| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33.2 | Very low | 37.9 | Very low | 254 Ų | 254 | 116.3 Ų | 116.3 | 100% | 1.251 | 63% | 0.63 | S | S | * | * | 0 | 90.7 | 0 | -100.5 | 175 | 144.6 | 0 | 0 | 108.7 | |||||
| 2 | S | 32.1 | Very low | 38.6 | Very low | 105 Ų | 105 | 116.2 Ų | 116.2 | 73% | 0.734 | 63% | 0.628 | S | S | * | * | trans | -117.4 | 113.4 | 172.4 | 39.5 | 0 | 0 | 0 | 0 | 108 | L4 | S2-L4 PolarHBondContact O-N 2.91Å; S2-L4 VanDerWaalsContact O-N 3.13Å | ||
| 3 | K | 36.6 | Very low | 38.9 | Very low | 212 Ų | 212 | 119.5 Ų | 119.5 | 92% | 0.922 | 63% | 0.626 | S | S | * | * | trans | -71.1 | 100.2 | 173.1 | -75.3 | 177 | 177.4 | 174.4 | 0 | 107.9 | S5 | K3-S5 PolarHBondContact O-N 3.12Š| ||
| 4 | L | 39.1 | Very low | 39.1 | Very low | 126 Ų | 126 | 120 Ų | 120 | 66% | 0.66 | 62% | 0.621 | S | S | * | * | trans | -72 | 108.7 | 160 | -101.2 | 86 | 0 | 0 | 0 | 107.6 | S2 | S2-L4 PolarHBondContact O-N 2.91Å; S2-L4 VanDerWaalsContact O-N 3.13Å | ||
| 5 | S | 39.1 | Very low | 39 | Very low | 59 Ų | 59 | 118.4 Ų | 118.4 | 41% | 0.413 | 62% | 0.618 | S | S | . | * | trans | -71.5 | 146.5 | 170.6 | 177.9 | 0 | 0 | 0 | 0 | 109.4 | K3 T7 S8 | K3-S5 PolarHBondContact O-N 3.12Å; S5-T7 PolarHBondContact O-N 3Å; S5-T7 PolarHBondContact OG-N 2.91Å; S5-T7 PolarHBondContact OG-OG1 3.37Å; S5-S8 WeakPolarHBondContact O-CA 3.15Å; S5-S8 VanDerWaalsContact O-CB 3.3Å; S5-S8 WeakPolarHBondContact O-CB 3.42Å; S5-S8 PolarHBondContact O-N 3.38Å | ||
| 6 | M | 35.5 | Very low | 39 | Very low | 156 Ų | 156 | 114.8 Ų | 114.8 | 77% | 0.768 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -52.7 | -25.4 | 171.8 | -159.1 | 160.1 | 79.5 | 0 | 0 | 112.2 | C9 I10 | M6-C9 PolarHBondContact O-N 3.27Å; M6-I10 WeakPolarHBondContact O-CG1 3.31Å; M6-I10 PolarHBondContact O-N 2.73Å |
| 7 | T | 37.9 | Very low | 38.8 | Very low | 80 Ų | 80 | 113.9 Ų | 113.9 | 49% | 0.491 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.6 | -34.9 | 172.2 | -31.8 | 0 | 0 | 0 | 0 | 113.1 | S5 I10 N11 | S5-T7 PolarHBondContact O-N 3Å; S5-T7 PolarHBondContact OG-N 2.91Å; S5-T7 PolarHBondContact OG-OG1 3.37Å; T7-I10 PolarHBondContact O-N 3.31Å; T7-N11 WeakPolarHBondContact O-CB 3.38Å; T7-N11 VanDerWaalsContact O-CG 3.22Å; T7-N11 PolarHBondContact O-N 3.22Å; T7-N11 PolarHBondContact O-ND2 3.32Å |
| 8 | S | 38.3 | Very low | 38.8 | Very low | 51 Ų | 51 | 113.7 Ų | 113.7 | 36% | 0.357 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -67.2 | -37.3 | 176.5 | -64.6 | 0 | 0 | 0 | 0 | 111.5 | S5 N11 L12 | S5-S8 WeakPolarHBondContact O-CA 3.15Å; S5-S8 VanDerWaalsContact O-CB 3.3Å; S5-S8 WeakPolarHBondContact O-CB 3.42Å; S5-S8 PolarHBondContact O-N 3.38Å; S8-N11 PolarHBondContact O-N 3.49Å; S8-L12 WeakPolarHBondContact O-CB 3.43Å; S8-L12 PolarHBondContact O-N 3.31Å |
| 9 | C | 40.3 | Very low | 38.5 | Very low | 66 Ų | 66 | 111.6 Ų | 111.6 | 45% | 0.446 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -67.9 | -40 | 174.6 | -67.1 | 0 | 0 | 0 | 0 | 112.3 | M6 N11 L12 W13 | M6-C9 PolarHBondContact O-N 3.27Å; C9-N11 VanDerWaalsContact C-N 3.31Å; C9-N11 PolarHBondContact O-N 2.99Å; C9-L12 PolarHBondContact O-N 2.68Å; C9-W13 WeakPolarHBondContact O-CB 3.29Å; C9-W13 PolarHBondContact O-N 3.35Å |
| 10 | I | 46 | Very low | 38.6 | Very low | 85 Ų | 85 | 113 Ų | 113 | 44% | 0.436 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -65.2 | -37.4 | 175.3 | -66.2 | 166.5 | 0 | 0 | 0 | 111 | M6 T7 W13 K14 | M6-I10 WeakPolarHBondContact O-CG1 3.31Å; M6-I10 PolarHBondContact O-N 2.73Å; T7-I10 PolarHBondContact O-N 3.31Å; I10-W13 PolarHBondContact O-N 2.97Å; I10-K14 PolarHBondContact O-N 3.43Å; I10-K14 VanDerWaalsContact O-N 3.07Å |
| 11 | N | 39.1 | Very low | 38.6 | Very low | 85 Ų | 85 | 116 Ų | 116 | 46% | 0.455 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -70.8 | -42.8 | 178.6 | -73.8 | -19.2 | 0 | 0 | 0 | 111.7 | T7 S8 C9 W13 K14 T15 | T7-N11 WeakPolarHBondContact O-CB 3.38Å; T7-N11 VanDerWaalsContact O-CG 3.22Å; T7-N11 PolarHBondContact O-N 3.22Å; T7-N11 PolarHBondContact O-ND2 3.32Å; S8-N11 PolarHBondContact O-N 3.49Å; C9-N11 VanDerWaalsContact C-N 3.31Å; C9-N11 PolarHBondContact O-N 2.99Å; N11-W13 VanDerWaalsContact C-N 3.25Å; N11-W13 PolarHBondContact O-N 3.06Å; N11-K14 PolarHBondContact O-N 3.07Å; N11-K14 VanDerWaalsContact O-N 3.15Å; N11-T15 PolarHBondContact O-N 3.05Å; N11-T15 PolarHBondContact O-OG1 3.27Å |
| 12 | L | 45.5 | Very low | 38.6 | Very low | 115 Ų | 115 | 107.8 Ų | 107.8 | 60% | 0.602 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -57.4 | -37.7 | 171.9 | -93.2 | 146.6 | 0 | 0 | 0 | 112.4 | S8 C9 T15 A16 | S8-L12 WeakPolarHBondContact O-CB 3.43Å; S8-L12 PolarHBondContact O-N 3.31Å; C9-L12 PolarHBondContact O-N 2.68Å; L12-T15 PolarHBondContact O-N 2.82Å; L12-T15 PolarHBondContact O-OG1 3.26Å; L12-A16 PolarHBondContact O-N 3.37Å; L12-A16 VanDerWaalsContact O-N 3.12Å |
| 13 | W | 43.6 | Very low | 38.7 | Very low | 159 Ų | 159 | 109.3 Ų | 109.3 | 60% | 0.602 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.6 | -41 | 175 | -178.7 | 71.1 | 0 | 0 | 0 | 112.9 | C9 I10 N11 A16 M17 | C9-W13 WeakPolarHBondContact O-CB 3.29Å; C9-W13 PolarHBondContact O-N 3.35Å; I10-W13 PolarHBondContact O-N 2.97Å; N11-W13 VanDerWaalsContact C-N 3.25Å; N11-W13 PolarHBondContact O-N 3.06Å; W13-A16 PolarHBondContact O-N 3.32Å; W13-M17 HydrophobicContact CH2-CE 4.01Å; W13-M17 HydrophobicContact CZ2-CE 3.81Å; W13-M17 PolarHBondContact O-N 3.36Å; W13-M17 VanDerWaalsContact O-N 3.16Å |
| 14 | K | 40.4 | Very low | 38.7 | Very low | 127 Ų | 127 | 107.8 Ų | 107.8 | 55% | 0.552 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -64.6 | -40.6 | 175.2 | -78 | -176.1 | 177.4 | -178.9 | 0 | 112.3 | I10 N11 M17 V18 | I10-K14 PolarHBondContact O-N 3.43Å; I10-K14 VanDerWaalsContact O-N 3.07Å; N11-K14 PolarHBondContact O-N 3.07Å; N11-K14 VanDerWaalsContact O-N 3.15Å; K14-M17 PolarHBondContact O-N 3.43Å; K14-V18 WeakPolarHBondContact O-CG2 3.16Å; K14-V18 PolarHBondContact O-N 3.42Å |
| 15 | T | 38.9 | Very low | 38.6 | Very low | 96 Ų | 96 | 105.3 Ų | 105.3 | 59% | 0.589 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -66.8 | -37.8 | 178.3 | -1.6 | 0 | 0 | 0 | 0 | 112.1 | N11 L12 V18 S19 | N11-T15 PolarHBondContact O-N 3.05Å; N11-T15 PolarHBondContact O-OG1 3.27Å; L12-T15 PolarHBondContact O-N 2.82Å; L12-T15 PolarHBondContact O-OG1 3.26Å; T15-V18 PolarHBondContact O-N 2.96Å; T15-S19 PolarHBondContact O-N 3.25Å |
| 16 | A | 38.2 | Very low | 38.6 | Very low | 60 Ų | 60 | 107.4 Ų | 107.4 | 50% | 0.496 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64 | -41.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | L12 W13 S19 Q20 | L12-A16 PolarHBondContact O-N 3.37Å; L12-A16 VanDerWaalsContact O-N 3.12Å; W13-A16 PolarHBondContact O-N 3.32Å; A16-S19 PolarHBondContact O-N 2.91Å; A16-Q20 PolarHBondContact O-N 3.5Å |
| 17 | M | 35.8 | Very low | 38.6 | Very low | 101 Ų | 101 | 104 Ų | 104 | 50% | 0.498 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.5 | -35.3 | 177.4 | -79.4 | -100.5 | -94.3 | 0 | 0 | 113.6 | W13 K14 | W13-M17 HydrophobicContact CH2-CE 4.01Å; W13-M17 HydrophobicContact CZ2-CE 3.81Å; W13-M17 PolarHBondContact O-N 3.36Å; W13-M17 VanDerWaalsContact O-N 3.16Å; K14-M17 PolarHBondContact O-N 3.43Å |
| 18 | V | 38.8 | Very low | 38.5 | Very low | 110 Ų | 110 | 107.4 Ų | 107.4 | 67% | 0.667 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -72.2 | -38.3 | 178.7 | 173.7 | 0 | 0 | 0 | 0 | 111.6 | K14 T15 Q20 K21 | K14-V18 WeakPolarHBondContact O-CG2 3.16Å; K14-V18 PolarHBondContact O-N 3.42Å; T15-V18 PolarHBondContact O-N 2.96Å; V18-Q20 VanDerWaalsContact C-N 3.29Å; V18-Q20 PolarHBondContact O-N 3.35Å; V18-K21 PolarHBondContact O-N 3.26Å |
| 19 | S | 32.4 | Very low | 38.4 | Very low | 74 Ų | 74 | 116.2 Ų | 116.2 | 52% | 0.517 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -62.2 | -36.3 | 176 | -168.8 | 0 | 0 | 0 | 0 | 112.4 | T15 A16 K21 S22 H23 | T15-S19 PolarHBondContact O-N 3.25Å; A16-S19 PolarHBondContact O-N 2.91Å; S19-K21 PolarHBondContact O-N 3.09Å; S19-S22 PolarHBondContact O-N 2.66Å; S19-H23 PolarHBondContact O-N 3.32Å |
| 20 | Q | 40.9 | Very low | 38 | Very low | 139 Ų | 139 | 116.7 Ų | 116.7 | 65% | 0.65 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -71.3 | -27.5 | -178.7 | -142.7 | 174.7 | 9.8 | 0 | 0 | 113.6 | A16 V18 S22 K24 | A16-Q20 PolarHBondContact O-N 3.5Å; V18-Q20 VanDerWaalsContact C-N 3.29Å; V18-Q20 PolarHBondContact O-N 3.35Å; Q20-S22 VanDerWaalsContact C-N 3.33Å; Q20-K24 PolarHBondContact O-N 2.96Å |
| 21 | K | 38.7 | Very low | 37.4 | Very low | 177 Ų | 177 | 120.1 Ų | 120.1 | 77% | 0.77 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -73.6 | -26.7 | 176.5 | -143.3 | 177.4 | -173.5 | -177 | 0 | 112.3 | V18 S19 | V18-K21 PolarHBondContact O-N 3.26Å; S19-K21 PolarHBondContact O-N 3.09Å |
| 22 | S | 32.8 | Very low | 37.1 | Very low | 80 Ų | 80 | 122.2 Ų | 122.2 | 56% | 0.559 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -76.1 | -42.6 | 176.5 | -171.3 | 0 | 0 | 0 | 0 | 112 | S19 Q20 K24 A25 T26 | S19-S22 PolarHBondContact O-N 2.66Å; Q20-S22 VanDerWaalsContact C-N 3.33Å; S22-K24 VanDerWaalsContact C-N 3.34Å; S22-K24 PolarHBondContact O-N 2.8Å; S22-A25 PolarHBondContact O-N 2.99Å; S22-T26 PolarHBondContact O-OG1 2.85Å |
| 23 | H | 35 | Very low | 36.3 | Very low | 137 Ų | 137 | 123.6 Ų | 123.6 | 63% | 0.634 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -67.4 | -28.5 | 177.3 | -93.8 | -79 | 0 | 0 | 0 | 114.3 | S19 A25 T26 A27 | S19-H23 PolarHBondContact O-N 3.32Å; H23-A25 VanDerWaalsContact C-N 3.32Å; H23-T26 PolarHBondContact O-OG1 2.86Å; H23-A27 PolarHBondContact O-N 3.29Å |
| 24 | K | 37.3 | Very low | 35.6 | Very low | 180 Ų | 180 | 121.8 Ų | 121.8 | 78% | 0.783 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -76 | -18.7 | 176.7 | -134.8 | 172.2 | -172.6 | 175.8 | 0 | 113.3 | Q20 S22 | Q20-K24 PolarHBondContact O-N 2.96Å; S22-K24 VanDerWaalsContact C-N 3.34Å; S22-K24 PolarHBondContact O-N 2.8Å |
| 25 | A | 36.9 | Very low | 35 | Very low | 75 Ų | 75 | 121.4 Ų | 121.4 | 62% | 0.62 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -86.1 | -28.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | S22 H23 | S22-A25 PolarHBondContact O-N 2.99Å; H23-A25 VanDerWaalsContact C-N 3.32Å |
| 26 | T | 38.6 | Very low | 34.8 | Very low | 102 Ų | 102 | 126.4 Ų | 126.4 | 63% | 0.626 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -83.4 | -25.5 | 177.9 | 29.2 | 0 | 0 | 0 | 0 | 113.7 | S22 H23 N28 | S22-T26 PolarHBondContact O-OG1 2.85Å; H23-T26 PolarHBondContact O-OG1 2.86Å; T26-N28 VanDerWaalsContact C-N 3.29Å; T26-N28 PolarHBondContact O-N 3.38Å |
| 27 | A | 35.9 | Very low | 34.2 | Very low | 86 Ų | 86 | 135.6 Ų | 135.6 | 71% | 0.711 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -8.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | H23 | H23-A27 PolarHBondContact O-N 3.29Š|
| 28 | N | 35.5 | Very low | 33.8 | Very low | 150 Ų | 150 | 139.2 Ų | 139.2 | 80% | 0.802 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.4 | 12.4 | -175.5 | -141.9 | 21 | 0 | 0 | 0 | 114.2 | T26 | T26-N28 VanDerWaalsContact C-N 3.29Å; T26-N28 PolarHBondContact O-N 3.38Å |
| 29 | R | 35.3 | Very low | 33.2 | Very low | 236 Ų | 236 | 140 Ų | 140 | 89% | 0.891 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -132.3 | 88.8 | 175 | -101 | -174.2 | -174.9 | 179.7 | 2.5 | 110.1 | ||
| 30 | G | 33.1 | Very low | 32.9 | Very low | 76 Ų | 76 | 145.9 Ų | 145.9 | 78% | 0.784 | 78% | 0.776 | S | S | * | * | trans | 153.5 | 74.6 | 166.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 31 | N | 32.4 | Very low | 32.3 | Very low | 158 Ų | 158 | 144.2 Ų | 144.2 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -148.3 | 95.2 | 153.2 | -149.6 | 9.7 | 0 | 0 | 0 | 110.7 | ||||
| 32 | T | 33.2 | Very low | 32.2 | Very low | 128 Ų | 128 | 141.5 Ų | 141.5 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | -152.3 | 130.3 | 151.8 | 31.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 33 | N | 28.8 | Very low | 32 | Very low | 145 Ų | 145 | 143.5 Ų | 143.5 | 78% | 0.775 | 79% | 0.789 | S | S | * | * | trans | 92.9 | 118.8 | 154.1 | -64.8 | -13.2 | 0 | 0 | 0 | 122.5 | ||||
| 34 | C | 28.4 | Very low | 31.5 | Very low | 120 Ų | 120 | 145.6 Ų | 145.6 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | trans | 65 | 119.6 | 131.7 | -73.2 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 35 | S | 28.3 | Very low | 30.9 | Very low | 120 Ų | 120 | 145.1 Ų | 145.1 | 84% | 0.839 | 80% | 0.804 | S | S | * | * | 156.2 | 150.5 | 82 | -153.2 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 36 | K | 35.2 | Very low | 30.4 | Very low | 201 Ų | 201 | 149.2 Ų | 149.2 | 87% | 0.874 | 81% | 0.814 | S | S | * | * | trans | -64.1 | 144.8 | 174 | -68.8 | 169.6 | 173.6 | 175.1 | 0 | 112.5 | ||||
| 37 | R | 24.9 | Very low | 29.7 | Very low | 252 Ų | 252 | 151.6 Ų | 151.6 | 95% | 0.951 | 82% | 0.823 | S | S | * | * | trans | -163.1 | 128.5 | 142.6 | -113.8 | 175.8 | -151.6 | -145.4 | 4 | 113.5 | ||||
| 38 | M | 27.7 | Very low | 29.1 | Very low | 177 Ų | 177 | 155.7 Ų | 155.7 | 87% | 0.872 | 83% | 0.83 | S | S | * | * | trans | -65.1 | 155.4 | 161.8 | -84.4 | 166.3 | 153.9 | 0 | 0 | 111.8 | ||||
| 39 | C | 25.6 | Very low | 28.7 | Very low | 126 Ų | 126 | 157.7 Ų | 157.7 | 85% | 0.851 | 83% | 0.834 | S | S | * | * | trans | -172.9 | 119.6 | 131 | -100.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 40 | F | 25.8 | Very low | 28.2 | Very low | 199 Ų | 199 | 151.2 Ų | 151.2 | 87% | 0.873 | 83% | 0.825 | S | S | * | * | trans | 12.5 | 140.1 | 146 | -83.5 | -97 | 0 | 0 | 0 | 124.5 | ||||
| 41 | S | 29.7 | Very low | 27.9 | Very low | 104 Ų | 104 | 153.5 Ų | 153.5 | 73% | 0.727 | 82% | 0.824 | S | S | * | * | trans | -74.7 | 168.9 | 156.3 | -65.1 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 42 | P | 36.1 | Very low | 28.1 | Very low | 120 Ų | 120 | 150.5 Ų | 150.5 | 78% | 0.779 | 82% | 0.815 | S | S | * | * | -141.7 | 134.7 | 108 | 31.7 | -14.5 | 0 | 0 | 0 | 113.2 | |||||
| 43 | V | 28 | Very low | 27.9 | Very low | 122 Ų | 122 | 151.3 Ų | 151.3 | 74% | 0.739 | 82% | 0.815 | S | S | * | * | 56.3 | 113.7 | 95 | -175.1 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 44 | L | 24.7 | Very low | 28 | Very low | 181 Ų | 181 | 152.5 Ų | 152.5 | 95% | 0.948 | 82% | 0.819 | S | S | * | * | trans | -138.7 | 126.4 | 144.5 | -141.3 | 99.6 | 0 | 0 | 0 | 108.8 | ||||
| 45 | Q | 24.2 | Very low | 28.2 | Very low | 169 Ų | 169 | 152.2 Ų | 152.2 | 79% | 0.79 | 81% | 0.814 | S | S | * | * | trans | -126.4 | 170.7 | 179.5 | -151 | -179.4 | -1.8 | 0 | 0 | 107.7 | ||||
| 46 | I | 27.1 | Very low | 28.4 | Very low | 161 Ų | 161 | 152.1 Ų | 152.1 | 83% | 0.826 | 81% | 0.808 | S | S | * | * | trans | 116.3 | 125.6 | 171.4 | -61.2 | 160.5 | 0 | 0 | 0 | 110.7 | ||||
| 47 | N | 23.2 | Very low | 28.2 | Very low | 153 Ų | 153 | 152.5 Ų | 152.5 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | cis | -154.2 | 166 | 6.6 | -145.3 | -8.8 | 0 | 0 | 0 | 112.8 | ||||
| 48 | M | 24.6 | Very low | 28.7 | Very low | 171 Ų | 171 | 146.4 Ų | 146.4 | 84% | 0.842 | 79% | 0.79 | S | S | * | * | trans | -82.2 | 151.8 | 177.1 | -114.1 | -177.8 | 139 | 0 | 0 | 115.1 | ||||
| 49 | Q | 27.1 | Very low | 29.1 | Very low | 193 Ų | 193 | 143.2 Ų | 143.2 | 90% | 0.902 | 78% | 0.776 | S | S | * | * | trans | 162.4 | 139.6 | 136.9 | -91.4 | 174.8 | 2.4 | 0 | 0 | 107.6 | ||||
| 50 | S | 24.9 | Very low | 29.7 | Very low | 99 Ų | 99 | 143 Ų | 143 | 69% | 0.692 | 77% | 0.766 | S | S | * | * | cis | -171.8 | 159.8 | -5.6 | 72.4 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 51 | V | 26.6 | Very low | 30.4 | Very low | 125 Ų | 125 | 139.3 Ų | 139.3 | 76% | 0.758 | 76% | 0.755 | S | S | * | * | trans | 83.3 | 106.5 | 152.1 | -176.7 | 0 | 0 | 0 | 0 | 119 | ||||
| 52 | S | 35.1 | Very low | 30.7 | Very low | 94 Ų | 94 | 139.8 Ų | 139.8 | 66% | 0.657 | 75% | 0.75 | S | S | * | * | trans | 32.5 | 115.6 | 147.3 | 65.3 | 0 | 0 | 0 | 0 | 120 | ||||
| 53 | N | 29.3 | Very low | 30.9 | Very low | 146 Ų | 146 | 140.2 Ų | 140.2 | 78% | 0.781 | 74% | 0.744 | S | S | * | * | -152.3 | 114 | 126.6 | -91.2 | -26.3 | 0 | 0 | 0 | 108.6 | T55 | N53-T55 HydrophobicContact CB-CG2 4.4Å; N53-T55 PolarHBondContact O-N 3.5Å | |||
| 54 | I | 32.4 | Very low | 31.4 | Very low | 169 Ų | 169 | 138.5 Ų | 138.5 | 87% | 0.867 | 73% | 0.73 | S | S | * | * | trans | -69.8 | 89.6 | 160.9 | -64.3 | 166.2 | 0 | 0 | 0 | 104.8 | ||||
| 55 | T | 30.8 | Very low | 32.1 | Very low | 115 Ų | 115 | 133.9 Ų | 133.9 | 71% | 0.706 | 71% | 0.71 | S | S | * | * | trans | -87.4 | 107.2 | 160.8 | 47.1 | 0 | 0 | 0 | 0 | 106.3 | N53 R57 | N53-T55 HydrophobicContact CB-CG2 4.4Å; N53-T55 PolarHBondContact O-N 3.5Å; T55-R57 PolarHBondContact O-N 2.86Å | ||
| 56 | V | 33.5 | Very low | 32.7 | Very low | 118 Ų | 118 | 131.7 Ų | 131.7 | 72% | 0.715 | 70% | 0.704 | S | S | * | * | trans | -43.4 | 113.6 | 158.3 | 173.3 | 0 | 0 | 0 | 0 | 106.4 | D58 | V56-D58 PolarHBondContact O-N 3.28Š| ||
| 57 | R | 31.3 | Very low | 33.3 | Very low | 209 Ų | 209 | 130.4 Ų | 130.4 | 79% | 0.789 | 70% | 0.696 | S | S | * | * | trans | -71.7 | 112.8 | 174.5 | -152 | 167.8 | -168.5 | 141.8 | -0.8 | 104.9 | T55 D59 | T55-R57 PolarHBondContact O-N 2.86Å; R57-D59 PolarHBondContact O-N 2.83Å | ||
| 58 | D | 34.8 | Very low | 33.9 | Very low | 123 Ų | 123 | 131.5 Ų | 131.5 | 66% | 0.658 | 69% | 0.69 | S | S | * | * | trans | -63.9 | 84.9 | 167.7 | -77.6 | -44.4 | 0 | 0 | 0 | 107.9 | V56 I60 | V56-D58 PolarHBondContact O-N 3.28Å; D58-I60 PolarHBondContact O-N 3.09Å | ||
| 59 | D | 35.5 | Very low | 34.5 | Very low | 110 Ų | 110 | 130.7 Ų | 130.7 | 59% | 0.588 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | 27.7 | 169.9 | -74.3 | -32.3 | 0 | 0 | 0 | 111.6 | R57 | R57-D59 PolarHBondContact O-N 2.83Š|
| 60 | I | 40.2 | Very low | 35.3 | Very low | 122 Ų | 122 | 124.3 Ų | 124.3 | 63% | 0.626 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.9 | -24.1 | -178.6 | -61.1 | -176.9 | 0 | 0 | 0 | 111.7 | D58 | D58-I60 PolarHBondContact O-N 3.09Š|
| 61 | D | 38.5 | Very low | 36.7 | Very low | 121 Ų | 121 | 123 Ų | 123 | 65% | 0.647 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -86.8 | -17.6 | -177.9 | -75.5 | -24.8 | 0 | 0 | 0 | 114.4 | T65 | D61-T65 PolarHBondContact O-OG1 3.03Å |
| 62 | D | 36.3 | Very low | 38.4 | Very low | 115 Ų | 115 | 121.1 Ų | 121.1 | 62% | 0.615 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -86.6 | -12.7 | 179.2 | -97.2 | -30.4 | 0 | 0 | 0 | 113.7 | N66 | D62-N66 PolarHBondContact O-ND2 2.98Å |
| 63 | I | 41 | Very low | 40.2 | Very low | 129 Ų | 129 | 117.9 Ų | 117.9 | 66% | 0.662 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -87.2 | -37.5 | 176.8 | -61.2 | 177.8 | 0 | 0 | 0 | 110.9 | ||
| 64 | D | 38.9 | Very low | 42.9 | Very low | 85 Ų | 85 | 114 Ų | 114 | 46% | 0.455 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -72.2 | -35.3 | 177.1 | -95.7 | -21.5 | 0 | 0 | 0 | 111.9 | N66 M67 Y68 | D64-N66 VanDerWaalsContact C-N 3.34Å; D64-N66 PolarHBondContact O-N 2.86Å; D64-M67 PolarHBondContact O-N 3.06Å; D64-Y68 WeakPolarHBondContact O-CD2 3.2Å; D64-Y68 WeakPolarHBondContact O-CE2 3.28Å |
| 65 | T | 39.5 | Very low | 45.4 | Very low | 85 Ų | 85 | 112.2 Ų | 112.2 | 52% | 0.521 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -71.1 | -28.8 | -175.9 | -45.9 | 0 | 0 | 0 | 0 | 113 | D61 | D61-T65 PolarHBondContact O-OG1 3.03Å |
| 66 | N | 36.7 | Very low | 48.2 | Very low | 123 Ų | 123 | 111.2 Ų | 111.2 | 66% | 0.658 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -86 | -10.6 | 179.4 | -72.4 | -54.2 | 0 | 0 | 0 | 113.9 | D62 D64 | D62-N66 PolarHBondContact O-ND2 2.98Å; D64-N66 VanDerWaalsContact C-N 3.34Å; D64-N66 PolarHBondContact O-N 2.86Å |
| 67 | M | 38.3 | Very low | 50.8 | Low | 134 Ų | 134 | 107.5 Ų | 107.5 | 66% | 0.66 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -86.9 | -17.9 | 177 | -165.2 | 168.9 | 66.9 | 0 | 0 | 113.2 | D64 | D64-M67 PolarHBondContact O-N 3.06Å |
| 68 | Y | 36.7 | Very low | 53.6 | Low | 175 Ų | 175 | 99.4 Ų | 99.4 | 69% | 0.686 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -89.9 | -6 | 176.5 | -66.5 | -74.2 | 0 | 0 | 0 | 114.3 | D64 A70 | D64-Y68 WeakPolarHBondContact O-CD2 3.2Å; D64-Y68 WeakPolarHBondContact O-CE2 3.28Å; Y68-A70 VanDerWaalsContact C-N 3.28Å; Y68-A70 PolarHBondContact O-N 3.28Å |
| 69 | Q | 37.7 | Very low | 56.4 | Low | 155 Ų | 155 | 98 Ų | 98 | 72% | 0.724 | 53% | 0.528 | S | S | * | . | trans | -91 | 35.3 | -174.4 | -152.5 | 93.1 | 6.9 | 0 | 0 | 113.2 | ||||
| 70 | A | 43 | Very low | 59.2 | Low | 58 Ų | 58 | 95.8 Ų | 95.8 | 48% | 0.479 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -128.2 | 81.2 | 171 | 0 | 0 | 0 | 0 | 0 | 109.3 | Y68 S72 | Y68-A70 VanDerWaalsContact C-N 3.28Å; Y68-A70 PolarHBondContact O-N 3.28Å; A70-S72 PolarHBondContact O-N 3.48Å; A70-S72 PolarHBondContact O-OG 2.94Å |
| 71 | L | 55.1 | Low | 61.8 | Low | 73 Ų | 73 | 90.5 Ų | 90.5 | 38% | 0.382 | 49% | 0.494 | S | S | . | . | trans | 25.8 | 57.1 | 165.2 | -147.4 | 85.2 | 0 | 0 | 0 | 117.6 | T237 | L71-T237 HydrophobicContact CD1-CG2 3.54Š| ||
| 72 | S | 61.1 | Low | 64.4 | Low | 85 Ų | 85 | 85.8 Ų | 85.8 | 59% | 0.594 | 47% | 0.47 | S | S | * | . | P | Polyproline II helix | trans | -90.7 | 116.3 | 169.7 | -68.5 | 0 | 0 | 0 | 0 | 109.4 | A70 | A70-S72 PolarHBondContact O-N 3.48Å; A70-S72 PolarHBondContact O-OG 2.94Å |
| 73 | Y | 74.4 | Confident | 67.3 | Low | 26 Ų | 26 | 82.4 Ų | 82.4 | 10% | 0.102 | 46% | 0.462 | C | S | . | . | P | Polyproline II helix | trans | -52.9 | 148.6 | 169.3 | -65.6 | -80.4 | 0 | 0 | 0 | 109.6 | L75 F77 K383 L386 | Y73-L75 PolarHBondContact O-N 3.46Å; Y73-F77 AromaticContact CD1-CD1 3.99Å; Y73-F77 HydrophobicContact CD1-CD1 3.99Å; Y73-F77 AromaticContact CD1-CE1 3.87Å; Y73-F77 HydrophobicContact CD1-CE1 3.87Å; Y73-F77 HydrophobicContact CE1-CE1 4.36Å; Y73-F77 HydrophobicContact CG-CD1 4.09Å; Y73-F77 HydrophobicContact CG-CE1 4.26Å; Y73-K383 HydrophobicContact CD1-CG 4.24Å; Y73-K383 HydrophobicContact CE1-CG 4.13Å; Y73-L386 HydrophobicContact CE1-CD1 3.81Å; Y73-L386 HydrophobicContact CE2-CD1 4.21Å; Y73-L386 WeakPolarHBondContact OH-CD1 3.46Å |
| 74 | P | 84.4 | Confident | 69.9 | Low | 65 Ų | 65 | 81.7 Ų | 81.7 | 42% | 0.422 | 45% | 0.454 | S | S | . | . | P | Polyproline II helix | trans | -56.1 | 134.8 | 177.4 | 20.2 | -29.1 | 0 | 0 | 0 | 109.9 | S76 F77 Q78 | P74-S76 PolarHBondContact O-N 2.97Å; P74-F77 HydrophobicContact CG-CB 3.8Å; P74-F77 WeakPolarHBondContact O-CA 3.47Å; P74-F77 VanDerWaalsContact O-CB 3.26Å; P74-F77 WeakPolarHBondContact O-CB 3.36Å; P74-F77 PolarHBondContact O-N 2.78Å; P74-Q78 PolarHBondContact O-N 3.23Å; P74-Q78 VanDerWaalsContact O-N 3.17Å |
| 75 | L | 85.4 | Confident | 72.6 | Confident | 130 Ų | 130 | 77.7 Ų | 77.7 | 68% | 0.681 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -52.4 | -38.4 | -171.6 | -176.1 | 67.4 | 0 | 0 | 0 | 112.8 | Y73 F77 Q78 V79 | Y73-L75 PolarHBondContact O-N 3.46Å; L75-F77 VanDerWaalsContact C-N 3.32Å; L75-F77 PolarHBondContact O-N 3.22Å; L75-Q78 PolarHBondContact O-N 3.41Å; L75-V79 HydrophobicContact CD1-CG2 4.15Å; L75-V79 HydrophobicContact CG-CG2 4.24Å; L75-V79 WeakPolarHBondContact O-CB 3.25Å; L75-V79 VanDerWaalsContact O-CG2 3.28Å; L75-V79 WeakPolarHBondContact O-CG2 3.28Å; L75-V79 PolarHBondContact O-N 3.39Å |
| 76 | S | 89.5 | Confident | 75.4 | Confident | 95 Ų | 95 | 78.3 Ų | 78.3 | 66% | 0.664 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -60.5 | -38.6 | 176.4 | 56.6 | 0 | 0 | 0 | 0 | 113.1 | P74 S80 | P74-S76 PolarHBondContact O-N 2.97Å; S76-S80 WeakPolarHBondContact O-CB 3.43Å; S76-S80 PolarHBondContact O-N 2.92Å |
| 77 | F | 89.4 | Confident | 78.2 | Confident | 39 Ų | 39 | 76.6 Ų | 76.6 | 17% | 0.171 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -68.3 | -47.7 | 176.5 | -179.4 | -93.9 | 0 | 0 | 0 | 111.1 | Y73 P74 L75 S80 L81 K383 L386 C387 | Y73-F77 AromaticContact CD1-CD1 3.99Å; Y73-F77 HydrophobicContact CD1-CD1 3.99Å; Y73-F77 AromaticContact CD1-CE1 3.87Å; Y73-F77 HydrophobicContact CD1-CE1 3.87Å; Y73-F77 HydrophobicContact CE1-CE1 4.36Å; Y73-F77 HydrophobicContact CG-CD1 4.09Å; Y73-F77 HydrophobicContact CG-CE1 4.26Å; P74-F77 HydrophobicContact CG-CB 3.8Å; P74-F77 WeakPolarHBondContact O-CA 3.47Å; P74-F77 VanDerWaalsContact O-CB 3.26Å; P74-F77 WeakPolarHBondContact O-CB 3.36Å; P74-F77 PolarHBondContact O-N 2.78Å; L75-F77 VanDerWaalsContact C-N 3.32Å; L75-F77 PolarHBondContact O-N 3.22Å; F77-S80 PolarHBondContact O-N 2.91Å; F77-L81 HydrophobicContact CE1-CD2 4.01Å; F77-L81 HydrophobicContact CZ-CD2 4.02Å; F77-L81 VanDerWaalsContact O-CB 3.31Å; F77-L81 WeakPolarHBondContact O-CB 3.46Å; F77-L81 PolarHBondContact O-N 3.35Å; F77-K383 HydrophobicContact CE2-CB 4.48Å; F77-K383 HydrophobicContact CZ-CB 4.28Å; F77-L386 HydrophobicContact CE1-CD1 4.28Å; F77-L386 HydrophobicContact CZ-CB 4.36Å; F77-C387 VanDerWaalsContact CE2-SG 3.55Å |
| 78 | Q | 89.9 | Confident | 80.9 | Confident | 40 Ų | 40 | 71 Ų | 71 | 19% | 0.187 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -61.2 | -48.2 | 179.4 | -178.5 | 179.1 | -12.2 | 0 | 0 | 111.9 | P74 L75 T82 L140 L141 | P74-Q78 PolarHBondContact O-N 3.23Å; P74-Q78 VanDerWaalsContact O-N 3.17Å; L75-Q78 PolarHBondContact O-N 3.41Å; Q78-T82 WeakPolarHBondContact O-CB 3.24Å; Q78-T82 PolarHBondContact O-N 2.94Å; Q78-T82 PolarHBondContact O-OG1 3.35Å; Q78-L140 WeakPolarHBondContact CG-O 3.21Å; Q78-L140 PolarHBondContact NE2-O 2.85Å; Q78-L141 HydrophobicContact CG-CD2 3.78Å |
| 79 | V | 92.4 | Very high | 83.8 | Confident | 94 Ų | 94 | 64.2 Ų | 64.2 | 57% | 0.57 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -63.2 | -45.1 | 178.4 | 171.8 | 0 | 0 | 0 | 0 | 110.9 | L75 G83 | L75-V79 HydrophobicContact CD1-CG2 4.15Å; L75-V79 HydrophobicContact CG-CG2 4.24Å; L75-V79 WeakPolarHBondContact O-CB 3.25Å; L75-V79 VanDerWaalsContact O-CG2 3.28Å; L75-V79 WeakPolarHBondContact O-CG2 3.28Å; L75-V79 PolarHBondContact O-N 3.39Å; V79-G83 PolarHBondContact O-N 2.83Å |
| 80 | S | 94.9 | Very high | 86.6 | Confident | 62 Ų | 62 | 61.6 Ų | 61.6 | 43% | 0.434 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.2 | -50.3 | 179.7 | -178.8 | 0 | 0 | 0 | 0 | 111.7 | S76 F77 G83 F84 | S76-S80 WeakPolarHBondContact O-CB 3.43Å; S76-S80 PolarHBondContact O-N 2.92Å; F77-S80 PolarHBondContact O-N 2.91Å; S80-G83 PolarHBondContact O-N 3.5Å; S80-F84 WeakPolarHBondContact O-CD2 3.38Å; S80-F84 PolarHBondContact O-N 3.06Å |
| 81 | L | 93.8 | Very high | 89.1 | Confident | 12 Ų | 12 | 62.5 Ų | 62.5 | 6% | 0.063 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -68.9 | -41.1 | -174.8 | -152.2 | 68.4 | 0 | 0 | 0 | 111.7 | F77 G83 F84 L85 L140 L386 V390 | F77-L81 HydrophobicContact CE1-CD2 4.01Å; F77-L81 HydrophobicContact CZ-CD2 4.02Å; F77-L81 VanDerWaalsContact O-CB 3.31Å; F77-L81 WeakPolarHBondContact O-CB 3.46Å; F77-L81 PolarHBondContact O-N 3.35Å; L81-G83 VanDerWaalsContact C-N 3.32Å; L81-G83 PolarHBondContact O-N 3.08Å; L81-F84 PolarHBondContact O-N 3.27Å; L81-L85 VanDerWaalsContact O-CG 3.32Å; L81-L85 WeakPolarHBondContact O-CG 3.2Å; L81-L85 PolarHBondContact O-N 2.85Å; L81-L140 HydrophobicContact CB-CD1 4.16Å; L81-L140 HydrophobicContact CD2-CD1 3.78Å; L81-L140 HydrophobicContact CD2-CD2 3.85Å; L81-L140 HydrophobicContact CD2-CG 4.48Å; L81-L140 HydrophobicContact CG-CD1 4.09Å; L81-L386 HydrophobicContact CD2-CB 3.85Å; L81-V390 HydrophobicContact CD1-CB 4.11Å; L81-V390 HydrophobicContact CD1-CG1 4.44Å; L81-V390 HydrophobicContact CD1-CG2 3.47Å; L81-V390 VanDerWaalsContact CD1-CG2 3.47Å; L81-V390 HydrophobicContact CD2-CG2 3.97Å; L81-V390 HydrophobicContact CG-CG2 3.54Å |
| 82 | T | 94.4 | Very high | 91 | Very high | 22 Ų | 22 | 59 Ų | 59 | 14% | 0.135 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.2 | -42 | 172.6 | -56.8 | 0 | 0 | 0 | 0 | 111.1 | Q78 F84 L85 M86 I137 L141 | Q78-T82 WeakPolarHBondContact O-CB 3.24Å; Q78-T82 PolarHBondContact O-N 2.94Å; Q78-T82 PolarHBondContact O-OG1 3.35Å; T82-F84 PolarHBondContact O-N 3.42Å; T82-L85 PolarHBondContact O-N 3.47Å; T82-M86 HydrophobicContact CG2-CG 4.32Å; T82-M86 WeakPolarHBondContact O-CB 3.34Å; T82-M86 VanDerWaalsContact O-CG 3.28Å; T82-M86 WeakPolarHBondContact O-CG 3.06Å; T82-M86 PolarHBondContact O-N 2.85Å; T82-I137 HydrophobicContact CG2-CG1 4.49Å; T82-I137 HydrophobicContact CG2-CG2 3.84Å; T82-L141 HydrophobicContact CG2-CD2 4.43Å |
| 83 | G | 96.1 | Very high | 92.5 | Very high | 43 Ų | 43 | 57.6 Ų | 57.6 | 44% | 0.443 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -59.2 | -44.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | V79 S80 L81 M86 L87 | V79-G83 PolarHBondContact O-N 2.83Å; S80-G83 PolarHBondContact O-N 3.5Å; L81-G83 VanDerWaalsContact C-N 3.32Å; L81-G83 PolarHBondContact O-N 3.08Å; G83-M86 PolarHBondContact O-N 2.87Å; G83-L87 PolarHBondContact O-N 2.93Å |
| 84 | F | 96.6 | Very high | 93.4 | Very high | 115 Ų | 115 | 58.1 Ų | 58.1 | 50% | 0.504 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.9 | -44.5 | 174.6 | -78.2 | -66.9 | 0 | 0 | 0 | 112.4 | S80 L81 T82 M86 L87 E88 V390 | S80-F84 WeakPolarHBondContact O-CD2 3.38Å; S80-F84 PolarHBondContact O-N 3.06Å; L81-F84 PolarHBondContact O-N 3.27Å; T82-F84 PolarHBondContact O-N 3.42Å; F84-M86 VanDerWaalsContact C-N 3.34Å; F84-M86 PolarHBondContact O-N 3.38Å; F84-L87 WeakPolarHBondContact O-CB 3.45Å; F84-L87 PolarHBondContact O-N 3.27Å; F84-L87 VanDerWaalsContact O-N 3.17Å; F84-E88 WeakPolarHBondContact O-CG 3.38Å; F84-E88 PolarHBondContact O-N 2.86Å; F84-V390 HydrophobicContact CB-CG1 4.04Å |
| 85 | L | 96.5 | Very high | 93.7 | Very high | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.7 | -39 | 178.5 | -70.2 | 166.1 | 0 | 0 | 0 | 112.1 | L81 T82 L87 E88 I89 I133 T136 I137 L140 V390 Y393 | L81-L85 VanDerWaalsContact O-CG 3.32Å; L81-L85 WeakPolarHBondContact O-CG 3.2Å; L81-L85 PolarHBondContact O-N 2.85Å; T82-L85 PolarHBondContact O-N 3.47Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 3.46Å; L85-E88 WeakPolarHBondContact O-CB 3.25Å; L85-E88 PolarHBondContact O-N 3.43Å; L85-I89 WeakPolarHBondContact O-CG1 3.17Å; L85-I89 PolarHBondContact O-N 3.32Å; L85-I133 HydrophobicContact CB-CG2 3.79Å; L85-I133 HydrophobicContact CD2-CG2 3.74Å; L85-I133 HydrophobicContact CG-CG2 4.33Å; L85-T136 HydrophobicContact CD1-CG2 4.01Å; L85-I137 HydrophobicContact CB-CD1 3.84Å; L85-I137 HydrophobicContact CB-CG1 3.73Å; L85-I137 HydrophobicContact CD1-CG1 3.85Å; L85-I137 HydrophobicContact CG-CG1 4.42Å; L85-L140 HydrophobicContact CD1-CD1 3.47Å; L85-L140 VanDerWaalsContact CD1-CD1 3.47Å; L85-V390 HydrophobicContact CD1-CG2 4.09Å; L85-V390 HydrophobicContact CD2-CB 4.25Å; L85-V390 HydrophobicContact CD2-CG1 4.04Å; L85-V390 HydrophobicContact CD2-CG2 3.7Å; L85-V390 HydrophobicContact CG-CG1 4.28Å; L85-V390 HydrophobicContact CG-CG2 3.88Å; L85-Y393 HydrophobicContact CD2-CD2 3.84Å; L85-Y393 HydrophobicContact CD2-CE2 4.43Å |
| 86 | M | 96.7 | Very high | 94.1 | Very high | 98 Ų | 98 | 50 Ų | 50 | 48% | 0.483 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64 | -40 | 173.6 | -71.4 | -61 | -71 | 0 | 0 | 111.9 | T82 G83 F84 E88 I89 V90 I137 | T82-M86 HydrophobicContact CG2-CG 4.32Å; T82-M86 WeakPolarHBondContact O-CB 3.34Å; T82-M86 VanDerWaalsContact O-CG 3.28Å; T82-M86 WeakPolarHBondContact O-CG 3.06Å; T82-M86 PolarHBondContact O-N 2.85Å; G83-M86 PolarHBondContact O-N 2.87Å; F84-M86 VanDerWaalsContact C-N 3.34Å; F84-M86 PolarHBondContact O-N 3.38Å; M86-E88 VanDerWaalsContact C-N 3.3Å; M86-E88 PolarHBondContact O-N 3.47Å; M86-I89 PolarHBondContact O-N 3.33Å; M86-I89 HydrophobicContact SD-CD1 4.06Å; M86-V90 WeakPolarHBondContact O-CG2 3.28Å; M86-V90 PolarHBondContact O-N 2.93Å; M86-I137 HydrophobicContact CG-CD1 4.04Å; M86-I137 HydrophobicContact SD-CD1 3.57Å; M86-I137 VanDerWaalsContact SD-CD1 3.57Å |
| 87 | L | 96.3 | Very high | 94.3 | Very high | 88 Ų | 88 | 49.6 Ų | 49.6 | 46% | 0.461 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 173.6 | -177 | 66.5 | 0 | 0 | 0 | 111.4 | G83 F84 L85 V90 L91 | G83-L87 PolarHBondContact O-N 2.93Å; F84-L87 WeakPolarHBondContact O-CB 3.45Å; F84-L87 PolarHBondContact O-N 3.27Å; F84-L87 VanDerWaalsContact O-N 3.17Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 3.46Å; L87-V90 PolarHBondContact O-N 3.34Å; L87-L91 HydrophobicContact CD1-CD1 3.74Å; L87-L91 HydrophobicContact CD1-CG 3.84Å; L87-L91 HydrophobicContact CD2-CD1 4.27Å; L87-L91 HydrophobicContact CG-CD1 3.75Å; L87-L91 HydrophobicContact CG-CG 4.15Å; L87-L91 WeakPolarHBondContact O-CB 3.25Å; L87-L91 WeakPolarHBondContact O-CG 3.23Å; L87-L91 PolarHBondContact O-N 2.86Å |
| 88 | E | 95.6 | Very high | 94.3 | Very high | 16 Ų | 16 | 51.8 Ų | 51.8 | 8% | 0.075 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.2 | -40.5 | 174.6 | -71.6 | 179.8 | -179 | 0 | 0 | 112.8 | F84 L85 M86 G92 I133 Y393 G394 I397 | F84-E88 WeakPolarHBondContact O-CG 3.38Å; F84-E88 PolarHBondContact O-N 2.86Å; L85-E88 WeakPolarHBondContact O-CB 3.25Å; L85-E88 PolarHBondContact O-N 3.43Å; M86-E88 VanDerWaalsContact C-N 3.3Å; M86-E88 PolarHBondContact O-N 3.47Å; E88-G92 WeakPolarHBondContact O-CA 3.23Å; E88-G92 PolarHBondContact O-N 3.05Å; E88-I133 HydrophobicContact CB-CD1 3.93Å; E88-Y393 WeakPolarHBondContact OE2-CB 3.47Å; E88-G394 PolarHBondContact OE1-N 3.48Å; E88-I397 HydrophobicContact CB-CD1 4.24Å; E88-I397 HydrophobicContact CG-CD1 3.66Å; E88-I397 HydrophobicContact CG-CG1 4.44Å |
| 89 | I | 96.8 | Very high | 94.2 | Very high | 32 Ų | 32 | 51.1 Ų | 51.1 | 16% | 0.164 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.7 | -52.3 | 172.6 | -66.5 | 168.4 | 0 | 0 | 0 | 109.8 | L85 M86 L93 I133 P134 I137 | L85-I89 WeakPolarHBondContact O-CG1 3.17Å; L85-I89 PolarHBondContact O-N 3.32Å; M86-I89 PolarHBondContact O-N 3.33Å; M86-I89 HydrophobicContact SD-CD1 4.06Å; I89-L93 WeakPolarHBondContact O-CA 3.29Å; I89-L93 WeakPolarHBondContact O-CB 3.38Å; I89-L93 PolarHBondContact O-N 2.88Å; I89-I133 HydrophobicContact CD1-CB 4.44Å; I89-I133 HydrophobicContact CD1-CG2 3.83Å; I89-I133 HydrophobicContact CG1-CB 4.07Å; I89-I133 HydrophobicContact CG1-CG2 3.59Å; I89-P134 HydrophobicContact CD1-CG 3.99Å; I89-I137 HydrophobicContact CD1-CD1 3.86Å |
| 90 | V | 96.3 | Very high | 94 | Very high | 101 Ų | 101 | 48.5 Ų | 48.5 | 61% | 0.612 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -63.4 | -50.7 | -175.3 | 174 | 0 | 0 | 0 | 0 | 111.5 | M86 L87 G94 | M86-V90 WeakPolarHBondContact O-CG2 3.28Å; M86-V90 PolarHBondContact O-N 2.93Å; L87-V90 PolarHBondContact O-N 3.34Å; V90-G94 PolarHBondContact O-N 3.42Å; V90-G94 VanDerWaalsContact O-N 3.1Å |
| 91 | L | 95 | Very high | 93.7 | Very high | 76 Ų | 76 | 48.8 Ų | 48.8 | 40% | 0.398 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -73.3 | -43.6 | -177.6 | -65.4 | -176.8 | 0 | 0 | 0 | 112.1 | L87 S95 I397 | L87-L91 HydrophobicContact CD1-CD1 3.74Å; L87-L91 HydrophobicContact CD1-CG 3.84Å; L87-L91 HydrophobicContact CD2-CD1 4.27Å; L87-L91 HydrophobicContact CG-CD1 3.75Å; L87-L91 HydrophobicContact CG-CG 4.15Å; L87-L91 WeakPolarHBondContact O-CB 3.25Å; L87-L91 WeakPolarHBondContact O-CG 3.23Å; L87-L91 PolarHBondContact O-N 2.86Å; L91-S95 WeakPolarHBondContact O-CB 3.42Å; L91-S95 PolarHBondContact O-N 3.13Å; L91-S95 PolarHBondContact O-OG 3.24Å; L91-I397 HydrophobicContact CB-CD1 4.16Å; L91-I397 HydrophobicContact CB-CG1 3.94Å; L91-I397 HydrophobicContact CB-CG2 4.07Å; L91-I397 HydrophobicContact CD1-CD1 4.24Å; L91-I397 HydrophobicContact CD1-CG2 4.42Å |
| 92 | G | 94.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.7 | -54 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | E88 S95 N96 | E88-G92 WeakPolarHBondContact O-CA 3.23Å; E88-G92 PolarHBondContact O-N 3.05Å; G92-S95 PolarHBondContact O-OG 3.34Å; G92-N96 WeakPolarHBondContact O-CB 3.27Å; G92-N96 PolarHBondContact O-N 2.99Å; G92-N96 PolarHBondContact O-ND2 2.86Å |
| 93 | L | 94.3 | Very high | 92.7 | Very high | 56 Ų | 56 | 53.2 Ų | 53.2 | 29% | 0.293 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63 | -48.7 | 179.8 | -167.4 | 70 | 0 | 0 | 0 | 111.3 | I89 S95 L97 V126 C129 V130 | I89-L93 WeakPolarHBondContact O-CA 3.29Å; I89-L93 WeakPolarHBondContact O-CB 3.38Å; I89-L93 PolarHBondContact O-N 2.88Å; L93-S95 PolarHBondContact O-N 2.9Å; L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 PolarHBondContact O-N 2.84Å; L93-V126 HydrophobicContact CD1-CG1 3.89Å; L93-V126 HydrophobicContact CD1-CG2 4.35Å; L93-C129 HydrophobicContact CB-CB 4.43Å; L93-C129 HydrophobicContact CD1-CB 4.39Å; L93-V130 HydrophobicContact CD1-CG1 3.67Å |
| 94 | G | 92.2 | Very high | 92.1 | Very high | 36 Ų | 36 | 55.5 Ų | 55.5 | 37% | 0.371 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.9 | -46.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | V90 T98 | V90-G94 PolarHBondContact O-N 3.42Å; V90-G94 VanDerWaalsContact O-N 3.1Å; G94-T98 WeakPolarHBondContact O-CB 3.3Å; G94-T98 PolarHBondContact O-N 2.83Å; G94-T98 VanDerWaalsContact O-N 3.12Å; G94-T98 PolarHBondContact O-OG1 3.15Å |
| 95 | S | 91.8 | Very high | 91.3 | Very high | 26 Ų | 26 | 57.3 Ų | 57.3 | 18% | 0.182 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -73.2 | -41.6 | -177.8 | 66.9 | 0 | 0 | 0 | 0 | 113.2 | L91 G92 L93 V99 P400 | L91-S95 WeakPolarHBondContact O-CB 3.42Å; L91-S95 PolarHBondContact O-N 3.13Å; L91-S95 PolarHBondContact O-OG 3.24Å; G92-S95 PolarHBondContact O-OG 3.34Å; L93-S95 PolarHBondContact O-N 2.9Å; S95-V99 WeakPolarHBondContact O-CG2 3.49Å; S95-V99 PolarHBondContact O-N 3.35Å; S95-P400 WeakPolarHBondContact OG-CG 3.22Å |
| 96 | N | 93.4 | Very high | 90.4 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -69.5 | -42.3 | 178.4 | -74.6 | -70.4 | 0 | 0 | 0 | 112.2 | G92 T98 V99 L100 H122 D125 V126 T396 P400 | G92-N96 WeakPolarHBondContact O-CB 3.27Å; G92-N96 PolarHBondContact O-N 2.99Å; G92-N96 PolarHBondContact O-ND2 2.86Å; N96-T98 VanDerWaalsContact C-N 3.34Å; N96-T98 PolarHBondContact O-N 2.87Å; N96-V99 PolarHBondContact O-N 3.34Å; N96-L100 PolarHBondContact O-N 2.92Å; N96-H122 HydrophobicContact CB-CB 4.49Å; N96-H122 PolarHBondContact OD1-ND1 2.87Å; N96-D125 HydrophobicContact CB-CB 4.45Å; N96-D125 PolarHBondContact OD1-OD2 3.18Å; N96-V126 HydrophobicContact CB-CG2 3.75Å; N96-T396 PolarHBondContact ND2-O 3.5Å; N96-P400 HydrophobicContact CB-CG 4.28Å; N96-P400 WeakPolarHBondContact OD1-CD 3.39Å; N96-P400 WeakPolarHBondContact OD1-CG 3.28Å |
| 97 | L | 92.8 | Very high | 89.1 | Confident | 85 Ų | 85 | 62 Ų | 62 | 45% | 0.445 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.5 | -41.5 | 176.9 | -174.3 | 61.7 | 0 | 0 | 0 | 111.4 | L93 V99 L100 V101 | L93-L97 WeakPolarHBondContact O-CB 3.43Å; L93-L97 PolarHBondContact O-N 2.84Å; L97-V99 VanDerWaalsContact C-N 3.28Å; L97-V99 PolarHBondContact O-N 3.21Å; L97-L100 PolarHBondContact O-N 3.1Å; L97-L100 VanDerWaalsContact O-N 3.16Å; L97-V101 HydrophobicContact CD1-CG2 4.4Å; L97-V101 HydrophobicContact CG-CG2 4.39Å; L97-V101 WeakPolarHBondContact O-CG2 3.26Å; L97-V101 PolarHBondContact O-N 3.4Å |
| 98 | T | 89.4 | Confident | 88 | Confident | 85 Ų | 85 | 63.7 Ų | 63.7 | 52% | 0.521 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -56.3 | -44.4 | 174.7 | -62.6 | 0 | 0 | 0 | 0 | 111.2 | G94 N96 L102 | G94-T98 WeakPolarHBondContact O-CB 3.3Å; G94-T98 PolarHBondContact O-N 2.83Å; G94-T98 VanDerWaalsContact O-N 3.12Å; G94-T98 PolarHBondContact O-OG1 3.15Å; N96-T98 VanDerWaalsContact C-N 3.34Å; N96-T98 PolarHBondContact O-N 2.87Å; T98-L102 HydrophobicContact CG2-CD1 4.43Å; T98-L102 VanDerWaalsContact O-CG 3.28Å; T98-L102 WeakPolarHBondContact O-CG 3.3Å; T98-L102 PolarHBondContact O-N 3.49Å; T98-L102 VanDerWaalsContact O-N 3.13Å |
| 99 | V | 87.9 | Confident | 86.8 | Confident | 26 Ų | 26 | 65 Ų | 65 | 16% | 0.158 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 178 | 175.9 | 0 | 0 | 0 | 0 | 111.2 | S95 N96 L97 L102 Y103 H122 P400 | S95-V99 WeakPolarHBondContact O-CG2 3.49Å; S95-V99 PolarHBondContact O-N 3.35Å; N96-V99 PolarHBondContact O-N 3.34Å; L97-V99 VanDerWaalsContact C-N 3.28Å; L97-V99 PolarHBondContact O-N 3.21Å; V99-L102 WeakPolarHBondContact O-CB 3.39Å; V99-L102 PolarHBondContact O-N 3.43Å; V99-Y103 HydrophobicContact CG1-CD2 3.8Å; V99-Y103 HydrophobicContact CG1-CE2 3.49Å; V99-Y103 VanDerWaalsContact CG1-CE2 3.49Å; V99-Y103 WeakPolarHBondContact O-CD2 3.47Å; V99-Y103 PolarHBondContact O-N 3.42Å; V99-Y103 VanDerWaalsContact O-N 3.14Å; V99-H122 VanDerWaalsContact CG1-CD2 3.48Å; V99-H122 WeakPolarHBondContact CG1-CD2 3.16Å; V99-H122 WeakPolarHBondContact CG1-NE2 3.35Å; V99-P400 HydrophobicContact CG2-CB 4.21Å |
| 100 | L | 89.4 | Confident | 85.5 | Confident | 40 Ų | 40 | 66.4 Ų | 66.4 | 21% | 0.209 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.6 | -45.8 | 178.3 | -173.3 | 61.7 | 0 | 0 | 0 | 111.9 | N96 L97 L102 Y103 C104 M119 V123 | N96-L100 PolarHBondContact O-N 2.92Å; L97-L100 PolarHBondContact O-N 3.1Å; L97-L100 VanDerWaalsContact O-N 3.16Å; L100-L102 VanDerWaalsContact C-N 3.3Å; L100-L102 PolarHBondContact O-N 3.15Å; L100-Y103 WeakPolarHBondContact O-CB 3.47Å; L100-Y103 PolarHBondContact O-N 3Å; L100-C104 PolarHBondContact O-N 2.84Å; L100-C104 PolarHBondContact O-SG 3.39Å; L100-C104 VanDerWaalsContact O-SG 3.37Å; L100-M119 HydrophobicContact CD1-CG 3.74Å; L100-M119 HydrophobicContact CD1-SD 4.25Å; L100-V123 HydrophobicContact CD1-CG2 4.23Å |
| 101 | V | 87.6 | Confident | 84.5 | Confident | 67 Ų | 67 | 67.4 Ų | 67.4 | 41% | 0.406 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -57.4 | -43.1 | 175 | 170.1 | 0 | 0 | 0 | 0 | 111 | L97 Y103 C104 M105 | L97-V101 HydrophobicContact CD1-CG2 4.4Å; L97-V101 HydrophobicContact CG-CG2 4.39Å; L97-V101 WeakPolarHBondContact O-CG2 3.26Å; L97-V101 PolarHBondContact O-N 3.4Å; V101-Y103 VanDerWaalsContact C-N 3.27Å; V101-Y103 PolarHBondContact O-N 3.21Å; V101-C104 PolarHBondContact O-N 3.29Å; V101-M105 HydrophobicContact CG1-CG 4.13Å; V101-M105 HydrophobicContact CG1-SD 3.75Å; V101-M105 WeakPolarHBondContact O-CB 3.37Å; V101-M105 VanDerWaalsContact O-CG 3.27Å; V101-M105 WeakPolarHBondContact O-CG 3.45Å; V101-M105 PolarHBondContact O-N 3.34Å |
| 102 | L | 84.4 | Confident | 84 | Confident | 101 Ų | 101 | 66 Ų | 66 | 53% | 0.529 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.8 | -31.3 | 176.6 | -71.2 | 172.7 | 0 | 0 | 0 | 113.4 | T98 V99 L100 | T98-L102 HydrophobicContact CG2-CD1 4.43Å; T98-L102 VanDerWaalsContact O-CG 3.28Å; T98-L102 WeakPolarHBondContact O-CG 3.3Å; T98-L102 PolarHBondContact O-N 3.49Å; T98-L102 VanDerWaalsContact O-N 3.13Å; V99-L102 WeakPolarHBondContact O-CB 3.39Å; V99-L102 PolarHBondContact O-N 3.43Å; L100-L102 VanDerWaalsContact C-N 3.3Å; L100-L102 PolarHBondContact O-N 3.15Å |
| 103 | Y | 83.4 | Confident | 83.6 | Confident | 26 Ų | 26 | 66.5 Ų | 66.5 | 10% | 0.102 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -71.5 | -44.5 | 172.7 | -80.9 | -73 | 0 | 0 | 0 | 111.3 | V99 L100 V101 M105 K106 L109 N115 | V99-Y103 HydrophobicContact CG1-CD2 3.8Å; V99-Y103 HydrophobicContact CG1-CE2 3.49Å; V99-Y103 VanDerWaalsContact CG1-CE2 3.49Å; V99-Y103 WeakPolarHBondContact O-CD2 3.47Å; V99-Y103 PolarHBondContact O-N 3.42Å; V99-Y103 VanDerWaalsContact O-N 3.14Å; L100-Y103 WeakPolarHBondContact O-CB 3.47Å; L100-Y103 PolarHBondContact O-N 3Å; V101-Y103 VanDerWaalsContact C-N 3.27Å; V101-Y103 PolarHBondContact O-N 3.21Å; Y103-M105 PolarHBondContact O-N 2.89Å; Y103-K106 CarbonylContact O-C 3.42Å; Y103-K106 PolarHBondContact O-N 2.95Å; Y103-L109 HydrophobicContact CD1-CB 3.68Å; Y103-L109 HydrophobicContact CD1-CD1 4.09Å; Y103-L109 HydrophobicContact CD1-CG 4.47Å; Y103-L109 HydrophobicContact CE1-CB 3.97Å; Y103-L109 HydrophobicContact CE1-CD1 4.37Å; Y103-N115 HydrophobicContact CE1-CB 4Å |
| 104 | C | 83 | Confident | 83.2 | Confident | 92 Ų | 92 | 64.3 Ų | 64.3 | 62% | 0.622 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.3 | -42.8 | 177.9 | -63.8 | 0 | 0 | 0 | 0 | 112.4 | L100 V101 K106 | L100-C104 PolarHBondContact O-N 2.84Å; L100-C104 PolarHBondContact O-SG 3.39Å; L100-C104 VanDerWaalsContact O-SG 3.37Å; V101-C104 PolarHBondContact O-N 3.29Å; C104-K106 PolarHBondContact O-N 2.82Å; C104-K106 VanDerWaalsContact O-N 3.17Å |
| 105 | M | 79.8 | Confident | 82.9 | Confident | 152 Ų | 152 | 64.7 Ų | 64.7 | 75% | 0.749 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -16.6 | 179.3 | -69.8 | 178 | 79.4 | 0 | 0 | 113.5 | V101 Y103 | V101-M105 HydrophobicContact CG1-CG 4.13Å; V101-M105 HydrophobicContact CG1-SD 3.75Å; V101-M105 WeakPolarHBondContact O-CB 3.37Å; V101-M105 VanDerWaalsContact O-CG 3.27Å; V101-M105 WeakPolarHBondContact O-CG 3.45Å; V101-M105 PolarHBondContact O-N 3.34Å; Y103-M105 PolarHBondContact O-N 2.89Å |
| 106 | K | 78.6 | Confident | 82.8 | Confident | 120 Ų | 120 | 65 Ų | 65 | 52% | 0.522 | 36% | 0.358 | S | S | . | . | trans | -133.6 | 82.6 | -173.8 | -170.7 | 167.7 | -174.4 | 159.6 | 0 | 111 | Y103 C104 N108 L109 | Y103-K106 CarbonylContact O-C 3.42Å; Y103-K106 PolarHBondContact O-N 2.95Å; C104-K106 PolarHBondContact O-N 2.82Å; C104-K106 VanDerWaalsContact O-N 3.17Å; K106-N108 PolarHBondContact O-N 3.21Å; K106-L109 HydrophobicContact CB-CD1 3.8Å; K106-L109 HydrophobicContact CB-CG 4.22Å; K106-L109 HydrophobicContact CD-CD1 3.92Å; K106-L109 HydrophobicContact CD-CG 4.06Å; K106-L109 HydrophobicContact CG-CD1 4Å; K106-L109 HydrophobicContact CG-CG 3.97Å; K106-L109 WeakPolarHBondContact O-CB 3.31Å; K106-L109 PolarHBondContact O-N 2.82Å | ||
| 107 | S | 68.6 | Low | 82.6 | Confident | 78 Ų | 78 | 65 Ų | 65 | 55% | 0.545 | 36% | 0.358 | S | S | . | . | G | 310 helix | trans | -45.7 | -37.5 | 178.5 | 59.6 | 0 | 0 | 0 | 0 | 114.5 | L109 I110 | S107-L109 PolarHBondContact O-N 3.43Å; S107-I110 WeakPolarHBondContact O-CG1 3.48Å; S107-I110 PolarHBondContact O-N 2.96Å; S107-I110 VanDerWaalsContact O-N 3.09Å |
| 108 | N | 72.3 | Confident | 82.3 | Confident | 122 Ų | 122 | 61.1 Ų | 61.1 | 65% | 0.652 | 34% | 0.338 | S | S | * | . | G | 310 helix | trans | -60.3 | -17.6 | 177 | -71.5 | -62.3 | 0 | 0 | 0 | 114.9 | K106 | K106-N108 PolarHBondContact O-N 3.21Š|
| 109 | L | 71.4 | Confident | 82.3 | Confident | 45 Ų | 45 | 59.2 Ų | 59.2 | 24% | 0.236 | 32% | 0.324 | C | S | . | . | G | 310 helix | trans | -79.5 | -23.2 | 176.9 | -70.8 | 169.2 | 0 | 0 | 0 | 112.6 | Y103 K106 S107 N111 N115 | Y103-L109 HydrophobicContact CD1-CB 3.68Å; Y103-L109 HydrophobicContact CD1-CD1 4.09Å; Y103-L109 HydrophobicContact CD1-CG 4.47Å; Y103-L109 HydrophobicContact CE1-CB 3.97Å; Y103-L109 HydrophobicContact CE1-CD1 4.37Å; K106-L109 HydrophobicContact CB-CD1 3.8Å; K106-L109 HydrophobicContact CB-CG 4.22Å; K106-L109 HydrophobicContact CD-CD1 3.92Å; K106-L109 HydrophobicContact CD-CG 4.06Å; K106-L109 HydrophobicContact CG-CD1 4Å; K106-L109 HydrophobicContact CG-CG 3.97Å; K106-L109 WeakPolarHBondContact O-CB 3.31Å; K106-L109 PolarHBondContact O-N 2.82Å; S107-L109 PolarHBondContact O-N 3.43Å; L109-N111 VanDerWaalsContact C-N 3.32Å; L109-N111 PolarHBondContact O-N 3.38Å; L109-N115 WeakPolarHBondContact O-CB 3.13Å; L109-N115 PolarHBondContact O-ND2 3.23Å |
| 110 | I | 70.2 | Confident | 82.5 | Confident | 61 Ų | 61 | 58.9 Ų | 58.9 | 31% | 0.313 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | -15 | -171.1 | -33 | 168.6 | 0 | 0 | 0 | 111.5 | S107 S112 I116 | S107-I110 WeakPolarHBondContact O-CG1 3.48Å; S107-I110 PolarHBondContact O-N 2.96Å; S107-I110 VanDerWaalsContact O-N 3.09Å; I110-S112 PolarHBondContact O-N 2.94Å; I110-I116 HydrophobicContact CG2-CD1 4.38Å; I110-I116 HydrophobicContact CG2-CG1 4.05Å; I110-I116 WeakPolarHBondContact O-CG1 3.26Å |
| 111 | N | 74.5 | Confident | 82.6 | Confident | 121 Ų | 121 | 57 Ų | 57 | 65% | 0.647 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.2 | -2.4 | -175.9 | -63.5 | -22.7 | 0 | 0 | 0 | 115.1 | L109 | L109-N111 VanDerWaalsContact C-N 3.32Å; L109-N111 PolarHBondContact O-N 3.38Å |
| 112 | S | 84.5 | Confident | 82.9 | Confident | 46 Ų | 46 | 53.8 Ų | 53.8 | 32% | 0.322 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -113.1 | 129.6 | -178.4 | 177.8 | 0 | 0 | 0 | 0 | 110.9 | I110 S114 N115 I116 | I110-S112 PolarHBondContact O-N 2.94Å; S112-S114 VanDerWaalsContact C-N 3.26Å; S112-S114 PolarHBondContact O-N 3.03Å; S112-N115 WeakPolarHBondContact O-CA 3.42Å; S112-N115 WeakPolarHBondContact O-CB 3.4Å; S112-N115 PolarHBondContact O-N 3.41Å; S112-I116 PolarHBondContact O-N 3.31Å; S112-I116 VanDerWaalsContact O-N 3.16Å |
| 113 | V | 86.9 | Confident | 83.4 | Confident | 12 Ų | 12 | 51.2 Ų | 51.2 | 7% | 0.073 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -44.3 | -50.4 | 173.9 | 170.9 | 0 | 0 | 0 | 0 | 112.3 | N115 I116 I117 L189 M191 A194 | V113-N115 PolarHBondContact O-N 3.4Å; V113-I116 PolarHBondContact O-N 3.33Å; V113-I117 HydrophobicContact CG1-CD1 3.76Å; V113-I117 WeakPolarHBondContact O-CG1 3.44Å; V113-I117 PolarHBondContact O-N 3.41Å; V113-L189 HydrophobicContact CG1-CD2 3.72Å; V113-L189 HydrophobicContact CG1-CG 3.83Å; V113-M191 HydrophobicContact CG2-CB 4.4Å; V113-M191 HydrophobicContact CG2-SD 4.03Å; V113-A194 HydrophobicContact CB-CB 4.47Å; V113-A194 HydrophobicContact CG1-CB 3.64Å; V113-A194 HydrophobicContact CG2-CB 4.3Å |
| 114 | S | 86.1 | Confident | 84 | Confident | 10 Ų | 10 | 50 Ų | 50 | 7% | 0.07 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.5 | -29.4 | -179.8 | -46.8 | 0 | 0 | 0 | 0 | 114.2 | S112 T118 D176 I180 | S112-S114 VanDerWaalsContact C-N 3.26Å; S112-S114 PolarHBondContact O-N 3.03Å; S114-T118 WeakPolarHBondContact O-CB 3.49Å; S114-T118 PolarHBondContact O-N 3.28Å; S114-T118 PolarHBondContact O-OG1 3.04Å; S114-D176 WeakPolarHBondContact CA-OD2 3.32Å; S114-D176 WeakPolarHBondContact CB-OD2 3.43Å; S114-D176 PolarHBondContact OG-OD1 2.64Å; S114-D176 PolarHBondContact OG-OD2 2.84Å; S114-I180 VanDerWaalsContact OG-CD1 3.31Å; S114-I180 WeakPolarHBondContact OG-CD1 3.23Å |
| 115 | N | 85.9 | Confident | 84.6 | Confident | 44 Ų | 44 | 45.6 Ų | 45.6 | 24% | 0.235 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -81.2 | -36.8 | -179.3 | -68.5 | -7.6 | 0 | 0 | 0 | 110.6 | Y103 L109 S112 V113 T118 M119 | Y103-N115 HydrophobicContact CE1-CB 4Å; L109-N115 WeakPolarHBondContact O-CB 3.13Å; L109-N115 PolarHBondContact O-ND2 3.23Å; S112-N115 WeakPolarHBondContact O-CA 3.42Å; S112-N115 WeakPolarHBondContact O-CB 3.4Å; S112-N115 PolarHBondContact O-N 3.41Å; V113-N115 PolarHBondContact O-N 3.4Å; N115-T118 PolarHBondContact O-N 2.98Å; N115-M119 VanDerWaalsContact O-CB 3.25Å; N115-M119 WeakPolarHBondContact O-CB 3.37Å; N115-M119 PolarHBondContact O-N 3.03Å |
| 116 | I | 88.3 | Confident | 85.4 | Confident | 31 Ų | 31 | 39.8 Ų | 39.8 | 16% | 0.159 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.9 | -46.8 | 172.8 | -63.3 | -172.7 | 0 | 0 | 0 | 110.9 | I110 S112 V113 T118 M119 N120 M191 | I110-I116 HydrophobicContact CG2-CD1 4.38Å; I110-I116 HydrophobicContact CG2-CG1 4.05Å; I110-I116 WeakPolarHBondContact O-CG1 3.26Å; S112-I116 PolarHBondContact O-N 3.31Å; S112-I116 VanDerWaalsContact O-N 3.16Å; V113-I116 PolarHBondContact O-N 3.33Å; I116-T118 VanDerWaalsContact C-N 3.29Å; I116-T118 PolarHBondContact O-N 3.28Å; I116-M119 WeakPolarHBondContact O-CB 3.09Å; I116-M119 PolarHBondContact O-N 3.34Å; I116-M119 VanDerWaalsContact O-N 3.14Å; I116-N120 PolarHBondContact O-N 2.79Å; I116-M191 HydrophobicContact CD1-CE 3.61Å; I116-M191 HydrophobicContact CD1-SD 3.42Å; I116-M191 WeakPolarHBondContact CD1-SD 3.5Å; I116-M191 HydrophobicContact CG1-CE 4.47Å; I116-M191 HydrophobicContact CG1-SD 4.49Å |
| 117 | I | 89.8 | Confident | 86.3 | Confident | 1 Ų | 1 | 37.4 Ų | 37.4 | 1% | 0.005 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.3 | -42.2 | 178 | -66.1 | 168.2 | 0 | 0 | 0 | 110.7 | V113 N120 L121 A172 I173 D176 L189 M198 | V113-I117 HydrophobicContact CG1-CD1 3.76Å; V113-I117 WeakPolarHBondContact O-CG1 3.44Å; V113-I117 PolarHBondContact O-N 3.41Å; I117-N120 PolarHBondContact O-N 3Å; I117-L121 PolarHBondContact O-N 3.45Å; I117-A172 HydrophobicContact CG2-CB 4.07Å; I117-I173 HydrophobicContact CG2-CB 4.48Å; I117-I173 HydrophobicContact CG2-CG1 3.65Å; I117-D176 HydrophobicContact CD1-CB 3.81Å; I117-L189 HydrophobicContact CD1-CD2 3.69Å; I117-M198 HydrophobicContact CG1-SD 4.03Å |
| 118 | T | 87.1 | Confident | 87.6 | Confident | 3 Ų | 3 | 33.8 Ų | 33.8 | 2% | 0.018 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.4 | -42.1 | 174.9 | -66.1 | 0 | 0 | 0 | 0 | 112.2 | S114 N115 I116 N120 L121 H122 Y403 | S114-T118 WeakPolarHBondContact O-CB 3.49Å; S114-T118 PolarHBondContact O-N 3.28Å; S114-T118 PolarHBondContact O-OG1 3.04Å; N115-T118 PolarHBondContact O-N 2.98Å; I116-T118 VanDerWaalsContact C-N 3.29Å; I116-T118 PolarHBondContact O-N 3.28Å; T118-N120 VanDerWaalsContact C-N 3.29Å; T118-N120 PolarHBondContact O-N 3.32Å; T118-L121 WeakPolarHBondContact O-CB 3.22Å; T118-L121 PolarHBondContact O-N 3.24Å; T118-H122 PolarHBondContact O-CD2 3.36Å; T118-H122 PolarHBondContact O-N 2.84Å; T118-Y403 HydrophobicContact CG2-CD1 3.96Å; T118-Y403 HydrophobicContact CG2-CE1 3.16Å; T118-Y403 HydrophobicContact CG2-CE2 4.37Å; T118-Y403 VanDerWaalsContact CG2-CZ 3.43Å; T118-Y403 WeakPolarHBondContact CG2-OH 3Å; T118-Y403 PolarHBondContact OG1-OH 3.2Å |
| 119 | M | 88.6 | Confident | 88.8 | Confident | 46 Ų | 46 | 28 Ų | 28 | 23% | 0.227 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.5 | -40.3 | 179 | -176.1 | -175.9 | 77.9 | 0 | 0 | 110.7 | L100 N115 I116 L121 H122 V123 | L100-M119 HydrophobicContact CD1-CG 3.74Å; L100-M119 HydrophobicContact CD1-SD 4.25Å; N115-M119 VanDerWaalsContact O-CB 3.25Å; N115-M119 WeakPolarHBondContact O-CB 3.37Å; N115-M119 PolarHBondContact O-N 3.03Å; I116-M119 WeakPolarHBondContact O-CB 3.09Å; I116-M119 PolarHBondContact O-N 3.34Å; I116-M119 VanDerWaalsContact O-N 3.14Å; M119-L121 VanDerWaalsContact C-N 3.27Å; M119-L121 PolarHBondContact O-N 3.13Å; M119-H122 PolarHBondContact O-N 3.02Å; M119-H122 VanDerWaalsContact O-N 3.1Å; M119-V123 PolarHBondContact O-N 3.34Å |
| 120 | N | 91.9 | Very high | 90 | Very high | 19 Ų | 19 | 29.8 Ų | 29.8 | 10% | 0.102 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.8 | -35.3 | 176.7 | -164.4 | 81.7 | 0 | 0 | 0 | 112.8 | I116 I117 T118 H122 V123 L124 N169 M198 W202 | I116-N120 PolarHBondContact O-N 2.79Å; I117-N120 PolarHBondContact O-N 3Å; T118-N120 VanDerWaalsContact C-N 3.29Å; T118-N120 PolarHBondContact O-N 3.32Å; N120-H122 VanDerWaalsContact C-N 3.33Å; N120-H122 PolarHBondContact O-N 2.9Å; N120-V123 PolarHBondContact O-N 2.83Å; N120-L124 PolarHBondContact O-N 2.9Å; N120-N169 PolarHBondContact ND2-OD1 3.42Å; N120-M198 HydrophobicContact CB-CE 3.37Å; N120-M198 WeakPolarHBondContact ND2-CE 3.4Å; N120-W202 WeakPolarHBondContact OD1-CZ2 3.34Å; N120-W202 PolarHBondContact OD1-NE1 3.43Å |
| 121 | L | 92.1 | Very high | 91.1 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -59.5 | -44.8 | 173.3 | -174.6 | 72.2 | 0 | 0 | 0 | 111.1 | I117 T118 M119 V123 L124 D125 N169 I173 H399 | I117-L121 PolarHBondContact O-N 3.45Å; T118-L121 WeakPolarHBondContact O-CB 3.22Å; T118-L121 PolarHBondContact O-N 3.24Å; M119-L121 VanDerWaalsContact C-N 3.27Å; M119-L121 PolarHBondContact O-N 3.13Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.18Å; L121-L124 WeakPolarHBondContact O-CB 3.5Å; L121-L124 PolarHBondContact O-N 3.45Å; L121-D125 VanDerWaalsContact O-CG 3.29Å; L121-D125 PolarHBondContact O-N 3.24Å; L121-N169 HydrophobicContact CD1-CB 3.91Å; L121-I173 HydrophobicContact CB-CD1 4.42Å; L121-I173 HydrophobicContact CD2-CD1 3.75Å; L121-I173 HydrophobicContact CG-CD1 4.47Å; L121-H399 HydrophobicContact CD2-CB 4.16Å |
| 122 | H | 93.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -66 | -33.2 | 177.1 | -64.9 | -58.1 | 0 | 0 | 0 | 112.9 | N96 V99 T118 M119 N120 V126 | N96-H122 HydrophobicContact CB-CB 4.49Å; N96-H122 PolarHBondContact OD1-ND1 2.87Å; V99-H122 VanDerWaalsContact CG1-CD2 3.48Å; V99-H122 WeakPolarHBondContact CG1-CD2 3.16Å; V99-H122 WeakPolarHBondContact CG1-NE2 3.35Å; T118-H122 PolarHBondContact O-CD2 3.36Å; T118-H122 PolarHBondContact O-N 2.84Å; M119-H122 PolarHBondContact O-N 3.02Å; M119-H122 VanDerWaalsContact O-N 3.1Å; N120-H122 VanDerWaalsContact C-N 3.33Å; N120-H122 PolarHBondContact O-N 2.9Å; H122-V126 WeakPolarHBondContact O-CG2 3.4Å; H122-V126 PolarHBondContact O-N 3.45Å; H122-V126 VanDerWaalsContact O-N 3.09Å |
| 123 | V | 94.9 | Very high | 92.7 | Very high | 47 Ų | 47 | 20.6 Ų | 20.6 | 29% | 0.285 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -64.6 | -45.1 | 172.7 | 173.9 | 0 | 0 | 0 | 0 | 110.4 | L100 M119 N120 L121 V126 L127 W202 | L100-V123 HydrophobicContact CD1-CG2 4.23Å; M119-V123 PolarHBondContact O-N 3.34Å; N120-V123 PolarHBondContact O-N 2.83Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.18Å; V123-V126 PolarHBondContact O-N 3.01Å; V123-L127 WeakPolarHBondContact O-CG 3.46Å; V123-L127 PolarHBondContact O-N 3.47Å; V123-L127 VanDerWaalsContact O-N 3.07Å; V123-W202 HydrophobicContact CG1-CH2 4.22Å; V123-W202 HydrophobicContact CG1-CZ2 4.14Å |
| 124 | L | 96.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.5 | -46.8 | 175.3 | 174 | 64 | 0 | 0 | 0 | 111.8 | N120 L121 V126 L127 I128 F161 S165 N169 | N120-L124 PolarHBondContact O-N 2.9Å; L121-L124 WeakPolarHBondContact O-CB 3.5Å; L121-L124 PolarHBondContact O-N 3.45Å; L124-V126 VanDerWaalsContact C-N 3.26Å; L124-V126 PolarHBondContact O-N 3.43Å; L124-L127 WeakPolarHBondContact O-CB 3.24Å; L124-L127 PolarHBondContact O-N 3.06Å; L124-L127 VanDerWaalsContact O-N 3.08Å; L124-I128 HydrophobicContact CD1-CD1 4.1Å; L124-I128 HydrophobicContact CD1-CG1 4.23Å; L124-I128 HydrophobicContact CG-CD1 3.98Å; L124-I128 HydrophobicContact CG-CG1 4.49Å; L124-I128 WeakPolarHBondContact O-CG1 3.39Å; L124-I128 PolarHBondContact O-N 3.48Å; L124-F161 HydrophobicContact CD1-CE1 3.81Å; L124-F161 HydrophobicContact CD1-CZ 3.92Å; L124-S165 VanDerWaalsContact CD1-CB 3.43Å; L124-S165 VanDerWaalsContact CD2-C 3.46Å; L124-N169 HydrophobicContact CD2-CB 4.3Å |
| 125 | D | 95.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.3 | -37.8 | -179.8 | -68.9 | -24.3 | 0 | 0 | 0 | 111.3 | N96 L121 I128 C129 T396 H399 | N96-D125 HydrophobicContact CB-CB 4.45Å; N96-D125 PolarHBondContact OD1-OD2 3.18Å; L121-D125 VanDerWaalsContact O-CG 3.29Å; L121-D125 PolarHBondContact O-N 3.24Å; D125-I128 PolarHBondContact O-N 3.48Å; D125-C129 PolarHBondContact O-N 3.11Å; D125-C129 PolarHBondContact O-SG 3.4Å; D125-T396 HydrophobicContact CB-CG2 4.13Å; D125-H399 IonicContact OD1-CE1 3Å; D125-H399 IonicContact OD1-ND1 3.76Å; D125-H399 PolarHBondContact OD1-ND1 3.04Å; D125-H399 WeakPolarHBondContact OD2-CB 3.43Å; D125-H399 IonicContact OD2-CE1 3.54Å; D125-H399 IonicContact OD2-CG 3.86Å; D125-H399 IonicContact OD2-ND1 4Å; D125-H399 PolarHBondContact OD2-ND1 3.44Å |
| 126 | V | 96.6 | Very high | 93.6 | Very high | 29 Ų | 29 | 20.8 Ų | 20.8 | 18% | 0.176 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63.6 | -45.8 | 173 | 168.3 | 0 | 0 | 0 | 0 | 111.3 | L93 N96 H122 V123 L124 I128 C129 V130 | L93-V126 HydrophobicContact CD1-CG1 3.89Å; L93-V126 HydrophobicContact CD1-CG2 4.35Å; N96-V126 HydrophobicContact CB-CG2 3.75Å; H122-V126 WeakPolarHBondContact O-CG2 3.4Å; H122-V126 PolarHBondContact O-N 3.45Å; H122-V126 VanDerWaalsContact O-N 3.09Å; V123-V126 PolarHBondContact O-N 3.01Å; L124-V126 VanDerWaalsContact C-N 3.26Å; L124-V126 PolarHBondContact O-N 3.43Å; V126-I128 VanDerWaalsContact C-N 3.31Å; V126-I128 PolarHBondContact O-N 3.23Å; V126-C129 PolarHBondContact O-N 2.89Å; V126-C129 VanDerWaalsContact O-N 3.15Å; V126-V130 HydrophobicContact CG1-CG1 4.41Å; V126-V130 WeakPolarHBondContact O-CG2 3.3Å; V126-V130 PolarHBondContact O-N 3.48Å |
| 127 | L | 96.5 | Very high | 93.8 | Very high | 71 Ų | 71 | 20.1 Ų | 20.1 | 37% | 0.372 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -60.2 | -40.5 | 177.6 | -70.4 | -179.8 | 0 | 0 | 0 | 112.3 | V123 L124 V130 G131 W202 | V123-L127 WeakPolarHBondContact O-CG 3.46Å; V123-L127 PolarHBondContact O-N 3.47Å; V123-L127 VanDerWaalsContact O-N 3.07Å; L124-L127 WeakPolarHBondContact O-CB 3.24Å; L124-L127 PolarHBondContact O-N 3.06Å; L124-L127 VanDerWaalsContact O-N 3.08Å; L127-V130 PolarHBondContact O-N 3.4Å; L127-G131 PolarHBondContact O-N 2.92Å; L127-W202 HydrophobicContact CD1-CH2 3.47Å; L127-W202 VanDerWaalsContact CD1-CH2 3.47Å; L127-W202 HydrophobicContact CD1-CZ3 3.55Å |
| 128 | I | 96.6 | Very high | 93.8 | Very high | 1 Ų | 1 | 23 Ų | 23 | 1% | 0.005 | 14% | 0.14 | C | C | . | . | I | π-helix | trans | -62.7 | -45.4 | 174.9 | -66.9 | 171 | 0 | 0 | 0 | 110.1 | L124 D125 V126 V130 C132 I133 A162 Y393 T396 | L124-I128 HydrophobicContact CD1-CD1 4.1Å; L124-I128 HydrophobicContact CD1-CG1 4.23Å; L124-I128 HydrophobicContact CG-CD1 3.98Å; L124-I128 HydrophobicContact CG-CG1 4.49Å; L124-I128 WeakPolarHBondContact O-CG1 3.39Å; L124-I128 PolarHBondContact O-N 3.48Å; D125-I128 PolarHBondContact O-N 3.48Å; V126-I128 VanDerWaalsContact C-N 3.31Å; V126-I128 PolarHBondContact O-N 3.23Å; I128-V130 PolarHBondContact O-N 2.92Å; I128-C132 HydrophobicContact CG2-CB 4.08Å; I128-C132 WeakPolarHBondContact O-CB 3.33Å; I128-C132 PolarHBondContact O-N 2.89Å; I128-I133 HydrophobicContact CG2-CG1 4.28Å; I128-I133 PolarHBondContact O-N 3.32Å; I128-A162 HydrophobicContact CD1-CB 4.03Å; I128-A162 HydrophobicContact CG1-CB 4.06Å; I128-Y393 HydrophobicContact CG2-CD1 3.73Å; I128-Y393 HydrophobicContact CG2-CE1 4.1Å; I128-T396 HydrophobicContact CB-CG2 4.06Å; I128-T396 HydrophobicContact CG2-CG2 3.8Å |
| 129 | C | 97.1 | Very high | 93.7 | Very high | 1 Ų | 1 | 23 Ų | 23 | 1% | 0.007 | 14% | 0.14 | C | C | . | . | I | π-helix | trans | -64 | -35.5 | 179.6 | -66.9 | 0 | 0 | 0 | 0 | 114 | L93 D125 V126 P134 | L93-C129 HydrophobicContact CB-CB 4.43Å; L93-C129 HydrophobicContact CD1-CB 4.39Å; D125-C129 PolarHBondContact O-N 3.11Å; D125-C129 PolarHBondContact O-SG 3.4Å; V126-C129 PolarHBondContact O-N 2.89Å; V126-C129 VanDerWaalsContact O-N 3.15Å; C129-P134 VanDerWaalsContact O-CD 3.25Å; C129-P134 WeakPolarHBondContact O-CD 3.32Å |
| 130 | V | 96.6 | Very high | 93.5 | Very high | 82 Ų | 82 | 21 Ų | 21 | 50% | 0.497 | 13% | 0.13 | S | C | . | . | I | π-helix | trans | -93 | -20.4 | -177.5 | -56.2 | 0 | 0 | 0 | 0 | 113.8 | L93 V126 L127 I128 | L93-V130 HydrophobicContact CD1-CG1 3.67Å; V126-V130 HydrophobicContact CG1-CG1 4.41Å; V126-V130 WeakPolarHBondContact O-CG2 3.3Å; V126-V130 PolarHBondContact O-N 3.48Å; L127-V130 PolarHBondContact O-N 3.4Å; I128-V130 PolarHBondContact O-N 2.92Å |
| 131 | G | 94.7 | Very high | 93.2 | Very high | 32 Ų | 32 | 24.3 Ų | 24.3 | 33% | 0.33 | 15% | 0.147 | S | C | . | . | I | π-helix | trans | -110.8 | -62.8 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L127 L135 | L127-G131 PolarHBondContact O-N 2.92Å; G131-L135 VanDerWaalsContact O-CB 3.28Å; G131-L135 WeakPolarHBondContact O-CB 3.49Å; G131-L135 PolarHBondContact O-N 3.49Å |
| 132 | C | 95.3 | Very high | 92.5 | Very high | 4 Ų | 4 | 27.8 Ų | 27.8 | 3% | 0.027 | 17% | 0.165 | C | C | . | . | I | π-helix | trans | -71.5 | -44.6 | -169.7 | -56.6 | 0 | 0 | 0 | 0 | 112.4 | I128 T136 C158 Y393 | I128-C132 HydrophobicContact CG2-CB 4.08Å; I128-C132 WeakPolarHBondContact O-CB 3.33Å; I128-C132 PolarHBondContact O-N 2.89Å; C132-T136 PolarHBondContact O-N 3.27Å; C132-T136 PolarHBondContact O-OG1 3.26Å; C132-C158 HydrophobicContact CB-CB 4.31Å; C132-Y393 HydrophobicContact CB-CE1 3.95Å |
| 133 | I | 95.8 | Very high | 91 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.5 | -49.8 | -177.6 | -58.7 | -179 | 0 | 0 | 0 | 111.7 | L85 E88 I89 I128 L135 T136 I137 Y393 | L85-I133 HydrophobicContact CB-CG2 3.79Å; L85-I133 HydrophobicContact CD2-CG2 3.74Å; L85-I133 HydrophobicContact CG-CG2 4.33Å; E88-I133 HydrophobicContact CB-CD1 3.93Å; I89-I133 HydrophobicContact CD1-CB 4.44Å; I89-I133 HydrophobicContact CD1-CG2 3.83Å; I89-I133 HydrophobicContact CG1-CB 4.07Å; I89-I133 HydrophobicContact CG1-CG2 3.59Å; I128-I133 HydrophobicContact CG2-CG1 4.28Å; I128-I133 PolarHBondContact O-N 3.32Å; I133-L135 VanDerWaalsContact C-N 3.3Å; I133-L135 PolarHBondContact O-N 2.96Å; I133-T136 WeakPolarHBondContact O-CB 3.28Å; I133-T136 PolarHBondContact O-N 3Å; I133-T136 VanDerWaalsContact O-N 3.1Å; I133-I137 HydrophobicContact CG2-CD1 4.42Å; I133-I137 PolarHBondContact O-N 3.14Å; I133-Y393 HydrophobicContact CD1-CG 4.4Å; I133-Y393 HydrophobicContact CG1-CD1 4.41Å; I133-Y393 HydrophobicContact CG1-CD2 3.94Å; I133-Y393 HydrophobicContact CG1-CE2 4.4Å; I133-Y393 HydrophobicContact CG1-CG 3.94Å |
| 134 | P | 95.5 | Very high | 89.2 | Confident | 46 Ų | 46 | 30.9 Ų | 30.9 | 30% | 0.299 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -61.6 | -38.2 | 178.6 | -25.3 | 37 | 0 | 0 | 0 | 112.7 | I89 C129 T136 I137 V138 | I89-P134 HydrophobicContact CD1-CG 3.99Å; C129-P134 VanDerWaalsContact O-CD 3.25Å; C129-P134 WeakPolarHBondContact O-CD 3.32Å; P134-T136 VanDerWaalsContact C-N 3.31Å; P134-T136 PolarHBondContact O-N 3.4Å; P134-I137 WeakPolarHBondContact O-CB 3.31Å; P134-I137 PolarHBondContact O-N 2.8Å; P134-I137 VanDerWaalsContact O-N 3.14Å; P134-V138 WeakPolarHBondContact O-CG2 3.42Å; P134-V138 PolarHBondContact O-N 3.31Å |
| 135 | L | 92.2 | Very high | 87.3 | Confident | 22 Ų | 22 | 38 Ų | 38 | 12% | 0.115 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.9 | -37.6 | 175.5 | -177.8 | 66.4 | 0 | 0 | 0 | 112.3 | G131 I133 I137 V138 I139 I151 F154 H155 C158 | G131-L135 VanDerWaalsContact O-CB 3.28Å; G131-L135 WeakPolarHBondContact O-CB 3.49Å; G131-L135 PolarHBondContact O-N 3.49Å; I133-L135 VanDerWaalsContact C-N 3.3Å; I133-L135 PolarHBondContact O-N 2.96Å; L135-I137 VanDerWaalsContact C-N 3.3Å; L135-I137 PolarHBondContact O-N 2.96Å; L135-V138 PolarHBondContact O-N 2.98Å; L135-I139 WeakPolarHBondContact O-CG1 3.31Å; L135-I139 PolarHBondContact O-N 3.43Å; L135-I151 HydrophobicContact CD1-CG2 3.96Å; L135-F154 HydrophobicContact CD1-CD1 4.09Å; L135-F154 HydrophobicContact CD2-CD1 3.38Å; L135-F154 HydrophobicContact CD2-CE1 3.9Å; L135-F154 HydrophobicContact CD2-CG 4.42Å; L135-F154 HydrophobicContact CG-CD1 4.37Å; L135-H155 VanDerWaalsContact CD2-CA 3.45Å; L135-H155 HydrophobicContact CD2-CB 4.06Å; L135-H155 HydrophobicContact CG-CB 4.15Å; L135-C158 HydrophobicContact CD2-CB 3.89Å; L135-C158 VanDerWaalsContact CD2-SG 3.56Å |
| 136 | T | 91.4 | Very high | 85.2 | Confident | 1 Ų | 1 | 42.9 Ų | 42.9 | 1% | 0.006 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64 | -38.1 | 173.2 | -51.4 | 0 | 0 | 0 | 0 | 110.8 | L85 C132 I133 P134 I139 L140 H155 L389 Y393 | L85-T136 HydrophobicContact CD1-CG2 4.01Å; C132-T136 PolarHBondContact O-N 3.27Å; C132-T136 PolarHBondContact O-OG1 3.26Å; I133-T136 WeakPolarHBondContact O-CB 3.28Å; I133-T136 PolarHBondContact O-N 3Å; I133-T136 VanDerWaalsContact O-N 3.1Å; P134-T136 VanDerWaalsContact C-N 3.31Å; P134-T136 PolarHBondContact O-N 3.4Å; T136-I139 PolarHBondContact O-N 3.01Å; T136-L140 HydrophobicContact CG2-CD1 4.48Å; T136-L140 VanDerWaalsContact O-CG 3.32Å; T136-L140 WeakPolarHBondContact O-CG 2.95Å; T136-L140 PolarHBondContact O-N 3.01Å; T136-H155 PolarHBondContact OG1-NE2 3.05Å; T136-L389 HydrophobicContact CG2-CD2 4.15Å; T136-Y393 HydrophobicContact CG2-CE2 4.24Å; T136-Y393 VanDerWaalsContact OG1-CE2 3.3Å; T136-Y393 WeakPolarHBondContact OG1-CE2 3.44Å; T136-Y393 PolarHBondContact OG1-OH 3.46Å |
| 137 | I | 92.5 | Very high | 83.4 | Confident | 17 Ų | 17 | 47.8 Ų | 47.8 | 9% | 0.087 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.6 | -47 | 174 | -65.3 | 170.4 | 0 | 0 | 0 | 110.9 | T82 L85 M86 I89 I133 P134 L135 I139 L140 L141 | T82-I137 HydrophobicContact CG2-CG1 4.49Å; T82-I137 HydrophobicContact CG2-CG2 3.84Å; L85-I137 HydrophobicContact CB-CD1 3.84Å; L85-I137 HydrophobicContact CB-CG1 3.73Å; L85-I137 HydrophobicContact CD1-CG1 3.85Å; L85-I137 HydrophobicContact CG-CG1 4.42Å; M86-I137 HydrophobicContact CG-CD1 4.04Å; M86-I137 HydrophobicContact SD-CD1 3.57Å; M86-I137 VanDerWaalsContact SD-CD1 3.57Å; I89-I137 HydrophobicContact CD1-CD1 3.86Å; I133-I137 HydrophobicContact CG2-CD1 4.42Å; I133-I137 PolarHBondContact O-N 3.14Å; P134-I137 WeakPolarHBondContact O-CB 3.31Å; P134-I137 PolarHBondContact O-N 2.8Å; P134-I137 VanDerWaalsContact O-N 3.14Å; L135-I137 VanDerWaalsContact C-N 3.3Å; L135-I137 PolarHBondContact O-N 2.96Å; I137-I139 PolarHBondContact O-N 3.45Å; I137-L140 PolarHBondContact O-N 3.15Å; I137-L141 HydrophobicContact CG2-CD1 3.64Å; I137-L141 HydrophobicContact CG2-CG 4.03Å; I137-L141 WeakPolarHBondContact O-CG 3.47Å; I137-L141 PolarHBondContact O-N 3.29Å |
| 138 | V | 89.4 | Confident | 82.1 | Confident | 63 Ų | 63 | 44.8 Ų | 44.8 | 38% | 0.382 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -53.5 | -47.3 | 176.5 | 170.8 | 0 | 0 | 0 | 0 | 110.2 | P134 L135 L140 L141 L142 I151 | P134-V138 WeakPolarHBondContact O-CG2 3.42Å; P134-V138 PolarHBondContact O-N 3.31Å; L135-V138 PolarHBondContact O-N 2.98Å; V138-L140 VanDerWaalsContact C-N 3.31Å; V138-L140 PolarHBondContact O-N 3.41Å; V138-L141 PolarHBondContact O-N 2.77Å; V138-L141 VanDerWaalsContact O-N 3.15Å; V138-L142 WeakPolarHBondContact O-CB 3.38Å; V138-L142 PolarHBondContact O-N 3.31Å; V138-I151 HydrophobicContact CG1-CG2 4.31Å |
| 139 | I | 83.9 | Confident | 80.9 | Confident | 3 Ų | 3 | 45.5 Ų | 45.5 | 2% | 0.015 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.9 | -33.6 | 177.9 | -76.1 | -66 | 0 | 0 | 0 | 113.5 | L135 T136 I137 I151 H155 L233 | L135-I139 WeakPolarHBondContact O-CG1 3.31Å; L135-I139 PolarHBondContact O-N 3.43Å; T136-I139 PolarHBondContact O-N 3.01Å; I137-I139 PolarHBondContact O-N 3.45Å; I139-I151 HydrophobicContact CD1-CB 4.45Å; I139-I151 HydrophobicContact CD1-CG2 3.73Å; I139-I151 HydrophobicContact CG1-CG2 4.24Å; I139-H155 HydrophobicContact CD1-CB 4.36Å; I139-H155 HydrophobicContact CG1-CB 3.96Å; I139-L233 HydrophobicContact CB-CD2 4.47Å; I139-L233 HydrophobicContact CG2-CD2 3.01Å |
| 140 | L | 86.1 | Confident | 79.9 | Confident | 4 Ų | 4 | 49.4 Ų | 49.4 | 2% | 0.021 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -76.3 | -26.4 | 176.1 | -70.8 | 169.6 | 0 | 0 | 0 | 113.2 | Q78 L81 L85 T136 I137 V138 L386 | Q78-L140 WeakPolarHBondContact CG-O 3.21Å; Q78-L140 PolarHBondContact NE2-O 2.85Å; L81-L140 HydrophobicContact CB-CD1 4.16Å; L81-L140 HydrophobicContact CD2-CD1 3.78Å; L81-L140 HydrophobicContact CD2-CD2 3.85Å; L81-L140 HydrophobicContact CD2-CG 4.48Å; L81-L140 HydrophobicContact CG-CD1 4.09Å; L85-L140 HydrophobicContact CD1-CD1 3.47Å; L85-L140 VanDerWaalsContact CD1-CD1 3.47Å; T136-L140 HydrophobicContact CG2-CD1 4.48Å; T136-L140 VanDerWaalsContact O-CG 3.32Å; T136-L140 WeakPolarHBondContact O-CG 2.95Å; T136-L140 PolarHBondContact O-N 3.01Å; I137-L140 PolarHBondContact O-N 3.15Å; V138-L140 VanDerWaalsContact C-N 3.31Å; V138-L140 PolarHBondContact O-N 3.41Å; L140-L386 HydrophobicContact CD2-CD1 3.84Å; L140-L386 HydrophobicContact CD2-CD2 4.29Å |
| 141 | L | 85 | Confident | 79.2 | Confident | 88 Ų | 88 | 48.3 Ų | 48.3 | 46% | 0.461 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -98.1 | -23.5 | -174.9 | -61.5 | -176 | 0 | 0 | 0 | 113.8 | Q78 T82 I137 V138 | Q78-L141 HydrophobicContact CG-CD2 3.78Å; T82-L141 HydrophobicContact CG2-CD2 4.43Å; I137-L141 HydrophobicContact CG2-CD1 3.64Å; I137-L141 HydrophobicContact CG2-CG 4.03Å; I137-L141 WeakPolarHBondContact O-CG 3.47Å; I137-L141 PolarHBondContact O-N 3.29Å; V138-L141 PolarHBondContact O-N 2.77Å; V138-L141 VanDerWaalsContact O-N 3.15Å |
| 142 | L | 77.8 | Confident | 78.3 | Confident | 72 Ų | 72 | 46.8 Ų | 46.8 | 38% | 0.377 | 26% | 0.264 | S | S | . | . | S | Bend | trans | -77.8 | 128.5 | -178.4 | -145.2 | 80.8 | 0 | 0 | 0 | 110.3 | V138 L144 T148 I151 | V138-L142 WeakPolarHBondContact O-CB 3.38Å; V138-L142 PolarHBondContact O-N 3.31Å; L142-L144 PolarHBondContact O-N 2.86Å; L142-T148 HydrophobicContact CD2-CG2 3.67Å; L142-I151 HydrophobicContact CD2-CD1 4.24Å |
| 143 | S | 60.6 | Low | 77.5 | Confident | 70 Ų | 70 | 46.9 Ų | 46.9 | 49% | 0.49 | 26% | 0.264 | S | S | . | . | trans | -67.4 | 121.1 | 162.2 | -61.3 | 0 | 0 | 0 | 0 | 108 | E145 | S143-E145 VanDerWaalsContact C-N 3.28Å; S143-E145 PolarHBondContact O-N 2.92Å | ||
| 144 | L | 57.6 | Low | 77 | Confident | 42 Ų | 42 | 51.5 Ų | 51.5 | 22% | 0.22 | 29% | 0.285 | C | S | . | . | trans | -73 | 80.5 | -174.2 | -79.1 | 92.1 | 0 | 0 | 0 | 111.5 | L142 L233 C234 | L142-L144 PolarHBondContact O-N 2.86Å; L144-L233 WeakPolarHBondContact CD2-O 3.37Å; L144-C234 HydrophobicContact CD2-CB 4.14Å; L144-C234 VanDerWaalsContact CD2-SG 3.6Å | ||
| 145 | E | 55.4 | Low | 76.6 | Confident | 149 Ų | 149 | 49.4 Ų | 49.4 | 70% | 0.696 | 27% | 0.271 | S | S | * | . | trans | -80.6 | 167 | 165.6 | -71.2 | -178.5 | 179 | 0 | 0 | 111.2 | S143 N147 T148 | S143-E145 VanDerWaalsContact C-N 3.28Å; S143-E145 PolarHBondContact O-N 2.92Å; E145-N147 PolarHBondContact O-N 2.78Å; E145-T148 PolarHBondContact O-N 2.94Å; E145-T148 PolarHBondContact O-OG1 3.12Å | ||
| 146 | S | 53.5 | Low | 76.2 | Confident | 103 Ų | 103 | 48.4 Ų | 48.4 | 72% | 0.72 | 27% | 0.266 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -11.3 | -168.9 | 53.6 | 0 | 0 | 0 | 0 | 116.5 | ||
| 147 | N | 58.9 | Low | 76 | Confident | 133 Ų | 133 | 48.4 Ų | 48.4 | 71% | 0.711 | 27% | 0.266 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.2 | 14.8 | -178.7 | -154.5 | 16.3 | 0 | 0 | 0 | 114.7 | E145 | E145-N147 PolarHBondContact O-N 2.78Š|
| 148 | T | 69.2 | Low | 76 | Confident | 7 Ų | 7 | 48 Ų | 48 | 4% | 0.043 | 26% | 0.264 | C | S | . | . | trans | -91.2 | -3.6 | -173.7 | -47.4 | 0 | 0 | 0 | 0 | 114.2 | L142 E145 L150 I151 C152 | L142-T148 HydrophobicContact CD2-CG2 3.67Å; E145-T148 PolarHBondContact O-N 2.94Å; E145-T148 PolarHBondContact O-OG1 3.12Å; T148-L150 VanDerWaalsContact C-N 3.32Å; T148-L150 PolarHBondContact O-N 3.35Å; T148-I151 HydrophobicContact CG2-CB 4.19Å; T148-I151 HydrophobicContact CG2-CD1 4.46Å; T148-I151 PolarHBondContact O-N 3.48Å; T148-C152 PolarHBondContact O-N 3.39Å; T148-C152 VanDerWaalsContact O-N 3.09Å | ||
| 149 | A | 71 | Confident | 75.9 | Confident | 16 Ų | 16 | 45 Ų | 45 | 13% | 0.132 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -49.7 | -46.7 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114 | I151 C152 C153 N229 | A149-I151 PolarHBondContact O-N 3.48Å; A149-C152 PolarHBondContact O-N 3.05Å; A149-C153 WeakPolarHBondContact O-CB 3.2Å; A149-C153 PolarHBondContact O-N 3.15Å; A149-N229 WeakPolarHBondContact CA-OD1 3.49Å; A149-N229 WeakPolarHBondContact CB-OD1 3.38Å |
| 150 | L | 76.3 | Confident | 76.1 | Confident | 83 Ų | 83 | 45.1 Ų | 45.1 | 44% | 0.435 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -66.3 | -38.5 | -177.5 | -68.9 | 175 | 0 | 0 | 0 | 112.2 | T148 C153 F154 F218 | T148-L150 VanDerWaalsContact C-N 3.32Å; T148-L150 PolarHBondContact O-N 3.35Å; L150-C153 PolarHBondContact O-N 3.07Å; L150-F154 VanDerWaalsContact O-CB 3.32Å; L150-F154 WeakPolarHBondContact O-CB 3.47Å; L150-F154 PolarHBondContact O-N 3.42Å; L150-F218 HydrophobicContact CD2-CD2 4.32Å; L150-F218 HydrophobicContact CD2-CE2 3.73Å |
| 151 | I | 80.4 | Confident | 76.4 | Confident | 59 Ų | 59 | 46.3 Ų | 46.3 | 30% | 0.303 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -68.4 | -42.3 | 179.2 | -55.7 | 178.1 | 0 | 0 | 0 | 109.6 | L135 V138 I139 L142 T148 A149 F154 H155 | L135-I151 HydrophobicContact CD1-CG2 3.96Å; V138-I151 HydrophobicContact CG1-CG2 4.31Å; I139-I151 HydrophobicContact CD1-CB 4.45Å; I139-I151 HydrophobicContact CD1-CG2 3.73Å; I139-I151 HydrophobicContact CG1-CG2 4.24Å; L142-I151 HydrophobicContact CD2-CD1 4.24Å; T148-I151 HydrophobicContact CG2-CB 4.19Å; T148-I151 HydrophobicContact CG2-CD1 4.46Å; T148-I151 PolarHBondContact O-N 3.48Å; A149-I151 PolarHBondContact O-N 3.48Å; I151-F154 PolarHBondContact O-N 3.47Å; I151-H155 VanDerWaalsContact O-CB 3.28Å; I151-H155 WeakPolarHBondContact O-CB 3.44Å; I151-H155 PolarHBondContact O-N 2.96Å |
| 152 | C | 77.3 | Confident | 76.7 | Confident | 1 Ų | 1 | 42.1 Ų | 42.1 | 1% | 0.007 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.8 | -43.9 | 173.4 | -83.9 | 0 | 0 | 0 | 0 | 112.5 | T148 A149 H155 E156 T231 C234 | T148-C152 PolarHBondContact O-N 3.39Å; T148-C152 VanDerWaalsContact O-N 3.09Å; A149-C152 PolarHBondContact O-N 3.05Å; C152-H155 WeakPolarHBondContact O-CB 3.37Å; C152-H155 PolarHBondContact O-N 2.95Å; C152-E156 PolarHBondContact O-N 3.39Å; C152-T231 HydrophobicContact CB-CG2 4.19Å; C152-C234 HydrophobicContact CB-CB 3.76Å; C152-C234 WeakPolarHBondContact CB-SG 3.48Å; C152-C234 WeakPolarHBondContact SG-CB 3.29Å; C152-C234 CovalentContact SG-SG 2.03Å; C152-C234 PolarHBondContact SG-SG 2.89Å |
| 153 | C | 78.3 | Confident | 77.3 | Confident | 5 Ų | 5 | 39.1 Ų | 39.1 | 3% | 0.034 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.8 | -46.1 | 176 | -175 | 0 | 0 | 0 | 0 | 111.6 | A149 L150 H155 E156 A157 | A149-C153 WeakPolarHBondContact O-CB 3.2Å; A149-C153 PolarHBondContact O-N 3.15Å; L150-C153 PolarHBondContact O-N 3.07Å; C153-H155 VanDerWaalsContact C-N 3.29Å; C153-H155 PolarHBondContact O-N 3.21Å; C153-E156 PolarHBondContact O-N 3Å; C153-A157 WeakPolarHBondContact O-CB 3.45Å; C153-A157 PolarHBondContact O-N 3.46Å |
| 154 | F | 85.4 | Confident | 78.6 | Confident | 98 Ų | 98 | 36 Ų | 36 | 43% | 0.43 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -63.9 | -36.6 | 177.1 | -165.4 | -96.6 | 0 | 0 | 0 | 111.4 | L135 L150 I151 A157 C158 F209 F213 | L135-F154 HydrophobicContact CD1-CD1 4.09Å; L135-F154 HydrophobicContact CD2-CD1 3.38Å; L135-F154 HydrophobicContact CD2-CE1 3.9Å; L135-F154 HydrophobicContact CD2-CG 4.42Å; L135-F154 HydrophobicContact CG-CD1 4.37Å; L150-F154 VanDerWaalsContact O-CB 3.32Å; L150-F154 WeakPolarHBondContact O-CB 3.47Å; L150-F154 PolarHBondContact O-N 3.42Å; I151-F154 PolarHBondContact O-N 3.47Å; F154-A157 WeakPolarHBondContact O-CB 3.29Å; F154-A157 PolarHBondContact O-N 3.47Å; F154-C158 PolarHBondContact O-N 3.39Å; F154-F209 AromaticContact CD2-CZ 3.95Å; F154-F209 HydrophobicContact CD2-CZ 3.95Å; F154-F209 HydrophobicContact CE2-CE1 4.45Å; F154-F209 HydrophobicContact CE2-CE2 4.41Å; F154-F209 AromaticContact CE2-CZ 3.57Å; F154-F209 HydrophobicContact CE2-CZ 3.57Å; F154-F209 HydrophobicContact CZ-CZ 4.03Å; F154-F213 HydrophobicContact CB-CZ 4.4Å; F154-F213 AromaticContact CD2-CZ 3.88Å; F154-F213 HydrophobicContact CD2-CZ 3.88Å |
| 155 | H | 87.1 | Confident | 80.3 | Confident | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.005 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61 | -50.7 | 173.6 | 173.4 | -93.9 | 0 | 0 | 0 | 111.9 | L135 T136 I139 I151 C152 C153 A157 C158 V159 | L135-H155 VanDerWaalsContact CD2-CA 3.45Å; L135-H155 HydrophobicContact CD2-CB 4.06Å; L135-H155 HydrophobicContact CG-CB 4.15Å; T136-H155 PolarHBondContact OG1-NE2 3.05Å; I139-H155 HydrophobicContact CD1-CB 4.36Å; I139-H155 HydrophobicContact CG1-CB 3.96Å; I151-H155 VanDerWaalsContact O-CB 3.28Å; I151-H155 WeakPolarHBondContact O-CB 3.44Å; I151-H155 PolarHBondContact O-N 2.96Å; C152-H155 WeakPolarHBondContact O-CB 3.37Å; C152-H155 PolarHBondContact O-N 2.95Å; C153-H155 VanDerWaalsContact C-N 3.29Å; C153-H155 PolarHBondContact O-N 3.21Å; H155-A157 VanDerWaalsContact C-N 3.27Å; H155-A157 PolarHBondContact O-N 3.31Å; H155-C158 WeakPolarHBondContact O-CB 3.45Å; H155-C158 PolarHBondContact O-N 3.33Å; H155-C158 VanDerWaalsContact O-N 3.15Å; H155-V159 WeakPolarHBondContact O-CG2 3.41Å; H155-V159 PolarHBondContact O-N 2.88Å |
| 156 | E | 84.2 | Confident | 82 | Confident | 2 Ų | 2 | 27 Ų | 27 | 1% | 0.009 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -63.4 | -34.4 | 177.5 | -67.8 | -56.7 | 156 | 0 | 0 | 112.7 | C152 C153 V159 S160 P212 T231 H249 R385 | C152-E156 PolarHBondContact O-N 3.39Å; C153-E156 PolarHBondContact O-N 3Å; E156-V159 PolarHBondContact O-N 3.33Å; E156-S160 WeakPolarHBondContact O-CB 3.37Å; E156-S160 PolarHBondContact O-N 2.77Å; E156-S160 PolarHBondContact O-OG 2.9Å; E156-P212 HydrophobicContact CB-CB 4.38Å; E156-P212 HydrophobicContact CB-CG 4.36Å; E156-T231 HydrophobicContact CB-CG2 4.37Å; E156-T231 HydrophobicContact CG-CG2 3.46Å; E156-T231 VanDerWaalsContact CG-CG2 3.46Å; E156-H249 IonicContact OE2-NE2 3.22Å; E156-R385 VanDerWaalsContact CD-NH2 3.34Å; E156-R385 IonicContact OE1-CZ 2.85Å; E156-R385 IonicContact OE1-NH1 3.46Å; E156-R385 PolarHBondContact OE1-NH1 3.44Å; E156-R385 IonicContact OE1-NH2 3.72Å; E156-R385 PolarHBondContact OE1-NH2 3.39Å; E156-R385 IonicContact OE2-CZ 3.99Å; E156-R385 IonicContact OE2-NH1 3.67Å; E156-R385 IonicContact OE2-NH2 2.74Å; E156-R385 PolarHBondContact OE2-NH2 2.79Å |
| 157 | A | 87.1 | Confident | 83.8 | Confident | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -62.8 | -45.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | C153 F154 H155 S160 F161 F209 P212 F213 | C153-A157 WeakPolarHBondContact O-CB 3.45Å; C153-A157 PolarHBondContact O-N 3.46Å; F154-A157 WeakPolarHBondContact O-CB 3.29Å; F154-A157 PolarHBondContact O-N 3.47Å; H155-A157 VanDerWaalsContact C-N 3.27Å; H155-A157 PolarHBondContact O-N 3.31Å; A157-S160 PolarHBondContact O-N 3.3Å; A157-F161 WeakPolarHBondContact O-CB 3.25Å; A157-F161 PolarHBondContact O-N 2.89Å; A157-F209 VanDerWaalsContact C-CD2 3.49Å; A157-F209 HydrophobicContact CB-CD1 4.44Å; A157-F209 HydrophobicContact CB-CD2 3.71Å; A157-F209 HydrophobicContact CB-CE1 4.3Å; A157-F209 HydrophobicContact CB-CE2 3.53Å; A157-F209 HydrophobicContact CB-CG 4.16Å; A157-F209 HydrophobicContact CB-CZ 3.85Å; A157-F209 VanDerWaalsContact CB-O 3.22Å; A157-F209 WeakPolarHBondContact CB-O 3.42Å; A157-F209 WeakPolarHBondContact O-CD2 3.46Å; A157-P212 HydrophobicContact CB-CB 4.46Å; A157-P212 HydrophobicContact CB-CG 4.24Å; A157-F213 HydrophobicContact CB-CD2 4.15Å; A157-F213 HydrophobicContact CB-CE2 3.42Å; A157-F213 VanDerWaalsContact CB-CE2 3.42Å; A157-F213 HydrophobicContact CB-CZ 4.14Å |
| 158 | C | 91.1 | Very high | 85.2 | Confident | 9 Ų | 9 | 17.3 Ų | 17.3 | 6% | 0.061 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -62.1 | -43.2 | 174.4 | -80.1 | 0 | 0 | 0 | 0 | 112.5 | C132 L135 F154 H155 F161 A162 | C132-C158 HydrophobicContact CB-CB 4.31Å; L135-C158 HydrophobicContact CD2-CB 3.89Å; L135-C158 VanDerWaalsContact CD2-SG 3.56Å; F154-C158 PolarHBondContact O-N 3.39Å; H155-C158 WeakPolarHBondContact O-CB 3.45Å; H155-C158 PolarHBondContact O-N 3.33Å; H155-C158 VanDerWaalsContact O-N 3.15Å; C158-F161 PolarHBondContact O-N 3.44Å; C158-A162 WeakPolarHBondContact O-CB 3.11Å; C158-A162 PolarHBondContact O-N 2.81Å |
| 159 | V | 88.6 | Confident | 86.3 | Confident | 1 Ų | 1 | 17.1 Ų | 17.1 | 1% | 0.006 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -61.6 | -45.1 | 176.3 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | H155 E156 A162 S163 L389 | H155-V159 WeakPolarHBondContact O-CG2 3.41Å; H155-V159 PolarHBondContact O-N 2.88Å; E156-V159 PolarHBondContact O-N 3.33Å; V159-A162 PolarHBondContact O-N 2.99Å; V159-S163 WeakPolarHBondContact O-CB 3.28Å; V159-S163 PolarHBondContact O-N 3.46Å; V159-S163 PolarHBondContact O-OG 3.48Å; V159-L389 HydrophobicContact CG1-CD1 3.95Å; V159-L389 HydrophobicContact CG2-CD1 4.02Å; V159-L389 HydrophobicContact CG2-CD2 3.84Å |
| 160 | S | 87.6 | Confident | 87.2 | Confident | 4 Ų | 4 | 16.3 Ų | 16.3 | 3% | 0.028 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.4 | -50.6 | 176.8 | -62.3 | 0 | 0 | 0 | 0 | 110.9 | E156 A157 A162 S163 V164 | E156-S160 WeakPolarHBondContact O-CB 3.37Å; E156-S160 PolarHBondContact O-N 2.77Å; E156-S160 PolarHBondContact O-OG 2.9Å; A157-S160 PolarHBondContact O-N 3.3Å; S160-A162 PolarHBondContact O-N 2.77Å; S160-S163 PolarHBondContact O-N 3.29Å; S160-S163 PolarHBondContact O-OG 2.95Å; S160-V164 PolarHBondContact O-N 2.93Å |
| 161 | F | 91.5 | Very high | 87.7 | Confident | 29 Ų | 29 | 14.5 Ų | 14.5 | 13% | 0.127 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -55.1 | -50.3 | 174.7 | 170.5 | -94.2 | 0 | 0 | 0 | 112.5 | L124 A157 C158 S163 V164 S165 W202 F209 | L124-F161 HydrophobicContact CD1-CE1 3.81Å; L124-F161 HydrophobicContact CD1-CZ 3.92Å; A157-F161 WeakPolarHBondContact O-CB 3.25Å; A157-F161 PolarHBondContact O-N 2.89Å; C158-F161 PolarHBondContact O-N 3.44Å; F161-S163 VanDerWaalsContact C-N 3.29Å; F161-S163 PolarHBondContact O-N 2.89Å; F161-V164 PolarHBondContact O-N 3.25Å; F161-S165 WeakPolarHBondContact CD2-OG 3.33Å; F161-S165 WeakPolarHBondContact CE2-OG 3.28Å; F161-S165 WeakPolarHBondContact O-CB 3.31Å; F161-S165 PolarHBondContact O-N 3.04Å; F161-S165 PolarHBondContact O-OG 3.29Å; F161-W202 HydrophobicContact CZ-CZ3 4.07Å; F161-F209 HydrophobicContact CB-CB 4.1Å; F161-F209 HydrophobicContact CB-CD2 3.93Å; F161-F209 HydrophobicContact CD2-CB 4.42Å |
| 162 | A | 92.8 | Very high | 88.2 | Confident | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -59.7 | -43.5 | -178 | 0 | 0 | 0 | 0 | 0 | 110.8 | I128 C158 V159 S160 T166 W362 Y393 | I128-A162 HydrophobicContact CD1-CB 4.03Å; I128-A162 HydrophobicContact CG1-CB 4.06Å; C158-A162 WeakPolarHBondContact O-CB 3.11Å; C158-A162 PolarHBondContact O-N 2.81Å; V159-A162 PolarHBondContact O-N 2.99Å; S160-A162 PolarHBondContact O-N 2.77Å; A162-T166 WeakPolarHBondContact O-CB 3.35Å; A162-T166 PolarHBondContact O-N 3.49Å; A162-T166 PolarHBondContact O-OG1 3.38Å; A162-W362 HydrophobicContact CB-CH2 4.08Å; A162-Y393 HydrophobicContact CB-CE1 4.19Å |
| 163 | S | 89.6 | Confident | 88.7 | Confident | 9 Ų | 9 | 11.7 Ų | 11.7 | 6% | 0.063 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -64.8 | -51.9 | -179.6 | 74.2 | 0 | 0 | 0 | 0 | 113.2 | V159 S160 F161 T166 A167 Q253 | V159-S163 WeakPolarHBondContact O-CB 3.28Å; V159-S163 PolarHBondContact O-N 3.46Å; V159-S163 PolarHBondContact O-OG 3.48Å; S160-S163 PolarHBondContact O-N 3.29Å; S160-S163 PolarHBondContact O-OG 2.95Å; F161-S163 VanDerWaalsContact C-N 3.29Å; F161-S163 PolarHBondContact O-N 2.89Å; S163-T166 PolarHBondContact O-N 3.24Å; S163-A167 WeakPolarHBondContact O-CB 3.47Å; S163-A167 PolarHBondContact O-N 3Å; S163-Q253 PolarHBondContact OG-NE2 3.45Å |
| 164 | V | 88.3 | Confident | 89.1 | Confident | 5 Ų | 5 | 11.5 Ų | 11.5 | 3% | 0.03 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -70.5 | -44.4 | -175.5 | 173.3 | 0 | 0 | 0 | 0 | 110 | S160 F161 T166 A167 I168 S208 I256 | S160-V164 PolarHBondContact O-N 2.93Å; F161-V164 PolarHBondContact O-N 3.25Å; V164-T166 VanDerWaalsContact C-N 3.33Å; V164-T166 PolarHBondContact O-N 3.35Å; V164-A167 PolarHBondContact O-N 3.04Å; V164-I168 HydrophobicContact CG1-CD1 3.54Å; V164-I168 HydrophobicContact CG1-CG1 4.23Å; V164-I168 VanDerWaalsContact O-CG1 3.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.16Å; V164-I168 PolarHBondContact O-N 3.1Å; V164-S208 VanDerWaalsContact CG2-OG 3.22Å; V164-S208 WeakPolarHBondContact CG2-OG 3.1Å; V164-I256 HydrophobicContact CG2-CD1 4.28Å; V164-I256 HydrophobicContact CG2-CG2 4.25Å |
| 165 | S | 92.1 | Very high | 89.3 | Confident | 1 Ų | 1 | 9.4 Ų | 9.4 | 1% | 0.007 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -59.5 | -44.7 | 177.5 | -55.9 | 0 | 0 | 0 | 0 | 111.7 | L124 F161 N169 S205 | L124-S165 VanDerWaalsContact CD1-CB 3.43Å; L124-S165 VanDerWaalsContact CD2-C 3.46Å; F161-S165 WeakPolarHBondContact CD2-OG 3.33Å; F161-S165 WeakPolarHBondContact CE2-OG 3.28Å; F161-S165 WeakPolarHBondContact O-CB 3.31Å; F161-S165 PolarHBondContact O-N 3.04Å; F161-S165 PolarHBondContact O-OG 3.29Å; S165-N169 VanDerWaalsContact O-CB 3.32Å; S165-N169 WeakPolarHBondContact O-CB 3.17Å; S165-N169 PolarHBondContact O-N 2.89Å; S165-N169 PolarHBondContact O-ND2 2.83Å; S165-S205 WeakPolarHBondContact CA-OG 3.48Å; S165-S205 WeakPolarHBondContact CB-OG 3.47Å; S165-S205 WeakPolarHBondContact OG-CB 3.47Å; S165-S205 PolarHBondContact OG-OG 3.49Å |
| 166 | T | 92.8 | Very high | 89.3 | Confident | 0 Ų | 0 | 9.3 Ų | 9.3 | 0% | 0 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -65.4 | -46 | 180 | -56.1 | 0 | 0 | 0 | 0 | 110.4 | A162 S163 V164 I168 N169 V170 F358 W362 | A162-T166 WeakPolarHBondContact O-CB 3.35Å; A162-T166 PolarHBondContact O-N 3.49Å; A162-T166 PolarHBondContact O-OG1 3.38Å; S163-T166 PolarHBondContact O-N 3.24Å; V164-T166 VanDerWaalsContact C-N 3.33Å; V164-T166 PolarHBondContact O-N 3.35Å; T166-I168 PolarHBondContact O-N 3.34Å; T166-N169 PolarHBondContact O-N 3Å; T166-V170 HydrophobicContact CG2-CG2 4.37Å; T166-V170 WeakPolarHBondContact O-CB 3.15Å; T166-V170 VanDerWaalsContact O-CG2 3.27Å; T166-V170 WeakPolarHBondContact O-CG2 3.41Å; T166-V170 PolarHBondContact O-N 3.24Å; T166-F358 HydrophobicContact CG2-CD2 3.77Å; T166-F358 HydrophobicContact CG2-CE2 3.95Å; T166-W362 HydrophobicContact CG2-CZ2 4.47Å |
| 167 | A | 89.6 | Confident | 89.4 | Confident | 2 Ų | 2 | 10 Ų | 10 | 2% | 0.017 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -58.8 | -48.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S163 V164 V170 F171 T260 F358 | S163-A167 WeakPolarHBondContact O-CB 3.47Å; S163-A167 PolarHBondContact O-N 3Å; V164-A167 PolarHBondContact O-N 3.04Å; A167-V170 PolarHBondContact O-N 2.58Å; A167-F171 WeakPolarHBondContact O-CB 3.35Å; A167-F171 PolarHBondContact O-N 2.94Å; A167-T260 HydrophobicContact CB-CG2 3.77Å; A167-F358 HydrophobicContact CB-CE2 4.08Å; A167-F358 HydrophobicContact CB-CZ 3.65Å |
| 168 | I | 89.6 | Confident | 89.3 | Confident | 32 Ų | 32 | 13.1 Ų | 13.1 | 16% | 0.164 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -72.7 | -33.5 | -177.6 | -52 | 169.6 | 0 | 0 | 0 | 111.3 | V164 T166 F171 A172 I201 F204 | V164-I168 HydrophobicContact CG1-CD1 3.54Å; V164-I168 HydrophobicContact CG1-CG1 4.23Å; V164-I168 VanDerWaalsContact O-CG1 3.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.16Å; V164-I168 PolarHBondContact O-N 3.1Å; T166-I168 PolarHBondContact O-N 3.34Å; I168-F171 WeakPolarHBondContact O-CB 3.25Å; I168-F171 PolarHBondContact O-N 3.37Å; I168-A172 PolarHBondContact O-N 2.94Å; I168-I201 HydrophobicContact CB-CG2 4.39Å; I168-I201 HydrophobicContact CG2-CB 4.47Å; I168-I201 HydrophobicContact CG2-CD1 4.17Å; I168-I201 HydrophobicContact CG2-CG1 3.61Å; I168-I201 HydrophobicContact CG2-CG2 4.34Å; I168-F204 HydrophobicContact CD1-CB 4.09Å |
| 169 | N | 91.6 | Very high | 89.1 | Confident | 2 Ų | 2 | 13 Ų | 13 | 1% | 0.011 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -65 | -43.1 | 173.4 | -86.8 | -87.5 | 0 | 0 | 0 | 112.2 | N120 L121 L124 S165 T166 F171 A172 I173 I201 | N120-N169 PolarHBondContact ND2-OD1 3.42Å; L121-N169 HydrophobicContact CD1-CB 3.91Å; L124-N169 HydrophobicContact CD2-CB 4.3Å; S165-N169 VanDerWaalsContact O-CB 3.32Å; S165-N169 WeakPolarHBondContact O-CB 3.17Å; S165-N169 PolarHBondContact O-N 2.89Å; S165-N169 PolarHBondContact O-ND2 2.83Å; T166-N169 PolarHBondContact O-N 3Å; N169-F171 VanDerWaalsContact C-N 3.27Å; N169-F171 PolarHBondContact O-N 3.47Å; N169-A172 WeakPolarHBondContact O-CB 3.36Å; N169-A172 PolarHBondContact O-N 3.43Å; N169-I173 WeakPolarHBondContact O-CG1 3.21Å; N169-I173 PolarHBondContact O-N 3.34Å; N169-I201 WeakPolarHBondContact ND2-CG2 3.39Å |
| 170 | V | 89.4 | Confident | 88.9 | Confident | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -64.3 | -35.7 | 174.7 | 174.8 | 0 | 0 | 0 | 0 | 111 | T166 A167 I173 T174 M264 I354 I355 F358 | T166-V170 HydrophobicContact CG2-CG2 4.37Å; T166-V170 WeakPolarHBondContact O-CB 3.15Å; T166-V170 VanDerWaalsContact O-CG2 3.27Å; T166-V170 WeakPolarHBondContact O-CG2 3.41Å; T166-V170 PolarHBondContact O-N 3.24Å; A167-V170 PolarHBondContact O-N 2.58Å; V170-I173 PolarHBondContact O-N 3.46Å; V170-T174 PolarHBondContact O-N 2.92Å; V170-T174 PolarHBondContact O-OG1 3.1Å; V170-M264 HydrophobicContact CG1-CE 3.47Å; V170-M264 VanDerWaalsContact CG1-CE 3.47Å; V170-M264 HydrophobicContact CG1-SD 3.87Å; V170-I354 HydrophobicContact CG2-CG2 4.3Å; V170-I355 HydrophobicContact CG1-CG1 3.69Å; V170-F358 HydrophobicContact CG1-CB 4.34Å; V170-F358 HydrophobicContact CG1-CG 4.37Å; V170-F358 HydrophobicContact CG2-CB 4.26Å; V170-F358 HydrophobicContact CG2-CD2 4.19Å; V170-F358 HydrophobicContact CG2-CG 4.24Å |
| 171 | F | 87.9 | Confident | 88.5 | Confident | 45 Ų | 45 | 14.8 Ų | 14.8 | 20% | 0.197 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -64.5 | -42.3 | 171.5 | 175.2 | -122.7 | 0 | 0 | 0 | 112.6 | A167 I168 N169 I173 T174 L175 V263 | A167-F171 WeakPolarHBondContact O-CB 3.35Å; A167-F171 PolarHBondContact O-N 2.94Å; I168-F171 WeakPolarHBondContact O-CB 3.25Å; I168-F171 PolarHBondContact O-N 3.37Å; N169-F171 VanDerWaalsContact C-N 3.27Å; N169-F171 PolarHBondContact O-N 3.47Å; F171-I173 VanDerWaalsContact C-N 3.33Å; F171-I173 PolarHBondContact O-N 2.9Å; F171-T174 CarbonylContact O-C 3.6Å; F171-T174 WeakPolarHBondContact O-CA 3.46Å; F171-T174 VanDerWaalsContact O-CB 3.23Å; F171-T174 WeakPolarHBondContact O-CB 3.48Å; F171-T174 PolarHBondContact O-N 3.19Å; F171-L175 HydrophobicContact CD1-CD1 4.27Å; F171-L175 HydrophobicContact CD2-CG 4.27Å; F171-L175 HydrophobicContact CE1-CD1 3.65Å; F171-L175 HydrophobicContact CE1-CG 4.17Å; F171-L175 HydrophobicContact CE2-CD1 4.11Å; F171-L175 HydrophobicContact CE2-CD2 3.72Å; F171-L175 HydrophobicContact CE2-CG 3.69Å; F171-L175 HydrophobicContact CZ-CD1 3.57Å; F171-L175 HydrophobicContact CZ-CD2 3.72Å; F171-L175 HydrophobicContact CZ-CG 3.68Å; F171-L175 PolarHBondContact O-N 3.39Å; F171-V263 HydrophobicContact CD2-CG1 3.89Å; F171-V263 HydrophobicContact CE2-CB 4.28Å; F171-V263 HydrophobicContact CE2-CG1 3.2Å; F171-V263 HydrophobicContact CZ-CG1 3.8Å |
| 172 | A | 90 | Very high | 88 | Confident | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -61 | -41 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | I117 I168 N169 T174 L175 D176 L197 I201 | I117-A172 HydrophobicContact CG2-CB 4.07Å; I168-A172 PolarHBondContact O-N 2.94Å; N169-A172 WeakPolarHBondContact O-CB 3.36Å; N169-A172 PolarHBondContact O-N 3.43Å; A172-T174 VanDerWaalsContact C-N 3.26Å; A172-T174 PolarHBondContact O-N 2.93Å; A172-L175 PolarHBondContact O-N 3.08Å; A172-D176 PolarHBondContact O-N 3.1Å; A172-L197 HydrophobicContact CB-CD2 4.09Å; A172-I201 HydrophobicContact CB-CD1 3.77Å |
| 173 | I | 88.8 | Confident | 87.3 | Confident | 1 Ų | 1 | 19.4 Ų | 19.4 | 1% | 0.005 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -58.9 | -43.3 | 171.8 | -67 | 167.2 | 0 | 0 | 0 | 109.9 | I117 L121 N169 V170 F171 L175 D176 R177 I354 | I117-I173 HydrophobicContact CG2-CB 4.48Å; I117-I173 HydrophobicContact CG2-CG1 3.65Å; L121-I173 HydrophobicContact CB-CD1 4.42Å; L121-I173 HydrophobicContact CD2-CD1 3.75Å; L121-I173 HydrophobicContact CG-CD1 4.47Å; N169-I173 WeakPolarHBondContact O-CG1 3.21Å; N169-I173 PolarHBondContact O-N 3.34Å; V170-I173 PolarHBondContact O-N 3.46Å; F171-I173 VanDerWaalsContact C-N 3.33Å; F171-I173 PolarHBondContact O-N 2.9Å; I173-L175 PolarHBondContact O-N 3.12Å; I173-D176 PolarHBondContact O-N 3.32Å; I173-R177 HydrophobicContact CG2-CG 4.4Å; I173-R177 WeakPolarHBondContact O-CG 3.33Å; I173-R177 PolarHBondContact O-N 3.35Å; I173-I354 HydrophobicContact CD1-CG2 4.48Å |
| 174 | T | 87.1 | Confident | 86.7 | Confident | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -62.2 | -42.8 | 178.6 | -61.4 | 0 | 0 | 0 | 0 | 112.5 | V170 F171 A172 R177 Y178 T267 Y268 I355 | V170-T174 PolarHBondContact O-N 2.92Å; V170-T174 PolarHBondContact O-OG1 3.1Å; F171-T174 CarbonylContact O-C 3.6Å; F171-T174 WeakPolarHBondContact O-CA 3.46Å; F171-T174 VanDerWaalsContact O-CB 3.23Å; F171-T174 WeakPolarHBondContact O-CB 3.48Å; F171-T174 PolarHBondContact O-N 3.19Å; A172-T174 VanDerWaalsContact C-N 3.26Å; A172-T174 PolarHBondContact O-N 2.93Å; T174-R177 PolarHBondContact O-N 3.25Å; T174-Y178 WeakPolarHBondContact O-CB 3.36Å; T174-Y178 PolarHBondContact O-N 3.28Å; T174-T267 HydrophobicContact CG2-CG2 4.32Å; T174-T267 WeakPolarHBondContact CG2-OG1 3.22Å; T174-Y268 HydrophobicContact CG2-CD2 3.77Å; T174-Y268 HydrophobicContact CG2-CE2 3.46Å; T174-Y268 VanDerWaalsContact CG2-CE2 3.46Å; T174-I355 VanDerWaalsContact OG1-CD1 3.24Å; T174-I355 WeakPolarHBondContact OG1-CD1 3.33Å |
| 175 | L | 87.9 | Confident | 86.1 | Confident | 54 Ų | 54 | 26.3 Ų | 26.3 | 28% | 0.283 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -62.6 | -45 | 175.6 | -71 | 179.8 | 0 | 0 | 0 | 112.4 | F171 A172 I173 R177 Y178 D179 L197 | F171-L175 HydrophobicContact CD1-CD1 4.27Å; F171-L175 HydrophobicContact CD2-CG 4.27Å; F171-L175 HydrophobicContact CE1-CD1 3.65Å; F171-L175 HydrophobicContact CE1-CG 4.17Å; F171-L175 HydrophobicContact CE2-CD1 4.11Å; F171-L175 HydrophobicContact CE2-CD2 3.72Å; F171-L175 HydrophobicContact CE2-CG 3.69Å; F171-L175 HydrophobicContact CZ-CD1 3.57Å; F171-L175 HydrophobicContact CZ-CD2 3.72Å; F171-L175 HydrophobicContact CZ-CG 3.68Å; F171-L175 PolarHBondContact O-N 3.39Å; A172-L175 PolarHBondContact O-N 3.08Å; I173-L175 PolarHBondContact O-N 3.12Å; L175-R177 VanDerWaalsContact C-N 3.26Å; L175-R177 PolarHBondContact O-N 2.93Å; L175-Y178 PolarHBondContact O-N 3.47Å; L175-D179 WeakPolarHBondContact O-CB 3.43Å; L175-D179 PolarHBondContact O-N 3.49Å; L175-L197 HydrophobicContact CD1-CD2 4.48Å |
| 176 | D | 88.5 | Confident | 85.7 | Confident | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -58.2 | -40.2 | 174.6 | 173.3 | 64.5 | 0 | 0 | 0 | 111.4 | S114 I117 A172 I173 D179 I180 R187 L189 | S114-D176 WeakPolarHBondContact CA-OD2 3.32Å; S114-D176 WeakPolarHBondContact CB-OD2 3.43Å; S114-D176 PolarHBondContact OG-OD1 2.64Å; S114-D176 PolarHBondContact OG-OD2 2.84Å; I117-D176 HydrophobicContact CD1-CB 3.81Å; A172-D176 PolarHBondContact O-N 3.1Å; I173-D176 PolarHBondContact O-N 3.32Å; D176-D179 PolarHBondContact O-N 3.49Å; D176-I180 WeakPolarHBondContact O-CD1 3.46Å; D176-I180 WeakPolarHBondContact O-CG1 3.23Å; D176-I180 PolarHBondContact O-N 3.15Å; D176-I180 VanDerWaalsContact O-N 3.1Å; D176-R187 IonicContact OD1-NH2 3.8Å; D176-L189 HydrophobicContact CB-CD2 3.84Å |
| 177 | R | 85.8 | Confident | 85.2 | Confident | 16 Ų | 16 | 37.4 Ų | 37.4 | 6% | 0.06 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -70.8 | -37.7 | 178.9 | -63.6 | -71.6 | 160.3 | -103.8 | -15.4 | 112.6 | I173 T174 L175 S181 I271 S351 | I173-R177 HydrophobicContact CG2-CG 4.4Å; I173-R177 WeakPolarHBondContact O-CG 3.33Å; I173-R177 PolarHBondContact O-N 3.35Å; T174-R177 PolarHBondContact O-N 3.25Å; L175-R177 VanDerWaalsContact C-N 3.26Å; L175-R177 PolarHBondContact O-N 2.93Å; R177-S181 WeakPolarHBondContact O-CB 3.39Å; R177-S181 PolarHBondContact O-N 2.91Å; R177-S181 PolarHBondContact O-OG 3.49Å; R177-I271 HydrophobicContact CB-CD1 4.25Å; R177-S351 WeakPolarHBondContact CD-OG 3.21Å; R177-S351 VanDerWaalsContact CG-OG 3.31Å; R177-S351 WeakPolarHBondContact CG-OG 3.26Å; R177-S351 PolarHBondContact NE-OG 3.36Å |
| 178 | Y | 85.5 | Confident | 84.9 | Confident | 65 Ų | 65 | 41.4 Ų | 41.4 | 26% | 0.255 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61.9 | -48.3 | 173.8 | -179.4 | -95 | 0 | 0 | 0 | 110.9 | T174 L175 I180 S181 V182 K270 I271 | T174-Y178 WeakPolarHBondContact O-CB 3.36Å; T174-Y178 PolarHBondContact O-N 3.28Å; L175-Y178 PolarHBondContact O-N 3.47Å; Y178-I180 PolarHBondContact O-N 2.76Å; Y178-S181 PolarHBondContact O-N 3.14Å; Y178-V182 HydrophobicContact CD2-CB 4.27Å; Y178-V182 HydrophobicContact CD2-CG2 3.63Å; Y178-V182 HydrophobicContact CE1-CB 4.49Å; Y178-V182 HydrophobicContact CE2-CB 4.02Å; Y178-V182 HydrophobicContact CE2-CG1 4.13Å; Y178-V182 HydrophobicContact CE2-CG2 3.6Å; Y178-V182 HydrophobicContact CG-CG2 4.26Å; Y178-V182 WeakPolarHBondContact O-CB 3.49Å; Y178-V182 PolarHBondContact O-N 2.98Å; Y178-K270 HydrophobicContact CD2-CB 4.46Å; Y178-K270 HydrophobicContact CE2-CB 3.84Å; Y178-I271 HydrophobicContact CD2-CG1 4.02Å |
| 179 | D | 86.1 | Confident | 84.6 | Confident | 7 Ų | 7 | 41 Ų | 41 | 4% | 0.037 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -57.3 | -49.7 | 178.4 | -171.2 | 64.3 | 0 | 0 | 0 | 111.9 | L175 D176 S181 K183 R187 I188 L189 | L175-D179 WeakPolarHBondContact O-CB 3.43Å; L175-D179 PolarHBondContact O-N 3.49Å; D176-D179 PolarHBondContact O-N 3.49Å; D179-S181 PolarHBondContact O-N 3.43Å; D179-K183 CarbonylContact O-C 3.58Å; D179-K183 PolarHBondContact O-N 3.21Å; D179-R187 WeakPolarHBondContact OD1-CA 3.13Å; D179-R187 VanDerWaalsContact OD2-CB 3.26Å; D179-R187 WeakPolarHBondContact OD2-CB 3.48Å; D179-R187 WeakPolarHBondContact OD2-CG 3.26Å; D179-R187 IonicContact OD2-CZ 3.24Å; D179-R187 IonicContact OD2-NE 2.94Å; D179-R187 PolarHBondContact OD2-NE 3.22Å; D179-R187 IonicContact OD2-NH2 3.83Å; D179-I188 PolarHBondContact OD1-N 3.12Å; D179-L189 HydrophobicContact CB-CB 4.47Å |
| 180 | I | 84.1 | Confident | 84.5 | Confident | 33 Ų | 33 | 44.2 Ų | 44.2 | 17% | 0.169 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.7 | -39.1 | -179.4 | -68.9 | 166 | 0 | 0 | 0 | 112.5 | S114 D176 Y178 | S114-I180 VanDerWaalsContact OG-CD1 3.31Å; S114-I180 WeakPolarHBondContact OG-CD1 3.23Å; D176-I180 WeakPolarHBondContact O-CD1 3.46Å; D176-I180 WeakPolarHBondContact O-CG1 3.23Å; D176-I180 PolarHBondContact O-N 3.15Å; D176-I180 VanDerWaalsContact O-N 3.1Å; Y178-I180 PolarHBondContact O-N 2.76Å |
| 181 | S | 80.5 | Confident | 84.4 | Confident | 9 Ų | 9 | 47.5 Ų | 47.5 | 6% | 0.063 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -84.7 | -48 | -171.3 | -57.3 | 0 | 0 | 0 | 0 | 111.9 | R177 Y178 D179 R278 | R177-S181 WeakPolarHBondContact O-CB 3.39Å; R177-S181 PolarHBondContact O-N 2.91Å; R177-S181 PolarHBondContact O-OG 3.49Å; Y178-S181 PolarHBondContact O-N 3.14Å; D179-S181 PolarHBondContact O-N 3.43Å; S181-R278 PolarHBondContact O-NH2 3.21Å |
| 182 | V | 80.7 | Confident | 84.4 | Confident | 42 Ų | 42 | 47.9 Ų | 47.9 | 26% | 0.255 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -88 | -42.1 | -171.4 | -174.7 | 0 | 0 | 0 | 0 | 111.4 | Y178 P184 I271 A274 | Y178-V182 HydrophobicContact CD2-CB 4.27Å; Y178-V182 HydrophobicContact CD2-CG2 3.63Å; Y178-V182 HydrophobicContact CE1-CB 4.49Å; Y178-V182 HydrophobicContact CE2-CB 4.02Å; Y178-V182 HydrophobicContact CE2-CG1 4.13Å; Y178-V182 HydrophobicContact CE2-CG2 3.6Å; Y178-V182 HydrophobicContact CG-CG2 4.26Å; Y178-V182 WeakPolarHBondContact O-CB 3.49Å; Y178-V182 PolarHBondContact O-N 2.98Å; V182-P184 VanDerWaalsContact O-CD 3.26Å; V182-P184 WeakPolarHBondContact O-CD 3.33Å; V182-I271 HydrophobicContact CG2-CG1 4.14Å; V182-A274 HydrophobicContact CB-CB 4.38Å; V182-A274 HydrophobicContact CG1-CB 4.4Å; V182-A274 HydrophobicContact CG2-CB 3.8Å |
| 183 | K | 78.5 | Confident | 84.5 | Confident | 85 Ų | 85 | 54.7 Ų | 54.7 | 37% | 0.37 | 29% | 0.294 | S | S | . | . | trans | -119.9 | 57.7 | -174.5 | -62.4 | -175.4 | 179.6 | -178.3 | 0 | 113.1 | D179 A185 N186 I188 | D179-K183 CarbonylContact O-C 3.58Å; D179-K183 PolarHBondContact O-N 3.21Å; K183-A185 PolarHBondContact O-N 3.42Å; K183-A185 VanDerWaalsContact O-N 3.13Å; K183-N186 CarbonylContact O-C 3.45Å; K183-N186 PolarHBondContact O-N 3.16Å; K183-I188 HydrophobicContact CD-CD1 4.07Å | ||
| 184 | P | 76.3 | Confident | 84.5 | Confident | 68 Ų | 68 | 54.7 Ų | 54.7 | 44% | 0.442 | 30% | 0.295 | S | S | . | . | S | Bend | trans | -64.7 | -23.8 | -173.8 | 30.6 | -39.8 | 0 | 0 | 0 | 114.7 | V182 | V182-P184 VanDerWaalsContact O-CD 3.26Å; V182-P184 WeakPolarHBondContact O-CD 3.33Å |
| 185 | A | 76.5 | Confident | 84.6 | Confident | 91 Ų | 91 | 58 Ų | 58 | 75% | 0.752 | 32% | 0.315 | S | S | * | . | S | Bend | trans | -90.8 | -26.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | K183 | K183-A185 PolarHBondContact O-N 3.42Å; K183-A185 VanDerWaalsContact O-N 3.13Å |
| 186 | N | 82.7 | Confident | 84.8 | Confident | 126 Ų | 126 | 62 Ų | 62 | 67% | 0.674 | 33% | 0.333 | S | S | * | . | S | Bend | trans | -122.6 | 61.8 | -175.3 | -63.6 | -15.6 | 0 | 0 | 0 | 108.8 | K183 I188 | K183-N186 CarbonylContact O-C 3.45Å; K183-N186 PolarHBondContact O-N 3.16Å; N186-I188 PolarHBondContact O-N 3.44Å |
| 187 | R | 81.6 | Confident | 84.9 | Confident | 108 Ų | 108 | 63.9 Ų | 63.9 | 41% | 0.408 | 34% | 0.343 | S | S | . | . | trans | -66.6 | 120.3 | -178.9 | -69.5 | -168.3 | 72 | -172.5 | 4 | 110.1 | D176 D179 | D176-R187 IonicContact OD1-NH2 3.8Å; D179-R187 WeakPolarHBondContact OD1-CA 3.13Å; D179-R187 VanDerWaalsContact OD2-CB 3.26Å; D179-R187 WeakPolarHBondContact OD2-CB 3.48Å; D179-R187 WeakPolarHBondContact OD2-CG 3.26Å; D179-R187 IonicContact OD2-CZ 3.24Å; D179-R187 IonicContact OD2-NE 2.94Å; D179-R187 PolarHBondContact OD2-NE 3.22Å; D179-R187 IonicContact OD2-NH2 3.83Å | ||
| 188 | I | 83 | Confident | 85.1 | Confident | 85 Ų | 85 | 63.7 Ų | 63.7 | 44% | 0.436 | 34% | 0.343 | S | S | . | . | trans | -88.2 | -34.4 | -177 | -60.6 | 174.4 | 0 | 0 | 0 | 110.4 | D179 K183 N186 T190 R193 | D179-I188 PolarHBondContact OD1-N 3.12Å; K183-I188 HydrophobicContact CD-CD1 4.07Å; N186-I188 PolarHBondContact O-N 3.44Å; I188-T190 PolarHBondContact O-N 3.49Å; I188-T190 VanDerWaalsContact O-N 3.07Å; I188-R193 WeakPolarHBondContact O-CD 3.36Å; I188-R193 PolarHBondContact O-NH1 3.42Å | ||
| 189 | L | 85.2 | Confident | 85.4 | Confident | 24 Ų | 24 | 64.1 Ų | 64.1 | 13% | 0.126 | 35% | 0.353 | C | S | . | . | trans | -83.9 | 81.6 | -176.9 | -164.3 | 66.6 | 0 | 0 | 0 | 110.2 | V113 I117 D176 D179 A194 L197 | V113-L189 HydrophobicContact CG1-CD2 3.72Å; V113-L189 HydrophobicContact CG1-CG 3.83Å; I117-L189 HydrophobicContact CD1-CD2 3.69Å; D176-L189 HydrophobicContact CB-CD2 3.84Å; D179-L189 HydrophobicContact CB-CB 4.47Å; L189-A194 HydrophobicContact CD1-CB 4.27Å; L189-A194 HydrophobicContact CG-CB 4.26Å; L189-L197 HydrophobicContact CD1-CD2 4.23Å | ||
| 190 | T | 88.8 | Confident | 85.7 | Confident | 69 Ų | 69 | 65.7 Ų | 65.7 | 42% | 0.423 | 36% | 0.364 | S | S | . | . | trans | -77.6 | 167.7 | 172.5 | 62.3 | 0 | 0 | 0 | 0 | 111 | I188 G192 R193 A194 | I188-T190 PolarHBondContact O-N 3.49Å; I188-T190 VanDerWaalsContact O-N 3.07Å; T190-G192 PolarHBondContact O-N 2.99Å; T190-R193 PolarHBondContact O-N 3.43Å; T190-R193 WeakPolarHBondContact OG1-CG 3.06Å; T190-A194 WeakPolarHBondContact O-CB 3.39Å; T190-A194 PolarHBondContact O-N 3.5Å | ||
| 191 | M | 86.9 | Confident | 86 | Confident | 70 Ų | 70 | 64.2 Ų | 64.2 | 35% | 0.345 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -58.5 | -48.1 | -179 | -168.6 | 62.5 | 99 | 0 | 0 | 112.8 | V113 I116 R193 A194 V195 | V113-M191 HydrophobicContact CG2-CB 4.4Å; V113-M191 HydrophobicContact CG2-SD 4.03Å; I116-M191 HydrophobicContact CD1-CE 3.61Å; I116-M191 HydrophobicContact CD1-SD 3.42Å; I116-M191 WeakPolarHBondContact CD1-SD 3.5Å; I116-M191 HydrophobicContact CG1-CE 4.47Å; I116-M191 HydrophobicContact CG1-SD 4.49Å; M191-R193 VanDerWaalsContact C-N 3.35Å; M191-R193 PolarHBondContact O-N 3.41Å; M191-A194 WeakPolarHBondContact O-CB 3.12Å; M191-A194 PolarHBondContact O-N 3.12Å; M191-V195 WeakPolarHBondContact O-CG2 3.33Å; M191-V195 PolarHBondContact O-N 3.07Å |
| 192 | G | 88.8 | Confident | 86.7 | Confident | 53 Ų | 53 | 67.4 Ų | 67.4 | 55% | 0.546 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.3 | -41.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | T190 V195 M196 | T190-G192 PolarHBondContact O-N 2.99Å; G192-V195 PolarHBondContact O-N 3.34Å; G192-M196 WeakPolarHBondContact O-CB 3.01Å; G192-M196 PolarHBondContact O-N 3.49Å |
| 193 | R | 91 | Very high | 87.3 | Confident | 142 Ų | 142 | 69.4 Ų | 69.4 | 54% | 0.536 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -67.4 | -35.9 | 175.6 | -71.8 | 177.2 | 175.5 | 175 | -1.7 | 112.4 | I188 T190 M191 L197 | I188-R193 WeakPolarHBondContact O-CD 3.36Å; I188-R193 PolarHBondContact O-NH1 3.42Å; T190-R193 PolarHBondContact O-N 3.43Å; T190-R193 WeakPolarHBondContact OG1-CG 3.06Å; M191-R193 VanDerWaalsContact C-N 3.35Å; M191-R193 PolarHBondContact O-N 3.41Å; R193-L197 VanDerWaalsContact O-CB 3.32Å; R193-L197 WeakPolarHBondContact O-CB 3.19Å; R193-L197 PolarHBondContact O-N 3.44Å |
| 194 | A | 89.1 | Confident | 87.8 | Confident | 1 Ų | 1 | 71.6 Ų | 71.6 | 1% | 0.008 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -66.3 | -44.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | V113 L189 T190 M191 L197 M198 | V113-A194 HydrophobicContact CB-CB 4.47Å; V113-A194 HydrophobicContact CG1-CB 3.64Å; V113-A194 HydrophobicContact CG2-CB 4.3Å; L189-A194 HydrophobicContact CD1-CB 4.27Å; L189-A194 HydrophobicContact CG-CB 4.26Å; T190-A194 WeakPolarHBondContact O-CB 3.39Å; T190-A194 PolarHBondContact O-N 3.5Å; M191-A194 WeakPolarHBondContact O-CB 3.12Å; M191-A194 PolarHBondContact O-N 3.12Å; A194-L197 WeakPolarHBondContact O-CB 3.13Å; A194-L197 PolarHBondContact O-N 3.04Å; A194-M198 VanDerWaalsContact O-CG 3.27Å; A194-M198 WeakPolarHBondContact O-CG 3.24Å; A194-M198 PolarHBondContact O-N 2.9Å |
| 195 | V | 89.6 | Confident | 88.6 | Confident | 70 Ų | 70 | 68.4 Ų | 68.4 | 42% | 0.424 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -61.9 | -46.3 | 175.5 | 173.5 | 0 | 0 | 0 | 0 | 110.8 | M191 G192 L197 M198 T199 | M191-V195 WeakPolarHBondContact O-CG2 3.33Å; M191-V195 PolarHBondContact O-N 3.07Å; G192-V195 PolarHBondContact O-N 3.34Å; V195-L197 VanDerWaalsContact C-N 3.31Å; V195-L197 PolarHBondContact O-N 2.92Å; V195-M198 WeakPolarHBondContact O-CB 3.3Å; V195-M198 PolarHBondContact O-N 2.85Å; V195-T199 PolarHBondContact O-N 3.31Å; V195-T199 PolarHBondContact O-OG1 3.16Å; V195-T199 VanDerWaalsContact O-OG1 3.13Å |
| 196 | M | 91.2 | Very high | 89.3 | Confident | 137 Ų | 137 | 69.5 Ų | 69.5 | 68% | 0.675 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -58.4 | -41.9 | 175.2 | -175.8 | -171.1 | -65.2 | 0 | 0 | 112.3 | G192 T199 S200 | G192-M196 WeakPolarHBondContact O-CB 3.01Å; G192-M196 PolarHBondContact O-N 3.49Å; M196-T199 PolarHBondContact O-N 3Å; M196-S200 PolarHBondContact O-N 3Å |
| 197 | L | 90.8 | Very high | 89.6 | Confident | 40 Ų | 40 | 69.3 Ų | 69.3 | 21% | 0.209 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -61 | -43.3 | 173.1 | 177.4 | 66.4 | 0 | 0 | 0 | 111 | A172 L175 L189 R193 A194 V195 S200 I201 | A172-L197 HydrophobicContact CB-CD2 4.09Å; L175-L197 HydrophobicContact CD1-CD2 4.48Å; L189-L197 HydrophobicContact CD1-CD2 4.23Å; R193-L197 VanDerWaalsContact O-CB 3.32Å; R193-L197 WeakPolarHBondContact O-CB 3.19Å; R193-L197 PolarHBondContact O-N 3.44Å; A194-L197 WeakPolarHBondContact O-CB 3.13Å; A194-L197 PolarHBondContact O-N 3.04Å; V195-L197 VanDerWaalsContact C-N 3.31Å; V195-L197 PolarHBondContact O-N 2.92Å; L197-S200 PolarHBondContact O-N 3.28Å; L197-S200 PolarHBondContact O-OG 3.33Å; L197-I201 HydrophobicContact CD1-CD1 4.37Å; L197-I201 HydrophobicContact CG-CD1 4.03Å; L197-I201 WeakPolarHBondContact O-CD1 3.31Å; L197-I201 WeakPolarHBondContact O-CG1 3.31Å; L197-I201 PolarHBondContact O-N 3.12Å |
| 198 | M | 90.4 | Very high | 89.9 | Confident | 12 Ų | 12 | 64.6 Ų | 64.6 | 6% | 0.059 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 177.4 | -60.8 | -40.4 | -55.7 | 0 | 0 | 111.7 | I117 N120 A194 V195 S200 I201 W202 | I117-M198 HydrophobicContact CG1-SD 4.03Å; N120-M198 HydrophobicContact CB-CE 3.37Å; N120-M198 WeakPolarHBondContact ND2-CE 3.4Å; A194-M198 VanDerWaalsContact O-CG 3.27Å; A194-M198 WeakPolarHBondContact O-CG 3.24Å; A194-M198 PolarHBondContact O-N 2.9Å; V195-M198 WeakPolarHBondContact O-CB 3.3Å; V195-M198 PolarHBondContact O-N 2.85Å; M198-S200 VanDerWaalsContact C-N 3.31Å; M198-S200 PolarHBondContact O-N 3.28Å; M198-I201 HydrophobicContact CE-CD1 3.88Å; M198-I201 WeakPolarHBondContact O-CB 3.19Å; M198-I201 PolarHBondContact O-N 3.37Å; M198-I201 HydrophobicContact SD-CD1 3.99Å; M198-W202 PolarHBondContact O-N 3.29Å; M198-W202 VanDerWaalsContact O-N 3.1Å |
| 199 | T | 91.3 | Very high | 90.2 | Very high | 75 Ų | 75 | 62.5 Ų | 62.5 | 46% | 0.46 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.5 | -43.3 | 176.2 | -54.6 | 0 | 0 | 0 | 0 | 111.3 | V195 M196 I201 W202 I203 | V195-T199 PolarHBondContact O-N 3.31Å; V195-T199 PolarHBondContact O-OG1 3.16Å; V195-T199 VanDerWaalsContact O-OG1 3.13Å; M196-T199 PolarHBondContact O-N 3Å; T199-I201 VanDerWaalsContact C-N 3.34Å; T199-I201 PolarHBondContact O-N 2.96Å; T199-W202 PolarHBondContact O-N 3.12Å; T199-I203 HydrophobicContact CG2-CD1 4.07Å; T199-I203 WeakPolarHBondContact O-CG1 3.17Å; T199-I203 PolarHBondContact O-N 2.86Å; T199-I203 VanDerWaalsContact O-N 3.11Å |
| 200 | S | 92.1 | Very high | 90.3 | Very high | 39 Ų | 39 | 63.2 Ų | 63.2 | 27% | 0.273 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -65.4 | -37.9 | 176.9 | 71.5 | 0 | 0 | 0 | 0 | 112.2 | M196 L197 M198 W202 I203 F204 | M196-S200 PolarHBondContact O-N 3Å; L197-S200 PolarHBondContact O-N 3.28Å; L197-S200 PolarHBondContact O-OG 3.33Å; M198-S200 VanDerWaalsContact C-N 3.31Å; M198-S200 PolarHBondContact O-N 3.28Å; S200-W202 PolarHBondContact O-N 2.94Å; S200-I203 PolarHBondContact O-N 2.69Å; S200-F204 WeakPolarHBondContact O-CD2 3.5Å; S200-F204 PolarHBondContact O-N 3.41Å |
| 201 | I | 91.9 | Very high | 90 | Very high | 2 Ų | 2 | 61.8 Ų | 61.8 | 1% | 0.01 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -55.9 | -50.5 | 174.5 | -69.3 | 168 | 0 | 0 | 0 | 110.7 | I168 N169 A172 L197 M198 T199 I203 F204 S205 | I168-I201 HydrophobicContact CB-CG2 4.39Å; I168-I201 HydrophobicContact CG2-CB 4.47Å; I168-I201 HydrophobicContact CG2-CD1 4.17Å; I168-I201 HydrophobicContact CG2-CG1 3.61Å; I168-I201 HydrophobicContact CG2-CG2 4.34Å; N169-I201 WeakPolarHBondContact ND2-CG2 3.39Å; A172-I201 HydrophobicContact CB-CD1 3.77Å; L197-I201 HydrophobicContact CD1-CD1 4.37Å; L197-I201 HydrophobicContact CG-CD1 4.03Å; L197-I201 WeakPolarHBondContact O-CD1 3.31Å; L197-I201 WeakPolarHBondContact O-CG1 3.31Å; L197-I201 PolarHBondContact O-N 3.12Å; M198-I201 HydrophobicContact CE-CD1 3.88Å; M198-I201 WeakPolarHBondContact O-CB 3.19Å; M198-I201 PolarHBondContact O-N 3.37Å; M198-I201 HydrophobicContact SD-CD1 3.99Å; T199-I201 VanDerWaalsContact C-N 3.34Å; T199-I201 PolarHBondContact O-N 2.96Å; I201-I203 VanDerWaalsContact C-N 3.31Å; I201-I203 PolarHBondContact O-N 3.44Å; I201-F204 PolarHBondContact O-N 3.01Å; I201-S205 WeakPolarHBondContact O-CB 3.44Å; I201-S205 PolarHBondContact O-N 2.83Å; I201-S205 PolarHBondContact O-OG 2.84Å; I201-S205 VanDerWaalsContact O-OG 3.05Å |
| 202 | W | 94.7 | Very high | 89.6 | Confident | 77 Ų | 77 | 58.7 Ų | 58.7 | 29% | 0.292 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.2 | -38.3 | 179.3 | -73.3 | 108.2 | 0 | 0 | 0 | 112.8 | N120 V123 L127 F161 M198 T199 S200 S205 F206 | N120-W202 WeakPolarHBondContact OD1-CZ2 3.34Å; N120-W202 PolarHBondContact OD1-NE1 3.43Å; V123-W202 HydrophobicContact CG1-CH2 4.22Å; V123-W202 HydrophobicContact CG1-CZ2 4.14Å; L127-W202 HydrophobicContact CD1-CH2 3.47Å; L127-W202 VanDerWaalsContact CD1-CH2 3.47Å; L127-W202 HydrophobicContact CD1-CZ3 3.55Å; F161-W202 HydrophobicContact CZ-CZ3 4.07Å; M198-W202 PolarHBondContact O-N 3.29Å; M198-W202 VanDerWaalsContact O-N 3.1Å; T199-W202 PolarHBondContact O-N 3.12Å; S200-W202 PolarHBondContact O-N 2.94Å; W202-S205 PolarHBondContact O-N 3.12Å; W202-F206 WeakPolarHBondContact O-CB 3.15Å; W202-F206 PolarHBondContact O-N 2.97Å |
| 203 | I | 93.6 | Very high | 89.2 | Confident | 84 Ų | 84 | 57.2 Ų | 57.2 | 43% | 0.431 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63.4 | -49.4 | 175.7 | -68.6 | 167.3 | 0 | 0 | 0 | 110.7 | T199 S200 I201 S205 F206 F207 | T199-I203 HydrophobicContact CG2-CD1 4.07Å; T199-I203 WeakPolarHBondContact O-CG1 3.17Å; T199-I203 PolarHBondContact O-N 2.86Å; T199-I203 VanDerWaalsContact O-N 3.11Å; S200-I203 PolarHBondContact O-N 2.69Å; I201-I203 VanDerWaalsContact C-N 3.31Å; I201-I203 PolarHBondContact O-N 3.44Å; I203-S205 VanDerWaalsContact C-N 3.33Å; I203-S205 PolarHBondContact O-N 3.19Å; I203-F206 PolarHBondContact O-N 2.87Å; I203-F207 HydrophobicContact CG2-CD2 3.68Å; I203-F207 HydrophobicContact CG2-CE2 3.36Å; I203-F207 WeakPolarHBondContact O-CD2 3.04Å; I203-F207 PolarHBondContact O-N 3.28Å |
| 204 | F | 89.1 | Confident | 88.5 | Confident | 131 Ų | 131 | 55.5 Ų | 55.5 | 58% | 0.575 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -61.9 | -40.7 | 177.5 | -85 | -71.5 | 0 | 0 | 0 | 112.4 | I168 S200 I201 F207 S208 | I168-F204 HydrophobicContact CD1-CB 4.09Å; S200-F204 WeakPolarHBondContact O-CD2 3.5Å; S200-F204 PolarHBondContact O-N 3.41Å; I201-F204 PolarHBondContact O-N 3.01Å; F204-F207 PolarHBondContact O-N 3.41Å; F204-S208 PolarHBondContact O-N 2.79Å |
| 205 | S | 92.3 | Very high | 87.6 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60 | -44.5 | 174.1 | -72.8 | 0 | 0 | 0 | 0 | 112.5 | S165 I201 W202 I203 S208 F209 | S165-S205 WeakPolarHBondContact CA-OG 3.48Å; S165-S205 WeakPolarHBondContact CB-OG 3.47Å; S165-S205 WeakPolarHBondContact OG-CB 3.47Å; S165-S205 PolarHBondContact OG-OG 3.49Å; I201-S205 WeakPolarHBondContact O-CB 3.44Å; I201-S205 PolarHBondContact O-N 2.83Å; I201-S205 PolarHBondContact O-OG 2.84Å; I201-S205 VanDerWaalsContact O-OG 3.05Å; W202-S205 PolarHBondContact O-N 3.12Å; I203-S205 VanDerWaalsContact C-N 3.33Å; I203-S205 PolarHBondContact O-N 3.19Å; S205-S208 WeakPolarHBondContact O-CB 3.23Å; S205-S208 PolarHBondContact O-N 3.22Å; S205-F209 PolarHBondContact O-N 3.39Å |
| 206 | F | 91.4 | Very high | 86.4 | Confident | 114 Ų | 114 | 57.4 Ų | 57.4 | 50% | 0.5 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.7 | -42.9 | 176.8 | 178.2 | -105.4 | 0 | 0 | 0 | 111.7 | W202 I203 S208 F209 L210 | W202-F206 WeakPolarHBondContact O-CB 3.15Å; W202-F206 PolarHBondContact O-N 2.97Å; I203-F206 PolarHBondContact O-N 2.87Å; F206-S208 VanDerWaalsContact C-N 3.28Å; F206-S208 PolarHBondContact O-N 3.15Å; F206-F209 VanDerWaalsContact O-CB 3.28Å; F206-F209 WeakPolarHBondContact O-CB 3.46Å; F206-F209 PolarHBondContact O-N 3.02Å; F206-L210 HydrophobicContact CD1-CD1 4.11Å; F206-L210 HydrophobicContact CE1-CD1 3.54Å; F206-L210 HydrophobicContact CE1-CD2 4.47Å; F206-L210 HydrophobicContact CE1-CG 4.11Å; F206-L210 HydrophobicContact CE2-CD2 4.38Å; F206-L210 HydrophobicContact CZ-CD1 3.93Å; F206-L210 HydrophobicContact CZ-CD2 4.02Å; F206-L210 HydrophobicContact CZ-CG 4.14Å; F206-L210 PolarHBondContact O-N 2.98Å; F206-L210 VanDerWaalsContact O-N 3.16Å |
| 207 | F | 89.1 | Confident | 85.2 | Confident | 122 Ų | 122 | 55.9 Ų | 55.9 | 54% | 0.535 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -59.8 | -40.8 | 173.4 | -77.9 | -61.6 | 0 | 0 | 0 | 112.1 | I203 F204 F209 L210 I211 | I203-F207 HydrophobicContact CG2-CD2 3.68Å; I203-F207 HydrophobicContact CG2-CE2 3.36Å; I203-F207 WeakPolarHBondContact O-CD2 3.04Å; I203-F207 PolarHBondContact O-N 3.28Å; F204-F207 PolarHBondContact O-N 3.41Å; F207-F209 PolarHBondContact O-N 3.48Å; F207-L210 HydrophobicContact CD1-CD1 4.47Å; F207-L210 PolarHBondContact O-N 2.88Å; F207-L210 VanDerWaalsContact O-N 3.09Å; F207-I211 WeakPolarHBondContact O-CG1 3.43Å; F207-I211 PolarHBondContact O-N 3.44Å |
| 208 | S | 87.3 | Confident | 83.9 | Confident | 10 Ų | 10 | 58.5 Ų | 58.5 | 7% | 0.07 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -62 | -31.8 | 174.9 | -176.3 | 0 | 0 | 0 | 0 | 113.2 | V164 F204 S205 F206 L210 | V164-S208 VanDerWaalsContact CG2-OG 3.22Å; V164-S208 WeakPolarHBondContact CG2-OG 3.1Å; F204-S208 PolarHBondContact O-N 2.79Å; S205-S208 WeakPolarHBondContact O-CB 3.23Å; S205-S208 PolarHBondContact O-N 3.22Å; F206-S208 VanDerWaalsContact C-N 3.28Å; F206-S208 PolarHBondContact O-N 3.15Å; S208-L210 VanDerWaalsContact C-N 3.34Å |
| 209 | F | 89.6 | Confident | 82.5 | Confident | 40 Ų | 40 | 64.2 Ų | 64.2 | 18% | 0.175 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -67.8 | -34.7 | 174.4 | -179.6 | -92.6 | 0 | 0 | 0 | 111.8 | F154 A157 F161 S205 F206 F207 I211 P212 F213 | F154-F209 AromaticContact CD2-CZ 3.95Å; F154-F209 HydrophobicContact CD2-CZ 3.95Å; F154-F209 HydrophobicContact CE2-CE1 4.45Å; F154-F209 HydrophobicContact CE2-CE2 4.41Å; F154-F209 AromaticContact CE2-CZ 3.57Å; F154-F209 HydrophobicContact CE2-CZ 3.57Å; F154-F209 HydrophobicContact CZ-CZ 4.03Å; A157-F209 VanDerWaalsContact C-CD2 3.49Å; A157-F209 HydrophobicContact CB-CD1 4.44Å; A157-F209 HydrophobicContact CB-CD2 3.71Å; A157-F209 HydrophobicContact CB-CE1 4.3Å; A157-F209 HydrophobicContact CB-CE2 3.53Å; A157-F209 HydrophobicContact CB-CG 4.16Å; A157-F209 HydrophobicContact CB-CZ 3.85Å; A157-F209 VanDerWaalsContact CB-O 3.22Å; A157-F209 WeakPolarHBondContact CB-O 3.42Å; A157-F209 WeakPolarHBondContact O-CD2 3.46Å; F161-F209 HydrophobicContact CB-CB 4.1Å; F161-F209 HydrophobicContact CB-CD2 3.93Å; F161-F209 HydrophobicContact CD2-CB 4.42Å; S205-F209 PolarHBondContact O-N 3.39Å; F206-F209 VanDerWaalsContact O-CB 3.28Å; F206-F209 WeakPolarHBondContact O-CB 3.46Å; F206-F209 PolarHBondContact O-N 3.02Å; F207-F209 PolarHBondContact O-N 3.48Å; F209-I211 VanDerWaalsContact C-N 3.33Å; F209-I211 PolarHBondContact O-N 3.03Å; F209-P212 WeakPolarHBondContact O-CD 3.31Å; F209-F213 HydrophobicContact CD1-CE2 4.21Å; F209-F213 HydrophobicContact CE1-CD2 4.41Å; F209-F213 AromaticContact CE1-CE2 3.6Å; F209-F213 HydrophobicContact CE1-CE2 3.6Å; F209-F213 HydrophobicContact CE1-CZ 4.34Å; F209-F213 AromaticContact CZ-CE2 3.9Å; F209-F213 HydrophobicContact CZ-CE2 3.9Å; F209-F213 HydrophobicContact CZ-CZ 4.39Å |
| 210 | L | 87.4 | Confident | 80.8 | Confident | 40 Ų | 40 | 63.2 Ų | 63.2 | 21% | 0.209 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -74.9 | -20.2 | -178.4 | -64.9 | -179.4 | 0 | 0 | 0 | 114 | F206 F207 S208 F213 I214 | F206-L210 HydrophobicContact CD1-CD1 4.11Å; F206-L210 HydrophobicContact CE1-CD1 3.54Å; F206-L210 HydrophobicContact CE1-CD2 4.47Å; F206-L210 HydrophobicContact CE1-CG 4.11Å; F206-L210 HydrophobicContact CE2-CD2 4.38Å; F206-L210 HydrophobicContact CZ-CD1 3.93Å; F206-L210 HydrophobicContact CZ-CD2 4.02Å; F206-L210 HydrophobicContact CZ-CG 4.14Å; F206-L210 PolarHBondContact O-N 2.98Å; F206-L210 VanDerWaalsContact O-N 3.16Å; F207-L210 HydrophobicContact CD1-CD1 4.47Å; F207-L210 PolarHBondContact O-N 2.88Å; F207-L210 VanDerWaalsContact O-N 3.09Å; S208-L210 VanDerWaalsContact C-N 3.34Å; L210-F213 WeakPolarHBondContact O-CB 3.02Å; L210-F213 PolarHBondContact O-N 2.96Å; L210-F213 VanDerWaalsContact O-N 3.1Å; L210-I214 HydrophobicContact CB-CD1 4.37Å; L210-I214 WeakPolarHBondContact O-CG1 3.42Å; L210-I214 PolarHBondContact O-N 2.87Å; L210-I214 VanDerWaalsContact O-N 3.13Å |
| 211 | I | 82.1 | Confident | 78.7 | Confident | 39 Ų | 39 | 69.9 Ų | 69.9 | 20% | 0.2 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -53.2 | -51.9 | -173.9 | -69.4 | 171.6 | 0 | 0 | 0 | 112.2 | F207 F209 F213 I214 E215 H249 V252 | F207-I211 WeakPolarHBondContact O-CG1 3.43Å; F207-I211 PolarHBondContact O-N 3.44Å; F209-I211 VanDerWaalsContact C-N 3.33Å; F209-I211 PolarHBondContact O-N 3.03Å; I211-F213 VanDerWaalsContact C-N 3.26Å; I211-F213 PolarHBondContact O-N 2.78Å; I211-I214 PolarHBondContact O-N 3.19Å; I211-I214 VanDerWaalsContact O-N 3.12Å; I211-E215 HydrophobicContact CG2-CG 4.45Å; I211-E215 WeakPolarHBondContact CG2-OE1 2.9Å; I211-E215 WeakPolarHBondContact O-CG 3.19Å; I211-E215 PolarHBondContact O-N 2.81Å; I211-H249 HydrophobicContact CG2-CB 3.85Å; I211-V252 HydrophobicContact CD1-CB 4.45Å; I211-V252 HydrophobicContact CD1-CG1 3.84Å |
| 212 | P | 79.6 | Confident | 76.5 | Confident | 5 Ų | 5 | 78.1 Ų | 78.1 | 3% | 0.032 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.7 | -30 | -179.6 | -28.2 | 40.5 | 0 | 0 | 0 | 114.2 | E156 A157 F209 E215 V216 H249 | E156-P212 HydrophobicContact CB-CB 4.38Å; E156-P212 HydrophobicContact CB-CG 4.36Å; A157-P212 HydrophobicContact CB-CB 4.46Å; A157-P212 HydrophobicContact CB-CG 4.24Å; F209-P212 WeakPolarHBondContact O-CD 3.31Å; P212-E215 PolarHBondContact O-N 3.19Å; P212-V216 WeakPolarHBondContact O-CG2 3.14Å; P212-V216 PolarHBondContact O-N 3.35Å; P212-H249 HydrophobicContact CG-CB 4.41Å |
| 213 | F | 79.5 | Confident | 74.2 | Confident | 22 Ų | 22 | 80.8 Ų | 80.8 | 10% | 0.096 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -71.7 | -38 | 176.1 | -65.7 | -81.5 | 0 | 0 | 0 | 112.4 | F154 A157 F209 L210 I211 E215 F218 F219 | F154-F213 HydrophobicContact CB-CZ 4.4Å; F154-F213 AromaticContact CD2-CZ 3.88Å; F154-F213 HydrophobicContact CD2-CZ 3.88Å; A157-F213 HydrophobicContact CB-CD2 4.15Å; A157-F213 HydrophobicContact CB-CE2 3.42Å; A157-F213 VanDerWaalsContact CB-CE2 3.42Å; A157-F213 HydrophobicContact CB-CZ 4.14Å; F209-F213 HydrophobicContact CD1-CE2 4.21Å; F209-F213 HydrophobicContact CE1-CD2 4.41Å; F209-F213 AromaticContact CE1-CE2 3.6Å; F209-F213 HydrophobicContact CE1-CE2 3.6Å; F209-F213 HydrophobicContact CE1-CZ 4.34Å; F209-F213 AromaticContact CZ-CE2 3.9Å; F209-F213 HydrophobicContact CZ-CE2 3.9Å; F209-F213 HydrophobicContact CZ-CZ 4.39Å; L210-F213 WeakPolarHBondContact O-CB 3.02Å; L210-F213 PolarHBondContact O-N 2.96Å; L210-F213 VanDerWaalsContact O-N 3.1Å; I211-F213 VanDerWaalsContact C-N 3.26Å; I211-F213 PolarHBondContact O-N 2.78Å; F213-E215 VanDerWaalsContact C-N 3.29Å; F213-F218 HydrophobicContact CB-CB 4.27Å; F213-F218 HydrophobicContact CD1-CD1 4.42Å; F213-F218 HydrophobicContact CD1-CG 4.24Å; F213-F218 WeakPolarHBondContact O-CB 3.32Å; F213-F218 PolarHBondContact O-N 3.19Å; F213-F219 HydrophobicContact CB-CE2 3.89Å; F213-F219 HydrophobicContact CB-CZ 4.42Å |
| 214 | I | 77.1 | Confident | 71.8 | Confident | 105 Ų | 105 | 79.5 Ų | 79.5 | 54% | 0.538 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.3 | -38.4 | 175.1 | -62.9 | 167.8 | 0 | 0 | 0 | 109.7 | L210 I211 N217 F219 | L210-I214 HydrophobicContact CB-CD1 4.37Å; L210-I214 WeakPolarHBondContact O-CG1 3.42Å; L210-I214 PolarHBondContact O-N 2.87Å; L210-I214 VanDerWaalsContact O-N 3.13Å; I211-I214 PolarHBondContact O-N 3.19Å; I211-I214 VanDerWaalsContact O-N 3.12Å; I214-N217 WeakPolarHBondContact O-CA 3.49Å; I214-N217 PolarHBondContact O-N 3.44Å; I214-N217 VanDerWaalsContact O-N 3.08Å; I214-F219 HydrophobicContact CG1-CD2 4.42Å; I214-F219 HydrophobicContact CG1-CE2 4.31Å |
| 215 | E | 68.6 | Low | 69.8 | Low | 49 Ų | 49 | 81 Ų | 81 | 23% | 0.229 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64.7 | -40.9 | 179.8 | -74.9 | 172.8 | -170.1 | 0 | 0 | 113.7 | I211 P212 F213 N217 Y248 H249 | I211-E215 HydrophobicContact CG2-CG 4.45Å; I211-E215 WeakPolarHBondContact CG2-OE1 2.9Å; I211-E215 WeakPolarHBondContact O-CG 3.19Å; I211-E215 PolarHBondContact O-N 2.81Å; P212-E215 PolarHBondContact O-N 3.19Å; F213-E215 VanDerWaalsContact C-N 3.29Å; E215-N217 PolarHBondContact O-N 2.92Å; E215-N217 VanDerWaalsContact O-N 3.15Å; E215-Y248 WeakPolarHBondContact OE1-CB 3.39Å; E215-H249 VanDerWaalsContact OE1-CA 3.24Å; E215-H249 WeakPolarHBondContact OE1-CA 3.48Å; E215-H249 WeakPolarHBondContact OE1-CB 3.45Å; E215-H249 PolarHBondContact OE1-N 2.96Å; E215-H249 WeakPolarHBondContact OE2-CB 3.13Å; E215-H249 IonicContact OE2-CG 2.74Å; E215-H249 PolarHBondContact OE2-N 2.9Å; E215-H249 IonicContact OE2-ND1 3.57Å; E215-H249 PolarHBondContact OE2-ND1 3.45Å |
| 216 | V | 64.4 | Low | 67.4 | Low | 63 Ų | 63 | 86.3 Ų | 86.3 | 38% | 0.382 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | 6.6 | 176.8 | -175.7 | 0 | 0 | 0 | 0 | 111.3 | P212 F218 | P212-V216 WeakPolarHBondContact O-CG2 3.14Å; P212-V216 PolarHBondContact O-N 3.35Å; V216-F218 PolarHBondContact O-N 2.69Å |
| 217 | N | 66.4 | Low | 65.4 | Low | 104 Ų | 104 | 89.2 Ų | 89.2 | 56% | 0.556 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 33 | -175.5 | -141.1 | 35 | 0 | 0 | 0 | 112.2 | I214 E215 F219 S220 | I214-N217 WeakPolarHBondContact O-CA 3.49Å; I214-N217 PolarHBondContact O-N 3.44Å; I214-N217 VanDerWaalsContact O-N 3.08Å; E215-N217 PolarHBondContact O-N 2.92Å; E215-N217 VanDerWaalsContact O-N 3.15Å; N217-F219 PolarHBondContact O-N 3.37Å; N217-S220 WeakPolarHBondContact ND2-CB 3.46Å; N217-S220 PolarHBondContact ND2-OG 3.32Å; N217-S220 PolarHBondContact O-N 3.38Å; N217-S220 PolarHBondContact O-OG 2.89Å |
| 218 | F | 63.3 | Low | 63.5 | Low | 96 Ų | 96 | 89.2 Ų | 89.2 | 42% | 0.421 | 47% | 0.472 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.6 | -31.3 | -173.7 | -177.7 | -95.4 | 0 | 0 | 0 | 112.7 | L150 F213 V216 | L150-F218 HydrophobicContact CD2-CD2 4.32Å; L150-F218 HydrophobicContact CD2-CE2 3.73Å; F213-F218 HydrophobicContact CB-CB 4.27Å; F213-F218 HydrophobicContact CD1-CD1 4.42Å; F213-F218 HydrophobicContact CD1-CG 4.24Å; F213-F218 WeakPolarHBondContact O-CB 3.32Å; F213-F218 PolarHBondContact O-N 3.19Å; V216-F218 PolarHBondContact O-N 2.69Å |
| 219 | F | 61.8 | Low | 61.6 | Low | 132 Ų | 132 | 90.9 Ų | 90.9 | 58% | 0.579 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.6 | -5.8 | -178.8 | -60.2 | -73.7 | 0 | 0 | 0 | 114.2 | F213 I214 N217 L221 | F213-F219 HydrophobicContact CB-CE2 3.89Å; F213-F219 HydrophobicContact CB-CZ 4.42Å; I214-F219 HydrophobicContact CG1-CD2 4.42Å; I214-F219 HydrophobicContact CG1-CE2 4.31Å; N217-F219 PolarHBondContact O-N 3.37Å; F219-L221 PolarHBondContact O-N 3.1Å |
| 220 | S | 54.8 | Low | 59.7 | Low | 53 Ų | 53 | 93.7 Ų | 93.7 | 37% | 0.371 | 49% | 0.493 | S | S | . | . | trans | -81.5 | 108.3 | 174.1 | 76.1 | 0 | 0 | 0 | 0 | 110 | N217 Q222 | N217-S220 WeakPolarHBondContact ND2-CB 3.46Å; N217-S220 PolarHBondContact ND2-OG 3.32Å; N217-S220 PolarHBondContact O-N 3.38Å; N217-S220 PolarHBondContact O-OG 2.89Å; S220-Q222 VanDerWaalsContact C-N 3.3Å; S220-Q222 PolarHBondContact O-N 3.2Å | ||
| 221 | L | 48.9 | Very low | 57.8 | Low | 179 Ų | 179 | 92.4 Ų | 92.4 | 94% | 0.937 | 49% | 0.486 | S | S | * | . | trans | -63.5 | 86.8 | 164.9 | -84.2 | 133.9 | 0 | 0 | 0 | 109.5 | F219 | F219-L221 PolarHBondContact O-N 3.1Š| ||
| 222 | Q | 45.6 | Very low | 56.1 | Low | 175 Ų | 175 | 91.6 Ų | 91.6 | 82% | 0.818 | 48% | 0.483 | S | S | * | . | trans | -128.3 | 123.4 | 166.8 | -157.1 | 119.5 | 1.5 | 0 | 0 | 110.9 | S220 G224 | S220-Q222 VanDerWaalsContact C-N 3.3Å; S220-Q222 PolarHBondContact O-N 3.2Å; Q222-G224 PolarHBondContact O-N 3.29Å | ||
| 223 | S | 45.9 | Very low | 54.7 | Low | 133 Ų | 133 | 91.7 Ų | 91.7 | 93% | 0.93 | 48% | 0.483 | S | S | * | . | trans | -70.3 | 93.6 | -170.4 | -174.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 224 | G | 43.2 | Very low | 53.3 | Low | 57 Ų | 57 | 91 Ų | 91 | 59% | 0.588 | 48% | 0.481 | S | S | * | . | trans | -170 | 106.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q222 T226 | Q222-G224 PolarHBondContact O-N 3.29Å; G224-T226 VanDerWaalsContact C-N 3.32Å; G224-T226 PolarHBondContact O-N 3.17Å | ||
| 225 | N | 46.9 | Very low | 51.8 | Low | 162 Ų | 162 | 87.4 Ų | 87.4 | 87% | 0.866 | 46% | 0.464 | S | S | * | . | trans | -67.9 | 79.9 | -179.7 | -74.4 | -13.5 | 0 | 0 | 0 | 112 | ||||
| 226 | T | 43.7 | Very low | 50.4 | Low | 112 Ų | 112 | 89.4 Ų | 89.4 | 69% | 0.687 | 48% | 0.483 | S | S | * | . | trans | -152.7 | 101.4 | 155 | 46.5 | 0 | 0 | 0 | 0 | 108.7 | G224 E228 | G224-T226 VanDerWaalsContact C-N 3.32Å; G224-T226 PolarHBondContact O-N 3.17Å; T226-E228 PolarHBondContact O-N 3.42Å | ||
| 227 | W | 48.7 | Very low | 49.4 | Very low | 175 Ų | 175 | 90.6 Ų | 90.6 | 66% | 0.663 | 49% | 0.49 | S | S | * | . | trans | -67 | 96.9 | 170.2 | -54.8 | 97.2 | 0 | 0 | 0 | 108.6 | N229 | W227-N229 PolarHBondContact O-N 3.09Š| ||
| 228 | E | 49.2 | Very low | 48 | Very low | 122 Ų | 122 | 90.8 Ų | 90.8 | 57% | 0.57 | 50% | 0.5 | S | S | * | . | trans | -75.3 | 120.7 | 174.1 | -70.7 | -177 | 160.6 | 0 | 0 | 109.8 | T226 K230 | T226-E228 PolarHBondContact O-N 3.42Å; E228-K230 HydrophobicContact CB-CD 4.47Å; E228-K230 HydrophobicContact CB-CG 4.32Å; E228-K230 PolarHBondContact O-N 3.04Å; E228-K230 WeakPolarHBondContact OE2-CE 3.17Å; E228-K230 IonicContact OE2-NZ 2.7Å; E228-K230 PolarHBondContact OE2-NZ 3.17Å | ||
| 229 | N | 48.2 | Very low | 46.9 | Very low | 46 Ų | 46 | 91.1 Ų | 91.1 | 25% | 0.246 | 50% | 0.503 | C | S | . | . | trans | -64.5 | 91.3 | 177.1 | -75.2 | -40.9 | 0 | 0 | 0 | 111 | A149 W227 C234 V235 | A149-N229 WeakPolarHBondContact CA-OD1 3.49Å; A149-N229 WeakPolarHBondContact CB-OD1 3.38Å; W227-N229 PolarHBondContact O-N 3.09Å; N229-C234 HydrophobicContact CB-CB 4.44Å; N229-C234 VanDerWaalsContact CB-O 3.31Å; N229-C234 WeakPolarHBondContact CB-O 3.43Å; N229-V235 WeakPolarHBondContact O-CG2 3.3Å | ||
| 230 | K | 47.8 | Very low | 45.9 | Very low | 99 Ų | 99 | 90.1 Ų | 90.1 | 43% | 0.43 | 50% | 0.496 | S | S | . | . | trans | -109.2 | 44.8 | -177.6 | -69.2 | 176.7 | 178.2 | 162.8 | 0 | 112.6 | E228 | E228-K230 HydrophobicContact CB-CD 4.47Å; E228-K230 HydrophobicContact CB-CG 4.32Å; E228-K230 PolarHBondContact O-N 3.04Å; E228-K230 WeakPolarHBondContact OE2-CE 3.17Å; E228-K230 IonicContact OE2-NZ 2.7Å; E228-K230 PolarHBondContact OE2-NZ 3.17Å | ||
| 231 | T | 47.4 | Very low | 45.1 | Very low | 12 Ų | 12 | 94.6 Ų | 94.6 | 7% | 0.074 | 51% | 0.505 | C | S | . | . | S | Bend | trans | -128.9 | 140 | 177.3 | -26.8 | 0 | 0 | 0 | 0 | 109.7 | C152 E156 L233 C234 V235 M246 | C152-T231 HydrophobicContact CB-CG2 4.19Å; E156-T231 HydrophobicContact CB-CG2 4.37Å; E156-T231 HydrophobicContact CG-CG2 3.46Å; E156-T231 VanDerWaalsContact CG-CG2 3.46Å; T231-L233 PolarHBondContact O-N 3.45Å; T231-C234 WeakPolarHBondContact O-CA 3.32Å; T231-C234 PolarHBondContact O-N 3.18Å; T231-V235 WeakPolarHBondContact O-CG2 3.14Å; T231-V235 PolarHBondContact O-N 3.38Å; T231-M246 VanDerWaalsContact C-CE 3.49Å |
| 232 | L | 47.5 | Very low | 44.8 | Very low | 23 Ų | 23 | 91.2 Ų | 91.2 | 12% | 0.12 | 49% | 0.493 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.8 | -28.8 | -169.1 | -165.5 | 88.9 | 0 | 0 | 0 | 114.1 | M246 I372 P377 | L232-M246 HydrophobicContact CB-CE 3.88Å; L232-M246 HydrophobicContact CD1-CE 4.07Å; L232-I372 HydrophobicContact CD1-CG2 4.31Å; L232-P377 HydrophobicContact CD1-CB 4.17Å |
| 233 | L | 50.8 | Low | 44.7 | Very low | 6 Ų | 6 | 88.7 Ų | 88.7 | 3% | 0.031 | 48% | 0.481 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | -15.9 | 179.7 | -134.7 | 93.6 | 0 | 0 | 0 | 114.4 | I139 L144 T231 V382 L386 | I139-L233 HydrophobicContact CB-CD2 4.47Å; I139-L233 HydrophobicContact CG2-CD2 3.01Å; L144-L233 WeakPolarHBondContact CD2-O 3.37Å; T231-L233 PolarHBondContact O-N 3.45Å; L233-V382 HydrophobicContact CD1-CG1 4.15Å; L233-L386 HydrophobicContact CD1-CD2 4.23Å |
| 234 | C | 48.9 | Very low | 44.6 | Very low | 8 Ų | 8 | 87.9 Ų | 87.9 | 5% | 0.054 | 47% | 0.465 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.5 | -0.3 | -172.5 | -92.6 | 0 | 0 | 0 | 0 | 114.7 | L144 C152 N229 T231 S236 | L144-C234 HydrophobicContact CD2-CB 4.14Å; L144-C234 VanDerWaalsContact CD2-SG 3.6Å; C152-C234 HydrophobicContact CB-CB 3.76Å; C152-C234 WeakPolarHBondContact CB-SG 3.48Å; C152-C234 WeakPolarHBondContact SG-CB 3.29Å; C152-C234 CovalentContact SG-SG 2.03Å; C152-C234 PolarHBondContact SG-SG 2.89Å; N229-C234 HydrophobicContact CB-CB 4.44Å; N229-C234 VanDerWaalsContact CB-O 3.31Å; N229-C234 WeakPolarHBondContact CB-O 3.43Å; T231-C234 WeakPolarHBondContact O-CA 3.32Å; T231-C234 PolarHBondContact O-N 3.18Å; C234-S236 PolarHBondContact O-N 3.3Å |
| 235 | V | 45 | Very low | 44.8 | Very low | 30 Ų | 30 | 86.7 Ų | 86.7 | 18% | 0.182 | 45% | 0.453 | C | S | . | . | trans | -75.9 | 113.4 | 175 | -178.2 | 0 | 0 | 0 | 0 | 108.9 | N229 T231 E239 M246 | N229-V235 WeakPolarHBondContact O-CG2 3.3Å; T231-V235 WeakPolarHBondContact O-CG2 3.14Å; T231-V235 PolarHBondContact O-N 3.38Å; V235-E239 WeakPolarHBondContact CG1-O 3.35Å; V235-M246 HydrophobicContact CG2-CE 4.14Å | ||
| 236 | S | 41.1 | Very low | 45.1 | Very low | 91 Ų | 91 | 80.3 Ų | 80.3 | 64% | 0.636 | 42% | 0.418 | S | S | * | . | trans | -56.9 | 138.9 | 174.6 | -162.1 | 0 | 0 | 0 | 0 | 110.6 | C234 S238 | C234-S236 PolarHBondContact O-N 3.3Å; S236-S238 PolarHBondContact O-N 3.43Å | ||
| 237 | T | 42.2 | Very low | 46 | Very low | 88 Ų | 88 | 77 Ų | 77 | 54% | 0.54 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | 8.3 | -170.1 | 29.9 | 0 | 0 | 0 | 0 | 116.9 | L71 | L71-T237 HydrophobicContact CD1-CG2 3.54Š|
| 238 | S | 37.9 | Very low | 46.5 | Very low | 107 Ų | 107 | 74 Ų | 74 | 75% | 0.748 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.5 | -34.7 | 179 | -169 | 0 | 0 | 0 | 0 | 113.3 | S236 | S236-S238 PolarHBondContact O-N 3.43Š|
| 239 | E | 38.7 | Very low | 47.3 | Very low | 104 Ų | 104 | 68.9 Ų | 68.9 | 49% | 0.486 | 36% | 0.359 | S | S | . | . | trans | -152.2 | 107.7 | -177.4 | -69.3 | -179.1 | 136.9 | 0 | 0 | 108.4 | V235 Y241 | V235-E239 WeakPolarHBondContact CG1-O 3.35Å; E239-Y241 HydrophobicContact CB-CD2 3.65Å; E239-Y241 HydrophobicContact CB-CE2 3.41Å; E239-Y241 VanDerWaalsContact CB-CE2 3.41Å; E239-Y241 HydrophobicContact CG-CE2 4.16Å; E239-Y241 WeakPolarHBondContact O-CD2 3.45Å; E239-Y241 PolarHBondContact O-N 3.35Å; E239-Y241 WeakPolarHBondContact OE2-CE2 3.44Å; E239-Y241 PolarHBondContact OE2-OH 3.4Å | ||
| 240 | Y | 41.8 | Very low | 48.3 | Very low | 110 Ų | 110 | 66.8 Ų | 66.8 | 43% | 0.431 | 35% | 0.348 | S | S | . | . | trans | -63.6 | 82.6 | 162.2 | -74.6 | -81.4 | 0 | 0 | 0 | 107.3 | T242 P377 | Y240-T242 PolarHBondContact O-N 3.33Å; Y240-P377 HydrophobicContact CD1-CB 4.34Å; Y240-P377 HydrophobicContact CD1-CG 3.54Å; Y240-P377 HydrophobicContact CE1-CB 3.88Å; Y240-P377 HydrophobicContact CE1-CG 3.58Å; Y240-P377 HydrophobicContact CG-CG 4.41Å | ||
| 241 | Y | 38.8 | Very low | 49.2 | Very low | 147 Ų | 147 | 65.8 Ų | 65.8 | 58% | 0.576 | 35% | 0.347 | S | S | * | . | trans | -62.2 | 97 | 168.3 | -81.1 | -82.9 | 0 | 0 | 0 | 106.8 | E239 E243 | E239-Y241 HydrophobicContact CB-CD2 3.65Å; E239-Y241 HydrophobicContact CB-CE2 3.41Å; E239-Y241 VanDerWaalsContact CB-CE2 3.41Å; E239-Y241 HydrophobicContact CG-CE2 4.16Å; E239-Y241 WeakPolarHBondContact O-CD2 3.45Å; E239-Y241 PolarHBondContact O-N 3.35Å; E239-Y241 WeakPolarHBondContact OE2-CE2 3.44Å; E239-Y241 PolarHBondContact OE2-OH 3.4Å; Y241-E243 PolarHBondContact O-N 2.92Å | ||
| 242 | T | 40.8 | Very low | 50.2 | Low | 109 Ų | 109 | 68.1 Ų | 68.1 | 67% | 0.669 | 36% | 0.361 | S | S | * | . | trans | -73.3 | 52.2 | 173.5 | 38.9 | 0 | 0 | 0 | 0 | 109.1 | Y240 | Y240-T242 PolarHBondContact O-N 3.33Š| ||
| 243 | E | 45.3 | Very low | 51.4 | Low | 121 Ų | 121 | 67.8 Ų | 67.8 | 57% | 0.565 | 36% | 0.359 | S | S | * | . | trans | -75.7 | 133.7 | 170.3 | -80 | -67.6 | 156.3 | 0 | 0 | 108.8 | Y241 G245 M246 | Y241-E243 PolarHBondContact O-N 2.92Å; E243-G245 PolarHBondContact O-N 3.15Å; E243-M246 PolarHBondContact O-N 3.24Å | ||
| 244 | L | 43.8 | Very low | 52.8 | Low | 116 Ų | 116 | 68.4 Ų | 68.4 | 61% | 0.607 | 36% | 0.362 | S | S | * | . | G | 310 helix | trans | -52.9 | -20.3 | -170.5 | -151.2 | 72.6 | 0 | 0 | 0 | 113.6 | M246 Y248 | L244-M246 VanDerWaalsContact C-N 3.32Å; L244-M246 PolarHBondContact O-N 3.32Å; L244-Y248 HydrophobicContact CB-CE2 4.46Å; L244-Y248 VanDerWaalsContact CD2-OH 3.26Å; L244-Y248 WeakPolarHBondContact CD2-OH 3.47Å; L244-Y248 HydrophobicContact CG-CE2 4.26Å; L244-Y248 VanDerWaalsContact O-CD2 3.22Å; L244-Y248 WeakPolarHBondContact O-CD2 3.34Å; L244-Y248 WeakPolarHBondContact O-CE2 3.34Å |
| 245 | G | 46.4 | Very low | 54.4 | Low | 32 Ų | 32 | 71.5 Ų | 71.5 | 33% | 0.33 | 38% | 0.382 | S | S | . | . | G | 310 helix | trans | -62.3 | -26.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | E243 Y247 | E243-G245 PolarHBondContact O-N 3.15Å; G245-Y247 VanDerWaalsContact C-N 3.28Å; G245-Y247 PolarHBondContact O-N 2.82Å |
| 246 | M | 53.8 | Low | 56 | Low | 28 Ų | 28 | 72.5 Ų | 72.5 | 14% | 0.138 | 39% | 0.386 | C | S | . | . | G | 310 helix | trans | -74.9 | -13.3 | -173.1 | -71.1 | -80.8 | -79.5 | 0 | 0 | 114.9 | T231 L232 V235 E243 L244 H249 | T231-M246 VanDerWaalsContact C-CE 3.49Å; L232-M246 HydrophobicContact CB-CE 3.88Å; L232-M246 HydrophobicContact CD1-CE 4.07Å; V235-M246 HydrophobicContact CG2-CE 4.14Å; E243-M246 PolarHBondContact O-N 3.24Å; L244-M246 VanDerWaalsContact C-N 3.32Å; L244-M246 PolarHBondContact O-N 3.32Å; M246-H249 PolarHBondContact O-CE1 3.35Å |
| 247 | Y | 61.2 | Low | 58 | Low | 44 Ų | 44 | 68.8 Ų | 68.8 | 17% | 0.173 | 36% | 0.358 | C | S | . | . | G | 310 helix | trans | -105.5 | -11.3 | -171.4 | -64.9 | -71.5 | 0 | 0 | 0 | 113.8 | G245 L250 L251 L373 | G245-Y247 VanDerWaalsContact C-N 3.28Å; G245-Y247 PolarHBondContact O-N 2.82Å; Y247-L250 PolarHBondContact O-N 2.82Å; Y247-L251 VanDerWaalsContact O-CB 3.23Å; Y247-L251 WeakPolarHBondContact O-CB 3.39Å; Y247-L251 WeakPolarHBondContact O-CD1 3.33Å; Y247-L251 WeakPolarHBondContact O-CG 3.17Å; Y247-L251 PolarHBondContact O-N 2.9Å; Y247-L373 HydrophobicContact CD1-CD1 3.26Å; Y247-L373 HydrophobicContact CD1-CG 4.46Å; Y247-L373 HydrophobicContact CE1-CD1 4.05Å; Y247-L373 HydrophobicContact CG-CD1 3.72Å |
| 248 | Y | 59.7 | Low | 59.9 | Low | 111 Ų | 111 | 68.9 Ų | 68.9 | 44% | 0.435 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -69.8 | -40.9 | -171.1 | -72.8 | -74.4 | 0 | 0 | 0 | 113.1 | E215 L244 L250 L251 V252 | E215-Y248 WeakPolarHBondContact OE1-CB 3.39Å; L244-Y248 HydrophobicContact CB-CE2 4.46Å; L244-Y248 VanDerWaalsContact CD2-OH 3.26Å; L244-Y248 WeakPolarHBondContact CD2-OH 3.47Å; L244-Y248 HydrophobicContact CG-CE2 4.26Å; L244-Y248 VanDerWaalsContact O-CD2 3.22Å; L244-Y248 WeakPolarHBondContact O-CD2 3.34Å; L244-Y248 WeakPolarHBondContact O-CE2 3.34Å; Y248-L250 VanDerWaalsContact C-N 3.33Å; Y248-L250 PolarHBondContact O-N 3.34Å; Y248-L251 HydrophobicContact CD1-CD1 4.32Å; Y248-L251 CarbonylContact O-C 3.44Å; Y248-L251 WeakPolarHBondContact O-CB 3.48Å; Y248-L251 PolarHBondContact O-N 3.38Å; Y248-L251 VanDerWaalsContact O-N 3.15Å; Y248-V252 WeakPolarHBondContact O-CG2 3.47Å; Y248-V252 PolarHBondContact O-N 3.27Å |
| 249 | H | 65.9 | Low | 62.1 | Low | 14 Ų | 14 | 69.9 Ų | 69.9 | 7% | 0.065 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -69.5 | -37.3 | 179.3 | 65 | -82.2 | 0 | 0 | 0 | 110.5 | E156 I211 P212 E215 M246 V252 Q253 | E156-H249 IonicContact OE2-NE2 3.22Å; I211-H249 HydrophobicContact CG2-CB 3.85Å; P212-H249 HydrophobicContact CG-CB 4.41Å; E215-H249 VanDerWaalsContact OE1-CA 3.24Å; E215-H249 WeakPolarHBondContact OE1-CA 3.48Å; E215-H249 WeakPolarHBondContact OE1-CB 3.45Å; E215-H249 PolarHBondContact OE1-N 2.96Å; E215-H249 WeakPolarHBondContact OE2-CB 3.13Å; E215-H249 IonicContact OE2-CG 2.74Å; E215-H249 PolarHBondContact OE2-N 2.9Å; E215-H249 IonicContact OE2-ND1 3.57Å; E215-H249 PolarHBondContact OE2-ND1 3.45Å; M246-H249 PolarHBondContact O-CE1 3.35Å; H249-V252 PolarHBondContact O-N 2.84Å; H249-Q253 WeakPolarHBondContact O-CB 3.43Å; H249-Q253 PolarHBondContact O-N 3.28Å |
| 250 | L | 69.6 | Low | 64.2 | Low | 2 Ų | 2 | 65.2 Ų | 65.2 | 1% | 0.01 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63 | -42.5 | 171.5 | -59.9 | -178.4 | 0 | 0 | 0 | 111.1 | Y247 Y248 V252 Q253 I254 N369 | Y247-L250 PolarHBondContact O-N 2.82Å; Y248-L250 VanDerWaalsContact C-N 3.33Å; Y248-L250 PolarHBondContact O-N 3.34Å; L250-V252 PolarHBondContact O-N 3.19Å; L250-Q253 PolarHBondContact O-N 3.41Å; L250-I254 HydrophobicContact CB-CD1 4.48Å; L250-I254 VanDerWaalsContact O-CB 3.32Å; L250-I254 WeakPolarHBondContact O-CB 3.08Å; L250-I254 WeakPolarHBondContact O-CD1 3.34Å; L250-I254 WeakPolarHBondContact O-CG1 3.46Å; L250-I254 PolarHBondContact O-N 2.96Å; L250-N369 HydrophobicContact CD2-CB 4.06Å |
| 251 | L | 67.2 | Low | 66.2 | Low | 79 Ų | 79 | 61 Ų | 61 | 41% | 0.414 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.8 | -23.4 | 176.1 | -78.2 | 168.6 | 0 | 0 | 0 | 113.3 | Y247 Y248 P255 L373 | Y247-L251 VanDerWaalsContact O-CB 3.23Å; Y247-L251 WeakPolarHBondContact O-CB 3.39Å; Y247-L251 WeakPolarHBondContact O-CD1 3.33Å; Y247-L251 WeakPolarHBondContact O-CG 3.17Å; Y247-L251 PolarHBondContact O-N 2.9Å; Y248-L251 HydrophobicContact CD1-CD1 4.32Å; Y248-L251 CarbonylContact O-C 3.44Å; Y248-L251 WeakPolarHBondContact O-CB 3.48Å; Y248-L251 PolarHBondContact O-N 3.38Å; Y248-L251 VanDerWaalsContact O-N 3.15Å; L251-P255 WeakPolarHBondContact O-CD 3.48Å; L251-P255 WeakPolarHBondContact O-CG 3.37Å; L251-L373 HydrophobicContact CD2-CD1 4.27Å; L251-L373 HydrophobicContact CD2-CD2 3.58Å; L251-L373 HydrophobicContact CG-CD1 4.22Å; L251-L373 HydrophobicContact CG-CD2 4.2Å |
| 252 | V | 67.3 | Low | 68.5 | Low | 61 Ų | 61 | 58.6 Ų | 58.6 | 37% | 0.37 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -89.1 | -40.3 | 173.4 | 174.9 | 0 | 0 | 0 | 0 | 111.3 | I211 Y248 H249 L250 P255 I256 | I211-V252 HydrophobicContact CD1-CB 4.45Å; I211-V252 HydrophobicContact CD1-CG1 3.84Å; Y248-V252 WeakPolarHBondContact O-CG2 3.47Å; Y248-V252 PolarHBondContact O-N 3.27Å; H249-V252 PolarHBondContact O-N 2.84Å; L250-V252 PolarHBondContact O-N 3.19Å; V252-P255 WeakPolarHBondContact O-CD 3.42Å; V252-I256 HydrophobicContact CG1-CD1 3.64Å; V252-I256 WeakPolarHBondContact O-CD1 3.48Å; V252-I256 VanDerWaalsContact O-CG1 3.22Å; V252-I256 WeakPolarHBondContact O-CG1 3.27Å; V252-I256 PolarHBondContact O-N 3.31Å |
| 253 | Q | 72.9 | Confident | 70.5 | Confident | 15 Ų | 15 | 54.9 Ų | 54.9 | 7% | 0.07 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -68.2 | -39.7 | -177.6 | -167.8 | -179 | 20.8 | 0 | 0 | 112.3 | S163 H249 L250 I256 F257 | S163-Q253 PolarHBondContact OG-NE2 3.45Å; H249-Q253 WeakPolarHBondContact O-CB 3.43Å; H249-Q253 PolarHBondContact O-N 3.28Å; L250-Q253 PolarHBondContact O-N 3.41Å; Q253-I256 PolarHBondContact O-N 3.39Å; Q253-F257 WeakPolarHBondContact O-CB 3.36Å; Q253-F257 PolarHBondContact O-N 3.05Å |
| 254 | I | 80.3 | Confident | 72.3 | Confident | 20 Ų | 20 | 49.2 Ų | 49.2 | 10% | 0.103 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62 | -54.2 | -179 | -71.5 | 165.2 | 0 | 0 | 0 | 111.6 | L250 I256 F257 F258 N369 L373 | L250-I254 HydrophobicContact CB-CD1 4.48Å; L250-I254 VanDerWaalsContact O-CB 3.32Å; L250-I254 WeakPolarHBondContact O-CB 3.08Å; L250-I254 WeakPolarHBondContact O-CD1 3.34Å; L250-I254 WeakPolarHBondContact O-CG1 3.46Å; L250-I254 PolarHBondContact O-N 2.96Å; I254-I256 VanDerWaalsContact C-N 3.34Å; I254-I256 PolarHBondContact O-N 2.96Å; I254-F257 PolarHBondContact O-N 3.49Å; I254-F258 HydrophobicContact CG2-CD2 3.62Å; I254-F258 HydrophobicContact CG2-CE2 3.55Å; I254-F258 WeakPolarHBondContact O-CD2 3.44Å; I254-F258 PolarHBondContact O-N 3.37Å; I254-N369 HydrophobicContact CD1-CB 4.45Å; I254-L373 HydrophobicContact CD1-CD2 4.09Å |
| 255 | P | 82 | Confident | 74.3 | Confident | 73 Ų | 73 | 48.3 Ų | 48.3 | 47% | 0.474 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.7 | -39.4 | 176.4 | -25.9 | 35.2 | 0 | 0 | 0 | 113.5 | L251 V252 F257 F258 F259 | L251-P255 WeakPolarHBondContact O-CD 3.48Å; L251-P255 WeakPolarHBondContact O-CG 3.37Å; V252-P255 WeakPolarHBondContact O-CD 3.42Å; P255-F257 VanDerWaalsContact C-N 3.34Å; P255-F257 PolarHBondContact O-N 3.04Å; P255-F258 PolarHBondContact O-N 2.95Å; P255-F259 WeakPolarHBondContact O-CB 3.17Å; P255-F259 PolarHBondContact O-N 2.89Å |
| 256 | I | 78.7 | Confident | 76.1 | Confident | 51 Ų | 51 | 51.3 Ų | 51.3 | 26% | 0.262 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.3 | -46.5 | 177.5 | -69.1 | 169.7 | 0 | 0 | 0 | 109.9 | V164 V252 Q253 I254 F259 T260 | V164-I256 HydrophobicContact CG2-CD1 4.28Å; V164-I256 HydrophobicContact CG2-CG2 4.25Å; V252-I256 HydrophobicContact CG1-CD1 3.64Å; V252-I256 WeakPolarHBondContact O-CD1 3.48Å; V252-I256 VanDerWaalsContact O-CG1 3.22Å; V252-I256 WeakPolarHBondContact O-CG1 3.27Å; V252-I256 PolarHBondContact O-N 3.31Å; Q253-I256 PolarHBondContact O-N 3.39Å; I254-I256 VanDerWaalsContact C-N 3.34Å; I254-I256 PolarHBondContact O-N 2.96Å; I256-F259 PolarHBondContact O-N 2.93Å; I256-T260 HydrophobicContact CG2-CG2 4.34Å; I256-T260 WeakPolarHBondContact O-CG2 3.47Å; I256-T260 PolarHBondContact O-N 3.02Å; I256-T260 PolarHBondContact O-OG1 3.05Å |
| 257 | F | 82.8 | Confident | 77.5 | Confident | 12 Ų | 12 | 50.8 Ų | 50.8 | 5% | 0.053 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -58.6 | -55.2 | 176.3 | 178.7 | -100.9 | 0 | 0 | 0 | 111.1 | Q253 I254 P255 F259 T260 V261 F358 W362 S366 | Q253-F257 WeakPolarHBondContact O-CB 3.36Å; Q253-F257 PolarHBondContact O-N 3.05Å; I254-F257 PolarHBondContact O-N 3.49Å; P255-F257 VanDerWaalsContact C-N 3.34Å; P255-F257 PolarHBondContact O-N 3.04Å; F257-F259 VanDerWaalsContact C-N 3.32Å; F257-F259 PolarHBondContact O-N 3.42Å; F257-T260 PolarHBondContact O-N 2.65Å; F257-T260 VanDerWaalsContact O-N 3.12Å; F257-T260 PolarHBondContact O-OG1 2.79Å; F257-V261 HydrophobicContact CD1-CG2 4.25Å; F257-V261 HydrophobicContact CD2-CG2 4.46Å; F257-V261 HydrophobicContact CE1-CG2 3.86Å; F257-V261 HydrophobicContact CE2-CG2 4.07Å; F257-V261 HydrophobicContact CZ-CG2 3.75Å; F257-V261 WeakPolarHBondContact O-CG2 3.47Å; F257-V261 PolarHBondContact O-N 2.79Å; F257-F358 HydrophobicContact CD2-CE1 4.42Å; F257-F358 HydrophobicContact CD2-CZ 4.1Å; F257-F358 AromaticContact CE2-CE1 3.93Å; F257-F358 HydrophobicContact CE2-CE1 3.93Å; F257-F358 AromaticContact CE2-CZ 3.89Å; F257-F358 HydrophobicContact CE2-CZ 3.89Å; F257-W362 HydrophobicContact CD2-CB 4.46Å; F257-W362 HydrophobicContact CE2-CB 3.69Å; F257-W362 HydrophobicContact CZ-CB 4.41Å; F257-S366 WeakPolarHBondContact CD1-OG 3.2Å; F257-S366 WeakPolarHBondContact CD2-OG 3.33Å; F257-S366 VanDerWaalsContact CG-OG 3.29Å; F257-S366 WeakPolarHBondContact CG-OG 3.33Å |
| 258 | F | 84.1 | Confident | 78.5 | Confident | 91 Ų | 91 | 49.2 Ų | 49.2 | 40% | 0.399 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.8 | -38.8 | -179.1 | -75.9 | -65.4 | 0 | 0 | 0 | 113 | I254 P255 V261 I262 | I254-F258 HydrophobicContact CG2-CD2 3.62Å; I254-F258 HydrophobicContact CG2-CE2 3.55Å; I254-F258 WeakPolarHBondContact O-CD2 3.44Å; I254-F258 PolarHBondContact O-N 3.37Å; P255-F258 PolarHBondContact O-N 2.95Å; F258-V261 PolarHBondContact O-N 2.99Å; F258-I262 WeakPolarHBondContact O-CB 3.42Å; F258-I262 VanDerWaalsContact O-CG1 3.23Å; F258-I262 WeakPolarHBondContact O-CG1 3.36Å; F258-I262 PolarHBondContact O-N 3.45Å |
| 259 | F | 83.7 | Confident | 79.6 | Confident | 128 Ų | 128 | 47.3 Ų | 47.3 | 56% | 0.561 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -59.1 | -49 | 173.2 | 174.1 | -100.8 | 0 | 0 | 0 | 111.2 | P255 I256 F257 V261 I262 V263 | P255-F259 WeakPolarHBondContact O-CB 3.17Å; P255-F259 PolarHBondContact O-N 2.89Å; I256-F259 PolarHBondContact O-N 2.93Å; F257-F259 VanDerWaalsContact C-N 3.32Å; F257-F259 PolarHBondContact O-N 3.42Å; F259-V261 VanDerWaalsContact C-N 3.32Å; F259-V261 PolarHBondContact O-N 2.79Å; F259-I262 PolarHBondContact O-N 3.43Å; F259-V263 HydrophobicContact CD2-CG2 4.17Å; F259-V263 HydrophobicContact CE1-CG2 4.15Å; F259-V263 HydrophobicContact CE2-CG2 3.78Å; F259-V263 HydrophobicContact CZ-CG2 3.77Å; F259-V263 VanDerWaalsContact O-CG2 3.32Å; F259-V263 WeakPolarHBondContact O-CG2 3.04Å; F259-V263 PolarHBondContact O-N 3.06Å |
| 260 | T | 81.3 | Confident | 80.4 | Confident | 5 Ų | 5 | 51.7 Ų | 51.7 | 3% | 0.031 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.7 | -42.9 | 177.6 | 64.8 | 0 | 0 | 0 | 0 | 111.5 | A167 I256 F257 V263 M264 | A167-T260 HydrophobicContact CB-CG2 3.77Å; I256-T260 HydrophobicContact CG2-CG2 4.34Å; I256-T260 WeakPolarHBondContact O-CG2 3.47Å; I256-T260 PolarHBondContact O-N 3.02Å; I256-T260 PolarHBondContact O-OG1 3.05Å; F257-T260 PolarHBondContact O-N 2.65Å; F257-T260 VanDerWaalsContact O-N 3.12Å; F257-T260 PolarHBondContact O-OG1 2.79Å; T260-V263 PolarHBondContact O-N 2.9Å; T260-M264 VanDerWaalsContact O-CB 3.26Å; T260-M264 WeakPolarHBondContact O-CB 3.18Å; T260-M264 WeakPolarHBondContact O-CG 3.46Å; T260-M264 PolarHBondContact O-N 3.47Å |
| 261 | V | 85.5 | Confident | 81 | Confident | 22 Ų | 22 | 51.6 Ų | 51.6 | 13% | 0.133 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.8 | -47.5 | 177.3 | 174.7 | 0 | 0 | 0 | 0 | 111.7 | F257 F258 F259 V263 M264 L265 L359 | F257-V261 HydrophobicContact CD1-CG2 4.25Å; F257-V261 HydrophobicContact CD2-CG2 4.46Å; F257-V261 HydrophobicContact CE1-CG2 3.86Å; F257-V261 HydrophobicContact CE2-CG2 4.07Å; F257-V261 HydrophobicContact CZ-CG2 3.75Å; F257-V261 WeakPolarHBondContact O-CG2 3.47Å; F257-V261 PolarHBondContact O-N 2.79Å; F258-V261 PolarHBondContact O-N 2.99Å; F259-V261 VanDerWaalsContact C-N 3.32Å; F259-V261 PolarHBondContact O-N 2.79Å; V261-V263 PolarHBondContact O-N 3.14Å; V261-M264 PolarHBondContact O-N 3.37Å; V261-L265 HydrophobicContact CG1-CD1 3.86Å; V261-L265 HydrophobicContact CG1-CG 4.28Å; V261-L265 WeakPolarHBondContact O-CB 3.42Å; V261-L265 VanDerWaalsContact O-CG 3.28Å; V261-L265 WeakPolarHBondContact O-CG 3.23Å; V261-L265 PolarHBondContact O-N 3.38Å; V261-L359 HydrophobicContact CB-CD2 4.27Å; V261-L359 HydrophobicContact CG1-CD2 3.89Å; V261-L359 HydrophobicContact CG2-CD2 3.51Å |
| 262 | I | 87.1 | Confident | 81.7 | Confident | 96 Ų | 96 | 51.6 Ų | 51.6 | 49% | 0.492 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -59.7 | -48.9 | 179.5 | -71.5 | 165.3 | 0 | 0 | 0 | 110.5 | F258 F259 M264 L265 I266 | F258-I262 WeakPolarHBondContact O-CB 3.42Å; F258-I262 VanDerWaalsContact O-CG1 3.23Å; F258-I262 WeakPolarHBondContact O-CG1 3.36Å; F258-I262 PolarHBondContact O-N 3.45Å; F259-I262 PolarHBondContact O-N 3.43Å; I262-M264 VanDerWaalsContact C-N 3.33Å; I262-M264 PolarHBondContact O-N 3.42Å; I262-L265 PolarHBondContact O-N 3.48Å; I262-I266 HydrophobicContact CG2-CD1 3.79Å; I262-I266 WeakPolarHBondContact O-CG1 3.5Å; I262-I266 PolarHBondContact O-N 3.34Å |
| 263 | V | 82.1 | Confident | 82.4 | Confident | 31 Ų | 31 | 53 Ų | 53 | 19% | 0.188 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.2 | -41.1 | -179.8 | 178.6 | 0 | 0 | 0 | 0 | 110.8 | F171 F259 T260 V261 I266 T267 | F171-V263 HydrophobicContact CD2-CG1 3.89Å; F171-V263 HydrophobicContact CE2-CB 4.28Å; F171-V263 HydrophobicContact CE2-CG1 3.2Å; F171-V263 HydrophobicContact CZ-CG1 3.8Å; F259-V263 HydrophobicContact CD2-CG2 4.17Å; F259-V263 HydrophobicContact CE1-CG2 4.15Å; F259-V263 HydrophobicContact CE2-CG2 3.78Å; F259-V263 HydrophobicContact CZ-CG2 3.77Å; F259-V263 VanDerWaalsContact O-CG2 3.32Å; F259-V263 WeakPolarHBondContact O-CG2 3.04Å; F259-V263 PolarHBondContact O-N 3.06Å; T260-V263 PolarHBondContact O-N 2.9Å; V261-V263 PolarHBondContact O-N 3.14Å; V263-I266 PolarHBondContact O-N 3.2Å; V263-T267 HydrophobicContact CG1-CG2 4.34Å; V263-T267 WeakPolarHBondContact O-CB 3.46Å; V263-T267 VanDerWaalsContact O-CG2 3.31Å; V263-T267 WeakPolarHBondContact O-CG2 3.37Å; V263-T267 PolarHBondContact O-N 3.16Å; V263-T267 PolarHBondContact O-OG1 3.02Å |
| 264 | M | 83.3 | Confident | 82.6 | Confident | 3 Ų | 3 | 53.2 Ų | 53.2 | 2% | 0.015 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 175.2 | -75.1 | 170.5 | 50.8 | 0 | 0 | 112.1 | V170 T260 V261 I262 T267 Y268 I355 F358 | V170-M264 HydrophobicContact CG1-CE 3.47Å; V170-M264 VanDerWaalsContact CG1-CE 3.47Å; V170-M264 HydrophobicContact CG1-SD 3.87Å; T260-M264 VanDerWaalsContact O-CB 3.26Å; T260-M264 WeakPolarHBondContact O-CB 3.18Å; T260-M264 WeakPolarHBondContact O-CG 3.46Å; T260-M264 PolarHBondContact O-N 3.47Å; V261-M264 PolarHBondContact O-N 3.37Å; I262-M264 VanDerWaalsContact C-N 3.33Å; I262-M264 PolarHBondContact O-N 3.42Å; M264-T267 WeakPolarHBondContact CA-OG1 3.49Å; M264-T267 PolarHBondContact O-OG1 3.48Å; M264-Y268 WeakPolarHBondContact O-CB 3.46Å; M264-Y268 VanDerWaalsContact O-CD2 3.31Å; M264-Y268 WeakPolarHBondContact O-CD2 3.11Å; M264-Y268 PolarHBondContact O-N 3.18Å; M264-I355 HydrophobicContact CE-CB 3.87Å; M264-I355 HydrophobicContact CE-CD1 3.89Å; M264-I355 HydrophobicContact CE-CG1 3.55Å; M264-I355 HydrophobicContact CE-CG2 3.3Å; M264-F358 HydrophobicContact CE-CD1 4.01Å; M264-F358 HydrophobicContact SD-CD1 4.42Å; M264-F358 HydrophobicContact SD-CE1 4.41Å |
| 265 | L | 85.4 | Confident | 82.2 | Confident | 96 Ų | 96 | 53.6 Ų | 53.6 | 50% | 0.503 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62 | -49.5 | 176.7 | -72.5 | 171.1 | 0 | 0 | 0 | 111.3 | V261 I262 T267 Y268 T269 | V261-L265 HydrophobicContact CG1-CD1 3.86Å; V261-L265 HydrophobicContact CG1-CG 4.28Å; V261-L265 WeakPolarHBondContact O-CB 3.42Å; V261-L265 VanDerWaalsContact O-CG 3.28Å; V261-L265 WeakPolarHBondContact O-CG 3.23Å; V261-L265 PolarHBondContact O-N 3.38Å; I262-L265 PolarHBondContact O-N 3.48Å; L265-T267 PolarHBondContact O-N 2.89Å; L265-Y268 PolarHBondContact O-N 3.47Å; L265-T269 PolarHBondContact O-N 3.3Å; L265-T269 PolarHBondContact O-OG1 3.17Å |
| 266 | I | 85.3 | Confident | 81.7 | Confident | 96 Ų | 96 | 55.4 Ų | 55.4 | 49% | 0.492 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.5 | -50.9 | -180 | -68.5 | 168 | 0 | 0 | 0 | 110.8 | I262 V263 Y268 T269 K270 | I262-I266 HydrophobicContact CG2-CD1 3.79Å; I262-I266 WeakPolarHBondContact O-CG1 3.5Å; I262-I266 PolarHBondContact O-N 3.34Å; V263-I266 PolarHBondContact O-N 3.2Å; I266-Y268 VanDerWaalsContact C-N 3.29Å; I266-Y268 PolarHBondContact O-N 2.9Å; I266-T269 PolarHBondContact O-N 2.97Å; I266-K270 VanDerWaalsContact O-CG 3.27Å; I266-K270 WeakPolarHBondContact O-CG 3.19Å; I266-K270 PolarHBondContact O-N 3.39Å |
| 267 | T | 82.6 | Confident | 80.9 | Confident | 16 Ų | 16 | 58 Ų | 58 | 10% | 0.098 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.7 | -39.3 | -179.4 | 48.8 | 0 | 0 | 0 | 0 | 111.5 | T174 V263 M264 L265 K270 I271 | T174-T267 HydrophobicContact CG2-CG2 4.32Å; T174-T267 WeakPolarHBondContact CG2-OG1 3.22Å; V263-T267 HydrophobicContact CG1-CG2 4.34Å; V263-T267 WeakPolarHBondContact O-CB 3.46Å; V263-T267 VanDerWaalsContact O-CG2 3.31Å; V263-T267 WeakPolarHBondContact O-CG2 3.37Å; V263-T267 PolarHBondContact O-N 3.16Å; V263-T267 PolarHBondContact O-OG1 3.02Å; M264-T267 WeakPolarHBondContact CA-OG1 3.49Å; M264-T267 PolarHBondContact O-OG1 3.48Å; L265-T267 PolarHBondContact O-N 2.89Å; T267-K270 PolarHBondContact O-N 2.93Å; T267-I271 WeakPolarHBondContact O-CG1 3.22Å; T267-I271 PolarHBondContact O-N 3.27Å |
| 268 | Y | 81.1 | Confident | 80 | Confident | 12 Ų | 12 | 59.9 Ų | 59.9 | 5% | 0.047 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -71.1 | -39.7 | 177 | -92.6 | -98.4 | 0 | 0 | 0 | 114.1 | T174 M264 L265 I266 K270 I271 L272 F348 S351 L352 I355 | T174-Y268 HydrophobicContact CG2-CD2 3.77Å; T174-Y268 HydrophobicContact CG2-CE2 3.46Å; T174-Y268 VanDerWaalsContact CG2-CE2 3.46Å; M264-Y268 WeakPolarHBondContact O-CB 3.46Å; M264-Y268 VanDerWaalsContact O-CD2 3.31Å; M264-Y268 WeakPolarHBondContact O-CD2 3.11Å; M264-Y268 PolarHBondContact O-N 3.18Å; L265-Y268 PolarHBondContact O-N 3.47Å; I266-Y268 VanDerWaalsContact C-N 3.29Å; I266-Y268 PolarHBondContact O-N 2.9Å; Y268-K270 PolarHBondContact O-N 3.38Å; Y268-I271 HydrophobicContact CD2-CD1 4.32Å; Y268-I271 HydrophobicContact CE2-CD1 4.26Å; Y268-I271 PolarHBondContact O-N 2.91Å; Y268-I271 VanDerWaalsContact O-N 3.15Å; Y268-L272 WeakPolarHBondContact O-CB 3.14Å; Y268-L272 WeakPolarHBondContact O-CG 3.32Å; Y268-L272 PolarHBondContact O-N 3.48Å; Y268-F348 AromaticContact CD1-CE2 3.73Å; Y268-F348 HydrophobicContact CD1-CE2 3.73Å; Y268-F348 HydrophobicContact CD1-CZ 4.06Å; Y268-F348 HydrophobicContact CE1-CD2 4.27Å; Y268-F348 AromaticContact CE1-CE2 3.55Å; Y268-F348 HydrophobicContact CE1-CE2 3.55Å; Y268-F348 HydrophobicContact CE1-CZ 4.14Å; Y268-S351 VanDerWaalsContact OH-C 3.23Å; Y268-S351 WeakPolarHBondContact OH-CB 3.43Å; Y268-S351 PolarHBondContact OH-O 3.23Å; Y268-L352 HydrophobicContact CD1-CD1 4.08Å; Y268-L352 HydrophobicContact CE1-CB 4.22Å; Y268-L352 HydrophobicContact CE1-CD1 4.23Å; Y268-I355 HydrophobicContact CD2-CD1 3.62Å; Y268-I355 HydrophobicContact CE1-CD1 4.05Å; Y268-I355 HydrophobicContact CE2-CD1 2.86Å; Y268-I355 HydrophobicContact CE2-CG1 4.34Å; Y268-I355 HydrophobicContact CG-CD1 4.45Å; Y268-I355 WeakPolarHBondContact OH-CD1 3.44Å |
| 269 | T | 83.9 | Confident | 78.8 | Confident | 71 Ų | 71 | 59 Ų | 59 | 44% | 0.436 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -56.7 | -43.1 | 171.7 | -55.5 | 0 | 0 | 0 | 0 | 110 | L265 I266 L272 Q273 | L265-T269 PolarHBondContact O-N 3.3Å; L265-T269 PolarHBondContact O-OG1 3.17Å; I266-T269 PolarHBondContact O-N 2.97Å; T269-L272 PolarHBondContact O-N 2.86Å; T269-Q273 WeakPolarHBondContact O-CB 3Å; T269-Q273 VanDerWaalsContact O-CG 3.25Å; T269-Q273 WeakPolarHBondContact O-CG 3.27Å; T269-Q273 PolarHBondContact O-N 2.92Å |
| 270 | K | 83.4 | Confident | 77.5 | Confident | 105 Ų | 105 | 54.8 Ų | 54.8 | 46% | 0.457 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67 | -38.4 | 176.6 | -63.5 | -69.8 | 175 | -178.8 | 0 | 112.7 | Y178 I266 T267 Y268 Q273 A274 | Y178-K270 HydrophobicContact CD2-CB 4.46Å; Y178-K270 HydrophobicContact CE2-CB 3.84Å; I266-K270 VanDerWaalsContact O-CG 3.27Å; I266-K270 WeakPolarHBondContact O-CG 3.19Å; I266-K270 PolarHBondContact O-N 3.39Å; T267-K270 PolarHBondContact O-N 2.93Å; Y268-K270 PolarHBondContact O-N 3.38Å; K270-Q273 PolarHBondContact O-N 3.41Å; K270-A274 WeakPolarHBondContact O-CB 3.36Å; K270-A274 PolarHBondContact O-N 3.37Å |
| 271 | I | 82.4 | Confident | 76.4 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.8 | -46.1 | 175.1 | -65.1 | 160.3 | 0 | 0 | 0 | 110.7 | R177 Y178 V182 T267 Y268 Q273 A274 L275 F348 | R177-I271 HydrophobicContact CB-CD1 4.25Å; Y178-I271 HydrophobicContact CD2-CG1 4.02Å; V182-I271 HydrophobicContact CG2-CG1 4.14Å; T267-I271 WeakPolarHBondContact O-CG1 3.22Å; T267-I271 PolarHBondContact O-N 3.27Å; Y268-I271 HydrophobicContact CD2-CD1 4.32Å; Y268-I271 HydrophobicContact CE2-CD1 4.26Å; Y268-I271 PolarHBondContact O-N 2.91Å; Y268-I271 VanDerWaalsContact O-N 3.15Å; I271-Q273 VanDerWaalsContact C-N 3.33Å; I271-Q273 PolarHBondContact O-N 3.44Å; I271-A274 PolarHBondContact O-N 3.22Å; I271-L275 HydrophobicContact CG2-CD1 3.91Å; I271-L275 HydrophobicContact CG2-CG 4.26Å; I271-L275 WeakPolarHBondContact O-CB 3.43Å; I271-L275 VanDerWaalsContact O-CG 3.3Å; I271-L275 WeakPolarHBondContact O-CG 3.2Å; I271-L275 PolarHBondContact O-N 2.85Å; I271-F348 HydrophobicContact CB-CD2 4.5Å; I271-F348 HydrophobicContact CB-CE2 3.94Å; I271-F348 HydrophobicContact CG2-CD2 3.38Å; I271-F348 HydrophobicContact CG2-CE2 3.21Å; I271-F348 HydrophobicContact CG2-CG 4.43Å; I271-F348 HydrophobicContact CG2-CZ 4.15Å |
| 272 | L | 81.1 | Confident | 74.9 | Confident | 80 Ų | 80 | 60.6 Ų | 60.6 | 42% | 0.419 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60 | -43.9 | 177.3 | -73.9 | 171.8 | 0 | 0 | 0 | 111.4 | Y268 T269 L275 N276 F348 | Y268-L272 WeakPolarHBondContact O-CB 3.14Å; Y268-L272 WeakPolarHBondContact O-CG 3.32Å; Y268-L272 PolarHBondContact O-N 3.48Å; T269-L272 PolarHBondContact O-N 2.86Å; L272-L275 PolarHBondContact O-N 3.48Å; L272-N276 WeakPolarHBondContact O-CB 3.29Å; L272-N276 PolarHBondContact O-N 3.24Å; L272-F348 HydrophobicContact CD2-CE1 3.68Å; L272-F348 HydrophobicContact CD2-CZ 3.44Å; L272-F348 VanDerWaalsContact CD2-CZ 3.44Å; L272-F348 HydrophobicContact CG-CZ 3.92Å |
| 273 | Q | 81.3 | Confident | 73.1 | Confident | 90 Ų | 90 | 63.6 Ų | 63.6 | 42% | 0.421 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60 | -48.7 | 173.5 | -75.1 | 174.5 | -10.2 | 0 | 0 | 111.5 | T269 K270 I271 L275 N276 I277 | T269-Q273 WeakPolarHBondContact O-CB 3Å; T269-Q273 VanDerWaalsContact O-CG 3.25Å; T269-Q273 WeakPolarHBondContact O-CG 3.27Å; T269-Q273 PolarHBondContact O-N 2.92Å; K270-Q273 PolarHBondContact O-N 3.41Å; I271-Q273 VanDerWaalsContact C-N 3.33Å; I271-Q273 PolarHBondContact O-N 3.44Å; Q273-L275 VanDerWaalsContact C-N 3.3Å; Q273-L275 PolarHBondContact O-N 2.72Å; Q273-N276 PolarHBondContact O-N 3.21Å; Q273-I277 HydrophobicContact CB-CD1 4.5Å; Q273-I277 WeakPolarHBondContact O-CB 3.21Å; Q273-I277 WeakPolarHBondContact O-CG1 3.32Å; Q273-I277 PolarHBondContact O-N 3.43Å |
| 274 | A | 76.8 | Confident | 71.5 | Confident | 19 Ų | 19 | 64.9 Ų | 64.9 | 16% | 0.157 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62 | -37 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V182 K270 I271 R278 | V182-A274 HydrophobicContact CB-CB 4.38Å; V182-A274 HydrophobicContact CG1-CB 4.4Å; V182-A274 HydrophobicContact CG2-CB 3.8Å; K270-A274 WeakPolarHBondContact O-CB 3.36Å; K270-A274 PolarHBondContact O-N 3.37Å; I271-A274 PolarHBondContact O-N 3.22Å; A274-R278 WeakPolarHBondContact O-CB 3.49Å; A274-R278 PolarHBondContact O-N 3.33Å |
| 275 | L | 73.6 | Confident | 70.1 | Confident | 29 Ų | 29 | 68.5 Ų | 68.5 | 15% | 0.152 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -67.2 | -43.8 | 175.2 | -71.6 | 173.2 | 0 | 0 | 0 | 111.7 | I271 L272 Q273 R278 I279 F348 | I271-L275 HydrophobicContact CG2-CD1 3.91Å; I271-L275 HydrophobicContact CG2-CG 4.26Å; I271-L275 WeakPolarHBondContact O-CB 3.43Å; I271-L275 VanDerWaalsContact O-CG 3.3Å; I271-L275 WeakPolarHBondContact O-CG 3.2Å; I271-L275 PolarHBondContact O-N 2.85Å; L272-L275 PolarHBondContact O-N 3.48Å; Q273-L275 VanDerWaalsContact C-N 3.3Å; Q273-L275 PolarHBondContact O-N 2.72Å; L275-R278 PolarHBondContact O-N 3.23Å; L275-I279 WeakPolarHBondContact O-CD1 3.49Å; L275-I279 VanDerWaalsContact O-CG1 3.25Å; L275-I279 WeakPolarHBondContact O-CG1 3.44Å; L275-I279 PolarHBondContact O-N 3.1Å; L275-F348 HydrophobicContact CD1-CB 4.33Å; L275-F348 HydrophobicContact CD1-CD1 3.55Å; L275-F348 HydrophobicContact CD1-CD2 3.91Å; L275-F348 HydrophobicContact CD1-CE1 3.77Å; L275-F348 HydrophobicContact CD1-CE2 4.11Å; L275-F348 HydrophobicContact CD1-CG 3.62Å; L275-F348 HydrophobicContact CD1-CZ 4.04Å |
| 276 | N | 71.6 | Confident | 68.4 | Low | 110 Ų | 110 | 65.8 Ų | 65.8 | 59% | 0.588 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -69.3 | -43.1 | 177.3 | -80.7 | -7.5 | 0 | 0 | 0 | 112.7 | L272 Q273 R278 I279 G280 | L272-N276 WeakPolarHBondContact O-CB 3.29Å; L272-N276 PolarHBondContact O-N 3.24Å; Q273-N276 PolarHBondContact O-N 3.21Å; N276-R278 VanDerWaalsContact C-N 3.28Å; N276-R278 PolarHBondContact O-N 2.8Å; N276-I279 CarbonylContact O-C 3.58Å; N276-I279 WeakPolarHBondContact O-CA 3.42Å; N276-I279 WeakPolarHBondContact O-CB 3.45Å; N276-I279 PolarHBondContact O-N 3.37Å; N276-G280 PolarHBondContact O-N 3.22Å |
| 277 | I | 61.2 | Low | 66.8 | Low | 105 Ų | 105 | 68.3 Ų | 68.3 | 54% | 0.538 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60.7 | -40.6 | 173.5 | -67.8 | 165.8 | 0 | 0 | 0 | 109.9 | Q273 I279 G280 T281 | Q273-I277 HydrophobicContact CB-CD1 4.5Å; Q273-I277 WeakPolarHBondContact O-CB 3.21Å; Q273-I277 WeakPolarHBondContact O-CG1 3.32Å; Q273-I277 PolarHBondContact O-N 3.43Å; I277-I279 PolarHBondContact O-N 2.89Å; I277-G280 PolarHBondContact O-N 3.36Å; I277-T281 HydrophobicContact CG2-CG2 3.71Å; I277-T281 VanDerWaalsContact O-CB 3.31Å; I277-T281 WeakPolarHBondContact O-CB 3.4Å; I277-T281 VanDerWaalsContact O-CG2 3.29Å; I277-T281 WeakPolarHBondContact O-CG2 3.39Å; I277-T281 PolarHBondContact O-N 3.02Å; I277-T281 PolarHBondContact O-OG1 3.07Å |
| 278 | R | 62.8 | Low | 65.1 | Low | 52 Ų | 52 | 74.7 Ų | 74.7 | 20% | 0.196 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -68.6 | -19.9 | 175.4 | -176.3 | 177.5 | -78.6 | -173.5 | 15.4 | 112.9 | S181 A274 L275 N276 R282 | S181-R278 PolarHBondContact O-NH2 3.21Å; A274-R278 WeakPolarHBondContact O-CB 3.49Å; A274-R278 PolarHBondContact O-N 3.33Å; L275-R278 PolarHBondContact O-N 3.23Å; N276-R278 VanDerWaalsContact C-N 3.28Å; N276-R278 PolarHBondContact O-N 2.8Å; R278-R282 VanDerWaalsContact CD-NH2 3.33Å; R278-R282 VanDerWaalsContact CG-NH2 3.33Å; R278-R282 WeakPolarHBondContact O-CD 3.44Å; R278-R282 WeakPolarHBondContact O-CG 3.47Å; R278-R282 PolarHBondContact O-NE 3.46Å; R278-R282 VanDerWaalsContact O-NE 3.08Å |
| 279 | I | 58.8 | Low | 63.6 | Low | 72 Ų | 72 | 81.9 Ų | 81.9 | 37% | 0.369 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -79.8 | -51.2 | 169.6 | -67.9 | 158.4 | 0 | 0 | 0 | 109.2 | L275 N276 I277 F283 | L275-I279 WeakPolarHBondContact O-CD1 3.49Å; L275-I279 VanDerWaalsContact O-CG1 3.25Å; L275-I279 WeakPolarHBondContact O-CG1 3.44Å; L275-I279 PolarHBondContact O-N 3.1Å; N276-I279 CarbonylContact O-C 3.58Å; N276-I279 WeakPolarHBondContact O-CA 3.42Å; N276-I279 WeakPolarHBondContact O-CB 3.45Å; N276-I279 PolarHBondContact O-N 3.37Å; I277-I279 PolarHBondContact O-N 2.89Å; I279-F283 HydrophobicContact CG2-CE2 4.07Å; I279-F283 WeakPolarHBondContact O-CD2 3.46Å |
| 280 | G | 56.8 | Low | 61.9 | Low | 41 Ų | 41 | 86.4 Ų | 86.4 | 42% | 0.423 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -67.2 | -44.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | N276 I277 R282 F283 S284 | N276-G280 PolarHBondContact O-N 3.22Å; I277-G280 PolarHBondContact O-N 3.36Å; G280-R282 VanDerWaalsContact C-N 3.26Å; G280-R282 PolarHBondContact O-N 3.09Å; G280-F283 PolarHBondContact O-N 3.06Å; G280-S284 PolarHBondContact O-N 2.86Å |
| 281 | T | 58 | Low | 60.2 | Low | 68 Ų | 68 | 84.3 Ų | 84.3 | 42% | 0.417 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.8 | -29.3 | 179.9 | 52.1 | 0 | 0 | 0 | 0 | 113 | I277 S284 T285 | I277-T281 HydrophobicContact CG2-CG2 3.71Å; I277-T281 VanDerWaalsContact O-CB 3.31Å; I277-T281 WeakPolarHBondContact O-CB 3.4Å; I277-T281 VanDerWaalsContact O-CG2 3.29Å; I277-T281 WeakPolarHBondContact O-CG2 3.39Å; I277-T281 PolarHBondContact O-N 3.02Å; I277-T281 PolarHBondContact O-OG1 3.07Å; T281-S284 PolarHBondContact O-N 3.43Å; T281-T285 PolarHBondContact O-N 3.03Å; T281-T285 PolarHBondContact O-OG1 3.46Å |
| 282 | R | 54 | Low | 58.4 | Low | 81 Ų | 81 | 93.8 Ų | 93.8 | 31% | 0.306 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -74.3 | -27.2 | 179.8 | -68.7 | -176.4 | -161.2 | -134.1 | 9.8 | 113.6 | R278 G280 G286 H337 R341 | R278-R282 VanDerWaalsContact CD-NH2 3.33Å; R278-R282 VanDerWaalsContact CG-NH2 3.33Å; R278-R282 WeakPolarHBondContact O-CD 3.44Å; R278-R282 WeakPolarHBondContact O-CG 3.47Å; R278-R282 PolarHBondContact O-NE 3.46Å; R278-R282 VanDerWaalsContact O-NE 3.08Å; G280-R282 VanDerWaalsContact C-N 3.26Å; G280-R282 PolarHBondContact O-N 3.09Å; R282-G286 PolarHBondContact O-N 3.09Å; R282-H337 PolarHBondContact NH1-CE1 3.4Å; R282-H337 PolarHBondContact NH1-NE2 3.16Å; R282-R341 VanDerWaalsContact CD-CZ 3.48Å; R282-R341 VanDerWaalsContact CZ-CZ 3.47Å; R282-R341 VanDerWaalsContact NH1-NE 3.19Å |
| 283 | F | 49.2 | Very low | 56.7 | Low | 159 Ų | 159 | 97.8 Ų | 97.8 | 70% | 0.697 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -72.5 | -39.7 | 170.9 | -72.8 | -75.5 | 0 | 0 | 0 | 110.8 | I279 G280 Q287 | I279-F283 HydrophobicContact CG2-CE2 4.07Å; I279-F283 WeakPolarHBondContact O-CD2 3.46Å; G280-F283 PolarHBondContact O-N 3.06Å; F283-Q287 PolarHBondContact O-N 3.01Å |
| 284 | S | 50 | Low | 54.9 | Low | 57 Ų | 57 | 101.7 Ų | 101.7 | 40% | 0.399 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69.4 | -44.4 | 179.2 | -167.2 | 0 | 0 | 0 | 0 | 113.4 | G280 T281 G286 Q287 K288 | G280-S284 PolarHBondContact O-N 2.86Å; T281-S284 PolarHBondContact O-N 3.43Å; S284-G286 VanDerWaalsContact C-N 3.34Å; S284-G286 PolarHBondContact O-N 3.1Å; S284-Q287 PolarHBondContact O-N 3.21Å; S284-K288 PolarHBondContact O-N 3.45Å |
| 285 | T | 52.1 | Low | 53.2 | Low | 79 Ų | 79 | 109 Ų | 109 | 49% | 0.485 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -72 | -27.5 | -179.4 | -44.8 | 0 | 0 | 0 | 0 | 112.9 | T281 K289 | T281-T285 PolarHBondContact O-N 3.03Å; T281-T285 PolarHBondContact O-OG1 3.46Å; T285-K289 PolarHBondContact O-N 2.74Å |
| 286 | G | 51.5 | Low | 51.4 | Low | 40 Ų | 40 | 113.1 Ų | 113.1 | 41% | 0.412 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -68.8 | -34.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | R282 S284 | R282-G286 PolarHBondContact O-N 3.09Å; S284-G286 VanDerWaalsContact C-N 3.34Å; S284-G286 PolarHBondContact O-N 3.1Å |
| 287 | Q | 50.5 | Low | 50.1 | Low | 149 Ų | 149 | 114.9 Ų | 114.9 | 70% | 0.696 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -76.6 | -41.4 | 173.1 | -75.9 | -171.4 | -14.8 | 0 | 0 | 112.3 | F283 S284 K289 K290 A291 | F283-Q287 PolarHBondContact O-N 3.01Å; S284-Q287 PolarHBondContact O-N 3.21Å; Q287-K289 VanDerWaalsContact C-N 3.32Å; Q287-K289 PolarHBondContact O-N 3.08Å; Q287-K290 PolarHBondContact O-N 2.94Å; Q287-A291 PolarHBondContact O-N 3.13Å |
| 288 | K | 47.9 | Very low | 49.2 | Very low | 149 Ų | 149 | 113.7 Ų | 113.7 | 65% | 0.648 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61.6 | -34.4 | 178.6 | -72.5 | -175 | 179.7 | -174.2 | 0 | 113.4 | S284 A291 R292 | S284-K288 PolarHBondContact O-N 3.45Å; K288-A291 PolarHBondContact O-N 3.2Å; K288-R292 PolarHBondContact O-N 3.05Å; K288-R292 VanDerWaalsContact O-N 3.07Å |
| 289 | K | 48.8 | Very low | 48.1 | Very low | 163 Ų | 163 | 118.8 Ų | 118.8 | 71% | 0.709 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -70.8 | -30.4 | 173.3 | -77.3 | -171.5 | 176.3 | -173.2 | 0 | 113.6 | T285 Q287 K293 | T285-K289 PolarHBondContact O-N 2.74Å; Q287-K289 VanDerWaalsContact C-N 3.32Å; Q287-K289 PolarHBondContact O-N 3.08Å; K289-K293 PolarHBondContact O-N 3.33Å |
| 290 | K | 48.5 | Very low | 47.2 | Very low | 167 Ų | 167 | 122.2 Ų | 122.2 | 73% | 0.726 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -73.3 | -36.6 | 173.3 | -72.3 | -175.8 | 178.2 | -173.4 | 0 | 111.9 | Q287 K294 | Q287-K290 PolarHBondContact O-N 2.94Å; K290-K294 PolarHBondContact O-N 2.79Å |
| 291 | A | 47.2 | Very low | 46 | Very low | 61 Ų | 61 | 127.3 Ų | 127.3 | 50% | 0.504 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -68.2 | -40.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q287 K288 K294 K295 | Q287-A291 PolarHBondContact O-N 3.13Å; K288-A291 PolarHBondContact O-N 3.2Å; A291-K294 PolarHBondContact O-N 3.27Å; A291-K295 PolarHBondContact O-N 2.77Å |
| 292 | R | 45 | Very low | 44.8 | Very low | 198 Ų | 198 | 132 Ų | 132 | 75% | 0.747 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -68.9 | -34.3 | 178.6 | -165.5 | 170.3 | 171.9 | 174.1 | -3.3 | 112.8 | K288 K294 K295 T296 | K288-R292 PolarHBondContact O-N 3.05Å; K288-R292 VanDerWaalsContact O-N 3.07Å; R292-K294 VanDerWaalsContact C-N 3.28Å; R292-K294 PolarHBondContact O-N 3.4Å; R292-K295 PolarHBondContact O-N 2.77Å; R292-T296 PolarHBondContact O-N 3.02Å; R292-T296 PolarHBondContact O-OG1 2.96Å |
| 293 | K | 44.8 | Very low | 43.7 | Very low | 164 Ų | 164 | 135.6 Ų | 135.6 | 71% | 0.713 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -71.6 | -20.9 | 175.2 | -150.1 | 178.1 | -174.8 | -173.6 | 0 | 113.3 | K289 | K289-K293 PolarHBondContact O-N 3.33Å |
| 294 | K | 44.1 | Very low | 42.7 | Very low | 172 Ų | 172 | 134.8 Ų | 134.8 | 75% | 0.748 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -81.9 | -26.6 | 175 | -145.4 | 178.6 | -176.7 | -171.7 | 0 | 112.6 | K290 A291 R292 S298 | K290-K294 PolarHBondContact O-N 2.79Å; A291-K294 PolarHBondContact O-N 3.27Å; R292-K294 VanDerWaalsContact C-N 3.28Å; R292-K294 PolarHBondContact O-N 3.4Å; K294-S298 PolarHBondContact O-OG 2.68Å; K294-S298 VanDerWaalsContact O-OG 3.12Å |
| 295 | K | 40.9 | Very low | 42.2 | Very low | 172 Ų | 172 | 137.9 Ų | 137.9 | 75% | 0.748 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -85.3 | -19.9 | 177.6 | -81.6 | -169 | 172.7 | -169.3 | 0 | 115.1 | A291 R292 I297 | A291-K295 PolarHBondContact O-N 2.77Å; R292-K295 PolarHBondContact O-N 2.77Å; K295-I297 VanDerWaalsContact C-N 3.32Å |
| 296 | T | 34.9 | Very low | 41 | Very low | 116 Ų | 116 | 141.7 Ų | 141.7 | 71% | 0.712 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84 | -4.4 | 177.4 | -50.3 | 0 | 0 | 0 | 0 | 113.2 | R292 | R292-T296 PolarHBondContact O-N 3.02Å; R292-T296 PolarHBondContact O-OG1 2.96Å |
| 297 | I | 45.5 | Very low | 40.2 | Very low | 147 Ų | 147 | 147.3 Ų | 147.3 | 75% | 0.754 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.9 | 7.9 | 179.1 | -58.9 | 174.7 | 0 | 0 | 0 | 111.5 | K295 | K295-I297 VanDerWaalsContact C-N 3.32Š|
| 298 | S | 41.5 | Very low | 39.4 | Very low | 80 Ų | 80 | 145 Ų | 145 | 56% | 0.559 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -123.3 | 24.7 | -172 | 22 | 0 | 0 | 0 | 0 | 114.5 | K294 | K294-S298 PolarHBondContact O-OG 2.68Å; K294-S298 VanDerWaalsContact O-OG 3.12Å |
| 299 | L | 40.4 | Very low | 38.7 | Very low | 159 Ų | 159 | 147.1 Ų | 147.1 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | trans | -141.2 | 67.8 | 178.1 | -141.7 | 84.6 | 0 | 0 | 0 | 112.9 | ||||
| 300 | T | 39.7 | Very low | 38.3 | Very low | 144 Ų | 144 | 143.4 Ų | 143.4 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | trans | -164.9 | 81.1 | 152.8 | 10.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 301 | T | 32.5 | Very low | 37.8 | Very low | 148 Ų | 148 | 141.5 Ų | 141.5 | 91% | 0.908 | 77% | 0.773 | S | S | * | * | trans | -153.5 | 102.2 | 154.3 | -39.3 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 302 | Q | 31.4 | Very low | 37.3 | Very low | 167 Ų | 167 | 142.1 Ų | 142.1 | 78% | 0.78 | 79% | 0.786 | S | S | * | * | trans | -144.6 | 103.6 | 157.9 | -156.3 | 169.4 | -1.3 | 0 | 0 | 108.9 | ||||
| 303 | E | 30.4 | Very low | 36.9 | Very low | 157 Ų | 157 | 136.5 Ų | 136.5 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | 63.4 | 117.3 | 139.5 | -66.1 | 176.4 | 144.1 | 0 | 0 | 120.3 | ||||
| 304 | T | 28.7 | Very low | 36.4 | Very low | 141 Ų | 141 | 139.8 Ų | 139.8 | 87% | 0.865 | 80% | 0.797 | S | S | * | * | -171 | 150.1 | 102.2 | 37.9 | 0 | 0 | 0 | 0 | 111 | |||||
| 305 | T | 39.4 | Very low | 35.9 | Very low | 123 Ų | 123 | 139.1 Ų | 139.1 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -56 | 141.8 | -178 | 42.1 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 306 | D | 27.3 | Very low | 35.8 | Very low | 158 Ų | 158 | 136.5 Ų | 136.5 | 85% | 0.845 | 80% | 0.8 | S | S | * | * | 175 | 170.3 | 114.1 | -98.1 | -19.1 | 0 | 0 | 0 | 114.4 | |||||
| 307 | M | 34.1 | Very low | 35.9 | Very low | 159 Ų | 159 | 136.6 Ų | 136.6 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | trans | -80.6 | 156.2 | -148.2 | -154.9 | 48.1 | 57.2 | 0 | 0 | 117.1 | ||||
| 308 | S | 33.8 | Very low | 35.7 | Very low | 101 Ų | 101 | 138.2 Ų | 138.2 | 71% | 0.706 | 80% | 0.802 | S | S | * | * | trans | 90.5 | 140.2 | 146.4 | 78.8 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 309 | Q | 32.9 | Very low | 35.8 | Very low | 193 Ų | 193 | 136.8 Ų | 136.8 | 90% | 0.902 | 80% | 0.8 | S | S | * | * | trans | 78.5 | 103.8 | 162.5 | -62.3 | -167.3 | 1.1 | 0 | 0 | 119.3 | ||||
| 310 | G | 41.6 | Very low | 36.5 | Very low | 85 Ų | 85 | 134.3 Ų | 134.3 | 88% | 0.876 | 79% | 0.791 | S | S | * | * | trans | -82.2 | 130.2 | 163.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 311 | S | 36.9 | Very low | 37.2 | Very low | 126 Ų | 126 | 138.8 Ų | 138.8 | 88% | 0.881 | 79% | 0.792 | S | S | * | * | trans | -168 | 135.7 | 138.8 | -172 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 312 | G | 36.4 | Very low | 38.6 | Very low | 75 Ų | 75 | 135.2 Ų | 135.2 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | trans | 94.1 | 98.8 | 159.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 313 | G | 37.7 | Very low | 41 | Very low | 79 Ų | 79 | 130.3 Ų | 130.3 | 81% | 0.814 | 75% | 0.754 | S | S | * | * | 100 | 131 | 126 | 0 | 0 | 0 | 0 | 0 | 118.5 | |||||
| 314 | R | 34.5 | Very low | 43.5 | Very low | 233 Ų | 233 | 127.8 Ų | 127.8 | 88% | 0.879 | 75% | 0.749 | S | S | * | * | trans | 76.5 | 87.8 | 160.3 | -70.3 | 177 | 155.7 | 137 | -4.9 | 117 | V316 | R314-V316 VanDerWaalsContact C-N 3.33Å; R314-V316 PolarHBondContact O-N 3.35Å | ||
| 315 | N | 33.8 | Very low | 46 | Very low | 159 Ų | 159 | 125.4 Ų | 125.4 | 85% | 0.85 | 74% | 0.738 | S | S | * | * | trans | -46 | 99.3 | 135.7 | -80.9 | -50.4 | 0 | 0 | 0 | 109.7 | V317 | N315-V317 HydrophobicContact CB-CG2 4.36Å; N315-V317 PolarHBondContact O-N 3.24Å | ||
| 316 | V | 37.5 | Very low | 48.2 | Very low | 116 Ų | 116 | 123 Ų | 123 | 70% | 0.703 | 72% | 0.723 | S | S | * | * | trans | -76.4 | 75.2 | 163.8 | -175.5 | 0 | 0 | 0 | 0 | 106.9 | R314 F318 | R314-V316 VanDerWaalsContact C-N 3.33Å; R314-V316 PolarHBondContact O-N 3.35Å; V316-F318 VanDerWaalsContact C-N 3.31Å; V316-F318 HydrophobicContact CG1-CD2 4.21Å; V316-F318 PolarHBondContact O-N 3.22Å | ||
| 317 | V | 38.5 | Very low | 50.9 | Low | 119 Ų | 119 | 118.5 Ų | 118.5 | 72% | 0.721 | 70% | 0.698 | S | S | * | * | trans | -64.6 | 101.9 | 158.4 | 174.6 | 0 | 0 | 0 | 0 | 104.9 | N315 G319 | N315-V317 HydrophobicContact CB-CG2 4.36Å; N315-V317 PolarHBondContact O-N 3.24Å; V317-G319 PolarHBondContact O-N 3.22Å | ||
| 318 | F | 40.8 | Very low | 53.4 | Low | 181 Ų | 181 | 114.2 Ų | 114.2 | 79% | 0.794 | 68% | 0.678 | S | S | * | * | trans | -70.2 | 63 | 167.1 | -138.4 | -87.6 | 0 | 0 | 0 | 108.4 | V316 V320 | V316-F318 VanDerWaalsContact C-N 3.31Å; V316-F318 HydrophobicContact CG1-CD2 4.21Å; V316-F318 PolarHBondContact O-N 3.22Å; F318-V320 VanDerWaalsContact C-N 3.33Å; F318-V320 HydrophobicContact CD1-CG2 4.12Å; F318-V320 PolarHBondContact O-N 3.39Å | ||
| 319 | G | 43.9 | Very low | 56 | Low | 50 Ų | 50 | 112 Ų | 112 | 52% | 0.515 | 67% | 0.665 | S | S | . | * | trans | -67.9 | 97.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 105.8 | V317 R321 | V317-G319 PolarHBondContact O-N 3.22Å; G319-R321 PolarHBondContact O-N 3.48Å | ||
| 320 | V | 54.2 | Low | 58.5 | Low | 107 Ų | 107 | 108 Ų | 108 | 65% | 0.648 | 65% | 0.65 | S | S | * | * | trans | -64.9 | 79.7 | 167.5 | -174.3 | 0 | 0 | 0 | 0 | 106.5 | F318 T322 | F318-V320 VanDerWaalsContact C-N 3.33Å; F318-V320 HydrophobicContact CD1-CG2 4.12Å; F318-V320 PolarHBondContact O-N 3.39Å; V320-T322 HydrophobicContact CG1-CG2 3.77Å; V320-T322 PolarHBondContact O-N 3.4Å | ||
| 321 | R | 55.2 | Low | 60.7 | Low | 238 Ų | 238 | 112.6 Ų | 112.6 | 90% | 0.898 | 64% | 0.641 | S | S | * | * | trans | -67.2 | 80 | 159.8 | -81.8 | -175.9 | 171 | -172.2 | -1.6 | 104.9 | G319 S323 | G319-R321 PolarHBondContact O-N 3.48Å; R321-S323 PolarHBondContact O-N 3.46Å | ||
| 322 | T | 62.6 | Low | 63.1 | Low | 73 Ų | 73 | 114.3 Ų | 114.3 | 45% | 0.448 | 63% | 0.628 | S | S | . | * | trans | -52.6 | 112.2 | 166.3 | 42.1 | 0 | 0 | 0 | 0 | 106 | V320 V324 I327 | V320-T322 HydrophobicContact CG1-CG2 3.77Å; V320-T322 PolarHBondContact O-N 3.4Å; T322-V324 PolarHBondContact O-N 3.36Å; T322-I327 WeakPolarHBondContact O-CD1 3.47Å | ||
| 323 | S | 80.8 | Confident | 65.4 | Low | 63 Ų | 63 | 113 Ų | 113 | 44% | 0.441 | 61% | 0.61 | S | S | . | * | trans | -53.4 | 144.2 | -176.2 | 53.7 | 0 | 0 | 0 | 0 | 109.6 | R321 S325 V326 I327 | R321-S323 PolarHBondContact O-N 3.46Å; S323-S325 PolarHBondContact O-N 3.36Å; S323-V326 WeakPolarHBondContact O-CA 3.36Å; S323-V326 WeakPolarHBondContact O-CB 3.35Å; S323-V326 PolarHBondContact O-N 3.38Å; S323-V326 VanDerWaalsContact OG-CG2 3.28Å; S323-V326 WeakPolarHBondContact OG-CG2 3.26Å; S323-I327 PolarHBondContact O-N 3.38Å; S323-I327 VanDerWaalsContact O-N 3.09Å | ||
| 324 | V | 82.8 | Confident | 67.7 | Low | 105 Ų | 105 | 113.4 Ų | 113.4 | 64% | 0.636 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -51.1 | -34.9 | -178.6 | 176.2 | 0 | 0 | 0 | 0 | 110.8 | T322 I327 I328 | T322-V324 PolarHBondContact O-N 3.36Å; V324-I327 PolarHBondContact O-N 3.29Å; V324-I328 HydrophobicContact CG1-CD1 3.74Å; V324-I328 HydrophobicContact CG1-CG1 4.3Å; V324-I328 WeakPolarHBondContact O-CB 3.27Å; V324-I328 VanDerWaalsContact O-CG1 3.24Å; V324-I328 WeakPolarHBondContact O-CG1 3.46Å; V324-I328 PolarHBondContact O-N 3.31Å |
| 325 | S | 81.1 | Confident | 70.2 | Confident | 90 Ų | 90 | 108.8 Ų | 108.8 | 63% | 0.629 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -60.3 | -42.6 | 173.2 | -52.9 | 0 | 0 | 0 | 0 | 114 | S323 I328 A329 | S323-S325 PolarHBondContact O-N 3.36Å; S325-I328 PolarHBondContact O-N 3.47Å; S325-A329 VanDerWaalsContact O-CB 3.25Å; S325-A329 WeakPolarHBondContact O-CB 3.46Å; S325-A329 PolarHBondContact O-N 3.19Å |
| 326 | V | 85.1 | Confident | 72.4 | Confident | 73 Ų | 73 | 107.9 Ų | 107.9 | 44% | 0.442 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.4 | -41.4 | 175.3 | 172.1 | 0 | 0 | 0 | 0 | 110.4 | S323 I328 A329 L330 | S323-V326 WeakPolarHBondContact O-CA 3.36Å; S323-V326 WeakPolarHBondContact O-CB 3.35Å; S323-V326 PolarHBondContact O-N 3.38Å; S323-V326 VanDerWaalsContact OG-CG2 3.28Å; S323-V326 WeakPolarHBondContact OG-CG2 3.26Å; V326-I328 PolarHBondContact O-N 2.67Å; V326-A329 PolarHBondContact O-N 3.45Å; V326-L330 WeakPolarHBondContact O-CB 3.36Å; V326-L330 PolarHBondContact O-N 2.96Å |
| 327 | I | 84.7 | Confident | 74.3 | Confident | 63 Ų | 63 | 106.1 Ų | 106.1 | 32% | 0.323 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.2 | -45.7 | 176.4 | -60.9 | 173.7 | 0 | 0 | 0 | 110.4 | T322 S323 V324 L330 R331 | T322-I327 WeakPolarHBondContact O-CD1 3.47Å; S323-I327 PolarHBondContact O-N 3.38Å; S323-I327 VanDerWaalsContact O-N 3.09Å; V324-I327 PolarHBondContact O-N 3.29Å; I327-L330 PolarHBondContact O-N 3.45Å; I327-R331 HydrophobicContact CG2-CG 4.46Å; I327-R331 WeakPolarHBondContact O-CB 3.48Å; I327-R331 VanDerWaalsContact O-CG 3.28Å; I327-R331 WeakPolarHBondContact O-CG 3.31Å; I327-R331 PolarHBondContact O-N 2.91Å |
| 328 | I | 86.3 | Confident | 76.3 | Confident | 70 Ų | 70 | 109 Ų | 109 | 36% | 0.359 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.4 | -45.3 | 177.8 | -69.2 | 169 | 0 | 0 | 0 | 110.7 | V324 S325 V326 L330 R331 R332 | V324-I328 HydrophobicContact CG1-CD1 3.74Å; V324-I328 HydrophobicContact CG1-CG1 4.3Å; V324-I328 WeakPolarHBondContact O-CB 3.27Å; V324-I328 VanDerWaalsContact O-CG1 3.24Å; V324-I328 WeakPolarHBondContact O-CG1 3.46Å; V324-I328 PolarHBondContact O-N 3.31Å; S325-I328 PolarHBondContact O-N 3.47Å; V326-I328 PolarHBondContact O-N 2.67Å; I328-L330 VanDerWaalsContact C-N 3.34Å; I328-L330 PolarHBondContact O-N 3.42Å; I328-R331 PolarHBondContact O-N 3.11Å; I328-R332 HydrophobicContact CG2-CG 4.43Å; I328-R332 WeakPolarHBondContact O-CB 3.33Å; I328-R332 VanDerWaalsContact O-CG 3.29Å; I328-R332 WeakPolarHBondContact O-CG 3.45Å; I328-R332 PolarHBondContact O-N 3.34Å |
| 329 | A | 87.9 | Confident | 78.1 | Confident | 53 Ų | 53 | 104.2 Ų | 104.2 | 44% | 0.438 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61 | -43.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S325 V326 R332 A333 | S325-A329 VanDerWaalsContact O-CB 3.25Å; S325-A329 WeakPolarHBondContact O-CB 3.46Å; S325-A329 PolarHBondContact O-N 3.19Å; V326-A329 PolarHBondContact O-N 3.45Å; A329-R332 PolarHBondContact O-N 3.23Å; A329-A333 WeakPolarHBondContact O-CB 3.32Å; A329-A333 PolarHBondContact O-N 3.4Å |
| 330 | L | 87.5 | Confident | 79.6 | Confident | 111 Ų | 111 | 109.5 Ų | 109.5 | 58% | 0.581 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -68.7 | -41.6 | 178.9 | -159.1 | 141.4 | 0 | 0 | 0 | 111.2 | V326 I327 I328 R332 A333 V334 | V326-L330 WeakPolarHBondContact O-CB 3.36Å; V326-L330 PolarHBondContact O-N 2.96Å; I327-L330 PolarHBondContact O-N 3.45Å; I328-L330 VanDerWaalsContact C-N 3.34Å; I328-L330 PolarHBondContact O-N 3.42Å; L330-R332 PolarHBondContact O-N 2.94Å; L330-A333 PolarHBondContact O-N 2.99Å; L330-V334 HydrophobicContact CD2-CG2 4.01Å; L330-V334 WeakPolarHBondContact O-CB 3.25Å; L330-V334 VanDerWaalsContact O-CG2 3.23Å; L330-V334 WeakPolarHBondContact O-CG2 3.06Å; L330-V334 PolarHBondContact O-N 3.04Å |
| 331 | R | 85.8 | Confident | 80.6 | Confident | 181 Ų | 181 | 108.4 Ų | 108.4 | 68% | 0.683 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.9 | -43.7 | 171.4 | -75.9 | -180 | -176 | -162.4 | 2.9 | 111.7 | I327 I328 V334 K335 | I327-R331 HydrophobicContact CG2-CG 4.46Å; I327-R331 WeakPolarHBondContact O-CB 3.48Å; I327-R331 VanDerWaalsContact O-CG 3.28Å; I327-R331 WeakPolarHBondContact O-CG 3.31Å; I327-R331 PolarHBondContact O-N 2.91Å; I328-R331 PolarHBondContact O-N 3.11Å; R331-V334 PolarHBondContact O-N 3.43Å; R331-K335 VanDerWaalsContact O-CB 3.23Å; R331-K335 WeakPolarHBondContact O-CB 3.09Å; R331-K335 PolarHBondContact O-N 3.37Å |
| 332 | R | 87.9 | Confident | 81.7 | Confident | 162 Ų | 162 | 100.3 Ų | 100.3 | 61% | 0.611 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.1 | -40.4 | 175.9 | -73.1 | 176 | -173 | 168.4 | 3.7 | 111.9 | I328 A329 L330 R336 | I328-R332 HydrophobicContact CG2-CG 4.43Å; I328-R332 WeakPolarHBondContact O-CB 3.33Å; I328-R332 VanDerWaalsContact O-CG 3.29Å; I328-R332 WeakPolarHBondContact O-CG 3.45Å; I328-R332 PolarHBondContact O-N 3.34Å; A329-R332 PolarHBondContact O-N 3.23Å; L330-R332 PolarHBondContact O-N 2.94Å; R332-R336 WeakPolarHBondContact O-CB 3.32Å; R332-R336 WeakPolarHBondContact O-CG 3.38Å; R332-R336 PolarHBondContact O-N 2.84Å |
| 333 | A | 86.1 | Confident | 82.3 | Confident | 47 Ų | 47 | 104.6 Ų | 104.6 | 39% | 0.388 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.6 | -45.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A329 L330 R336 H337 | A329-A333 WeakPolarHBondContact O-CB 3.32Å; A329-A333 PolarHBondContact O-N 3.4Å; L330-A333 PolarHBondContact O-N 2.99Å; A333-R336 PolarHBondContact O-N 3.13Å; A333-H337 VanDerWaalsContact O-CB 3.28Å; A333-H337 WeakPolarHBondContact O-CB 3.38Å; A333-H337 PolarHBondContact O-N 2.89Å |
| 334 | V | 85.3 | Confident | 82 | Confident | 88 Ų | 88 | 104.5 Ų | 104.5 | 53% | 0.533 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.9 | -43.4 | 175.3 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | L330 R331 H337 R338 | L330-V334 HydrophobicContact CD2-CG2 4.01Å; L330-V334 WeakPolarHBondContact O-CB 3.25Å; L330-V334 VanDerWaalsContact O-CG2 3.23Å; L330-V334 WeakPolarHBondContact O-CG2 3.06Å; L330-V334 PolarHBondContact O-N 3.04Å; R331-V334 PolarHBondContact O-N 3.43Å; V334-H337 PolarHBondContact O-N 2.9Å; V334-R338 WeakPolarHBondContact O-CB 3.03Å; V334-R338 PolarHBondContact O-N 2.73Å |
| 335 | K | 85.9 | Confident | 81.7 | Confident | 136 Ų | 136 | 104.8 Ų | 104.8 | 59% | 0.591 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.1 | -51.6 | 175.8 | -176.5 | 177.4 | 177.5 | -178.3 | 0 | 111.7 | R331 H337 R338 E339 | R331-K335 VanDerWaalsContact O-CB 3.23Å; R331-K335 WeakPolarHBondContact O-CB 3.09Å; R331-K335 PolarHBondContact O-N 3.37Å; K335-H337 VanDerWaalsContact C-N 3.25Å; K335-H337 PolarHBondContact O-N 3.29Å; K335-R338 PolarHBondContact O-N 3.05Å; K335-E339 WeakPolarHBondContact CE-OE1 3.48Å; K335-E339 WeakPolarHBondContact CG-OE1 3.41Å; K335-E339 WeakPolarHBondContact O-CG 3.43Å; K335-E339 PolarHBondContact O-N 2.65Å |
| 336 | R | 80.6 | Confident | 81.6 | Confident | 140 Ų | 140 | 103 Ų | 103 | 53% | 0.528 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -56 | -41.5 | 176 | -84.4 | -174.8 | -84.7 | 154.5 | -8.4 | 111.8 | R332 A333 R340 | R332-R336 WeakPolarHBondContact O-CB 3.32Å; R332-R336 WeakPolarHBondContact O-CG 3.38Å; R332-R336 PolarHBondContact O-N 2.84Å; A333-R336 PolarHBondContact O-N 3.13Å; R336-R340 VanDerWaalsContact O-CG 3.31Å; R336-R340 WeakPolarHBondContact O-CG 3.39Å; R336-R340 PolarHBondContact O-N 2.88Å |
| 337 | H | 76.7 | Confident | 81.2 | Confident | 78 Ų | 78 | 102 Ų | 102 | 36% | 0.361 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -70.7 | -40.5 | 179.6 | -176.8 | -115.7 | 0 | 0 | 0 | 113 | R282 A333 V334 K335 R340 R341 | R282-H337 PolarHBondContact NH1-CE1 3.4Å; R282-H337 PolarHBondContact NH1-NE2 3.16Å; A333-H337 VanDerWaalsContact O-CB 3.28Å; A333-H337 WeakPolarHBondContact O-CB 3.38Å; A333-H337 PolarHBondContact O-N 2.89Å; V334-H337 PolarHBondContact O-N 2.9Å; K335-H337 VanDerWaalsContact C-N 3.25Å; K335-H337 PolarHBondContact O-N 3.29Å; H337-R340 PolarHBondContact O-N 3.47Å; H337-R341 PolarHBondContact CE1-NE 3.44Å; H337-R341 VanDerWaalsContact CE1-NE 3.35Å; H337-R341 PolarHBondContact CE1-NH2 3.02Å; H337-R341 VanDerWaalsContact CE1-NH2 3.27Å; H337-R341 PolarHBondContact O-N 2.7Å; H337-R341 VanDerWaalsContact O-N 3.1Å |
| 338 | R | 80.9 | Confident | 80.9 | Confident | 179 Ų | 179 | 100 Ų | 100 | 68% | 0.675 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -59.9 | -47.8 | 172.2 | -175.8 | 178.7 | -179 | -177 | 1.8 | 110.5 | V334 K335 R340 R341 E342 | V334-R338 WeakPolarHBondContact O-CB 3.03Å; V334-R338 PolarHBondContact O-N 2.73Å; K335-R338 PolarHBondContact O-N 3.05Å; R338-R340 VanDerWaalsContact C-N 3.34Å; R338-R340 PolarHBondContact O-N 3.1Å; R338-R341 PolarHBondContact O-N 3.24Å; R338-R341 VanDerWaalsContact O-N 3.15Å; R338-E342 HydrophobicContact CG-CG 4.43Å; R338-E342 WeakPolarHBondContact O-CG 3.18Å; R338-E342 PolarHBondContact O-N 3.39Å |
| 339 | E | 78 | Confident | 80.6 | Confident | 81 Ų | 81 | 101.4 Ų | 101.4 | 38% | 0.379 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -59.6 | -41.6 | 178 | -73.4 | 177 | -169.3 | 0 | 0 | 112.6 | K335 E342 R343 | K335-E339 WeakPolarHBondContact CE-OE1 3.48Å; K335-E339 WeakPolarHBondContact CG-OE1 3.41Å; K335-E339 WeakPolarHBondContact O-CG 3.43Å; K335-E339 PolarHBondContact O-N 2.65Å; E339-E342 PolarHBondContact O-N 2.84Å; E339-R343 VanDerWaalsContact O-CG 3.28Å; E339-R343 WeakPolarHBondContact O-CG 3.18Å; E339-R343 PolarHBondContact O-N 3.4Å |
| 340 | R | 76.6 | Confident | 80.3 | Confident | 162 Ų | 162 | 99.9 Ų | 99.9 | 61% | 0.611 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -60.2 | -44.3 | 174.1 | -74.5 | 173.8 | -176.7 | 173.4 | -0.7 | 111.9 | R336 H337 R338 R343 Q344 | R336-R340 VanDerWaalsContact O-CG 3.31Å; R336-R340 WeakPolarHBondContact O-CG 3.39Å; R336-R340 PolarHBondContact O-N 2.88Å; H337-R340 PolarHBondContact O-N 3.47Å; R338-R340 VanDerWaalsContact C-N 3.34Å; R338-R340 PolarHBondContact O-N 3.1Å; R340-R343 PolarHBondContact O-N 2.74Å; R340-Q344 WeakPolarHBondContact O-CG 3.42Å; R340-Q344 PolarHBondContact O-N 3.38Å |
| 341 | R | 74.9 | Confident | 80 | Confident | 83 Ų | 83 | 94.6 Ų | 94.6 | 31% | 0.313 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -65.9 | -42.6 | 177.6 | -68.6 | -163 | -160.3 | -171.5 | 18.6 | 112.6 | R282 H337 R338 R343 Q344 K345 | R282-R341 VanDerWaalsContact CD-CZ 3.48Å; R282-R341 VanDerWaalsContact CZ-CZ 3.47Å; R282-R341 VanDerWaalsContact NH1-NE 3.19Å; H337-R341 PolarHBondContact CE1-NE 3.44Å; H337-R341 VanDerWaalsContact CE1-NE 3.35Å; H337-R341 PolarHBondContact CE1-NH2 3.02Å; H337-R341 VanDerWaalsContact CE1-NH2 3.27Å; H337-R341 PolarHBondContact O-N 2.7Å; H337-R341 VanDerWaalsContact O-N 3.1Å; R338-R341 PolarHBondContact O-N 3.24Å; R338-R341 VanDerWaalsContact O-N 3.15Å; R341-R343 VanDerWaalsContact C-N 3.28Å; R341-R343 PolarHBondContact O-N 3.37Å; R341-Q344 PolarHBondContact O-N 2.9Å; R341-K345 WeakPolarHBondContact O-CG 3.17Å; R341-K345 PolarHBondContact O-N 2.66Å |
| 342 | E | 77.7 | Confident | 79.8 | Confident | 68 Ų | 68 | 89.8 Ų | 89.8 | 32% | 0.318 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.1 | -38.3 | 177.3 | -71.5 | -58 | 144.2 | 0 | 0 | 111.6 | R338 E339 R346 | R338-E342 HydrophobicContact CG-CG 4.43Å; R338-E342 WeakPolarHBondContact O-CG 3.18Å; R338-E342 PolarHBondContact O-N 3.39Å; E339-E342 PolarHBondContact O-N 2.84Å; E342-R346 VanDerWaalsContact O-CB 3.31Å; E342-R346 WeakPolarHBondContact O-CB 3.17Å; E342-R346 PolarHBondContact O-N 2.91Å |
| 343 | R | 76.3 | Confident | 79.8 | Confident | 163 Ų | 163 | 85.1 Ų | 85.1 | 62% | 0.615 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -63.1 | -48.3 | 172.1 | -70.6 | 175.4 | -166.9 | -142.8 | 7.6 | 111.2 | E339 R340 R341 K345 R346 V347 | E339-R343 VanDerWaalsContact O-CG 3.28Å; E339-R343 WeakPolarHBondContact O-CG 3.18Å; E339-R343 PolarHBondContact O-N 3.4Å; R340-R343 PolarHBondContact O-N 2.74Å; R341-R343 VanDerWaalsContact C-N 3.28Å; R341-R343 PolarHBondContact O-N 3.37Å; R343-K345 PolarHBondContact O-N 2.88Å; R343-R346 PolarHBondContact O-N 3.14Å; R343-V347 WeakPolarHBondContact O-CB 3.34Å; R343-V347 VanDerWaalsContact O-CG2 3.25Å; R343-V347 WeakPolarHBondContact O-CG2 3.42Å; R343-V347 PolarHBondContact O-N 3.08Å |
| 344 | Q | 74.7 | Confident | 79.7 | Confident | 62 Ų | 62 | 82.9 Ų | 82.9 | 29% | 0.29 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -59.3 | -47.3 | 177.5 | -75.9 | -176.3 | -23.8 | 0 | 0 | 112.5 | R340 R341 R346 V347 F348 | R340-Q344 WeakPolarHBondContact O-CG 3.42Å; R340-Q344 PolarHBondContact O-N 3.38Å; R341-Q344 PolarHBondContact O-N 2.9Å; Q344-R346 VanDerWaalsContact C-N 3.33Å; Q344-R346 PolarHBondContact O-N 2.94Å; Q344-V347 PolarHBondContact O-N 3.33Å; Q344-F348 WeakPolarHBondContact O-CB 3.22Å; Q344-F348 PolarHBondContact O-N 2.94Å |
| 345 | K | 76.3 | Confident | 79.8 | Confident | 110 Ų | 110 | 79.2 Ų | 79.2 | 48% | 0.478 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61 | -41.3 | 176.9 | -75.7 | -174.6 | 175.4 | -172 | 0 | 112.2 | R341 R343 F348 R349 | R341-K345 WeakPolarHBondContact O-CG 3.17Å; R341-K345 PolarHBondContact O-N 2.66Å; R343-K345 PolarHBondContact O-N 2.88Å; K345-F348 PolarHBondContact O-N 3.07Å; K345-R349 VanDerWaalsContact O-CB 3.29Å; K345-R349 WeakPolarHBondContact O-CB 3.28Å; K345-R349 PolarHBondContact O-N 3.05Å |
| 346 | R | 78.8 | Confident | 79.9 | Confident | 54 Ų | 54 | 75.3 Ų | 75.3 | 20% | 0.204 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.3 | -48.9 | 177.4 | -173.6 | -166.8 | -54.4 | -178.9 | 7.6 | 110.9 | E342 R343 Q344 F348 R349 M350 T406 | E342-R346 VanDerWaalsContact O-CB 3.31Å; E342-R346 WeakPolarHBondContact O-CB 3.17Å; E342-R346 PolarHBondContact O-N 2.91Å; R343-R346 PolarHBondContact O-N 3.14Å; Q344-R346 VanDerWaalsContact C-N 3.33Å; Q344-R346 PolarHBondContact O-N 2.94Å; R346-F348 VanDerWaalsContact C-N 3.33Å; R346-F348 PolarHBondContact O-N 3.35Å; R346-R349 PolarHBondContact O-N 3.09Å; R346-M350 WeakPolarHBondContact O-CB 3.37Å; R346-M350 PolarHBondContact O-N 3.15Å; R346-T406 WeakPolarHBondContact CD-O 3.26Å; R346-T406 WeakPolarHBondContact CG-O 3.35Å |
| 347 | V | 77.2 | Confident | 80.3 | Confident | 50 Ų | 50 | 69.6 Ų | 69.6 | 30% | 0.303 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 179.9 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | R343 Q344 M350 S351 | R343-V347 WeakPolarHBondContact O-CB 3.34Å; R343-V347 VanDerWaalsContact O-CG2 3.25Å; R343-V347 WeakPolarHBondContact O-CG2 3.42Å; R343-V347 PolarHBondContact O-N 3.08Å; Q344-V347 PolarHBondContact O-N 3.33Å; V347-M350 WeakPolarHBondContact O-CB 3.02Å; V347-S351 PolarHBondContact O-N 3.11Å; V347-S351 VanDerWaalsContact O-N 3.1Å; V347-S351 PolarHBondContact O-OG 2.86Å |
| 348 | F | 77.9 | Confident | 81 | Confident | 21 Ų | 21 | 66 Ų | 66 | 9% | 0.092 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.7 | -52 | 173.9 | 173.7 | -104.6 | 0 | 0 | 0 | 112.9 | Y268 I271 L272 L275 Q344 K345 R346 M350 S351 L352 | Y268-F348 AromaticContact CD1-CE2 3.73Å; Y268-F348 HydrophobicContact CD1-CE2 3.73Å; Y268-F348 HydrophobicContact CD1-CZ 4.06Å; Y268-F348 HydrophobicContact CE1-CD2 4.27Å; Y268-F348 AromaticContact CE1-CE2 3.55Å; Y268-F348 HydrophobicContact CE1-CE2 3.55Å; Y268-F348 HydrophobicContact CE1-CZ 4.14Å; I271-F348 HydrophobicContact CB-CD2 4.5Å; I271-F348 HydrophobicContact CB-CE2 3.94Å; I271-F348 HydrophobicContact CG2-CD2 3.38Å; I271-F348 HydrophobicContact CG2-CE2 3.21Å; I271-F348 HydrophobicContact CG2-CG 4.43Å; I271-F348 HydrophobicContact CG2-CZ 4.15Å; L272-F348 HydrophobicContact CD2-CE1 3.68Å; L272-F348 HydrophobicContact CD2-CZ 3.44Å; L272-F348 VanDerWaalsContact CD2-CZ 3.44Å; L272-F348 HydrophobicContact CG-CZ 3.92Å; L275-F348 HydrophobicContact CD1-CB 4.33Å; L275-F348 HydrophobicContact CD1-CD1 3.55Å; L275-F348 HydrophobicContact CD1-CD2 3.91Å; L275-F348 HydrophobicContact CD1-CE1 3.77Å; L275-F348 HydrophobicContact CD1-CE2 4.11Å; L275-F348 HydrophobicContact CD1-CG 3.62Å; L275-F348 HydrophobicContact CD1-CZ 4.04Å; Q344-F348 WeakPolarHBondContact O-CB 3.22Å; Q344-F348 PolarHBondContact O-N 2.94Å; K345-F348 PolarHBondContact O-N 3.07Å; R346-F348 VanDerWaalsContact C-N 3.33Å; R346-F348 PolarHBondContact O-N 3.35Å; F348-M350 PolarHBondContact O-N 3.01Å; F348-S351 PolarHBondContact O-N 3.23Å; F348-S351 VanDerWaalsContact O-N 3.11Å; F348-L352 PolarHBondContact O-N 2.96Å |
| 349 | R | 80.7 | Confident | 81.5 | Confident | 100 Ų | 100 | 59.3 Ų | 59.3 | 38% | 0.377 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -55.9 | -39.7 | 178.6 | 177.9 | -179.5 | 65.8 | -159.8 | 5.8 | 111.5 | K345 R346 L352 L353 | K345-R349 VanDerWaalsContact O-CB 3.29Å; K345-R349 WeakPolarHBondContact O-CB 3.28Å; K345-R349 PolarHBondContact O-N 3.05Å; R346-R349 PolarHBondContact O-N 3.09Å; R349-L352 WeakPolarHBondContact O-CB 3.19Å; R349-L352 PolarHBondContact O-N 3.16Å; R349-L353 WeakPolarHBondContact O-CG 3.24Å; R349-L353 PolarHBondContact O-N 3.46Å |
| 350 | M | 80.8 | Confident | 82.2 | Confident | 22 Ų | 22 | 61.1 Ų | 61.1 | 11% | 0.108 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.2 | -45.5 | 178.2 | 175.9 | 176.2 | -168.8 | 0 | 0 | 112.5 | R346 V347 F348 L352 L353 I354 Y403 T406 | R346-M350 WeakPolarHBondContact O-CB 3.37Å; R346-M350 PolarHBondContact O-N 3.15Å; V347-M350 WeakPolarHBondContact O-CB 3.02Å; F348-M350 PolarHBondContact O-N 3.01Å; M350-L352 VanDerWaalsContact C-N 3.31Å; M350-L352 PolarHBondContact O-N 3.25Å; M350-L353 WeakPolarHBondContact O-CB 3.39Å; M350-L353 PolarHBondContact O-N 2.99Å; M350-I354 HydrophobicContact CG-CD1 4.49Å; M350-I354 WeakPolarHBondContact O-CG1 3.32Å; M350-I354 PolarHBondContact O-N 3.32Å; M350-I354 VanDerWaalsContact O-N 3.08Å; M350-Y403 HydrophobicContact CE-CD1 2.84Å; M350-Y403 HydrophobicContact CE-CD2 3.53Å; M350-Y403 HydrophobicContact CE-CE1 3.06Å; M350-Y403 HydrophobicContact CE-CE2 3.78Å; M350-Y403 HydrophobicContact CE-CG 3.01Å; M350-Y403 HydrophobicContact SD-CD1 4.29Å; M350-Y403 HydrophobicContact SD-CE1 4.29Å; M350-T406 HydrophobicContact CB-CG2 4.2Å; M350-T406 HydrophobicContact CG-CG2 4.33Å |
| 351 | S | 80.3 | Confident | 83 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -68.5 | -30.7 | 175.4 | -61.6 | 0 | 0 | 0 | 0 | 113 | R177 Y268 V347 F348 L353 I354 I355 | R177-S351 WeakPolarHBondContact CD-OG 3.21Å; R177-S351 VanDerWaalsContact CG-OG 3.31Å; R177-S351 WeakPolarHBondContact CG-OG 3.26Å; R177-S351 PolarHBondContact NE-OG 3.36Å; Y268-S351 VanDerWaalsContact OH-C 3.23Å; Y268-S351 WeakPolarHBondContact OH-CB 3.43Å; Y268-S351 PolarHBondContact OH-O 3.23Å; V347-S351 PolarHBondContact O-N 3.11Å; V347-S351 VanDerWaalsContact O-N 3.1Å; V347-S351 PolarHBondContact O-OG 2.86Å; F348-S351 PolarHBondContact O-N 3.23Å; F348-S351 VanDerWaalsContact O-N 3.11Å; S351-L353 VanDerWaalsContact C-N 3.32Å; S351-L353 PolarHBondContact O-N 3.18Å; S351-I354 PolarHBondContact O-N 3.37Å; S351-I355 VanDerWaalsContact O-CG1 3.3Å; S351-I355 WeakPolarHBondContact O-CG1 3.5Å; S351-I355 PolarHBondContact O-N 3.35Å; S351-I355 VanDerWaalsContact O-N 3.1Å |
| 352 | L | 83.3 | Confident | 83.8 | Confident | 79 Ų | 79 | 50 Ų | 50 | 41% | 0.414 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60.3 | -41.8 | 169.2 | -178.7 | 68.3 | 0 | 0 | 0 | 111.8 | Y268 F348 R349 M350 I355 S356 | Y268-L352 HydrophobicContact CD1-CD1 4.08Å; Y268-L352 HydrophobicContact CE1-CB 4.22Å; Y268-L352 HydrophobicContact CE1-CD1 4.23Å; F348-L352 PolarHBondContact O-N 2.96Å; R349-L352 WeakPolarHBondContact O-CB 3.19Å; R349-L352 PolarHBondContact O-N 3.16Å; M350-L352 VanDerWaalsContact C-N 3.31Å; M350-L352 PolarHBondContact O-N 3.25Å; L352-I355 PolarHBondContact O-N 3.14Å; L352-S356 WeakPolarHBondContact O-CB 3.33Å; L352-S356 PolarHBondContact O-N 3.19Å |
| 353 | L | 86.1 | Confident | 84.5 | Confident | 65 Ų | 65 | 49.1 Ų | 49.1 | 34% | 0.34 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -65 | -45.8 | 177 | -70.7 | 167 | 0 | 0 | 0 | 111.7 | R349 M350 S351 I355 S356 T357 L402 T406 | R349-L353 WeakPolarHBondContact O-CG 3.24Å; R349-L353 PolarHBondContact O-N 3.46Å; M350-L353 WeakPolarHBondContact O-CB 3.39Å; M350-L353 PolarHBondContact O-N 2.99Å; S351-L353 VanDerWaalsContact C-N 3.32Å; S351-L353 PolarHBondContact O-N 3.18Å; L353-I355 PolarHBondContact O-N 3.22Å; L353-S356 PolarHBondContact O-N 3.17Å; L353-T357 WeakPolarHBondContact O-CB 3.21Å; L353-T357 PolarHBondContact O-N 3.49Å; L353-T357 PolarHBondContact O-OG1 3.03Å; L353-T357 VanDerWaalsContact O-OG1 3.12Å; L353-L402 HydrophobicContact CB-CD1 4Å; L353-L402 HydrophobicContact CB-CD2 3.9Å; L353-L402 HydrophobicContact CB-CG 4.43Å; L353-L402 HydrophobicContact CD1-CD2 4.12Å; L353-L402 HydrophobicContact CG-CD2 4.41Å; L353-T406 HydrophobicContact CD1-CG2 3.52Å |
| 354 | I | 85.8 | Confident | 85.3 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -54.4 | -44.5 | 177 | -67.6 | 167.2 | 0 | 0 | 0 | 110.6 | V170 I173 M350 S351 T357 F358 L402 Y403 | V170-I354 HydrophobicContact CG2-CG2 4.3Å; I173-I354 HydrophobicContact CD1-CG2 4.48Å; M350-I354 HydrophobicContact CG-CD1 4.49Å; M350-I354 WeakPolarHBondContact O-CG1 3.32Å; M350-I354 PolarHBondContact O-N 3.32Å; M350-I354 VanDerWaalsContact O-N 3.08Å; S351-I354 PolarHBondContact O-N 3.37Å; I354-T357 PolarHBondContact O-N 2.88Å; I354-F358 PolarHBondContact O-N 2.94Å; I354-L402 HydrophobicContact CG1-CD1 4.43Å; I354-Y403 HydrophobicContact CD1-CE2 3.55Å; I354-Y403 WeakPolarHBondContact CD1-OH 3.45Å; I354-Y403 HydrophobicContact CG1-CE2 4.29Å |
| 355 | I | 85.8 | Confident | 86 | Confident | 11 Ų | 11 | 40 Ų | 40 | 6% | 0.056 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -71.6 | -44.1 | -179 | -69.8 | 176.3 | 0 | 0 | 0 | 112.4 | V170 T174 M264 Y268 S351 L352 L353 T357 F358 L359 | V170-I355 HydrophobicContact CG1-CG1 3.69Å; T174-I355 VanDerWaalsContact OG1-CD1 3.24Å; T174-I355 WeakPolarHBondContact OG1-CD1 3.33Å; M264-I355 HydrophobicContact CE-CB 3.87Å; M264-I355 HydrophobicContact CE-CD1 3.89Å; M264-I355 HydrophobicContact CE-CG1 3.55Å; M264-I355 HydrophobicContact CE-CG2 3.3Å; Y268-I355 HydrophobicContact CD2-CD1 3.62Å; Y268-I355 HydrophobicContact CE1-CD1 4.05Å; Y268-I355 HydrophobicContact CE2-CD1 2.86Å; Y268-I355 HydrophobicContact CE2-CG1 4.34Å; Y268-I355 HydrophobicContact CG-CD1 4.45Å; Y268-I355 WeakPolarHBondContact OH-CD1 3.44Å; S351-I355 VanDerWaalsContact O-CG1 3.3Å; S351-I355 WeakPolarHBondContact O-CG1 3.5Å; S351-I355 PolarHBondContact O-N 3.35Å; S351-I355 VanDerWaalsContact O-N 3.1Å; L352-I355 PolarHBondContact O-N 3.14Å; L353-I355 PolarHBondContact O-N 3.22Å; I355-T357 PolarHBondContact O-N 3.34Å; I355-F358 PolarHBondContact O-N 2.97Å; I355-L359 HydrophobicContact CG2-CD1 4.06Å; I355-L359 HydrophobicContact CG2-CG 4.36Å; I355-L359 WeakPolarHBondContact O-CG 3.09Å; I355-L359 PolarHBondContact O-N 3.47Å |
| 356 | S | 88 | Confident | 86.7 | Confident | 54 Ų | 54 | 35.1 Ų | 35.1 | 38% | 0.378 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -56.5 | -43.2 | 175.9 | -172.1 | 0 | 0 | 0 | 0 | 110.3 | L352 L353 L359 L360 | L352-S356 WeakPolarHBondContact O-CB 3.33Å; L352-S356 PolarHBondContact O-N 3.19Å; L353-S356 PolarHBondContact O-N 3.17Å; S356-L359 PolarHBondContact O-N 3.31Å; S356-L360 WeakPolarHBondContact O-CB 3.47Å; S356-L360 WeakPolarHBondContact O-CD1 3.34Å; S356-L360 WeakPolarHBondContact O-CG 3.4Å; S356-L360 PolarHBondContact O-N 3.49Å |
| 357 | T | 90.8 | Very high | 87.2 | Confident | 20 Ų | 20 | 36 Ų | 36 | 12% | 0.123 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.7 | -46.2 | 176 | -63.3 | 0 | 0 | 0 | 0 | 111.9 | L353 I354 I355 L359 L360 C361 T395 F398 | L353-T357 WeakPolarHBondContact O-CB 3.21Å; L353-T357 PolarHBondContact O-N 3.49Å; L353-T357 PolarHBondContact O-OG1 3.03Å; L353-T357 VanDerWaalsContact O-OG1 3.12Å; I354-T357 PolarHBondContact O-N 2.88Å; I355-T357 PolarHBondContact O-N 3.34Å; T357-L359 VanDerWaalsContact C-N 3.32Å; T357-L359 PolarHBondContact O-N 2.98Å; T357-L360 PolarHBondContact O-N 2.88Å; T357-C361 WeakPolarHBondContact O-CB 3.34Å; T357-C361 PolarHBondContact O-N 3.17Å; T357-C361 PolarHBondContact O-SG 3.4Å; T357-T395 HydrophobicContact CG2-CG2 4.4Å; T357-F398 HydrophobicContact CG2-CB 3.54Å; T357-F398 HydrophobicContact CG2-CD2 3.59Å; T357-F398 HydrophobicContact CG2-CG 3.8Å |
| 358 | F | 90.4 | Very high | 87.7 | Confident | 1 Ų | 1 | 34.2 Ų | 34.2 | 0% | 0.004 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -54.4 | -48.7 | 175 | 171.9 | -101.3 | 0 | 0 | 0 | 111.7 | T166 A167 V170 F257 M264 I354 I355 C361 W362 | T166-F358 HydrophobicContact CG2-CD2 3.77Å; T166-F358 HydrophobicContact CG2-CE2 3.95Å; A167-F358 HydrophobicContact CB-CE2 4.08Å; A167-F358 HydrophobicContact CB-CZ 3.65Å; V170-F358 HydrophobicContact CG1-CB 4.34Å; V170-F358 HydrophobicContact CG1-CG 4.37Å; V170-F358 HydrophobicContact CG2-CB 4.26Å; V170-F358 HydrophobicContact CG2-CD2 4.19Å; V170-F358 HydrophobicContact CG2-CG 4.24Å; F257-F358 HydrophobicContact CD2-CE1 4.42Å; F257-F358 HydrophobicContact CD2-CZ 4.1Å; F257-F358 AromaticContact CE2-CE1 3.93Å; F257-F358 HydrophobicContact CE2-CE1 3.93Å; F257-F358 AromaticContact CE2-CZ 3.89Å; F257-F358 HydrophobicContact CE2-CZ 3.89Å; M264-F358 HydrophobicContact CE-CD1 4.01Å; M264-F358 HydrophobicContact SD-CD1 4.42Å; M264-F358 HydrophobicContact SD-CE1 4.41Å; I354-F358 PolarHBondContact O-N 2.94Å; I355-F358 PolarHBondContact O-N 2.97Å; F358-C361 PolarHBondContact O-N 3.5Å; F358-W362 HydrophobicContact CD2-CB 4.45Å; F358-W362 AromaticContact CD2-CD1 3.27Å; F358-W362 AromaticContact CD2-CG 3.95Å; F358-W362 HydrophobicContact CD2-CG 3.95Å; F358-W362 AromaticContact CD2-NE1 3.79Å; F358-W362 HydrophobicContact CE2-CB 4.13Å; F358-W362 AromaticContact CE2-CD1 3.45Å; F358-W362 VanDerWaalsContact CE2-CD1 3.45Å; F358-W362 HydrophobicContact CE2-CD2 4.32Å; F358-W362 AromaticContact CE2-CG 3.69Å; F358-W362 HydrophobicContact CE2-CG 3.69Å; F358-W362 AromaticContact CE2-NE1 3.92Å; F358-W362 HydrophobicContact CZ-CB 4.36Å; F358-W362 HydrophobicContact CZ-CG 4.37Å; F358-W362 WeakPolarHBondContact O-CB 3.08Å; F358-W362 PolarHBondContact O-N 2.95Å |
| 359 | L | 90.8 | Very high | 88.1 | Confident | 39 Ų | 39 | 33.3 Ų | 33.3 | 20% | 0.204 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.6 | -46.5 | 178.4 | -66.3 | 175.3 | 0 | 0 | 0 | 111.6 | V261 I355 S356 T357 C361 T363 | V261-L359 HydrophobicContact CB-CD2 4.27Å; V261-L359 HydrophobicContact CG1-CD2 3.89Å; V261-L359 HydrophobicContact CG2-CD2 3.51Å; I355-L359 HydrophobicContact CG2-CD1 4.06Å; I355-L359 HydrophobicContact CG2-CG 4.36Å; I355-L359 WeakPolarHBondContact O-CG 3.09Å; I355-L359 PolarHBondContact O-N 3.47Å; S356-L359 PolarHBondContact O-N 3.31Å; T357-L359 VanDerWaalsContact C-N 3.32Å; T357-L359 PolarHBondContact O-N 2.98Å; L359-C361 VanDerWaalsContact C-N 3.33Å; L359-C361 PolarHBondContact O-N 3.44Å; L359-T363 WeakPolarHBondContact O-CB 3.46Å; L359-T363 PolarHBondContact O-N 3.21Å; L359-T363 PolarHBondContact O-OG1 3.17Å |
| 360 | L | 92.5 | Very high | 88.3 | Confident | 119 Ų | 119 | 30.5 Ų | 30.5 | 62% | 0.623 | 17% | 0.174 | S | C | * | . | H | α-helix | trans | -63.1 | -39 | -178.8 | -73.4 | 168.8 | 0 | 0 | 0 | 112.5 | S356 T357 P364 | S356-L360 WeakPolarHBondContact O-CB 3.47Å; S356-L360 WeakPolarHBondContact O-CD1 3.34Å; S356-L360 WeakPolarHBondContact O-CG 3.4Å; S356-L360 PolarHBondContact O-N 3.49Å; T357-L360 PolarHBondContact O-N 2.88Å; L360-P364 WeakPolarHBondContact O-CD 3.45Å; L360-P364 WeakPolarHBondContact O-CG 3.41Å |
| 361 | C | 93.8 | Very high | 88.5 | Confident | 9 Ų | 9 | 31.7 Ų | 31.7 | 6% | 0.061 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -82.3 | -37.9 | -176.8 | -71 | 0 | 0 | 0 | 0 | 113.3 | T357 F358 L359 M391 T395 | T357-C361 WeakPolarHBondContact O-CB 3.34Å; T357-C361 PolarHBondContact O-N 3.17Å; T357-C361 PolarHBondContact O-SG 3.4Å; F358-C361 PolarHBondContact O-N 3.5Å; L359-C361 VanDerWaalsContact C-N 3.33Å; L359-C361 PolarHBondContact O-N 3.44Å; C361-M391 WeakPolarHBondContact CB-O 3.34Å; C361-M391 PolarHBondContact SG-O 3.15Å; C361-M391 VanDerWaalsContact SG-O 3.37Å; C361-T395 HydrophobicContact CB-CG2 3.36Å |
| 362 | W | 92.4 | Very high | 88.6 | Confident | 3 Ų | 3 | 31.7 Ų | 31.7 | 1% | 0.011 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -96.1 | -22.5 | -174.6 | -71.2 | 89.8 | 0 | 0 | 0 | 114.4 | A162 T166 F257 F358 I365 S366 A392 | A162-W362 HydrophobicContact CB-CH2 4.08Å; T166-W362 HydrophobicContact CG2-CZ2 4.47Å; F257-W362 HydrophobicContact CD2-CB 4.46Å; F257-W362 HydrophobicContact CE2-CB 3.69Å; F257-W362 HydrophobicContact CZ-CB 4.41Å; F358-W362 HydrophobicContact CD2-CB 4.45Å; F358-W362 AromaticContact CD2-CD1 3.27Å; F358-W362 AromaticContact CD2-CG 3.95Å; F358-W362 HydrophobicContact CD2-CG 3.95Å; F358-W362 AromaticContact CD2-NE1 3.79Å; F358-W362 HydrophobicContact CE2-CB 4.13Å; F358-W362 AromaticContact CE2-CD1 3.45Å; F358-W362 VanDerWaalsContact CE2-CD1 3.45Å; F358-W362 HydrophobicContact CE2-CD2 4.32Å; F358-W362 AromaticContact CE2-CG 3.69Å; F358-W362 HydrophobicContact CE2-CG 3.69Å; F358-W362 AromaticContact CE2-NE1 3.92Å; F358-W362 HydrophobicContact CZ-CB 4.36Å; F358-W362 HydrophobicContact CZ-CG 4.37Å; F358-W362 WeakPolarHBondContact O-CB 3.08Å; F358-W362 PolarHBondContact O-N 2.95Å; W362-I365 HydrophobicContact CE3-CG2 4.11Å; W362-I365 WeakPolarHBondContact O-CG2 3.33Å; W362-S366 WeakPolarHBondContact O-CB 3.49Å; W362-S366 PolarHBondContact O-N 2.9Å; W362-S366 VanDerWaalsContact O-N 3.15Å; W362-S366 PolarHBondContact O-OG 2.75Å; W362-A392 HydrophobicContact CD2-CB 3.85Å; W362-A392 HydrophobicContact CE3-CB 3.83Å; W362-A392 HydrophobicContact CG-CB 4.43Å; W362-A392 HydrophobicContact CH2-CB 4.09Å; W362-A392 HydrophobicContact CZ2-CB 4.14Å; W362-A392 HydrophobicContact CZ3-CB 3.92Å |
| 363 | T | 91.6 | Very high | 88.5 | Confident | 50 Ų | 50 | 30.4 Ų | 30.4 | 31% | 0.307 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -61.8 | -43.7 | 178.1 | -57 | 0 | 0 | 0 | 0 | 113.1 | L359 I365 S366 V367 | L359-T363 WeakPolarHBondContact O-CB 3.46Å; L359-T363 PolarHBondContact O-N 3.21Å; L359-T363 PolarHBondContact O-OG1 3.17Å; T363-I365 PolarHBondContact O-N 3.28Å; T363-S366 PolarHBondContact O-N 3.31Å; T363-V367 HydrophobicContact CG2-CG2 3.86Å; T363-V367 WeakPolarHBondContact O-CB 3.5Å; T363-V367 WeakPolarHBondContact O-CG2 3.41Å; T363-V367 PolarHBondContact O-N 3.48Å |
| 364 | P | 94.1 | Very high | 88.3 | Confident | 32 Ų | 32 | 31.5 Ų | 31.5 | 21% | 0.208 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -57.9 | -45.9 | -178 | -26.7 | 36.4 | 0 | 0 | 0 | 113.1 | L360 L368 F388 M391 | L360-P364 WeakPolarHBondContact O-CD 3.45Å; L360-P364 WeakPolarHBondContact O-CG 3.41Å; P364-L368 WeakPolarHBondContact O-CB 3.3Å; P364-L368 PolarHBondContact O-N 3.01Å; P364-F388 HydrophobicContact CB-CB 4.12Å; P364-F388 HydrophobicContact CB-CD1 3.64Å; P364-F388 HydrophobicContact CB-CD2 3.9Å; P364-F388 HydrophobicContact CB-CE1 3.96Å; P364-F388 HydrophobicContact CB-CE2 4.21Å; P364-F388 HydrophobicContact CB-CG 3.62Å; P364-F388 HydrophobicContact CB-CZ 4.25Å; P364-M391 HydrophobicContact CG-SD 4.05Å |
| 365 | I | 89.7 | Confident | 88.2 | Confident | 2 Ų | 2 | 38.3 Ų | 38.3 | 1% | 0.01 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -67.8 | -40.3 | 177.3 | -174.5 | 164 | 0 | 0 | 0 | 111.9 | W362 T363 V367 L368 N369 F388 L389 A392 | W362-I365 HydrophobicContact CE3-CG2 4.11Å; W362-I365 WeakPolarHBondContact O-CG2 3.33Å; T363-I365 PolarHBondContact O-N 3.28Å; I365-V367 PolarHBondContact O-N 2.88Å; I365-L368 PolarHBondContact O-N 2.93Å; I365-N369 WeakPolarHBondContact O-CB 3.47Å; I365-N369 VanDerWaalsContact O-CG 3.24Å; I365-N369 PolarHBondContact O-N 3.42Å; I365-F388 HydrophobicContact CB-CB 3.86Å; I365-L389 HydrophobicContact CD1-CB 3.82Å; I365-L389 HydrophobicContact CD1-CD1 3.77Å; I365-L389 HydrophobicContact CD1-CG 4.39Å; I365-A392 HydrophobicContact CG2-CB 4.21Å |
| 366 | S | 89.3 | Confident | 87.5 | Confident | 7 Ų | 7 | 38.7 Ų | 38.7 | 5% | 0.049 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.8 | -41.2 | 177.5 | -64 | 0 | 0 | 0 | 0 | 112.7 | F257 W362 T363 T370 | F257-S366 WeakPolarHBondContact CD1-OG 3.2Å; F257-S366 WeakPolarHBondContact CD2-OG 3.33Å; F257-S366 VanDerWaalsContact CG-OG 3.29Å; F257-S366 WeakPolarHBondContact CG-OG 3.33Å; W362-S366 WeakPolarHBondContact O-CB 3.49Å; W362-S366 PolarHBondContact O-N 2.9Å; W362-S366 VanDerWaalsContact O-N 3.15Å; W362-S366 PolarHBondContact O-OG 2.75Å; T363-S366 PolarHBondContact O-N 3.31Å; S366-T370 PolarHBondContact O-N 3.1Å; S366-T370 VanDerWaalsContact O-N 3.12Å; S366-T370 PolarHBondContact O-OG1 2.83Å |
| 367 | V | 90 | Very high | 86.9 | Confident | 72 Ų | 72 | 37.5 Ų | 37.5 | 44% | 0.436 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -65.4 | -44.8 | 175 | 171.4 | 0 | 0 | 0 | 0 | 110 | T363 I365 N369 T370 T371 | T363-V367 HydrophobicContact CG2-CG2 3.86Å; T363-V367 WeakPolarHBondContact O-CB 3.5Å; T363-V367 WeakPolarHBondContact O-CG2 3.41Å; T363-V367 PolarHBondContact O-N 3.48Å; I365-V367 PolarHBondContact O-N 2.88Å; V367-N369 PolarHBondContact O-N 2.7Å; V367-T370 WeakPolarHBondContact O-CA 3.46Å; V367-T370 VanDerWaalsContact O-CB 3.3Å; V367-T370 WeakPolarHBondContact O-CB 3.43Å; V367-T370 PolarHBondContact O-N 3.34Å; V367-T370 VanDerWaalsContact O-N 3.12Å; V367-T371 PolarHBondContact O-N 3.04Å; V367-T371 PolarHBondContact O-OG1 3.23Å; V367-T371 VanDerWaalsContact O-OG1 3.12Å |
| 368 | L | 88.2 | Confident | 86.3 | Confident | 13 Ų | 13 | 38.7 Ų | 38.7 | 7% | 0.068 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64 | -41.9 | 179.2 | -171.5 | 72.4 | 0 | 0 | 0 | 112.4 | P364 I365 T370 T371 I372 L381 L384 R385 F388 | P364-L368 WeakPolarHBondContact O-CB 3.3Å; P364-L368 PolarHBondContact O-N 3.01Å; I365-L368 PolarHBondContact O-N 2.93Å; L368-T370 PolarHBondContact O-N 3.13Å; L368-T371 CarbonylContact O-C 3.53Å; L368-T371 WeakPolarHBondContact O-CA 3.31Å; L368-T371 WeakPolarHBondContact O-CB 3.32Å; L368-T371 PolarHBondContact O-N 2.92Å; L368-I372 HydrophobicContact CG-CD1 4.19Å; L368-I372 WeakPolarHBondContact O-CG1 3.32Å; L368-I372 PolarHBondContact O-N 2.92Å; L368-L381 HydrophobicContact CD1-CG 4.1Å; L368-L384 HydrophobicContact CD1-CB 4.34Å; L368-L384 VanDerWaalsContact CD2-C 3.47Å; L368-L384 HydrophobicContact CD2-CB 3.81Å; L368-R385 HydrophobicContact CD2-CB 3.67Å; L368-R385 HydrophobicContact CD2-CG 4.44Å; L368-F388 HydrophobicContact CB-CD2 3.97Å; L368-F388 HydrophobicContact CB-CE2 4.24Å; L368-F388 HydrophobicContact CD1-CE2 4.46Å; L368-F388 HydrophobicContact CD2-CD2 3.67Å; L368-F388 HydrophobicContact CD2-CE2 4.08Å; L368-F388 HydrophobicContact CG-CD2 4.36Å |
| 369 | N | 85.6 | Confident | 85.6 | Confident | 2 Ų | 2 | 43.5 Ų | 43.5 | 1% | 0.011 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.2 | -36.1 | 173.5 | -74.5 | -13.3 | 0 | 0 | 0 | 111.6 | L250 I254 I365 V367 L373 R385 | L250-N369 HydrophobicContact CD2-CB 4.06Å; I254-N369 HydrophobicContact CD1-CB 4.45Å; I365-N369 WeakPolarHBondContact O-CB 3.47Å; I365-N369 VanDerWaalsContact O-CG 3.24Å; I365-N369 PolarHBondContact O-N 3.42Å; V367-N369 PolarHBondContact O-N 2.7Å; N369-L373 WeakPolarHBondContact O-CB 3.43Å; N369-L373 PolarHBondContact O-N 3.02Å; N369-R385 PolarHBondContact OD1-NE 3.12Å |
| 370 | T | 84.9 | Confident | 85.3 | Confident | 40 Ų | 40 | 47 Ų | 47 | 25% | 0.245 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.6 | -42 | 173 | -51.3 | 0 | 0 | 0 | 0 | 111.2 | S366 V367 L368 L373 C374 | S366-T370 PolarHBondContact O-N 3.1Å; S366-T370 VanDerWaalsContact O-N 3.12Å; S366-T370 PolarHBondContact O-OG1 2.83Å; V367-T370 WeakPolarHBondContact O-CA 3.46Å; V367-T370 VanDerWaalsContact O-CB 3.3Å; V367-T370 WeakPolarHBondContact O-CB 3.43Å; V367-T370 PolarHBondContact O-N 3.34Å; V367-T370 VanDerWaalsContact O-N 3.12Å; L368-T370 PolarHBondContact O-N 3.13Å; T370-L373 WeakPolarHBondContact O-CB 3.26Å; T370-L373 PolarHBondContact O-N 3.06Å; T370-C374 PolarHBondContact O-N 3.46Å; T370-C374 PolarHBondContact O-SG 3.05Å |
| 371 | T | 85.7 | Confident | 84.9 | Confident | 48 Ų | 48 | 42.7 Ų | 42.7 | 29% | 0.294 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 176.2 | -54.1 | 0 | 0 | 0 | 0 | 111.9 | V367 L368 L373 C374 L375 L381 | V367-T371 PolarHBondContact O-N 3.04Å; V367-T371 PolarHBondContact O-OG1 3.23Å; V367-T371 VanDerWaalsContact O-OG1 3.12Å; L368-T371 CarbonylContact O-C 3.53Å; L368-T371 WeakPolarHBondContact O-CA 3.31Å; L368-T371 WeakPolarHBondContact O-CB 3.32Å; L368-T371 PolarHBondContact O-N 2.92Å; T371-L373 VanDerWaalsContact C-N 3.29Å; T371-L373 PolarHBondContact O-N 3.4Å; T371-C374 PolarHBondContact O-N 3.05Å; T371-C374 VanDerWaalsContact O-N 3.16Å; T371-L375 HydrophobicContact CG2-CD1 3.73Å; T371-L375 HydrophobicContact CG2-CG 4.32Å; T371-L375 WeakPolarHBondContact O-CB 3.44Å; T371-L375 PolarHBondContact O-N 2.88Å; T371-L381 HydrophobicContact CG2-CD2 4.04Å |
| 372 | I | 82.4 | Confident | 84.2 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.5 | -41.2 | 175.3 | -68.2 | 166.6 | 0 | 0 | 0 | 110.3 | L232 L368 C374 G376 L381 R385 | L232-I372 HydrophobicContact CD1-CG2 4.31Å; L368-I372 HydrophobicContact CG-CD1 4.19Å; L368-I372 WeakPolarHBondContact O-CG1 3.32Å; L368-I372 PolarHBondContact O-N 2.92Å; I372-C374 VanDerWaalsContact C-N 3.35Å; I372-C374 PolarHBondContact O-N 3.34Å; I372-G376 CarbonylContact O-C 3.57Å; I372-G376 WeakPolarHBondContact O-CA 3.39Å; I372-G376 PolarHBondContact O-N 3.35Å; I372-L381 HydrophobicContact CD1-CB 4.5Å; I372-L381 HydrophobicContact CG1-CB 4.05Å; I372-L381 HydrophobicContact CG1-CD2 3.79Å; I372-L381 HydrophobicContact CG1-CG 4.31Å; I372-R385 HydrophobicContact CD1-CB 4.46Å |
| 373 | L | 80.6 | Confident | 83.8 | Confident | 52 Ų | 52 | 46.8 Ų | 46.8 | 27% | 0.272 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.2 | -35.2 | 175.9 | -179.4 | 67.7 | 0 | 0 | 0 | 112.8 | Y247 L251 I254 N369 T370 T371 | Y247-L373 HydrophobicContact CD1-CD1 3.26Å; Y247-L373 HydrophobicContact CD1-CG 4.46Å; Y247-L373 HydrophobicContact CE1-CD1 4.05Å; Y247-L373 HydrophobicContact CG-CD1 3.72Å; L251-L373 HydrophobicContact CD2-CD1 4.27Å; L251-L373 HydrophobicContact CD2-CD2 3.58Å; L251-L373 HydrophobicContact CG-CD1 4.22Å; L251-L373 HydrophobicContact CG-CD2 4.2Å; I254-L373 HydrophobicContact CD1-CD2 4.09Å; N369-L373 WeakPolarHBondContact O-CB 3.43Å; N369-L373 PolarHBondContact O-N 3.02Å; T370-L373 WeakPolarHBondContact O-CB 3.26Å; T370-L373 PolarHBondContact O-N 3.06Å; T371-L373 VanDerWaalsContact C-N 3.29Å; T371-L373 PolarHBondContact O-N 3.4Å |
| 374 | C | 82.4 | Confident | 83.7 | Confident | 88 Ų | 88 | 47.3 Ų | 47.3 | 60% | 0.595 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -85.8 | -37.8 | -177.3 | -67.8 | 0 | 0 | 0 | 0 | 114.5 | T370 T371 I372 | T370-C374 PolarHBondContact O-N 3.46Å; T370-C374 PolarHBondContact O-SG 3.05Å; T371-C374 PolarHBondContact O-N 3.05Å; T371-C374 VanDerWaalsContact O-N 3.16Å; I372-C374 VanDerWaalsContact C-N 3.35Å; I372-C374 PolarHBondContact O-N 3.34Å |
| 375 | L | 82.8 | Confident | 83.4 | Confident | 142 Ų | 142 | 46 Ų | 46 | 74% | 0.743 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -110 | -8.1 | -171.6 | -60.1 | 179.9 | 0 | 0 | 0 | 113.3 | T371 | T371-L375 HydrophobicContact CG2-CD1 3.73Å; T371-L375 HydrophobicContact CG2-CG 4.32Å; T371-L375 WeakPolarHBondContact O-CB 3.44Å; T371-L375 PolarHBondContact O-N 2.88Å |
| 376 | G | 72.2 | Confident | 83.3 | Confident | 19 Ų | 19 | 46 Ų | 46 | 20% | 0.196 | 26% | 0.262 | C | S | . | . | trans | 84.5 | 166.2 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | I372 | I372-G376 CarbonylContact O-C 3.57Å; I372-G376 WeakPolarHBondContact O-CA 3.39Å; I372-G376 PolarHBondContact O-N 3.35Å | ||
| 377 | P | 74.6 | Confident | 83.5 | Confident | 29 Ų | 29 | 47.8 Ų | 47.8 | 19% | 0.188 | 27% | 0.274 | C | S | . | . | trans | -70.8 | 144.8 | 174.9 | 29.8 | -34 | 0 | 0 | 0 | 111.6 | L232 Y240 | L232-P377 HydrophobicContact CD1-CB 4.17Å; Y240-P377 HydrophobicContact CD1-CB 4.34Å; Y240-P377 HydrophobicContact CD1-CG 3.54Å; Y240-P377 HydrophobicContact CE1-CB 3.88Å; Y240-P377 HydrophobicContact CE1-CG 3.58Å; Y240-P377 HydrophobicContact CG-CG 4.41Å | ||
| 378 | S | 78.9 | Confident | 83.7 | Confident | 46 Ų | 46 | 47 Ų | 47 | 32% | 0.322 | 27% | 0.265 | S | S | . | . | trans | -141.8 | 159.8 | 167.1 | 63.7 | 0 | 0 | 0 | 0 | 109.3 | L380 L381 V382 | S378-L380 PolarHBondContact O-N 2.87Å; S378-L381 PolarHBondContact O-N 3.04Å; S378-L381 WeakPolarHBondContact OG-CB 3.49Å; S378-L381 WeakPolarHBondContact OG-CD1 3.34Å; S378-L381 PolarHBondContact OG-N 2.86Å; S378-V382 WeakPolarHBondContact O-CG2 3.18Å; S378-V382 PolarHBondContact O-N 3.12Å | ||
| 379 | D | 76.3 | Confident | 83.9 | Confident | 101 Ų | 101 | 46.5 Ų | 46.5 | 54% | 0.54 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -54.5 | -39.8 | -178.3 | -63.8 | -19.8 | 0 | 0 | 0 | 113 | K383 | D379-K383 VanDerWaalsContact O-CG 3.31Å; D379-K383 WeakPolarHBondContact O-CG 3.13Å; D379-K383 PolarHBondContact O-N 3.38Å |
| 380 | L | 83 | Confident | 84.3 | Confident | 113 Ų | 113 | 46.9 Ų | 46.9 | 59% | 0.592 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -66.6 | -44.5 | 176.2 | 179.3 | 61.8 | 0 | 0 | 0 | 111.3 | S378 V382 K383 L384 | S378-L380 PolarHBondContact O-N 2.87Å; L380-V382 VanDerWaalsContact C-N 3.32Å; L380-V382 PolarHBondContact O-N 3.22Å; L380-K383 PolarHBondContact O-N 3.26Å; L380-L384 HydrophobicContact CD1-CD1 4.14Å; L380-L384 HydrophobicContact CD1-CG 4.15Å; L380-L384 HydrophobicContact CG-CD1 3.95Å; L380-L384 HydrophobicContact CG-CG 4.39Å; L380-L384 WeakPolarHBondContact O-CB 3.33Å; L380-L384 VanDerWaalsContact O-CG 3.27Å; L380-L384 WeakPolarHBondContact O-CG 2.97Å; L380-L384 PolarHBondContact O-N 2.94Å |
| 381 | L | 83.7 | Confident | 84.8 | Confident | 28 Ų | 28 | 49.2 Ų | 49.2 | 15% | 0.147 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.1 | -37.3 | 179.9 | -90.6 | 63.6 | 0 | 0 | 0 | 111.2 | L368 T371 I372 S378 R385 | L368-L381 HydrophobicContact CD1-CG 4.1Å; T371-L381 HydrophobicContact CG2-CD2 4.04Å; I372-L381 HydrophobicContact CD1-CB 4.5Å; I372-L381 HydrophobicContact CG1-CB 4.05Å; I372-L381 HydrophobicContact CG1-CD2 3.79Å; I372-L381 HydrophobicContact CG1-CG 4.31Å; S378-L381 PolarHBondContact O-N 3.04Å; S378-L381 WeakPolarHBondContact OG-CB 3.49Å; S378-L381 WeakPolarHBondContact OG-CD1 3.34Å; S378-L381 PolarHBondContact OG-N 2.86Å; L381-R385 WeakPolarHBondContact O-CB 3.27Å; L381-R385 PolarHBondContact O-N 3.33Å |
| 382 | V | 80.1 | Confident | 85.2 | Confident | 17 Ų | 17 | 47 Ų | 47 | 10% | 0.103 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -67.5 | -45.2 | 176.1 | 176.3 | 0 | 0 | 0 | 0 | 111.2 | L233 S378 L380 L384 R385 L386 | L233-V382 HydrophobicContact CD1-CG1 4.15Å; S378-V382 WeakPolarHBondContact O-CG2 3.18Å; S378-V382 PolarHBondContact O-N 3.12Å; L380-V382 VanDerWaalsContact C-N 3.32Å; L380-V382 PolarHBondContact O-N 3.22Å; V382-L384 PolarHBondContact O-N 3.47Å; V382-R385 WeakPolarHBondContact O-CB 3.48Å; V382-R385 PolarHBondContact O-N 3.09Å; V382-R385 VanDerWaalsContact O-N 3.17Å; V382-L386 PolarHBondContact O-N 2.73Å |
| 383 | K | 84.1 | Confident | 85.8 | Confident | 82 Ų | 82 | 47 Ų | 47 | 36% | 0.357 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 174.8 | -72.5 | 171.5 | -175.6 | 173.8 | 0 | 111.9 | Y73 F77 D379 L380 R385 L386 C387 | Y73-K383 HydrophobicContact CD1-CG 4.24Å; Y73-K383 HydrophobicContact CE1-CG 4.13Å; F77-K383 HydrophobicContact CE2-CB 4.48Å; F77-K383 HydrophobicContact CZ-CB 4.28Å; D379-K383 VanDerWaalsContact O-CG 3.31Å; D379-K383 WeakPolarHBondContact O-CG 3.13Å; D379-K383 PolarHBondContact O-N 3.38Å; L380-K383 PolarHBondContact O-N 3.26Å; K383-R385 VanDerWaalsContact C-N 3.27Å; K383-R385 PolarHBondContact O-N 2.96Å; K383-L386 PolarHBondContact O-N 3.16Å; K383-C387 PolarHBondContact O-N 3.06Å; K383-C387 VanDerWaalsContact O-N 3.16Å; K383-C387 PolarHBondContact O-SG 2.92Å; K383-C387 VanDerWaalsContact O-SG 3.4Å |
| 384 | L | 88.6 | Confident | 86.5 | Confident | 61 Ų | 61 | 44.8 Ų | 44.8 | 32% | 0.319 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63.2 | -33.3 | 176.2 | -73.5 | 174.8 | 0 | 0 | 0 | 112.4 | L368 L380 V382 L386 C387 F388 | L368-L384 HydrophobicContact CD1-CB 4.34Å; L368-L384 VanDerWaalsContact CD2-C 3.47Å; L368-L384 HydrophobicContact CD2-CB 3.81Å; L380-L384 HydrophobicContact CD1-CD1 4.14Å; L380-L384 HydrophobicContact CD1-CG 4.15Å; L380-L384 HydrophobicContact CG-CD1 3.95Å; L380-L384 HydrophobicContact CG-CG 4.39Å; L380-L384 WeakPolarHBondContact O-CB 3.33Å; L380-L384 VanDerWaalsContact O-CG 3.27Å; L380-L384 WeakPolarHBondContact O-CG 2.97Å; L380-L384 PolarHBondContact O-N 2.94Å; V382-L384 PolarHBondContact O-N 3.47Å; L384-L386 VanDerWaalsContact C-N 3.34Å; L384-C387 PolarHBondContact O-N 3.36Å; L384-F388 HydrophobicContact CB-CE2 4.39Å; L384-F388 WeakPolarHBondContact O-CD2 3.2Å; L384-F388 WeakPolarHBondContact O-CG 3.41Å; L384-F388 PolarHBondContact O-N 3.26Å |
| 385 | R | 88.1 | Confident | 87 | Confident | 5 Ų | 5 | 40.6 Ų | 40.6 | 2% | 0.019 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.7 | -43.7 | 177.4 | -173.8 | -178.4 | -179.3 | -114.5 | -0.6 | 111.1 | E156 L368 N369 I372 L381 V382 K383 F388 L389 | E156-R385 VanDerWaalsContact CD-NH2 3.34Å; E156-R385 IonicContact OE1-CZ 2.85Å; E156-R385 IonicContact OE1-NH1 3.46Å; E156-R385 PolarHBondContact OE1-NH1 3.44Å; E156-R385 IonicContact OE1-NH2 3.72Å; E156-R385 PolarHBondContact OE1-NH2 3.39Å; E156-R385 IonicContact OE2-CZ 3.99Å; E156-R385 IonicContact OE2-NH1 3.67Å; E156-R385 IonicContact OE2-NH2 2.74Å; E156-R385 PolarHBondContact OE2-NH2 2.79Å; L368-R385 HydrophobicContact CD2-CB 3.67Å; L368-R385 HydrophobicContact CD2-CG 4.44Å; N369-R385 PolarHBondContact OD1-NE 3.12Å; I372-R385 HydrophobicContact CD1-CB 4.46Å; L381-R385 WeakPolarHBondContact O-CB 3.27Å; L381-R385 PolarHBondContact O-N 3.33Å; V382-R385 WeakPolarHBondContact O-CB 3.48Å; V382-R385 PolarHBondContact O-N 3.09Å; V382-R385 VanDerWaalsContact O-N 3.17Å; K383-R385 VanDerWaalsContact C-N 3.27Å; K383-R385 PolarHBondContact O-N 2.96Å; R385-F388 PolarHBondContact O-N 3.24Å; R385-L389 VanDerWaalsContact O-CB 3.26Å; R385-L389 WeakPolarHBondContact O-CB 3.28Å; R385-L389 PolarHBondContact O-N 2.91Å |
| 386 | L | 88.2 | Confident | 87.5 | Confident | 2 Ų | 2 | 33.9 Ų | 33.9 | 1% | 0.01 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.5 | -43.9 | 174.7 | -68.4 | 169.6 | 0 | 0 | 0 | 111.6 | Y73 F77 L81 L140 L233 V382 K383 L384 F388 L389 V390 | Y73-L386 HydrophobicContact CE1-CD1 3.81Å; Y73-L386 HydrophobicContact CE2-CD1 4.21Å; Y73-L386 WeakPolarHBondContact OH-CD1 3.46Å; F77-L386 HydrophobicContact CE1-CD1 4.28Å; F77-L386 HydrophobicContact CZ-CB 4.36Å; L81-L386 HydrophobicContact CD2-CB 3.85Å; L140-L386 HydrophobicContact CD2-CD1 3.84Å; L140-L386 HydrophobicContact CD2-CD2 4.29Å; L233-L386 HydrophobicContact CD1-CD2 4.23Å; V382-L386 PolarHBondContact O-N 2.73Å; K383-L386 PolarHBondContact O-N 3.16Å; L384-L386 VanDerWaalsContact C-N 3.34Å; L386-F388 PolarHBondContact O-N 2.81Å; L386-L389 WeakPolarHBondContact O-CB 3.28Å; L386-L389 PolarHBondContact O-N 2.98Å; L386-V390 VanDerWaalsContact O-CG2 3.32Å; L386-V390 WeakPolarHBondContact O-CG2 3.47Å; L386-V390 PolarHBondContact O-N 3.33Å |
| 387 | C | 92.5 | Very high | 88.5 | Confident | 44 Ų | 44 | 34 Ų | 34 | 30% | 0.297 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -59.7 | -46.3 | 176 | -63.9 | 0 | 0 | 0 | 0 | 112.8 | F77 K383 L384 L389 V390 M391 | F77-C387 VanDerWaalsContact CE2-SG 3.55Å; K383-C387 PolarHBondContact O-N 3.06Å; K383-C387 VanDerWaalsContact O-N 3.16Å; K383-C387 PolarHBondContact O-SG 2.92Å; K383-C387 VanDerWaalsContact O-SG 3.4Å; L384-C387 PolarHBondContact O-N 3.36Å; C387-L389 VanDerWaalsContact C-N 3.31Å; C387-V390 PolarHBondContact O-N 3.29Å; C387-M391 PolarHBondContact O-N 3.06Å; C387-M391 VanDerWaalsContact O-N 3.09Å |
| 388 | F | 94.4 | Very high | 89.1 | Confident | 55 Ų | 55 | 37.1 Ų | 37.1 | 24% | 0.241 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -72.6 | -25.8 | 178.5 | -63.6 | -29.9 | 0 | 0 | 0 | 112.8 | P364 I365 L368 L384 R385 L386 M391 A392 | P364-F388 HydrophobicContact CB-CB 4.12Å; P364-F388 HydrophobicContact CB-CD1 3.64Å; P364-F388 HydrophobicContact CB-CD2 3.9Å; P364-F388 HydrophobicContact CB-CE1 3.96Å; P364-F388 HydrophobicContact CB-CE2 4.21Å; P364-F388 HydrophobicContact CB-CG 3.62Å; P364-F388 HydrophobicContact CB-CZ 4.25Å; I365-F388 HydrophobicContact CB-CB 3.86Å; L368-F388 HydrophobicContact CB-CD2 3.97Å; L368-F388 HydrophobicContact CB-CE2 4.24Å; L368-F388 HydrophobicContact CD1-CE2 4.46Å; L368-F388 HydrophobicContact CD2-CD2 3.67Å; L368-F388 HydrophobicContact CD2-CE2 4.08Å; L368-F388 HydrophobicContact CG-CD2 4.36Å; L384-F388 HydrophobicContact CB-CE2 4.39Å; L384-F388 WeakPolarHBondContact O-CD2 3.2Å; L384-F388 WeakPolarHBondContact O-CG 3.41Å; L384-F388 PolarHBondContact O-N 3.26Å; R385-F388 PolarHBondContact O-N 3.24Å; L386-F388 PolarHBondContact O-N 2.81Å; F388-M391 HydrophobicContact CD1-CE 4.45Å; F388-M391 PolarHBondContact O-N 3.18Å; F388-A392 WeakPolarHBondContact O-CB 3.43Å; F388-A392 PolarHBondContact O-N 2.78Å |
| 389 | L | 92.7 | Very high | 89.5 | Confident | 3 Ų | 3 | 34.9 Ų | 34.9 | 2% | 0.016 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66 | -44.8 | 171.8 | -178 | 60.6 | 0 | 0 | 0 | 111.4 | T136 V159 I365 R385 L386 C387 M391 A392 Y393 | T136-L389 HydrophobicContact CG2-CD2 4.15Å; V159-L389 HydrophobicContact CG1-CD1 3.95Å; V159-L389 HydrophobicContact CG2-CD1 4.02Å; V159-L389 HydrophobicContact CG2-CD2 3.84Å; I365-L389 HydrophobicContact CD1-CB 3.82Å; I365-L389 HydrophobicContact CD1-CD1 3.77Å; I365-L389 HydrophobicContact CD1-CG 4.39Å; R385-L389 VanDerWaalsContact O-CB 3.26Å; R385-L389 WeakPolarHBondContact O-CB 3.28Å; R385-L389 PolarHBondContact O-N 2.91Å; L386-L389 WeakPolarHBondContact O-CB 3.28Å; L386-L389 PolarHBondContact O-N 2.98Å; C387-L389 VanDerWaalsContact C-N 3.31Å; L389-M391 VanDerWaalsContact C-N 3.31Å; L389-M391 PolarHBondContact O-N 2.89Å; L389-A392 WeakPolarHBondContact O-CB 3.42Å; L389-A392 PolarHBondContact O-N 3.36Å; L389-A392 VanDerWaalsContact O-N 3.08Å; L389-Y393 HydrophobicContact CD1-CE1 4.1Å; L389-Y393 HydrophobicContact CD1-CE2 4.01Å; L389-Y393 HydrophobicContact CD2-CE2 4.13Å; L389-Y393 HydrophobicContact CG-CD2 4.29Å; L389-Y393 HydrophobicContact CG-CE2 3.68Å; L389-Y393 PolarHBondContact O-N 2.98Å |
| 390 | V | 94.8 | Very high | 89.7 | Confident | 10 Ų | 10 | 30.4 Ų | 30.4 | 6% | 0.061 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59 | -46.1 | 172.8 | 179.5 | 0 | 0 | 0 | 0 | 110.3 | L81 F84 L85 L386 C387 A392 Y393 G394 | L81-V390 HydrophobicContact CD1-CB 4.11Å; L81-V390 HydrophobicContact CD1-CG1 4.44Å; L81-V390 HydrophobicContact CD1-CG2 3.47Å; L81-V390 VanDerWaalsContact CD1-CG2 3.47Å; L81-V390 HydrophobicContact CD2-CG2 3.97Å; L81-V390 HydrophobicContact CG-CG2 3.54Å; F84-V390 HydrophobicContact CB-CG1 4.04Å; L85-V390 HydrophobicContact CD1-CG2 4.09Å; L85-V390 HydrophobicContact CD2-CB 4.25Å; L85-V390 HydrophobicContact CD2-CG1 4.04Å; L85-V390 HydrophobicContact CD2-CG2 3.7Å; L85-V390 HydrophobicContact CG-CG1 4.28Å; L85-V390 HydrophobicContact CG-CG2 3.88Å; L386-V390 VanDerWaalsContact O-CG2 3.32Å; L386-V390 WeakPolarHBondContact O-CG2 3.47Å; L386-V390 PolarHBondContact O-N 3.33Å; C387-V390 PolarHBondContact O-N 3.29Å; V390-A392 PolarHBondContact O-N 3.36Å; V390-Y393 PolarHBondContact O-N 3.32Å; V390-Y393 VanDerWaalsContact O-N 3.1Å; V390-G394 PolarHBondContact O-N 3.43Å |
| 391 | M | 95.3 | Very high | 89.3 | Confident | 89 Ų | 89 | 28.2 Ų | 28.2 | 44% | 0.438 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -57.4 | -36.1 | 174.8 | -170.6 | 180 | -64.2 | 0 | 0 | 113.3 | C361 P364 C387 F388 L389 G394 | C361-M391 WeakPolarHBondContact CB-O 3.34Å; C361-M391 PolarHBondContact SG-O 3.15Å; C361-M391 VanDerWaalsContact SG-O 3.37Å; P364-M391 HydrophobicContact CG-SD 4.05Å; C387-M391 PolarHBondContact O-N 3.06Å; C387-M391 VanDerWaalsContact O-N 3.09Å; F388-M391 HydrophobicContact CD1-CE 4.45Å; F388-M391 PolarHBondContact O-N 3.18Å; L389-M391 VanDerWaalsContact C-N 3.31Å; L389-M391 PolarHBondContact O-N 2.89Å; M391-G394 PolarHBondContact O-N 2.91Å |
| 392 | A | 94.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -66.6 | -43.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | W362 I365 F388 L389 V390 G394 T395 | W362-A392 HydrophobicContact CD2-CB 3.85Å; W362-A392 HydrophobicContact CE3-CB 3.83Å; W362-A392 HydrophobicContact CG-CB 4.43Å; W362-A392 HydrophobicContact CH2-CB 4.09Å; W362-A392 HydrophobicContact CZ2-CB 4.14Å; W362-A392 HydrophobicContact CZ3-CB 3.92Å; I365-A392 HydrophobicContact CG2-CB 4.21Å; F388-A392 WeakPolarHBondContact O-CB 3.43Å; F388-A392 PolarHBondContact O-N 2.78Å; L389-A392 WeakPolarHBondContact O-CB 3.42Å; L389-A392 PolarHBondContact O-N 3.36Å; L389-A392 VanDerWaalsContact O-N 3.08Å; V390-A392 PolarHBondContact O-N 3.36Å; A392-G394 VanDerWaalsContact C-N 3.26Å; A392-G394 PolarHBondContact O-N 2.98Å; A392-T395 WeakPolarHBondContact O-CB 3.49Å; A392-T395 WeakPolarHBondContact O-CG2 3.15Å; A392-T395 PolarHBondContact O-N 3.45Å; A392-T395 PolarHBondContact O-OG1 3.02Å |
| 393 | Y | 95.4 | Very high | 88.2 | Confident | 1 Ų | 1 | 29 Ų | 29 | 0% | 0.004 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.8 | -27.7 | 175.5 | -66.6 | -34.7 | 0 | 0 | 0 | 113.5 | L85 E88 I128 C132 I133 T136 A162 L389 V390 T395 T396 | L85-Y393 HydrophobicContact CD2-CD2 3.84Å; L85-Y393 HydrophobicContact CD2-CE2 4.43Å; E88-Y393 WeakPolarHBondContact OE2-CB 3.47Å; I128-Y393 HydrophobicContact CG2-CD1 3.73Å; I128-Y393 HydrophobicContact CG2-CE1 4.1Å; C132-Y393 HydrophobicContact CB-CE1 3.95Å; I133-Y393 HydrophobicContact CD1-CG 4.4Å; I133-Y393 HydrophobicContact CG1-CD1 4.41Å; I133-Y393 HydrophobicContact CG1-CD2 3.94Å; I133-Y393 HydrophobicContact CG1-CE2 4.4Å; I133-Y393 HydrophobicContact CG1-CG 3.94Å; T136-Y393 HydrophobicContact CG2-CE2 4.24Å; T136-Y393 VanDerWaalsContact OG1-CE2 3.3Å; T136-Y393 WeakPolarHBondContact OG1-CE2 3.44Å; T136-Y393 PolarHBondContact OG1-OH 3.46Å; A162-Y393 HydrophobicContact CB-CE1 4.19Å; L389-Y393 HydrophobicContact CD1-CE1 4.1Å; L389-Y393 HydrophobicContact CD1-CE2 4.01Å; L389-Y393 HydrophobicContact CD2-CE2 4.13Å; L389-Y393 HydrophobicContact CG-CD2 4.29Å; L389-Y393 HydrophobicContact CG-CE2 3.68Å; L389-Y393 PolarHBondContact O-N 2.98Å; V390-Y393 PolarHBondContact O-N 3.32Å; V390-Y393 VanDerWaalsContact O-N 3.1Å; Y393-T395 PolarHBondContact O-N 3.36Å; Y393-T396 WeakPolarHBondContact O-CB 3.37Å; Y393-T396 WeakPolarHBondContact O-CG2 3.09Å; Y393-T396 PolarHBondContact O-N 3.41Å; Y393-T396 PolarHBondContact O-OG1 3.14Å |
| 394 | G | 93.8 | Very high | 87.3 | Confident | 5 Ų | 5 | 27.3 Ų | 27.3 | 5% | 0.052 | 15% | 0.145 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -52.9 | -20.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | E88 V390 M391 A392 T396 I397 F398 | E88-G394 PolarHBondContact OE1-N 3.48Å; V390-G394 PolarHBondContact O-N 3.43Å; M391-G394 PolarHBondContact O-N 2.91Å; A392-G394 VanDerWaalsContact C-N 3.26Å; A392-G394 PolarHBondContact O-N 2.98Å; G394-T396 PolarHBondContact O-N 2.93Å; G394-I397 PolarHBondContact O-N 3.05Å; G394-I397 VanDerWaalsContact O-N 3.13Å; G394-F398 WeakPolarHBondContact O-CD2 3.36Å; G394-F398 PolarHBondContact O-N 3.39Å |
| 395 | T | 92.6 | Very high | 85.9 | Confident | 1 Ų | 1 | 29.9 Ų | 29.9 | 1% | 0.006 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -53.6 | -34.4 | 171.1 | 51.9 | 0 | 0 | 0 | 0 | 113.3 | T357 C361 A392 Y393 I397 F398 H399 | T357-T395 HydrophobicContact CG2-CG2 4.4Å; C361-T395 HydrophobicContact CB-CG2 3.36Å; A392-T395 WeakPolarHBondContact O-CB 3.49Å; A392-T395 WeakPolarHBondContact O-CG2 3.15Å; A392-T395 PolarHBondContact O-N 3.45Å; A392-T395 PolarHBondContact O-OG1 3.02Å; Y393-T395 PolarHBondContact O-N 3.36Å; T395-I397 VanDerWaalsContact C-N 3.29Å; T395-I397 PolarHBondContact O-N 3.02Å; T395-F398 PolarHBondContact O-N 3.06Å; T395-H399 PolarHBondContact O-N 3.1Å; T395-H399 VanDerWaalsContact O-N 3.1Å; T395-H399 PolarHBondContact O-ND1 2.97Å |
| 396 | T | 93.4 | Very high | 84.6 | Confident | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.9 | -34.6 | 179.1 | 61.7 | 0 | 0 | 0 | 0 | 112.6 | N96 D125 I128 Y393 G394 P400 | N96-T396 PolarHBondContact ND2-O 3.5Å; D125-T396 HydrophobicContact CB-CG2 4.13Å; I128-T396 HydrophobicContact CB-CG2 4.06Å; I128-T396 HydrophobicContact CG2-CG2 3.8Å; Y393-T396 WeakPolarHBondContact O-CB 3.37Å; Y393-T396 WeakPolarHBondContact O-CG2 3.09Å; Y393-T396 PolarHBondContact O-N 3.41Å; Y393-T396 PolarHBondContact O-OG1 3.14Å; G394-T396 PolarHBondContact O-N 2.93Å; T396-P400 WeakPolarHBondContact O-CD 3.5Å |
| 397 | I | 92.9 | Very high | 83.2 | Confident | 22 Ų | 22 | 37.1 Ų | 37.1 | 11% | 0.113 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -76.4 | -45.2 | 175.8 | -56.7 | 165.5 | 0 | 0 | 0 | 110.2 | E88 L91 G394 T395 H399 L401 | E88-I397 HydrophobicContact CB-CD1 4.24Å; E88-I397 HydrophobicContact CG-CD1 3.66Å; E88-I397 HydrophobicContact CG-CG1 4.44Å; L91-I397 HydrophobicContact CB-CD1 4.16Å; L91-I397 HydrophobicContact CB-CG1 3.94Å; L91-I397 HydrophobicContact CB-CG2 4.07Å; L91-I397 HydrophobicContact CD1-CD1 4.24Å; L91-I397 HydrophobicContact CD1-CG2 4.42Å; G394-I397 PolarHBondContact O-N 3.05Å; G394-I397 VanDerWaalsContact O-N 3.13Å; T395-I397 VanDerWaalsContact C-N 3.29Å; T395-I397 PolarHBondContact O-N 3.02Å; I397-H399 VanDerWaalsContact C-N 3.33Å; I397-H399 PolarHBondContact O-N 3.04Å; I397-L401 HydrophobicContact CG2-CD1 3.67Å; I397-L401 HydrophobicContact CG2-CG 4.33Å; I397-L401 WeakPolarHBondContact O-CG 3.5Å |
| 398 | F | 88.8 | Confident | 81.4 | Confident | 94 Ų | 94 | 37 Ų | 37 | 41% | 0.412 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -66.6 | -35.3 | -170.4 | -69.5 | -55.4 | 0 | 0 | 0 | 112.4 | T357 G394 T395 L401 L402 | T357-F398 HydrophobicContact CG2-CB 3.54Å; T357-F398 HydrophobicContact CG2-CD2 3.59Å; T357-F398 HydrophobicContact CG2-CG 3.8Å; G394-F398 WeakPolarHBondContact O-CD2 3.36Å; G394-F398 PolarHBondContact O-N 3.39Å; T395-F398 PolarHBondContact O-N 3.06Å; F398-L401 PolarHBondContact O-N 3.33Å; F398-L402 WeakPolarHBondContact O-CB 3.44Å; F398-L402 WeakPolarHBondContact O-CG 3.37Å; F398-L402 PolarHBondContact O-N 2.75Å |
| 399 | H | 86 | Confident | 79.3 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -51.7 | -69.8 | -179.8 | -68.5 | 150.8 | 0 | 0 | 0 | 111.3 | L121 D125 T395 I397 L401 L402 Y403 | L121-H399 HydrophobicContact CD2-CB 4.16Å; D125-H399 IonicContact OD1-CE1 3Å; D125-H399 IonicContact OD1-ND1 3.76Å; D125-H399 PolarHBondContact OD1-ND1 3.04Å; D125-H399 WeakPolarHBondContact OD2-CB 3.43Å; D125-H399 IonicContact OD2-CE1 3.54Å; D125-H399 IonicContact OD2-CG 3.86Å; D125-H399 IonicContact OD2-ND1 4Å; D125-H399 PolarHBondContact OD2-ND1 3.44Å; T395-H399 PolarHBondContact O-N 3.1Å; T395-H399 VanDerWaalsContact O-N 3.1Å; T395-H399 PolarHBondContact O-ND1 2.97Å; I397-H399 VanDerWaalsContact C-N 3.33Å; I397-H399 PolarHBondContact O-N 3.04Å; H399-L401 VanDerWaalsContact C-N 3.29Å; H399-L401 PolarHBondContact O-N 3.46Å; H399-L401 VanDerWaalsContact O-N 3.17Å; H399-L402 WeakPolarHBondContact O-CB 3.44Å; H399-L402 PolarHBondContact O-N 3.35Å; H399-Y403 WeakPolarHBondContact O-CD2 3.34Å; H399-Y403 PolarHBondContact O-N 3.17Å; H399-Y403 VanDerWaalsContact O-N 3.17Å |
| 400 | P | 82.1 | Confident | 77 | Confident | 7 Ų | 7 | 47.2 Ų | 47.2 | 5% | 0.045 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -50.6 | -40.9 | 177.2 | -30.5 | 36 | 0 | 0 | 0 | 115.6 | S95 N96 V99 T396 L402 Y403 A404 | S95-P400 WeakPolarHBondContact OG-CG 3.22Å; N96-P400 HydrophobicContact CB-CG 4.28Å; N96-P400 WeakPolarHBondContact OD1-CD 3.39Å; N96-P400 WeakPolarHBondContact OD1-CG 3.28Å; V99-P400 HydrophobicContact CG2-CB 4.21Å; T396-P400 WeakPolarHBondContact O-CD 3.5Å; P400-L402 VanDerWaalsContact C-N 3.33Å; P400-L402 PolarHBondContact O-N 2.99Å; P400-Y403 CarbonylContact O-C 3.21Å; P400-Y403 WeakPolarHBondContact O-CA 3.47Å; P400-Y403 WeakPolarHBondContact O-CB 3.46Å; P400-Y403 PolarHBondContact O-N 3.15Å; P400-Y403 VanDerWaalsContact O-N 3.09Å; P400-A404 PolarHBondContact O-N 3.27Å |
| 401 | L | 72.6 | Confident | 75.1 | Confident | 67 Ų | 67 | 50.5 Ų | 50.5 | 35% | 0.351 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.6 | -41.6 | 179.4 | -69.3 | -177.1 | 0 | 0 | 0 | 111.2 | I397 F398 H399 Y403 A404 F405 | I397-L401 HydrophobicContact CG2-CD1 3.67Å; I397-L401 HydrophobicContact CG2-CG 4.33Å; I397-L401 WeakPolarHBondContact O-CG 3.5Å; F398-L401 PolarHBondContact O-N 3.33Å; H399-L401 VanDerWaalsContact C-N 3.29Å; H399-L401 PolarHBondContact O-N 3.46Å; H399-L401 VanDerWaalsContact O-N 3.17Å; L401-Y403 VanDerWaalsContact C-N 3.31Å; L401-Y403 PolarHBondContact O-N 3.08Å; L401-A404 PolarHBondContact O-N 3.46Å; L401-F405 HydrophobicContact CB-CD2 4.04Å; L401-F405 HydrophobicContact CB-CE2 3.95Å; L401-F405 HydrophobicContact CD2-CE2 3.97Å; L401-F405 HydrophobicContact CG-CE2 4.4Å; L401-F405 WeakPolarHBondContact O-CB 3.28Å; L401-F405 WeakPolarHBondContact O-CD2 3.46Å; L401-F405 WeakPolarHBondContact O-CG 3.5Å; L401-F405 PolarHBondContact O-N 3.44Å |
| 402 | L | 73 | Confident | 73.3 | Confident | 27 Ų | 27 | 53.2 Ų | 53.2 | 14% | 0.141 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.9 | -35.6 | 174 | -66.2 | 173.5 | 0 | 0 | 0 | 111.5 | L353 I354 F398 H399 P400 T406 | L353-L402 HydrophobicContact CB-CD1 4Å; L353-L402 HydrophobicContact CB-CD2 3.9Å; L353-L402 HydrophobicContact CB-CG 4.43Å; L353-L402 HydrophobicContact CD1-CD2 4.12Å; L353-L402 HydrophobicContact CG-CD2 4.41Å; I354-L402 HydrophobicContact CG1-CD1 4.43Å; F398-L402 WeakPolarHBondContact O-CB 3.44Å; F398-L402 WeakPolarHBondContact O-CG 3.37Å; F398-L402 PolarHBondContact O-N 2.75Å; H399-L402 WeakPolarHBondContact O-CB 3.44Å; H399-L402 PolarHBondContact O-N 3.35Å; P400-L402 VanDerWaalsContact C-N 3.33Å; P400-L402 PolarHBondContact O-N 2.99Å; L402-T406 VanDerWaalsContact O-CB 3.23Å; L402-T406 WeakPolarHBondContact O-CB 3.35Å; L402-T406 WeakPolarHBondContact O-CG2 3.28Å; L402-T406 PolarHBondContact O-N 2.75Å; L402-T406 VanDerWaalsContact O-N 3.15Å; L402-T406 PolarHBondContact O-OG1 2.74Å |
| 403 | Y | 68.3 | Low | 71.3 | Confident | 33 Ų | 33 | 56.9 Ų | 56.9 | 13% | 0.129 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65.7 | -38.5 | 171.9 | -74 | -103.6 | 0 | 0 | 0 | 112.8 | T118 M350 I354 H399 P400 L401 | T118-Y403 HydrophobicContact CG2-CD1 3.96Å; T118-Y403 HydrophobicContact CG2-CE1 3.16Å; T118-Y403 HydrophobicContact CG2-CE2 4.37Å; T118-Y403 VanDerWaalsContact CG2-CZ 3.43Å; T118-Y403 WeakPolarHBondContact CG2-OH 3Å; T118-Y403 PolarHBondContact OG1-OH 3.2Å; M350-Y403 HydrophobicContact CE-CD1 2.84Å; M350-Y403 HydrophobicContact CE-CD2 3.53Å; M350-Y403 HydrophobicContact CE-CE1 3.06Å; M350-Y403 HydrophobicContact CE-CE2 3.78Å; M350-Y403 HydrophobicContact CE-CG 3.01Å; M350-Y403 HydrophobicContact SD-CD1 4.29Å; M350-Y403 HydrophobicContact SD-CE1 4.29Å; I354-Y403 HydrophobicContact CD1-CE2 3.55Å; I354-Y403 WeakPolarHBondContact CD1-OH 3.45Å; I354-Y403 HydrophobicContact CG1-CE2 4.29Å; H399-Y403 WeakPolarHBondContact O-CD2 3.34Å; H399-Y403 PolarHBondContact O-N 3.17Å; H399-Y403 VanDerWaalsContact O-N 3.17Å; P400-Y403 CarbonylContact O-C 3.21Å; P400-Y403 WeakPolarHBondContact O-CA 3.47Å; P400-Y403 WeakPolarHBondContact O-CB 3.46Å; P400-Y403 PolarHBondContact O-N 3.15Å; P400-Y403 VanDerWaalsContact O-N 3.09Å; L401-Y403 VanDerWaalsContact C-N 3.31Å; L401-Y403 PolarHBondContact O-N 3.08Å |
| 404 | A | 65.3 | Low | 69.2 | Low | 48 Ų | 48 | 60.9 Ų | 60.9 | 40% | 0.397 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -71.8 | -50.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | P400 L401 T406 R407 | P400-A404 PolarHBondContact O-N 3.27Å; L401-A404 PolarHBondContact O-N 3.46Å; A404-T406 PolarHBondContact O-N 3.13Å; A404-R407 PolarHBondContact O-N 3.1Å |
| 405 | F | 59.2 | Low | 67.5 | Low | 114 Ų | 114 | 67.5 Ų | 67.5 | 50% | 0.5 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -73.1 | -27.1 | -174.5 | -70 | -59.5 | 0 | 0 | 0 | 113.6 | L401 R407 F410 Q411 | L401-F405 HydrophobicContact CB-CD2 4.04Å; L401-F405 HydrophobicContact CB-CE2 3.95Å; L401-F405 HydrophobicContact CD2-CE2 3.97Å; L401-F405 HydrophobicContact CG-CE2 4.4Å; L401-F405 WeakPolarHBondContact O-CB 3.28Å; L401-F405 WeakPolarHBondContact O-CD2 3.46Å; L401-F405 WeakPolarHBondContact O-CG 3.5Å; L401-F405 PolarHBondContact O-N 3.44Å; F405-R407 VanDerWaalsContact C-N 3.32Å; F405-R407 PolarHBondContact O-N 2.54Å; F405-F410 HydrophobicContact CE1-CE1 4.47Å; F405-Q411 PolarHBondContact O-NE2 2.82Å |
| 406 | T | 60.4 | Low | 65.7 | Low | 7 Ų | 7 | 70.1 Ų | 70.1 | 4% | 0.043 | 34% | 0.335 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | -13.6 | 177.5 | 59.7 | 0 | 0 | 0 | 0 | 113.5 | R346 M350 L353 L402 A404 Q408 | R346-T406 WeakPolarHBondContact CD-O 3.26Å; R346-T406 WeakPolarHBondContact CG-O 3.35Å; M350-T406 HydrophobicContact CB-CG2 4.2Å; M350-T406 HydrophobicContact CG-CG2 4.33Å; L353-T406 HydrophobicContact CD1-CG2 3.52Å; L402-T406 VanDerWaalsContact O-CB 3.23Å; L402-T406 WeakPolarHBondContact O-CB 3.35Å; L402-T406 WeakPolarHBondContact O-CG2 3.28Å; L402-T406 PolarHBondContact O-N 2.75Å; L402-T406 VanDerWaalsContact O-N 3.15Å; L402-T406 PolarHBondContact O-OG1 2.74Å; A404-T406 PolarHBondContact O-N 3.13Å; T406-Q408 PolarHBondContact O-N 3.04Å; T406-Q408 VanDerWaalsContact O-N 3.14Å |
| 407 | R | 59.6 | Low | 63.9 | Low | 153 Ų | 153 | 76.8 Ų | 76.8 | 58% | 0.577 | 36% | 0.363 | S | S | * | . | trans | -70.8 | 108.9 | 174.4 | -86 | -175.4 | 171.6 | -159 | 2.8 | 110.4 | A404 F405 K409 F410 Q411 | A404-R407 PolarHBondContact O-N 3.1Å; F405-R407 VanDerWaalsContact C-N 3.32Å; F405-R407 PolarHBondContact O-N 2.54Å; R407-K409 PolarHBondContact O-N 2.9Å; R407-F410 PolarHBondContact O-N 3.42Å; R407-Q411 PolarHBondContact O-N 3.27Å | ||
| 408 | Q | 53.6 | Low | 62 | Low | 42 Ų | 42 | 81.2 Ų | 81.2 | 20% | 0.196 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -52.6 | -21.1 | 173.6 | -65.6 | 175.5 | -7.9 | 0 | 0 | 114.3 | T406 K412 | T406-Q408 PolarHBondContact O-N 3.04Å; T406-Q408 VanDerWaalsContact O-N 3.14Å; Q408-K412 WeakPolarHBondContact O-CB 3.45Å; Q408-K412 WeakPolarHBondContact O-CG 3.33Å; Q408-K412 PolarHBondContact O-N 2.89Å |
| 409 | K | 50.7 | Low | 60.6 | Low | 166 Ų | 166 | 84.2 Ų | 84.2 | 72% | 0.722 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -68.5 | -42.1 | 174.7 | -73.8 | -169.1 | 176.9 | -172.9 | 0 | 111.4 | R407 K412 V413 | R407-K409 PolarHBondContact O-N 2.9Å; K409-K412 PolarHBondContact O-N 3.39Å; K409-V413 WeakPolarHBondContact O-CG2 3.32Å; K409-V413 PolarHBondContact O-N 3.49Å |
| 410 | F | 44.7 | Very low | 59.1 | Low | 106 Ų | 106 | 91.8 Ų | 91.8 | 47% | 0.465 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -68.2 | -43.5 | 177.1 | -166 | -102.2 | 0 | 0 | 0 | 110.7 | F405 R407 K412 V413 L414 | F405-F410 HydrophobicContact CE1-CE1 4.47Å; R407-F410 PolarHBondContact O-N 3.42Å; F410-K412 VanDerWaalsContact C-N 3.29Å; F410-K412 PolarHBondContact O-N 3.4Å; F410-V413 PolarHBondContact O-N 2.93Å; F410-V413 VanDerWaalsContact O-N 3.14Å; F410-L414 VanDerWaalsContact O-CB 3.31Å; F410-L414 WeakPolarHBondContact O-CB 3.37Å; F410-L414 PolarHBondContact O-N 3.39Å |
| 411 | Q | 54.4 | Low | 57.8 | Low | 79 Ų | 79 | 100.5 Ų | 100.5 | 37% | 0.369 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.8 | -35.5 | 172.5 | -66.5 | -169.8 | -3.3 | 0 | 0 | 113.1 | F405 R407 K415 | F405-Q411 PolarHBondContact O-NE2 2.82Å; R407-Q411 PolarHBondContact O-N 3.27Å; Q411-K415 WeakPolarHBondContact O-CB 3.25Å; Q411-K415 WeakPolarHBondContact O-CG 3.41Å; Q411-K415 PolarHBondContact O-N 3.43Å |
| 412 | K | 57.6 | Low | 56.9 | Low | 146 Ų | 146 | 101.5 Ų | 101.5 | 64% | 0.635 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -69.7 | -36.5 | 175.2 | -78.5 | 176 | -176.7 | -171.2 | 0 | 112.4 | Q408 K409 F410 S416 | Q408-K412 WeakPolarHBondContact O-CB 3.45Å; Q408-K412 WeakPolarHBondContact O-CG 3.33Å; Q408-K412 PolarHBondContact O-N 2.89Å; K409-K412 PolarHBondContact O-N 3.39Å; F410-K412 VanDerWaalsContact C-N 3.29Å; F410-K412 PolarHBondContact O-N 3.4Å; K412-S416 WeakPolarHBondContact O-CB 3Å; K412-S416 PolarHBondContact O-N 3.36Å; K412-S416 PolarHBondContact O-OG 2.87Å |
| 413 | V | 53.5 | Low | 56 | Low | 76 Ų | 76 | 103.6 Ų | 103.6 | 46% | 0.461 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -72.5 | -41.3 | 175.6 | 173 | 0 | 0 | 0 | 0 | 111 | K409 F410 S416 K417 | K409-V413 WeakPolarHBondContact O-CG2 3.32Å; K409-V413 PolarHBondContact O-N 3.49Å; F410-V413 PolarHBondContact O-N 2.93Å; F410-V413 VanDerWaalsContact O-N 3.14Å; V413-S416 WeakPolarHBondContact CA-OG 3.31Å; V413-S416 PolarHBondContact O-N 3.29Å; V413-S416 PolarHBondContact O-OG 3.15Å; V413-K417 WeakPolarHBondContact O-CB 3.01Å; V413-K417 WeakPolarHBondContact O-CG 3.48Å; V413-K417 PolarHBondContact O-N 3.09Å |
| 414 | L | 51.6 | Low | 55.1 | Low | 86 Ų | 86 | 105.9 Ų | 105.9 | 45% | 0.45 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.9 | -46.7 | 175.6 | -167.2 | 71.7 | 0 | 0 | 0 | 110.6 | F410 S416 K417 M418 | F410-L414 VanDerWaalsContact O-CB 3.31Å; F410-L414 WeakPolarHBondContact O-CB 3.37Å; F410-L414 PolarHBondContact O-N 3.39Å; L414-S416 VanDerWaalsContact C-N 3.35Å; L414-S416 PolarHBondContact O-N 2.03Å; L414-K417 PolarHBondContact O-N 2.9Å; L414-M418 HydrophobicContact CG-SD 4.38Å; L414-M418 WeakPolarHBondContact O-CB 3.17Å; L414-M418 VanDerWaalsContact O-CG 3.28Å; L414-M418 WeakPolarHBondContact O-CG 3.49Å; L414-M418 PolarHBondContact O-N 3.44Å |
| 415 | K | 56.9 | Low | 54.3 | Low | 144 Ų | 144 | 109.4 Ų | 109.4 | 63% | 0.626 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.8 | -33.2 | 173.9 | -72.3 | -178.2 | 179.4 | -167.1 | 0 | 112.6 | Q411 K419 | Q411-K415 WeakPolarHBondContact O-CB 3.25Å; Q411-K415 WeakPolarHBondContact O-CG 3.41Å; Q411-K415 PolarHBondContact O-N 3.43Å; K415-K419 WeakPolarHBondContact O-CB 3.49Å; K415-K419 PolarHBondContact O-N 3.23Å |
| 416 | S | 56 | Low | 53.9 | Low | 56 Ų | 56 | 109.3 Ų | 109.3 | 39% | 0.392 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -73.2 | -36.4 | 174.9 | 72.9 | 0 | 0 | 0 | 0 | 112 | K412 V413 L414 K420 | K412-S416 WeakPolarHBondContact O-CB 3Å; K412-S416 PolarHBondContact O-N 3.36Å; K412-S416 PolarHBondContact O-OG 2.87Å; V413-S416 WeakPolarHBondContact CA-OG 3.31Å; V413-S416 PolarHBondContact O-N 3.29Å; V413-S416 PolarHBondContact O-OG 3.15Å; L414-S416 VanDerWaalsContact C-N 3.35Å; L414-S416 PolarHBondContact O-N 2.03Å; S416-K420 WeakPolarHBondContact O-CB 3.41Å; S416-K420 VanDerWaalsContact O-CG 3.25Å; S416-K420 WeakPolarHBondContact O-CG 3.39Å; S416-K420 PolarHBondContact O-N 3.01Å |
| 417 | K | 54.8 | Low | 53.3 | Low | 140 Ų | 140 | 116.5 Ų | 116.5 | 61% | 0.609 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.9 | -43 | 171.9 | -78.7 | -166.2 | 174.3 | -163.3 | 0 | 112.1 | V413 L414 K420 R421 | V413-K417 WeakPolarHBondContact O-CB 3.01Å; V413-K417 WeakPolarHBondContact O-CG 3.48Å; V413-K417 PolarHBondContact O-N 3.09Å; L414-K417 PolarHBondContact O-N 2.9Å; K417-K420 PolarHBondContact O-N 2.93Å; K417-R421 PolarHBondContact O-N 2.92Å |
| 418 | M | 52.8 | Low | 52.5 | Low | 115 Ų | 115 | 112.4 Ų | 112.4 | 57% | 0.567 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67 | -42.1 | 175.2 | -71.3 | -174.4 | 82 | 0 | 0 | 111.6 | L414 K420 R421 V422 | L414-M418 HydrophobicContact CG-SD 4.38Å; L414-M418 WeakPolarHBondContact O-CB 3.17Å; L414-M418 VanDerWaalsContact O-CG 3.28Å; L414-M418 WeakPolarHBondContact O-CG 3.49Å; L414-M418 PolarHBondContact O-N 3.44Å; M418-K420 VanDerWaalsContact C-N 3.32Å; M418-K420 PolarHBondContact O-N 3.38Å; M418-R421 PolarHBondContact O-N 2.73Å; M418-V422 WeakPolarHBondContact O-CB 3.13Å; M418-V422 VanDerWaalsContact O-CG2 3.26Å; M418-V422 WeakPolarHBondContact O-CG2 3.02Å; M418-V422 PolarHBondContact O-N 2.81Å |
| 419 | K | 59.6 | Low | 51.5 | Low | 157 Ų | 157 | 117.2 Ų | 117.2 | 68% | 0.683 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -63.7 | -37.1 | 174.6 | -168.3 | 175.1 | -176.9 | -177.7 | 0 | 111.8 | K415 V423 | K415-K419 WeakPolarHBondContact O-CB 3.49Å; K415-K419 PolarHBondContact O-N 3.23Å; K419-V423 HydrophobicContact CG-CG2 4.43Å; K419-V423 WeakPolarHBondContact O-CB 3.47Å; K419-V423 WeakPolarHBondContact O-CG2 3.39Å; K419-V423 PolarHBondContact O-N 2.88Å |
| 420 | K | 54.5 | Low | 51 | Low | 158 Ų | 158 | 115.2 Ų | 115.2 | 69% | 0.687 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -65.9 | -40.6 | 172.2 | -79.1 | -179.7 | 177.8 | -167.7 | 0 | 112.7 | S416 K417 M418 S424 | S416-K420 WeakPolarHBondContact O-CB 3.41Å; S416-K420 VanDerWaalsContact O-CG 3.25Å; S416-K420 WeakPolarHBondContact O-CG 3.39Å; S416-K420 PolarHBondContact O-N 3.01Å; K417-K420 PolarHBondContact O-N 2.93Å; M418-K420 VanDerWaalsContact C-N 3.32Å; M418-K420 PolarHBondContact O-N 3.38Å; K420-S424 WeakPolarHBondContact O-CB 3.47Å; K420-S424 PolarHBondContact O-N 3.33Å |
| 421 | R | 53.9 | Low | 50.6 | Low | 191 Ų | 191 | 118.8 Ų | 118.8 | 72% | 0.721 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -68.2 | -40.4 | 175.8 | -78.2 | -170.5 | 177 | -175.7 | -1.9 | 112.3 | K417 M418 S424 I425 | K417-R421 PolarHBondContact O-N 2.92Å; M418-R421 PolarHBondContact O-N 2.73Å; R421-S424 PolarHBondContact O-N 3.05Å; R421-I425 WeakPolarHBondContact O-CB 3.32Å; R421-I425 WeakPolarHBondContact O-CD1 3.32Å; R421-I425 WeakPolarHBondContact O-CG1 3.37Å; R421-I425 PolarHBondContact O-N 3.02Å |
| 422 | V | 54.6 | Low | 50.1 | Low | 88 Ų | 88 | 120.3 Ų | 120.3 | 53% | 0.533 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -67.5 | -42.5 | 176.8 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | M418 I425 V426 | M418-V422 WeakPolarHBondContact O-CB 3.13Å; M418-V422 VanDerWaalsContact O-CG2 3.26Å; M418-V422 WeakPolarHBondContact O-CG2 3.02Å; M418-V422 PolarHBondContact O-N 2.81Å; V422-I425 PolarHBondContact O-N 3.17Å; V422-V426 VanDerWaalsContact O-CG2 3.3Å; V422-V426 WeakPolarHBondContact O-CG2 3.39Å; V422-V426 PolarHBondContact O-N 3.07Å |
| 423 | V | 53.7 | Low | 49.2 | Very low | 71 Ų | 71 | 120.8 Ų | 120.8 | 43% | 0.43 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -65.3 | -40.1 | 174.7 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | K419 I425 V426 E427 | K419-V423 HydrophobicContact CG-CG2 4.43Å; K419-V423 WeakPolarHBondContact O-CB 3.47Å; K419-V423 WeakPolarHBondContact O-CG2 3.39Å; K419-V423 PolarHBondContact O-N 2.88Å; V423-I425 VanDerWaalsContact C-N 3.27Å; V423-I425 PolarHBondContact O-N 2.91Å; V423-V426 PolarHBondContact O-N 3.21Å; V423-E427 WeakPolarHBondContact O-CB 3.01Å; V423-E427 PolarHBondContact O-N 2.82Å |
| 424 | S | 49 | Very low | 49 | Very low | 81 Ų | 81 | 124.7 Ų | 124.7 | 57% | 0.566 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -65.8 | -24.3 | 175.5 | 178.8 | 0 | 0 | 0 | 0 | 114.5 | K420 R421 | K420-S424 WeakPolarHBondContact O-CB 3.47Å; K420-S424 PolarHBondContact O-N 3.33Å; R421-S424 PolarHBondContact O-N 3.05Å |
| 425 | I | 50 | Low | 48.4 | Very low | 122 Ų | 122 | 124.7 Ų | 124.7 | 63% | 0.626 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -86.6 | -32.8 | 177.2 | -70.9 | 164.9 | 0 | 0 | 0 | 110.4 | R421 V422 V423 | R421-I425 WeakPolarHBondContact O-CB 3.32Å; R421-I425 WeakPolarHBondContact O-CD1 3.32Å; R421-I425 WeakPolarHBondContact O-CG1 3.37Å; R421-I425 PolarHBondContact O-N 3.02Å; V422-I425 PolarHBondContact O-N 3.17Å; V423-I425 VanDerWaalsContact C-N 3.27Å; V423-I425 PolarHBondContact O-N 2.91Å |
| 426 | V | 50 | Low | 47.5 | Very low | 112 Ų | 112 | 124.5 Ų | 124.5 | 68% | 0.679 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -75.1 | -24.6 | 176.5 | 172.5 | 0 | 0 | 0 | 0 | 112.4 | V422 V423 A428 | V422-V426 VanDerWaalsContact O-CG2 3.3Å; V422-V426 WeakPolarHBondContact O-CG2 3.39Å; V422-V426 PolarHBondContact O-N 3.07Å; V423-V426 PolarHBondContact O-N 3.21Å; V426-A428 VanDerWaalsContact C-N 3.33Å |
| 427 | E | 47.8 | Very low | 46.8 | Very low | 158 Ų | 158 | 128 Ų | 128 | 74% | 0.738 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | 0.2 | 177.2 | -146.4 | 125.2 | -170.6 | 0 | 0 | 113.4 | V423 | V423-E427 WeakPolarHBondContact O-CB 3.01Å; V423-E427 PolarHBondContact O-N 2.82Å |
| 428 | A | 42.1 | Very low | 46 | Very low | 66 Ų | 66 | 129 Ų | 129 | 55% | 0.545 | 70% | 0.696 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.8 | 3.8 | -176 | 0 | 0 | 0 | 0 | 0 | 114.5 | V426 P430 | V426-A428 VanDerWaalsContact C-N 3.33Å; A428-P430 VanDerWaalsContact O-CD 3.24Å; A428-P430 WeakPolarHBondContact O-CD 3.22Å |
| 429 | D | 33.8 | Very low | 45.1 | Very low | 144 Ų | 144 | 130.1 Ų | 130.1 | 77% | 0.77 | 70% | 0.704 | S | S | * | * | trans | -103.4 | 99 | 169.9 | -75.1 | -31.2 | 0 | 0 | 0 | 110.3 | M431 | D429-M431 PolarHBondContact O-N 2.81Š| ||
| 430 | P | 38.7 | Very low | 44.4 | Very low | 123 Ų | 123 | 127 Ų | 127 | 80% | 0.799 | 70% | 0.702 | S | S | * | * | trans | -80.9 | 104.3 | 168.6 | 31.2 | -29.5 | 0 | 0 | 0 | 109.2 | A428 | A428-P430 VanDerWaalsContact O-CD 3.24Å; A428-P430 WeakPolarHBondContact O-CD 3.22Å | ||
| 431 | M | 38 | Very low | 43.8 | Very low | 181 Ų | 181 | 130.6 Ų | 130.6 | 89% | 0.892 | 71% | 0.711 | S | S | * | * | trans | -81.4 | 130.5 | 157.1 | -101.7 | 177.6 | 70.8 | 0 | 0 | 109.1 | D429 N433 | D429-M431 PolarHBondContact O-N 2.81Å; M431-N433 PolarHBondContact O-N 3.35Å | ||
| 432 | P | 43.6 | Very low | 42.9 | Very low | 111 Ų | 111 | 129 Ų | 129 | 72% | 0.721 | 72% | 0.715 | S | S | * | * | trans | -83.6 | 104.1 | 178.8 | 32.8 | -28.3 | 0 | 0 | 0 | 108.4 | ||||
| 433 | N | 39.1 | Very low | 42.1 | Very low | 156 Ų | 156 | 131.5 Ų | 131.5 | 83% | 0.834 | 73% | 0.726 | S | S | * | * | trans | 171.5 | 120.4 | 135 | -91.8 | -19 | 0 | 0 | 0 | 111.4 | M431 | M431-N433 PolarHBondContact O-N 3.35Š| ||
| 434 | N | 48.5 | Very low | 41.3 | Very low | 158 Ų | 158 | 133.8 Ų | 133.8 | 85% | 0.845 | 74% | 0.742 | S | S | * | * | trans | 16.5 | 106 | 153.1 | -77.9 | -6.7 | 0 | 0 | 0 | 118.9 | ||||
| 435 | A | 38.8 | Very low | 40.7 | Very low | 87 Ų | 87 | 139.7 Ų | 139.7 | 72% | 0.719 | 76% | 0.758 | S | S | * | * | -157.3 | 101.3 | 129.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | I437 | A435-I437 PolarHBondContact O-N 2.99Å; A435-I437 VanDerWaalsContact O-N 3.09Å | |||
| 436 | V | 38.4 | Very low | 40.3 | Very low | 139 Ų | 139 | 145 Ų | 145 | 84% | 0.842 | 77% | 0.77 | S | S | * | * | trans | -71.2 | 98.9 | 171.1 | 176.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 437 | I | 41.1 | Very low | 39.5 | Very low | 130 Ų | 130 | 146.7 Ų | 146.7 | 67% | 0.667 | 78% | 0.775 | S | S | * | * | trans | -98.6 | 102.2 | 167.7 | -59.1 | 177.7 | 0 | 0 | 0 | 107.7 | A435 N439 | A435-I437 PolarHBondContact O-N 2.99Å; A435-I437 VanDerWaalsContact O-N 3.09Å; I437-N439 PolarHBondContact O-N 3.23Å | ||
| 438 | H | 37.8 | Very low | 38.9 | Very low | 161 Ų | 161 | 148.7 Ų | 148.7 | 75% | 0.745 | 78% | 0.781 | S | S | * | * | trans | -76.4 | 88.3 | 176.8 | -168.5 | -80.6 | 0 | 0 | 0 | 110.4 | S440 | H438-S440 PolarHBondContact O-N 3.26Š| ||
| 439 | N | 35.2 | Very low | 38.5 | Very low | 139 Ų | 139 | 155.8 Ų | 155.8 | 74% | 0.743 | 80% | 0.8 | S | S | * | * | trans | -84.7 | 95.3 | 168.7 | -75 | -30.5 | 0 | 0 | 0 | 109.8 | I437 W441 | I437-N439 PolarHBondContact O-N 3.23Å; N439-W441 PolarHBondContact O-N 2.91Å | ||
| 440 | S | 44.3 | Very low | 38.4 | Very low | 91 Ų | 91 | 154.7 Ų | 154.7 | 64% | 0.636 | 80% | 0.798 | S | S | * | * | trans | -58.6 | 95.3 | 165.6 | 171.8 | 0 | 0 | 0 | 0 | 109.6 | H438 | H438-S440 PolarHBondContact O-N 3.26Š| ||
| 441 | W | 40.6 | Very low | 38.3 | Very low | 233 Ų | 233 | 154.6 Ų | 154.6 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | -172.8 | 63.4 | 157.2 | -101.2 | 103.4 | 0 | 0 | 0 | 109.7 | N439 | N439-W441 PolarHBondContact O-N 2.91Š| ||
| 442 | I | 36.2 | Very low | 37.8 | Very low | 158 Ų | 158 | 154.9 Ų | 154.9 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | -135.2 | 97.7 | 165.5 | -59.3 | 176 | 0 | 0 | 0 | 107.9 | P444 | I442-P444 WeakPolarHBondContact O-CD 3.18Š| ||
| 443 | D | 36.9 | Very low | 37.4 | Very low | 140 Ų | 140 | 158.4 Ų | 158.4 | 75% | 0.749 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -61 | 124.2 | 160.7 | -91.6 | -40.5 | 0 | 0 | 0 | 109 | K445 | D443-K445 PolarHBondContact O-N 2.87Š|
| 444 | P | 38 | Very low | 37 | Very low | 119 Ų | 119 | 157.3 Ų | 157.3 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 127 | 177.7 | 26.6 | -29.2 | 0 | 0 | 0 | 110.4 | I442 R446 | I442-P444 WeakPolarHBondContact O-CD 3.18Å; P444-R446 PolarHBondContact O-N 2.83Å |
| 445 | K | 35.4 | Very low | 36.2 | Very low | 206 Ų | 206 | 154.7 Ų | 154.7 | 90% | 0.896 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 120.2 | 174.8 | -78 | 173 | 179.4 | 162.7 | 0 | 111.4 | D443 N447 | D443-K445 PolarHBondContact O-N 2.87Å; K445-N447 PolarHBondContact O-N 2.98Å; K445-N447 VanDerWaalsContact O-N 3.12Å |
| 446 | R | 41.1 | Very low | 35.8 | Very low | 234 Ų | 234 | 159 Ų | 159 | 88% | 0.883 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -50.5 | 105.9 | 153.3 | -162.5 | 178.3 | -172.6 | 177.4 | 2.9 | 110.4 | P444 | P444-R446 PolarHBondContact O-N 2.83Š|
| 447 | N | 34.4 | Very low | 35.5 | Very low | 147 Ų | 147 | 160 Ų | 160 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | trans | 153.4 | 92.6 | 141.5 | -84.1 | -5.1 | 0 | 0 | 0 | 111.3 | K445 | K445-N447 PolarHBondContact O-N 2.98Å; K445-N447 VanDerWaalsContact O-N 3.12Å | ||
| 448 | K | 34.4 | Very low | 35.1 | Very low | 199 Ų | 199 | 164.8 Ų | 164.8 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -138 | 116.7 | 138.5 | -92.4 | -174 | 176 | -178.4 | 0 | 106.9 | V450 | K448-V450 PolarHBondContact O-N 3.04Š| ||
| 449 | K | 34 | Very low | 34.9 | Very low | 215 Ų | 215 | 165.2 Ų | 165.2 | 94% | 0.935 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 124.9 | 164.5 | -70 | -179.3 | 175.3 | -173.2 | 0 | 106.4 | ||
| 450 | V | 32.9 | Very low | 34.8 | Very low | 121 Ų | 121 | 167.4 Ų | 167.4 | 73% | 0.733 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 125.3 | 169.9 | 178.7 | 0 | 0 | 0 | 0 | 106.1 | K448 | K448-V450 PolarHBondContact O-N 3.04Š|
| 451 | P | 35.1 | Very low | 34.1 | Very low | 122 Ų | 122 | 169 Ų | 169 | 79% | 0.792 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 126 | 159.9 | 31.6 | -22.6 | 0 | 0 | 0 | 107.9 | ||
| 452 | Y | 28.4 | Very low | 33.7 | Very low | 187 Ų | 187 | 165.6 Ų | 165.6 | 73% | 0.733 | 81% | 0.812 | S | S | * | * | trans | -138.4 | 109.5 | 165.5 | -160.3 | -97.1 | 0 | 0 | 0 | 106.7 | D454 | Y452-D454 HydrophobicContact CD1-CB 4.36Å; Y452-D454 HydrophobicContact CE1-CB 4.11Å; Y452-D454 WeakPolarHBondContact CE1-OD2 3.5Å | ||
| 453 | E | 34.4 | Very low | 33.5 | Very low | 184 Ų | 184 | 164.3 Ų | 164.3 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -68.4 | 135.9 | 159.9 | -79 | -167.7 | 138.9 | 0 | 0 | 107.9 | ||||
| 454 | D | 30.5 | Very low | 33.6 | Very low | 134 Ų | 134 | 163 Ų | 163 | 72% | 0.717 | 81% | 0.81 | S | S | * | * | trans | -145.3 | 114.4 | 149.3 | -115.2 | -6.7 | 0 | 0 | 0 | 107.5 | Y452 | Y452-D454 HydrophobicContact CD1-CB 4.36Å; Y452-D454 HydrophobicContact CE1-CB 4.11Å; Y452-D454 WeakPolarHBondContact CE1-OD2 3.5Å | ||
| 455 | S | 31.6 | Very low | 33.5 | Very low | 102 Ų | 102 | 165.7 Ų | 165.7 | 71% | 0.713 | 81% | 0.813 | S | S | * | * | trans | -76.9 | 139.1 | 172.9 | 44.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 456 | E | 31.9 | Very low | 33.4 | Very low | 177 Ų | 177 | 162.7 Ų | 162.7 | 83% | 0.827 | 81% | 0.811 | S | S | * | * | trans | 64 | 115.3 | 157.4 | -69.5 | -179.7 | 140.6 | 0 | 0 | 118.4 | ||||
| 457 | I | 31.7 | Very low | 33.3 | Very low | 160 Ų | 160 | 156.5 Ų | 156.5 | 82% | 0.821 | 80% | 0.799 | S | S | * | * | 174.9 | 139.8 | 114.3 | -84.7 | 153.8 | 0 | 0 | 0 | 108.9 | |||||
| 458 | R | 33 | Very low | 33.3 | Very low | 232 Ų | 232 | 155.1 Ų | 155.1 | 88% | 0.875 | 80% | 0.796 | S | S | * | * | trans | 89.9 | 67.9 | 169.6 | -83.5 | 174.7 | 179 | -157.9 | -1.5 | 118.4 | ||||
| 459 | E | 32.4 | Very low | 33.5 | Very low | 169 Ų | 169 | 156.6 Ų | 156.6 | 79% | 0.79 | 81% | 0.813 | S | S | * | * | -15 | 149.8 | 109 | -105.1 | -171.5 | 171.4 | 0 | 0 | 116.9 | |||||
| 460 | K | 33.8 | Very low | 33.5 | Very low | 186 Ų | 186 | 153.7 Ų | 153.7 | 81% | 0.809 | 81% | 0.807 | S | S | * | * | trans | 100.2 | 77.3 | 167 | -61.3 | 176.5 | -175.4 | -178.4 | 0 | 116.2 | ||||
| 461 | C | 29.1 | Very low | 33.5 | Very low | 123 Ų | 123 | 155.4 Ų | 155.4 | 83% | 0.831 | 81% | 0.811 | S | S | * | * | -35.5 | 137.6 | 122.1 | -66.3 | 0 | 0 | 0 | 0 | 111 | |||||
| 462 | L | 32.9 | Very low | 33.4 | Very low | 163 Ų | 163 | 157.2 Ų | 157.2 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | 178.7 | 140.1 | 128.3 | -95.4 | 166.3 | 0 | 0 | 0 | 109.5 | |||||
| 463 | V | 31.1 | Very low | 33.7 | Very low | 131 Ų | 131 | 155.5 Ų | 155.5 | 79% | 0.794 | 82% | 0.817 | S | S | * | * | trans | 155.7 | 142.6 | 134.9 | 166.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 464 | P | 39.8 | Very low | 33.7 | Very low | 113 Ų | 113 | 153.7 Ų | 153.7 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | cis | -123.6 | 154 | 10.8 | 12.8 | 11.8 | 0 | 0 | 0 | 116.4 | ||||
| 465 | Q | 34.8 | Very low | 33.9 | Very low | 175 Ų | 175 | 155 Ų | 155 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | trans | -64.6 | 142.9 | 151.9 | -73 | -175.4 | -33.7 | 0 | 0 | 110.8 | ||||
| 466 | V | 33.7 | Very low | 34 | Very low | 142 Ų | 142 | 158.8 Ų | 158.8 | 86% | 0.861 | 83% | 0.828 | S | S | * | * | trans | -134.1 | 124.7 | 143 | 178.3 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 467 | V | 38.7 | Very low | 34.2 | Very low | 105 Ų | 105 | 157.4 Ų | 157.4 | 64% | 0.636 | 83% | 0.828 | S | S | * | * | trans | -100.1 | 167.7 | 172.9 | 168.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 468 | T | 34.7 | Very low | 34.4 | Very low | 118 Ų | 118 | 157.2 Ų | 157.2 | 72% | 0.724 | 83% | 0.829 | S | S | * | * | trans | 99.2 | 122.7 | 173.1 | 72.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 469 | D | 38.8 | Very low | 34.5 | Very low | 229 Ų | 229 | 150.4 Ų | 150.4 | 100% | 1.225 | 83% | 0.825 | S | S | * | * | cis | -154.9 | 0 | -4.3 | -99.1 | -23.2 | 0 | 0 | 0 | 106.6 |
Retrieved 469 of 469 residues in 225.3 ms
(Link to these results)