| 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 | 37.9 | Very low | 45.8 | Very low | 214 Ų | 214 | 148.7 Ų | 148.7 | 100% | 1.054 | 74% | 0.739 | S | S | * | * | 0 | 96.7 | 0 | -70.9 | 179.7 | -173.9 | 0 | 0 | 108 | |||||
| 2 | V | 35.2 | Very low | 46 | Very low | 125 Ų | 125 | 144.8 Ų | 144.8 | 76% | 0.758 | 74% | 0.737 | S | S | * | * | trans | -90.5 | 111.3 | -179.4 | 177.3 | 0 | 0 | 0 | 0 | 107.9 | L4 | V2-L4 VanDerWaalsContact C-N 3.27Å; V2-L4 HydrophobicContact CG1-CB 4.29Å; V2-L4 HydrophobicContact CG1-CD1 3.45Å; V2-L4 VanDerWaalsContact CG1-CD1 3.45Å; V2-L4 HydrophobicContact CG1-CG 3.62Å; V2-L4 PolarHBondContact O-N 2.86Å; V2-L4 VanDerWaalsContact O-N 3.08Å | ||
| 3 | W | 41.8 | Very low | 46.1 | Very low | 109 Ų | 109 | 138.8 Ų | 138.8 | 41% | 0.413 | 71% | 0.713 | S | S | . | * | trans | -81.9 | 67.4 | 178.8 | -70.6 | 93.7 | 0 | 0 | 0 | 110.6 | I5 R26 P105 | W3-I5 PolarHBondContact O-N 3.5Å; W3-R26 VanDerWaalsContact CH2-NE 3.33Å; W3-P105 HydrophobicContact CH2-CB 3.62Å; W3-P105 HydrophobicContact CH2-CG 3.45Å; W3-P105 VanDerWaalsContact CH2-CG 3.45Å; W3-P105 HydrophobicContact CZ2-CG 4.16Å; W3-P105 HydrophobicContact CZ3-CB 3.82Å; W3-P105 HydrophobicContact CZ3-CG 4.02Å | ||
| 4 | L | 39.8 | Very low | 46.9 | Very low | 152 Ų | 152 | 140.3 Ų | 140.3 | 80% | 0.796 | 72% | 0.721 | S | S | * | * | trans | -95.5 | 93.9 | 173.7 | -79.1 | 164.3 | 0 | 0 | 0 | 109.6 | V2 R6 | V2-L4 VanDerWaalsContact C-N 3.27Å; V2-L4 HydrophobicContact CG1-CB 4.29Å; V2-L4 HydrophobicContact CG1-CD1 3.45Å; V2-L4 VanDerWaalsContact CG1-CD1 3.45Å; V2-L4 HydrophobicContact CG1-CG 3.62Å; V2-L4 PolarHBondContact O-N 2.86Å; V2-L4 VanDerWaalsContact O-N 3.08Å; L4-R6 PolarHBondContact O-N 2.88Å | ||
| 5 | I | 47.9 | Very low | 46.5 | Very low | 98 Ų | 98 | 140.8 Ų | 140.8 | 50% | 0.503 | 72% | 0.716 | S | S | . | * | trans | -78.3 | 117.1 | 161.6 | -64.1 | 174.1 | 0 | 0 | 0 | 106.7 | W3 R7 | W3-I5 PolarHBondContact O-N 3.5Å; I5-R7 PolarHBondContact O-N 2.89Å | ||
| 6 | R | 46.1 | Very low | 46.4 | Very low | 247 Ų | 247 | 139.7 Ų | 139.7 | 93% | 0.932 | 72% | 0.721 | S | S | * | * | trans | -53.8 | 109.3 | 172 | -147 | 179.2 | -163.7 | -177.7 | 4.2 | 108.1 | L4 K8 | L4-R6 PolarHBondContact O-N 2.88Å; R6-K8 PolarHBondContact O-N 3.44Å | ||
| 7 | R | 48.8 | Very low | 46.5 | Very low | 163 Ų | 163 | 140.3 Ų | 140.3 | 62% | 0.615 | 73% | 0.725 | S | S | * | * | trans | -58.3 | 135.2 | 176.4 | -84 | -173.8 | -176.6 | 179.8 | 3 | 108.6 | I5 | I5-R7 PolarHBondContact O-N 2.89Š| ||
| 8 | K | 50.1 | Low | 46.2 | Very low | 186 Ų | 186 | 141.6 Ų | 141.6 | 81% | 0.809 | 72% | 0.719 | S | S | * | * | trans | -81.6 | 115.2 | 167.2 | -164.1 | 178 | -176.5 | -178.2 | 0 | 106.4 | R6 G10 | R6-K8 PolarHBondContact O-N 3.44Å; K8-G10 PolarHBondContact O-N 3.01Å | ||
| 9 | D | 51.6 | Low | 45.9 | Very low | 165 Ų | 165 | 138.2 Ų | 138.2 | 88% | 0.882 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | 10.7 | -170.8 | -61 | -41.5 | 0 | 0 | 0 | 115.5 | ||
| 10 | G | 52.6 | Low | 45.8 | Very low | 69 Ų | 69 | 137 Ų | 137 | 71% | 0.711 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | 12.5 | -170.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | K8 | K8-G10 PolarHBondContact O-N 3.01Š|
| 11 | V | 52.1 | Low | 45.4 | Very low | 108 Ų | 108 | 138.4 Ų | 138.4 | 66% | 0.655 | 73% | 0.726 | S | S | * | * | trans | -119.9 | 105.5 | -178.8 | -169.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 12 | S | 48 | Very low | 45.8 | Very low | 102 Ų | 102 | 133.2 Ų | 133.2 | 71% | 0.713 | 71% | 0.71 | S | S | * | * | trans | -74 | 122.7 | 168.9 | 49 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 13 | P | 47.8 | Very low | 46.6 | Very low | 66 Ų | 66 | 130.9 Ų | 130.9 | 43% | 0.429 | 69% | 0.692 | S | S | . | * | trans | -68.3 | 142.9 | 172.5 | 27.7 | -32.3 | 0 | 0 | 0 | 110.5 | F15 R18 | P13-F15 PolarHBondContact O-N 3.5Å; P13-R18 HydrophobicContact CG-CG 4.18Å | ||
| 14 | I | 56.5 | Low | 47.7 | Very low | 160 Ų | 160 | 128.6 Ų | 128.6 | 82% | 0.821 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -65.3 | -15.8 | -179.1 | -66.7 | 167.1 | 0 | 0 | 0 | 112.3 | ||
| 15 | F | 40.9 | Very low | 49.3 | Very low | 148 Ų | 148 | 128.7 Ų | 128.7 | 65% | 0.649 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -127.5 | 139.4 | -179.3 | -82.2 | -85.8 | 0 | 0 | 0 | 113 | P13 L17 | P13-F15 PolarHBondContact O-N 3.5Å; F15-L17 PolarHBondContact O-N 3.36Å; F15-L17 VanDerWaalsContact O-N 3.07Å |
| 16 | P | 45.7 | Very low | 50.4 | Low | 123 Ų | 123 | 126.3 Ų | 126.3 | 80% | 0.799 | 67% | 0.674 | S | S | * | * | trans | -82.6 | 32.9 | -175.5 | 36 | -36.8 | 0 | 0 | 0 | 113.8 | R18 | P16-R18 PolarHBondContact O-N 2.95Å; P16-R18 VanDerWaalsContact O-N 3.11Å | ||
| 17 | L | 46.8 | Very low | 51.9 | Low | 150 Ų | 150 | 118.4 Ų | 118.4 | 79% | 0.785 | 65% | 0.65 | S | S | * | * | trans | -83.2 | 28.2 | 176.9 | -68.7 | 169.9 | 0 | 0 | 0 | 112.9 | F15 G19 | F15-L17 PolarHBondContact O-N 3.36Å; F15-L17 VanDerWaalsContact O-N 3.07Å; L17-G19 PolarHBondContact O-N 3.25Å | ||
| 18 | R | 42.6 | Very low | 53.4 | Low | 163 Ų | 163 | 112 Ų | 112 | 62% | 0.615 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -5.8 | -173.3 | -99.5 | -174.8 | 170.3 | -177.6 | 0.2 | 115.1 | P13 P16 | P13-R18 HydrophobicContact CG-CG 4.18Å; P16-R18 PolarHBondContact O-N 2.95Å; P16-R18 VanDerWaalsContact O-N 3.11Å |
| 19 | G | 40.6 | Very low | 55 | Low | 78 Ų | 78 | 104.6 Ų | 104.6 | 80% | 0.804 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.4 | -19.8 | -167.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | L17 | L17-G19 PolarHBondContact O-N 3.25Š|
| 20 | C | 43.5 | Very low | 56.6 | Low | 114 Ų | 114 | 99.4 Ų | 99.4 | 77% | 0.77 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.6 | -15.2 | -168.8 | -106.8 | 0 | 0 | 0 | 0 | 116.2 | ||
| 21 | F | 37.2 | Very low | 58.4 | Low | 166 Ų | 166 | 99.7 Ų | 99.7 | 73% | 0.728 | 56% | 0.56 | S | S | * | * | trans | -142.7 | 91.9 | 179.4 | -74.2 | -82.6 | 0 | 0 | 0 | 110.8 | L23 | F21-L23 HydrophobicContact CD1-CD1 4.1Å; F21-L23 HydrophobicContact CD1-CG 4.45Å; F21-L23 PolarHBondContact O-N 3.32Å | ||
| 22 | C | 46.3 | Very low | 60.2 | Low | 106 Ų | 106 | 96.9 Ų | 96.9 | 72% | 0.716 | 55% | 0.545 | S | S | * | . | trans | -73.7 | 47.4 | 164.8 | -72.3 | 0 | 0 | 0 | 0 | 111.2 | D24 | C22-D24 PolarHBondContact O-N 3.03Š| ||
| 23 | L | 51.9 | Low | 62.2 | Low | 75 Ų | 75 | 92 Ų | 92 | 39% | 0.393 | 51% | 0.511 | S | S | . | . | trans | -76.6 | 112.1 | 167.1 | -71.5 | 171.3 | 0 | 0 | 0 | 106.8 | F21 N25 L27 I31 | F21-L23 HydrophobicContact CD1-CD1 4.1Å; F21-L23 HydrophobicContact CD1-CG 4.45Å; F21-L23 PolarHBondContact O-N 3.32Å; L23-N25 PolarHBondContact O-N 3.35Å; L23-L27 HydrophobicContact CD2-CD2 3.4Å; L23-L27 HydrophobicContact CD2-CG 3.81Å; L23-I31 HydrophobicContact CD2-CD1 3.88Å | ||
| 24 | D | 65.7 | Low | 64.3 | Low | 61 Ų | 61 | 91.7 Ų | 91.7 | 33% | 0.326 | 51% | 0.505 | S | S | . | . | trans | -52.7 | 140.1 | 167.6 | -80.2 | -35.4 | 0 | 0 | 0 | 109.1 | C22 R26 L27 G28 | C22-D24 PolarHBondContact O-N 3.03Å; D24-R26 CarbonylContact O-C 3.55Å; D24-R26 PolarHBondContact O-N 3.43Å; D24-L27 HydrophobicContact CB-CB 4.37Å; D24-L27 CarbonylContact O-C 3.59Å; D24-L27 WeakPolarHBondContact O-CA 3.43Å; D24-L27 WeakPolarHBondContact O-CB 3.47Å; D24-L27 PolarHBondContact O-N 3.39Å; D24-G28 PolarHBondContact O-N 3Å | ||
| 25 | N | 72.3 | Confident | 66.1 | Low | 155 Ų | 155 | 87.8 Ų | 87.8 | 83% | 0.829 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -49.7 | -31.1 | 179.8 | -72 | -10.2 | 0 | 0 | 0 | 112.5 | L23 C29 | L23-N25 PolarHBondContact O-N 3.35Å; N25-C29 VanDerWaalsContact O-CB 3.23Å; N25-C29 WeakPolarHBondContact O-CB 3.4Å; N25-C29 PolarHBondContact O-N 3.25Å |
| 26 | R | 70.3 | Confident | 68.6 | Low | 48 Ų | 48 | 81.3 Ų | 81.3 | 18% | 0.181 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -68.2 | -44.6 | 174.1 | -172 | 178.3 | -175 | 141.4 | 4.9 | 112.8 | W3 D24 C29 F30 I102 | W3-R26 VanDerWaalsContact CH2-NE 3.33Å; D24-R26 CarbonylContact O-C 3.55Å; D24-R26 PolarHBondContact O-N 3.43Å; R26-C29 PolarHBondContact O-N 3.19Å; R26-F30 WeakPolarHBondContact O-CB 3.23Å; R26-F30 PolarHBondContact O-N 3.08Å; R26-I102 HydrophobicContact CG-CG2 4.2Å; R26-I102 PolarHBondContact NH2-O 3.09Å |
| 27 | L | 77.8 | Confident | 70.9 | Confident | 80 Ų | 80 | 76.2 Ų | 76.2 | 42% | 0.419 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -68 | -41.7 | 177 | -175.8 | 62.9 | 0 | 0 | 0 | 110.8 | L23 D24 C29 F30 I31 | L23-L27 HydrophobicContact CD2-CD2 3.4Å; L23-L27 HydrophobicContact CD2-CG 3.81Å; D24-L27 HydrophobicContact CB-CB 4.37Å; D24-L27 CarbonylContact O-C 3.59Å; D24-L27 WeakPolarHBondContact O-CA 3.43Å; D24-L27 WeakPolarHBondContact O-CB 3.47Å; D24-L27 PolarHBondContact O-N 3.39Å; L27-C29 PolarHBondContact O-N 3.48Å; L27-F30 WeakPolarHBondContact O-CB 3.36Å; L27-F30 PolarHBondContact O-N 2.95Å; L27-I31 HydrophobicContact CD1-CD1 4.17Å; L27-I31 HydrophobicContact CD1-CG1 4.37Å; L27-I31 HydrophobicContact CG-CD1 3.91Å; L27-I31 VanDerWaalsContact O-CG1 3.28Å; L27-I31 WeakPolarHBondContact O-CG1 3.1Å; L27-I31 PolarHBondContact O-N 3.31Å |
| 28 | G | 81.7 | Confident | 73.2 | Confident | 28 Ų | 28 | 73.7 Ų | 73.7 | 29% | 0.289 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -59.4 | -45.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | D24 S32 | D24-G28 PolarHBondContact O-N 3Å; G28-S32 VanDerWaalsContact O-CB 3.25Å; G28-S32 WeakPolarHBondContact O-CB 3.45Å; G28-S32 PolarHBondContact O-N 3.08Å |
| 29 | C | 82.8 | Confident | 75.6 | Confident | 31 Ų | 31 | 68.9 Ų | 68.9 | 21% | 0.209 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -64.2 | -39.7 | 174.7 | -178.9 | 0 | 0 | 0 | 0 | 112.4 | N25 R26 L27 S32 T33 L117 | N25-C29 VanDerWaalsContact O-CB 3.23Å; N25-C29 WeakPolarHBondContact O-CB 3.4Å; N25-C29 PolarHBondContact O-N 3.25Å; R26-C29 PolarHBondContact O-N 3.19Å; L27-C29 PolarHBondContact O-N 3.48Å; C29-S32 PolarHBondContact O-N 3.07Å; C29-T33 WeakPolarHBondContact O-CB 3.3Å; C29-T33 PolarHBondContact O-N 3.43Å; C29-T33 PolarHBondContact O-OG1 3.38Å; C29-L117 WeakPolarHBondContact SG-CD2 3.26Å |
| 30 | F | 86.5 | Confident | 78.1 | Confident | 57 Ų | 57 | 65.3 Ų | 65.3 | 25% | 0.25 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -62.5 | -49.5 | 176.9 | -173.8 | -113.1 | 0 | 0 | 0 | 112.1 | R26 L27 S32 T33 I34 I99 I102 | R26-F30 WeakPolarHBondContact O-CB 3.23Å; R26-F30 PolarHBondContact O-N 3.08Å; L27-F30 WeakPolarHBondContact O-CB 3.36Å; L27-F30 PolarHBondContact O-N 2.95Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 3.48Å; F30-T33 PolarHBondContact O-N 2.89Å; F30-I34 HydrophobicContact CD1-CD1 3.7Å; F30-I34 HydrophobicContact CD2-CD1 4.42Å; F30-I34 HydrophobicContact CE1-CD1 3.3Å; F30-I34 HydrophobicContact CE2-CD1 4.09Å; F30-I34 HydrophobicContact CG-CD1 4.26Å; F30-I34 HydrophobicContact CZ-CD1 3.53Å; F30-I34 HydrophobicContact CZ-CG1 4.47Å; F30-I34 WeakPolarHBondContact O-CG1 3.4Å; F30-I34 PolarHBondContact O-N 3.15Å; F30-I99 HydrophobicContact CE2-CG2 4.19Å; F30-I102 HydrophobicContact CB-CG2 4.12Å; F30-I102 HydrophobicContact CD2-CB 4Å; F30-I102 HydrophobicContact CD2-CD1 4.41Å; F30-I102 HydrophobicContact CD2-CG2 3.54Å; F30-I102 HydrophobicContact CE2-CG2 4.29Å; F30-I102 HydrophobicContact CG-CG2 4.14Å |
| 31 | I | 88.8 | Confident | 80.5 | Confident | 74 Ų | 74 | 61.4 Ų | 61.4 | 38% | 0.379 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.8 | -43.8 | 177 | -65.7 | 166.7 | 0 | 0 | 0 | 110.4 | L23 L27 T33 I34 T35 | L23-I31 HydrophobicContact CD2-CD1 3.88Å; L27-I31 HydrophobicContact CD1-CD1 4.17Å; L27-I31 HydrophobicContact CD1-CG1 4.37Å; L27-I31 HydrophobicContact CG-CD1 3.91Å; L27-I31 VanDerWaalsContact O-CG1 3.28Å; L27-I31 WeakPolarHBondContact O-CG1 3.1Å; L27-I31 PolarHBondContact O-N 3.31Å; I31-T33 VanDerWaalsContact C-N 3.32Å; I31-T33 PolarHBondContact O-N 3.47Å; I31-I34 PolarHBondContact O-N 2.99Å; I31-T35 HydrophobicContact CG2-CG2 4.43Å; I31-T35 WeakPolarHBondContact O-CB 3.39Å; I31-T35 WeakPolarHBondContact O-CG2 3.32Å; I31-T35 PolarHBondContact O-N 3.22Å; I31-T35 PolarHBondContact O-OG1 3.43Å |
| 32 | S | 89.9 | Confident | 83.2 | Confident | 50 Ų | 50 | 57.5 Ų | 57.5 | 35% | 0.35 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61 | -39.9 | 176.1 | 177.3 | 0 | 0 | 0 | 0 | 112.3 | G28 C29 F30 T35 T36 | G28-S32 VanDerWaalsContact O-CB 3.25Å; G28-S32 WeakPolarHBondContact O-CB 3.45Å; G28-S32 PolarHBondContact O-N 3.08Å; C29-S32 PolarHBondContact O-N 3.07Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 3.48Å; S32-T35 WeakPolarHBondContact CA-OG1 3.4Å; S32-T35 PolarHBondContact O-OG1 3.41Å; S32-T36 WeakPolarHBondContact O-CB 3.44Å; S32-T36 PolarHBondContact O-N 2.93Å; S32-T36 PolarHBondContact O-OG1 3.34Å |
| 33 | T | 90.3 | Very high | 85.4 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -70.8 | -39.5 | 178.6 | -48.7 | 0 | 0 | 0 | 0 | 111.4 | C29 F30 I31 T36 A37 S95 V98 I99 W120 | C29-T33 WeakPolarHBondContact O-CB 3.3Å; C29-T33 PolarHBondContact O-N 3.43Å; C29-T33 PolarHBondContact O-OG1 3.38Å; F30-T33 PolarHBondContact O-N 2.89Å; I31-T33 VanDerWaalsContact C-N 3.32Å; I31-T33 PolarHBondContact O-N 3.47Å; T33-T36 PolarHBondContact O-N 3.33Å; T33-A37 WeakPolarHBondContact O-CB 3.31Å; T33-A37 PolarHBondContact O-N 2.78Å; T33-S95 WeakPolarHBondContact CG2-O 3.41Å; T33-V98 HydrophobicContact CG2-CB 3.96Å; T33-V98 HydrophobicContact CG2-CG1 3.85Å; T33-I99 HydrophobicContact CG2-CD1 4.2Å; T33-I99 HydrophobicContact CG2-CG1 3.69Å; T33-W120 HydrophobicContact CG2-CZ2 4.26Å |
| 34 | I | 92.9 | Very high | 87.3 | Confident | 58 Ų | 58 | 54.7 Ų | 54.7 | 30% | 0.297 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63.7 | -48.5 | 175.9 | -71.9 | 171.5 | 0 | 0 | 0 | 111.1 | F30 I31 T36 A37 I38 I99 | F30-I34 HydrophobicContact CD1-CD1 3.7Å; F30-I34 HydrophobicContact CD2-CD1 4.42Å; F30-I34 HydrophobicContact CE1-CD1 3.3Å; F30-I34 HydrophobicContact CE2-CD1 4.09Å; F30-I34 HydrophobicContact CG-CD1 4.26Å; F30-I34 HydrophobicContact CZ-CD1 3.53Å; F30-I34 HydrophobicContact CZ-CG1 4.47Å; F30-I34 WeakPolarHBondContact O-CG1 3.4Å; F30-I34 PolarHBondContact O-N 3.15Å; I31-I34 PolarHBondContact O-N 2.99Å; I34-T36 VanDerWaalsContact C-N 3.27Å; I34-T36 PolarHBondContact O-N 3.07Å; I34-A37 PolarHBondContact O-N 2.76Å; I34-A37 VanDerWaalsContact O-N 3.13Å; I34-I38 HydrophobicContact CG2-CD1 3.77Å; I34-I38 HydrophobicContact CG2-CG1 4.42Å; I34-I38 WeakPolarHBondContact O-CG1 3.33Å; I34-I38 PolarHBondContact O-N 3.11Å; I34-I99 HydrophobicContact CG1-CD1 4.12Å; I34-I99 HydrophobicContact CG1-CG1 4.27Å |
| 35 | T | 93.3 | Very high | 88.7 | Confident | 78 Ų | 78 | 56.2 Ų | 56.2 | 48% | 0.479 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.6 | -38.3 | 178.3 | 47.8 | 0 | 0 | 0 | 0 | 111.5 | I31 S32 S39 | I31-T35 HydrophobicContact CG2-CG2 4.43Å; I31-T35 WeakPolarHBondContact O-CB 3.39Å; I31-T35 WeakPolarHBondContact O-CG2 3.32Å; I31-T35 PolarHBondContact O-N 3.22Å; I31-T35 PolarHBondContact O-OG1 3.43Å; S32-T35 WeakPolarHBondContact CA-OG1 3.4Å; S32-T35 PolarHBondContact O-OG1 3.41Å; T35-S39 WeakPolarHBondContact O-CB 3.45Å; T35-S39 PolarHBondContact O-N 2.9Å; T35-S39 PolarHBondContact O-OG 3.49Å |
| 36 | T | 93.5 | Very high | 89.6 | Confident | 13 Ų | 13 | 54.6 Ų | 54.6 | 8% | 0.08 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.9 | -45.3 | 171.9 | -57.1 | 0 | 0 | 0 | 0 | 111.6 | S32 T33 I34 I38 S39 S40 L91 W120 M124 | S32-T36 WeakPolarHBondContact O-CB 3.44Å; S32-T36 PolarHBondContact O-N 2.93Å; S32-T36 PolarHBondContact O-OG1 3.34Å; T33-T36 PolarHBondContact O-N 3.33Å; I34-T36 VanDerWaalsContact C-N 3.27Å; I34-T36 PolarHBondContact O-N 3.07Å; T36-I38 PolarHBondContact O-N 3.45Å; T36-S39 WeakPolarHBondContact CA-OG 3.43Å; T36-S39 PolarHBondContact O-N 3.34Å; T36-S39 PolarHBondContact O-OG 3.23Å; T36-S39 VanDerWaalsContact O-OG 3.06Å; T36-S40 VanDerWaalsContact O-CB 3.24Å; T36-S40 WeakPolarHBondContact O-CB 3.23Å; T36-S40 PolarHBondContact O-N 2.97Å; T36-S40 PolarHBondContact O-OG 2.88Å; T36-L91 HydrophobicContact CG2-CD1 4.08Å; T36-L91 HydrophobicContact CG2-CD2 4Å; T36-L91 HydrophobicContact CG2-CG 4.15Å; T36-W120 HydrophobicContact CG2-CZ2 4.2Å; T36-M124 HydrophobicContact CG2-CE 3.81Å; T36-M124 HydrophobicContact CG2-SD 3.5Å; T36-M124 VanDerWaalsContact CG2-SD 3.5Å |
| 37 | A | 93.7 | Very high | 90.5 | Very high | 16 Ų | 16 | 53 Ų | 53 | 13% | 0.132 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.8 | -45.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T33 I34 S40 A41 I99 | T33-A37 WeakPolarHBondContact O-CB 3.31Å; T33-A37 PolarHBondContact O-N 2.78Å; I34-A37 PolarHBondContact O-N 2.76Å; I34-A37 VanDerWaalsContact O-N 3.13Å; A37-S40 PolarHBondContact O-OG 3.42Å; A37-A41 VanDerWaalsContact O-CB 3.28Å; A37-A41 WeakPolarHBondContact O-CB 3.28Å; A37-A41 PolarHBondContact O-N 2.86Å; A37-I99 HydrophobicContact CB-CD1 3.91Å |
| 38 | I | 95.2 | Very high | 91.2 | Very high | 97 Ų | 97 | 51.2 Ų | 51.2 | 50% | 0.497 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.6 | -49.2 | 178.9 | -65.3 | 168.8 | 0 | 0 | 0 | 110.9 | I34 T36 A41 I42 | I34-I38 HydrophobicContact CG2-CD1 3.77Å; I34-I38 HydrophobicContact CG2-CG1 4.42Å; I34-I38 WeakPolarHBondContact O-CG1 3.33Å; I34-I38 PolarHBondContact O-N 3.11Å; T36-I38 PolarHBondContact O-N 3.45Å; I38-A41 PolarHBondContact O-N 2.71Å; I38-I42 HydrophobicContact CG2-CD1 3.9Å; I38-I42 WeakPolarHBondContact O-CG1 3.46Å; I38-I42 PolarHBondContact O-N 3.23Å |
| 39 | S | 93.7 | Very high | 91.5 | Very high | 61 Ų | 61 | 54.3 Ų | 54.3 | 43% | 0.427 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 178.8 | 50.7 | 0 | 0 | 0 | 0 | 111.9 | T35 T36 A41 I42 S43 | T35-S39 WeakPolarHBondContact O-CB 3.45Å; T35-S39 PolarHBondContact O-N 2.9Å; T35-S39 PolarHBondContact O-OG 3.49Å; T36-S39 WeakPolarHBondContact CA-OG 3.43Å; T36-S39 PolarHBondContact O-N 3.34Å; T36-S39 PolarHBondContact O-OG 3.23Å; T36-S39 VanDerWaalsContact O-OG 3.06Å; S39-A41 VanDerWaalsContact C-N 3.34Å; S39-A41 PolarHBondContact O-N 3.12Å; S39-I42 PolarHBondContact O-N 3.25Å; S39-S43 WeakPolarHBondContact O-CB 3.33Å; S39-S43 PolarHBondContact O-N 3.46Å; S39-S43 PolarHBondContact O-OG 3.49Å |
| 40 | S | 92.4 | Very high | 91.7 | Very high | 3 Ų | 3 | 56.3 Ų | 56.3 | 2% | 0.021 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.6 | -35.7 | 175.8 | 67.7 | 0 | 0 | 0 | 0 | 113 | T36 A37 W44 | T36-S40 VanDerWaalsContact O-CB 3.24Å; T36-S40 WeakPolarHBondContact O-CB 3.23Å; T36-S40 PolarHBondContact O-N 2.97Å; T36-S40 PolarHBondContact O-OG 2.88Å; A37-S40 PolarHBondContact O-OG 3.42Å; S40-W44 WeakPolarHBondContact O-CB 3.27Å; S40-W44 PolarHBondContact O-N 3.35Å |
| 41 | A | 94 | Very high | 91.7 | Very high | 32 Ų | 32 | 55.8 Ų | 55.8 | 26% | 0.264 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -67.3 | -43.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A37 I38 S39 W44 I45 L92 | A37-A41 VanDerWaalsContact O-CB 3.28Å; A37-A41 WeakPolarHBondContact O-CB 3.28Å; A37-A41 PolarHBondContact O-N 2.86Å; I38-A41 PolarHBondContact O-N 2.71Å; S39-A41 VanDerWaalsContact C-N 3.34Å; S39-A41 PolarHBondContact O-N 3.12Å; A41-W44 PolarHBondContact O-N 2.82Å; A41-I45 VanDerWaalsContact O-CG1 3.3Å; A41-I45 WeakPolarHBondContact O-CG1 3.49Å; A41-I45 PolarHBondContact O-N 2.9Å; A41-L92 HydrophobicContact CB-CD1 3.99Å |
| 42 | I | 93.9 | Very high | 91.6 | Very high | 85 Ų | 85 | 56.1 Ų | 56.1 | 44% | 0.436 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -61.7 | -49.1 | 174.9 | -67 | 168.1 | 0 | 0 | 0 | 109.9 | I38 S39 W44 I45 F46 | I38-I42 HydrophobicContact CG2-CD1 3.9Å; I38-I42 WeakPolarHBondContact O-CG1 3.46Å; I38-I42 PolarHBondContact O-N 3.23Å; S39-I42 PolarHBondContact O-N 3.25Å; I42-W44 VanDerWaalsContact C-N 3.3Å; I42-W44 PolarHBondContact O-N 2.95Å; I42-I45 PolarHBondContact O-N 3.49Å; I42-F46 HydrophobicContact CG2-CD2 3.82Å; I42-F46 HydrophobicContact CG2-CE2 3.53Å; I42-F46 WeakPolarHBondContact O-CD2 3.35Å; I42-F46 PolarHBondContact O-N 2.87Å; I42-F46 VanDerWaalsContact O-N 3.12Å |
| 43 | S | 92 | Very high | 91.2 | Very high | 48 Ų | 48 | 56.4 Ų | 56.4 | 34% | 0.336 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.8 | -40.9 | 176.3 | -66.7 | 0 | 0 | 0 | 0 | 112.3 | S39 F46 V47 N88 | S39-S43 WeakPolarHBondContact O-CB 3.33Å; S39-S43 PolarHBondContact O-N 3.46Å; S39-S43 PolarHBondContact O-OG 3.49Å; S43-F46 PolarHBondContact O-N 3.19Å; S43-V47 WeakPolarHBondContact O-CG2 3.37Å; S43-V47 PolarHBondContact O-N 2.97Å; S43-N88 WeakPolarHBondContact CB-OD1 3.27Å |
| 44 | W | 93.7 | Very high | 90.4 | Very high | 74 Ų | 74 | 59.1 Ų | 59.1 | 28% | 0.28 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.1 | -41.2 | 176.9 | -171 | 81.2 | 0 | 0 | 0 | 112.2 | S40 A41 I42 V47 V48 F85 N88 | S40-W44 WeakPolarHBondContact O-CB 3.27Å; S40-W44 PolarHBondContact O-N 3.35Å; A41-W44 PolarHBondContact O-N 2.82Å; I42-W44 VanDerWaalsContact C-N 3.3Å; I42-W44 PolarHBondContact O-N 2.95Å; W44-V47 PolarHBondContact O-N 3.42Å; W44-V48 HydrophobicContact CD2-CG2 4.04Å; W44-V48 HydrophobicContact CE3-CG2 4.07Å; W44-V48 HydrophobicContact CH2-CG2 3.95Å; W44-V48 HydrophobicContact CZ2-CG2 3.9Å; W44-V48 HydrophobicContact CZ3-CG2 4.02Å; W44-V48 WeakPolarHBondContact O-CG2 3.5Å; W44-V48 PolarHBondContact O-N 3.08Å; W44-F85 AromaticContact CE2-CE2 3.51Å; W44-F85 HydrophobicContact CH2-CE2 4.47Å; W44-F85 HydrophobicContact CZ2-CD2 4.36Å; W44-F85 AromaticContact CZ2-CE2 3.41Å; W44-F85 HydrophobicContact CZ2-CE2 3.41Å; W44-F85 VanDerWaalsContact CZ2-CE2 3.41Å; W44-F85 AromaticContact CZ2-CZ 3.83Å; W44-F85 HydrophobicContact CZ2-CZ 3.83Å; W44-F85 AromaticContact NE1-CD2 3.48Å; W44-F85 AromaticContact NE1-CE2 3.32Å; W44-F85 VanDerWaalsContact NE1-CE2 3.32Å; W44-F85 AromaticContact NE1-CZ 3.9Å; W44-N88 HydrophobicContact CB-CB 3.95Å; W44-N88 HydrophobicContact CG-CB 4.27Å |
| 45 | I | 93.2 | Very high | 89.6 | Confident | 92 Ų | 92 | 60.1 Ų | 60.1 | 47% | 0.472 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -60.4 | -46.2 | 175.5 | -68.5 | 162.7 | 0 | 0 | 0 | 110.7 | A41 I42 V47 V48 L49 | A41-I45 VanDerWaalsContact O-CG1 3.3Å; A41-I45 WeakPolarHBondContact O-CG1 3.49Å; A41-I45 PolarHBondContact O-N 2.9Å; I42-I45 PolarHBondContact O-N 3.49Å; I45-V47 PolarHBondContact O-N 3.48Å; I45-V48 PolarHBondContact O-N 3.19Å; I45-L49 HydrophobicContact CG2-CD1 4.1Å; I45-L49 HydrophobicContact CG2-CG 4.41Å; I45-L49 WeakPolarHBondContact O-CG 3.38Å; I45-L49 PolarHBondContact O-N 3.35Å |
| 46 | F | 91.4 | Very high | 88.8 | Confident | 122 Ų | 122 | 60.5 Ų | 60.5 | 54% | 0.535 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 177.7 | -78.6 | -68.5 | 0 | 0 | 0 | 112.2 | I42 S43 V48 L49 D50 | I42-F46 HydrophobicContact CG2-CD2 3.82Å; I42-F46 HydrophobicContact CG2-CE2 3.53Å; I42-F46 WeakPolarHBondContact O-CD2 3.35Å; I42-F46 PolarHBondContact O-N 2.87Å; I42-F46 VanDerWaalsContact O-N 3.12Å; S43-F46 PolarHBondContact O-N 3.19Å; F46-V48 VanDerWaalsContact C-N 3.28Å; F46-V48 PolarHBondContact O-N 2.9Å; F46-L49 WeakPolarHBondContact O-CB 3.26Å; F46-L49 PolarHBondContact O-N 3.37Å; F46-L49 VanDerWaalsContact O-N 3.11Å; F46-D50 PolarHBondContact O-N 3.24Å |
| 47 | V | 90.7 | Very high | 87.3 | Confident | 14 Ų | 14 | 65.7 Ų | 65.7 | 9% | 0.085 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -61.7 | -37.5 | 176.7 | 173.9 | 0 | 0 | 0 | 0 | 111.8 | S43 W44 I45 D50 L51 D81 M84 F85 | S43-V47 WeakPolarHBondContact O-CG2 3.37Å; S43-V47 PolarHBondContact O-N 2.97Å; W44-V47 PolarHBondContact O-N 3.42Å; I45-V47 PolarHBondContact O-N 3.48Å; V47-D50 PolarHBondContact O-N 3.5Å; V47-L51 HydrophobicContact CG1-CD1 4.25Å; V47-L51 WeakPolarHBondContact O-CG 3.29Å; V47-L51 PolarHBondContact O-N 3.42Å; V47-D81 HydrophobicContact CG1-CB 4.38Å; V47-D81 WeakPolarHBondContact CG1-O 3.4Å; V47-M84 HydrophobicContact CG2-CB 4.07Å; V47-F85 HydrophobicContact CG1-CB 3.76Å |
| 48 | V | 91.3 | Very high | 85.9 | Confident | 42 Ų | 42 | 71.5 Ų | 71.5 | 26% | 0.255 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65 | -43.4 | 174.2 | 169.2 | 0 | 0 | 0 | 0 | 111.2 | W44 I45 F46 D50 L51 V52 F85 | W44-V48 HydrophobicContact CD2-CG2 4.04Å; W44-V48 HydrophobicContact CE3-CG2 4.07Å; W44-V48 HydrophobicContact CH2-CG2 3.95Å; W44-V48 HydrophobicContact CZ2-CG2 3.9Å; W44-V48 HydrophobicContact CZ3-CG2 4.02Å; W44-V48 WeakPolarHBondContact O-CG2 3.5Å; W44-V48 PolarHBondContact O-N 3.08Å; I45-V48 PolarHBondContact O-N 3.19Å; F46-V48 VanDerWaalsContact C-N 3.28Å; F46-V48 PolarHBondContact O-N 2.9Å; V48-D50 VanDerWaalsContact C-N 3.3Å; V48-D50 PolarHBondContact O-N 2.9Å; V48-L51 PolarHBondContact O-N 2.94Å; V48-V52 HydrophobicContact CG1-CG2 4.26Å; V48-V52 WeakPolarHBondContact O-CB 3.48Å; V48-V52 VanDerWaalsContact O-CG2 3.23Å; V48-V52 WeakPolarHBondContact O-CG2 3.22Å; V48-V52 PolarHBondContact O-N 3.5Å; V48-F85 HydrophobicContact CG2-CD2 3.81Å; V48-F85 HydrophobicContact CG2-CE2 3.61Å |
| 49 | L | 89.2 | Confident | 84.2 | Confident | 93 Ų | 93 | 70.7 Ų | 70.7 | 49% | 0.487 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.5 | -39.4 | 176.1 | -69.3 | 172.4 | 0 | 0 | 0 | 111.6 | I45 F46 V52 T53 | I45-L49 HydrophobicContact CG2-CD1 4.1Å; I45-L49 HydrophobicContact CG2-CG 4.41Å; I45-L49 WeakPolarHBondContact O-CG 3.38Å; I45-L49 PolarHBondContact O-N 3.35Å; F46-L49 WeakPolarHBondContact O-CB 3.26Å; F46-L49 PolarHBondContact O-N 3.37Å; F46-L49 VanDerWaalsContact O-N 3.11Å; L49-V52 PolarHBondContact O-N 3.03Å; L49-T53 WeakPolarHBondContact O-CB 3.32Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.15Å |
| 50 | D | 85.9 | Confident | 82.3 | Confident | 73 Ų | 73 | 72.8 Ų | 72.8 | 39% | 0.39 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.9 | -49.1 | 175.5 | -69.2 | -28.8 | 0 | 0 | 0 | 110.6 | F46 V47 V48 V52 T53 W54 | F46-D50 PolarHBondContact O-N 3.24Å; V47-D50 PolarHBondContact O-N 3.5Å; V48-D50 VanDerWaalsContact C-N 3.3Å; V48-D50 PolarHBondContact O-N 2.9Å; D50-V52 VanDerWaalsContact C-N 3.32Å; D50-V52 PolarHBondContact O-N 3.39Å; D50-T53 WeakPolarHBondContact O-CB 3.26Å; D50-T53 PolarHBondContact O-N 3.34Å; D50-T53 VanDerWaalsContact O-N 3.17Å; D50-W54 PolarHBondContact O-N 2.9Å; D50-W54 VanDerWaalsContact O-N 3.08Å |
| 51 | L | 87 | Confident | 80.7 | Confident | 46 Ų | 46 | 76.3 Ų | 76.3 | 24% | 0.241 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -61.8 | -36.1 | 176.5 | -70.5 | 173.3 | 0 | 0 | 0 | 113.3 | V47 V48 W54 A55 D81 I82 F85 | V47-L51 HydrophobicContact CG1-CD1 4.25Å; V47-L51 WeakPolarHBondContact O-CG 3.29Å; V47-L51 PolarHBondContact O-N 3.42Å; V48-L51 PolarHBondContact O-N 2.94Å; L51-W54 PolarHBondContact O-N 3.43Å; L51-A55 PolarHBondContact O-N 3.4Å; L51-D81 HydrophobicContact CD2-CB 3.79Å; L51-D81 HydrophobicContact CG-CB 4.15Å; L51-I82 HydrophobicContact CD2-CG1 3.9Å; L51-F85 HydrophobicContact CD1-CB 4.07Å; L51-F85 HydrophobicContact CD1-CD2 4.13Å; L51-F85 HydrophobicContact CD1-CG 4.22Å |
| 52 | V | 85.9 | Confident | 78.8 | Confident | 81 Ų | 81 | 79.8 Ų | 79.8 | 49% | 0.491 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -68 | -42 | 175.6 | 169.4 | 0 | 0 | 0 | 0 | 110.4 | V48 L49 D50 W54 A55 I56 | V48-V52 HydrophobicContact CG1-CG2 4.26Å; V48-V52 WeakPolarHBondContact O-CB 3.48Å; V48-V52 VanDerWaalsContact O-CG2 3.23Å; V48-V52 WeakPolarHBondContact O-CG2 3.22Å; V48-V52 PolarHBondContact O-N 3.5Å; L49-V52 PolarHBondContact O-N 3.03Å; D50-V52 VanDerWaalsContact C-N 3.32Å; D50-V52 PolarHBondContact O-N 3.39Å; V52-W54 PolarHBondContact O-N 3.26Å; V52-A55 PolarHBondContact O-N 3.47Å; V52-I56 PolarHBondContact O-N 2.87Å |
| 53 | T | 81.2 | Confident | 76.7 | Confident | 56 Ų | 56 | 80.4 Ų | 80.4 | 34% | 0.344 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -55.4 | -42.1 | 174.3 | -55.6 | 0 | 0 | 0 | 0 | 111.3 | L49 D50 A55 I56 F59 | L49-T53 WeakPolarHBondContact O-CB 3.32Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.15Å; D50-T53 WeakPolarHBondContact O-CB 3.26Å; D50-T53 PolarHBondContact O-N 3.34Å; D50-T53 VanDerWaalsContact O-N 3.17Å; T53-A55 VanDerWaalsContact C-N 3.27Å; T53-A55 PolarHBondContact O-N 2.69Å; T53-I56 PolarHBondContact O-N 3.27Å; T53-F59 HydrophobicContact CG2-CD2 3.66Å; T53-F59 HydrophobicContact CG2-CE2 3.48Å; T53-F59 VanDerWaalsContact CG2-CE2 3.48Å; T53-F59 HydrophobicContact CG2-CZ 4.32Å |
| 54 | W | 74 | Confident | 74.6 | Confident | 57 Ų | 57 | 85 Ų | 85 | 22% | 0.216 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -65.4 | -24.7 | 175.9 | -72.7 | 116.4 | 0 | 0 | 0 | 114.5 | D50 L51 V52 F59 I61 W74 I78 D81 | D50-W54 PolarHBondContact O-N 2.9Å; D50-W54 VanDerWaalsContact O-N 3.08Å; L51-W54 PolarHBondContact O-N 3.43Å; V52-W54 PolarHBondContact O-N 3.26Å; W54-F59 HydrophobicContact CE3-CD1 4.05Å; W54-F59 AromaticContact CE3-CE1 3.86Å; W54-F59 HydrophobicContact CE3-CE1 3.86Å; W54-F59 AromaticContact CH2-CE1 3.77Å; W54-F59 HydrophobicContact CH2-CE1 3.77Å; W54-F59 HydrophobicContact CH2-CZ 4.34Å; W54-F59 AromaticContact CZ3-CD1 3.89Å; W54-F59 HydrophobicContact CZ3-CD1 3.89Å; W54-F59 AromaticContact CZ3-CE1 3.37Å; W54-F59 HydrophobicContact CZ3-CE1 3.37Å; W54-F59 HydrophobicContact CZ3-CZ 4.3Å; W54-I61 HydrophobicContact CZ3-CD1 4.05Å; W54-I61 HydrophobicContact CZ3-CG1 4.27Å; W54-W74 HydrophobicContact CH2-CB 4.46Å; W54-W74 AromaticContact CH2-CD2 3.9Å; W54-W74 HydrophobicContact CH2-CD2 3.9Å; W54-W74 AromaticContact CH2-CE3 3.16Å; W54-W74 HydrophobicContact CH2-CE3 3.16Å; W54-W74 HydrophobicContact CH2-CG 4.49Å; W54-W74 HydrophobicContact CH2-CH2 4.44Å; W54-W74 AromaticContact CH2-CZ3 3.46Å; W54-W74 HydrophobicContact CH2-CZ3 3.46Å; W54-W74 VanDerWaalsContact CH2-CZ3 3.46Å; W54-W74 AromaticContact CZ2-CE3 3.55Å; W54-W74 HydrophobicContact CZ2-CE3 3.55Å; W54-W74 AromaticContact CZ2-CZ3 3.7Å; W54-W74 HydrophobicContact CZ2-CZ3 3.7Å; W54-W74 HydrophobicContact CZ3-CE3 4.34Å; W54-I78 HydrophobicContact CD2-CD1 3.95Å; W54-I78 HydrophobicContact CD2-CG1 3.7Å; W54-I78 HydrophobicContact CE3-CD1 3.87Å; W54-I78 HydrophobicContact CE3-CG1 4.13Å; W54-I78 HydrophobicContact CG-CD1 4.39Å; W54-I78 HydrophobicContact CG-CG1 3.96Å; W54-I78 HydrophobicContact CZ2-CG1 4.34Å; W54-I78 HydrophobicContact CZ3-CD1 4.31Å; W54-D81 PolarHBondContact NE1-OD2 2.92Å |
| 55 | A | 76.4 | Confident | 72.3 | Confident | 80 Ų | 80 | 87.3 Ų | 87.3 | 66% | 0.661 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -87.5 | -12.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | L51 V52 T53 | L51-A55 PolarHBondContact O-N 3.4Å; V52-A55 PolarHBondContact O-N 3.47Å; T53-A55 VanDerWaalsContact C-N 3.27Å; T53-A55 PolarHBondContact O-N 2.69Å |
| 56 | I | 77 | Confident | 70.2 | Confident | 85 Ų | 85 | 88.6 Ų | 88.6 | 44% | 0.436 | 49% | 0.488 | S | S | . | . | trans | -72.4 | 123.1 | 179.2 | -64.2 | 168.5 | 0 | 0 | 0 | 108.7 | V52 T53 D58 F59 | V52-I56 PolarHBondContact O-N 2.87Å; T53-I56 PolarHBondContact O-N 3.27Å; I56-D58 HydrophobicContact CG2-CB 4.25Å; I56-D58 PolarHBondContact O-N 2.91Å; I56-F59 VanDerWaalsContact O-CB 3.22Å; I56-F59 WeakPolarHBondContact O-CB 3.33Å; I56-F59 PolarHBondContact O-N 3.02Å | ||
| 57 | P | 62.4 | Low | 68.6 | Low | 123 Ų | 123 | 85.3 Ų | 85.3 | 80% | 0.799 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -23.7 | -175.6 | 26 | -34.6 | 0 | 0 | 0 | 113.3 | F59 | P57-F59 VanDerWaalsContact C-N 3.25Å; P57-F59 PolarHBondContact O-N 3.19Å |
| 58 | D | 63.7 | Low | 66.9 | Low | 138 Ų | 138 | 94.3 Ų | 94.3 | 74% | 0.738 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.8 | 7.5 | 175.9 | -59.4 | -37.4 | 0 | 0 | 0 | 113 | I56 V60 | I56-D58 HydrophobicContact CG2-CB 4.25Å; I56-D58 PolarHBondContact O-N 2.91Å; D58-V60 PolarHBondContact O-N 2.9Å |
| 59 | F | 59 | Low | 65.4 | Low | 79 Ų | 79 | 98.2 Ų | 98.2 | 35% | 0.346 | 52% | 0.522 | S | S | . | . | trans | -70.9 | 79.7 | 171.1 | -167.1 | -99.3 | 0 | 0 | 0 | 109.5 | T53 W54 I56 P57 I61 | T53-F59 HydrophobicContact CG2-CD2 3.66Å; T53-F59 HydrophobicContact CG2-CE2 3.48Å; T53-F59 VanDerWaalsContact CG2-CE2 3.48Å; T53-F59 HydrophobicContact CG2-CZ 4.32Å; W54-F59 HydrophobicContact CE3-CD1 4.05Å; W54-F59 AromaticContact CE3-CE1 3.86Å; W54-F59 HydrophobicContact CE3-CE1 3.86Å; W54-F59 AromaticContact CH2-CE1 3.77Å; W54-F59 HydrophobicContact CH2-CE1 3.77Å; W54-F59 HydrophobicContact CH2-CZ 4.34Å; W54-F59 AromaticContact CZ3-CD1 3.89Å; W54-F59 HydrophobicContact CZ3-CD1 3.89Å; W54-F59 AromaticContact CZ3-CE1 3.37Å; W54-F59 HydrophobicContact CZ3-CE1 3.37Å; W54-F59 HydrophobicContact CZ3-CZ 4.3Å; I56-F59 VanDerWaalsContact O-CB 3.22Å; I56-F59 WeakPolarHBondContact O-CB 3.33Å; I56-F59 PolarHBondContact O-N 3.02Å; P57-F59 VanDerWaalsContact C-N 3.25Å; P57-F59 PolarHBondContact O-N 3.19Å; F59-I61 HydrophobicContact CD1-CG1 3.96Å; F59-I61 HydrophobicContact CE1-CG1 3.74Å; F59-I61 PolarHBondContact O-N 2.9Å; F59-I61 VanDerWaalsContact O-N 3.11Å | ||
| 60 | V | 55 | Low | 64 | Low | 105 Ų | 105 | 97.9 Ų | 97.9 | 64% | 0.636 | 51% | 0.514 | S | S | * | . | trans | -70.9 | 104.2 | 169 | -178.2 | 0 | 0 | 0 | 0 | 106.3 | D58 D62 | D58-V60 PolarHBondContact O-N 2.9Å; V60-D62 VanDerWaalsContact C-N 3.28Å; V60-D62 PolarHBondContact O-N 3.2Å | ||
| 61 | I | 58.1 | Low | 62.7 | Low | 78 Ų | 78 | 99.2 Ų | 99.2 | 40% | 0.4 | 52% | 0.52 | S | S | . | . | trans | -60.2 | 103.3 | 160.7 | -60.4 | 170.4 | 0 | 0 | 0 | 104.7 | W54 F59 P63 W74 | W54-I61 HydrophobicContact CZ3-CD1 4.05Å; W54-I61 HydrophobicContact CZ3-CG1 4.27Å; F59-I61 HydrophobicContact CD1-CG1 3.96Å; F59-I61 HydrophobicContact CE1-CG1 3.74Å; F59-I61 PolarHBondContact O-N 2.9Å; F59-I61 VanDerWaalsContact O-N 3.11Å; I61-P63 VanDerWaalsContact O-CD 3.3Å; I61-P63 WeakPolarHBondContact O-CD 3.25Å; I61-W74 HydrophobicContact CD1-CG 4.43Å; I61-W74 HydrophobicContact CG2-CZ2 4.21Å | ||
| 62 | D | 53.4 | Low | 61.8 | Low | 104 Ų | 104 | 106.7 Ų | 106.7 | 56% | 0.556 | 55% | 0.545 | S | S | * | . | trans | -48.6 | 117.3 | -178 | -102.8 | -36.4 | 0 | 0 | 0 | 108.7 | V60 Q64 | V60-D62 VanDerWaalsContact C-N 3.28Å; V60-D62 PolarHBondContact O-N 3.2Å; D62-Q64 HydrophobicContact CB-CG 4.29Å; D62-Q64 PolarHBondContact O-N 3.38Å | ||
| 63 | P | 49.3 | Very low | 61 | Low | 98 Ų | 98 | 105 Ų | 105 | 64% | 0.636 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.1 | 11.8 | -177.3 | 28.5 | -34.3 | 0 | 0 | 0 | 112.4 | I61 F65 | I61-P63 VanDerWaalsContact O-CD 3.3Å; I61-P63 WeakPolarHBondContact O-CD 3.25Å; P63-F65 CarbonylContact O-C 3.53Å; P63-F65 PolarHBondContact O-N 3.46Å |
| 64 | Q | 48.7 | Very low | 60.6 | Low | 145 Ų | 145 | 106.1 Ų | 106.1 | 68% | 0.678 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | -9.7 | 177.2 | -69.9 | -173.8 | -4.2 | 0 | 0 | 113.6 | D62 | D62-Q64 HydrophobicContact CB-CG 4.29Å; D62-Q64 PolarHBondContact O-N 3.38Å |
| 65 | F | 45.4 | Very low | 60.7 | Low | 123 Ų | 123 | 110.4 Ų | 110.4 | 54% | 0.539 | 55% | 0.549 | S | S | . | . | S | Bend | trans | -120 | 87.1 | 167.7 | -57.3 | -75.7 | 0 | 0 | 0 | 111.6 | P63 T67 | P63-F65 CarbonylContact O-C 3.53Å; P63-F65 PolarHBondContact O-N 3.46Å; F65-T67 PolarHBondContact O-N 2.87Å |
| 66 | P | 50 | Low | 61 | Low | 119 Ų | 119 | 107.3 Ų | 107.3 | 77% | 0.773 | 53% | 0.526 | S | S | * | . | trans | -72.3 | 25.3 | -167 | 29.5 | -37.3 | 0 | 0 | 0 | 115.6 | ||||
| 67 | T | 56.3 | Low | 61.3 | Low | 53 Ų | 53 | 104.3 Ų | 104.3 | 33% | 0.325 | 51% | 0.509 | S | S | . | . | trans | -107.4 | 119 | -170.9 | 51.6 | 0 | 0 | 0 | 0 | 112.7 | F65 W69 R70 | F65-T67 PolarHBondContact O-N 2.87Å; T67-W69 PolarHBondContact O-N 3.3Å; T67-W69 PolarHBondContact OG1-NE1 2.91Å; T67-W69 VanDerWaalsContact OG1-NE1 3.08Å; T67-R70 WeakPolarHBondContact O-CB 3.35Å; T67-R70 PolarHBondContact O-N 3.47Å | ||
| 68 | Y | 55.8 | Low | 62.4 | Low | 203 Ų | 203 | 101 Ų | 101 | 80% | 0.796 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -49.9 | -27.6 | -180 | -75.3 | -81.8 | 0 | 0 | 0 | 115.6 | R70 | Y68-R70 VanDerWaalsContact C-N 3.33Å; Y68-R70 PolarHBondContact O-N 3Å |
| 69 | W | 58.7 | Low | 63.5 | Low | 124 Ų | 124 | 100.2 Ų | 100.2 | 47% | 0.47 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 176.8 | 64.6 | -85.3 | 0 | 0 | 0 | 110.4 | T67 I71 R72 F73 W141 | T67-W69 PolarHBondContact O-N 3.3Å; T67-W69 PolarHBondContact OG1-NE1 2.91Å; T67-W69 VanDerWaalsContact OG1-NE1 3.08Å; W69-I71 VanDerWaalsContact C-N 3.3Å; W69-I71 PolarHBondContact O-N 3.49Å; W69-R72 WeakPolarHBondContact O-CB 3.38Å; W69-R72 PolarHBondContact O-N 3.49Å; W69-F73 VanDerWaalsContact C-CE2 3.4Å; W69-F73 HydrophobicContact CB-CE2 3.98Å; W69-F73 AromaticContact CD2-CE2 3.93Å; W69-F73 HydrophobicContact CD2-CE2 3.93Å; W69-F73 AromaticContact CE3-CD2 3.87Å; W69-F73 HydrophobicContact CE3-CD2 3.87Å; W69-F73 AromaticContact CE3-CE2 3.1Å; W69-F73 HydrophobicContact CE3-CE2 3.1Å; W69-F73 AromaticContact CE3-CZ 3.67Å; W69-F73 HydrophobicContact CE3-CZ 3.67Å; W69-F73 HydrophobicContact CG-CE2 4.33Å; W69-F73 HydrophobicContact CZ3-CD2 4.29Å; W69-F73 AromaticContact CZ3-CE2 3.82Å; W69-F73 HydrophobicContact CZ3-CE2 3.82Å; W69-F73 HydrophobicContact CZ3-CZ 4.25Å; W69-F73 WeakPolarHBondContact O-CD2 3.5Å; W69-F73 WeakPolarHBondContact O-CE2 3.28Å; W69-W141 HydrophobicContact CZ3-CZ3 4.08Å |
| 70 | R | 59.8 | Low | 65 | Low | 86 Ų | 86 | 97.1 Ų | 97.1 | 33% | 0.325 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -56.3 | -35.4 | -178.4 | -72.1 | -169.1 | -175.8 | -151.9 | 5 | 114.3 | T67 Y68 R72 F73 W74 | T67-R70 WeakPolarHBondContact O-CB 3.35Å; T67-R70 PolarHBondContact O-N 3.47Å; Y68-R70 VanDerWaalsContact C-N 3.33Å; Y68-R70 PolarHBondContact O-N 3Å; R70-R72 VanDerWaalsContact C-N 3.28Å; R70-R72 PolarHBondContact O-N 2.69Å; R70-F73 PolarHBondContact O-N 2.93Å; R70-F73 VanDerWaalsContact O-N 3.08Å; R70-W74 PolarHBondContact O-N 2.82Å |
| 71 | I | 60.6 | Low | 66.7 | Low | 101 Ų | 101 | 93.2 Ų | 93.2 | 52% | 0.518 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61 | -35.4 | 177 | -62.4 | 169.2 | 0 | 0 | 0 | 111.9 | W69 F73 K75 | W69-I71 VanDerWaalsContact C-N 3.3Å; W69-I71 PolarHBondContact O-N 3.49Å; I71-F73 VanDerWaalsContact C-N 3.31Å; I71-F73 PolarHBondContact O-N 3.34Å; I71-K75 PolarHBondContact O-N 2.91Å |
| 72 | R | 67 | Low | 68.2 | Low | 202 Ų | 202 | 93.2 Ų | 93.2 | 76% | 0.762 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -69.3 | -30.5 | 177.3 | -63.4 | -175.4 | -177.2 | 178.4 | 0.7 | 112.1 | W69 R70 K75 G76 | W69-R72 WeakPolarHBondContact O-CB 3.38Å; W69-R72 PolarHBondContact O-N 3.49Å; R70-R72 VanDerWaalsContact C-N 3.28Å; R70-R72 PolarHBondContact O-N 2.69Å; R72-K75 PolarHBondContact O-N 3.47Å; R72-G76 PolarHBondContact O-N 2.85Å |
| 73 | F | 69.4 | Low | 70.1 | Confident | 46 Ų | 46 | 93.5 Ų | 93.5 | 20% | 0.202 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -72.2 | -40.1 | 179 | -61.4 | -75.4 | 0 | 0 | 0 | 111.9 | W69 R70 I71 K75 G76 F77 Y137 W141 | W69-F73 VanDerWaalsContact C-CE2 3.4Å; W69-F73 HydrophobicContact CB-CE2 3.98Å; W69-F73 AromaticContact CD2-CE2 3.93Å; W69-F73 HydrophobicContact CD2-CE2 3.93Å; W69-F73 AromaticContact CE3-CD2 3.87Å; W69-F73 HydrophobicContact CE3-CD2 3.87Å; W69-F73 AromaticContact CE3-CE2 3.1Å; W69-F73 HydrophobicContact CE3-CE2 3.1Å; W69-F73 AromaticContact CE3-CZ 3.67Å; W69-F73 HydrophobicContact CE3-CZ 3.67Å; W69-F73 HydrophobicContact CG-CE2 4.33Å; W69-F73 HydrophobicContact CZ3-CD2 4.29Å; W69-F73 AromaticContact CZ3-CE2 3.82Å; W69-F73 HydrophobicContact CZ3-CE2 3.82Å; W69-F73 HydrophobicContact CZ3-CZ 4.25Å; W69-F73 WeakPolarHBondContact O-CD2 3.5Å; W69-F73 WeakPolarHBondContact O-CE2 3.28Å; R70-F73 PolarHBondContact O-N 2.93Å; R70-F73 VanDerWaalsContact O-N 3.08Å; I71-F73 VanDerWaalsContact C-N 3.31Å; I71-F73 PolarHBondContact O-N 3.34Å; F73-K75 VanDerWaalsContact C-N 3.27Å; F73-K75 PolarHBondContact O-N 3.43Å; F73-G76 CarbonylContact O-C 3.52Å; F73-G76 WeakPolarHBondContact O-CA 3.45Å; F73-G76 PolarHBondContact O-N 2.94Å; F73-F77 HydrophobicContact CB-CE2 4.47Å; F73-F77 WeakPolarHBondContact O-CD2 3.42Å; F73-F77 PolarHBondContact O-N 2.89Å; F73-Y137 PolarHBondContact O-OH 3.11Å; F73-W141 AromaticContact CD1-CD2 3.72Å; F73-W141 HydrophobicContact CD1-CD2 3.72Å; F73-W141 AromaticContact CD1-CE2 3.33Å; F73-W141 AromaticContact CD1-CE3 3.97Å; F73-W141 HydrophobicContact CD1-CE3 3.97Å; F73-W141 AromaticContact CD1-CH2 3.64Å; F73-W141 HydrophobicContact CD1-CH2 3.64Å; F73-W141 AromaticContact CD1-CZ2 3.35Å; F73-W141 HydrophobicContact CD1-CZ2 3.35Å; F73-W141 AromaticContact CD1-CZ3 3.92Å; F73-W141 HydrophobicContact CD1-CZ3 3.92Å; F73-W141 AromaticContact CD1-NE1 3.81Å; F73-W141 HydrophobicContact CE1-CD2 4.11Å; F73-W141 AromaticContact CE1-CE2 3.54Å; F73-W141 HydrophobicContact CE1-CE3 4.07Å; F73-W141 AromaticContact CE1-CH2 2.96Å; F73-W141 HydrophobicContact CE1-CH2 2.96Å; F73-W141 AromaticContact CE1-CZ2 2.99Å; F73-W141 HydrophobicContact CE1-CZ2 2.99Å; F73-W141 AromaticContact CE1-CZ3 3.52Å; F73-W141 HydrophobicContact CE1-CZ3 3.52Å; F73-W141 HydrophobicContact CG-CD2 4.41Å; F73-W141 HydrophobicContact CG-CE3 4.48Å; F73-W141 AromaticContact CZ-CH2 3.49Å; F73-W141 HydrophobicContact CZ-CH2 3.49Å; F73-W141 VanDerWaalsContact CZ-CH2 3.49Å; F73-W141 AromaticContact CZ-CZ2 3.99Å; F73-W141 HydrophobicContact CZ-CZ2 3.99Å; F73-W141 AromaticContact CZ-CZ3 3.79Å; F73-W141 HydrophobicContact CZ-CZ3 3.79Å |
| 74 | W | 72.6 | Confident | 72.2 | Confident | 80 Ų | 80 | 89.5 Ų | 89.5 | 30% | 0.303 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -58.7 | -39.5 | 173.8 | -68.7 | 117 | 0 | 0 | 0 | 112.1 | W54 I61 R70 G76 F77 I78 | W54-W74 HydrophobicContact CH2-CB 4.46Å; W54-W74 AromaticContact CH2-CD2 3.9Å; W54-W74 HydrophobicContact CH2-CD2 3.9Å; W54-W74 AromaticContact CH2-CE3 3.16Å; W54-W74 HydrophobicContact CH2-CE3 3.16Å; W54-W74 HydrophobicContact CH2-CG 4.49Å; W54-W74 HydrophobicContact CH2-CH2 4.44Å; W54-W74 AromaticContact CH2-CZ3 3.46Å; W54-W74 HydrophobicContact CH2-CZ3 3.46Å; W54-W74 VanDerWaalsContact CH2-CZ3 3.46Å; W54-W74 AromaticContact CZ2-CE3 3.55Å; W54-W74 HydrophobicContact CZ2-CE3 3.55Å; W54-W74 AromaticContact CZ2-CZ3 3.7Å; W54-W74 HydrophobicContact CZ2-CZ3 3.7Å; W54-W74 HydrophobicContact CZ3-CE3 4.34Å; I61-W74 HydrophobicContact CD1-CG 4.43Å; I61-W74 HydrophobicContact CG2-CZ2 4.21Å; R70-W74 PolarHBondContact O-N 2.82Å; W74-G76 VanDerWaalsContact C-N 3.28Å; W74-G76 PolarHBondContact O-N 2.86Å; W74-F77 HydrophobicContact CE3-CD2 4.21Å; W74-F77 PolarHBondContact O-N 3.22Å; W74-I78 WeakPolarHBondContact O-CG1 3.48Å; W74-I78 PolarHBondContact O-N 2.94Å |
| 75 | K | 76 | Confident | 74.4 | Confident | 146 Ų | 146 | 84.9 Ų | 84.9 | 64% | 0.635 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -60.9 | -37.2 | 170.8 | -67 | -175.6 | 177.5 | -172.7 | 0 | 112.7 | I71 R72 F73 L79 | I71-K75 PolarHBondContact O-N 2.91Å; R72-K75 PolarHBondContact O-N 3.47Å; F73-K75 VanDerWaalsContact C-N 3.27Å; F73-K75 PolarHBondContact O-N 3.43Å; K75-L79 WeakPolarHBondContact O-CB 3.46Å; K75-L79 PolarHBondContact O-N 3.31Å |
| 76 | G | 82.2 | Confident | 76.7 | Confident | 16 Ų | 16 | 84.3 Ų | 84.3 | 17% | 0.165 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -68.4 | -37.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | R72 F73 W74 L79 C80 Y137 | R72-G76 PolarHBondContact O-N 2.85Å; F73-G76 CarbonylContact O-C 3.52Å; F73-G76 WeakPolarHBondContact O-CA 3.45Å; F73-G76 PolarHBondContact O-N 2.94Å; W74-G76 VanDerWaalsContact C-N 3.28Å; W74-G76 PolarHBondContact O-N 2.86Å; G76-L79 PolarHBondContact O-N 3.41Å; G76-C80 PolarHBondContact O-N 2.92Å; G76-C80 PolarHBondContact O-SG 3.06Å; G76-Y137 WeakPolarHBondContact CA-OH 3.28Å |
| 77 | F | 83.3 | Confident | 78.8 | Confident | 21 Ų | 21 | 79.5 Ų | 79.5 | 9% | 0.092 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.4 | -48.4 | 172.9 | -78 | -71.1 | 0 | 0 | 0 | 111.6 | F73 W74 L79 C80 D81 Y137 T138 W141 Y142 | F73-F77 HydrophobicContact CB-CE2 4.47Å; F73-F77 WeakPolarHBondContact O-CD2 3.42Å; F73-F77 PolarHBondContact O-N 2.89Å; W74-F77 HydrophobicContact CE3-CD2 4.21Å; W74-F77 PolarHBondContact O-N 3.22Å; F77-L79 VanDerWaalsContact C-N 3.26Å; F77-L79 PolarHBondContact O-N 3.44Å; F77-C80 WeakPolarHBondContact O-CA 3.41Å; F77-C80 WeakPolarHBondContact O-CB 3.42Å; F77-C80 PolarHBondContact O-N 3.42Å; F77-D81 PolarHBondContact O-N 3.49Å; F77-Y137 HydrophobicContact CD1-CE1 4.27Å; F77-Y137 HydrophobicContact CE1-CE1 4.36Å; F77-Y137 HydrophobicContact CG-CE1 4.38Å; F77-T138 HydrophobicContact CD1-CG2 4.08Å; F77-T138 HydrophobicContact CE1-CG2 3.74Å; F77-W141 HydrophobicContact CE2-CB 4.49Å; F77-W141 HydrophobicContact CZ-CB 4.02Å; F77-W141 HydrophobicContact CZ-CG 4.31Å; F77-Y142 HydrophobicContact CD1-CE2 4.41Å; F77-Y142 HydrophobicContact CE1-CD2 4.06Å; F77-Y142 AromaticContact CE1-CE2 3.43Å; F77-Y142 HydrophobicContact CE1-CE2 3.43Å; F77-Y142 VanDerWaalsContact CE1-CE2 3.43Å; F77-Y142 HydrophobicContact CE2-CE2 4.49Å; F77-Y142 AromaticContact CZ-CD2 4Å; F77-Y142 HydrophobicContact CZ-CD2 4Å; F77-Y142 AromaticContact CZ-CE2 3.48Å; F77-Y142 HydrophobicContact CZ-CE2 3.48Å; F77-Y142 VanDerWaalsContact CZ-CE2 3.48Å |
| 78 | I | 85.3 | Confident | 80.6 | Confident | 53 Ų | 53 | 77 Ų | 77 | 27% | 0.272 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -57.5 | -41.2 | 175.2 | -65 | 165.7 | 0 | 0 | 0 | 111 | W54 W74 D81 I82 | W54-I78 HydrophobicContact CD2-CD1 3.95Å; W54-I78 HydrophobicContact CD2-CG1 3.7Å; W54-I78 HydrophobicContact CE3-CD1 3.87Å; W54-I78 HydrophobicContact CE3-CG1 4.13Å; W54-I78 HydrophobicContact CG-CD1 4.39Å; W54-I78 HydrophobicContact CG-CG1 3.96Å; W54-I78 HydrophobicContact CZ2-CG1 4.34Å; W54-I78 HydrophobicContact CZ3-CD1 4.31Å; W74-I78 WeakPolarHBondContact O-CG1 3.48Å; W74-I78 PolarHBondContact O-N 2.94Å; I78-D81 PolarHBondContact O-N 2.86Å; I78-I82 HydrophobicContact CG2-CD1 3.9Å; I78-I82 HydrophobicContact CG2-CG1 4.47Å; I78-I82 VanDerWaalsContact O-CG1 3.27Å; I78-I82 WeakPolarHBondContact O-CG1 3.39Å; I78-I82 PolarHBondContact O-N 3.35Å |
| 79 | L | 87.8 | Confident | 82.4 | Confident | 123 Ų | 123 | 70 Ų | 70 | 64% | 0.644 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -65.7 | -38.5 | 177.4 | -172.8 | 128 | 0 | 0 | 0 | 112.3 | K75 G76 F77 F83 | K75-L79 WeakPolarHBondContact O-CB 3.46Å; K75-L79 PolarHBondContact O-N 3.31Å; G76-L79 PolarHBondContact O-N 3.41Å; F77-L79 VanDerWaalsContact C-N 3.26Å; F77-L79 PolarHBondContact O-N 3.44Å; L79-F83 WeakPolarHBondContact O-CB 3.41Å; L79-F83 PolarHBondContact O-N 2.96Å |
| 80 | C | 89.8 | Confident | 84.1 | Confident | 14 Ų | 14 | 68.5 Ų | 68.5 | 10% | 0.095 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 172.6 | -72.4 | 0 | 0 | 0 | 0 | 111.9 | G76 F77 F83 M84 V134 Y137 | G76-C80 PolarHBondContact O-N 2.92Å; G76-C80 PolarHBondContact O-SG 3.06Å; F77-C80 WeakPolarHBondContact O-CA 3.41Å; F77-C80 WeakPolarHBondContact O-CB 3.42Å; F77-C80 PolarHBondContact O-N 3.42Å; C80-F83 PolarHBondContact O-N 3.31Å; C80-M84 WeakPolarHBondContact O-CB 3.28Å; C80-M84 WeakPolarHBondContact O-CG 3.17Å; C80-M84 PolarHBondContact O-N 2.99Å; C80-V134 HydrophobicContact CB-CG1 3.86Å; C80-V134 HydrophobicContact CB-CG2 4.33Å; C80-Y137 WeakPolarHBondContact SG-CD1 3.44Å |
| 81 | D | 90.2 | Very high | 85.7 | Confident | 23 Ų | 23 | 64.6 Ų | 64.6 | 12% | 0.123 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.2 | -44.7 | 178.9 | -65.1 | -19 | 0 | 0 | 0 | 111 | V47 L51 W54 F77 I78 F83 M84 F85 | V47-D81 HydrophobicContact CG1-CB 4.38Å; V47-D81 WeakPolarHBondContact CG1-O 3.4Å; L51-D81 HydrophobicContact CD2-CB 3.79Å; L51-D81 HydrophobicContact CG-CB 4.15Å; W54-D81 PolarHBondContact NE1-OD2 2.92Å; F77-D81 PolarHBondContact O-N 3.49Å; I78-D81 PolarHBondContact O-N 2.86Å; D81-F83 VanDerWaalsContact C-N 3.33Å; D81-F83 PolarHBondContact O-N 3.34Å; D81-M84 PolarHBondContact O-N 3.04Å; D81-F85 WeakPolarHBondContact O-CB 3.44Å; D81-F85 PolarHBondContact O-N 2.73Å |
| 82 | I | 91.5 | Very high | 87.3 | Confident | 78 Ų | 78 | 62 Ų | 62 | 40% | 0.4 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.1 | -44 | 174.8 | -67.2 | 167.6 | 0 | 0 | 0 | 110.9 | L51 I78 F85 F86 | L51-I82 HydrophobicContact CD2-CG1 3.9Å; I78-I82 HydrophobicContact CG2-CD1 3.9Å; I78-I82 HydrophobicContact CG2-CG1 4.47Å; I78-I82 VanDerWaalsContact O-CG1 3.27Å; I78-I82 WeakPolarHBondContact O-CG1 3.39Å; I78-I82 PolarHBondContact O-N 3.35Å; I82-F85 WeakPolarHBondContact O-CB 3.38Å; I82-F85 PolarHBondContact O-N 3.33Å; I82-F86 HydrophobicContact CG2-CD2 4.12Å; I82-F86 HydrophobicContact CG2-CE2 3.77Å; I82-F86 WeakPolarHBondContact O-CD2 3.31Å; I82-F86 PolarHBondContact O-N 3.42Å |
| 83 | F | 93 | Very high | 88.6 | Confident | 109 Ų | 109 | 56.6 Ų | 56.6 | 48% | 0.478 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -64.4 | -44.7 | 178.6 | -178.8 | -106.9 | 0 | 0 | 0 | 111.8 | L79 C80 D81 F85 F86 A87 A130 V134 | L79-F83 WeakPolarHBondContact O-CB 3.41Å; L79-F83 PolarHBondContact O-N 2.96Å; C80-F83 PolarHBondContact O-N 3.31Å; D81-F83 VanDerWaalsContact C-N 3.33Å; D81-F83 PolarHBondContact O-N 3.34Å; F83-F85 VanDerWaalsContact C-N 3.3Å; F83-F85 PolarHBondContact O-N 2.94Å; F83-F86 PolarHBondContact O-N 3.3Å; F83-A87 WeakPolarHBondContact O-CB 3.29Å; F83-A87 PolarHBondContact O-N 3.31Å; F83-A130 HydrophobicContact CE1-CB 3.51Å; F83-A130 HydrophobicContact CZ-CB 3.99Å; F83-V134 HydrophobicContact CD1-CG2 4.1Å |
| 84 | M | 93.2 | Very high | 89.6 | Confident | 14 Ų | 14 | 55.9 Ų | 55.9 | 7% | 0.069 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.3 | -30.4 | 177.1 | -73 | -59.1 | -70.9 | 0 | 0 | 112.6 | V47 C80 D81 A87 N88 Y127 N131 V134 | V47-M84 HydrophobicContact CG2-CB 4.07Å; C80-M84 WeakPolarHBondContact O-CB 3.28Å; C80-M84 WeakPolarHBondContact O-CG 3.17Å; C80-M84 PolarHBondContact O-N 2.99Å; D81-M84 PolarHBondContact O-N 3.04Å; M84-A87 PolarHBondContact O-N 2.88Å; M84-N88 WeakPolarHBondContact O-CB 3.37Å; M84-N88 PolarHBondContact O-N 3.36Å; M84-N88 PolarHBondContact O-ND2 3.47Å; M84-Y127 HydrophobicContact CE-CE2 4.33Å; M84-N131 HydrophobicContact CE-CB 4.26Å; M84-N131 WeakPolarHBondContact CE-OD1 3.3Å; M84-V134 HydrophobicContact CG-CB 4.23Å; M84-V134 HydrophobicContact CG-CG1 3.97Å; M84-V134 HydrophobicContact CG-CG2 3.9Å; M84-V134 HydrophobicContact SD-CB 4.24Å; M84-V134 HydrophobicContact SD-CG2 3.95Å |
| 85 | F | 93.9 | Very high | 90.6 | Very high | 49 Ų | 49 | 52 Ų | 52 | 22% | 0.215 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.7 | -51.1 | 173.8 | 174.3 | -93.7 | 0 | 0 | 0 | 110.5 | W44 V47 V48 L51 D81 I82 F83 L89 | W44-F85 AromaticContact CE2-CE2 3.51Å; W44-F85 HydrophobicContact CH2-CE2 4.47Å; W44-F85 HydrophobicContact CZ2-CD2 4.36Å; W44-F85 AromaticContact CZ2-CE2 3.41Å; W44-F85 HydrophobicContact CZ2-CE2 3.41Å; W44-F85 VanDerWaalsContact CZ2-CE2 3.41Å; W44-F85 AromaticContact CZ2-CZ 3.83Å; W44-F85 HydrophobicContact CZ2-CZ 3.83Å; W44-F85 AromaticContact NE1-CD2 3.48Å; W44-F85 AromaticContact NE1-CE2 3.32Å; W44-F85 VanDerWaalsContact NE1-CE2 3.32Å; W44-F85 AromaticContact NE1-CZ 3.9Å; V47-F85 HydrophobicContact CG1-CB 3.76Å; V48-F85 HydrophobicContact CG2-CD2 3.81Å; V48-F85 HydrophobicContact CG2-CE2 3.61Å; L51-F85 HydrophobicContact CD1-CB 4.07Å; L51-F85 HydrophobicContact CD1-CD2 4.13Å; L51-F85 HydrophobicContact CD1-CG 4.22Å; D81-F85 WeakPolarHBondContact O-CB 3.44Å; D81-F85 PolarHBondContact O-N 2.73Å; I82-F85 WeakPolarHBondContact O-CB 3.38Å; I82-F85 PolarHBondContact O-N 3.33Å; F83-F85 VanDerWaalsContact C-N 3.3Å; F83-F85 PolarHBondContact O-N 2.94Å; F85-L89 VanDerWaalsContact O-CB 3.31Å; F85-L89 WeakPolarHBondContact O-CB 3.21Å; F85-L89 PolarHBondContact O-N 2.83Å |
| 86 | F | 94.2 | Very high | 91.4 | Very high | 110 Ų | 110 | 48.4 Ų | 48.4 | 48% | 0.482 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -68.4 | -40.1 | 177.6 | -69.9 | -65.3 | 0 | 0 | 0 | 112.5 | I82 F83 L89 I90 | I82-F86 HydrophobicContact CG2-CD2 4.12Å; I82-F86 HydrophobicContact CG2-CE2 3.77Å; I82-F86 WeakPolarHBondContact O-CD2 3.31Å; I82-F86 PolarHBondContact O-N 3.42Å; F83-F86 PolarHBondContact O-N 3.3Å; F86-L89 PolarHBondContact O-N 3.15Å; F86-I90 VanDerWaalsContact O-CG1 3.29Å; F86-I90 WeakPolarHBondContact O-CG1 3.4Å; F86-I90 PolarHBondContact O-N 3.04Å |
| 87 | A | 93.7 | Very high | 91.8 | Very high | 18 Ų | 18 | 50.9 Ų | 50.9 | 15% | 0.149 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.5 | -46.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | F83 M84 L91 Y127 | F83-A87 WeakPolarHBondContact O-CB 3.29Å; F83-A87 PolarHBondContact O-N 3.31Å; M84-A87 PolarHBondContact O-N 2.88Å; A87-L91 WeakPolarHBondContact O-CB 3.46Å; A87-L91 PolarHBondContact O-N 2.9Å; A87-Y127 HydrophobicContact CB-CD2 3.99Å; A87-Y127 HydrophobicContact CB-CE2 4.14Å |
| 88 | N | 93.6 | Very high | 92 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 175.4 | -81.5 | -69 | 0 | 0 | 0 | 111.8 | S43 W44 M84 L91 L92 Y127 | S43-N88 WeakPolarHBondContact CB-OD1 3.27Å; W44-N88 HydrophobicContact CB-CB 3.95Å; W44-N88 HydrophobicContact CG-CB 4.27Å; M84-N88 WeakPolarHBondContact O-CB 3.37Å; M84-N88 PolarHBondContact O-N 3.36Å; M84-N88 PolarHBondContact O-ND2 3.47Å; N88-L91 PolarHBondContact O-N 2.86Å; N88-L92 VanDerWaalsContact O-CB 3.29Å; N88-L92 WeakPolarHBondContact O-CB 3.31Å; N88-L92 PolarHBondContact O-N 3.45Å; N88-Y127 PolarHBondContact OD1-OH 3.41Å |
| 89 | L | 94 | Very high | 92.3 | Very high | 58 Ų | 58 | 49.1 Ų | 49.1 | 30% | 0.304 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -61 | -47.1 | 178.6 | -175.3 | 69.3 | 0 | 0 | 0 | 111.9 | F85 F86 L91 L92 I93 | F85-L89 VanDerWaalsContact O-CB 3.31Å; F85-L89 WeakPolarHBondContact O-CB 3.21Å; F85-L89 PolarHBondContact O-N 2.83Å; F86-L89 PolarHBondContact O-N 3.15Å; L89-L91 VanDerWaalsContact C-N 3.34Å; L89-L91 PolarHBondContact O-N 3.06Å; L89-L92 PolarHBondContact O-N 2.72Å; L89-I93 HydrophobicContact CD1-CD1 4.44Å; L89-I93 HydrophobicContact CG-CD1 4.1Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.5Å; L89-I93 PolarHBondContact O-N 3.33Å |
| 90 | I | 94.4 | Very high | 92.2 | Very high | 92 Ų | 92 | 46.1 Ų | 46.1 | 47% | 0.472 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.6 | -44.6 | 177.4 | -68.4 | 166.5 | 0 | 0 | 0 | 110.3 | F86 L92 I93 M94 I123 | F86-I90 VanDerWaalsContact O-CG1 3.29Å; F86-I90 WeakPolarHBondContact O-CG1 3.4Å; F86-I90 PolarHBondContact O-N 3.04Å; I90-L92 VanDerWaalsContact C-N 3.34Å; I90-L92 PolarHBondContact O-N 2.83Å; I90-I93 PolarHBondContact O-N 2.85Å; I90-M94 WeakPolarHBondContact O-CB 3.45Å; I90-M94 WeakPolarHBondContact O-CG 3.44Å; I90-M94 PolarHBondContact O-N 3.29Å; I90-M94 VanDerWaalsContact O-N 3.08Å; I90-I123 HydrophobicContact CG2-CG2 4.22Å |
| 91 | L | 93.8 | Very high | 92 | Very high | 4 Ų | 4 | 45.6 Ų | 45.6 | 2% | 0.021 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.4 | -40.5 | 179 | -179.5 | 61.3 | 0 | 0 | 0 | 112 | T36 A87 N88 L89 S95 I123 M124 Y127 | T36-L91 HydrophobicContact CG2-CD1 4.08Å; T36-L91 HydrophobicContact CG2-CD2 4Å; T36-L91 HydrophobicContact CG2-CG 4.15Å; A87-L91 WeakPolarHBondContact O-CB 3.46Å; A87-L91 PolarHBondContact O-N 2.9Å; N88-L91 PolarHBondContact O-N 2.86Å; L89-L91 VanDerWaalsContact C-N 3.34Å; L89-L91 PolarHBondContact O-N 3.06Å; L91-S95 VanDerWaalsContact O-CB 3.28Å; L91-S95 WeakPolarHBondContact O-CB 3.43Å; L91-S95 PolarHBondContact O-N 3.39Å; L91-S95 PolarHBondContact O-OG 2.91Å; L91-I123 HydrophobicContact CD1-CG2 4.22Å; L91-M124 HydrophobicContact CD1-CG 4.07Å; L91-M124 HydrophobicContact CD1-SD 3.42Å; L91-M124 WeakPolarHBondContact CD1-SD 2.99Å; L91-M124 HydrophobicContact CD2-SD 4.1Å; L91-M124 HydrophobicContact CG-SD 4.38Å; L91-Y127 HydrophobicContact CB-CD2 4.23Å; L91-Y127 HydrophobicContact CD2-CD1 3.79Å; L91-Y127 HydrophobicContact CD2-CD2 3.82Å; L91-Y127 HydrophobicContact CD2-CE1 3.97Å; L91-Y127 HydrophobicContact CD2-CE2 4.01Å; L91-Y127 HydrophobicContact CD2-CG 3.73Å |
| 92 | L | 94 | Very high | 91.7 | Very high | 46 Ų | 46 | 44.8 Ų | 44.8 | 24% | 0.241 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65 | -49.7 | 178.6 | -167.1 | 161.7 | 0 | 0 | 0 | 110.8 | A41 N88 L89 I90 M94 S95 V96 | A41-L92 HydrophobicContact CB-CD1 3.99Å; N88-L92 VanDerWaalsContact O-CB 3.29Å; N88-L92 WeakPolarHBondContact O-CB 3.31Å; N88-L92 PolarHBondContact O-N 3.45Å; L89-L92 PolarHBondContact O-N 2.72Å; I90-L92 VanDerWaalsContact C-N 3.34Å; I90-L92 PolarHBondContact O-N 2.83Å; L92-M94 VanDerWaalsContact C-N 3.31Å; L92-M94 PolarHBondContact O-N 3.13Å; L92-S95 PolarHBondContact O-N 2.92Å; L92-V96 HydrophobicContact CD2-CG2 3.94Å; L92-V96 WeakPolarHBondContact O-CG2 3.38Å; L92-V96 PolarHBondContact O-N 3.49Å |
| 93 | I | 93.9 | Very high | 91.4 | Very high | 88 Ų | 88 | 43.6 Ų | 43.6 | 45% | 0.451 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -55.6 | -47.9 | 177.6 | -69.2 | 166.8 | 0 | 0 | 0 | 110.5 | L89 I90 S95 V96 I97 | L89-I93 HydrophobicContact CD1-CD1 4.44Å; L89-I93 HydrophobicContact CG-CD1 4.1Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.5Å; L89-I93 PolarHBondContact O-N 3.33Å; I90-I93 PolarHBondContact O-N 2.85Å; I93-S95 PolarHBondContact O-N 3.31Å; I93-V96 PolarHBondContact O-N 3.06Å; I93-I97 HydrophobicContact CG2-CD1 3.93Å; I93-I97 WeakPolarHBondContact O-CG1 3.24Å; I93-I97 PolarHBondContact O-N 2.96Å |
| 94 | M | 92.2 | Very high | 90.8 | Very high | 31 Ų | 31 | 44.8 Ų | 44.8 | 15% | 0.153 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -67.7 | -37.2 | -179.3 | -72.2 | -65.2 | -54.7 | 0 | 0 | 112.7 | I90 L92 I97 V98 A119 I123 | I90-M94 WeakPolarHBondContact O-CB 3.45Å; I90-M94 WeakPolarHBondContact O-CG 3.44Å; I90-M94 PolarHBondContact O-N 3.29Å; I90-M94 VanDerWaalsContact O-N 3.08Å; L92-M94 VanDerWaalsContact C-N 3.31Å; L92-M94 PolarHBondContact O-N 3.13Å; M94-I97 PolarHBondContact O-N 2.94Å; M94-I97 HydrophobicContact SD-CD1 4.1Å; M94-V98 WeakPolarHBondContact O-CG2 3.39Å; M94-V98 PolarHBondContact O-N 3.49Å; M94-A119 HydrophobicContact CE-CB 4.05Å; M94-I123 HydrophobicContact CB-CD1 4.28Å; M94-I123 HydrophobicContact CE-CD1 3.83Å; M94-I123 HydrophobicContact CG-CD1 3.53Å; M94-I123 HydrophobicContact SD-CD1 4.05Å |
| 95 | S | 92.5 | Very high | 89.7 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.1 | -40.5 | 175.6 | -60 | 0 | 0 | 0 | 0 | 111.3 | T33 L91 L92 I93 V98 I99 W120 | T33-S95 WeakPolarHBondContact CG2-O 3.41Å; L91-S95 VanDerWaalsContact O-CB 3.28Å; L91-S95 WeakPolarHBondContact O-CB 3.43Å; L91-S95 PolarHBondContact O-N 3.39Å; L91-S95 PolarHBondContact O-OG 2.91Å; L92-S95 PolarHBondContact O-N 2.92Å; I93-S95 PolarHBondContact O-N 3.31Å; S95-V98 PolarHBondContact O-N 2.9Å; S95-I99 WeakPolarHBondContact O-CB 3.34Å; S95-I99 WeakPolarHBondContact O-CD1 3.49Å; S95-I99 VanDerWaalsContact O-CG1 3.22Å; S95-I99 WeakPolarHBondContact O-CG1 3.36Å; S95-I99 PolarHBondContact O-N 3.27Å; S95-W120 PolarHBondContact OG-NE1 3.25Å |
| 96 | V | 92.3 | Very high | 88.6 | Confident | 69 Ų | 69 | 49.1 Ų | 49.1 | 42% | 0.418 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.7 | -44.9 | 174.2 | 172.9 | 0 | 0 | 0 | 0 | 111.3 | L92 I93 V98 I99 V100 | L92-V96 HydrophobicContact CD2-CG2 3.94Å; L92-V96 WeakPolarHBondContact O-CG2 3.38Å; L92-V96 PolarHBondContact O-N 3.49Å; I93-V96 PolarHBondContact O-N 3.06Å; V96-V98 VanDerWaalsContact C-N 3.32Å; V96-V98 PolarHBondContact O-N 3.32Å; V96-I99 PolarHBondContact O-N 2.87Å; V96-V100 HydrophobicContact CG1-CG2 4.44Å; V96-V100 WeakPolarHBondContact O-CG2 3.37Å; V96-V100 PolarHBondContact O-N 3.27Å |
| 97 | I | 90.6 | Very high | 87.4 | Confident | 68 Ų | 68 | 52.6 Ų | 52.6 | 35% | 0.349 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58 | -45.2 | 176.8 | -68.4 | 165.6 | 0 | 0 | 0 | 110.8 | I93 M94 V100 A101 Y116 | I93-I97 HydrophobicContact CG2-CD1 3.93Å; I93-I97 WeakPolarHBondContact O-CG1 3.24Å; I93-I97 PolarHBondContact O-N 2.96Å; M94-I97 PolarHBondContact O-N 2.94Å; M94-I97 HydrophobicContact SD-CD1 4.1Å; I97-V100 PolarHBondContact O-N 2.85Å; I97-A101 VanDerWaalsContact O-CB 3.32Å; I97-A101 WeakPolarHBondContact O-CB 3.32Å; I97-A101 PolarHBondContact O-N 3.32Å; I97-Y116 HydrophobicContact CG2-CD1 3.86Å; I97-Y116 HydrophobicContact CG2-CE1 4.07Å |
| 98 | V | 88.8 | Confident | 85.8 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -66.7 | -41.1 | 178.5 | 173 | 0 | 0 | 0 | 0 | 111.6 | T33 M94 S95 V96 V100 A101 I102 L117 W120 | T33-V98 HydrophobicContact CG2-CB 3.96Å; T33-V98 HydrophobicContact CG2-CG1 3.85Å; M94-V98 WeakPolarHBondContact O-CG2 3.39Å; M94-V98 PolarHBondContact O-N 3.49Å; S95-V98 PolarHBondContact O-N 2.9Å; V96-V98 VanDerWaalsContact C-N 3.32Å; V96-V98 PolarHBondContact O-N 3.32Å; V98-V100 PolarHBondContact O-N 3.27Å; V98-A101 PolarHBondContact O-N 3Å; V98-I102 HydrophobicContact CG1-CD1 3.65Å; V98-I102 HydrophobicContact CG1-CG1 4.24Å; V98-I102 WeakPolarHBondContact O-CB 3.49Å; V98-I102 VanDerWaalsContact O-CG1 3.28Å; V98-I102 WeakPolarHBondContact O-CG1 3.21Å; V98-I102 PolarHBondContact O-N 2.97Å; V98-L117 HydrophobicContact CG1-CD2 3.97Å; V98-W120 HydrophobicContact CG2-CB 3.77Å; V98-W120 HydrophobicContact CG2-CG 3.92Å |
| 99 | I | 90 | Very high | 84.3 | Confident | 37 Ų | 37 | 64.5 Ų | 64.5 | 19% | 0.19 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -59 | -46.9 | 175.2 | -71.5 | 163.8 | 0 | 0 | 0 | 110.7 | F30 T33 I34 A37 S95 V96 I102 S103 | F30-I99 HydrophobicContact CE2-CG2 4.19Å; T33-I99 HydrophobicContact CG2-CD1 4.2Å; T33-I99 HydrophobicContact CG2-CG1 3.69Å; I34-I99 HydrophobicContact CG1-CD1 4.12Å; I34-I99 HydrophobicContact CG1-CG1 4.27Å; A37-I99 HydrophobicContact CB-CD1 3.91Å; S95-I99 WeakPolarHBondContact O-CB 3.34Å; S95-I99 WeakPolarHBondContact O-CD1 3.49Å; S95-I99 VanDerWaalsContact O-CG1 3.22Å; S95-I99 WeakPolarHBondContact O-CG1 3.36Å; S95-I99 PolarHBondContact O-N 3.27Å; V96-I99 PolarHBondContact O-N 2.87Å; I99-I102 PolarHBondContact O-N 3.42Å; I99-S103 VanDerWaalsContact O-CB 3.26Å; I99-S103 WeakPolarHBondContact O-CB 3.42Å; I99-S103 PolarHBondContact O-N 2.82Å; I99-S103 PolarHBondContact O-OG 2.91Å |
| 100 | V | 87.6 | Confident | 82.7 | Confident | 60 Ų | 60 | 67.5 Ų | 67.5 | 36% | 0.364 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 177.3 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | V96 I97 V98 I102 S103 W104 | V96-V100 HydrophobicContact CG1-CG2 4.44Å; V96-V100 WeakPolarHBondContact O-CG2 3.37Å; V96-V100 PolarHBondContact O-N 3.27Å; I97-V100 PolarHBondContact O-N 2.85Å; V98-V100 PolarHBondContact O-N 3.27Å; V100-I102 VanDerWaalsContact C-N 3.34Å; V100-I102 PolarHBondContact O-N 3.36Å; V100-S103 PolarHBondContact O-N 2.94Å; V100-W104 HydrophobicContact CG1-CE3 4.38Å; V100-W104 PolarHBondContact O-N 3.06Å; V100-W104 VanDerWaalsContact O-N 3.15Å |
| 101 | A | 85.1 | Confident | 81 | Confident | 3 Ų | 3 | 73.1 Ų | 73.1 | 3% | 0.025 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.1 | -38.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I97 V98 Y108 L113 | I97-A101 VanDerWaalsContact O-CB 3.32Å; I97-A101 WeakPolarHBondContact O-CB 3.32Å; I97-A101 PolarHBondContact O-N 3.32Å; V98-A101 PolarHBondContact O-N 3Å; A101-Y108 HydrophobicContact CB-CD2 4.29Å; A101-Y108 HydrophobicContact CB-CG 4.32Å; A101-L113 HydrophobicContact CB-CD1 3.63Å |
| 102 | I | 84.1 | Confident | 79.9 | Confident | 6 Ų | 6 | 78.8 Ų | 78.8 | 3% | 0.031 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -72.5 | -37.4 | 176.1 | -65.7 | 170.4 | 0 | 0 | 0 | 111.1 | R26 F30 V98 I99 V100 W104 L113 | R26-I102 HydrophobicContact CG-CG2 4.2Å; R26-I102 PolarHBondContact NH2-O 3.09Å; F30-I102 HydrophobicContact CB-CG2 4.12Å; F30-I102 HydrophobicContact CD2-CB 4Å; F30-I102 HydrophobicContact CD2-CD1 4.41Å; F30-I102 HydrophobicContact CD2-CG2 3.54Å; F30-I102 HydrophobicContact CE2-CG2 4.29Å; F30-I102 HydrophobicContact CG-CG2 4.14Å; V98-I102 HydrophobicContact CG1-CD1 3.65Å; V98-I102 HydrophobicContact CG1-CG1 4.24Å; V98-I102 WeakPolarHBondContact O-CB 3.49Å; V98-I102 VanDerWaalsContact O-CG1 3.28Å; V98-I102 WeakPolarHBondContact O-CG1 3.21Å; V98-I102 PolarHBondContact O-N 2.97Å; I99-I102 PolarHBondContact O-N 3.42Å; V100-I102 VanDerWaalsContact C-N 3.34Å; V100-I102 PolarHBondContact O-N 3.36Å; I102-W104 VanDerWaalsContact C-N 3.31Å; I102-W104 PolarHBondContact O-N 2.81Å; I102-L113 HydrophobicContact CG1-CD1 4.22Å; I102-L113 HydrophobicContact CG1-CD2 4.37Å |
| 103 | S | 83.7 | Confident | 79 | Confident | 53 Ų | 53 | 77.1 Ų | 77.1 | 37% | 0.371 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -70.8 | -22.3 | -177.2 | -59.2 | 0 | 0 | 0 | 0 | 113.7 | I99 V100 P105 | I99-S103 VanDerWaalsContact O-CB 3.26Å; I99-S103 WeakPolarHBondContact O-CB 3.42Å; I99-S103 PolarHBondContact O-N 2.82Å; I99-S103 PolarHBondContact O-OG 2.91Å; V100-S103 PolarHBondContact O-N 2.94Å; S103-P105 VanDerWaalsContact C-CD 3.41Å; S103-P105 WeakPolarHBondContact O-CD 3.28Å |
| 104 | W | 80.9 | Confident | 78.4 | Confident | 135 Ų | 135 | 80.6 Ų | 80.6 | 51% | 0.511 | 39% | 0.385 | S | S | . | . | trans | -111.6 | 73.5 | 178.8 | -78.1 | -3.5 | 0 | 0 | 0 | 113.2 | V100 I102 A106 R107 Y108 | V100-W104 HydrophobicContact CG1-CE3 4.38Å; V100-W104 PolarHBondContact O-N 3.06Å; V100-W104 VanDerWaalsContact O-N 3.15Å; I102-W104 VanDerWaalsContact C-N 3.31Å; I102-W104 PolarHBondContact O-N 2.81Å; W104-A106 PolarHBondContact O-N 3.22Å; W104-A106 VanDerWaalsContact O-N 3.15Å; W104-R107 PolarHBondContact O-N 3.24Å; W104-Y108 HydrophobicContact CB-CD2 4.25Å; W104-Y108 PolarHBondContact O-N 2.67Å; W104-Y108 VanDerWaalsContact O-N 3.09Å | ||
| 105 | P | 71.1 | Confident | 78.1 | Confident | 55 Ų | 55 | 83.4 Ų | 83.4 | 36% | 0.357 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.7 | -24 | 177.6 | 26.6 | -34.5 | 0 | 0 | 0 | 113.4 | W3 S103 | W3-P105 HydrophobicContact CH2-CB 3.62Å; W3-P105 HydrophobicContact CH2-CG 3.45Å; W3-P105 VanDerWaalsContact CH2-CG 3.45Å; W3-P105 HydrophobicContact CZ2-CG 4.16Å; W3-P105 HydrophobicContact CZ3-CB 3.82Å; W3-P105 HydrophobicContact CZ3-CG 4.02Å; S103-P105 VanDerWaalsContact C-CD 3.41Å; S103-P105 WeakPolarHBondContact O-CD 3.28Å |
| 106 | A | 70.3 | Confident | 77.7 | Confident | 99 Ų | 99 | 88.1 Ų | 88.1 | 82% | 0.818 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -35 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | W104 | W104-A106 PolarHBondContact O-N 3.22Å; W104-A106 VanDerWaalsContact O-N 3.15Å |
| 107 | R | 68.9 | Low | 77.4 | Confident | 182 Ų | 182 | 87 Ų | 87 | 69% | 0.687 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.1 | -39.1 | 178.6 | -82.9 | -176.4 | 175.1 | 167 | -3.7 | 112.4 | W104 | W104-R107 PolarHBondContact O-N 3.24Š|
| 108 | Y | 60.5 | Low | 77.3 | Confident | 72 Ų | 72 | 92.8 Ų | 92.8 | 28% | 0.282 | 44% | 0.435 | S | S | . | . | trans | -102.6 | 88.1 | -176.4 | -63.3 | -80.1 | 0 | 0 | 0 | 110.7 | A101 W104 H112 | A101-Y108 HydrophobicContact CB-CD2 4.29Å; A101-Y108 HydrophobicContact CB-CG 4.32Å; W104-Y108 HydrophobicContact CB-CD2 4.25Å; W104-Y108 PolarHBondContact O-N 2.67Å; W104-Y108 VanDerWaalsContact O-N 3.09Å; Y108-H112 HydrophobicContact CD1-CB 4.45Å | ||
| 109 | R | 61.1 | Low | 77.4 | Confident | 196 Ų | 196 | 94.6 Ų | 94.6 | 74% | 0.74 | 45% | 0.449 | S | S | * | . | trans | -60.7 | 147.5 | 165.3 | -72.6 | -173.8 | -175.8 | 176.2 | 2.5 | 109.2 | Y111 H112 | R109-Y111 PolarHBondContact O-N 3.42Å; R109-H112 PolarHBondContact O-N 3.3Å | ||
| 110 | L | 60.4 | Low | 77.4 | Confident | 122 Ų | 122 | 93.6 Ų | 93.6 | 64% | 0.639 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -43.7 | -34.1 | -175.6 | -83.4 | 133.8 | 0 | 0 | 0 | 114.8 | H112 L113 K114 | L110-H112 PolarHBondContact O-N 2.75Å; L110-L113 PolarHBondContact O-N 2.86Å; L110-K114 PolarHBondContact O-N 3.06Å |
| 111 | Y | 59.3 | Low | 77.5 | Confident | 209 Ų | 209 | 93.7 Ų | 93.7 | 82% | 0.82 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -64.4 | -36.4 | 178.7 | -67.9 | -74.2 | 0 | 0 | 0 | 114 | R109 | R109-Y111 PolarHBondContact O-N 3.42Å |
| 112 | H | 71.4 | Confident | 77.9 | Confident | 124 Ų | 124 | 97.7 Ų | 97.7 | 57% | 0.574 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -78.1 | -29.5 | 177.1 | -66.4 | -74.1 | 0 | 0 | 0 | 112 | Y108 R109 L110 K114 Y116 | Y108-H112 HydrophobicContact CD1-CB 4.45Å; R109-H112 PolarHBondContact O-N 3.3Å; L110-H112 PolarHBondContact O-N 2.75Å; H112-K114 VanDerWaalsContact C-N 3.32Å; H112-K114 PolarHBondContact O-N 3.19Å; H112-Y116 VanDerWaalsContact O-CD2 3.23Å; H112-Y116 WeakPolarHBondContact O-CD2 3.4Å |
| 113 | L | 75.3 | Confident | 78.3 | Confident | 11 Ų | 11 | 99.1 Ų | 99.1 | 6% | 0.058 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -68.7 | -29.4 | -179.4 | -171.9 | 65.9 | 0 | 0 | 0 | 112.8 | A101 I102 L110 S115 Y116 L117 | A101-L113 HydrophobicContact CB-CD1 3.63Å; I102-L113 HydrophobicContact CG1-CD1 4.22Å; I102-L113 HydrophobicContact CG1-CD2 4.37Å; L110-L113 PolarHBondContact O-N 2.86Å; L113-S115 PolarHBondContact O-N 3.32Å; L113-Y116 PolarHBondContact O-N 3.49Å; L113-L117 HydrophobicContact CD1-CG 4.37Å; L113-L117 HydrophobicContact CD2-CD1 3.89Å; L113-L117 HydrophobicContact CG-CD1 3.68Å; L113-L117 HydrophobicContact CG-CG 3.99Å; L113-L117 PolarHBondContact O-N 3.36Å |
| 114 | K | 80.1 | Confident | 78.7 | Confident | 161 Ų | 161 | 98.3 Ų | 98.3 | 70% | 0.7 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -57.3 | -42.7 | -174.6 | -172.1 | 177.4 | 180 | -179.2 | 0 | 113.2 | L110 H112 R118 | L110-K114 PolarHBondContact O-N 3.06Å; H112-K114 VanDerWaalsContact C-N 3.32Å; H112-K114 PolarHBondContact O-N 3.19Å; K114-R118 WeakPolarHBondContact O-CB 3.15Å; K114-R118 PolarHBondContact O-N 2.92Å |
| 115 | S | 85.6 | Confident | 79.3 | Confident | 89 Ų | 89 | 97 Ų | 97 | 62% | 0.622 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -69.4 | -40.5 | -179.5 | -61.1 | 0 | 0 | 0 | 0 | 112.2 | L113 R118 A119 | L113-S115 PolarHBondContact O-N 3.32Å; S115-R118 PolarHBondContact O-N 3.43Å; S115-A119 WeakPolarHBondContact O-CB 3.47Å; S115-A119 PolarHBondContact O-N 3.08Å |
| 116 | Y | 85.3 | Confident | 80.4 | Confident | 99 Ų | 99 | 99.5 Ų | 99.5 | 39% | 0.388 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.7 | -43.4 | 176.6 | -68 | -77.8 | 0 | 0 | 0 | 112.1 | I97 H112 L113 A119 W120 | I97-Y116 HydrophobicContact CG2-CD1 3.86Å; I97-Y116 HydrophobicContact CG2-CE1 4.07Å; H112-Y116 VanDerWaalsContact O-CD2 3.23Å; H112-Y116 WeakPolarHBondContact O-CD2 3.4Å; L113-Y116 PolarHBondContact O-N 3.49Å; Y116-A119 PolarHBondContact O-N 3.45Å; Y116-W120 WeakPolarHBondContact O-CB 3.27Å; Y116-W120 PolarHBondContact O-N 3.21Å |
| 117 | L | 85.7 | Confident | 81.5 | Confident | 45 Ų | 45 | 95.9 Ų | 95.9 | 24% | 0.236 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -62.8 | -42.4 | 175.7 | -74.5 | 171.3 | 0 | 0 | 0 | 111.8 | C29 V98 L113 W120 C121 | C29-L117 WeakPolarHBondContact SG-CD2 3.26Å; V98-L117 HydrophobicContact CG1-CD2 3.97Å; L113-L117 HydrophobicContact CD1-CG 4.37Å; L113-L117 HydrophobicContact CD2-CD1 3.89Å; L113-L117 HydrophobicContact CG-CD1 3.68Å; L113-L117 HydrophobicContact CG-CG 3.99Å; L113-L117 PolarHBondContact O-N 3.36Å; L117-W120 PolarHBondContact O-N 3.01Å; L117-C121 PolarHBondContact O-N 2.93Å; L117-C121 PolarHBondContact O-SG 2.88Å; L117-C121 VanDerWaalsContact O-SG 3.38Å |
| 118 | R | 88.3 | Confident | 82.6 | Confident | 191 Ų | 191 | 92.1 Ų | 92.1 | 72% | 0.721 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -61.8 | -44.9 | 176.1 | -172.8 | 179.9 | -177.9 | -176.3 | 0.8 | 111.4 | K114 S115 C121 I122 | K114-R118 WeakPolarHBondContact O-CB 3.15Å; K114-R118 PolarHBondContact O-N 2.92Å; S115-R118 PolarHBondContact O-N 3.43Å; R118-C121 PolarHBondContact O-N 3.38Å; R118-I122 HydrophobicContact CG-CD1 4.13Å; R118-I122 VanDerWaalsContact O-CG1 3.3Å; R118-I122 WeakPolarHBondContact O-CG1 3.13Å; R118-I122 PolarHBondContact O-N 3.28Å; R118-I122 VanDerWaalsContact O-N 3.08Å |
| 119 | A | 90.1 | Very high | 84.2 | Confident | 37 Ų | 37 | 93.9 Ų | 93.9 | 31% | 0.306 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.8 | -44.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | M94 S115 Y116 C121 I122 I123 | M94-A119 HydrophobicContact CE-CB 4.05Å; S115-A119 WeakPolarHBondContact O-CB 3.47Å; S115-A119 PolarHBondContact O-N 3.08Å; Y116-A119 PolarHBondContact O-N 3.45Å; A119-C121 PolarHBondContact O-N 3.23Å; A119-I122 PolarHBondContact O-N 3.23Å; A119-I123 VanDerWaalsContact O-CG1 3.26Å; A119-I123 WeakPolarHBondContact O-CG1 3.35Å; A119-I123 PolarHBondContact O-N 3.33Å |
| 120 | W | 90 | Very high | 85.7 | Confident | 16 Ų | 16 | 85.3 Ų | 85.3 | 6% | 0.061 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 177 | -178.5 | 81.1 | 0 | 0 | 0 | 112.4 | T33 T36 S95 V98 Y116 L117 I122 I123 M124 | T33-W120 HydrophobicContact CG2-CZ2 4.26Å; T36-W120 HydrophobicContact CG2-CZ2 4.2Å; S95-W120 PolarHBondContact OG-NE1 3.25Å; V98-W120 HydrophobicContact CG2-CB 3.77Å; V98-W120 HydrophobicContact CG2-CG 3.92Å; Y116-W120 WeakPolarHBondContact O-CB 3.27Å; Y116-W120 PolarHBondContact O-N 3.21Å; L117-W120 PolarHBondContact O-N 3.01Å; W120-I122 PolarHBondContact O-N 3.33Å; W120-I123 PolarHBondContact O-N 3.04Å; W120-M124 HydrophobicContact CD2-CG 4.11Å; W120-M124 HydrophobicContact CE3-CG 4.43Å; W120-M124 HydrophobicContact CH2-CE 4.48Å; W120-M124 HydrophobicContact CH2-CG 4.27Å; W120-M124 HydrophobicContact CZ2-CE 4.32Å; W120-M124 HydrophobicContact CZ2-CG 3.93Å; W120-M124 HydrophobicContact CZ2-SD 4.25Å; W120-M124 WeakPolarHBondContact O-CB 3.19Å; W120-M124 WeakPolarHBondContact O-CG 3.49Å; W120-M124 PolarHBondContact O-N 3.2Å |
| 121 | C | 90.6 | Very high | 87.2 | Confident | 63 Ų | 63 | 82.6 Ų | 82.6 | 43% | 0.426 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -59.2 | -43.2 | 173.5 | -74 | 0 | 0 | 0 | 0 | 112.8 | L117 R118 A119 M124 I125 | L117-C121 PolarHBondContact O-N 2.93Å; L117-C121 PolarHBondContact O-SG 2.88Å; L117-C121 VanDerWaalsContact O-SG 3.38Å; R118-C121 PolarHBondContact O-N 3.38Å; A119-C121 PolarHBondContact O-N 3.23Å; C121-M124 PolarHBondContact O-N 3.27Å; C121-I125 WeakPolarHBondContact O-CG1 3.38Å; C121-I125 PolarHBondContact O-N 3.38Å |
| 122 | I | 93.4 | Very high | 88.7 | Confident | 86 Ų | 86 | 78.3 Ų | 78.3 | 44% | 0.441 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.7 | -45.7 | 178.5 | -68.2 | 164.7 | 0 | 0 | 0 | 110.3 | R118 A119 W120 M124 I125 L126 | R118-I122 HydrophobicContact CG-CD1 4.13Å; R118-I122 VanDerWaalsContact O-CG1 3.3Å; R118-I122 WeakPolarHBondContact O-CG1 3.13Å; R118-I122 PolarHBondContact O-N 3.28Å; R118-I122 VanDerWaalsContact O-N 3.08Å; A119-I122 PolarHBondContact O-N 3.23Å; W120-I122 PolarHBondContact O-N 3.33Å; I122-M124 VanDerWaalsContact C-N 3.33Å; I122-M124 PolarHBondContact O-N 3.12Å; I122-I125 PolarHBondContact O-N 3.39Å; I122-L126 HydrophobicContact CG2-CD1 4.07Å; I122-L126 WeakPolarHBondContact O-CG 3.46Å; I122-L126 PolarHBondContact O-N 3.38Å |
| 123 | I | 93.4 | Very high | 89.6 | Confident | 37 Ų | 37 | 74.4 Ų | 74.4 | 19% | 0.19 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64.4 | -39.7 | 179.6 | -68.2 | 168.3 | 0 | 0 | 0 | 110.9 | I90 L91 M94 A119 W120 I125 L126 Y127 | I90-I123 HydrophobicContact CG2-CG2 4.22Å; L91-I123 HydrophobicContact CD1-CG2 4.22Å; M94-I123 HydrophobicContact CB-CD1 4.28Å; M94-I123 HydrophobicContact CE-CD1 3.83Å; M94-I123 HydrophobicContact CG-CD1 3.53Å; M94-I123 HydrophobicContact SD-CD1 4.05Å; A119-I123 VanDerWaalsContact O-CG1 3.26Å; A119-I123 WeakPolarHBondContact O-CG1 3.35Å; A119-I123 PolarHBondContact O-N 3.33Å; W120-I123 PolarHBondContact O-N 3.04Å; I123-I125 PolarHBondContact O-N 3.03Å; I123-L126 PolarHBondContact O-N 3.34Å; I123-Y127 VanDerWaalsContact O-CB 3.27Å; I123-Y127 WeakPolarHBondContact O-CB 3.31Å; I123-Y127 PolarHBondContact O-N 2.95Å |
| 124 | M | 91.8 | Very high | 90.2 | Very high | 35 Ų | 35 | 74.9 Ų | 74.9 | 17% | 0.172 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -58.8 | -46.1 | 173.2 | -80.6 | -68.5 | -80.6 | 0 | 0 | 112.2 | T36 L91 W120 C121 I122 Y127 Q128 | T36-M124 HydrophobicContact CG2-CE 3.81Å; T36-M124 HydrophobicContact CG2-SD 3.5Å; T36-M124 VanDerWaalsContact CG2-SD 3.5Å; L91-M124 HydrophobicContact CD1-CG 4.07Å; L91-M124 HydrophobicContact CD1-SD 3.42Å; L91-M124 WeakPolarHBondContact CD1-SD 2.99Å; L91-M124 HydrophobicContact CD2-SD 4.1Å; L91-M124 HydrophobicContact CG-SD 4.38Å; W120-M124 HydrophobicContact CD2-CG 4.11Å; W120-M124 HydrophobicContact CE3-CG 4.43Å; W120-M124 HydrophobicContact CH2-CE 4.48Å; W120-M124 HydrophobicContact CH2-CG 4.27Å; W120-M124 HydrophobicContact CZ2-CE 4.32Å; W120-M124 HydrophobicContact CZ2-CG 3.93Å; W120-M124 HydrophobicContact CZ2-SD 4.25Å; W120-M124 WeakPolarHBondContact O-CB 3.19Å; W120-M124 WeakPolarHBondContact O-CG 3.49Å; W120-M124 PolarHBondContact O-N 3.2Å; C121-M124 PolarHBondContact O-N 3.27Å; I122-M124 VanDerWaalsContact C-N 3.33Å; I122-M124 PolarHBondContact O-N 3.12Å; M124-Y127 PolarHBondContact O-N 2.99Å; M124-Q128 VanDerWaalsContact O-CG 3.31Å; M124-Q128 WeakPolarHBondContact O-CG 3.32Å; M124-Q128 PolarHBondContact O-N 2.99Å |
| 125 | I | 93.1 | Very high | 90.6 | Very high | 108 Ų | 108 | 68.1 Ų | 68.1 | 55% | 0.554 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.6 | -46.1 | 177.9 | -67.8 | 165.9 | 0 | 0 | 0 | 110.7 | C121 I122 I123 Y127 Q128 I129 | C121-I125 WeakPolarHBondContact O-CG1 3.38Å; C121-I125 PolarHBondContact O-N 3.38Å; I122-I125 PolarHBondContact O-N 3.39Å; I123-I125 PolarHBondContact O-N 3.03Å; I125-Y127 VanDerWaalsContact C-N 3.33Å; I125-Y127 PolarHBondContact O-N 3.42Å; I125-Q128 PolarHBondContact O-N 3.32Å; I125-I129 HydrophobicContact CG2-CD1 4.19Å; I125-I129 WeakPolarHBondContact O-CG1 3.36Å; I125-I129 PolarHBondContact O-N 2.99Å; I125-I129 VanDerWaalsContact O-N 3.12Å |
| 126 | L | 93.9 | Very high | 90.6 | Very high | 107 Ų | 107 | 68.3 Ų | 68.3 | 56% | 0.56 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -61.9 | -41.6 | 177.6 | -69.6 | 173.1 | 0 | 0 | 0 | 112 | I122 I123 Q128 I129 A130 | I122-L126 HydrophobicContact CG2-CD1 4.07Å; I122-L126 WeakPolarHBondContact O-CG 3.46Å; I122-L126 PolarHBondContact O-N 3.38Å; I123-L126 PolarHBondContact O-N 3.34Å; L126-Q128 VanDerWaalsContact C-N 3.35Å; L126-Q128 PolarHBondContact O-N 3.49Å; L126-I129 PolarHBondContact O-N 2.91Å; L126-A130 WeakPolarHBondContact O-CB 2.95Å; L126-A130 PolarHBondContact O-N 3.22Å |
| 127 | Y | 93.6 | Very high | 90.6 | Very high | 24 Ų | 24 | 66.4 Ų | 66.4 | 9% | 0.094 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -61.2 | -42.1 | 175.7 | 178.3 | -90.1 | 0 | 0 | 0 | 111.7 | M84 A87 N88 L91 I123 M124 I125 I129 A130 N131 | M84-Y127 HydrophobicContact CE-CE2 4.33Å; A87-Y127 HydrophobicContact CB-CD2 3.99Å; A87-Y127 HydrophobicContact CB-CE2 4.14Å; N88-Y127 PolarHBondContact OD1-OH 3.41Å; L91-Y127 HydrophobicContact CB-CD2 4.23Å; L91-Y127 HydrophobicContact CD2-CD1 3.79Å; L91-Y127 HydrophobicContact CD2-CD2 3.82Å; L91-Y127 HydrophobicContact CD2-CE1 3.97Å; L91-Y127 HydrophobicContact CD2-CE2 4.01Å; L91-Y127 HydrophobicContact CD2-CG 3.73Å; I123-Y127 VanDerWaalsContact O-CB 3.27Å; I123-Y127 WeakPolarHBondContact O-CB 3.31Å; I123-Y127 PolarHBondContact O-N 2.95Å; M124-Y127 PolarHBondContact O-N 2.99Å; I125-Y127 VanDerWaalsContact C-N 3.33Å; I125-Y127 PolarHBondContact O-N 3.42Å; Y127-I129 VanDerWaalsContact C-N 3.35Å; Y127-I129 PolarHBondContact O-N 3.3Å; Y127-A130 WeakPolarHBondContact O-CB 3.21Å; Y127-A130 PolarHBondContact O-N 3.41Å; Y127-N131 HydrophobicContact CE1-CB 4.3Å; Y127-N131 VanDerWaalsContact O-CB 3.28Å; Y127-N131 WeakPolarHBondContact O-CB 3.2Å; Y127-N131 PolarHBondContact O-N 2.84Å |
| 128 | Q | 92.8 | Very high | 90.4 | Very high | 102 Ų | 102 | 65.9 Ų | 65.9 | 48% | 0.477 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.6 | -38.6 | 177.3 | -68 | -63.2 | -8.2 | 0 | 0 | 112.3 | M124 I125 L126 N131 L132 | M124-Q128 VanDerWaalsContact O-CG 3.31Å; M124-Q128 WeakPolarHBondContact O-CG 3.32Å; M124-Q128 PolarHBondContact O-N 2.99Å; I125-Q128 PolarHBondContact O-N 3.32Å; L126-Q128 VanDerWaalsContact C-N 3.35Å; L126-Q128 PolarHBondContact O-N 3.49Å; Q128-N131 PolarHBondContact O-N 3.36Å; Q128-L132 VanDerWaalsContact O-CB 3.26Å; Q128-L132 WeakPolarHBondContact O-CB 3.41Å; Q128-L132 PolarHBondContact O-N 3.41Å |
| 129 | I | 93.7 | Very high | 90 | Very high | 109 Ų | 109 | 65 Ų | 65 | 56% | 0.559 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64.9 | -44.9 | 174.9 | -65.1 | 167 | 0 | 0 | 0 | 110.6 | I125 L126 Y127 L132 G133 | I125-I129 HydrophobicContact CG2-CD1 4.19Å; I125-I129 WeakPolarHBondContact O-CG1 3.36Å; I125-I129 PolarHBondContact O-N 2.99Å; I125-I129 VanDerWaalsContact O-N 3.12Å; L126-I129 PolarHBondContact O-N 2.91Å; Y127-I129 VanDerWaalsContact C-N 3.35Å; Y127-I129 PolarHBondContact O-N 3.3Å; I129-L132 PolarHBondContact O-N 3.07Å; I129-G133 PolarHBondContact O-N 2.96Å |
| 130 | A | 92.8 | Very high | 89.5 | Confident | 17 Ų | 17 | 65.8 Ų | 65.8 | 14% | 0.14 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -58.3 | -49.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | F83 L126 Y127 L132 G133 V134 | F83-A130 HydrophobicContact CE1-CB 3.51Å; F83-A130 HydrophobicContact CZ-CB 3.99Å; L126-A130 WeakPolarHBondContact O-CB 2.95Å; L126-A130 PolarHBondContact O-N 3.22Å; Y127-A130 WeakPolarHBondContact O-CB 3.21Å; Y127-A130 PolarHBondContact O-N 3.41Å; A130-L132 VanDerWaalsContact C-N 3.34Å; A130-L132 PolarHBondContact O-N 3.39Å; A130-G133 PolarHBondContact O-N 3.08Å; A130-V134 WeakPolarHBondContact O-CG2 3.35Å; A130-V134 PolarHBondContact O-N 2.86Å |
| 131 | N | 90.5 | Very high | 88.6 | Confident | 65 Ų | 65 | 69.3 Ų | 69.3 | 35% | 0.348 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.9 | -39.8 | 178.9 | -170.5 | 39.4 | 0 | 0 | 0 | 111.8 | M84 Y127 Q128 G135 | M84-N131 HydrophobicContact CE-CB 4.26Å; M84-N131 WeakPolarHBondContact CE-OD1 3.3Å; Y127-N131 HydrophobicContact CE1-CB 4.3Å; Y127-N131 VanDerWaalsContact O-CB 3.28Å; Y127-N131 WeakPolarHBondContact O-CB 3.2Å; Y127-N131 PolarHBondContact O-N 2.84Å; Q128-N131 PolarHBondContact O-N 3.36Å; N131-G135 PolarHBondContact O-N 3.21Å |
| 132 | L | 91.2 | Very high | 87.5 | Confident | 119 Ų | 119 | 72.5 Ų | 72.5 | 62% | 0.623 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63.1 | -45.4 | 173.5 | -177.3 | 68.1 | 0 | 0 | 0 | 111.3 | Q128 I129 A130 G135 V136 | Q128-L132 VanDerWaalsContact O-CB 3.26Å; Q128-L132 WeakPolarHBondContact O-CB 3.41Å; Q128-L132 PolarHBondContact O-N 3.41Å; I129-L132 PolarHBondContact O-N 3.07Å; A130-L132 VanDerWaalsContact C-N 3.34Å; A130-L132 PolarHBondContact O-N 3.39Å; L132-G135 PolarHBondContact O-N 2.78Å; L132-V136 HydrophobicContact CD1-CG2 4.41Å; L132-V136 HydrophobicContact CG-CG2 4.5Å; L132-V136 WeakPolarHBondContact O-CB 3.35Å; L132-V136 VanDerWaalsContact O-CG2 3.27Å; L132-V136 WeakPolarHBondContact O-CG2 3.46Å; L132-V136 PolarHBondContact O-N 2.76Å |
| 133 | G | 90.2 | Very high | 86 | Confident | 42 Ų | 42 | 69.2 Ų | 69.2 | 43% | 0.433 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -61.9 | -45.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | I129 A130 V136 Y137 | I129-G133 PolarHBondContact O-N 2.96Å; A130-G133 PolarHBondContact O-N 3.08Å; G133-V136 PolarHBondContact O-N 3.08Å; G133-Y137 PolarHBondContact O-N 3.45Å |
| 134 | V | 89.3 | Confident | 84.5 | Confident | 20 Ų | 20 | 73.4 Ų | 73.4 | 12% | 0.121 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65.3 | -43.8 | 175.2 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | C80 F83 M84 A130 V136 Y137 T138 | C80-V134 HydrophobicContact CB-CG1 3.86Å; C80-V134 HydrophobicContact CB-CG2 4.33Å; F83-V134 HydrophobicContact CD1-CG2 4.1Å; M84-V134 HydrophobicContact CG-CB 4.23Å; M84-V134 HydrophobicContact CG-CG1 3.97Å; M84-V134 HydrophobicContact CG-CG2 3.9Å; M84-V134 HydrophobicContact SD-CB 4.24Å; M84-V134 HydrophobicContact SD-CG2 3.95Å; A130-V134 WeakPolarHBondContact O-CG2 3.35Å; A130-V134 PolarHBondContact O-N 2.86Å; V134-V136 PolarHBondContact O-N 3.17Å; V134-Y137 WeakPolarHBondContact O-CB 3.46Å; V134-Y137 PolarHBondContact O-N 2.92Å; V134-Y137 VanDerWaalsContact O-N 3.15Å; V134-T138 HydrophobicContact CG1-CG2 4.19Å; V134-T138 WeakPolarHBondContact O-CG2 3.34Å; V134-T138 PolarHBondContact O-N 2.99Å; V134-T138 PolarHBondContact O-OG1 2.94Å |
| 135 | G | 87 | Confident | 83.1 | Confident | 19 Ų | 19 | 74.5 Ų | 74.5 | 20% | 0.196 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -58.6 | -46 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | N131 L132 Y137 T138 Y139 | N131-G135 PolarHBondContact O-N 3.21Å; L132-G135 PolarHBondContact O-N 2.78Å; G135-Y137 VanDerWaalsContact C-N 3.3Å; G135-Y137 PolarHBondContact O-N 3.38Å; G135-T138 PolarHBondContact O-N 3.32Å; G135-T138 PolarHBondContact O-OG1 3.5Å; G135-T138 VanDerWaalsContact O-OG1 3.06Å; G135-Y139 VanDerWaalsContact O-CB 3.31Å; G135-Y139 WeakPolarHBondContact O-CB 3.46Å; G135-Y139 WeakPolarHBondContact O-CD2 3.34Å; G135-Y139 PolarHBondContact O-N 3.34Å |
| 136 | V | 86.5 | Confident | 81.5 | Confident | 93 Ų | 93 | 72.2 Ų | 72.2 | 56% | 0.564 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -61.4 | -41.9 | 175.7 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | L132 G133 V134 S140 | L132-V136 HydrophobicContact CD1-CG2 4.41Å; L132-V136 HydrophobicContact CG-CG2 4.5Å; L132-V136 WeakPolarHBondContact O-CB 3.35Å; L132-V136 VanDerWaalsContact O-CG2 3.27Å; L132-V136 WeakPolarHBondContact O-CG2 3.46Å; L132-V136 PolarHBondContact O-N 2.76Å; G133-V136 PolarHBondContact O-N 3.08Å; V134-V136 PolarHBondContact O-N 3.17Å; V136-S140 WeakPolarHBondContact O-CB 3.23Å; V136-S140 PolarHBondContact O-N 3.35Å; V136-S140 PolarHBondContact O-OG 2.9Å |
| 137 | Y | 84.9 | Confident | 80 | Confident | 59 Ų | 59 | 76.5 Ų | 76.5 | 23% | 0.231 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -61.3 | -52.4 | 175.9 | 178.9 | -97.5 | 0 | 0 | 0 | 111.5 | F73 G76 F77 C80 G133 V134 G135 S140 W141 | F73-Y137 PolarHBondContact O-OH 3.11Å; G76-Y137 WeakPolarHBondContact CA-OH 3.28Å; F77-Y137 HydrophobicContact CD1-CE1 4.27Å; F77-Y137 HydrophobicContact CE1-CE1 4.36Å; F77-Y137 HydrophobicContact CG-CE1 4.38Å; C80-Y137 WeakPolarHBondContact SG-CD1 3.44Å; G133-Y137 PolarHBondContact O-N 3.45Å; V134-Y137 WeakPolarHBondContact O-CB 3.46Å; V134-Y137 PolarHBondContact O-N 2.92Å; V134-Y137 VanDerWaalsContact O-N 3.15Å; G135-Y137 VanDerWaalsContact C-N 3.3Å; G135-Y137 PolarHBondContact O-N 3.38Å; Y137-S140 PolarHBondContact O-N 3.32Å; Y137-S140 PolarHBondContact O-OG 3.4Å; Y137-W141 AromaticContact CD2-NE1 3.76Å; Y137-W141 AromaticContact CE2-NE1 3.34Å; Y137-W141 VanDerWaalsContact CE2-NE1 3.34Å; Y137-W141 AromaticContact CZ-CD1 3.94Å; Y137-W141 AromaticContact CZ-NE1 3.55Å |
| 138 | T | 82.3 | Confident | 78.8 | Confident | 35 Ų | 35 | 80.5 Ų | 80.5 | 22% | 0.215 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -63.7 | -46.2 | -178.4 | 59.2 | 0 | 0 | 0 | 0 | 111.9 | F77 V134 G135 S140 W141 Y142 | F77-T138 HydrophobicContact CD1-CG2 4.08Å; F77-T138 HydrophobicContact CE1-CG2 3.74Å; V134-T138 HydrophobicContact CG1-CG2 4.19Å; V134-T138 WeakPolarHBondContact O-CG2 3.34Å; V134-T138 PolarHBondContact O-N 2.99Å; V134-T138 PolarHBondContact O-OG1 2.94Å; G135-T138 PolarHBondContact O-N 3.32Å; G135-T138 PolarHBondContact O-OG1 3.5Å; G135-T138 VanDerWaalsContact O-OG1 3.06Å; T138-S140 VanDerWaalsContact C-N 3.33Å; T138-S140 PolarHBondContact O-N 3.44Å; T138-W141 PolarHBondContact O-N 3Å; T138-Y142 WeakPolarHBondContact O-CD2 3.22Å; T138-Y142 PolarHBondContact O-N 2.88Å |
| 139 | Y | 79.2 | Confident | 77.4 | Confident | 173 Ų | 173 | 83.9 Ų | 83.9 | 68% | 0.678 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -67.9 | -28.1 | 177.9 | -81 | -69.5 | 0 | 0 | 0 | 113.4 | G135 W141 G143 | G135-Y139 VanDerWaalsContact O-CB 3.31Å; G135-Y139 WeakPolarHBondContact O-CB 3.46Å; G135-Y139 WeakPolarHBondContact O-CD2 3.34Å; G135-Y139 PolarHBondContact O-N 3.34Å; Y139-W141 PolarHBondContact O-N 3.33Å; Y139-G143 WeakPolarHBondContact O-CA 3.32Å; Y139-G143 PolarHBondContact O-N 2.98Å |
| 140 | S | 79.1 | Confident | 76.3 | Confident | 53 Ų | 53 | 81.7 Ų | 81.7 | 37% | 0.371 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.7 | -28.8 | 175 | 70.6 | 0 | 0 | 0 | 0 | 112.4 | V136 Y137 T138 L144 | V136-S140 WeakPolarHBondContact O-CB 3.23Å; V136-S140 PolarHBondContact O-N 3.35Å; V136-S140 PolarHBondContact O-OG 2.9Å; Y137-S140 PolarHBondContact O-N 3.32Å; Y137-S140 PolarHBondContact O-OG 3.4Å; T138-S140 VanDerWaalsContact C-N 3.33Å; T138-S140 PolarHBondContact O-N 3.44Å; S140-L144 WeakPolarHBondContact O-CB 3.49Å |
| 141 | W | 70.8 | Confident | 75.4 | Confident | 90 Ų | 90 | 89.5 Ų | 89.5 | 34% | 0.341 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -92.8 | -54.1 | 177.9 | -60.1 | 111.7 | 0 | 0 | 0 | 112.2 | W69 F73 F77 Y137 T138 Y139 A145 | W69-W141 HydrophobicContact CZ3-CZ3 4.08Å; F73-W141 AromaticContact CD1-CD2 3.72Å; F73-W141 HydrophobicContact CD1-CD2 3.72Å; F73-W141 AromaticContact CD1-CE2 3.33Å; F73-W141 AromaticContact CD1-CE3 3.97Å; F73-W141 HydrophobicContact CD1-CE3 3.97Å; F73-W141 AromaticContact CD1-CH2 3.64Å; F73-W141 HydrophobicContact CD1-CH2 3.64Å; F73-W141 AromaticContact CD1-CZ2 3.35Å; F73-W141 HydrophobicContact CD1-CZ2 3.35Å; F73-W141 AromaticContact CD1-CZ3 3.92Å; F73-W141 HydrophobicContact CD1-CZ3 3.92Å; F73-W141 AromaticContact CD1-NE1 3.81Å; F73-W141 HydrophobicContact CE1-CD2 4.11Å; F73-W141 AromaticContact CE1-CE2 3.54Å; F73-W141 HydrophobicContact CE1-CE3 4.07Å; F73-W141 AromaticContact CE1-CH2 2.96Å; F73-W141 HydrophobicContact CE1-CH2 2.96Å; F73-W141 AromaticContact CE1-CZ2 2.99Å; F73-W141 HydrophobicContact CE1-CZ2 2.99Å; F73-W141 AromaticContact CE1-CZ3 3.52Å; F73-W141 HydrophobicContact CE1-CZ3 3.52Å; F73-W141 HydrophobicContact CG-CD2 4.41Å; F73-W141 HydrophobicContact CG-CE3 4.48Å; F73-W141 AromaticContact CZ-CH2 3.49Å; F73-W141 HydrophobicContact CZ-CH2 3.49Å; F73-W141 VanDerWaalsContact CZ-CH2 3.49Å; F73-W141 AromaticContact CZ-CZ2 3.99Å; F73-W141 HydrophobicContact CZ-CZ2 3.99Å; F73-W141 AromaticContact CZ-CZ3 3.79Å; F73-W141 HydrophobicContact CZ-CZ3 3.79Å; F77-W141 HydrophobicContact CE2-CB 4.49Å; F77-W141 HydrophobicContact CZ-CB 4.02Å; F77-W141 HydrophobicContact CZ-CG 4.31Å; Y137-W141 AromaticContact CD2-NE1 3.76Å; Y137-W141 AromaticContact CE2-NE1 3.34Å; Y137-W141 VanDerWaalsContact CE2-NE1 3.34Å; Y137-W141 AromaticContact CZ-CD1 3.94Å; Y137-W141 AromaticContact CZ-NE1 3.55Å; T138-W141 PolarHBondContact O-N 3Å; Y139-W141 PolarHBondContact O-N 3.33Å; W141-A145 WeakPolarHBondContact O-CB 3.46Å; W141-A145 PolarHBondContact O-N 3.11Å; W141-A145 VanDerWaalsContact O-N 3.07Å |
| 142 | Y | 68.9 | Low | 74.8 | Confident | 129 Ų | 129 | 90.9 Ų | 90.9 | 51% | 0.506 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -69.8 | -37.7 | -178.6 | -74.8 | -70.1 | 0 | 0 | 0 | 112.2 | F77 T138 A145 A146 | F77-Y142 HydrophobicContact CD1-CE2 4.41Å; F77-Y142 HydrophobicContact CE1-CD2 4.06Å; F77-Y142 AromaticContact CE1-CE2 3.43Å; F77-Y142 HydrophobicContact CE1-CE2 3.43Å; F77-Y142 VanDerWaalsContact CE1-CE2 3.43Å; F77-Y142 HydrophobicContact CE2-CE2 4.49Å; F77-Y142 AromaticContact CZ-CD2 4Å; F77-Y142 HydrophobicContact CZ-CD2 4Å; F77-Y142 AromaticContact CZ-CE2 3.48Å; F77-Y142 HydrophobicContact CZ-CE2 3.48Å; F77-Y142 VanDerWaalsContact CZ-CE2 3.48Å; T138-Y142 WeakPolarHBondContact O-CD2 3.22Å; T138-Y142 PolarHBondContact O-N 2.88Å; Y142-A145 PolarHBondContact O-N 2.77Å; Y142-A146 VanDerWaalsContact O-CB 3.22Å; Y142-A146 WeakPolarHBondContact O-CB 3.38Å; Y142-A146 PolarHBondContact O-N 3.46Å |
| 143 | G | 61 | Low | 74.1 | Confident | 18 Ų | 18 | 88.7 Ų | 88.7 | 19% | 0.186 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -62.3 | -47.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | Y139 A145 A146 W147 | Y139-G143 WeakPolarHBondContact O-CA 3.32Å; Y139-G143 PolarHBondContact O-N 2.98Å; G143-A145 VanDerWaalsContact C-N 3.32Å; G143-A145 PolarHBondContact O-N 2.83Å; G143-A146 PolarHBondContact O-N 3.29Å; G143-W147 WeakPolarHBondContact O-CB 3.32Å; G143-W147 PolarHBondContact O-N 2.8Å |
| 144 | L | 63 | Low | 73.6 | Confident | 124 Ų | 124 | 90.5 Ų | 90.5 | 65% | 0.649 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.4 | -37.1 | 179.3 | -154.4 | 138.8 | 0 | 0 | 0 | 111.8 | S140 L148 | S140-L144 WeakPolarHBondContact O-CB 3.49Å; L144-L148 WeakPolarHBondContact O-CB 3.22Å; L144-L148 PolarHBondContact O-N 3.36Å |
| 145 | A | 60.7 | Low | 73.2 | Confident | 58 Ų | 58 | 96.4 Ų | 96.4 | 48% | 0.479 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.6 | -41.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | W141 Y142 G143 L148 W149 | W141-A145 WeakPolarHBondContact O-CB 3.46Å; W141-A145 PolarHBondContact O-N 3.11Å; W141-A145 VanDerWaalsContact O-N 3.07Å; Y142-A145 PolarHBondContact O-N 2.77Å; G143-A145 VanDerWaalsContact C-N 3.32Å; G143-A145 PolarHBondContact O-N 2.83Å; A145-L148 PolarHBondContact O-N 3.28Å; A145-W149 WeakPolarHBondContact O-CB 3.38Å; A145-W149 PolarHBondContact O-N 2.9Å |
| 146 | A | 59.7 | Low | 72.6 | Confident | 60 Ų | 60 | 98.5 Ų | 98.5 | 50% | 0.496 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.2 | -39.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y142 G143 W149 C150 | Y142-A146 VanDerWaalsContact O-CB 3.22Å; Y142-A146 WeakPolarHBondContact O-CB 3.38Å; Y142-A146 PolarHBondContact O-N 3.46Å; G143-A146 PolarHBondContact O-N 3.29Å; A146-W149 PolarHBondContact O-N 3.47Å; A146-C150 WeakPolarHBondContact O-CB 3.3Å; A146-C150 PolarHBondContact O-N 2.99Å |
| 147 | W | 63.5 | Low | 72.2 | Confident | 198 Ų | 198 | 101 Ų | 101 | 75% | 0.75 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.8 | -42.9 | 172.3 | -81.2 | 109.8 | 0 | 0 | 0 | 111.5 | G143 W149 C150 W151 | G143-W147 WeakPolarHBondContact O-CB 3.32Å; G143-W147 PolarHBondContact O-N 2.8Å; W147-W149 VanDerWaalsContact C-N 3.33Å; W147-C150 PolarHBondContact O-N 3.21Å; W147-W151 WeakPolarHBondContact O-CB 3.45Å; W147-W151 PolarHBondContact O-N 2.83Å |
| 148 | L | 68.8 | Low | 72.1 | Confident | 108 Ų | 108 | 103.3 Ų | 103.3 | 57% | 0.565 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.2 | -41.2 | 174.5 | -160.6 | 102.4 | 0 | 0 | 0 | 111.2 | L144 A145 W151 I152 | L144-L148 WeakPolarHBondContact O-CB 3.22Å; L144-L148 PolarHBondContact O-N 3.36Å; A145-L148 PolarHBondContact O-N 3.28Å; L148-W151 WeakPolarHBondContact O-CB 3.38Å; L148-W151 PolarHBondContact O-N 3.46Å; L148-I152 HydrophobicContact CD2-CD1 3.9Å; L148-I152 HydrophobicContact CG-CD1 4.26Å; L148-I152 VanDerWaalsContact O-CG1 3.23Å; L148-I152 WeakPolarHBondContact O-CG1 3.4Å; L148-I152 PolarHBondContact O-N 2.84Å |
| 149 | W | 62.4 | Low | 71.9 | Confident | 173 Ų | 173 | 104.4 Ų | 104.4 | 66% | 0.655 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.9 | -43.4 | 178.9 | -147.7 | 83 | 0 | 0 | 0 | 111.6 | A145 A146 W147 W151 I152 I153 | A145-W149 WeakPolarHBondContact O-CB 3.38Å; A145-W149 PolarHBondContact O-N 2.9Å; A146-W149 PolarHBondContact O-N 3.47Å; W147-W149 VanDerWaalsContact C-N 3.33Å; W149-W151 VanDerWaalsContact C-N 3.32Å; W149-W151 PolarHBondContact O-N 3.3Å; W149-I152 PolarHBondContact O-N 2.88Å; W149-I153 HydrophobicContact CD2-CD1 4.3Å; W149-I153 HydrophobicContact CD2-CG1 4.47Å; W149-I153 HydrophobicContact CE3-CD1 3.27Å; W149-I153 HydrophobicContact CE3-CG1 3.86Å; W149-I153 HydrophobicContact CH2-CD1 3.89Å; W149-I153 HydrophobicContact CH2-CG1 4.18Å; W149-I153 HydrophobicContact CZ3-CD1 3.04Å; W149-I153 HydrophobicContact CZ3-CG1 3.73Å; W149-I153 WeakPolarHBondContact O-CG1 3.28Å; W149-I153 PolarHBondContact O-N 3.33Å |
| 150 | C | 70.7 | Confident | 71.7 | Confident | 63 Ų | 63 | 102.3 Ų | 102.3 | 43% | 0.426 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.2 | -44.3 | 172.1 | -175.7 | 0 | 0 | 0 | 0 | 111.1 | A146 W147 I152 I153 C154 | A146-C150 WeakPolarHBondContact O-CB 3.3Å; A146-C150 PolarHBondContact O-N 2.99Å; W147-C150 PolarHBondContact O-N 3.21Å; C150-I152 PolarHBondContact O-N 3.46Å; C150-I153 PolarHBondContact O-N 3.21Å; C150-C154 WeakPolarHBondContact O-CB 3.35Å; C150-C154 PolarHBondContact O-N 2.87Å; C150-C154 PolarHBondContact O-SG 3.24Å |
| 151 | W | 73.6 | Confident | 71.5 | Confident | 181 Ų | 181 | 103.1 Ų | 103.1 | 69% | 0.686 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.3 | -43.6 | 174.8 | -170.4 | -73.2 | 0 | 0 | 0 | 112.2 | W147 L148 W149 C154 W155 | W147-W151 WeakPolarHBondContact O-CB 3.45Å; W147-W151 PolarHBondContact O-N 2.83Å; L148-W151 WeakPolarHBondContact O-CB 3.38Å; L148-W151 PolarHBondContact O-N 3.46Å; W149-W151 VanDerWaalsContact C-N 3.32Å; W149-W151 PolarHBondContact O-N 3.3Å; W151-C154 PolarHBondContact O-N 2.96Å; W151-W155 VanDerWaalsContact O-CB 3.28Å; W151-W155 WeakPolarHBondContact O-CB 3.43Å; W151-W155 PolarHBondContact O-N 2.84Å |
| 152 | I | 77.2 | Confident | 71.8 | Confident | 93 Ų | 93 | 102.2 Ų | 102.2 | 48% | 0.477 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62 | -45.2 | 178 | -70.6 | 162.9 | 0 | 0 | 0 | 110.7 | L148 W149 C150 W155 S156 | L148-I152 HydrophobicContact CD2-CD1 3.9Å; L148-I152 HydrophobicContact CG-CD1 4.26Å; L148-I152 VanDerWaalsContact O-CG1 3.23Å; L148-I152 WeakPolarHBondContact O-CG1 3.4Å; L148-I152 PolarHBondContact O-N 2.84Å; W149-I152 PolarHBondContact O-N 2.88Å; C150-I152 PolarHBondContact O-N 3.46Å; I152-W155 PolarHBondContact O-N 3.45Å; I152-S156 WeakPolarHBondContact O-CB 3.23Å; I152-S156 PolarHBondContact O-N 2.88Å; I152-S156 PolarHBondContact O-OG 2.89Å |
| 153 | I | 77.6 | Confident | 72 | Confident | 74 Ų | 74 | 100.6 Ų | 100.6 | 38% | 0.379 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63 | -46.9 | 175.9 | -61.2 | 166.8 | 0 | 0 | 0 | 111 | W149 C150 W155 S156 Y157 | W149-I153 HydrophobicContact CD2-CD1 4.3Å; W149-I153 HydrophobicContact CD2-CG1 4.47Å; W149-I153 HydrophobicContact CE3-CD1 3.27Å; W149-I153 HydrophobicContact CE3-CG1 3.86Å; W149-I153 HydrophobicContact CH2-CD1 3.89Å; W149-I153 HydrophobicContact CH2-CG1 4.18Å; W149-I153 HydrophobicContact CZ3-CD1 3.04Å; W149-I153 HydrophobicContact CZ3-CG1 3.73Å; W149-I153 WeakPolarHBondContact O-CG1 3.28Å; W149-I153 PolarHBondContact O-N 3.33Å; C150-I153 PolarHBondContact O-N 3.21Å; I153-W155 VanDerWaalsContact C-N 3.25Å; I153-W155 PolarHBondContact O-N 3.37Å; I153-S156 WeakPolarHBondContact CA-OG 3.39Å; I153-S156 PolarHBondContact O-N 3.26Å; I153-S156 PolarHBondContact O-OG 2.82Å; I153-Y157 VanDerWaalsContact O-CB 3.3Å; I153-Y157 WeakPolarHBondContact O-CB 3.39Å; I153-Y157 PolarHBondContact O-N 3.28Å |
| 154 | C | 79.6 | Confident | 72.5 | Confident | 79 Ų | 79 | 102.1 Ų | 102.1 | 53% | 0.534 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.7 | -38.7 | -180 | -71.4 | 0 | 0 | 0 | 0 | 111.1 | C150 W151 K158 | C150-C154 WeakPolarHBondContact O-CB 3.35Å; C150-C154 PolarHBondContact O-N 2.87Å; C150-C154 PolarHBondContact O-SG 3.24Å; W151-C154 PolarHBondContact O-N 2.96Å; C154-K158 WeakPolarHBondContact O-CB 3.37Å; C154-K158 PolarHBondContact O-N 2.91Å |
| 155 | W | 79.7 | Confident | 72.7 | Confident | 144 Ų | 144 | 100.6 Ų | 100.6 | 55% | 0.545 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -69.3 | -43.3 | 175.9 | -168.9 | -91.3 | 0 | 0 | 0 | 112.1 | W151 I152 I153 Y157 K158 V159 | W151-W155 VanDerWaalsContact O-CB 3.28Å; W151-W155 WeakPolarHBondContact O-CB 3.43Å; W151-W155 PolarHBondContact O-N 2.84Å; I152-W155 PolarHBondContact O-N 3.45Å; I153-W155 VanDerWaalsContact C-N 3.25Å; I153-W155 PolarHBondContact O-N 3.37Å; W155-Y157 VanDerWaalsContact C-N 3.31Å; W155-Y157 PolarHBondContact O-N 3.37Å; W155-K158 PolarHBondContact O-N 2.95Å; W155-V159 WeakPolarHBondContact O-CG2 3.3Å; W155-V159 PolarHBondContact O-N 2.86Å |
| 156 | S | 76.2 | Confident | 72.9 | Confident | 64 Ų | 64 | 104.5 Ų | 104.5 | 45% | 0.448 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -40.2 | 176.8 | 63.9 | 0 | 0 | 0 | 0 | 111.4 | I152 I153 V159 E160 | I152-S156 WeakPolarHBondContact O-CB 3.23Å; I152-S156 PolarHBondContact O-N 2.88Å; I152-S156 PolarHBondContact O-OG 2.89Å; I153-S156 WeakPolarHBondContact CA-OG 3.39Å; I153-S156 PolarHBondContact O-N 3.26Å; I153-S156 PolarHBondContact O-OG 2.82Å; S156-V159 PolarHBondContact O-N 3.35Å; S156-E160 WeakPolarHBondContact O-CB 3.44Å; S156-E160 PolarHBondContact O-N 3.21Å |
| 157 | Y | 78.2 | Confident | 72.8 | Confident | 145 Ų | 145 | 105 Ų | 105 | 57% | 0.569 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.3 | -39.2 | 175.6 | -168.7 | -109.5 | 0 | 0 | 0 | 111.9 | I153 W155 E160 I161 | I153-Y157 VanDerWaalsContact O-CB 3.3Å; I153-Y157 WeakPolarHBondContact O-CB 3.39Å; I153-Y157 PolarHBondContact O-N 3.28Å; W155-Y157 VanDerWaalsContact C-N 3.31Å; W155-Y157 PolarHBondContact O-N 3.37Å; Y157-E160 PolarHBondContact O-N 3Å; Y157-I161 HydrophobicContact CD1-CD1 3.68Å; Y157-I161 HydrophobicContact CE1-CD1 3.37Å; Y157-I161 HydrophobicContact CE1-CG1 4.31Å; Y157-I161 WeakPolarHBondContact O-CG1 3.43Å; Y157-I161 PolarHBondContact O-N 3.43Å |
| 158 | K | 81.8 | Confident | 72.4 | Confident | 108 Ų | 108 | 101.6 Ų | 101.6 | 47% | 0.47 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.9 | -47 | 173.4 | -172.5 | -171.5 | 171.6 | -169.4 | 0 | 111.6 | C154 W155 E160 I161 D162 | C154-K158 WeakPolarHBondContact O-CB 3.37Å; C154-K158 PolarHBondContact O-N 2.91Å; W155-K158 PolarHBondContact O-N 2.95Å; K158-E160 VanDerWaalsContact C-N 3.31Å; K158-E160 PolarHBondContact O-N 2.85Å; K158-I161 PolarHBondContact O-N 2.93Å; K158-D162 VanDerWaalsContact O-CG 3.26Å; K158-D162 PolarHBondContact O-N 3.39Å |
| 159 | V | 77.5 | Confident | 71.7 | Confident | 58 Ų | 58 | 101.8 Ų | 101.8 | 35% | 0.352 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.2 | -39.2 | 177.7 | 171 | 0 | 0 | 0 | 0 | 111.2 | W155 S156 D162 I163 | W155-V159 WeakPolarHBondContact O-CG2 3.3Å; W155-V159 PolarHBondContact O-N 2.86Å; S156-V159 PolarHBondContact O-N 3.35Å; V159-D162 PolarHBondContact O-N 3.38Å; V159-I163 HydrophobicContact CG1-CD1 3.78Å; V159-I163 HydrophobicContact CG1-CG1 4.41Å; V159-I163 VanDerWaalsContact O-CG1 3.25Å; V159-I163 WeakPolarHBondContact O-CG1 3.25Å; V159-I163 PolarHBondContact O-N 2.99Å |
| 160 | E | 75.3 | Confident | 71.3 | Confident | 128 Ų | 128 | 99 Ų | 99 | 60% | 0.598 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.6 | -40.3 | 175.5 | -169.6 | 175.5 | -174.1 | 0 | 0 | 112 | S156 Y157 K158 A164 | S156-E160 WeakPolarHBondContact O-CB 3.44Å; S156-E160 PolarHBondContact O-N 3.21Å; Y157-E160 PolarHBondContact O-N 3Å; K158-E160 VanDerWaalsContact C-N 3.31Å; K158-E160 PolarHBondContact O-N 2.85Å; E160-A164 WeakPolarHBondContact O-CB 3.42Å; E160-A164 PolarHBondContact O-N 3.42Å |
| 161 | I | 76.1 | Confident | 70.6 | Confident | 70 Ų | 70 | 103 Ų | 103 | 36% | 0.359 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.8 | -44.9 | 173.1 | -70.3 | 169.4 | 0 | 0 | 0 | 111.4 | Y157 K158 I163 A164 L165 | Y157-I161 HydrophobicContact CD1-CD1 3.68Å; Y157-I161 HydrophobicContact CE1-CD1 3.37Å; Y157-I161 HydrophobicContact CE1-CG1 4.31Å; Y157-I161 WeakPolarHBondContact O-CG1 3.43Å; Y157-I161 PolarHBondContact O-N 3.43Å; K158-I161 PolarHBondContact O-N 2.93Å; I161-I163 VanDerWaalsContact C-N 3.33Å; I161-I163 PolarHBondContact O-N 3.37Å; I161-A164 PolarHBondContact O-N 2.92Å; I161-L165 HydrophobicContact CG2-CD1 3.76Å; I161-L165 HydrophobicContact CG2-CG 4.39Å; I161-L165 WeakPolarHBondContact O-CG 3.36Å; I161-L165 PolarHBondContact O-N 3.46Å |
| 162 | D | 76.4 | Confident | 69.7 | Low | 71 Ų | 71 | 99.8 Ų | 99.8 | 38% | 0.38 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.8 | -42.3 | -179.6 | -69.5 | -19.2 | 0 | 0 | 0 | 110.3 | K158 V159 L165 E166 | K158-D162 VanDerWaalsContact O-CG 3.26Å; K158-D162 PolarHBondContact O-N 3.39Å; V159-D162 PolarHBondContact O-N 3.38Å; D162-L165 PolarHBondContact O-N 3.2Å; D162-E166 PolarHBondContact O-N 2.94Å |
| 163 | I | 73 | Confident | 68.8 | Low | 95 Ų | 95 | 96.8 Ų | 96.8 | 49% | 0.487 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.2 | -42.1 | 174.2 | -67.2 | 166 | 0 | 0 | 0 | 111.4 | V159 I161 L165 E166 T167 | V159-I163 HydrophobicContact CG1-CD1 3.78Å; V159-I163 HydrophobicContact CG1-CG1 4.41Å; V159-I163 VanDerWaalsContact O-CG1 3.25Å; V159-I163 WeakPolarHBondContact O-CG1 3.25Å; V159-I163 PolarHBondContact O-N 2.99Å; I161-I163 VanDerWaalsContact C-N 3.33Å; I161-I163 PolarHBondContact O-N 3.37Å; I163-L165 VanDerWaalsContact C-N 3.32Å; I163-L165 PolarHBondContact O-N 2.99Å; I163-E166 PolarHBondContact O-N 3.31Å; I163-T167 WeakPolarHBondContact O-CG2 3.43Å; I163-T167 PolarHBondContact O-N 3.11Å; I163-T167 PolarHBondContact O-OG1 3.31Å |
| 164 | A | 71 | Confident | 67.8 | Low | 51 Ų | 51 | 98 Ų | 98 | 42% | 0.421 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | E160 I161 T167 E168 | E160-A164 WeakPolarHBondContact O-CB 3.42Å; E160-A164 PolarHBondContact O-N 3.42Å; I161-A164 PolarHBondContact O-N 2.92Å; A164-T167 PolarHBondContact O-N 3.07Å; A164-T167 PolarHBondContact O-OG1 3.41Å; A164-E168 PolarHBondContact O-N 3.33Å |
| 165 | L | 68.1 | Low | 66.9 | Low | 92 Ų | 92 | 101 Ų | 101 | 48% | 0.482 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.8 | -42.4 | 175.6 | -74.2 | 165.6 | 0 | 0 | 0 | 112.1 | I161 D162 I163 T167 E168 D169 | I161-L165 HydrophobicContact CG2-CD1 3.76Å; I161-L165 HydrophobicContact CG2-CG 4.39Å; I161-L165 WeakPolarHBondContact O-CG 3.36Å; I161-L165 PolarHBondContact O-N 3.46Å; D162-L165 PolarHBondContact O-N 3.2Å; I163-L165 VanDerWaalsContact C-N 3.32Å; I163-L165 PolarHBondContact O-N 2.99Å; L165-T167 VanDerWaalsContact C-N 3.26Å; L165-T167 PolarHBondContact O-N 3.45Å; L165-E168 PolarHBondContact O-N 2.77Å; L165-E168 VanDerWaalsContact O-N 3.07Å; L165-D169 PolarHBondContact O-N 3.41Å; L165-D169 VanDerWaalsContact O-N 3.11Å |
| 166 | E | 64.5 | Low | 66 | Low | 139 Ų | 139 | 98.6 Ų | 98.6 | 65% | 0.65 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.7 | -37.4 | 174.7 | -78.2 | -178.1 | 174.7 | 0 | 0 | 111.8 | D162 I163 E168 D169 D170 | D162-E166 PolarHBondContact O-N 2.94Å; I163-E166 PolarHBondContact O-N 3.31Å; E166-E168 VanDerWaalsContact C-N 3.3Å; E166-E168 PolarHBondContact O-N 3.47Å; E166-D169 PolarHBondContact O-N 3.06Å; E166-D170 PolarHBondContact O-N 2.85Å |
| 167 | T | 57.1 | Low | 64.9 | Low | 71 Ų | 71 | 104 Ų | 104 | 44% | 0.436 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -71.4 | -20.6 | 176.3 | 61.4 | 0 | 0 | 0 | 0 | 114.4 | I163 A164 L165 K171 | I163-T167 WeakPolarHBondContact O-CG2 3.43Å; I163-T167 PolarHBondContact O-N 3.11Å; I163-T167 PolarHBondContact O-OG1 3.31Å; A164-T167 PolarHBondContact O-N 3.07Å; A164-T167 PolarHBondContact O-OG1 3.41Å; L165-T167 VanDerWaalsContact C-N 3.26Å; L165-T167 PolarHBondContact O-N 3.45Å; T167-K171 WeakPolarHBondContact O-CG 3.32Å; T167-K171 PolarHBondContact O-N 2.77Å |
| 168 | E | 55.2 | Low | 64 | Low | 127 Ų | 127 | 100.1 Ų | 100.1 | 59% | 0.593 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -77.4 | -39.8 | 170.1 | -77.3 | -165.8 | 152.6 | 0 | 0 | 111.5 | A164 L165 E166 D170 K171 M172 | A164-E168 PolarHBondContact O-N 3.33Å; L165-E168 PolarHBondContact O-N 2.77Å; L165-E168 VanDerWaalsContact O-N 3.07Å; E166-E168 VanDerWaalsContact C-N 3.3Å; E166-E168 PolarHBondContact O-N 3.47Å; E168-D170 VanDerWaalsContact C-N 3.31Å; E168-D170 PolarHBondContact O-N 3.32Å; E168-K171 PolarHBondContact O-N 3.27Å; E168-M172 PolarHBondContact O-N 2.95Å |
| 169 | D | 54.5 | Low | 62.9 | Low | 111 Ų | 111 | 98.7 Ų | 98.7 | 59% | 0.594 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.9 | -35.8 | 174.6 | -84.2 | -18.5 | 0 | 0 | 0 | 111.7 | L165 E166 M172 A173 | L165-D169 PolarHBondContact O-N 3.41Å; L165-D169 VanDerWaalsContact O-N 3.11Å; E166-D169 PolarHBondContact O-N 3.06Å; D169-M172 PolarHBondContact O-N 3.33Å; D169-A173 WeakPolarHBondContact O-CB 3.43Å; D169-A173 PolarHBondContact O-N 2.97Å |
| 170 | D | 54.5 | Low | 61.9 | Low | 114 Ų | 114 | 100.1 Ų | 100.1 | 61% | 0.61 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -70.2 | -34.8 | 176.4 | -127 | 11 | 0 | 0 | 0 | 112 | E166 E168 M172 A173 V174 | E166-D170 PolarHBondContact O-N 2.85Å; E168-D170 VanDerWaalsContact C-N 3.31Å; E168-D170 PolarHBondContact O-N 3.32Å; D170-M172 VanDerWaalsContact C-N 3.35Å; D170-A173 PolarHBondContact O-N 3.46Å; D170-V174 WeakPolarHBondContact O-CB 3.22Å; D170-V174 WeakPolarHBondContact O-CG2 3.46Å; D170-V174 PolarHBondContact O-N 3.43Å |
| 171 | K | 55.3 | Low | 61 | Low | 149 Ų | 149 | 99 Ų | 99 | 65% | 0.648 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.4 | -37 | 171.4 | -75.1 | 172.7 | -174.7 | 168.8 | 0 | 111.8 | T167 E168 Y175 | T167-K171 WeakPolarHBondContact O-CG 3.32Å; T167-K171 PolarHBondContact O-N 2.77Å; E168-K171 PolarHBondContact O-N 3.27Å; K171-Y175 WeakPolarHBondContact O-CB 3.26Å; K171-Y175 PolarHBondContact O-N 3.28Å |
| 172 | M | 55.6 | Low | 60.1 | Low | 112 Ų | 112 | 101.4 Ų | 101.4 | 55% | 0.552 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -71.1 | -37.8 | 175.9 | -147.5 | -170.7 | -63.3 | 0 | 0 | 111.1 | E168 D169 D170 Y175 I176 | E168-M172 PolarHBondContact O-N 2.95Å; D169-M172 PolarHBondContact O-N 3.33Å; D170-M172 VanDerWaalsContact C-N 3.35Å; M172-Y175 PolarHBondContact O-N 3.28Å; M172-I176 HydrophobicContact CG-CD1 4.39Å; M172-I176 WeakPolarHBondContact O-CB 3.22Å; M172-I176 WeakPolarHBondContact O-CG1 3.5Å; M172-I176 PolarHBondContact O-N 2.87Å |
| 173 | A | 56.8 | Low | 59.2 | Low | 30 Ų | 30 | 102.5 Ų | 102.5 | 25% | 0.248 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -64 | -47.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | D169 D170 Y175 I176 Y177 | D169-A173 WeakPolarHBondContact O-CB 3.43Å; D169-A173 PolarHBondContact O-N 2.97Å; D170-A173 PolarHBondContact O-N 3.46Å; A173-Y175 VanDerWaalsContact C-N 3.29Å; A173-Y175 PolarHBondContact O-N 2.82Å; A173-I176 PolarHBondContact O-N 3.48Å; A173-Y177 HydrophobicContact CB-CD2 4.47Å; A173-Y177 WeakPolarHBondContact O-CB 3.1Å; A173-Y177 WeakPolarHBondContact O-CD2 3.35Å; A173-Y177 PolarHBondContact O-N 2.98Å |
| 174 | V | 58 | Low | 58.4 | Low | 100 Ų | 100 | 100.6 Ų | 100.6 | 61% | 0.606 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.3 | -39.1 | 174.7 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | D170 S178 | D170-V174 WeakPolarHBondContact O-CB 3.22Å; D170-V174 WeakPolarHBondContact O-CG2 3.46Å; D170-V174 PolarHBondContact O-N 3.43Å; V174-S178 WeakPolarHBondContact O-CB 3.38Å; V174-S178 PolarHBondContact O-N 3.24Å; V174-S178 PolarHBondContact O-OG 3.39Å |
| 175 | Y | 60.5 | Low | 57.5 | Low | 143 Ų | 143 | 102.9 Ų | 102.9 | 56% | 0.561 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.1 | -45.3 | 174.6 | -173.5 | -100.2 | 0 | 0 | 0 | 112.1 | K171 M172 A173 S178 Q179 | K171-Y175 WeakPolarHBondContact O-CB 3.26Å; K171-Y175 PolarHBondContact O-N 3.28Å; M172-Y175 PolarHBondContact O-N 3.28Å; A173-Y175 VanDerWaalsContact C-N 3.29Å; A173-Y175 PolarHBondContact O-N 2.82Å; Y175-S178 PolarHBondContact O-N 3.38Å; Y175-S178 PolarHBondContact O-OG 3.2Å; Y175-Q179 HydrophobicContact CD1-CG 4.23Å; Y175-Q179 HydrophobicContact CE1-CG 3.93Å; Y175-Q179 VanDerWaalsContact O-CG 3.28Å; Y175-Q179 WeakPolarHBondContact O-CG 3.34Å; Y175-Q179 PolarHBondContact O-N 3Å; Y175-Q179 PolarHBondContact OH-NE2 3.16Å |
| 176 | I | 60 | Low | 56.9 | Low | 92 Ų | 92 | 107.1 Ų | 107.1 | 47% | 0.472 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64 | -43.6 | 177.7 | -68.6 | 165.6 | 0 | 0 | 0 | 110.9 | M172 A173 S178 Q179 V180 | M172-I176 HydrophobicContact CG-CD1 4.39Å; M172-I176 WeakPolarHBondContact O-CB 3.22Å; M172-I176 WeakPolarHBondContact O-CG1 3.5Å; M172-I176 PolarHBondContact O-N 2.87Å; A173-I176 PolarHBondContact O-N 3.48Å; I176-S178 PolarHBondContact O-N 2.73Å; I176-Q179 PolarHBondContact O-N 3.3Å; I176-V180 HydrophobicContact CG2-CG2 4.39Å; I176-V180 VanDerWaalsContact O-CG2 3.26Å; I176-V180 WeakPolarHBondContact O-CG2 3.44Å; I176-V180 PolarHBondContact O-N 3.26Å |
| 177 | Y | 53.3 | Low | 56.5 | Low | 179 Ų | 179 | 105 Ų | 105 | 70% | 0.702 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.8 | -36.9 | 176.2 | -78.3 | -67.5 | 0 | 0 | 0 | 112.2 | A173 Q179 V180 D181 | A173-Y177 HydrophobicContact CB-CD2 4.47Å; A173-Y177 WeakPolarHBondContact O-CB 3.1Å; A173-Y177 WeakPolarHBondContact O-CD2 3.35Å; A173-Y177 PolarHBondContact O-N 2.98Å; Y177-Q179 VanDerWaalsContact C-N 3.34Å; Y177-Q179 PolarHBondContact O-N 3.17Å; Y177-V180 PolarHBondContact O-N 3.14Å; Y177-D181 PolarHBondContact O-N 3.47Å; Y177-D181 VanDerWaalsContact O-N 3.14Å |
| 178 | S | 60.1 | Low | 56.2 | Low | 62 Ų | 62 | 103.2 Ų | 103.2 | 43% | 0.434 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65 | -36.3 | 174.6 | 74.2 | 0 | 0 | 0 | 0 | 112.8 | V174 Y175 I176 E182 | V174-S178 WeakPolarHBondContact O-CB 3.38Å; V174-S178 PolarHBondContact O-N 3.24Å; V174-S178 PolarHBondContact O-OG 3.39Å; Y175-S178 PolarHBondContact O-N 3.38Å; Y175-S178 PolarHBondContact O-OG 3.2Å; I176-S178 PolarHBondContact O-N 2.73Å; S178-E182 PolarHBondContact O-N 2.99Å |
| 179 | Q | 58.1 | Low | 56 | Low | 79 Ų | 79 | 101.8 Ų | 101.8 | 37% | 0.369 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -74.1 | -33.5 | 177 | -71.8 | -105.6 | -35.7 | 0 | 0 | 112.8 | Y175 I176 Y177 N183 | Y175-Q179 HydrophobicContact CD1-CG 4.23Å; Y175-Q179 HydrophobicContact CE1-CG 3.93Å; Y175-Q179 VanDerWaalsContact O-CG 3.28Å; Y175-Q179 WeakPolarHBondContact O-CG 3.34Å; Y175-Q179 PolarHBondContact O-N 3Å; Y175-Q179 PolarHBondContact OH-NE2 3.16Å; I176-Q179 PolarHBondContact O-N 3.3Å; Y177-Q179 VanDerWaalsContact C-N 3.34Å; Y177-Q179 PolarHBondContact O-N 3.17Å; Q179-N183 WeakPolarHBondContact O-CB 3.28Å; Q179-N183 PolarHBondContact O-N 2.95Å; Q179-N183 VanDerWaalsContact O-N 3.16Å; Q179-N183 PolarHBondContact O-ND2 3.37Å; Q179-N183 VanDerWaalsContact O-ND2 3.17Å |
| 180 | V | 57.5 | Low | 55.9 | Low | 88 Ų | 88 | 100.6 Ų | 100.6 | 53% | 0.533 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -69 | -37.7 | 176.9 | 170.6 | 0 | 0 | 0 | 0 | 110.8 | I176 Y177 S184 | I176-V180 HydrophobicContact CG2-CG2 4.39Å; I176-V180 VanDerWaalsContact O-CG2 3.26Å; I176-V180 WeakPolarHBondContact O-CG2 3.44Å; I176-V180 PolarHBondContact O-N 3.26Å; Y177-V180 PolarHBondContact O-N 3.14Å; V180-S184 WeakPolarHBondContact O-CB 3.34Å; V180-S184 PolarHBondContact O-N 3.25Å; V180-S184 PolarHBondContact O-OG 2.92Å |
| 181 | D | 56.1 | Low | 55.8 | Low | 104 Ų | 104 | 99.4 Ų | 99.4 | 56% | 0.556 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -72 | -35.4 | 178.3 | -141.5 | 15.2 | 0 | 0 | 0 | 112.1 | Y177 S184 L185 | Y177-D181 PolarHBondContact O-N 3.47Å; Y177-D181 VanDerWaalsContact O-N 3.14Å; D181-S184 WeakPolarHBondContact CA-OG 3.47Å; D181-S184 PolarHBondContact O-OG 2.89Å; D181-L185 WeakPolarHBondContact O-CB 3.38Å; D181-L185 WeakPolarHBondContact O-CD1 3.46Å; D181-L185 PolarHBondContact O-N 3.21Å |
| 182 | E | 56.9 | Low | 55.4 | Low | 121 Ų | 121 | 100.5 Ų | 100.5 | 57% | 0.565 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -70.3 | -35.2 | 177 | -151.1 | 176.8 | -166.2 | 0 | 0 | 112.5 | S178 R186 | S178-E182 PolarHBondContact O-N 2.99Å; E182-R186 PolarHBondContact O-N 2.75Å; E182-R186 VanDerWaalsContact O-N 3.11Å |
| 183 | N | 57.2 | Low | 55 | Low | 94 Ų | 94 | 104.6 Ų | 104.6 | 50% | 0.503 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -78.3 | -32.1 | 177 | -76.8 | -37.7 | 0 | 0 | 0 | 113.2 | Q179 T187 | Q179-N183 WeakPolarHBondContact O-CB 3.28Å; Q179-N183 PolarHBondContact O-N 2.95Å; Q179-N183 VanDerWaalsContact O-N 3.16Å; Q179-N183 PolarHBondContact O-ND2 3.37Å; Q179-N183 VanDerWaalsContact O-ND2 3.17Å; N183-T187 PolarHBondContact O-N 3.48Å; N183-T187 PolarHBondContact O-OG1 3.06Å |
| 184 | S | 56.4 | Low | 54.2 | Low | 55 Ų | 55 | 114.1 Ų | 114.1 | 39% | 0.385 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.8 | -37.8 | 173.5 | 70.2 | 0 | 0 | 0 | 0 | 111.2 | V180 D181 T187 G188 | V180-S184 WeakPolarHBondContact O-CB 3.34Å; V180-S184 PolarHBondContact O-N 3.25Å; V180-S184 PolarHBondContact O-OG 2.92Å; D181-S184 WeakPolarHBondContact CA-OG 3.47Å; D181-S184 PolarHBondContact O-OG 2.89Å; S184-T187 WeakPolarHBondContact CA-OG1 3.46Å; S184-T187 PolarHBondContact O-N 3.05Å; S184-T187 PolarHBondContact O-OG1 2.95Å; S184-G188 PolarHBondContact O-N 3.11Å |
| 185 | L | 51.9 | Low | 54 | Low | 98 Ų | 98 | 114.9 Ų | 114.9 | 51% | 0.513 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.2 | -39.8 | 172.4 | -94.8 | 144.1 | 0 | 0 | 0 | 112.6 | D181 I189 | D181-L185 WeakPolarHBondContact O-CB 3.38Å; D181-L185 WeakPolarHBondContact O-CD1 3.46Å; D181-L185 PolarHBondContact O-N 3.21Å; L185-I189 HydrophobicContact CD2-CD1 4.05Å; L185-I189 WeakPolarHBondContact O-CB 3.44Å; L185-I189 WeakPolarHBondContact O-CD1 3.22Å; L185-I189 WeakPolarHBondContact O-CG1 3.47Å; L185-I189 PolarHBondContact O-N 3.38Å |
| 186 | R | 54.8 | Low | 53.6 | Low | 181 Ų | 181 | 113.4 Ų | 113.4 | 68% | 0.683 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -68 | -36.1 | 175.5 | -84.4 | -175.3 | 173.5 | -151.9 | -0.1 | 113.7 | E182 S190 | E182-R186 PolarHBondContact O-N 2.75Å; E182-R186 VanDerWaalsContact O-N 3.11Å; R186-S190 WeakPolarHBondContact O-CB 3.37Å; R186-S190 PolarHBondContact O-N 3.47Å; R186-S190 PolarHBondContact O-OG 3.42Å |
| 187 | T | 56.6 | Low | 53.3 | Low | 96 Ų | 96 | 114.6 Ų | 114.6 | 59% | 0.589 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -78.1 | -30.3 | 176.6 | 44.6 | 0 | 0 | 0 | 0 | 112.3 | N183 S184 S190 S191 | N183-T187 PolarHBondContact O-N 3.48Å; N183-T187 PolarHBondContact O-OG1 3.06Å; S184-T187 WeakPolarHBondContact CA-OG1 3.46Å; S184-T187 PolarHBondContact O-N 3.05Å; S184-T187 PolarHBondContact O-OG1 2.95Å; T187-S190 PolarHBondContact O-OG 3.35Å; T187-S191 PolarHBondContact O-N 2.77Å |
| 188 | G | 51.7 | Low | 53.3 | Low | 33 Ų | 33 | 110.8 Ų | 110.8 | 34% | 0.34 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.2 | -44.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | S184 S191 | S184-G188 PolarHBondContact O-N 3.11Å; G188-S191 PolarHBondContact O-N 2.76Å; G188-S191 PolarHBondContact O-OG 2.96Å |
| 189 | I | 50.1 | Low | 52.8 | Low | 97 Ų | 97 | 113.8 Ų | 113.8 | 50% | 0.497 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -74.2 | -33 | -177.6 | -66.3 | 167.7 | 0 | 0 | 0 | 112.1 | L185 S191 F192 Y193 | L185-I189 HydrophobicContact CD2-CD1 4.05Å; L185-I189 WeakPolarHBondContact O-CB 3.44Å; L185-I189 WeakPolarHBondContact O-CD1 3.22Å; L185-I189 WeakPolarHBondContact O-CG1 3.47Å; L185-I189 PolarHBondContact O-N 3.38Å; I189-S191 VanDerWaalsContact C-N 3.28Å; I189-S191 PolarHBondContact O-N 3.22Å; I189-F192 PolarHBondContact O-N 3.2Å; I189-Y193 HydrophobicContact CG2-CD2 4.36Å |
| 190 | S | 52.7 | Low | 52.5 | Low | 86 Ų | 86 | 116.1 Ų | 116.1 | 60% | 0.601 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -71.5 | -20.2 | 174.8 | 51.9 | 0 | 0 | 0 | 0 | 113.6 | R186 T187 F192 | R186-S190 WeakPolarHBondContact O-CB 3.37Å; R186-S190 PolarHBondContact O-N 3.47Å; R186-S190 PolarHBondContact O-OG 3.42Å; T187-S190 PolarHBondContact O-OG 3.35Å; S190-F192 VanDerWaalsContact C-N 3.29Å |
| 191 | S | 51.6 | Low | 52.1 | Low | 89 Ų | 89 | 118.1 Ų | 118.1 | 62% | 0.622 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.7 | -12.7 | 171.6 | 77.1 | 0 | 0 | 0 | 0 | 114 | T187 G188 I189 | T187-S191 PolarHBondContact O-N 2.77Å; G188-S191 PolarHBondContact O-N 2.76Å; G188-S191 PolarHBondContact O-OG 2.96Å; I189-S191 VanDerWaalsContact C-N 3.28Å; I189-S191 PolarHBondContact O-N 3.22Å |
| 192 | F | 47.6 | Very low | 51.8 | Low | 172 Ų | 172 | 119.2 Ų | 119.2 | 75% | 0.754 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -102.2 | -8 | -177.3 | -100.5 | -85.5 | 0 | 0 | 0 | 114.7 | I189 S190 | I189-F192 PolarHBondContact O-N 3.2Å; S190-F192 VanDerWaalsContact C-N 3.29Å |
| 193 | Y | 47.9 | Very low | 51.4 | Low | 198 Ų | 198 | 119.1 Ų | 119.1 | 78% | 0.776 | 63% | 0.625 | S | S | * | * | trans | -127.2 | 47.2 | -174.5 | -83 | -81.3 | 0 | 0 | 0 | 113.6 | I189 | I189-Y193 HydrophobicContact CG2-CD2 4.36Š| ||
| 194 | N | 38.8 | Very low | 50.9 | Low | 230 Ų | 230 | 121.4 Ų | 121.4 | 100% | 1.23 | 64% | 0.636 | S | S | * | * | trans | -80.2 | 0 | 143.4 | -92 | -21.6 | 0 | 0 | 0 | 109.3 |
Retrieved 194 of 194 residues in 156.1 ms
(Link to these results)