49.5 Ų | 49.5 | 18% | 0.176 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.4 | -48.2 | 177.7 | 173.2 | 0 | 0 | 0 | 0 | 111 | I218 H241 K242 C243 F247 F248 L249 | I218-V245 HydrophobicContact CD1-CG2 3.92Å; I218-V245 HydrophobicContact CG1-CG2 3.88Å; H241-V245 WeakPolarHBondContact O-CG2 3.13Å; H241-V245 PolarHBondContact O-N 2.89Å; K242-V245 PolarHBondContact O-N 3.33Å; C243-V245 PolarHBondContact O-N 3.19Å; V245-F247 PolarHBondContact O-N 2.84Å; V245-F248 PolarHBondContact O-N 3.01Å; V245-L249 HydrophobicContact CG1-CD1 4.18Å; V245-L249 WeakPolarHBondContact O-CG 3.48Å; V245-L249 PolarHBondContact O-N 3.28Å |
| 246 | V | 98.4 | Very high | 95.4 | Very high | 79 Ų | 79 | 49.6 Ų | 49.6 | 48% | 0.479 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.7 | -47.5 | 179.2 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | K242 C243 F248 L249 L250 | K242-V246 WeakPolarHBondContact O-CG2 3.48Å; K242-V246 PolarHBondContact O-N 3.17Å; C243-V246 PolarHBondContact O-N 3.29Å; V246-F248 VanDerWaalsContact C-N 3.35Å; V246-F248 PolarHBondContact O-N 2.92Å; V246-L249 PolarHBondContact O-N 2.9Å; V246-L250 HydrophobicContact CG1-CD1 4.04Å; V246-L250 WeakPolarHBondContact O-CG 3.42Å; V246-L250 PolarHBondContact O-N 2.98Å |
| 247 | F | 98.6 | Very high | 95 | Very high | 52 Ų | 52 | 51.1 Ų | 51.1 | 23% | 0.228 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.1 | -38.7 | 179.7 | -65.4 | -37.1 | 0 | 0 | 0 | 112.3 | C243 Q244 V245 L250 A251 F281 L284 C285 A288 | C243-F247 HydrophobicContact CB-CD2 4.23Å; C243-F247 HydrophobicContact CB-CE2 3.83Å; C243-F247 HydrophobicContact CB-CZ 4.47Å; C243-F247 WeakPolarHBondContact O-CB 3.48Å; C243-F247 WeakPolarHBondContact O-CD2 3.35Å; C243-F247 VanDerWaalsContact O-CG 3.23Å; C243-F247 WeakPolarHBondContact O-CG 3.27Å; C243-F247 PolarHBondContact O-N 3.16Å; Q244-F247 PolarHBondContact O-N 2.95Å; V245-F247 PolarHBondContact O-N 2.84Å; F247-L250 PolarHBondContact O-N 3.28Å; F247-A251 WeakPolarHBondContact O-CB 3.39Å; F247-A251 PolarHBondContact O-N 3.46Å; F247-F281 HydrophobicContact CD1-CD1 4.02Å; F247-F281 HydrophobicContact CD1-CE1 4.45Å; F247-L284 HydrophobicContact CB-CB 4.45Å; F247-L284 HydrophobicContact CD1-CB 4.32Å; F247-L284 HydrophobicContact CD1-CD1 4.49Å; F247-L284 HydrophobicContact CD2-CB 3.75Å; F247-L284 HydrophobicContact CE1-CD1 4.29Å; F247-L284 HydrophobicContact CE2-CB 3.98Å; F247-L284 HydrophobicContact CG-CB 3.94Å; F247-L284 HydrophobicContact CZ-CB 4.38Å; F247-L284 HydrophobicContact CZ-CD1 4.5Å; F247-C285 HydrophobicContact CB-CB 3.8Å; F247-A288 HydrophobicContact CD2-CB 4.32Å; F247-A288 HydrophobicContact CE2-CB 4.45Å |
| 248 | F | 98.1 | Very high | 94.4 | Very high | 55 Ų | 55 | 55.7 Ų | 55.7 | 24% | 0.241 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 174.5 | -176 | -88.1 | 0 | 0 | 0 | 112.1 | Y214 Q244 V245 V246 L250 A251 A252 | Y214-F248 AromaticContact CD1-CD1 3.83Å; Y214-F248 HydrophobicContact CD1-CD1 3.83Å; Y214-F248 AromaticContact CD1-CE1 3.38Å; Y214-F248 HydrophobicContact CD1-CE1 3.38Å; Y214-F248 HydrophobicContact CD1-CZ 4.04Å; Y214-F248 AromaticContact CD2-CD1 3.64Å; Y214-F248 HydrophobicContact CD2-CD1 3.64Å; Y214-F248 AromaticContact CD2-CD2 3.84Å; Y214-F248 HydrophobicContact CD2-CD2 3.84Å; Y214-F248 AromaticContact CD2-CE1 3.35Å; Y214-F248 HydrophobicContact CD2-CE1 3.35Å; Y214-F248 AromaticContact CD2-CE2 3.56Å; Y214-F248 HydrophobicContact CD2-CE2 3.56Å; Y214-F248 AromaticContact CD2-CG 3.87Å; Y214-F248 HydrophobicContact CD2-CG 3.87Å; Y214-F248 AromaticContact CD2-CZ 3.3Å; Y214-F248 HydrophobicContact CD2-CZ 3.3Å; Y214-F248 AromaticContact CE1-CD1 3.44Å; Y214-F248 HydrophobicContact CE1-CD1 3.44Å; Y214-F248 VanDerWaalsContact CE1-CD1 3.44Å; Y214-F248 AromaticContact CE1-CE1 3.54Å; Y214-F248 HydrophobicContact CE1-CE1 3.54Å; Y214-F248 HydrophobicContact CE1-CG 4.32Å; Y214-F248 HydrophobicContact CE1-CZ 4.47Å; Y214-F248 HydrophobicContact CE2-CB 3.97Å; Y214-F248 AromaticContact CE2-CD1 3.23Å; Y214-F248 HydrophobicContact CE2-CD1 3.23Å; Y214-F248 AromaticContact CE2-CD2 3.63Å; Y214-F248 HydrophobicContact CE2-CD2 3.63Å; Y214-F248 AromaticContact CE2-CE1 3.51Å; Y214-F248 HydrophobicContact CE2-CE1 3.51Å; Y214-F248 AromaticContact CE2-CE2 3.87Å; Y214-F248 HydrophobicContact CE2-CE2 3.87Å; Y214-F248 AromaticContact CE2-CG 3.29Å; Y214-F248 HydrophobicContact CE2-CG 3.29Å; Y214-F248 AromaticContact CE2-CZ 3.81Å; Y214-F248 HydrophobicContact CE2-CZ 3.81Å; Y214-F248 AromaticContact CG-CD1 3.9Å; Y214-F248 HydrophobicContact CG-CD1 3.9Å; Y214-F248 AromaticContact CG-CE1 3.27Å; Y214-F248 HydrophobicContact CG-CE1 3.27Å; Y214-F248 HydrophobicContact CG-CE2 4.17Å; Y214-F248 AromaticContact CG-CZ 3.42Å; Y214-F248 HydrophobicContact CG-CZ 3.42Å; Y214-F248 VanDerWaalsContact CG-CZ 3.42Å; Y214-F248 AromaticContact CZ-CD1 3.11Å; Y214-F248 AromaticContact CZ-CE1 3.59Å; Y214-F248 AromaticContact CZ-CG 3.55Å; Q244-F248 WeakPolarHBondContact O-CB 3.43Å; Q244-F248 PolarHBondContact O-N 3.45Å; V245-F248 PolarHBondContact O-N 3.01Å; V246-F248 VanDerWaalsContact C-N 3.35Å; V246-F248 PolarHBondContact O-N 2.92Å; F248-L250 VanDerWaalsContact C-N 3.3Å; F248-L250 PolarHBondContact O-N 3.29Å; F248-A251 WeakPolarHBondContact O-CB 3.44Å; F248-A251 PolarHBondContact O-N 3.08Å; F248-A252 HydrophobicContact CE1-CB 4.34Å; F248-A252 WeakPolarHBondContact O-CB 3.47Å; F248-A252 PolarHBondContact O-N 3.38Å |
| 249 | L | 97.1 | Very high | 94.1 | Very high | 101 Ų | 101 | 57.7 Ų | 57.7 | 53% | 0.529 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.2 | -39.6 | 178.9 | -67.3 | 175.1 | 0 | 0 | 0 | 111.6 | V245 V246 A253 | V245-L249 HydrophobicContact CG1-CD1 4.18Å; V245-L249 WeakPolarHBondContact O-CG 3.48Å; V245-L249 PolarHBondContact O-N 3.28Å; V246-L249 PolarHBondContact O-N 2.9Å; L249-A253 WeakPolarHBondContact O-CB 3.2Å; L249-A253 PolarHBondContact O-N 3.41Å |
| 250 | L | 97.6 | Very high | 93.8 | Very high | 66 Ų | 66 | 53.5 Ų | 53.5 | 35% | 0.346 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63.9 | -44.8 | 173.2 | -69 | 171.8 | 0 | 0 | 0 | 111.6 | V246 F247 F248 A253 F254 F281 | V246-L250 HydrophobicContact CG1-CD1 4.04Å; V246-L250 WeakPolarHBondContact O-CG 3.42Å; V246-L250 PolarHBondContact O-N 2.98Å; F247-L250 PolarHBondContact O-N 3.28Å; F248-L250 VanDerWaalsContact C-N 3.3Å; F248-L250 PolarHBondContact O-N 3.29Å; L250-A253 WeakPolarHBondContact O-CB 3.37Å; L250-A253 PolarHBondContact O-N 3.34Å; L250-F254 VanDerWaalsContact O-CD2 3.25Å; L250-F254 WeakPolarHBondContact O-CD2 3.25Å; L250-F254 PolarHBondContact O-N 2.8Å; L250-F281 HydrophobicContact CB-CB 4.37Å; L250-F281 HydrophobicContact CB-CD1 3.93Å; L250-F281 HydrophobicContact CB-CD2 4.11Å; L250-F281 HydrophobicContact CB-CE1 4.24Å; L250-F281 HydrophobicContact CB-CE2 4.43Å; L250-F281 HydrophobicContact CB-CG 3.87Å; L250-F281 HydrophobicContact CB-CZ 4.48Å; L250-F281 HydrophobicContact CD1-CD1 3.91Å; L250-F281 HydrophobicContact CD1-CE1 3.59Å; L250-F281 HydrophobicContact CD1-CZ 4.11Å |
| 251 | A | 97.1 | Very high | 93.4 | Very high | 1 Ų | 1 | 49.6 Ų | 49.6 | 1% | 0.008 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58 | -50.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | F247 F248 A253 F254 F255 F278 F281 L282 | F247-A251 WeakPolarHBondContact O-CB 3.39Å; F247-A251 PolarHBondContact O-N 3.46Å; F248-A251 WeakPolarHBondContact O-CB 3.44Å; F248-A251 PolarHBondContact O-N 3.08Å; A251-A253 VanDerWaalsContact C-N 3.27Å; A251-A253 PolarHBondContact O-N 3.19Å; A251-F254 PolarHBondContact O-N 3.01Å; A251-F255 WeakPolarHBondContact O-CB 3.26Å; A251-F255 PolarHBondContact O-N 3.24Å; A251-F278 HydrophobicContact CB-CD2 3.91Å; A251-F278 HydrophobicContact CB-CE2 4.28Å; A251-F278 WeakPolarHBondContact O-CD2 3.33Å; A251-F281 HydrophobicContact CB-CB 3.8Å; A251-L282 HydrophobicContact CB-CB 4.36Å |
| 252 | A | 94.3 | Very high | 93 | Very high | 36 Ų | 36 | 57.3 Ų | 57.3 | 30% | 0.298 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -58.4 | -39.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | F248 F255 S256 | F248-A252 HydrophobicContact CE1-CB 4.34Å; F248-A252 WeakPolarHBondContact O-CB 3.47Å; F248-A252 PolarHBondContact O-N 3.38Å; A252-F255 PolarHBondContact O-N 3Å; A252-S256 PolarHBondContact O-N 2.92Å |
| 253 | A | 93.6 | Very high | 92.7 | Very high | 26 Ų | 26 | 59.7 Ų | 59.7 | 22% | 0.215 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64 | -44.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L249 L250 A251 T257 F258 | L249-A253 WeakPolarHBondContact O-CB 3.2Å; L249-A253 PolarHBondContact O-N 3.41Å; L250-A253 WeakPolarHBondContact O-CB 3.37Å; L250-A253 PolarHBondContact O-N 3.34Å; A251-A253 VanDerWaalsContact C-N 3.27Å; A251-A253 PolarHBondContact O-N 3.19Å; A253-T257 PolarHBondContact O-N 2.96Å; A253-T257 PolarHBondContact O-OG1 3.42Å; A253-F258 HydrophobicContact CB-CD2 3.67Å; A253-F258 HydrophobicContact CB-CE2 3.85Å; A253-F258 PolarHBondContact O-N 2.75Å |
| 254 | F | 94.4 | Very high | 92.2 | Very high | 42 Ų | 42 | 63.5 Ų | 63.5 | 18% | 0.184 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -69.5 | -30.2 | 174.7 | -78.7 | -69.4 | 0 | 0 | 0 | 113.4 | L250 A251 F258 P260 L277 F278 F281 | L250-F254 VanDerWaalsContact O-CD2 3.25Å; L250-F254 WeakPolarHBondContact O-CD2 3.25Å; L250-F254 PolarHBondContact O-N 2.8Å; A251-F254 PolarHBondContact O-N 3.01Å; F254-F258 HydrophobicContact CD1-CB 3.79Å; F254-F258 HydrophobicContact CE1-CB 4Å; F254-P260 HydrophobicContact CE1-CG 4.14Å; F254-L277 HydrophobicContact CB-CB 4.42Å; F254-L277 HydrophobicContact CD1-CB 3.84Å; F254-L277 HydrophobicContact CD1-CD1 3.8Å; F254-L277 HydrophobicContact CD1-CG 4.48Å; F254-L277 HydrophobicContact CD2-CB 4.01Å; F254-L277 HydrophobicContact CE1-CB 4.09Å; F254-L277 HydrophobicContact CE1-CD1 3.31Å; F254-L277 HydrophobicContact CE1-CG 4.35Å; F254-L277 HydrophobicContact CE2-CB 4.26Å; F254-L277 HydrophobicContact CE2-CD1 4.45Å; F254-L277 HydrophobicContact CG-CB 3.82Å; F254-L277 HydrophobicContact CZ-CB 4.29Å; F254-L277 HydrophobicContact CZ-CD1 3.7Å; F254-F278 HydrophobicContact CB-CB 4.13Å; F254-F281 AromaticContact CD2-CD2 3.7Å; F254-F281 HydrophobicContact CD2-CD2 3.7Å; F254-F281 AromaticContact CD2-CE2 3.77Å; F254-F281 HydrophobicContact CD2-CE2 3.77Å; F254-F281 AromaticContact CE2-CD2 3.83Å; F254-F281 HydrophobicContact CE2-CD2 3.83Å; F254-F281 AromaticContact CE2-CE2 3.37Å; F254-F281 HydrophobicContact CE2-CE2 3.37Å; F254-F281 HydrophobicContact CE2-CZ 4.36Å; F254-F281 HydrophobicContact CZ-CE2 4.33Å |
| 255 | F | 89.7 | Confident | 91.6 | Very high | 80 Ų | 80 | 66.8 Ų | 66.8 | 35% | 0.351 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -69.5 | -46.1 | 175.6 | -176.5 | -97.6 | 0 | 0 | 0 | 112.2 | E207 A251 A252 F278 | E207-F255 HydrophobicContact CG-CE1 4.36Å; A251-F255 WeakPolarHBondContact O-CB 3.26Å; A251-F255 PolarHBondContact O-N 3.24Å; A252-F255 PolarHBondContact O-N 3Å; F255-F278 HydrophobicContact CB-CD2 3.75Å; F255-F278 HydrophobicContact CB-CE2 4.06Å; F255-F278 HydrophobicContact CB-CG 4.1Å; F255-F278 AromaticContact CD2-CD1 3.96Å; F255-F278 HydrophobicContact CD2-CD1 3.96Å; F255-F278 HydrophobicContact CD2-CD2 4.24Å; F255-F278 AromaticContact CD2-CE1 3.83Å; F255-F278 HydrophobicContact CD2-CE1 3.83Å; F255-F278 HydrophobicContact CD2-CE2 4.1Å; F255-F278 HydrophobicContact CD2-CG 4.17Å; F255-F278 AromaticContact CD2-CZ 3.89Å; F255-F278 HydrophobicContact CD2-CZ 3.89Å; F255-F278 HydrophobicContact CE2-CE1 4.36Å; F255-F278 HydrophobicContact CE2-CZ 4.5Å; F255-F278 HydrophobicContact CG-CD2 4.39Å; F255-F278 HydrophobicContact CG-CE2 4.32Å |
| 256 | S | 85 | Confident | 90.7 | Very high | 38 Ų | 38 | 66.5 Ų | 66.5 | 27% | 0.266 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -95.8 | -35.1 | -170.8 | -64.6 | 0 | 0 | 0 | 0 | 114.6 | E207 A252 | E207-S256 PolarHBondContact OE2-OG 3.24Å; A252-S256 PolarHBondContact O-N 2.92Å |
| 257 | T | 81.4 | Confident | 90.2 | Very high | 95 Ų | 95 | 67.1 Ų | 67.1 | 58% | 0.583 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128.7 | -40.4 | -162 | 61.9 | 0 | 0 | 0 | 0 | 115.2 | A253 | A253-T257 PolarHBondContact O-N 2.96Å; A253-T257 PolarHBondContact O-OG1 3.42Å |
| 258 | F | 84 | Confident | 89.8 | Confident | 98 Ų | 98 | 65.2 Ų | 65.2 | 43% | 0.43 | 34% | 0.338 | S | S | . | . | trans | -97.8 | 109.7 | -173.5 | -66.1 | -68.7 | 0 | 0 | 0 | 111.5 | A253 F254 P260 W263 | A253-F258 HydrophobicContact CB-CD2 3.67Å; A253-F258 HydrophobicContact CB-CE2 3.85Å; A253-F258 PolarHBondContact O-N 2.75Å; F254-F258 HydrophobicContact CD1-CB 3.79Å; F254-F258 HydrophobicContact CE1-CB 4Å; F258-P260 WeakPolarHBondContact O-CD 3.37Å; F258-W263 HydrophobicContact CD1-CH2 4.23Å | ||
| 259 | M | 86.1 | Confident | 89.4 | Confident | 59 Ų | 59 | 65 Ų | 65 | 29% | 0.291 | 34% | 0.338 | S | S | . | . | trans | -117.8 | 89.2 | 176.6 | -61.2 | -177.8 | 72.5 | 0 | 0 | 109.5 | P45 Y46 E261 R262 | P45-M259 HydrophobicContact CB-CE 3.89Å; P45-M259 HydrophobicContact CG-CE 4.12Å; Y46-M259 HydrophobicContact CD2-CE 4.4Å; Y46-M259 HydrophobicContact CE2-CE 4.43Å; M259-E261 HydrophobicContact CB-CG 4.46Å; M259-E261 HydrophobicContact CE-CG 4.46Å; M259-E261 WeakPolarHBondContact CE-OE1 3.28Å; M259-E261 PolarHBondContact O-N 3.08Å; M259-R262 HydrophobicContact CB-CB 4.33Å; M259-R262 WeakPolarHBondContact O-CB 3.41Å; M259-R262 PolarHBondContact O-N 3.5Å | ||
| 260 | P | 88.4 | Confident | 89.1 | Confident | 19 Ų | 19 | 61.6 Ų | 61.6 | 12% | 0.123 | 32% | 0.321 | C | S | . | . | G | 310 helix | trans | -55.6 | -33.2 | -179.2 | -24.5 | 33.1 | 0 | 0 | 0 | 114.3 | F254 F258 R262 W263 F264 L277 | F254-P260 HydrophobicContact CE1-CG 4.14Å; F258-P260 WeakPolarHBondContact O-CD 3.37Å; P260-R262 PolarHBondContact O-N 3.14Å; P260-R262 VanDerWaalsContact O-N 3.1Å; P260-W263 VanDerWaalsContact CA-CE3 3.44Å; P260-W263 HydrophobicContact CB-CE3 4.04Å; P260-W263 HydrophobicContact CB-CZ3 4Å; P260-W263 HydrophobicContact CG-CZ3 4.18Å; P260-W263 PolarHBondContact O-N 2.89Å; P260-F264 PolarHBondContact O-N 2.96Å; P260-L277 HydrophobicContact CG-CD1 3.91Å |
| 261 | E | 89.8 | Confident | 88.9 | Confident | 13 Ų | 13 | 64.5 Ų | 64.5 | 6% | 0.061 | 33% | 0.331 | C | S | . | . | G | 310 helix | trans | -59.2 | -20.1 | 175.1 | 63.5 | -90.6 | -149.8 | 0 | 0 | 113.6 | Y46 I47 M259 W263 F264 C268 G274 | Y46-E261 WeakPolarHBondContact CB-O 3.23Å; Y46-E261 HydrophobicContact CD2-CG 4Å; Y46-E261 HydrophobicContact CG-CG 4.45Å; I47-E261 HydrophobicContact CD1-CB 4.4Å; M259-E261 HydrophobicContact CB-CG 4.46Å; M259-E261 HydrophobicContact CE-CG 4.46Å; M259-E261 WeakPolarHBondContact CE-OE1 3.28Å; M259-E261 PolarHBondContact O-N 3.08Å; E261-W263 VanDerWaalsContact C-N 3.33Å; E261-F264 CarbonylContact O-C 3.38Å; E261-F264 PolarHBondContact O-N 2.87Å; E261-C268 HydrophobicContact CB-CB 3.79Å; E261-G274 PolarHBondContact OE2-N 3.23Å |
| 262 | R | 89.5 | Confident | 88.6 | Confident | 162 Ų | 162 | 66.1 Ų | 66.1 | 61% | 0.611 | 35% | 0.348 | S | S | * | . | G | 310 helix | trans | -68.8 | -32.5 | 172.7 | -179.3 | 175.4 | 174.8 | 178 | -0.1 | 112.2 | Y46 M259 P260 | Y46-R262 HydrophobicContact CD2-CB 4.13Å; Y46-R262 HydrophobicContact CE1-CG 4.32Å; Y46-R262 HydrophobicContact CE2-CB 3.74Å; Y46-R262 HydrophobicContact CE2-CG 3.99Å; M259-R262 HydrophobicContact CB-CB 4.33Å; M259-R262 WeakPolarHBondContact O-CB 3.41Å; M259-R262 PolarHBondContact O-N 3.5Å; P260-R262 PolarHBondContact O-N 3.14Å; P260-R262 VanDerWaalsContact O-N 3.1Å |
| 263 | W | 89 | Confident | 88.5 | Confident | 155 Ų | 155 | 64.5 Ų | 64.5 | 59% | 0.587 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | -20.3 | 179.5 | -54.7 | -48.3 | 0 | 0 | 0 | 112.1 | F258 P260 E261 | F258-W263 HydrophobicContact CD1-CH2 4.23Å; P260-W263 VanDerWaalsContact CA-CE3 3.44Å; P260-W263 HydrophobicContact CB-CE3 4.04Å; P260-W263 HydrophobicContact CB-CZ3 4Å; P260-W263 HydrophobicContact CG-CZ3 4.18Å; P260-W263 PolarHBondContact O-N 2.89Å; E261-W263 VanDerWaalsContact C-N 3.33Å |
| 264 | F | 87.9 | Confident | 88.6 | Confident | 124 Ų | 124 | 63.3 Ų | 63.3 | 54% | 0.544 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -132.9 | 64.2 | 178.4 | -49.6 | -78.6 | 0 | 0 | 0 | 112.4 | P260 E261 G266 S267 | P260-F264 PolarHBondContact O-N 2.96Å; E261-F264 CarbonylContact O-C 3.38Å; E261-F264 PolarHBondContact O-N 2.87Å; F264-G266 PolarHBondContact O-N 3.35Å; F264-S267 WeakPolarHBondContact O-CB 3.5Å; F264-S267 PolarHBondContact O-N 3.43Å |
| 265 | P | 84.9 | Confident | 88.6 | Confident | 72 Ų | 72 | 63.9 Ų | 63.9 | 47% | 0.468 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.4 | 130.5 | -177 | -23.7 | 34.5 | 0 | 0 | 0 | 111.9 | Y46 Y48 S267 | Y46-P265 HydrophobicContact CD1-CB 4.24Å; Y46-P265 HydrophobicContact CD1-CG 4.2Å; Y48-P265 HydrophobicContact CE2-CB 4.28Å; P265-S267 PolarHBondContact O-N 3.38Å |
| 266 | G | 80.8 | Confident | 88.9 | Confident | 24 Ų | 24 | 60.4 Ų | 60.4 | 25% | 0.247 | 31% | 0.313 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 74.4 | 2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | Y46 F264 H269 | Y46-G266 PolarHBondContact O-N 3.39Å; F264-G266 PolarHBondContact O-N 3.35Å; G266-H269 PolarHBondContact O-CE1 2.87Å; G266-H269 PolarHBondContact O-ND1 3.29Å; G266-H269 VanDerWaalsContact O-ND1 3.11Å |
| 267 | S | 86.8 | Confident | 89.5 | Confident | 92 Ų | 92 | 61 Ų | 61 | 64% | 0.643 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.4 | -26.5 | 171.9 | -57.4 | 0 | 0 | 0 | 0 | 112.1 | F264 P265 H269 | F264-S267 WeakPolarHBondContact O-CB 3.5Å; F264-S267 PolarHBondContact O-N 3.43Å; P265-S267 PolarHBondContact O-N 3.38Å; S267-H269 VanDerWaalsContact C-N 3.34Å; S267-H269 PolarHBondContact O-N 2.97Å |
| 268 | C | 90.1 | Very high | 90.2 | Very high | 12 Ų | 12 | 58.1 Ų | 58.1 | 8% | 0.081 | 29% | 0.292 | C | S | . | . | trans | -92.8 | 33.2 | -174.3 | -57.5 | 0 | 0 | 0 | 0 | 114.4 | I47 E261 V270 F271 Q273 | I47-C268 HydrophobicContact CD1-CB 4.39Å; I47-C268 WeakPolarHBondContact CD1-O 3.14Å; E261-C268 HydrophobicContact CB-CB 3.79Å; C268-V270 VanDerWaalsContact C-N 3.32Å; C268-V270 PolarHBondContact O-N 3.29Å; C268-F271 CarbonylContact C-O 3.6Å; C268-F271 WeakPolarHBondContact CA-O 3.42Å; C268-F271 VanDerWaalsContact CB-O 3.27Å; C268-F271 WeakPolarHBondContact CB-O 3.37Å; C268-Q273 HydrophobicContact CB-CG 4.37Å; C268-Q273 VanDerWaalsContact O-CG 3.27Å; C268-Q273 WeakPolarHBondContact O-CG 3.49Å; C268-Q273 PolarHBondContact O-NE2 3.04Å; C268-Q273 VanDerWaalsContact O-NE2 3.13Å | ||
| 269 | H | 89.9 | Confident | 90.9 | Very high | 49 Ų | 49 | 53.6 Ų | 53.6 | 23% | 0.227 | 27% | 0.272 | C | S | . | . | S | Bend | trans | -59.2 | -40.9 | -175 | -68.4 | 132.5 | 0 | 0 | 0 | 113.3 | Y48 A49 N70 G266 S267 Q273 | Y48-H269 PolarHBondContact N-CD2 3.47Å; Y48-H269 PolarHBondContact N-NE2 2.97Å; A49-H269 PolarHBondContact N-CD2 3.47Å; A49-H269 PolarHBondContact N-NE2 3.35Å; N70-H269 WeakPolarHBondContact CA-O 3.23Å; N70-H269 WeakPolarHBondContact CB-O 3.23Å; G266-H269 PolarHBondContact O-CE1 2.87Å; G266-H269 PolarHBondContact O-ND1 3.29Å; G266-H269 VanDerWaalsContact O-ND1 3.11Å; S267-H269 VanDerWaalsContact C-N 3.34Å; S267-H269 PolarHBondContact O-N 2.97Å; H269-Q273 PolarHBondContact O-NE2 2.9Å |
| 270 | V | 90.3 | Very high | 91.5 | Very high | 30 Ų | 30 | 54 Ų | 54 | 18% | 0.182 | 28% | 0.275 | C | S | . | . | S | Bend | trans | -115.2 | -35.5 | -178.7 | -178.1 | 0 | 0 | 0 | 0 | 112.1 | V73 C268 Q276 | V73-V270 WeakPolarHBondContact CG2-O 3.4Å; C268-V270 VanDerWaalsContact C-N 3.32Å; C268-V270 PolarHBondContact O-N 3.29Å; V270-Q276 PolarHBondContact O-NE2 3.45Å |
| 271 | F | 93.8 | Very high | 92 | Very high | 128 Ų | 128 | 55.1 Ų | 55.1 | 56% | 0.561 | 28% | 0.278 | S | S | * | . | S | Bend | trans | -126.2 | 156.4 | -175.6 | -62.8 | -80.1 | 0 | 0 | 0 | 111.5 | V73 C268 | V73-F271 HydrophobicContact CG2-CD1 3.55Å; V73-F271 HydrophobicContact CG2-CE1 3.53Å; V73-F271 HydrophobicContact CG2-CG 4.49Å; V73-F271 HydrophobicContact CG2-CZ 4.46Å; C268-F271 CarbonylContact C-O 3.6Å; C268-F271 WeakPolarHBondContact CA-O 3.42Å; C268-F271 VanDerWaalsContact CB-O 3.27Å; C268-F271 WeakPolarHBondContact CB-O 3.37Å |
| 272 | G | 89.9 | Confident | 92.4 | Very high | 35 Ų | 35 | 55.5 Ų | 55.5 | 36% | 0.361 | 28% | 0.28 | S | S | . | . | trans | 80.5 | 21.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 273 | Q | 93.3 | Very high | 92.8 | Very high | 2 Ų | 2 | 48.6 Ų | 48.6 | 1% | 0.009 | 26% | 0.256 | C | S | . | . | trans | -82.8 | 141.9 | 174.7 | -56.2 | 176.2 | 9.5 | 0 | 0 | 110.2 | I47 N70 C268 H269 H275 Q276 L277 | I47-Q273 HydrophobicContact CD1-CG 4.01Å; N70-Q273 PolarHBondContact O-NE2 2.99Å; N70-Q273 PolarHBondContact O-OE1 3.12Å; C268-Q273 HydrophobicContact CB-CG 4.37Å; C268-Q273 VanDerWaalsContact O-CG 3.27Å; C268-Q273 WeakPolarHBondContact O-CG 3.49Å; C268-Q273 PolarHBondContact O-NE2 3.04Å; C268-Q273 VanDerWaalsContact O-NE2 3.13Å; H269-Q273 PolarHBondContact O-NE2 2.9Å; Q273-H275 PolarHBondContact O-N 3.39Å; Q273-Q276 HydrophobicContact CB-CG 3.99Å; Q273-Q276 VanDerWaalsContact O-CB 3.31Å; Q273-Q276 WeakPolarHBondContact O-CB 3.25Å; Q273-Q276 PolarHBondContact O-N 3.04Å; Q273-L277 PolarHBondContact O-N 2.7Å | ||
| 274 | G | 94.6 | Very high | 93.3 | Very high | 1 Ų | 1 | 44.4 Ų | 44.4 | 1% | 0.01 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.5 | -37.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | E261 Q276 L277 F278 | E261-G274 PolarHBondContact OE2-N 3.23Å; G274-Q276 VanDerWaalsContact C-N 3.26Å; G274-Q276 PolarHBondContact O-N 3.41Å; G274-L277 PolarHBondContact O-N 3.34Å; G274-L277 VanDerWaalsContact O-N 3.15Å; G274-F278 PolarHBondContact O-N 3.49Å |
| 275 | H | 95.3 | Very high | 93.8 | Very high | 54 Ų | 54 | 38.7 Ų | 38.7 | 25% | 0.25 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61 | -32.5 | 175.6 | -161.1 | 86.4 | 0 | 0 | 0 | 113.3 | H125 Q273 F278 H279 | H125-H275 AromaticContact CE1-CD2 3.77Å; H125-H275 AromaticContact CE1-NE2 3.42Å; H125-H275 PolarHBondContact CE1-NE2 2.84Å; H125-H275 AromaticContact NE2-NE2 3.32Å; H125-H275 PolarHBondContact NE2-NE2 3.46Å; Q273-H275 PolarHBondContact O-N 3.39Å; H275-F278 AromaticContact CE1-CD1 3.97Å; H275-F278 WeakPolarHBondContact O-CB 3.44Å; H275-H279 AromaticContact CD2-CD2 3.83Å; H275-H279 AromaticContact CD2-CE1 3.96Å; H275-H279 AromaticContact CD2-NE2 3.51Å; H275-H279 AromaticContact CE1-NE2 3.88Å; H275-H279 AromaticContact NE2-CD2 3.57Å; H275-H279 AromaticContact NE2-CE1 3.62Å; H275-H279 AromaticContact NE2-NE2 2.91Å; H275-H279 PolarHBondContact NE2-NE2 3.45Å; H275-H279 PolarHBondContact O-N 2.67Å |
| 276 | Q | 96.7 | Very high | 94.4 | Very high | 7 Ų | 7 | 35.3 Ų | 35.3 | 3% | 0.033 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -70.2 | -42.5 | 176.1 | -64.5 | 166.9 | -0.3 | 0 | 0 | 110.9 | V73 N74 V270 Q273 G274 F278 H279 I280 | V73-Q276 HydrophobicContact CB-CG 3.87Å; V73-Q276 HydrophobicContact CG1-CB 3.96Å; V73-Q276 HydrophobicContact CG1-CG 3.74Å; N74-Q276 WeakPolarHBondContact OD1-CG 3.31Å; V270-Q276 PolarHBondContact O-NE2 3.45Å; Q273-Q276 HydrophobicContact CB-CG 3.99Å; Q273-Q276 VanDerWaalsContact O-CB 3.31Å; Q273-Q276 WeakPolarHBondContact O-CB 3.25Å; Q273-Q276 PolarHBondContact O-N 3.04Å; G274-Q276 VanDerWaalsContact C-N 3.26Å; G274-Q276 PolarHBondContact O-N 3.41Å; Q276-F278 VanDerWaalsContact C-N 3.33Å; Q276-H279 PolarHBondContact O-N 3.1Å; Q276-I280 VanDerWaalsContact O-CG1 3.29Å; Q276-I280 WeakPolarHBondContact O-CG1 3.34Å; Q276-I280 PolarHBondContact O-N 3.26Å |
| 277 | L | 96.9 | Very high | 95.2 | Very high | 51 Ų | 51 | 36.6 Ų | 36.6 | 27% | 0.267 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -65.6 | -39.5 | 176.4 | -63.2 | 176.1 | 0 | 0 | 0 | 110.9 | F254 P260 Q273 G274 H279 I280 F281 | F254-L277 HydrophobicContact CB-CB 4.42Å; F254-L277 HydrophobicContact CD1-CB 3.84Å; F254-L277 HydrophobicContact CD1-CD1 3.8Å; F254-L277 HydrophobicContact CD1-CG 4.48Å; F254-L277 HydrophobicContact CD2-CB 4.01Å; F254-L277 HydrophobicContact CE1-CB 4.09Å; F254-L277 HydrophobicContact CE1-CD1 3.31Å; F254-L277 HydrophobicContact CE1-CG 4.35Å; F254-L277 HydrophobicContact CE2-CB 4.26Å; F254-L277 HydrophobicContact CE2-CD1 4.45Å; F254-L277 HydrophobicContact CG-CB 3.82Å; F254-L277 HydrophobicContact CZ-CB 4.29Å; F254-L277 HydrophobicContact CZ-CD1 3.7Å; P260-L277 HydrophobicContact CG-CD1 3.91Å; Q273-L277 PolarHBondContact O-N 2.7Å; G274-L277 PolarHBondContact O-N 3.34Å; G274-L277 VanDerWaalsContact O-N 3.15Å; L277-H279 PolarHBondContact O-N 2.8Å; L277-I280 HydrophobicContact CD2-CD1 4.35Å; L277-I280 PolarHBondContact O-N 3.33Å; L277-F281 WeakPolarHBondContact O-CD2 3.49Å; L277-F281 PolarHBondContact O-N 3.45Å |
| 278 | F | 97.3 | Very high | 95.8 | Very high | 34 Ų | 34 | 32.6 Ų | 32.6 | 15% | 0.149 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -53.6 | -51.9 | 170.1 | 162.5 | -115.6 | 0 | 0 | 0 | 111.6 | A251 F254 F255 G274 H275 Q276 I280 F281 L282 | A251-F278 HydrophobicContact CB-CD2 3.91Å; A251-F278 HydrophobicContact CB-CE2 4.28Å; A251-F278 WeakPolarHBondContact O-CD2 3.33Å; F254-F278 HydrophobicContact CB-CB 4.13Å; F255-F278 HydrophobicContact CB-CD2 3.75Å; F255-F278 HydrophobicContact CB-CE2 4.06Å; F255-F278 HydrophobicContact CB-CG 4.1Å; F255-F278 AromaticContact CD2-CD1 3.96Å; F255-F278 HydrophobicContact CD2-CD1 3.96Å; F255-F278 HydrophobicContact CD2-CD2 4.24Å; F255-F278 AromaticContact CD2-CE1 3.83Å; F255-F278 HydrophobicContact CD2-CE1 3.83Å; F255-F278 HydrophobicContact CD2-CE2 4.1Å; F255-F278 HydrophobicContact CD2-CG 4.17Å; F255-F278 AromaticContact CD2-CZ 3.89Å; F255-F278 HydrophobicContact CD2-CZ 3.89Å; F255-F278 HydrophobicContact CE2-CE1 4.36Å; F255-F278 HydrophobicContact CE2-CZ 4.5Å; F255-F278 HydrophobicContact CG-CD2 4.39Å; F255-F278 HydrophobicContact CG-CE2 4.32Å; G274-F278 PolarHBondContact O-N 3.49Å; H275-F278 AromaticContact CE1-CD1 3.97Å; H275-F278 WeakPolarHBondContact O-CB 3.44Å; Q276-F278 VanDerWaalsContact C-N 3.33Å; F278-I280 PolarHBondContact O-N 2.93Å; F278-F281 PolarHBondContact O-N 3.45Å; F278-L282 HydrophobicContact CE2-CB 4.47Å; F278-L282 HydrophobicContact CE2-CD2 4.14Å; F278-L282 HydrophobicContact CZ-CD2 3.84Å; F278-L282 VanDerWaalsContact O-CB 3.3Å; F278-L282 WeakPolarHBondContact O-CB 3.35Å; F278-L282 PolarHBondContact O-N 2.82Å |
| 279 | H | 98.1 | Very high | 96.2 | Very high | 2 Ų | 2 | 32 Ų | 32 | 1% | 0.009 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.8 | -44.7 | 176.4 | -78.7 | -157 | 0 | 0 | 0 | 112.5 | N74 H78 H125 H275 Q276 L277 L282 V283 | N74-H279 PolarHBondContact O-ND1 3.28Å; H78-H279 AromaticContact CD2-CG 3.79Å; H78-H279 AromaticContact CD2-ND1 3.68Å; H78-H279 AromaticContact CE1-CD2 3.63Å; H78-H279 AromaticContact CE1-CE1 3.54Å; H78-H279 AromaticContact CE1-CG 3.63Å; H78-H279 AromaticContact CE1-ND1 3.58Å; H78-H279 AromaticContact CE1-NE2 3.6Å; H78-H279 AromaticContact CG-ND1 3.88Å; H78-H279 AromaticContact ND1-CE1 3.73Å; H78-H279 AromaticContact ND1-ND1 3.8Å; H78-H279 WeakPolarHBondContact NE2-CB 3.37Å; H78-H279 AromaticContact NE2-CD2 3.6Å; H78-H279 AromaticContact NE2-CE1 3.92Å; H78-H279 AromaticContact NE2-CG 3.26Å; H78-H279 VanDerWaalsContact NE2-CG 3.26Å; H78-H279 AromaticContact NE2-ND1 3.5Å; H78-H279 PolarHBondContact NE2-ND1 3.4Å; H125-H279 AromaticContact CD2-CE1 3.6Å; H125-H279 AromaticContact NE2-CE1 3.41Å; H125-H279 PolarHBondContact NE2-CE1 3.05Å; H125-H279 AromaticContact NE2-NE2 3.68Å; H275-H279 AromaticContact CD2-CD2 3.83Å; H275-H279 AromaticContact CD2-CE1 3.96Å; H275-H279 AromaticContact CD2-NE2 3.51Å; H275-H279 AromaticContact CE1-NE2 3.88Å; H275-H279 AromaticContact NE2-CD2 3.57Å; H275-H279 AromaticContact NE2-CE1 3.62Å; H275-H279 AromaticContact NE2-NE2 2.91Å; H275-H279 PolarHBondContact NE2-NE2 3.45Å; H275-H279 PolarHBondContact O-N 2.67Å; Q276-H279 PolarHBondContact O-N 3.1Å; L277-H279 PolarHBondContact O-N 2.8Å; H279-L282 PolarHBondContact O-N 2.78Å; H279-V283 WeakPolarHBondContact O-CB 3.39Å; H279-V283 WeakPolarHBondContact O-CG2 3.18Å; H279-V283 PolarHBondContact O-N 3.44Å |
| 280 | I | 98.3 | Very high | 96.6 | Very high | 67 Ų | 67 | 29.7 Ų | 29.7 | 34% | 0.344 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -59.9 | -50.8 | 179.8 | -69.9 | 163.6 | 0 | 0 | 0 | 110.8 | T77 Q276 L277 F278 L282 V283 L284 | T77-I280 HydrophobicContact CG2-CD1 4.37Å; T77-I280 HydrophobicContact CG2-CG1 3.71Å; Q276-I280 VanDerWaalsContact O-CG1 3.29Å; Q276-I280 WeakPolarHBondContact O-CG1 3.34Å; Q276-I280 PolarHBondContact O-N 3.26Å; L277-I280 HydrophobicContact CD2-CD1 4.35Å; L277-I280 PolarHBondContact O-N 3.33Å; F278-I280 PolarHBondContact O-N 2.93Å; I280-L282 VanDerWaalsContact C-N 3.34Å; I280-L282 PolarHBondContact O-N 2.8Å; I280-V283 PolarHBondContact O-N 3.34Å; I280-L284 HydrophobicContact CG2-CD1 4.2Å; I280-L284 WeakPolarHBondContact O-CG 3.46Å; I280-L284 PolarHBondContact O-N 2.68Å |
| 281 | F | 98.5 | Very high | 96.9 | Very high | 44 Ų | 44 | 31 Ų | 31 | 19% | 0.193 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -68 | -33.9 | -179.9 | -74.6 | -64.2 | 0 | 0 | 0 | 112.5 | F247 L250 A251 F254 L277 F278 L284 C285 | F247-F281 HydrophobicContact CD1-CD1 4.02Å; F247-F281 HydrophobicContact CD1-CE1 4.45Å; L250-F281 HydrophobicContact CB-CB 4.37Å; L250-F281 HydrophobicContact CB-CD1 3.93Å; L250-F281 HydrophobicContact CB-CD2 4.11Å; L250-F281 HydrophobicContact CB-CE1 4.24Å; L250-F281 HydrophobicContact CB-CE2 4.43Å; L250-F281 HydrophobicContact CB-CG 3.87Å; L250-F281 HydrophobicContact CB-CZ 4.48Å; L250-F281 HydrophobicContact CD1-CD1 3.91Å; L250-F281 HydrophobicContact CD1-CE1 3.59Å; L250-F281 HydrophobicContact CD1-CZ 4.11Å; A251-F281 HydrophobicContact CB-CB 3.8Å; F254-F281 AromaticContact CD2-CD2 3.7Å; F254-F281 HydrophobicContact CD2-CD2 3.7Å; F254-F281 AromaticContact CD2-CE2 3.77Å; F254-F281 HydrophobicContact CD2-CE2 3.77Å; F254-F281 AromaticContact CE2-CD2 3.83Å; F254-F281 HydrophobicContact CE2-CD2 3.83Å; F254-F281 AromaticContact CE2-CE2 3.37Å; F254-F281 HydrophobicContact CE2-CE2 3.37Å; F254-F281 HydrophobicContact CE2-CZ 4.36Å; F254-F281 HydrophobicContact CZ-CE2 4.33Å; L277-F281 WeakPolarHBondContact O-CD2 3.49Å; L277-F281 PolarHBondContact O-N 3.45Å; F278-F281 PolarHBondContact O-N 3.45Å; F281-L284 HydrophobicContact CD1-CD1 4.31Å; F281-L284 PolarHBondContact O-N 3.42Å; F281-C285 WeakPolarHBondContact O-CB 3.28Å; F281-C285 PolarHBondContact O-N 3.04Å |
| 282 | L | 98.1 | Very high | 97.1 | Very high | 20 Ų | 20 | 24.9 Ų | 24.9 | 11% | 0.105 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -65.6 | -42.2 | 174.8 | -170 | 64.9 | 0 | 0 | 0 | 111.8 | Y117 A251 F278 H279 I280 C285 T286 | Y117-L282 HydrophobicContact CE2-CD2 4.17Å; A251-L282 HydrophobicContact CB-CB 4.36Å; F278-L282 HydrophobicContact CE2-CB 4.47Å; F278-L282 HydrophobicContact CE2-CD2 4.14Å; F278-L282 HydrophobicContact CZ-CD2 3.84Å; F278-L282 VanDerWaalsContact O-CB 3.3Å; F278-L282 WeakPolarHBondContact O-CB 3.35Å; F278-L282 PolarHBondContact O-N 2.82Å; H279-L282 PolarHBondContact O-N 2.78Å; I280-L282 VanDerWaalsContact C-N 3.34Å; I280-L282 PolarHBondContact O-N 2.8Å; L282-C285 WeakPolarHBondContact O-CB 3.37Å; L282-C285 PolarHBondContact O-N 3.5Å; L282-T286 PolarHBondContact O-N 3.5Å; L282-T286 PolarHBondContact O-OG1 2.89Å |
| 283 | V | 98.6 | Very high | 97.5 | Very high | 18 Ų | 18 | 23.2 Ų | 23.2 | 11% | 0.109 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -60.6 | -47.6 | 173.4 | 165.6 | 0 | 0 | 0 | 0 | 111.1 | A81 L118 H279 I280 C285 T286 L287 | A81-V283 HydrophobicContact CB-CB 4.3Å; A81-V283 HydrophobicContact CB-CG1 3.57Å; A81-V283 HydrophobicContact CB-CG2 3.71Å; L118-V283 HydrophobicContact CD2-CG2 3.92Å; H279-V283 WeakPolarHBondContact O-CB 3.39Å; H279-V283 WeakPolarHBondContact O-CG2 3.18Å; H279-V283 PolarHBondContact O-N 3.44Å; I280-V283 PolarHBondContact O-N 3.34Å; V283-C285 VanDerWaalsContact C-N 3.3Å; V283-C285 PolarHBondContact O-N 3.04Å; V283-T286 PolarHBondContact O-N 3.33Å; V283-L287 HydrophobicContact CG1-CD1 3.96Å; V283-L287 HydrophobicContact CG1-CG 4.34Å; V283-L287 WeakPolarHBondContact O-CG 3.48Å; V283-L287 PolarHBondContact O-N 3.2Å |
| 284 | L | 98.6 | Very high | 97.6 | Very high | 66 Ų | 66 | 23.3 Ų | 23.3 | 35% | 0.346 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -61 | -39.7 | 177.3 | -68.4 | 174.2 | 0 | 0 | 0 | 111.8 | F247 I280 F281 L287 A288 | F247-L284 HydrophobicContact CB-CB 4.45Å; F247-L284 HydrophobicContact CD1-CB 4.32Å; F247-L284 HydrophobicContact CD1-CD1 4.49Å; F247-L284 HydrophobicContact CD2-CB 3.75Å; F247-L284 HydrophobicContact CE1-CD1 4.29Å; F247-L284 HydrophobicContact CE2-CB 3.98Å; F247-L284 HydrophobicContact CG-CB 3.94Å; F247-L284 HydrophobicContact CZ-CB 4.38Å; F247-L284 HydrophobicContact CZ-CD1 4.5Å; I280-L284 HydrophobicContact CG2-CD1 4.2Å; I280-L284 WeakPolarHBondContact O-CG 3.46Å; I280-L284 PolarHBondContact O-N 2.68Å; F281-L284 HydrophobicContact CD1-CD1 4.31Å; F281-L284 PolarHBondContact O-N 3.42Å; L284-L287 PolarHBondContact O-N 3.36Å; L284-A288 WeakPolarHBondContact O-CB 3.04Å; L284-A288 PolarHBondContact O-N 3.43Å |
| 285 | C | 98.7 | Very high | 97.7 | Very high | 4 Ų | 4 | 25.2 Ų | 25.2 | 3% | 0.027 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -58.2 | -49.9 | 172.5 | 173.5 | 0 | 0 | 0 | 0 | 111.5 | F247 F281 L282 V283 A288 Q289 | F247-C285 HydrophobicContact CB-CB 3.8Å; F281-C285 WeakPolarHBondContact O-CB 3.28Å; F281-C285 PolarHBondContact O-N 3.04Å; L282-C285 WeakPolarHBondContact O-CB 3.37Å; L282-C285 PolarHBondContact O-N 3.5Å; V283-C285 VanDerWaalsContact C-N 3.3Å; V283-C285 PolarHBondContact O-N 3.04Å; C285-A288 PolarHBondContact O-N 3.02Å; C285-Q289 WeakPolarHBondContact O-CB 3.34Å; C285-Q289 PolarHBondContact O-N 2.87Å |
| 286 | T | 98.4 | Very high | 97.8 | Very high | 1 Ų | 1 | 22.7 Ų | 22.7 | 1% | 0.006 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63.1 | -42.9 | 178.8 | -63 | 0 | 0 | 0 | 0 | 112.2 | Y117 Y149 L282 V283 Q289 L290 | Y117-T286 HydrophobicContact CE1-CG2 4.1Å; Y117-T286 WeakPolarHBondContact OH-CB 3.49Å; Y117-T286 PolarHBondContact OH-OG1 2.7Å; Y149-T286 HydrophobicContact CE2-CG2 4.06Å; Y149-T286 PolarHBondContact OH-OG1 3.36Å; L282-T286 PolarHBondContact O-N 3.5Å; L282-T286 PolarHBondContact O-OG1 2.89Å; V283-T286 PolarHBondContact O-N 3.33Å; T286-Q289 PolarHBondContact O-N 3.48Å; T286-L290 HydrophobicContact CG2-CD1 4.04Å; T286-L290 HydrophobicContact CG2-CG 4.41Å; T286-L290 WeakPolarHBondContact O-CG 3.14Å; T286-L290 PolarHBondContact O-N 3.31Å |
| 287 | L | 98.1 | Very high | 97.8 | Very high | 52 Ų | 52 | 23.3 Ų | 23.3 | 27% | 0.272 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -63.6 | -43.1 | 177.8 | -68 | 175.7 | 0 | 0 | 0 | 111.7 | V84 L85 V283 L284 L290 E291 | V84-L287 HydrophobicContact CG1-CD2 4.2Å; L85-L287 HydrophobicContact CD2-CD2 3.94Å; V283-L287 HydrophobicContact CG1-CD1 3.96Å; V283-L287 HydrophobicContact CG1-CG 4.34Å; V283-L287 WeakPolarHBondContact O-CG 3.48Å; V283-L287 PolarHBondContact O-N 3.2Å; L284-L287 PolarHBondContact O-N 3.36Å; L287-L290 PolarHBondContact O-N 2.74Å; L287-E291 PolarHBondContact O-N 3.21Å; L287-E291 VanDerWaalsContact O-N 3.1Å |
| 288 | A | 98.3 | Very high | 97.7 | Very high | 7 Ų | 7 | 27 Ų | 27 | 6% | 0.058 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.8 | -41.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | C243 Q244 F247 L284 C285 E291 A292 | C243-A288 HydrophobicContact CB-CB 4.27Å; Q244-A288 HydrophobicContact CB-CB 4.13Å; F247-A288 HydrophobicContact CD2-CB 4.32Å; F247-A288 HydrophobicContact CE2-CB 4.45Å; L284-A288 WeakPolarHBondContact O-CB 3.04Å; L284-A288 PolarHBondContact O-N 3.43Å; C285-A288 PolarHBondContact O-N 3.02Å; A288-E291 PolarHBondContact O-N 3.14Å; A288-A292 WeakPolarHBondContact O-CB 2.97Å; A288-A292 PolarHBondContact O-N 2.85Å |
| 289 | Q | 98.4 | Very high | 97.6 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.8 | -48.4 | 175.7 | -177 | 178.9 | 29.8 | 0 | 0 | 112.2 | Y149 S153 H157 Q244 C285 T286 E291 A292 V293 | Y149-Q289 PolarHBondContact OH-OE1 3.5Å; S153-Q289 VanDerWaalsContact CB-NE2 3.33Å; S153-Q289 PolarHBondContact OG-NE2 3.42Å; H157-Q289 PolarHBondContact CE1-NE2 2.91Å; H157-Q289 PolarHBondContact NE2-NE2 3.49Å; Q244-Q289 HydrophobicContact CG-CB 3.98Å; C285-Q289 WeakPolarHBondContact O-CB 3.34Å; C285-Q289 PolarHBondContact O-N 2.87Å; T286-Q289 PolarHBondContact O-N 3.48Å; Q289-E291 VanDerWaalsContact C-N 3.26Å; Q289-E291 PolarHBondContact O-N 2.72Å; Q289-A292 PolarHBondContact O-N 3.35Å; Q289-V293 HydrophobicContact CG-CG2 4.17Å; Q289-V293 WeakPolarHBondContact O-CB 3.14Å; Q289-V293 VanDerWaalsContact O-CG2 3.3Å; Q289-V293 WeakPolarHBondContact O-CG2 3.49Å; Q289-V293 PolarHBondContact O-N 2.82Å |
| 290 | L | 97.6 | Very high | 97.4 | Very high | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.005 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -63.9 | -34.6 | -178.7 | -72.4 | 174.2 | 0 | 0 | 0 | 111.8 | L85 R88 I110 V111 T286 L287 A294 | L85-L290 HydrophobicContact CD1-CD1 3.99Å; L85-L290 HydrophobicContact CD2-CD1 3.31Å; L85-L290 HydrophobicContact CG-CD1 4.31Å; R88-L290 PolarHBondContact NH2-O 3.4Å; I110-L290 HydrophobicContact CG1-CD2 3.83Å; I110-L290 HydrophobicContact CG2-CD2 4.13Å; V111-L290 HydrophobicContact CG2-CD2 3.98Å; T286-L290 HydrophobicContact CG2-CD1 4.04Å; T286-L290 HydrophobicContact CG2-CG 4.41Å; T286-L290 WeakPolarHBondContact O-CG 3.14Å; T286-L290 PolarHBondContact O-N 3.31Å; L287-L290 PolarHBondContact O-N 2.74Å; L290-A294 VanDerWaalsContact O-CB 3.28Å; L290-A294 WeakPolarHBondContact O-CB 3.24Å; L290-A294 PolarHBondContact O-N 3.48Å |
| 291 | E | 97.4 | Very high | 97.2 | Very high | 56 Ų | 56 | 31.3 Ų | 31.3 | 26% | 0.262 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -64.9 | -50.7 | 172.3 | -162.6 | 61.6 | -147.2 | 0 | 0 | 112 | R88 Y240 L287 A288 Q289 V293 A294 L295 | R88-E291 IonicContact CZ-OE2 2.78Å; R88-E291 IonicContact NH1-OE2 3.46Å; R88-E291 PolarHBondContact NH1-OE2 3.46Å; R88-E291 IonicContact NH2-OE1 2.7Å; R88-E291 IonicContact NH2-OE2 3.27Å; R88-E291 PolarHBondContact NH2-OE2 3.37Å; Y240-E291 HydrophobicContact CD1-CB 3.83Å; Y240-E291 HydrophobicContact CD1-CG 3.8Å; Y240-E291 HydrophobicContact CD2-CB 4.34Å; Y240-E291 HydrophobicContact CD2-CG 3.77Å; Y240-E291 HydrophobicContact CE1-CB 4.1Å; Y240-E291 HydrophobicContact CE1-CG 3.65Å; Y240-E291 HydrophobicContact CE2-CG 3.63Å; Y240-E291 HydrophobicContact CG-CB 3.96Å; Y240-E291 HydrophobicContact CG-CG 3.86Å; L287-E291 PolarHBondContact O-N 3.21Å; L287-E291 VanDerWaalsContact O-N 3.1Å; A288-E291 PolarHBondContact O-N 3.14Å; Q289-E291 VanDerWaalsContact C-N 3.26Å; Q289-E291 PolarHBondContact O-N 2.72Å; E291-V293 VanDerWaalsContact C-N 3.33Å; E291-V293 PolarHBondContact O-N 3.04Å; E291-A294 PolarHBondContact O-N 2.93Å; E291-L295 HydrophobicContact CG-CD1 4.39Å; E291-L295 WeakPolarHBondContact O-CG 3.22Å; E291-L295 PolarHBondContact O-N 3.42Å |
| 292 | A | 97.9 | Very high | 97.1 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -58.9 | -45.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | H241 A288 Q289 A294 L295 D296 | H241-A292 VanDerWaalsContact CE1-CB 3.47Å; H241-A292 WeakPolarHBondContact CE1-CB 3.33Å; A288-A292 WeakPolarHBondContact O-CB 2.97Å; A288-A292 PolarHBondContact O-N 2.85Å; Q289-A292 PolarHBondContact O-N 3.35Å; A292-A294 PolarHBondContact O-N 2.91Å; A292-L295 PolarHBondContact O-N 2.95Å; A292-D296 WeakPolarHBondContact O-CB 3.48Å; A292-D296 PolarHBondContact O-N 3.43Å |
| 293 | V | 97.8 | Very high | 96.9 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -66.6 | -37.2 | -179.8 | 166.3 | 0 | 0 | 0 | 0 | 112 | L107 I110 A156 Y160 Q289 E291 D296 Y297 | L107-V293 HydrophobicContact CD1-CG1 3.91Å; I110-V293 HydrophobicContact CG2-CG1 4.33Å; A156-V293 HydrophobicContact CB-CG1 4.08Å; A156-V293 HydrophobicContact CB-CG2 3.92Å; Y160-V293 HydrophobicContact CD2-CG1 3.63Å; Y160-V293 HydrophobicContact CE2-CG1 3.94Å; Q289-V293 HydrophobicContact CG-CG2 4.17Å; Q289-V293 WeakPolarHBondContact O-CB 3.14Å; Q289-V293 VanDerWaalsContact O-CG2 3.3Å; Q289-V293 WeakPolarHBondContact O-CG2 3.49Å; Q289-V293 PolarHBondContact O-N 2.82Å; E291-V293 VanDerWaalsContact C-N 3.33Å; E291-V293 PolarHBondContact O-N 3.04Å; V293-D296 PolarHBondContact O-N 2.89Å; V293-Y297 WeakPolarHBondContact O-CB 3.46Å; V293-Y297 PolarHBondContact O-N 3.47Å |
| 294 | A | 96.8 | Very high | 96.7 | Very high | 5 Ų | 5 | 35.4 Ų | 35.4 | 4% | 0.041 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65.2 | -45.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | F92 L290 E291 A292 D296 Y297 E298 | F92-A294 HydrophobicContact CE1-CB 4.1Å; F92-A294 HydrophobicContact CZ-CB 3.77Å; L290-A294 VanDerWaalsContact O-CB 3.28Å; L290-A294 WeakPolarHBondContact O-CB 3.24Å; L290-A294 PolarHBondContact O-N 3.48Å; E291-A294 PolarHBondContact O-N 2.93Å; A292-A294 PolarHBondContact O-N 2.91Å; A294-D296 VanDerWaalsContact C-N 3.32Å; A294-D296 PolarHBondContact O-N 3.13Å; A294-Y297 WeakPolarHBondContact O-CB 3.4Å; A294-Y297 PolarHBondContact O-N 3.08Å; A294-E298 PolarHBondContact O-N 2.9Å; A294-E298 VanDerWaalsContact O-N 3.1Å |
| 295 | L | 96.6 | Very high | 96.4 | Very high | 41 Ų | 41 | 36.1 Ų | 36.1 | 22% | 0.215 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.5 | -40.5 | 175.2 | -68.8 | 169.7 | 0 | 0 | 0 | 111.6 | P236 A237 Y240 E291 A292 E298 A299 | P236-L295 HydrophobicContact CB-CD1 4.15Å; P236-L295 HydrophobicContact CG-CD1 4.34Å; A237-L295 HydrophobicContact CB-CB 3.81Å; A237-L295 HydrophobicContact CB-CD1 4.31Å; Y240-L295 HydrophobicContact CD2-CD1 3.81Å; Y240-L295 HydrophobicContact CE2-CD1 4.02Å; E291-L295 HydrophobicContact CG-CD1 4.39Å; E291-L295 WeakPolarHBondContact O-CG 3.22Å; E291-L295 PolarHBondContact O-N 3.42Å; A292-L295 PolarHBondContact O-N 2.95Å; L295-E298 PolarHBondContact O-N 3.22Å; L295-A299 VanDerWaalsContact O-CB 3.26Å; L295-A299 WeakPolarHBondContact O-CB 3.23Å; L295-A299 PolarHBondContact O-N 3.32Å |
| 296 | D | 97.2 | Very high | 96.2 | Very high | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.005 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.4 | -40.6 | 176.3 | -76.1 | -19.6 | 0 | 0 | 0 | 112.7 | A161 R224 A237 H241 A292 V293 A294 E298 R300 | A161-D296 WeakPolarHBondContact CB-OD2 3.35Å; R224-D296 IonicContact CZ-OD1 3.91Å; R224-D296 VanDerWaalsContact CZ-OD1 3.27Å; R224-D296 IonicContact CZ-OD2 2.67Å; R224-D296 IonicContact NH1-OD1 2.66Å; R224-D296 PolarHBondContact NH1-OD1 3.4Å; R224-D296 IonicContact NH1-OD2 3.16Å; R224-D296 PolarHBondContact NH1-OD2 3.37Å; R224-D296 IonicContact NH2-OD1 3.82Å; R224-D296 PolarHBondContact NH2-OD1 3.27Å; A237-D296 WeakPolarHBondContact CB-OD1 3.49Å; H241-D296 IonicContact CD2-OD2 2.74Å; H241-D296 IonicContact NE2-OD2 2.77Å; H241-D296 PolarHBondContact NE2-OD2 2.73Å; A292-D296 WeakPolarHBondContact O-CB 3.48Å; A292-D296 PolarHBondContact O-N 3.43Å; V293-D296 PolarHBondContact O-N 2.89Å; A294-D296 VanDerWaalsContact C-N 3.32Å; A294-D296 PolarHBondContact O-N 3.13Å; D296-E298 VanDerWaalsContact C-N 3.27Å; D296-E298 PolarHBondContact O-N 2.99Å; D296-R300 WeakPolarHBondContact O-CA 3.42Å; D296-R300 VanDerWaalsContact O-CB 3.23Å; D296-R300 WeakPolarHBondContact O-CB 3.48Å; D296-R300 PolarHBondContact O-N 2.94Å; D296-R300 WeakPolarHBondContact OD1-CD 3.44Å |
| 297 | Y | 96.3 | Very high | 96 | Very high | 19 Ų | 19 | 41.7 Ų | 41.7 | 8% | 0.075 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -56.8 | -43.5 | 174.5 | 168 | -104.4 | 0 | 0 | 0 | 111.2 | V96 D101 H103 A104 L107 Y160 V293 A294 Y304 | V96-Y297 HydrophobicContact CG1-CE1 3.85Å; V96-Y297 HydrophobicContact CG2-CE1 4.12Å; D101-Y297 PolarHBondContact OD2-OH 3.45Å; H103-Y297 WeakPolarHBondContact O-CE2 3.41Å; A104-Y297 HydrophobicContact CB-CE2 4.27Å; L107-Y297 HydrophobicContact CD2-CD1 3.92Å; L107-Y297 HydrophobicContact CD2-CE1 4.31Å; L107-Y297 HydrophobicContact CD2-CG 4.1Å; Y160-Y297 HydrophobicContact CD1-CD2 4.39Å; Y160-Y297 AromaticContact CE1-CD2 3.61Å; Y160-Y297 HydrophobicContact CE1-CD2 3.61Å; Y160-Y297 HydrophobicContact CE1-CG 4.36Å; Y160-Y297 AromaticContact CZ-CD2 3.94Å; V293-Y297 WeakPolarHBondContact O-CB 3.46Å; V293-Y297 PolarHBondContact O-N 3.47Å; A294-Y297 WeakPolarHBondContact O-CB 3.4Å; A294-Y297 PolarHBondContact O-N 3.08Å; Y297-Y304 WeakPolarHBondContact O-CE1 3.32Å; Y297-Y304 PolarHBondContact O-OH 3.01Å; Y297-Y304 VanDerWaalsContact O-OH 3.11Å |
| 298 | E | 94.4 | Very high | 95.6 | Very high | 130 Ų | 130 | 39.9 Ų | 39.9 | 61% | 0.607 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -74.6 | -48.4 | -179.9 | -68.7 | 179.4 | -177.5 | 0 | 0 | 112.6 | A294 L295 D296 | A294-E298 PolarHBondContact O-N 2.9Å; A294-E298 VanDerWaalsContact O-N 3.1Å; L295-E298 PolarHBondContact O-N 3.22Å; D296-E298 VanDerWaalsContact C-N 3.27Å; D296-E298 PolarHBondContact O-N 2.99Å |
| 299 | A | 94.5 | Very high | 94.7 | Very high | 79 Ų | 79 | 43.6 Ų | 43.6 | 65% | 0.653 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -88.5 | -24.9 | -168 | 0 | 0 | 0 | 0 | 0 | 114.2 | L295 | L295-A299 VanDerWaalsContact O-CB 3.26Å; L295-A299 WeakPolarHBondContact O-CB 3.23Å; L295-A299 PolarHBondContact O-N 3.32Å |
| 300 | R | 94.4 | Very high | 93.4 | Very high | 22 Ų | 22 | 51.7 Ų | 51.7 | 8% | 0.083 | 28% | 0.276 | C | S | . | . | trans | -107.9 | 14.2 | -167.9 | -58.7 | 176.1 | 59.3 | 92.4 | 0.4 | 114.5 | Y160 E163 R224 D296 P302 I303 Y304 | Y160-R300 PolarHBondContact O-NE 2.8Å; E163-R300 IonicContact OE1-CZ 2.8Å; E163-R300 IonicContact OE1-NH1 3.96Å; E163-R300 PolarHBondContact OE1-NH1 2.83Å; E163-R300 IonicContact OE1-NH2 3.98Å; E163-R300 PolarHBondContact OE1-NH2 3.46Å; E163-R300 IonicContact OE2-NH2 3.17Å; R224-R300 VanDerWaalsContact CZ-NH1 3.31Å; D296-R300 WeakPolarHBondContact O-CA 3.42Å; D296-R300 VanDerWaalsContact O-CB 3.23Å; D296-R300 WeakPolarHBondContact O-CB 3.48Å; D296-R300 PolarHBondContact O-N 2.94Å; D296-R300 WeakPolarHBondContact OD1-CD 3.44Å; R300-P302 VanDerWaalsContact C-CD 3.44Å; R300-P302 VanDerWaalsContact C-N 3.34Å; R300-I303 HydrophobicContact CB-CD1 4.49Å; R300-I303 WeakPolarHBondContact O-CA 3.37Å; R300-I303 WeakPolarHBondContact O-CB 3.33Å; R300-I303 PolarHBondContact O-N 2.75Å; R300-Y304 HydrophobicContact CB-CD1 4.17Å; R300-Y304 WeakPolarHBondContact O-CD1 3.28Å; R300-Y304 PolarHBondContact O-N 3.42Å | ||
| 301 | R | 94.9 | Very high | 92 | Very high | 91 Ų | 91 | 56.6 Ų | 56.6 | 34% | 0.343 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -49 | -46.5 | 176.1 | -175.4 | 177.6 | -70.5 | -149.5 | -5.9 | 114.1 | D101 I303 Y304 E305 | D101-R301 IonicContact OD1-NH2 2.8Å; D101-R301 IonicContact OD2-CZ 3.71Å; D101-R301 IonicContact OD2-NH2 3.97Å; D101-R301 PolarHBondContact OD2-NH2 3.39Å; R301-I303 PolarHBondContact O-N 3.47Å; R301-Y304 VanDerWaalsContact CA-CZ 3.41Å; R301-Y304 HydrophobicContact CB-CE1 3.91Å; R301-Y304 HydrophobicContact CB-CE2 4.33Å; R301-Y304 WeakPolarHBondContact CB-OH 3.23Å; R301-Y304 HydrophobicContact CG-CE2 4.11Å; R301-Y304 PolarHBondContact NE-OH 3.05Å; R301-Y304 PolarHBondContact O-N 2.92Å; R301-E305 WeakPolarHBondContact CD-OE2 3.49Å; R301-E305 HydrophobicContact CG-CB 4.2Å; R301-E305 WeakPolarHBondContact CG-OE2 3.47Å; R301-E305 VanDerWaalsContact O-CB 3.27Å; R301-E305 WeakPolarHBondContact O-CB 3.47Å; R301-E305 PolarHBondContact O-N 3.15Å |
| 302 | P | 95.1 | Very high | 90 | Very high | 106 Ų | 106 | 58 Ų | 58 | 69% | 0.688 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -60 | -18.7 | 178.1 | -24.1 | 35.3 | 0 | 0 | 0 | 114.6 | R300 P306 | R300-P302 VanDerWaalsContact C-CD 3.44Å; R300-P302 VanDerWaalsContact C-N 3.34Å; P302-P306 WeakPolarHBondContact O-CD 3.44Å |
| 303 | I | 94.1 | Very high | 88.4 | Confident | 60 Ų | 60 | 60.9 Ų | 60.9 | 31% | 0.308 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -93.7 | -52.7 | 178.8 | -56.4 | 174.2 | 0 | 0 | 0 | 110.3 | P164 R300 R301 L307 | P164-I303 HydrophobicContact CG-CG2 4.12Å; R300-I303 HydrophobicContact CB-CD1 4.49Å; R300-I303 WeakPolarHBondContact O-CA 3.37Å; R300-I303 WeakPolarHBondContact O-CB 3.33Å; R300-I303 PolarHBondContact O-N 2.75Å; R301-I303 PolarHBondContact O-N 3.47Å; I303-L307 HydrophobicContact CG2-CD1 4.36Å; I303-L307 VanDerWaalsContact O-CG 3.31Å; I303-L307 WeakPolarHBondContact O-CG 3.26Å |
| 304 | Y | 94.3 | Very high | 87.8 | Confident | 2 Ų | 2 | 65.9 Ų | 65.9 | 1% | 0.008 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -77.2 | -33.1 | -172 | 68.1 | -113.9 | 0 | 0 | 0 | 113.5 | H103 Y159 Y160 Y297 R300 R301 L307 H308 | H103-Y304 HydrophobicContact CB-CE2 3.82Å; H103-Y304 AromaticContact CG-CE2 3.84Å; H103-Y304 AromaticContact ND1-CE2 3.77Å; Y159-Y304 HydrophobicContact CD1-CD2 4.18Å; Y159-Y304 AromaticContact CE1-CD2 3.79Å; Y159-Y304 HydrophobicContact CE1-CD2 3.79Å; Y159-Y304 HydrophobicContact CE1-CE2 4.15Å; Y159-Y304 WeakPolarHBondContact O-CB 3.47Å; Y160-Y304 AromaticContact CD1-CD1 3.85Å; Y160-Y304 HydrophobicContact CD1-CD1 3.85Å; Y160-Y304 AromaticContact CD1-CE1 3.81Å; Y160-Y304 HydrophobicContact CD1-CE1 3.81Å; Y160-Y304 HydrophobicContact CD1-CG 4.26Å; Y160-Y304 HydrophobicContact CE1-CE1 4.29Å; Y297-Y304 WeakPolarHBondContact O-CE1 3.32Å; Y297-Y304 PolarHBondContact O-OH 3.01Å; Y297-Y304 VanDerWaalsContact O-OH 3.11Å; R300-Y304 HydrophobicContact CB-CD1 4.17Å; R300-Y304 WeakPolarHBondContact O-CD1 3.28Å; R300-Y304 PolarHBondContact O-N 3.42Å; R301-Y304 VanDerWaalsContact CA-CZ 3.41Å; R301-Y304 HydrophobicContact CB-CE1 3.91Å; R301-Y304 HydrophobicContact CB-CE2 4.33Å; R301-Y304 WeakPolarHBondContact CB-OH 3.23Å; R301-Y304 HydrophobicContact CG-CE2 4.11Å; R301-Y304 PolarHBondContact NE-OH 3.05Å; R301-Y304 PolarHBondContact O-N 2.92Å; Y304-L307 PolarHBondContact O-N 3.33Å; Y304-H308 PolarHBondContact O-CD2 2.9Å; Y304-H308 PolarHBondContact O-N 3.11Å; Y304-H308 VanDerWaalsContact O-N 3.17Å |
| 305 | E | 93.8 | Very high | 87.5 | Confident | 81 Ų | 81 | 65.8 Ų | 65.8 | 38% | 0.379 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.5 | -46.5 | -174.7 | 172.6 | 176.7 | 178.1 | 0 | 0 | 112.3 | R301 L307 H308 T309 | R301-E305 WeakPolarHBondContact CD-OE2 3.49Å; R301-E305 HydrophobicContact CG-CB 4.2Å; R301-E305 WeakPolarHBondContact CG-OE2 3.47Å; R301-E305 VanDerWaalsContact O-CB 3.27Å; R301-E305 WeakPolarHBondContact O-CB 3.47Å; R301-E305 PolarHBondContact O-N 3.15Å; E305-L307 VanDerWaalsContact C-N 3.34Å; E305-L307 PolarHBondContact O-N 2.91Å; E305-H308 CarbonylContact O-C 3.51Å; E305-H308 PolarHBondContact O-N 3.01Å; E305-T309 PolarHBondContact O-N 2.94Å; E305-T309 PolarHBondContact O-OG1 2.98Å |
| 306 | P | 93.9 | Very high | 87.3 | Confident | 84 Ų | 84 | 65.6 Ų | 65.6 | 55% | 0.545 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.8 | -34.3 | 174.7 | -23.5 | 34.8 | 0 | 0 | 0 | 114 | P302 H308 T309 | P302-P306 WeakPolarHBondContact O-CD 3.44Å; P306-H308 PolarHBondContact O-N 2.88Å; P306-T309 WeakPolarHBondContact CA-OG1 3.47Å; P306-T309 PolarHBondContact O-OG1 3.43Å |
| 307 | L | 92.9 | Very high | 87.1 | Confident | 39 Ų | 39 | 67.3 Ų | 67.3 | 20% | 0.204 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -65.5 | -33.7 | 179.5 | -65.9 | 176.3 | 0 | 0 | 0 | 111.6 | I162 P164 H167 I303 Y304 E305 | I162-L307 HydrophobicContact CG2-CD1 4.1Å; P164-L307 HydrophobicContact CB-CD2 4.18Å; P164-L307 HydrophobicContact CG-CD1 4.35Å; P164-L307 HydrophobicContact CG-CD2 4.49Å; H167-L307 HydrophobicContact CB-CD1 4.29Å; H167-L307 HydrophobicContact CB-CD2 4.37Å; I303-L307 HydrophobicContact CG2-CD1 4.36Å; I303-L307 VanDerWaalsContact O-CG 3.31Å; I303-L307 WeakPolarHBondContact O-CG 3.26Å; Y304-L307 PolarHBondContact O-N 3.33Å; E305-L307 VanDerWaalsContact C-N 3.34Å; E305-L307 PolarHBondContact O-N 2.91Å |
| 308 | H | 89.8 | Confident | 87.1 | Confident | 14 Ų | 14 | 67.8 Ų | 67.8 | 7% | 0.065 | 37% | 0.371 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110.1 | 33.1 | -176.5 | -52 | -59.5 | 0 | 0 | 0 | 111.6 | F158 Y159 H167 Y304 E305 P306 W311 | F158-H308 AromaticContact CD1-CE1 3.9Å; F158-H308 AromaticContact CE1-CE1 3.53Å; F158-H308 AromaticContact CE1-ND1 3.93Å; F158-H308 PolarHBondContact O-NE2 3.1Å; Y159-H308 AromaticContact CD1-CD2 4Å; Y159-H308 AromaticContact CD2-CD2 3.91Å; Y159-H308 HydrophobicContact CE2-CB 3.97Å; Y159-H308 AromaticContact CE2-CD2 3.91Å; Y159-H308 AromaticContact CE2-CG 3.85Å; Y159-H308 AromaticContact CG-CD2 3.97Å; Y159-H308 AromaticContact CZ-CD2 3.97Å; Y159-H308 PolarHBondContact O-NE2 3.11Å; Y159-H308 VanDerWaalsContact O-NE2 3.08Å; H167-H308 AromaticContact CD2-CE1 3.86Å; H167-H308 AromaticContact NE2-CE1 3.68Å; H167-H308 AromaticContact NE2-ND1 3.88Å; Y304-H308 PolarHBondContact O-CD2 2.9Å; Y304-H308 PolarHBondContact O-N 3.11Å; Y304-H308 VanDerWaalsContact O-N 3.17Å; E305-H308 CarbonylContact O-C 3.51Å; E305-H308 PolarHBondContact O-N 3.01Å; P306-H308 PolarHBondContact O-N 2.88Å; H308-W311 PolarHBondContact O-NE1 2.88Å |
| 309 | T | 81.3 | Confident | 87.2 | Confident | 85 Ų | 85 | 63 Ų | 63 | 52% | 0.521 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -80.5 | -36.4 | 173.9 | -52.9 | 0 | 0 | 0 | 0 | 111.7 | E305 P306 | E305-T309 PolarHBondContact O-N 2.94Å; E305-T309 PolarHBondContact O-OG1 2.98Å; P306-T309 WeakPolarHBondContact CA-OG1 3.47Å; P306-T309 PolarHBondContact O-OG1 3.43Å |
| 310 | H | 69.4 | Low | 87.3 | Confident | 170 Ų | 170 | 64.9 Ų | 64.9 | 79% | 0.787 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -113.6 | 84.9 | -179 | -61.1 | -58.1 | 0 | 0 | 0 | 109.6 | P312 | H310-P312 WeakPolarHBondContact O-CD 3.49Š|
| 311 | W | 68.4 | Low | 87.4 | Confident | 103 Ų | 103 | 69 Ų | 69 | 39% | 0.39 | 37% | 0.37 | S | S | . | . | trans | -70.3 | 117.2 | -174 | -72.5 | 29.7 | 0 | 0 | 0 | 111.4 | Y159 H308 H313 F315 | Y159-W311 HydrophobicContact CE2-CZ2 4.07Å; H308-W311 PolarHBondContact O-NE1 2.88Å; W311-H313 VanDerWaalsContact C-N 3.28Å; W311-F315 AromaticContact CE3-CD1 3.9Å; W311-F315 HydrophobicContact CE3-CD1 3.9Å; W311-F315 HydrophobicContact CE3-CE1 4.08Å; W311-F315 AromaticContact CH2-CD1 3.55Å; W311-F315 HydrophobicContact CH2-CD1 3.55Å; W311-F315 AromaticContact CH2-CE1 2.84Å; W311-F315 HydrophobicContact CH2-CE1 2.84Å; W311-F315 HydrophobicContact CH2-CE2 4.45Å; W311-F315 AromaticContact CH2-CZ 3.36Å; W311-F315 HydrophobicContact CH2-CZ 3.36Å; W311-F315 HydrophobicContact CZ2-CD1 4.31Å; W311-F315 AromaticContact CZ2-CE1 3.59Å; W311-F315 HydrophobicContact CZ2-CE1 3.59Å; W311-F315 HydrophobicContact CZ2-CZ 4.34Å; W311-F315 AromaticContact CZ3-CD1 3.25Å; W311-F315 HydrophobicContact CZ3-CD1 3.25Å; W311-F315 AromaticContact CZ3-CE1 3.09Å; W311-F315 HydrophobicContact CZ3-CE1 3.09Å; W311-F315 HydrophobicContact CZ3-CE2 4.47Å; W311-F315 HydrophobicContact CZ3-CG 4.1Å; W311-F315 AromaticContact CZ3-CZ 3.72Å; W311-F315 HydrophobicContact CZ3-CZ 3.72Å | ||
| 312 | P | 56.8 | Low | 87.5 | Confident | 86 Ų | 86 | 64.8 Ų | 64.8 | 56% | 0.558 | 35% | 0.354 | S | S | * | . | S | Bend | trans | -75.4 | -18.5 | 171.1 | 29.4 | -32 | 0 | 0 | 0 | 112.5 | H310 | H310-P312 WeakPolarHBondContact O-CD 3.49Š|
| 313 | H | 64.2 | Low | 87.7 | Confident | 60 Ų | 60 | 61.8 Ų | 61.8 | 28% | 0.278 | 33% | 0.333 | S | S | . | . | S | Bend | trans | -138.6 | 135.9 | -172.9 | -55.3 | -53.3 | 0 | 0 | 0 | 112.7 | A172 W311 F315 L318 | A172-H313 PolarHBondContact O-NE2 3.25Å; A172-H313 VanDerWaalsContact O-NE2 3.11Å; W311-H313 VanDerWaalsContact C-N 3.28Å; H313-F315 PolarHBondContact O-N 3.41Å; H313-L318 HydrophobicContact CB-CD1 4.38Å |
| 314 | N | 84.1 | Confident | 87.9 | Confident | 105 Ų | 105 | 60.8 Ų | 60.8 | 56% | 0.561 | 34% | 0.338 | S | S | * | . | trans | -81.1 | 93.4 | 172 | -174.3 | -22.2 | 0 | 0 | 0 | 109.3 | S316 G317 L318 | N314-S316 PolarHBondContact O-N 3.21Å; N314-S316 VanDerWaalsContact O-N 3.16Å; N314-S316 VanDerWaalsContact OD1-CB 3.31Å; N314-S316 WeakPolarHBondContact OD1-CB 3.47Å; N314-S316 PolarHBondContact OD1-N 3.46Å; N314-S316 VanDerWaalsContact OD1-N 3.15Å; N314-G317 WeakPolarHBondContact O-CA 3.42Å; N314-G317 PolarHBondContact O-N 3.22Å; N314-G317 PolarHBondContact OD1-N 2.93Å; N314-L318 PolarHBondContact O-N 3.08Å; N314-L318 VanDerWaalsContact O-N 3.15Å | ||
| 315 | F | 90.9 | Very high | 88.1 | Confident | 3 Ų | 3 | 62 Ų | 62 | 1% | 0.013 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -58.7 | -28.1 | -178.9 | 66.2 | -119.5 | 0 | 0 | 0 | 112.6 | L105 P106 I109 L155 Y159 L175 W311 H313 G317 L318 F319 | L105-F315 HydrophobicContact CB-CZ 4.24Å; L105-F315 HydrophobicContact CD2-CE2 3.61Å; L105-F315 HydrophobicContact CD2-CZ 3.77Å; L105-F315 HydrophobicContact CG-CE2 3.84Å; L105-F315 HydrophobicContact CG-CZ 3.99Å; P106-F315 HydrophobicContact CG-CE1 3.94Å; P106-F315 HydrophobicContact CG-CZ 3.88Å; I109-F315 HydrophobicContact CD1-CD2 3.86Å; I109-F315 HydrophobicContact CD1-CE2 3.58Å; L155-F315 HydrophobicContact CD1-CB 3.8Å; L155-F315 HydrophobicContact CD1-CD1 3.88Å; L155-F315 HydrophobicContact CD1-CD2 4.36Å; L155-F315 HydrophobicContact CD1-CE1 4.48Å; L155-F315 HydrophobicContact CD1-CG 3.8Å; L155-F315 HydrophobicContact CD2-CB 4.37Å; L155-F315 HydrophobicContact CD2-CD2 3.79Å; L155-F315 HydrophobicContact CD2-CE2 4.3Å; L155-F315 HydrophobicContact CD2-CG 4.08Å; Y159-F315 HydrophobicContact CD2-CE1 4.48Å; Y159-F315 HydrophobicContact CE2-CE1 4.11Å; L175-F315 HydrophobicContact CD1-CB 4.1Å; W311-F315 AromaticContact CE3-CD1 3.9Å; W311-F315 HydrophobicContact CE3-CD1 3.9Å; W311-F315 HydrophobicContact CE3-CE1 4.08Å; W311-F315 AromaticContact CH2-CD1 3.55Å; W311-F315 HydrophobicContact CH2-CD1 3.55Å; W311-F315 AromaticContact CH2-CE1 2.84Å; W311-F315 HydrophobicContact CH2-CE1 2.84Å; W311-F315 HydrophobicContact CH2-CE2 4.45Å; W311-F315 AromaticContact CH2-CZ 3.36Å; W311-F315 HydrophobicContact CH2-CZ 3.36Å; W311-F315 HydrophobicContact CZ2-CD1 4.31Å; W311-F315 AromaticContact CZ2-CE1 3.59Å; W311-F315 HydrophobicContact CZ2-CE1 3.59Å; W311-F315 HydrophobicContact CZ2-CZ 4.34Å; W311-F315 AromaticContact CZ3-CD1 3.25Å; W311-F315 HydrophobicContact CZ3-CD1 3.25Å; W311-F315 AromaticContact CZ3-CE1 3.09Å; W311-F315 HydrophobicContact CZ3-CE1 3.09Å; W311-F315 HydrophobicContact CZ3-CE2 4.47Å; W311-F315 HydrophobicContact CZ3-CG 4.1Å; W311-F315 AromaticContact CZ3-CZ 3.72Å; W311-F315 HydrophobicContact CZ3-CZ 3.72Å; H313-F315 PolarHBondContact O-N 3.41Å; F315-G317 VanDerWaalsContact C-N 3.31Å; F315-L318 PolarHBondContact O-N 3.31Å; F315-F319 WeakPolarHBondContact O-CB 3.42Å; F315-F319 PolarHBondContact O-N 3.39Å |
| 316 | S | 91.6 | Very high | 88.3 | Confident | 38 Ų | 38 | 58.2 Ų | 58.2 | 27% | 0.266 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.1 | -39 | 176.3 | -54 | 0 | 0 | 0 | 0 | 110.5 | N314 F319 L320 | N314-S316 PolarHBondContact O-N 3.21Å; N314-S316 VanDerWaalsContact O-N 3.16Å; N314-S316 VanDerWaalsContact OD1-CB 3.31Å; N314-S316 WeakPolarHBondContact OD1-CB 3.47Å; N314-S316 PolarHBondContact OD1-N 3.46Å; N314-S316 VanDerWaalsContact OD1-N 3.15Å; S316-F319 PolarHBondContact O-N 2.92Å; S316-L320 WeakPolarHBondContact O-CB 3.13Å; S316-L320 VanDerWaalsContact O-CG 3.28Å; S316-L320 WeakPolarHBondContact O-CG 3.48Å; S316-L320 PolarHBondContact O-N 3.41Å |
| 317 | G | 94.4 | Very high | 88.5 | Confident | 36 Ų | 36 | 57.6 Ų | 57.6 | 37% | 0.371 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62 | -44.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | N314 F315 L320 L321 | N314-G317 WeakPolarHBondContact O-CA 3.42Å; N314-G317 PolarHBondContact O-N 3.22Å; N314-G317 PolarHBondContact OD1-N 2.93Å; F315-G317 VanDerWaalsContact C-N 3.31Å; G317-L320 PolarHBondContact O-N 3.1Å; G317-L321 VanDerWaalsContact O-CB 3.28Å; G317-L321 WeakPolarHBondContact O-CB 3.47Å; G317-L321 PolarHBondContact O-N 3.11Å |
| 318 | L | 95.8 | Very high | 88.8 | Confident | 30 Ų | 30 | 60.3 Ų | 60.3 | 16% | 0.157 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -66 | -38.4 | 176.4 | -69.9 | 173.9 | 0 | 0 | 0 | 112.5 | F151 L175 P176 A179 H313 N314 F315 L321 T322 | F151-L318 HydrophobicContact CE2-CB 3.85Å; F151-L318 HydrophobicContact CZ-CB 3.63Å; L175-L318 HydrophobicContact CB-CD1 3.79Å; P176-L318 HydrophobicContact CG-CD1 4.34Å; A179-L318 HydrophobicContact CB-CB 4.44Å; A179-L318 HydrophobicContact CB-CD2 4.31Å; H313-L318 HydrophobicContact CB-CD1 4.38Å; N314-L318 PolarHBondContact O-N 3.08Å; N314-L318 VanDerWaalsContact O-N 3.15Å; F315-L318 PolarHBondContact O-N 3.31Å; L318-L321 PolarHBondContact O-N 2.99Å; L318-T322 WeakPolarHBondContact O-CB 3.41Å; L318-T322 PolarHBondContact O-N 2.91Å; L318-T322 PolarHBondContact O-OG1 3.03Å |
| 319 | F | 96.1 | Very high | 89.2 | Confident | 28 Ų | 28 | 60.6 Ų | 60.6 | 12% | 0.123 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.7 | -52.7 | 174.4 | -179.1 | -102.3 | 0 | 0 | 0 | 110.8 | I109 V148 F151 F315 S316 L321 T322 V323 | I109-F319 HydrophobicContact CG2-CD2 3.7Å; I109-F319 HydrophobicContact CG2-CE2 3.62Å; I109-F319 HydrophobicContact CG2-CG 4.41Å; I109-F319 HydrophobicContact CG2-CZ 4.25Å; V148-F319 HydrophobicContact CG1-CE2 3.76Å; V148-F319 HydrophobicContact CG1-CZ 3.87Å; F151-F319 HydrophobicContact CD1-CB 4.21Å; F151-F319 AromaticContact CD1-CD2 3.72Å; F151-F319 HydrophobicContact CD1-CD2 3.72Å; F151-F319 HydrophobicContact CD1-CG 4.47Å; F151-F319 HydrophobicContact CE1-CB 3.71Å; F151-F319 HydrophobicContact CE1-CD2 4.01Å; F151-F319 HydrophobicContact CE1-CG 4.38Å; F315-F319 WeakPolarHBondContact O-CB 3.42Å; F315-F319 PolarHBondContact O-N 3.39Å; S316-F319 PolarHBondContact O-N 2.92Å; F319-L321 VanDerWaalsContact C-N 3.31Å; F319-L321 PolarHBondContact O-N 2.89Å; F319-T322 PolarHBondContact O-N 3.4Å; F319-T322 VanDerWaalsContact O-N 3.15Å; F319-V323 HydrophobicContact CD1-CG2 4.29Å; F319-V323 HydrophobicContact CE1-CG2 3.97Å; F319-V323 HydrophobicContact CE2-CG2 4.4Å; F319-V323 HydrophobicContact CZ-CG2 4.03Å; F319-V323 VanDerWaalsContact O-CG2 3.32Å; F319-V323 WeakPolarHBondContact O-CG2 3.35Å; F319-V323 PolarHBondContact O-N 2.6Å |
| 320 | L | 96.6 | Very high | 90 | Very high | 119 Ų | 119 | 57.1 Ų | 57.1 | 62% | 0.623 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -61.8 | -38.8 | 178.3 | -69.3 | 174.5 | 0 | 0 | 0 | 112 | S316 G317 G324 | S316-L320 WeakPolarHBondContact O-CB 3.13Å; S316-L320 VanDerWaalsContact O-CG 3.28Å; S316-L320 WeakPolarHBondContact O-CG 3.48Å; S316-L320 PolarHBondContact O-N 3.41Å; G317-L320 PolarHBondContact O-N 3.1Å; L320-G324 PolarHBondContact O-N 3.04Å |
| 321 | L | 96.8 | Very high | 91.4 | Very high | 110 Ų | 110 | 54.4 Ų | 54.4 | 58% | 0.576 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -63 | -43.7 | 174.3 | 179.7 | 64.3 | 0 | 0 | 0 | 111.5 | G317 L318 F319 G324 S325 | G317-L321 VanDerWaalsContact O-CB 3.28Å; G317-L321 WeakPolarHBondContact O-CB 3.47Å; G317-L321 PolarHBondContact O-N 3.11Å; L318-L321 PolarHBondContact O-N 2.99Å; F319-L321 VanDerWaalsContact C-N 3.31Å; F319-L321 PolarHBondContact O-N 2.89Å; L321-G324 PolarHBondContact O-N 3.44Å; L321-S325 VanDerWaalsContact O-CB 3.23Å; L321-S325 WeakPolarHBondContact O-CB 3.45Å; L321-S325 PolarHBondContact O-N 3.42Å; L321-S325 PolarHBondContact O-OG 3.24Å |
| 322 | T | 97.8 | Very high | 92.8 | Very high | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.012 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64 | -46.2 | 178.7 | -56.7 | 0 | 0 | 0 | 0 | 111 | F151 A179 A182 L318 F319 S325 S326 | F151-T322 HydrophobicContact CB-CG2 4.13Å; A179-T322 WeakPolarHBondContact CB-OG1 3.42Å; A182-T322 HydrophobicContact CB-CG2 3.81Å; L318-T322 WeakPolarHBondContact O-CB 3.41Å; L318-T322 PolarHBondContact O-N 2.91Å; L318-T322 PolarHBondContact O-OG1 3.03Å; F319-T322 PolarHBondContact O-N 3.4Å; F319-T322 VanDerWaalsContact O-N 3.15Å; T322-S325 PolarHBondContact O-OG 3.29Å; T322-S325 VanDerWaalsContact O-OG 3.14Å; T322-S326 VanDerWaalsContact O-CB 3.23Å; T322-S326 WeakPolarHBondContact O-CB 3.38Å; T322-S326 PolarHBondContact O-N 2.9Å; T322-S326 VanDerWaalsContact O-N 3.08Å; T322-S326 PolarHBondContact O-OG 3.03Å |
| 323 | V | 98.3 | Very high | 94.8 | Very high | 42 Ų | 42 | 50.6 Ų | 50.6 | 26% | 0.255 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.1 | -53.8 | 174.9 | 174.4 | 0 | 0 | 0 | 0 | 110.1 | V148 F319 S325 S326 V327 | V148-V323 HydrophobicContact CG1-CG2 4.3Å; V148-V323 HydrophobicContact CG2-CB 4.46Å; V148-V323 HydrophobicContact CG2-CG2 3.69Å; F319-V323 HydrophobicContact CD1-CG2 4.29Å; F319-V323 HydrophobicContact CE1-CG2 3.97Å; F319-V323 HydrophobicContact CE2-CG2 4.4Å; F319-V323 HydrophobicContact CZ-CG2 4.03Å; F319-V323 VanDerWaalsContact O-CG2 3.32Å; F319-V323 WeakPolarHBondContact O-CG2 3.35Å; F319-V323 PolarHBondContact O-N 2.6Å; V323-S325 PolarHBondContact O-N 2.95Å; V323-S326 PolarHBondContact O-N 3.24Å; V323-V327 HydrophobicContact CG1-CG2 4.3Å; V323-V327 WeakPolarHBondContact O-CB 3.37Å; V323-V327 VanDerWaalsContact O-CG2 3.28Å; V323-V327 WeakPolarHBondContact O-CG2 3.48Å; V323-V327 PolarHBondContact O-N 3.12Å |
| 324 | G | 98.5 | Very high | 96.4 | Very high | 40 Ų | 40 | 48.5 Ų | 48.5 | 41% | 0.412 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.9 | -45.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L320 L321 L328 | L320-G324 PolarHBondContact O-N 3.04Å; L321-G324 PolarHBondContact O-N 3.44Å; G324-L328 VanDerWaalsContact O-CB 3.23Å; G324-L328 WeakPolarHBondContact O-CB 3.17Å; G324-L328 PolarHBondContact O-N 3.18Å |
| 325 | S | 98.5 | Very high | 97 | Very high | 28 Ų | 28 | 47.3 Ų | 47.3 | 20% | 0.196 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -66.1 | -39.4 | 177.9 | 57.9 | 0 | 0 | 0 | 0 | 112.6 | L321 T322 V323 T329 | L321-S325 VanDerWaalsContact O-CB 3.23Å; L321-S325 WeakPolarHBondContact O-CB 3.45Å; L321-S325 PolarHBondContact O-N 3.42Å; L321-S325 PolarHBondContact O-OG 3.24Å; T322-S325 PolarHBondContact O-OG 3.29Å; T322-S325 VanDerWaalsContact O-OG 3.14Å; V323-S325 PolarHBondContact O-N 2.95Å; S325-T329 WeakPolarHBondContact O-CB 3.48Å; S325-T329 PolarHBondContact O-N 2.98Å; S325-T329 PolarHBondContact O-OG1 3.19Å |
| 326 | S | 98.6 | Very high | 97.3 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -68 | -45.7 | 177.3 | -58.6 | 0 | 0 | 0 | 0 | 111.6 | V144 T322 V323 L328 T329 A330 | V144-S326 WeakPolarHBondContact CG2-O 3.31Å; T322-S326 VanDerWaalsContact O-CB 3.23Å; T322-S326 WeakPolarHBondContact O-CB 3.38Å; T322-S326 PolarHBondContact O-N 2.9Å; T322-S326 VanDerWaalsContact O-N 3.08Å; T322-S326 PolarHBondContact O-OG 3.03Å; V323-S326 PolarHBondContact O-N 3.24Å; S326-L328 PolarHBondContact O-N 3.28Å; S326-T329 WeakPolarHBondContact O-CB 3.13Å; S326-T329 PolarHBondContact O-N 2.94Å; S326-A330 PolarHBondContact O-N 3.08Å |
| 327 | V | 98.7 | Very high | 97.6 | Very high | 72 Ų | 72 | 48.8 Ų | 48.8 | 44% | 0.436 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.8 | -44.4 | 175.4 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | V144 V323 T329 A330 F331 | V144-V327 HydrophobicContact CG1-CG2 3.8Å; V323-V327 HydrophobicContact CG1-CG2 4.3Å; V323-V327 WeakPolarHBondContact O-CB 3.37Å; V323-V327 VanDerWaalsContact O-CG2 3.28Å; V323-V327 WeakPolarHBondContact O-CG2 3.48Å; V323-V327 PolarHBondContact O-N 3.12Å; V327-T329 VanDerWaalsContact C-N 3.29Å; V327-T329 PolarHBondContact O-N 3.15Å; V327-A330 PolarHBondContact O-N 3.16Å; V327-F331 WeakPolarHBondContact O-CB 3.28Å; V327-F331 PolarHBondContact O-N 3.25Å |
| 328 | L | 98.6 | Very high | 97.7 | Very high | 96 Ų | 96 | 50.3 Ų | 50.3 | 50% | 0.503 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.1 | -42.9 | 176.1 | 179.2 | 61.5 | 0 | 0 | 0 | 111.1 | G324 S326 F331 L332 | G324-L328 VanDerWaalsContact O-CB 3.23Å; G324-L328 WeakPolarHBondContact O-CB 3.17Å; G324-L328 PolarHBondContact O-N 3.18Å; S326-L328 PolarHBondContact O-N 3.28Å; L328-F331 PolarHBondContact O-N 3.15Å; L328-L332 HydrophobicContact CD1-CD1 4.1Å; L328-L332 HydrophobicContact CD1-CG 4.1Å; L328-L332 HydrophobicContact CG-CD1 4Å; L328-L332 HydrophobicContact CG-CG 4.41Å; L328-L332 WeakPolarHBondContact O-CB 3.5Å; L328-L332 VanDerWaalsContact O-CG 3.25Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 3.26Å |
| 329 | T | 98.3 | Very high | 97.7 | Very high | 20 Ų | 20 | 56.6 Ų | 56.6 | 12% | 0.123 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.1 | -49 | 176.9 | -57.9 | 0 | 0 | 0 | 0 | 111.6 | W183 T187 S325 S326 V327 F331 L332 L333 | W183-T329 PolarHBondContact NE1-OG1 3.47Å; T187-T329 HydrophobicContact CG2-CG2 4.12Å; S325-T329 WeakPolarHBondContact O-CB 3.48Å; S325-T329 PolarHBondContact O-N 2.98Å; S325-T329 PolarHBondContact O-OG1 3.19Å; S326-T329 WeakPolarHBondContact O-CB 3.13Å; S326-T329 PolarHBondContact O-N 2.94Å; V327-T329 VanDerWaalsContact C-N 3.29Å; V327-T329 PolarHBondContact O-N 3.15Å; T329-F331 VanDerWaalsContact C-N 3.32Å; T329-F331 PolarHBondContact O-N 3.48Å; T329-L332 PolarHBondContact O-N 2.79Å; T329-L333 HydrophobicContact CG2-CD1 4.03Å; T329-L333 PolarHBondContact O-N 3.23Å |
| 330 | A | 98.3 | Very high | 97.7 | Very high | 11 Ų | 11 | 59.8 Ų | 59.8 | 9% | 0.091 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61 | -39.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F140 V144 S326 V327 S334 | F140-A330 HydrophobicContact CB-CB 3.8Å; V144-A330 HydrophobicContact CG2-CB 3.71Å; S326-A330 PolarHBondContact O-N 3.08Å; V327-A330 PolarHBondContact O-N 3.16Å; A330-S334 WeakPolarHBondContact O-CB 3.27Å; A330-S334 PolarHBondContact O-N 2.98Å; A330-S334 PolarHBondContact O-OG 2.66Å |
| 331 | F | 98.4 | Very high | 97.6 | Very high | 113 Ų | 113 | 55.4 Ų | 55.4 | 50% | 0.496 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.7 | -51.5 | 176.8 | 176.5 | -99.4 | 0 | 0 | 0 | 111.7 | V327 L328 T329 L333 S334 Q335 | V327-F331 WeakPolarHBondContact O-CB 3.28Å; V327-F331 PolarHBondContact O-N 3.25Å; L328-F331 PolarHBondContact O-N 3.15Å; T329-F331 VanDerWaalsContact C-N 3.32Å; T329-F331 PolarHBondContact O-N 3.48Å; F331-L333 VanDerWaalsContact C-N 3.32Å; F331-L333 PolarHBondContact O-N 3.15Å; F331-S334 WeakPolarHBondContact O-CB 3.27Å; F331-S334 PolarHBondContact O-N 3.45Å; F331-S334 VanDerWaalsContact O-N 3.14Å; F331-Q335 HydrophobicContact CD1-CG 4.41Å; F331-Q335 HydrophobicContact CE1-CG 3.99Å; F331-Q335 HydrophobicContact CE2-CG 4.4Å; F331-Q335 HydrophobicContact CZ-CG 3.99Å; F331-Q335 WeakPolarHBondContact O-CG 3.44Å; F331-Q335 PolarHBondContact O-N 3.14Å |
| 332 | L | 98.3 | Very high | 97.5 | Very high | 94 Ų | 94 | 53.8 Ų | 53.8 | 49% | 0.492 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -59.5 | -42.6 | 179.8 | -70.1 | 173.8 | 0 | 0 | 0 | 111.6 | L328 T329 Q335 L336 | L328-L332 HydrophobicContact CD1-CD1 4.1Å; L328-L332 HydrophobicContact CD1-CG 4.1Å; L328-L332 HydrophobicContact CG-CD1 4Å; L328-L332 HydrophobicContact CG-CG 4.41Å; L328-L332 WeakPolarHBondContact O-CB 3.5Å; L328-L332 VanDerWaalsContact O-CG 3.25Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 3.26Å; T329-L332 PolarHBondContact O-N 2.79Å; L332-Q335 WeakPolarHBondContact O-CB 3.46Å; L332-Q335 PolarHBondContact O-N 3.34Å; L332-L336 WeakPolarHBondContact O-CG 3.48Å; L332-L336 PolarHBondContact O-N 2.73Å; L332-L336 VanDerWaalsContact O-N 3.1Å |
| 333 | L | 97.7 | Very high | 97.3 | Very high | 16 Ų | 16 | 60.4 Ų | 60.4 | 8% | 0.084 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -68.5 | -35.5 | 176.4 | -74.6 | 167.6 | 0 | 0 | 0 | 112.4 | F140 C190 Y194 T329 F331 Q335 L336 V337 | F140-L333 HydrophobicContact CD2-CB 4.22Å; F140-L333 HydrophobicContact CE2-CB 3.69Å; F140-L333 HydrophobicContact CZ-CB 4.01Å; C190-L333 HydrophobicContact CB-CD1 3.31Å; Y194-L333 HydrophobicContact CD1-CD2 3.96Å; Y194-L333 HydrophobicContact CG-CD2 4.04Å; T329-L333 HydrophobicContact CG2-CD1 4.03Å; T329-L333 PolarHBondContact O-N 3.23Å; F331-L333 VanDerWaalsContact C-N 3.32Å; F331-L333 PolarHBondContact O-N 3.15Å; L333-Q335 VanDerWaalsContact C-N 3.32Å; L333-Q335 PolarHBondContact O-N 3.29Å; L333-L336 HydrophobicContact CD2-CD1 4.14Å; L333-L336 PolarHBondContact O-N 3.08Å; L333-V337 WeakPolarHBondContact O-CG2 3.22Å; L333-V337 PolarHBondContact O-N 3.37Å |
| 334 | S | 97.6 | Very high | 96.8 | Very high | 15 Ų | 15 | 65 Ų | 65 | 11% | 0.105 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.7 | -40.1 | 172.5 | -62.8 | 0 | 0 | 0 | 0 | 111.9 | S137 F140 A330 F331 L336 V337 Q338 | S137-S334 PolarHBondContact OG-OG 3.41Å; F140-S334 WeakPolarHBondContact CD2-OG 3.48Å; A330-S334 WeakPolarHBondContact O-CB 3.27Å; A330-S334 PolarHBondContact O-N 2.98Å; A330-S334 PolarHBondContact O-OG 2.66Å; F331-S334 WeakPolarHBondContact O-CB 3.27Å; F331-S334 PolarHBondContact O-N 3.45Å; F331-S334 VanDerWaalsContact O-N 3.14Å; S334-L336 VanDerWaalsContact C-N 3.33Å; S334-L336 PolarHBondContact O-N 2.98Å; S334-V337 WeakPolarHBondContact O-CB 3.43Å; S334-V337 PolarHBondContact O-N 3.03Å; S334-Q338 PolarHBondContact O-N 3.05Å |
| 335 | Q | 97.6 | Very high | 96 | Very high | 80 Ų | 80 | 69.1 Ų | 69.1 | 37% | 0.374 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.6 | -39 | 174.6 | -66 | -62.6 | -33.8 | 0 | 0 | 111.9 | F331 L332 L333 Q338 R339 | F331-Q335 HydrophobicContact CD1-CG 4.41Å; F331-Q335 HydrophobicContact CE1-CG 3.99Å; F331-Q335 HydrophobicContact CE2-CG 4.4Å; F331-Q335 HydrophobicContact CZ-CG 3.99Å; F331-Q335 WeakPolarHBondContact O-CG 3.44Å; F331-Q335 PolarHBondContact O-N 3.14Å; L332-Q335 WeakPolarHBondContact O-CB 3.46Å; L332-Q335 PolarHBondContact O-N 3.34Å; L333-Q335 VanDerWaalsContact C-N 3.32Å; L333-Q335 PolarHBondContact O-N 3.29Å; Q335-Q338 PolarHBondContact O-N 2.93Å; Q335-R339 WeakPolarHBondContact O-CG 3.43Å; Q335-R339 PolarHBondContact O-N 3.25Å; Q335-R339 VanDerWaalsContact O-N 3.09Å |
| 336 | L | 97.2 | Very high | 94.5 | Very high | 70 Ų | 70 | 78.9 Ų | 78.9 | 37% | 0.366 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -66.4 | -40 | 174.9 | -69.3 | 174.1 | 0 | 0 | 0 | 112.2 | Y194 L332 L333 S334 R339 R340 | Y194-L336 HydrophobicContact CE2-CB 4.04Å; L332-L336 WeakPolarHBondContact O-CG 3.48Å; L332-L336 PolarHBondContact O-N 2.73Å; L332-L336 VanDerWaalsContact O-N 3.1Å; L333-L336 HydrophobicContact CD2-CD1 4.14Å; L333-L336 PolarHBondContact O-N 3.08Å; S334-L336 VanDerWaalsContact C-N 3.33Å; S334-L336 PolarHBondContact O-N 2.98Å; L336-R339 PolarHBondContact O-N 3.01Å; L336-R340 WeakPolarHBondContact O-CB 3.35Å; L336-R340 PolarHBondContact O-N 3.36Å |
| 337 | V | 96.9 | Very high | 94.3 | Very high | 3 Ų | 3 | 82.8 Ų | 82.8 | 2% | 0.018 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -59.1 | -49.5 | 172.4 | 168.8 | 0 | 0 | 0 | 0 | 110.5 | F133 Y136 F140 Y194 L333 S334 R339 R340 L341 | F133-V337 HydrophobicContact CD2-CG1 4.21Å; Y136-V337 HydrophobicContact CD1-CG2 4.19Å; Y136-V337 HydrophobicContact CD2-CB 4.44Å; Y136-V337 HydrophobicContact CD2-CG1 3.45Å; Y136-V337 VanDerWaalsContact CD2-CG1 3.45Å; Y136-V337 HydrophobicContact CD2-CG2 4.07Å; Y136-V337 HydrophobicContact CE2-CG1 4.09Å; Y136-V337 HydrophobicContact CG-CG1 3.96Å; Y136-V337 HydrophobicContact CG-CG2 3.83Å; F140-V337 HydrophobicContact CE2-CG2 4.08Å; F140-V337 HydrophobicContact CZ-CG2 4.19Å; Y194-V337 HydrophobicContact CD2-CG2 3.63Å; Y194-V337 HydrophobicContact CE2-CG2 4.06Å; L333-V337 WeakPolarHBondContact O-CG2 3.22Å; L333-V337 PolarHBondContact O-N 3.37Å; S334-V337 WeakPolarHBondContact O-CB 3.43Å; S334-V337 PolarHBondContact O-N 3.03Å; V337-R339 VanDerWaalsContact C-N 3.34Å; V337-R339 PolarHBondContact O-N 3.33Å; V337-R340 WeakPolarHBondContact O-CB 3.4Å; V337-R340 PolarHBondContact O-N 3.46Å; V337-R340 VanDerWaalsContact O-N 3.13Å; V337-L341 HydrophobicContact CG1-CD1 3.82Å; V337-L341 HydrophobicContact CG1-CG 4.27Å; V337-L341 WeakPolarHBondContact O-CG 3.31Å; V337-L341 PolarHBondContact O-N 3.24Å |
| 338 | Q | 96.9 | Very high | 94 | Very high | 67 Ų | 67 | 83.4 Ų | 83.4 | 31% | 0.313 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -55.8 | -49.6 | 179.5 | -174.7 | 62.7 | 44.4 | 0 | 0 | 111.2 | F133 S334 Q335 R340 L341 D342 | F133-Q338 HydrophobicContact CD2-CB 4.22Å; F133-Q338 HydrophobicContact CE2-CB 4.04Å; S334-Q338 PolarHBondContact O-N 3.05Å; Q335-Q338 PolarHBondContact O-N 2.93Å; Q338-R340 VanDerWaalsContact C-N 3.3Å; Q338-R340 PolarHBondContact O-N 3.29Å; Q338-L341 PolarHBondContact O-N 3.42Å; Q338-L341 VanDerWaalsContact O-N 3.13Å; Q338-D342 PolarHBondContact NE2-OD1 3.17Å; Q338-D342 PolarHBondContact O-N 2.74Å |
| 339 | R | 96.9 | Very high | 93.8 | Very high | 162 Ų | 162 | 82.7 Ų | 82.7 | 61% | 0.611 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -58.3 | -41.2 | 177.6 | -70.3 | 174.2 | -176 | -177.1 | 1.3 | 112.5 | Q335 L336 V337 D342 Q343 | Q335-R339 WeakPolarHBondContact O-CG 3.43Å; Q335-R339 PolarHBondContact O-N 3.25Å; Q335-R339 VanDerWaalsContact O-N 3.09Å; L336-R339 PolarHBondContact O-N 3.01Å; V337-R339 VanDerWaalsContact C-N 3.34Å; V337-R339 PolarHBondContact O-N 3.33Å; R339-D342 PolarHBondContact O-N 3.3Å; R339-Q343 VanDerWaalsContact O-CG 3.3Å; R339-Q343 WeakPolarHBondContact O-CG 3.33Å; R339-Q343 PolarHBondContact O-N 3.41Å; R339-Q343 VanDerWaalsContact O-N 3.09Å |
| 340 | R | 95.2 | Very high | 93.5 | Very high | 96 Ų | 96 | 86.4 Ų | 86.4 | 36% | 0.362 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.7 | -40.8 | 177.4 | -175.2 | -171.8 | -74.4 | 177 | -4.9 | 111.5 | Y194 L336 V337 Q338 Q343 K344 | Y194-R340 VanDerWaalsContact CE2-NH2 3.33Å; Y194-R340 PolarHBondContact O-NH1 2.85Å; Y194-R340 PolarHBondContact OH-NH2 3.17Å; Y194-R340 VanDerWaalsContact OH-NH2 3.08Å; L336-R340 WeakPolarHBondContact O-CB 3.35Å; L336-R340 PolarHBondContact O-N 3.36Å; V337-R340 WeakPolarHBondContact O-CB 3.4Å; V337-R340 PolarHBondContact O-N 3.46Å; V337-R340 VanDerWaalsContact O-N 3.13Å; Q338-R340 VanDerWaalsContact C-N 3.3Å; Q338-R340 PolarHBondContact O-N 3.29Å; R340-Q343 PolarHBondContact O-N 2.93Å; R340-K344 PolarHBondContact O-N 3.41Å |
| 341 | L | 94.8 | Very high | 93.2 | Very high | 27 Ų | 27 | 91.1 Ų | 91.1 | 14% | 0.141 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -69.6 | -39.5 | 178.3 | -66.7 | 175.4 | 0 | 0 | 0 | 112 | E132 F133 V337 Q338 Q343 K344 T345 | E132-L341 HydrophobicContact CB-CD1 4.17Å; E132-L341 HydrophobicContact CB-CD2 4.01Å; E132-L341 WeakPolarHBondContact OE2-CD2 3.29Å; F133-L341 HydrophobicContact CB-CD1 3.74Å; V337-L341 HydrophobicContact CG1-CD1 3.82Å; V337-L341 HydrophobicContact CG1-CG 4.27Å; V337-L341 WeakPolarHBondContact O-CG 3.31Å; V337-L341 PolarHBondContact O-N 3.24Å; Q338-L341 PolarHBondContact O-N 3.42Å; Q338-L341 VanDerWaalsContact O-N 3.13Å; L341-Q343 VanDerWaalsContact C-N 3.29Å; L341-Q343 PolarHBondContact O-N 2.66Å; L341-K344 WeakPolarHBondContact O-CB 3.21Å; L341-K344 PolarHBondContact O-N 2.83Å; L341-K344 VanDerWaalsContact O-N 3.15Å; L341-T345 PolarHBondContact O-N 3.03Å; L341-T345 PolarHBondContact O-OG1 3.43Å |
| 342 | D | 94.4 | Very high | 92.9 | Very high | 75 Ų | 75 | 89.6 Ų | 89.6 | 40% | 0.401 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.5 | -38 | 175.4 | -64 | -20.1 | 0 | 0 | 0 | 111.3 | Q338 R339 T345 K346 | Q338-D342 PolarHBondContact NE2-OD1 3.17Å; Q338-D342 PolarHBondContact O-N 2.74Å; R339-D342 PolarHBondContact O-N 3.3Å; D342-T345 PolarHBondContact O-N 3.12Å; D342-K346 PolarHBondContact O-N 3.41Å |
| 343 | Q | 93.4 | Very high | 92.5 | Very high | 141 Ų | 141 | 89.3 Ų | 89.3 | 66% | 0.659 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -67.3 | -31.7 | 174.8 | -74.8 | 172.8 | -12.1 | 0 | 0 | 113.4 | R339 R340 L341 T345 | R339-Q343 VanDerWaalsContact O-CG 3.3Å; R339-Q343 WeakPolarHBondContact O-CG 3.33Å; R339-Q343 PolarHBondContact O-N 3.41Å; R339-Q343 VanDerWaalsContact O-N 3.09Å; R340-Q343 PolarHBondContact O-N 2.93Å; L341-Q343 VanDerWaalsContact C-N 3.29Å; L341-Q343 PolarHBondContact O-N 2.66Å; Q343-T345 VanDerWaalsContact C-N 3.27Å |
| 344 | K | 88.4 | Confident | 92.1 | Very high | 140 Ų | 140 | 94.9 Ų | 94.9 | 61% | 0.609 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -73 | -21.2 | 177.2 | -172.6 | -176.4 | 174.3 | -169.1 | 0 | 112.6 | E132 R340 L341 | E132-K344 IonicContact OE1-NZ 2.68Å; E132-K344 PolarHBondContact OE1-NZ 3.31Å; E132-K344 IonicContact OE2-NZ 3.03Å; E132-K344 PolarHBondContact OE2-NZ 3.27Å; R340-K344 PolarHBondContact O-N 3.41Å; L341-K344 WeakPolarHBondContact O-CB 3.21Å; L341-K344 PolarHBondContact O-N 2.83Å; L341-K344 VanDerWaalsContact O-N 3.15Å |
| 345 | T | 81.8 | Confident | 91.6 | Very high | 125 Ų | 125 | 101.6 Ų | 101.6 | 77% | 0.767 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -95.9 | -13.3 | -176.2 | -46.2 | 0 | 0 | 0 | 0 | 112.5 | L341 D342 Q343 | L341-T345 PolarHBondContact O-N 3.03Å; L341-T345 PolarHBondContact O-OG1 3.43Å; D342-T345 PolarHBondContact O-N 3.12Å; Q343-T345 VanDerWaalsContact C-N 3.27Å |
| 346 | K | 65.9 | Low | 91.1 | Very high | 233 Ų | 233 | 103.5 Ų | 103.5 | 100% | 1.013 | 48% | 0.478 | S | S | * | . | trans | -87.7 | 0 | 169.5 | -70 | 178.7 | -179.6 | -177.7 | 0 | 109.7 | D342 | D342-K346 PolarHBondContact O-N 3.41Š|
Retrieved 346 of 346 residues in 159.7 ms
(Link to these results)