| 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 | 38.7 | Very low | 36.9 | Very low | 241 Ų | 241 | 169.6 Ų | 169.6 | 100% | 1.187 | 89% | 0.891 | S | S | * | * | 0 | 79.4 | 0 | -64.5 | -122.9 | -165.6 | 0 | 0 | 107.1 | |||||
| 2 | A | 36.2 | Very low | 37.5 | Very low | 112 Ų | 112 | 162.1 Ų | 162.1 | 93% | 0.926 | 86% | 0.859 | S | S | * | * | 57.3 | 106 | 86.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 3 | G | 36.5 | Very low | 38.2 | Very low | 82 Ų | 82 | 159.5 Ų | 159.5 | 85% | 0.845 | 85% | 0.854 | S | S | * | * | trans | -178.9 | 46.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 4 | L | 36.7 | Very low | 38.4 | Very low | 185 Ų | 185 | 154 Ų | 154 | 97% | 0.969 | 83% | 0.832 | S | S | * | * | trans | -70.7 | 124.3 | 166 | -80.6 | 153.2 | 0 | 0 | 0 | 108.8 | ||||
| 5 | S | 37.2 | Very low | 38.6 | Very low | 121 Ų | 121 | 151.6 Ų | 151.6 | 85% | 0.846 | 82% | 0.818 | S | S | * | * | trans | -131.6 | 124.4 | 162 | -164.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 6 | R | 36.1 | Very low | 38.7 | Very low | 243 Ų | 243 | 152.1 Ų | 152.1 | 92% | 0.917 | 81% | 0.811 | S | S | * | * | trans | -54.2 | 127.4 | -169.9 | -69.9 | 162.8 | 172.6 | -171.1 | -4.1 | 113.8 | S8 | R6-S8 PolarHBondContact O-N 2.85Š| ||
| 7 | R | 34.8 | Very low | 39.1 | Very low | 250 Ų | 250 | 148.3 Ų | 148.3 | 94% | 0.943 | 80% | 0.795 | S | S | * | * | trans | -71.3 | 107.9 | 155.5 | -81.3 | -178.1 | 174.2 | -176.2 | -1.7 | 108.6 | ||||
| 8 | S | 35.2 | Very low | 39.2 | Very low | 93 Ų | 93 | 147.1 Ų | 147.1 | 65% | 0.65 | 79% | 0.787 | S | S | * | * | trans | -84.7 | 110.8 | 170.8 | 171.9 | 0 | 0 | 0 | 0 | 109.3 | R6 R10 | R6-S8 PolarHBondContact O-N 2.85Å; S8-R10 PolarHBondContact O-N 3.26Å | ||
| 9 | N | 39.5 | Very low | 39.3 | Very low | 160 Ų | 160 | 142.5 Ų | 142.5 | 86% | 0.856 | 77% | 0.772 | S | S | * | * | trans | -56.6 | 114 | 161.9 | -83.7 | -16.9 | 0 | 0 | 0 | 110 | ||||
| 10 | R | 38 | Very low | 39.4 | Very low | 224 Ų | 224 | 139.1 Ų | 139.1 | 85% | 0.845 | 76% | 0.756 | S | S | * | * | trans | -134.5 | 96.9 | 155.4 | -73.8 | -169 | -173.1 | -162.4 | 2.1 | 107.8 | S8 | S8-R10 PolarHBondContact O-N 3.26Š| ||
| 11 | L | 37.5 | Very low | 39.5 | Very low | 155 Ų | 155 | 139.5 Ų | 139.5 | 81% | 0.812 | 76% | 0.755 | S | S | * | * | trans | -57.8 | 135.5 | 164.6 | -78 | 155.7 | 0 | 0 | 0 | 108.6 | ||||
| 12 | P | 43.8 | Very low | 39.8 | Very low | 79 Ų | 79 | 131.3 Ų | 131.3 | 51% | 0.513 | 73% | 0.725 | S | S | . | * | trans | -77.5 | 132.1 | -174.1 | 29 | -31.9 | 0 | 0 | 0 | 111.3 | C14 L15 | P12-C14 HydrophobicContact CB-CB 4.3Å; P12-C14 PolarHBondContact O-N 3.12Å; P12-L15 PolarHBondContact O-N 3.37Å | ||
| 13 | T | 46.1 | Very low | 40.2 | Very low | 129 Ų | 129 | 134.1 Ų | 134.1 | 79% | 0.791 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56 | 0.8 | 166.1 | -22 | 0 | 0 | 0 | 0 | 113.7 | ||
| 14 | C | 41.8 | Very low | 40.8 | Very low | 82 Ų | 82 | 135.1 Ų | 135.1 | 55% | 0.554 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -17.2 | 172.6 | -70.2 | 0 | 0 | 0 | 0 | 114.2 | P12 F16 T17 L18 | P12-C14 HydrophobicContact CB-CB 4.3Å; P12-C14 PolarHBondContact O-N 3.12Å; C14-F16 VanDerWaalsContact C-N 3.25Å; C14-F16 PolarHBondContact O-N 3Å; C14-T17 PolarHBondContact O-OG1 3.47Å; C14-L18 PolarHBondContact O-N 3.23Å |
| 15 | L | 41.1 | Very low | 41.5 | Very low | 118 Ų | 118 | 131.9 Ų | 131.9 | 62% | 0.618 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -72.3 | -22 | 174.8 | -80.3 | 165.5 | 0 | 0 | 0 | 112.4 | P12 A19 | P12-L15 PolarHBondContact O-N 3.37Å; L15-A19 PolarHBondContact O-N 3.16Å |
| 16 | F | 40.9 | Very low | 42.3 | Very low | 160 Ų | 160 | 134 Ų | 134 | 70% | 0.702 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -83.1 | -20.9 | -179.9 | -150.9 | -95.4 | 0 | 0 | 0 | 113.2 | C14 T20 | C14-F16 VanDerWaalsContact C-N 3.25Å; C14-F16 PolarHBondContact O-N 3Å; F16-T20 PolarHBondContact O-OG1 2.78Å |
| 17 | T | 44.7 | Very low | 43.1 | Very low | 87 Ų | 87 | 130.5 Ų | 130.5 | 53% | 0.534 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -87.8 | -26.1 | 174.3 | 36.6 | 0 | 0 | 0 | 0 | 113.2 | C14 T20 M21 | C14-T17 PolarHBondContact O-OG1 3.47Å; T17-T20 PolarHBondContact O-OG1 2.85Å; T17-M21 WeakPolarHBondContact O-CG 3.29Å |
| 18 | L | 40.6 | Very low | 44.2 | Very low | 127 Ų | 127 | 121.9 Ų | 121.9 | 67% | 0.665 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -76.2 | -31.8 | 171.4 | -80.7 | 164.8 | 0 | 0 | 0 | 112.5 | C14 | C14-L18 PolarHBondContact O-N 3.23Å |
| 19 | A | 40.8 | Very low | 45.7 | Very low | 59 Ų | 59 | 120.4 Ų | 120.4 | 49% | 0.488 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -69.3 | -33.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L15 A22 | L15-A19 PolarHBondContact O-N 3.16Å; A19-A22 PolarHBondContact O-N 3.16Å |
| 20 | T | 42.7 | Very low | 47.1 | Very low | 75 Ų | 75 | 118.4 Ų | 118.4 | 46% | 0.46 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -81 | -14.3 | 178.7 | 42.3 | 0 | 0 | 0 | 0 | 114.2 | F16 T17 | F16-T20 PolarHBondContact O-OG1 2.78Å; T17-T20 PolarHBondContact O-OG1 2.85Å |
| 21 | M | 41.1 | Very low | 48.6 | Very low | 148 Ų | 148 | 109.7 Ų | 109.7 | 73% | 0.729 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -9.2 | 169.3 | -61.1 | -148 | 93.1 | 0 | 0 | 113.4 | T17 | T17-M21 WeakPolarHBondContact O-CG 3.29Š|
| 22 | A | 44.8 | Very low | 50.5 | Low | 68 Ų | 68 | 106.3 Ų | 106.3 | 56% | 0.562 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -83.6 | -14.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | A19 | A19-A22 PolarHBondContact O-N 3.16Š|
| 23 | E | 45 | Very low | 52.2 | Low | 172 Ų | 172 | 107.8 Ų | 107.8 | 80% | 0.804 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -92.1 | 9.1 | -179.1 | -79.5 | -177.8 | 160.1 | 0 | 0 | 114.6 | ||
| 24 | T | 49.4 | Very low | 53.8 | Low | 103 Ų | 103 | 109.7 Ų | 109.7 | 63% | 0.632 | 59% | 0.593 | S | S | * | * | trans | -119 | 52.1 | 168.8 | 61.4 | 0 | 0 | 0 | 0 | 111.2 | Q26 | T24-Q26 VanDerWaalsContact C-N 3.28Å; T24-Q26 PolarHBondContact O-N 3.34Å | ||
| 25 | V | 51.1 | Low | 55.9 | Low | 117 Ų | 117 | 111.6 Ų | 111.6 | 71% | 0.709 | 59% | 0.593 | S | S | * | * | trans | -89.5 | 79.5 | 161.1 | -174.2 | 0 | 0 | 0 | 0 | 107 | ||||
| 26 | Q | 52.3 | Low | 58.1 | Low | 164 Ų | 164 | 111.2 Ų | 111.2 | 77% | 0.766 | 59% | 0.591 | S | S | * | * | trans | -52.3 | 139.7 | 155.2 | -106.3 | 152.2 | -39.3 | 0 | 0 | 108.1 | T24 V28 | T24-Q26 VanDerWaalsContact C-N 3.28Å; T24-Q26 PolarHBondContact O-N 3.34Å; Q26-V28 VanDerWaalsContact C-N 3.35Å; Q26-V28 WeakPolarHBondContact O-CG2 3.4Å; Q26-V28 PolarHBondContact O-N 3.1Å | ||
| 27 | D | 54.1 | Low | 60.4 | Low | 171 Ų | 171 | 107.4 Ų | 107.4 | 91% | 0.914 | 58% | 0.581 | S | S | * | * | trans | -48.1 | 97.3 | 174.5 | -98.2 | -39 | 0 | 0 | 0 | 110.4 | S29 | D27-S29 PolarHBondContact O-N 3.45Š| ||
| 28 | V | 57.9 | Low | 62.5 | Low | 68 Ų | 68 | 108.8 Ų | 108.8 | 41% | 0.412 | 58% | 0.581 | S | S | . | * | trans | -70.7 | 114.5 | 177.9 | 178.1 | 0 | 0 | 0 | 0 | 106.1 | Q26 D32 K33 | Q26-V28 VanDerWaalsContact C-N 3.35Å; Q26-V28 WeakPolarHBondContact O-CG2 3.4Å; Q26-V28 PolarHBondContact O-N 3.1Å; V28-D32 HydrophobicContact CG1-CB 3.28Å; V28-K33 HydrophobicContact CG1-CG 4.09Å; V28-K33 WeakPolarHBondContact O-CE 3.48Å | ||
| 29 | S | 66.1 | Low | 64.9 | Low | 63 Ų | 63 | 106.7 Ų | 106.7 | 44% | 0.441 | 57% | 0.57 | S | S | . | * | trans | -53.9 | 148.5 | -176.1 | 179.6 | 0 | 0 | 0 | 0 | 110.3 | D27 A31 D32 K33 | D27-S29 PolarHBondContact O-N 3.45Å; S29-A31 CarbonylContact O-C 3.54Å; S29-A31 PolarHBondContact O-N 3.38Å; S29-A31 PolarHBondContact OG-N 2.8Å; S29-D32 WeakPolarHBondContact CB-OD2 3.42Å; S29-D32 PolarHBondContact N-OD2 2.86Å; S29-D32 VanDerWaalsContact N-OD2 3.07Å; S29-D32 WeakPolarHBondContact O-CA 3.43Å; S29-D32 WeakPolarHBondContact O-CB 3.48Å; S29-D32 PolarHBondContact O-N 2.73Å; S29-K33 PolarHBondContact O-N 3.39Å | ||
| 30 | E | 69.4 | Low | 67.3 | Low | 117 Ų | 117 | 106.7 Ų | 106.7 | 55% | 0.547 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -48.6 | -32.1 | 170.2 | -90.4 | -77.9 | 134.6 | 0 | 0 | 111.8 | R34 | E30-R34 VanDerWaalsContact O-CG 3.3Å; E30-R34 WeakPolarHBondContact O-CG 3.46Å; E30-R34 PolarHBondContact O-N 2.94Å; E30-R34 IonicContact OE2-NE 3.83Å; E30-R34 IonicContact OE2-NH2 2.89Å |
| 31 | A | 68.6 | Low | 69.6 | Low | 42 Ų | 42 | 108.4 Ų | 108.4 | 35% | 0.347 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.4 | -50.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | S29 K33 R34 H35 | S29-A31 CarbonylContact O-C 3.54Å; S29-A31 PolarHBondContact O-N 3.38Å; S29-A31 PolarHBondContact OG-N 2.8Å; A31-K33 VanDerWaalsContact C-N 3.31Å; A31-K33 PolarHBondContact O-N 3.48Å; A31-R34 WeakPolarHBondContact O-CB 3.49Å; A31-R34 PolarHBondContact O-N 3.43Å; A31-R34 VanDerWaalsContact O-N 3.07Å; A31-H35 PolarHBondContact O-N 3.37Å; A31-H35 PolarHBondContact O-ND1 2.79Å |
| 32 | D | 78.2 | Confident | 72.1 | Confident | 83 Ų | 83 | 106.2 Ų | 106.2 | 44% | 0.444 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.7 | -35 | -178 | -58.7 | -29.5 | 0 | 0 | 0 | 112.1 | V28 S29 R34 H35 L36 | V28-D32 HydrophobicContact CG1-CB 3.28Å; S29-D32 WeakPolarHBondContact CB-OD2 3.42Å; S29-D32 PolarHBondContact N-OD2 2.86Å; S29-D32 VanDerWaalsContact N-OD2 3.07Å; S29-D32 WeakPolarHBondContact O-CA 3.43Å; S29-D32 WeakPolarHBondContact O-CB 3.48Å; S29-D32 PolarHBondContact O-N 2.73Å; D32-R34 VanDerWaalsContact C-N 3.34Å; D32-R34 PolarHBondContact O-N 2.79Å; D32-H35 PolarHBondContact O-N 3.1Å; D32-L36 WeakPolarHBondContact O-CB 3.42Å; D32-L36 PolarHBondContact O-N 2.93Å |
| 33 | K | 79.6 | Confident | 74.3 | Confident | 111 Ų | 111 | 107.2 Ų | 107.2 | 48% | 0.483 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63 | -39.3 | 172.1 | -65.7 | 179.7 | -172.8 | 168.2 | 0 | 111.9 | V28 S29 A31 L36 V37 | V28-K33 HydrophobicContact CG1-CG 4.09Å; V28-K33 WeakPolarHBondContact O-CE 3.48Å; S29-K33 PolarHBondContact O-N 3.39Å; A31-K33 VanDerWaalsContact C-N 3.31Å; A31-K33 PolarHBondContact O-N 3.48Å; K33-L36 PolarHBondContact O-N 3.48Å; K33-V37 WeakPolarHBondContact O-CG2 3.25Å; K33-V37 PolarHBondContact O-N 2.87Å; K33-V37 VanDerWaalsContact O-N 3.08Å |
| 34 | R | 79.9 | Confident | 76.6 | Confident | 169 Ų | 169 | 107.5 Ų | 107.5 | 64% | 0.638 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.8 | -43.8 | 175.5 | -69.2 | 170.5 | -165.5 | -170.7 | 4 | 111.7 | E30 A31 D32 L36 V37 E38 | E30-R34 VanDerWaalsContact O-CG 3.3Å; E30-R34 WeakPolarHBondContact O-CG 3.46Å; E30-R34 PolarHBondContact O-N 2.94Å; E30-R34 IonicContact OE2-NE 3.83Å; E30-R34 IonicContact OE2-NH2 2.89Å; A31-R34 WeakPolarHBondContact O-CB 3.49Å; A31-R34 PolarHBondContact O-N 3.43Å; A31-R34 VanDerWaalsContact O-N 3.07Å; D32-R34 VanDerWaalsContact C-N 3.34Å; D32-R34 PolarHBondContact O-N 2.79Å; R34-L36 VanDerWaalsContact C-N 3.29Å; R34-L36 PolarHBondContact O-N 2.76Å; R34-V37 PolarHBondContact O-N 3.1Å; R34-E38 PolarHBondContact O-N 3.45Å |
| 35 | H | 86.2 | Confident | 78.6 | Confident | 121 Ų | 121 | 110.8 Ų | 110.8 | 56% | 0.56 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.2 | -40.1 | 174.7 | -69.6 | 88.5 | 0 | 0 | 0 | 111.6 | A31 D32 V37 E38 L39 | A31-H35 PolarHBondContact O-N 3.37Å; A31-H35 PolarHBondContact O-ND1 2.79Å; D32-H35 PolarHBondContact O-N 3.1Å; H35-V37 PolarHBondContact O-N 3.33Å; H35-E38 PolarHBondContact O-N 3.12Å; H35-L39 WeakPolarHBondContact O-CB 3.47Å; H35-L39 PolarHBondContact O-N 3.26Å |
| 36 | L | 86.3 | Confident | 80.6 | Confident | 110 Ų | 110 | 108.1 Ų | 108.1 | 58% | 0.576 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.2 | -40 | 177.2 | -163.6 | 72.2 | 0 | 0 | 0 | 112.2 | D32 K33 R34 E38 L39 V40 | D32-L36 WeakPolarHBondContact O-CB 3.42Å; D32-L36 PolarHBondContact O-N 2.93Å; K33-L36 PolarHBondContact O-N 3.48Å; R34-L36 VanDerWaalsContact C-N 3.29Å; R34-L36 PolarHBondContact O-N 2.76Å; L36-E38 VanDerWaalsContact C-N 3.34Å; L36-L39 PolarHBondContact O-N 2.63Å; L36-V40 VanDerWaalsContact O-CG2 3.27Å; L36-V40 WeakPolarHBondContact O-CG2 3.35Å; L36-V40 PolarHBondContact O-N 2.82Å |
| 37 | V | 88.8 | Confident | 82.5 | Confident | 81 Ų | 81 | 104.1 Ų | 104.1 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.7 | -40.1 | 175.6 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | K33 R34 H35 V40 K41 | K33-V37 WeakPolarHBondContact O-CG2 3.25Å; K33-V37 PolarHBondContact O-N 2.87Å; K33-V37 VanDerWaalsContact O-N 3.08Å; R34-V37 PolarHBondContact O-N 3.1Å; H35-V37 PolarHBondContact O-N 3.33Å; V37-V40 PolarHBondContact O-N 2.78Å; V37-K41 HydrophobicContact CG1-CD 4.44Å; V37-K41 WeakPolarHBondContact O-CG 3.32Å; V37-K41 PolarHBondContact O-N 3.43Å; V37-K41 VanDerWaalsContact O-N 3.09Å |
| 38 | E | 89.2 | Confident | 84.3 | Confident | 116 Ų | 116 | 98.6 Ų | 98.6 | 54% | 0.542 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.3 | -46.4 | 176.7 | -169 | 155.4 | -146.4 | 0 | 0 | 111.4 | R34 H35 L36 V40 K41 E42 | R34-E38 PolarHBondContact O-N 3.45Å; H35-E38 PolarHBondContact O-N 3.12Å; L36-E38 VanDerWaalsContact C-N 3.34Å; E38-V40 VanDerWaalsContact C-N 3.33Å; E38-V40 PolarHBondContact O-N 3.07Å; E38-K41 WeakPolarHBondContact O-CB 3.33Å; E38-K41 PolarHBondContact O-N 3.5Å; E38-E42 WeakPolarHBondContact O-CG 3.22Å; E38-E42 PolarHBondContact O-N 3.32Å |
| 39 | L | 92 | Very high | 85.9 | Confident | 82 Ų | 82 | 100 Ų | 100 | 43% | 0.429 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -41.7 | 175 | -175.6 | 64.4 | 0 | 0 | 0 | 112.3 | H35 L36 K41 E42 L43 | H35-L39 WeakPolarHBondContact O-CB 3.47Å; H35-L39 PolarHBondContact O-N 3.26Å; L36-L39 PolarHBondContact O-N 2.63Å; L39-K41 VanDerWaalsContact C-N 3.32Å; L39-K41 PolarHBondContact O-N 2.75Å; L39-E42 PolarHBondContact O-N 3.01Å; L39-L43 HydrophobicContact CD1-CG 4.5Å; L39-L43 HydrophobicContact CG-CD1 4.17Å; L39-L43 HydrophobicContact CG-CG 4.5Å; L39-L43 WeakPolarHBondContact O-CB 3.37Å; L39-L43 VanDerWaalsContact O-CG 3.29Å; L39-L43 WeakPolarHBondContact O-CG 3.46Å; L39-L43 PolarHBondContact O-N 3.45Å |
| 40 | V | 91.4 | Very high | 87 | Confident | 59 Ų | 59 | 101 Ų | 101 | 36% | 0.358 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -37.6 | 175.9 | 168.8 | 0 | 0 | 0 | 0 | 111.5 | L36 V37 E38 R44 | L36-V40 VanDerWaalsContact O-CG2 3.27Å; L36-V40 WeakPolarHBondContact O-CG2 3.35Å; L36-V40 PolarHBondContact O-N 2.82Å; V37-V40 PolarHBondContact O-N 2.78Å; E38-V40 VanDerWaalsContact C-N 3.33Å; E38-V40 PolarHBondContact O-N 3.07Å; V40-R44 WeakPolarHBondContact O-CB 3.15Å; V40-R44 VanDerWaalsContact O-CG 3.28Å; V40-R44 WeakPolarHBondContact O-CG 3.35Å; V40-R44 PolarHBondContact O-N 2.88Å |
| 41 | K | 91 | Very high | 88.1 | Confident | 111 Ų | 111 | 103.6 Ų | 103.6 | 48% | 0.483 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.4 | -42.7 | 175.2 | -73.1 | 172.1 | -178.2 | 175.8 | 0 | 111.3 | V37 E38 L39 R44 R45 | V37-K41 HydrophobicContact CG1-CD 4.44Å; V37-K41 WeakPolarHBondContact O-CG 3.32Å; V37-K41 PolarHBondContact O-N 3.43Å; V37-K41 VanDerWaalsContact O-N 3.09Å; E38-K41 WeakPolarHBondContact O-CB 3.33Å; E38-K41 PolarHBondContact O-N 3.5Å; L39-K41 VanDerWaalsContact C-N 3.32Å; L39-K41 PolarHBondContact O-N 2.75Å; K41-R44 PolarHBondContact O-N 3.16Å; K41-R45 WeakPolarHBondContact O-CG 3.04Å; K41-R45 PolarHBondContact O-N 2.86Å |
| 42 | E | 92.4 | Very high | 89 | Confident | 102 Ų | 102 | 104.5 Ų | 104.5 | 48% | 0.477 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -46.7 | 175.6 | -71.5 | 180 | 171.6 | 0 | 0 | 112 | E38 L39 R44 R45 S46 | E38-E42 WeakPolarHBondContact O-CG 3.22Å; E38-E42 PolarHBondContact O-N 3.32Å; L39-E42 PolarHBondContact O-N 3.01Å; E42-R44 VanDerWaalsContact C-N 3.3Å; E42-R44 PolarHBondContact O-N 2.91Å; E42-R45 WeakPolarHBondContact O-CB 3.36Å; E42-R45 PolarHBondContact O-N 2.88Å; E42-R45 VanDerWaalsContact O-N 3.15Å; E42-S46 WeakPolarHBondContact O-CB 3.49Å; E42-S46 PolarHBondContact O-N 2.78Å |
| 43 | L | 92 | Very high | 89.5 | Confident | 90 Ų | 90 | 103.1 Ų | 103.1 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.1 | -36.7 | 176.5 | -73 | 173.8 | 0 | 0 | 0 | 112.1 | L39 N47 | L39-L43 HydrophobicContact CD1-CG 4.5Å; L39-L43 HydrophobicContact CG-CD1 4.17Å; L39-L43 HydrophobicContact CG-CG 4.5Å; L39-L43 WeakPolarHBondContact O-CB 3.37Å; L39-L43 VanDerWaalsContact O-CG 3.29Å; L39-L43 WeakPolarHBondContact O-CG 3.46Å; L39-L43 PolarHBondContact O-N 3.45Å; L43-N47 WeakPolarHBondContact O-CB 3.44Å; L43-N47 PolarHBondContact O-N 3.4Å; L43-N47 PolarHBondContact O-ND2 3.43Å |
| 44 | R | 92.3 | Very high | 90 | Very high | 178 Ų | 178 | 101 Ų | 101 | 67% | 0.672 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.3 | -43 | 173.8 | -78.2 | 175.7 | -179.1 | 167.2 | 2.5 | 112 | V40 K41 E42 N47 A48 | V40-R44 WeakPolarHBondContact O-CB 3.15Å; V40-R44 VanDerWaalsContact O-CG 3.28Å; V40-R44 WeakPolarHBondContact O-CG 3.35Å; V40-R44 PolarHBondContact O-N 2.88Å; K41-R44 PolarHBondContact O-N 3.16Å; E42-R44 VanDerWaalsContact C-N 3.3Å; E42-R44 PolarHBondContact O-N 2.91Å; R44-N47 PolarHBondContact O-N 3.09Å; R44-A48 WeakPolarHBondContact O-CB 3.21Å; R44-A48 PolarHBondContact O-N 2.64Å |
| 45 | R | 92.1 | Very high | 90.4 | Very high | 171 Ų | 171 | 96.8 Ų | 96.8 | 65% | 0.645 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.8 | -47.2 | 175.5 | -70.6 | 171.4 | -177.1 | 155.5 | -2.4 | 111 | K41 E42 N47 A48 V49 | K41-R45 WeakPolarHBondContact O-CG 3.04Å; K41-R45 PolarHBondContact O-N 2.86Å; E42-R45 WeakPolarHBondContact O-CB 3.36Å; E42-R45 PolarHBondContact O-N 2.88Å; E42-R45 VanDerWaalsContact O-N 3.15Å; R45-N47 PolarHBondContact O-N 3.48Å; R45-A48 WeakPolarHBondContact O-CB 3.42Å; R45-A48 PolarHBondContact O-N 3.08Å; R45-A48 VanDerWaalsContact O-N 3.16Å; R45-V49 WeakPolarHBondContact O-CG2 3.19Å; R45-V49 PolarHBondContact O-N 3.32Å |
| 46 | S | 93.5 | Very high | 90.6 | Very high | 62 Ų | 62 | 92.8 Ų | 92.8 | 43% | 0.434 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.4 | -45.9 | 176.8 | 175.8 | 0 | 0 | 0 | 0 | 111.9 | E42 A48 V49 L50 | E42-S46 WeakPolarHBondContact O-CB 3.49Å; E42-S46 PolarHBondContact O-N 2.78Å; S46-A48 VanDerWaalsContact C-N 3.32Å; S46-A48 PolarHBondContact O-N 3.24Å; S46-V49 PolarHBondContact O-N 2.76Å; S46-L50 WeakPolarHBondContact O-CG 3.33Å; S46-L50 PolarHBondContact O-N 3.42Å |
| 47 | N | 92 | Very high | 90.7 | Very high | 79 Ų | 79 | 89.5 Ų | 89.5 | 42% | 0.422 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.8 | -35 | 175.4 | -83.1 | -63.9 | 0 | 0 | 0 | 113 | L43 R44 R45 R51 | L43-N47 WeakPolarHBondContact O-CB 3.44Å; L43-N47 PolarHBondContact O-N 3.4Å; L43-N47 PolarHBondContact O-ND2 3.43Å; R44-N47 PolarHBondContact O-N 3.09Å; R45-N47 PolarHBondContact O-N 3.48Å; N47-R51 WeakPolarHBondContact O-CB 3.38Å; N47-R51 VanDerWaalsContact O-CG 3.27Å; N47-R51 WeakPolarHBondContact O-CG 3.39Å; N47-R51 PolarHBondContact O-N 2.9Å |
| 48 | A | 92.4 | Very high | 90.7 | Very high | 56 Ų | 56 | 91.3 Ų | 91.3 | 46% | 0.463 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -65.5 | -40.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | R44 R45 S46 R51 A52 | R44-A48 WeakPolarHBondContact O-CB 3.21Å; R44-A48 PolarHBondContact O-N 2.64Å; R45-A48 WeakPolarHBondContact O-CB 3.42Å; R45-A48 PolarHBondContact O-N 3.08Å; R45-A48 VanDerWaalsContact O-N 3.16Å; S46-A48 VanDerWaalsContact C-N 3.32Å; S46-A48 PolarHBondContact O-N 3.24Å; A48-R51 PolarHBondContact O-N 3.14Å; A48-A52 PolarHBondContact O-N 3.17Å |
| 49 | V | 90.4 | Very high | 90.5 | Very high | 97 Ų | 97 | 92.4 Ų | 92.4 | 59% | 0.588 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -64.1 | -47.5 | 175.1 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | R45 S46 R51 A52 E53 | R45-V49 WeakPolarHBondContact O-CG2 3.19Å; R45-V49 PolarHBondContact O-N 3.32Å; S46-V49 PolarHBondContact O-N 2.76Å; V49-R51 VanDerWaalsContact C-N 3.29Å; V49-R51 PolarHBondContact O-N 3.33Å; V49-A52 PolarHBondContact O-N 3.22Å; V49-E53 WeakPolarHBondContact O-CB 3.25Å; V49-E53 PolarHBondContact O-N 3.46Å |
| 50 | L | 89.6 | Confident | 90.2 | Very high | 85 Ų | 85 | 90.4 Ų | 90.4 | 45% | 0.445 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -61.9 | -37.2 | 178.3 | -70.5 | 172.4 | 0 | 0 | 0 | 112.4 | S46 E53 T54 | S46-L50 WeakPolarHBondContact O-CG 3.33Å; S46-L50 PolarHBondContact O-N 3.42Å; L50-E53 PolarHBondContact O-N 2.85Å; L50-T54 WeakPolarHBondContact O-CB 3.45Å; L50-T54 PolarHBondContact O-N 3.45Å; L50-T54 PolarHBondContact O-OG1 2.9Å |
| 51 | R | 91.6 | Very high | 90 | Very high | 170 Ų | 170 | 92 Ų | 92 | 64% | 0.642 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -64.9 | -46.9 | 173.8 | -76.4 | 175.3 | -175.2 | 163 | 1.1 | 111.8 | N47 A48 V49 E53 T54 D55 | N47-R51 WeakPolarHBondContact O-CB 3.38Å; N47-R51 VanDerWaalsContact O-CG 3.27Å; N47-R51 WeakPolarHBondContact O-CG 3.39Å; N47-R51 PolarHBondContact O-N 2.9Å; A48-R51 PolarHBondContact O-N 3.14Å; V49-R51 VanDerWaalsContact C-N 3.29Å; V49-R51 PolarHBondContact O-N 3.33Å; R51-E53 VanDerWaalsContact C-N 3.29Å; R51-E53 PolarHBondContact O-N 2.95Å; R51-T54 PolarHBondContact O-N 2.98Å; R51-T54 VanDerWaalsContact O-N 3.14Å; R51-D55 WeakPolarHBondContact O-CB 3.3Å; R51-D55 VanDerWaalsContact O-CG 3.24Å; R51-D55 PolarHBondContact O-N 3.21Å |
| 52 | A | 87.5 | Confident | 89.6 | Confident | 61 Ų | 61 | 91.2 Ų | 91.2 | 50% | 0.504 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.5 | -39.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A48 V49 M56 | A48-A52 PolarHBondContact O-N 3.17Å; V49-A52 PolarHBondContact O-N 3.22Å; A52-M56 WeakPolarHBondContact O-CB 3.34Å; A52-M56 PolarHBondContact O-N 2.9Å; A52-M56 VanDerWaalsContact O-N 3.08Å |
| 53 | E | 88.8 | Confident | 89.1 | Confident | 55 Ų | 55 | 91 Ų | 91 | 26% | 0.257 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.4 | -43.8 | 173.5 | -179.9 | -179.5 | -174.8 | 0 | 0 | 111.5 | V49 L50 R51 M56 Y57 K114 | V49-E53 WeakPolarHBondContact O-CB 3.25Å; V49-E53 PolarHBondContact O-N 3.46Å; L50-E53 PolarHBondContact O-N 2.85Å; R51-E53 VanDerWaalsContact C-N 3.29Å; R51-E53 PolarHBondContact O-N 2.95Å; E53-M56 PolarHBondContact O-N 3.4Å; E53-Y57 HydrophobicContact CG-CD2 3.95Å; E53-Y57 HydrophobicContact CG-CE2 3.31Å; E53-Y57 WeakPolarHBondContact O-CD2 3.5Å; E53-Y57 PolarHBondContact O-N 2.9Å; E53-Y57 WeakPolarHBondContact OE1-CE2 3.32Å; E53-Y57 PolarHBondContact OE1-OH 3.46Å; E53-K114 IonicContact OE1-NZ 2.97Å; E53-K114 PolarHBondContact OE1-NZ 3.27Å |
| 54 | T | 89.6 | Confident | 88.4 | Confident | 67 Ų | 67 | 89.3 Ų | 89.3 | 41% | 0.411 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.6 | -47.1 | 177.8 | -52.8 | 0 | 0 | 0 | 0 | 111.4 | L50 R51 M56 Y57 E58 | L50-T54 WeakPolarHBondContact O-CB 3.45Å; L50-T54 PolarHBondContact O-N 3.45Å; L50-T54 PolarHBondContact O-OG1 2.9Å; R51-T54 PolarHBondContact O-N 2.98Å; R51-T54 VanDerWaalsContact O-N 3.14Å; T54-M56 VanDerWaalsContact C-N 3.26Å; T54-M56 PolarHBondContact O-N 3.42Å; T54-Y57 PolarHBondContact O-N 2.79Å; T54-Y57 VanDerWaalsContact O-N 3.14Å; T54-E58 HydrophobicContact CG2-CG 4.38Å; T54-E58 WeakPolarHBondContact O-CG 3.23Å; T54-E58 PolarHBondContact O-N 2.79Å |
| 55 | D | 90.2 | Very high | 87.1 | Confident | 79 Ų | 79 | 86.1 Ų | 86.1 | 42% | 0.422 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -58.8 | -39.4 | 177.9 | -70.3 | -0.8 | 0 | 0 | 0 | 111.5 | R51 E58 R59 | R51-D55 WeakPolarHBondContact O-CB 3.3Å; R51-D55 VanDerWaalsContact O-CG 3.24Å; R51-D55 PolarHBondContact O-N 3.21Å; D55-E58 PolarHBondContact O-N 2.74Å; D55-R59 VanDerWaalsContact O-CG 3.28Å; D55-R59 WeakPolarHBondContact O-CG 3.28Å; D55-R59 PolarHBondContact O-N 2.92Å |
| 56 | M | 90.1 | Very high | 85.6 | Confident | 37 Ų | 37 | 82.7 Ų | 82.7 | 18% | 0.182 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 176.1 | 177.9 | -85.4 | -62.8 | 0 | 0 | 111.3 | A52 E53 T54 R59 Y60 V117 A118 E121 | A52-M56 WeakPolarHBondContact O-CB 3.34Å; A52-M56 PolarHBondContact O-N 2.9Å; A52-M56 VanDerWaalsContact O-N 3.08Å; E53-M56 PolarHBondContact O-N 3.4Å; T54-M56 VanDerWaalsContact C-N 3.26Å; T54-M56 PolarHBondContact O-N 3.42Å; M56-R59 PolarHBondContact O-N 3.42Å; M56-Y60 PolarHBondContact O-N 3.38Å; M56-V117 HydrophobicContact SD-CG1 3.73Å; M56-A118 HydrophobicContact CE-CB 4.14Å; M56-A118 HydrophobicContact SD-CB 4.45Å; M56-E121 HydrophobicContact CG-CB 3.87Å; M56-E121 HydrophobicContact CG-CG 3.87Å; M56-E121 HydrophobicContact SD-CB 4.25Å; M56-E121 HydrophobicContact SD-CG 3.85Å |
| 57 | Y | 88 | Confident | 83.8 | Confident | 41 Ų | 41 | 90.2 Ų | 90.2 | 16% | 0.161 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -65.7 | -38.6 | 175.3 | -67.2 | -42.9 | 0 | 0 | 0 | 113.2 | E53 T54 R59 Y60 I61 L109 K114 V117 | E53-Y57 HydrophobicContact CG-CD2 3.95Å; E53-Y57 HydrophobicContact CG-CE2 3.31Å; E53-Y57 WeakPolarHBondContact O-CD2 3.5Å; E53-Y57 PolarHBondContact O-N 2.9Å; E53-Y57 WeakPolarHBondContact OE1-CE2 3.32Å; E53-Y57 PolarHBondContact OE1-OH 3.46Å; T54-Y57 PolarHBondContact O-N 2.79Å; T54-Y57 VanDerWaalsContact O-N 3.14Å; Y57-R59 VanDerWaalsContact C-N 3.34Å; Y57-Y60 PolarHBondContact O-N 3.29Å; Y57-I61 WeakPolarHBondContact O-CB 3.34Å; Y57-I61 WeakPolarHBondContact O-CD1 3.46Å; Y57-I61 WeakPolarHBondContact O-CG1 3.47Å; Y57-I61 PolarHBondContact O-N 3.38Å; Y57-L109 HydrophobicContact CE1-CD1 4.26Å; Y57-K114 VanDerWaalsContact OH-CB 3.31Å; Y57-K114 WeakPolarHBondContact OH-CB 3.44Å; Y57-K114 VanDerWaalsContact OH-CD 3.23Å; Y57-K114 WeakPolarHBondContact OH-CD 3.25Å; Y57-K114 WeakPolarHBondContact OH-CG 3.3Å; Y57-V117 HydrophobicContact CD1-CG1 3.7Å; Y57-V117 HydrophobicContact CE1-CB 4.17Å; Y57-V117 HydrophobicContact CE1-CG1 3.82Å |
| 58 | E | 88.4 | Confident | 82.1 | Confident | 120 Ų | 120 | 92.2 Ų | 92.2 | 56% | 0.561 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -62.7 | -42 | 176.7 | -75 | -179.2 | -179.1 | 0 | 0 | 111.5 | T54 D55 I61 S62 | T54-E58 HydrophobicContact CG2-CG 4.38Å; T54-E58 WeakPolarHBondContact O-CG 3.23Å; T54-E58 PolarHBondContact O-N 2.79Å; D55-E58 PolarHBondContact O-N 2.74Å; E58-I61 PolarHBondContact O-N 3.34Å; E58-S62 VanDerWaalsContact O-CB 3.26Å; E58-S62 WeakPolarHBondContact O-CB 3.46Å; E58-S62 PolarHBondContact O-N 2.93Å; E58-S62 PolarHBondContact O-OG 2.83Å |
| 59 | R | 86 | Confident | 80.4 | Confident | 139 Ų | 139 | 94.1 Ų | 94.1 | 53% | 0.525 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.7 | -46.9 | 174.7 | -73.3 | 173.5 | -171.6 | -169.3 | 3.3 | 111.6 | D55 M56 Y57 I61 S62 R63 E121 | D55-R59 VanDerWaalsContact O-CG 3.28Å; D55-R59 WeakPolarHBondContact O-CG 3.28Å; D55-R59 PolarHBondContact O-N 2.92Å; M56-R59 PolarHBondContact O-N 3.42Å; Y57-R59 VanDerWaalsContact C-N 3.34Å; R59-I61 PolarHBondContact O-N 3.4Å; R59-S62 PolarHBondContact O-N 3.05Å; R59-S62 PolarHBondContact O-OG 3.43Å; R59-R63 PolarHBondContact O-N 2.95Å; R59-E121 WeakPolarHBondContact CB-OE2 3.33Å |
| 60 | Y | 85.8 | Confident | 78.2 | Confident | 40 Ų | 40 | 94.3 Ų | 94.3 | 16% | 0.157 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -57.2 | -50.4 | 175.6 | -174.5 | -106.2 | 0 | 0 | 0 | 112.1 | M56 Y57 S62 R63 L64 V117 R120 E121 | M56-Y60 PolarHBondContact O-N 3.38Å; Y57-Y60 PolarHBondContact O-N 3.29Å; Y60-S62 VanDerWaalsContact C-N 3.32Å; Y60-S62 PolarHBondContact O-N 3.39Å; Y60-R63 PolarHBondContact O-N 3.49Å; Y60-L64 HydrophobicContact CD1-CD1 4.01Å; Y60-L64 HydrophobicContact CE1-CD1 3.68Å; Y60-L64 HydrophobicContact CE1-CD2 4.44Å; Y60-L64 HydrophobicContact CE1-CG 4.28Å; Y60-L64 PolarHBondContact O-N 2.94Å; Y60-V117 HydrophobicContact CD1-CG1 3.58Å; Y60-V117 HydrophobicContact CD1-CG2 4.15Å; Y60-V117 HydrophobicContact CD2-CG1 3.85Å; Y60-V117 HydrophobicContact CE1-CG1 4.03Å; Y60-V117 HydrophobicContact CE1-CG2 3.77Å; Y60-V117 HydrophobicContact CE2-CG1 4.27Å; Y60-V117 HydrophobicContact CG-CG1 3.48Å; Y60-V117 VanDerWaalsContact CG-CG1 3.48Å; Y60-R120 HydrophobicContact CE2-CB 4.16Å; Y60-R120 PolarHBondContact OH-NH1 2.84Å; Y60-E121 WeakPolarHBondContact CA-OE1 3.27Å; Y60-E121 VanDerWaalsContact CB-OE1 3.3Å; Y60-E121 WeakPolarHBondContact CB-OE1 3.41Å; Y60-E121 HydrophobicContact CD2-CG 3.94Å; Y60-E121 WeakPolarHBondContact CD2-OE1 3.5Å; Y60-E121 HydrophobicContact CG-CG 4.24Å; Y60-E121 PolarHBondContact N-OE1 3.45Å; Y60-E121 PolarHBondContact N-OE2 2.92Å |
| 61 | I | 85.2 | Confident | 76.2 | Confident | 92 Ų | 92 | 95.8 Ų | 95.8 | 47% | 0.472 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.8 | -37.8 | -179.5 | -67.3 | 164.5 | 0 | 0 | 0 | 111.1 | Y57 E58 R59 R63 L64 | Y57-I61 WeakPolarHBondContact O-CB 3.34Å; Y57-I61 WeakPolarHBondContact O-CD1 3.46Å; Y57-I61 WeakPolarHBondContact O-CG1 3.47Å; Y57-I61 PolarHBondContact O-N 3.38Å; E58-I61 PolarHBondContact O-N 3.34Å; R59-I61 PolarHBondContact O-N 3.4Å; I61-R63 PolarHBondContact O-N 3.08Å; I61-L64 PolarHBondContact O-N 3.17Å; I61-L64 VanDerWaalsContact O-N 3.15Å |
| 62 | S | 83.6 | Confident | 73.6 | Confident | 95 Ų | 95 | 96 Ų | 96 | 66% | 0.664 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.1 | -21 | 179.2 | 73.7 | 0 | 0 | 0 | 0 | 113.7 | E58 R59 Y60 | E58-S62 VanDerWaalsContact O-CB 3.26Å; E58-S62 WeakPolarHBondContact O-CB 3.46Å; E58-S62 PolarHBondContact O-N 2.93Å; E58-S62 PolarHBondContact O-OG 2.83Å; R59-S62 PolarHBondContact O-N 3.05Å; R59-S62 PolarHBondContact O-OG 3.43Å; Y60-S62 VanDerWaalsContact C-N 3.32Å; Y60-S62 PolarHBondContact O-N 3.39Å |
| 63 | R | 81.1 | Confident | 71.4 | Confident | 98 Ų | 98 | 99 Ų | 99 | 37% | 0.37 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -93 | -16.2 | 177.3 | -70 | -172.1 | -91.7 | -139.7 | 15.8 | 113.7 | R59 Y60 I61 E121 E124 D128 | R59-R63 PolarHBondContact O-N 2.95Å; Y60-R63 PolarHBondContact O-N 3.49Å; I61-R63 PolarHBondContact O-N 3.08Å; R63-E121 IonicContact CZ-OE1 3.58Å; R63-E121 IonicContact CZ-OE2 3.96Å; R63-E121 IonicContact NE-OE1 2.8Å; R63-E121 PolarHBondContact NE-OE1 3.49Å; R63-E121 IonicContact NH2-OE1 3.88Å; R63-E121 PolarHBondContact NH2-OE1 3.07Å; R63-E121 IonicContact NH2-OE2 2.95Å; R63-E121 PolarHBondContact NH2-OE2 2.81Å; R63-E124 WeakPolarHBondContact CD-OE2 3.32Å; R63-E124 IonicContact CZ-OE2 2.88Å; R63-E124 IonicContact NE-OE2 3.91Å; R63-E124 PolarHBondContact NE-OE2 3.01Å; R63-E124 IonicContact NH1-OE2 3.98Å; R63-E124 IonicContact NH2-OE2 3.54Å; R63-E124 PolarHBondContact NH2-OE2 3.32Å; R63-D128 IonicContact NH1-OD2 2.67Å |
| 64 | L | 77.7 | Confident | 68.9 | Low | 53 Ų | 53 | 104.9 Ų | 104.9 | 28% | 0.277 | 54% | 0.54 | S | S | . | . | S | Bend | trans | -76.2 | 135.1 | 176 | -67.7 | 175.6 | 0 | 0 | 0 | 110.9 | Y60 I61 L69 | Y60-L64 HydrophobicContact CD1-CD1 4.01Å; Y60-L64 HydrophobicContact CE1-CD1 3.68Å; Y60-L64 HydrophobicContact CE1-CD2 4.44Å; Y60-L64 HydrophobicContact CE1-CG 4.28Å; Y60-L64 PolarHBondContact O-N 2.94Å; I61-L64 PolarHBondContact O-N 3.17Å; I61-L64 VanDerWaalsContact O-N 3.15Å; L64-L69 HydrophobicContact CD1-CD2 4.13Å |
| 65 | D | 65.8 | Low | 66.5 | Low | 112 Ų | 112 | 106.5 Ų | 106.5 | 60% | 0.599 | 55% | 0.554 | S | S | * | * | trans | -67.5 | 141.5 | 174 | -110 | -28.6 | 0 | 0 | 0 | 109.9 | R67 D68 | D65-R67 PolarHBondContact O-N 3.11Å; D65-D68 PolarHBondContact O-N 2.78Å | ||
| 66 | P | 59.8 | Low | 64.2 | Low | 99 Ų | 99 | 109.9 Ų | 109.9 | 64% | 0.643 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.3 | -14 | -179.3 | -25.5 | 33.2 | 0 | 0 | 0 | 115.1 | ||
| 67 | R | 56.2 | Low | 61.7 | Low | 220 Ų | 220 | 113.6 Ų | 113.6 | 83% | 0.83 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -24.2 | 178.4 | -66.6 | -179 | 175.8 | -175.7 | -0.7 | 113.1 | D65 L69 | D65-R67 PolarHBondContact O-N 3.11Å; R67-L69 VanDerWaalsContact C-N 3.31Å |
| 68 | D | 56.9 | Low | 59.2 | Low | 120 Ų | 120 | 120.4 Ų | 120.4 | 64% | 0.642 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -10 | 179.6 | -62.4 | -29.2 | 0 | 0 | 0 | 112.6 | D65 | D65-D68 PolarHBondContact O-N 2.78Š|
| 69 | L | 55.8 | Low | 56.4 | Low | 96 Ų | 96 | 118.3 Ų | 118.3 | 50% | 0.503 | 65% | 0.651 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.9 | -2.3 | 178.7 | -65.8 | 170 | 0 | 0 | 0 | 113.6 | L64 R67 P71 | L64-L69 HydrophobicContact CD1-CD2 4.13Å; R67-L69 VanDerWaalsContact C-N 3.31Å; L69-P71 WeakPolarHBondContact O-CD 3.44Å |
| 70 | V | 44.9 | Very low | 54 | Low | 101 Ų | 101 | 117 Ų | 117 | 61% | 0.612 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -88.6 | 119 | 178.7 | -178.3 | 0 | 0 | 0 | 0 | 109.5 | Q72 | V70-Q72 PolarHBondContact O-N 2.98Å; V70-Q72 VanDerWaalsContact O-N 3.08Å |
| 71 | P | 46.5 | Very low | 51.6 | Low | 116 Ų | 116 | 119.6 Ų | 119.6 | 75% | 0.753 | 70% | 0.699 | S | S | * | * | trans | -63.9 | 113.4 | 173.6 | -16.3 | 29.3 | 0 | 0 | 0 | 109.7 | L69 | L69-P71 WeakPolarHBondContact O-CD 3.44Š| ||
| 72 | Q | 37.9 | Very low | 48.9 | Very low | 176 Ų | 176 | 120 Ų | 120 | 82% | 0.822 | 72% | 0.716 | S | S | * | * | trans | -70.3 | 133.7 | 164.2 | -77.7 | -156.8 | -15.3 | 0 | 0 | 109.2 | V70 L74 | V70-Q72 PolarHBondContact O-N 2.98Å; V70-Q72 VanDerWaalsContact O-N 3.08Å; Q72-L74 PolarHBondContact O-N 3.06Å; Q72-L74 VanDerWaalsContact O-N 3.13Å | ||
| 73 | P | 40.8 | Very low | 46.4 | Very low | 124 Ų | 124 | 120.4 Ų | 120.4 | 81% | 0.805 | 73% | 0.725 | S | S | * | * | trans | -67.7 | 113.9 | 173.2 | 26.3 | -29.2 | 0 | 0 | 0 | 108.8 | S75 | P73-S75 PolarHBondContact O-N 3.44Š| ||
| 74 | L | 36.9 | Very low | 44 | Very low | 178 Ų | 178 | 120.8 Ų | 120.8 | 93% | 0.932 | 74% | 0.743 | S | S | * | * | trans | -57.9 | 107.5 | 168.9 | -73 | 162.2 | 0 | 0 | 0 | 108.8 | Q72 | Q72-L74 PolarHBondContact O-N 3.06Å; Q72-L74 VanDerWaalsContact O-N 3.13Å | ||
| 75 | S | 39.9 | Very low | 41.8 | Very low | 100 Ų | 100 | 126.9 Ų | 126.9 | 70% | 0.699 | 77% | 0.77 | S | S | * | * | trans | -78 | 126.9 | 168.7 | 69 | 0 | 0 | 0 | 0 | 110.1 | P73 | P73-S75 PolarHBondContact O-N 3.44Š| ||
| 76 | D | 40.4 | Very low | 40.2 | Very low | 151 Ų | 151 | 128.8 Ų | 128.8 | 81% | 0.807 | 78% | 0.779 | S | S | * | * | trans | 39.9 | 86.5 | 139.8 | -60 | -18.7 | 0 | 0 | 0 | 117.5 | ||||
| 77 | S | 38.7 | Very low | 38.8 | Very low | 114 Ų | 114 | 131.6 Ų | 131.6 | 80% | 0.797 | 78% | 0.784 | S | S | * | * | trans | -163.7 | 118.3 | 144 | -83.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 78 | L | 34.2 | Very low | 37.6 | Very low | 185 Ų | 185 | 128.3 Ų | 128.3 | 97% | 0.969 | 78% | 0.781 | S | S | * | * | S | Bend | trans | 112.8 | 105.7 | 167.2 | -60.3 | 160.5 | 0 | 0 | 0 | 113.9 | ||
| 79 | G | 30.7 | Very low | 36.3 | Very low | 76 Ų | 76 | 126.3 Ų | 126.3 | 78% | 0.784 | 79% | 0.789 | S | S | * | * | trans | 144.5 | 23.2 | 156 | 0 | 0 | 0 | 0 | 0 | 118.2 | A81 | G79-A81 PolarHBondContact O-N 3.34Š| ||
| 80 | A | 35.4 | Very low | 35.2 | Very low | 112 Ų | 112 | 125.9 Ų | 125.9 | 93% | 0.926 | 81% | 0.808 | S | S | * | * | trans | -74.7 | 75.9 | 163.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 81 | A | 34.5 | Very low | 34.6 | Very low | 93 Ų | 93 | 124.7 Ų | 124.7 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | trans | -165.9 | 88.2 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | G79 | G79-A81 PolarHBondContact O-N 3.34Š| ||
| 82 | A | 30.3 | Very low | 34.3 | Very low | 101 Ų | 101 | 131.6 Ų | 131.6 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | trans | 159.3 | 60.4 | 147.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 83 | A | 29.9 | Very low | 34.2 | Very low | 104 Ų | 104 | 126.6 Ų | 126.6 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | trans | -98.1 | 97.9 | 162.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 84 | S | 31.3 | Very low | 34.6 | Very low | 106 Ų | 106 | 132.5 Ų | 132.5 | 74% | 0.741 | 83% | 0.829 | S | S | * | * | trans | -152.4 | 114.5 | 156 | 33.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 85 | Q | 31.9 | Very low | 34.9 | Very low | 180 Ų | 180 | 133.2 Ų | 133.2 | 84% | 0.841 | 82% | 0.824 | S | S | * | * | trans | 93.6 | 115.4 | 144 | -76 | 177 | -28.2 | 0 | 0 | 121.2 | ||||
| 86 | L | 30.9 | Very low | 35.2 | Very low | 152 Ų | 152 | 136.7 Ų | 136.7 | 80% | 0.796 | 83% | 0.832 | S | S | * | * | trans | 98.3 | 85.5 | 140.1 | -69.4 | 157.6 | 0 | 0 | 0 | 118.4 | ||||
| 87 | E | 30 | Very low | 35.3 | Very low | 158 Ų | 158 | 138.3 Ų | 138.3 | 74% | 0.738 | 83% | 0.832 | S | S | * | * | 34.4 | 106 | 115 | -70.2 | -79 | 141.5 | 0 | 0 | 118.9 | |||||
| 88 | I | 31.4 | Very low | 35.8 | Very low | 151 Ų | 151 | 137.2 Ų | 137.2 | 77% | 0.774 | 82% | 0.82 | S | S | * | * | 51 | 107 | 128.8 | -48 | -177 | 0 | 0 | 0 | 118.6 | |||||
| 89 | G | 30 | Very low | 36.4 | Very low | 78 Ų | 78 | 137.6 Ų | 137.6 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | -154.2 | 107 | 154.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 90 | G | 33.7 | Very low | 37.3 | Very low | 87 Ų | 87 | 137.9 Ų | 137.9 | 90% | 0.897 | 80% | 0.795 | S | S | * | * | trans | -64.8 | 142.2 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 91 | G | 30.9 | Very low | 38.2 | Very low | 77 Ų | 77 | 135.8 Ų | 135.8 | 79% | 0.794 | 77% | 0.771 | S | S | * | * | trans | -168.2 | 86.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | G93 | G91-G93 PolarHBondContact O-N 2.84Š| ||
| 92 | R | 40 | Very low | 38.8 | Very low | 261 Ų | 261 | 133.3 Ų | 133.3 | 99% | 0.985 | 75% | 0.75 | S | S | * | * | trans | -61.8 | 120.3 | 166.3 | -87.1 | 177.4 | 168.6 | -174.1 | -2.8 | 108.9 | ||||
| 93 | G | 37.2 | Very low | 39.7 | Very low | 70 Ų | 70 | 133.1 Ų | 133.1 | 72% | 0.722 | 74% | 0.735 | S | S | * | * | trans | 166.9 | 98.6 | 165.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | G91 | G91-G93 PolarHBondContact O-N 2.84Š| ||
| 94 | R | 48.5 | Very low | 40.5 | Very low | 248 Ų | 248 | 133.2 Ų | 133.2 | 94% | 0.936 | 72% | 0.718 | S | S | * | * | trans | 77.2 | 68.5 | 142.8 | -145.1 | 177.3 | -166.7 | -179.9 | 2.8 | 118.2 | ||||
| 95 | K | 42.5 | Very low | 41.3 | Very low | 193 Ų | 193 | 135.2 Ų | 135.2 | 84% | 0.839 | 72% | 0.715 | S | S | * | * | trans | -142.7 | 75.6 | 153.6 | -82.7 | -174.9 | 178.1 | 173 | 0 | 110.9 | ||||
| 96 | M | 46.1 | Very low | 42.2 | Very low | 173 Ų | 173 | 133.7 Ų | 133.7 | 85% | 0.852 | 71% | 0.712 | S | S | * | * | trans | -111.8 | -6 | 174.4 | -166.6 | 165.8 | 170.4 | 0 | 0 | 112.9 | ||||
| 97 | K | 43.9 | Very low | 43.5 | Very low | 185 Ų | 185 | 133.9 Ų | 133.9 | 80% | 0.804 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -93.7 | -17.3 | -175.2 | -147 | 161.1 | -177.4 | 175.7 | 0 | 114.4 | T100 | K97-T100 PolarHBondContact O-OG1 3.29Š|
| 98 | T | 47.6 | Very low | 45.2 | Very low | 91 Ų | 91 | 135.4 Ų | 135.4 | 56% | 0.558 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -88.4 | -17.2 | 177.4 | 28.1 | 0 | 0 | 0 | 0 | 113.7 | T101 A102 | T98-T101 PolarHBondContact O-OG1 3.34Å; T98-T101 VanDerWaalsContact O-OG1 3.1Å; T98-A102 PolarHBondContact O-N 2.86Å |
| 99 | R | 47.7 | Very low | 47.3 | Very low | 194 Ų | 194 | 131.9 Ų | 131.9 | 73% | 0.732 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -80.2 | -27.8 | -178.1 | -141.1 | 176.3 | 81 | 158.7 | 5.5 | 112.8 | L103 | R99-L103 PolarHBondContact O-N 3.48Å |
| 100 | T | 50.4 | Low | 49.9 | Very low | 81 Ų | 81 | 131.7 Ų | 131.7 | 50% | 0.497 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -74.3 | -41.8 | 177.3 | 42.7 | 0 | 0 | 0 | 0 | 112.1 | K97 A102 L103 E104 | K97-T100 PolarHBondContact O-OG1 3.29Å; T100-A102 VanDerWaalsContact C-N 3.33Å; T100-A102 PolarHBondContact O-N 3.46Å; T100-L103 PolarHBondContact O-N 2.83Å; T100-E104 WeakPolarHBondContact O-CG 3.48Å; T100-E104 PolarHBondContact O-N 3.43Å |
| 101 | T | 52.4 | Low | 52.1 | Low | 69 Ų | 69 | 134.3 Ų | 134.3 | 42% | 0.423 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -67.5 | -32.7 | 175.5 | 46 | 0 | 0 | 0 | 0 | 112.7 | T98 Q105 | T98-T101 PolarHBondContact O-OG1 3.34Å; T98-T101 VanDerWaalsContact O-OG1 3.1Å; T101-Q105 WeakPolarHBondContact O-CG 3.46Å; T101-Q105 PolarHBondContact O-N 2.92Å |
| 102 | A | 48 | Very low | 54.5 | Low | 40 Ų | 40 | 137.6 Ų | 137.6 | 33% | 0.331 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -70.4 | -38.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | T98 T100 Q105 L106 | T98-A102 PolarHBondContact O-N 2.86Å; T100-A102 VanDerWaalsContact C-N 3.33Å; T100-A102 PolarHBondContact O-N 3.46Å; A102-Q105 PolarHBondContact O-N 3.21Å; A102-L106 WeakPolarHBondContact O-CD1 3.27Å; A102-L106 PolarHBondContact O-N 2.91Å |
| 103 | L | 49.3 | Very low | 56.6 | Low | 97 Ų | 97 | 129.4 Ų | 129.4 | 51% | 0.508 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -66.9 | -37 | 172.9 | -91.2 | 156.4 | 0 | 0 | 0 | 112.5 | R99 T100 Q105 L106 Q107 | R99-L103 PolarHBondContact O-N 3.48Å; T100-L103 PolarHBondContact O-N 2.83Å; L103-Q105 VanDerWaalsContact C-N 3.35Å; L103-L106 PolarHBondContact O-N 2.85Å; L103-Q107 WeakPolarHBondContact O-CG 3.44Å; L103-Q107 PolarHBondContact O-N 3.34Å |
| 104 | E | 47.8 | Very low | 59 | Low | 107 Ų | 107 | 129.1 Ų | 129.1 | 50% | 0.5 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -67.8 | -32.6 | 172.7 | -76 | 173.8 | 172.3 | 0 | 0 | 112.8 | T100 Q107 | T100-E104 WeakPolarHBondContact O-CG 3.48Å; T100-E104 PolarHBondContact O-N 3.43Å; E104-Q107 PolarHBondContact O-N 2.89Å |
| 105 | Q | 48 | Very low | 60.8 | Low | 147 Ų | 147 | 121.2 Ų | 121.2 | 69% | 0.687 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -70.8 | -33.7 | 172.4 | -78.2 | 179 | -19.1 | 0 | 0 | 112.1 | T101 A102 L103 Q107 R108 | T101-Q105 WeakPolarHBondContact O-CG 3.46Å; T101-Q105 PolarHBondContact O-N 2.92Å; A102-Q105 PolarHBondContact O-N 3.21Å; L103-Q105 VanDerWaalsContact C-N 3.35Å; Q105-Q107 PolarHBondContact O-N 2.92Å; Q105-R108 PolarHBondContact O-N 3.43Å |
| 106 | L | 49 | Very low | 62.8 | Low | 148 Ų | 148 | 115.5 Ų | 115.5 | 78% | 0.775 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -71.4 | -13.6 | 171.4 | -96.4 | 120.6 | 0 | 0 | 0 | 114 | A102 L103 | A102-L106 WeakPolarHBondContact O-CD1 3.27Å; A102-L106 PolarHBondContact O-N 2.91Å; L103-L106 PolarHBondContact O-N 2.85Å |
| 107 | Q | 58.1 | Low | 64.9 | Low | 156 Ų | 156 | 107.7 Ų | 107.7 | 73% | 0.729 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.5 | -5.7 | 176.8 | -76.9 | 175.6 | -21.7 | 0 | 0 | 113.9 | L103 E104 Q105 | L103-Q107 WeakPolarHBondContact O-CG 3.44Å; L103-Q107 PolarHBondContact O-N 3.34Å; E104-Q107 PolarHBondContact O-N 2.89Å; Q105-Q107 PolarHBondContact O-N 2.92Å |
| 108 | R | 67.3 | Low | 67 | Low | 190 Ų | 190 | 100.8 Ų | 100.8 | 72% | 0.717 | 51% | 0.513 | S | S | * | . | S | Bend | trans | -95.1 | 123.3 | 177.8 | -69.1 | 177.8 | -177.8 | -153.9 | -0.6 | 109.2 | Q105 T110 | Q105-R108 PolarHBondContact O-N 3.43Å; R108-T110 PolarHBondContact O-N 3.5Å |
| 109 | L | 74.7 | Confident | 68.9 | Low | 78 Ų | 78 | 101 Ų | 101 | 41% | 0.408 | 51% | 0.507 | S | S | . | . | P | Polyproline II helix | trans | -53.8 | 135.8 | 170.6 | -67.2 | 170.1 | 0 | 0 | 0 | 109.6 | Y57 Q113 K114 | Y57-L109 HydrophobicContact CE1-CD1 4.26Å; L109-Q113 HydrophobicContact CB-CB 4.17Å; L109-Q113 HydrophobicContact CD2-CB 4.11Å; L109-K114 HydrophobicContact CB-CG 3.69Å; L109-K114 HydrophobicContact CD1-CG 4.45Å |
| 110 | T | 83.9 | Confident | 70.9 | Confident | 73 Ų | 73 | 97.7 Ų | 97.7 | 45% | 0.448 | 50% | 0.495 | S | S | . | . | P | Polyproline II helix | trans | -62.8 | 156.1 | 171.6 | 64.4 | 0 | 0 | 0 | 0 | 109.6 | R108 E112 Q113 K114 | R108-T110 PolarHBondContact O-N 3.5Å; T110-E112 PolarHBondContact O-N 3.17Å; T110-Q113 PolarHBondContact O-N 2.94Å; T110-Q113 VanDerWaalsContact O-N 3.09Å; T110-Q113 VanDerWaalsContact OG1-CG 3.23Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.32Å; T110-Q113 PolarHBondContact OG1-N 3.09Å; T110-Q113 PolarHBondContact OG1-OE1 3.37Å; T110-K114 WeakPolarHBondContact O-CG 3.33Å; T110-K114 PolarHBondContact O-N 3.46Å |
| 111 | L | 79.8 | Confident | 72.8 | Confident | 143 Ų | 143 | 94.1 Ų | 94.1 | 75% | 0.749 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -56 | -36.2 | 178 | -69 | 174.9 | 0 | 0 | 0 | 111.9 | K114 C115 | L111-K114 PolarHBondContact O-N 3.08Å; L111-C115 PolarHBondContact O-N 3.12Å; L111-C115 PolarHBondContact O-SG 3.04Å |
| 112 | E | 83.1 | Confident | 74.6 | Confident | 146 Ų | 146 | 94.5 Ų | 94.5 | 68% | 0.682 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -62.1 | -50.6 | 174.4 | -170.8 | 172.6 | -167.4 | 0 | 0 | 111.7 | T110 K114 C115 D116 | T110-E112 PolarHBondContact O-N 3.17Å; E112-K114 VanDerWaalsContact C-N 3.27Å; E112-K114 PolarHBondContact O-N 2.88Å; E112-C115 WeakPolarHBondContact O-CB 3.46Å; E112-C115 PolarHBondContact O-N 2.88Å; E112-C115 VanDerWaalsContact O-N 3.11Å; E112-D116 PolarHBondContact O-N 2.79Å |
| 113 | Q | 83.8 | Confident | 76.6 | Confident | 88 Ų | 88 | 95.5 Ų | 95.5 | 41% | 0.411 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -60.9 | -36 | 175.9 | -71.2 | 168.8 | -20.2 | 0 | 0 | 112.6 | L109 T110 D116 V117 | L109-Q113 HydrophobicContact CB-CB 4.17Å; L109-Q113 HydrophobicContact CD2-CB 4.11Å; T110-Q113 PolarHBondContact O-N 2.94Å; T110-Q113 VanDerWaalsContact O-N 3.09Å; T110-Q113 VanDerWaalsContact OG1-CG 3.23Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.32Å; T110-Q113 PolarHBondContact OG1-N 3.09Å; T110-Q113 PolarHBondContact OG1-OE1 3.37Å; Q113-D116 PolarHBondContact O-N 3.4Å; Q113-V117 VanDerWaalsContact O-CG2 3.28Å; Q113-V117 WeakPolarHBondContact O-CG2 3.44Å; Q113-V117 PolarHBondContact O-N 3.47Å |
| 114 | K | 86.8 | Confident | 78.7 | Confident | 64 Ų | 64 | 93.9 Ų | 93.9 | 28% | 0.278 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.9 | -41.7 | 175.2 | -69.8 | -169 | 164.3 | -155.1 | 0 | 112 | E53 Y57 L109 T110 L111 E112 V117 A118 | E53-K114 IonicContact OE1-NZ 2.97Å; E53-K114 PolarHBondContact OE1-NZ 3.27Å; Y57-K114 VanDerWaalsContact OH-CB 3.31Å; Y57-K114 WeakPolarHBondContact OH-CB 3.44Å; Y57-K114 VanDerWaalsContact OH-CD 3.23Å; Y57-K114 WeakPolarHBondContact OH-CD 3.25Å; Y57-K114 WeakPolarHBondContact OH-CG 3.3Å; L109-K114 HydrophobicContact CB-CG 3.69Å; L109-K114 HydrophobicContact CD1-CG 4.45Å; T110-K114 WeakPolarHBondContact O-CG 3.33Å; T110-K114 PolarHBondContact O-N 3.46Å; L111-K114 PolarHBondContact O-N 3.08Å; E112-K114 VanDerWaalsContact C-N 3.27Å; E112-K114 PolarHBondContact O-N 2.88Å; K114-V117 PolarHBondContact O-N 3.41Å; K114-A118 WeakPolarHBondContact O-CB 3.27Å; K114-A118 PolarHBondContact O-N 3.12Å |
| 115 | C | 86.2 | Confident | 80.7 | Confident | 83 Ų | 83 | 91.5 Ų | 91.5 | 56% | 0.561 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -64.1 | -41.6 | 174.9 | -71.1 | 0 | 0 | 0 | 0 | 111.3 | L111 E112 V117 A118 Q119 | L111-C115 PolarHBondContact O-N 3.12Å; L111-C115 PolarHBondContact O-SG 3.04Å; E112-C115 WeakPolarHBondContact O-CB 3.46Å; E112-C115 PolarHBondContact O-N 2.88Å; E112-C115 VanDerWaalsContact O-N 3.11Å; C115-V117 PolarHBondContact O-N 3.32Å; C115-A118 PolarHBondContact O-N 2.94Å; C115-Q119 WeakPolarHBondContact O-CB 3.44Å; C115-Q119 PolarHBondContact O-N 3.45Å |
| 116 | D | 85.8 | Confident | 82.9 | Confident | 72 Ų | 72 | 89.4 Ų | 89.4 | 39% | 0.385 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 176.8 | -69.5 | -17.1 | 0 | 0 | 0 | 111.9 | E112 Q113 Q119 R120 | E112-D116 PolarHBondContact O-N 2.79Å; Q113-D116 PolarHBondContact O-N 3.4Å; D116-Q119 PolarHBondContact O-N 2.95Å; D116-R120 WeakPolarHBondContact O-CG 3.38Å; D116-R120 PolarHBondContact O-N 2.85Å |
| 117 | V | 88.6 | Confident | 85 | Confident | 10 Ų | 10 | 87.2 Ų | 87.2 | 6% | 0.061 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -64.5 | -44.4 | 177.1 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | M56 Y57 Y60 Q113 K114 C115 Q119 R120 E121 | M56-V117 HydrophobicContact SD-CG1 3.73Å; Y57-V117 HydrophobicContact CD1-CG1 3.7Å; Y57-V117 HydrophobicContact CE1-CB 4.17Å; Y57-V117 HydrophobicContact CE1-CG1 3.82Å; Y60-V117 HydrophobicContact CD1-CG1 3.58Å; Y60-V117 HydrophobicContact CD1-CG2 4.15Å; Y60-V117 HydrophobicContact CD2-CG1 3.85Å; Y60-V117 HydrophobicContact CE1-CG1 4.03Å; Y60-V117 HydrophobicContact CE1-CG2 3.77Å; Y60-V117 HydrophobicContact CE2-CG1 4.27Å; Y60-V117 HydrophobicContact CG-CG1 3.48Å; Y60-V117 VanDerWaalsContact CG-CG1 3.48Å; Q113-V117 VanDerWaalsContact O-CG2 3.28Å; Q113-V117 WeakPolarHBondContact O-CG2 3.44Å; Q113-V117 PolarHBondContact O-N 3.47Å; K114-V117 PolarHBondContact O-N 3.41Å; C115-V117 PolarHBondContact O-N 3.32Å; V117-Q119 VanDerWaalsContact C-N 3.3Å; V117-Q119 PolarHBondContact O-N 3.36Å; V117-R120 PolarHBondContact O-N 2.95Å; V117-E121 HydrophobicContact CG1-CG 4.45Å; V117-E121 WeakPolarHBondContact O-CB 3.46Å; V117-E121 WeakPolarHBondContact O-CG 3.5Å; V117-E121 PolarHBondContact O-N 2.83Å |
| 118 | A | 88.1 | Confident | 86.7 | Confident | 40 Ų | 40 | 83.6 Ų | 83.6 | 33% | 0.331 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.7 | -38.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | M56 K114 C115 L122 | M56-A118 HydrophobicContact CE-CB 4.14Å; M56-A118 HydrophobicContact SD-CB 4.45Å; K114-A118 WeakPolarHBondContact O-CB 3.27Å; K114-A118 PolarHBondContact O-N 3.12Å; C115-A118 PolarHBondContact O-N 2.94Å; A118-L122 WeakPolarHBondContact O-CB 3.2Å; A118-L122 PolarHBondContact O-N 2.89Å |
| 119 | Q | 89.1 | Confident | 88 | Confident | 95 Ų | 95 | 78.8 Ų | 78.8 | 44% | 0.444 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.9 | -45.7 | 177.7 | -174.8 | 60.3 | 41.6 | 0 | 0 | 111.4 | C115 D116 V117 L122 D123 | C115-Q119 WeakPolarHBondContact O-CB 3.44Å; C115-Q119 PolarHBondContact O-N 3.45Å; D116-Q119 PolarHBondContact O-N 2.95Å; V117-Q119 VanDerWaalsContact C-N 3.3Å; V117-Q119 PolarHBondContact O-N 3.36Å; Q119-L122 WeakPolarHBondContact O-CB 3.4Å; Q119-L122 PolarHBondContact O-N 2.8Å; Q119-D123 PolarHBondContact NE2-OD1 2.9Å; Q119-D123 PolarHBondContact NE2-OD2 2.89Å; Q119-D123 PolarHBondContact O-N 3.44Å |
| 120 | R | 89 | Confident | 89 | Confident | 124 Ų | 124 | 80.5 Ų | 80.5 | 47% | 0.468 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.8 | -47.8 | 176.4 | -71.6 | 178.6 | -167.8 | 135.7 | 11.4 | 112 | Y60 D116 V117 L122 D123 E124 | Y60-R120 HydrophobicContact CE2-CB 4.16Å; Y60-R120 PolarHBondContact OH-NH1 2.84Å; D116-R120 WeakPolarHBondContact O-CG 3.38Å; D116-R120 PolarHBondContact O-N 2.85Å; V117-R120 PolarHBondContact O-N 2.95Å; R120-L122 VanDerWaalsContact C-N 3.27Å; R120-L122 PolarHBondContact O-N 3.32Å; R120-D123 PolarHBondContact O-N 3.41Å; R120-D123 VanDerWaalsContact O-N 3.16Å; R120-E124 WeakPolarHBondContact O-CG 3.43Å; R120-E124 PolarHBondContact O-N 3.43Å |
| 121 | E | 89.6 | Confident | 89.5 | Confident | 6 Ų | 6 | 82.4 Ų | 82.4 | 3% | 0.028 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -61.8 | -37.2 | 177.1 | -75.2 | -67.1 | 115.8 | 0 | 0 | 112.3 | M56 R59 Y60 R63 V117 T125 | M56-E121 HydrophobicContact CG-CB 3.87Å; M56-E121 HydrophobicContact CG-CG 3.87Å; M56-E121 HydrophobicContact SD-CB 4.25Å; M56-E121 HydrophobicContact SD-CG 3.85Å; R59-E121 WeakPolarHBondContact CB-OE2 3.33Å; Y60-E121 WeakPolarHBondContact CA-OE1 3.27Å; Y60-E121 VanDerWaalsContact CB-OE1 3.3Å; Y60-E121 WeakPolarHBondContact CB-OE1 3.41Å; Y60-E121 HydrophobicContact CD2-CG 3.94Å; Y60-E121 WeakPolarHBondContact CD2-OE1 3.5Å; Y60-E121 HydrophobicContact CG-CG 4.24Å; Y60-E121 PolarHBondContact N-OE1 3.45Å; Y60-E121 PolarHBondContact N-OE2 2.92Å; R63-E121 IonicContact CZ-OE1 3.58Å; R63-E121 IonicContact CZ-OE2 3.96Å; R63-E121 IonicContact NE-OE1 2.8Å; R63-E121 PolarHBondContact NE-OE1 3.49Å; R63-E121 IonicContact NH2-OE1 3.88Å; R63-E121 PolarHBondContact NH2-OE1 3.07Å; R63-E121 IonicContact NH2-OE2 2.95Å; R63-E121 PolarHBondContact NH2-OE2 2.81Å; V117-E121 HydrophobicContact CG1-CG 4.45Å; V117-E121 WeakPolarHBondContact O-CB 3.46Å; V117-E121 WeakPolarHBondContact O-CG 3.5Å; V117-E121 PolarHBondContact O-N 2.83Å; E121-T125 WeakPolarHBondContact O-CB 3.19Å; E121-T125 VanDerWaalsContact O-CG2 3.25Å; E121-T125 WeakPolarHBondContact O-CG2 3.28Å; E121-T125 PolarHBondContact O-N 3.25Å; E121-T125 PolarHBondContact O-OG1 3.3Å |
| 122 | L | 90.7 | Very high | 90.3 | Very high | 77 Ų | 77 | 81.2 Ų | 81.2 | 40% | 0.403 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -65.8 | -40.8 | 175.9 | -176.4 | 155.1 | 0 | 0 | 0 | 111.2 | A118 Q119 R120 T125 K126 | A118-L122 WeakPolarHBondContact O-CB 3.2Å; A118-L122 PolarHBondContact O-N 2.89Å; Q119-L122 WeakPolarHBondContact O-CB 3.4Å; Q119-L122 PolarHBondContact O-N 2.8Å; R120-L122 VanDerWaalsContact C-N 3.27Å; R120-L122 PolarHBondContact O-N 3.32Å; L122-T125 WeakPolarHBondContact CA-OG1 3.42Å; L122-T125 PolarHBondContact O-OG1 3.47Å; L122-K126 HydrophobicContact CD2-CD 4.05Å; L122-K126 VanDerWaalsContact O-CG 3.3Å; L122-K126 WeakPolarHBondContact O-CG 3.38Å; L122-K126 PolarHBondContact O-N 3.49Å; L122-K126 VanDerWaalsContact O-N 3.09Å |
| 123 | D | 90.9 | Very high | 90.9 | Very high | 62 Ų | 62 | 79.8 Ų | 79.8 | 33% | 0.332 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -71.9 | -40 | 178.2 | -66.6 | -31.1 | 0 | 0 | 0 | 111.9 | Q119 R120 T125 K126 E127 | Q119-D123 PolarHBondContact NE2-OD1 2.9Å; Q119-D123 PolarHBondContact NE2-OD2 2.89Å; Q119-D123 PolarHBondContact O-N 3.44Å; R120-D123 PolarHBondContact O-N 3.41Å; R120-D123 VanDerWaalsContact O-N 3.16Å; D123-T125 PolarHBondContact O-N 3.26Å; D123-K126 WeakPolarHBondContact O-CB 3.42Å; D123-K126 PolarHBondContact O-N 2.85Å; D123-K126 IonicContact OD1-NZ 3.72Å; D123-K126 PolarHBondContact OD1-NZ 3.02Å; D123-E127 PolarHBondContact O-N 3.27Å |
| 124 | E | 91.9 | Very high | 91.4 | Very high | 63 Ų | 63 | 80.2 Ų | 80.2 | 29% | 0.294 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.2 | -43 | 173.4 | -71.6 | 174.7 | 171.2 | 0 | 0 | 112.5 | R63 R120 K126 E127 D128 | R63-E124 WeakPolarHBondContact CD-OE2 3.32Å; R63-E124 IonicContact CZ-OE2 2.88Å; R63-E124 IonicContact NE-OE2 3.91Å; R63-E124 PolarHBondContact NE-OE2 3.01Å; R63-E124 IonicContact NH1-OE2 3.98Å; R63-E124 IonicContact NH2-OE2 3.54Å; R63-E124 PolarHBondContact NH2-OE2 3.32Å; R120-E124 WeakPolarHBondContact O-CG 3.43Å; R120-E124 PolarHBondContact O-N 3.43Å; E124-K126 VanDerWaalsContact C-N 3.29Å; E124-K126 PolarHBondContact O-N 3.28Å; E124-E127 PolarHBondContact O-N 2.96Å; E124-D128 PolarHBondContact O-N 2.99Å |
| 125 | T | 90.5 | Very high | 91.9 | Very high | 57 Ų | 57 | 79.6 Ų | 79.6 | 35% | 0.35 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.7 | -30.8 | 176.6 | 51.5 | 0 | 0 | 0 | 0 | 112.7 | E121 L122 D123 L129 | E121-T125 WeakPolarHBondContact O-CB 3.19Å; E121-T125 VanDerWaalsContact O-CG2 3.25Å; E121-T125 WeakPolarHBondContact O-CG2 3.28Å; E121-T125 PolarHBondContact O-N 3.25Å; E121-T125 PolarHBondContact O-OG1 3.3Å; L122-T125 WeakPolarHBondContact CA-OG1 3.42Å; L122-T125 PolarHBondContact O-OG1 3.47Å; D123-T125 PolarHBondContact O-N 3.26Å; T125-L129 WeakPolarHBondContact O-CB 3.41Å; T125-L129 PolarHBondContact O-N 3.5Å |
| 126 | K | 93.3 | Very high | 92.3 | Very high | 103 Ų | 103 | 78.2 Ų | 78.2 | 45% | 0.448 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.1 | -47.9 | 169.3 | -74.3 | 170.5 | -174.7 | 155.5 | 0 | 111 | L122 D123 E124 D128 L129 E130 | L122-K126 HydrophobicContact CD2-CD 4.05Å; L122-K126 VanDerWaalsContact O-CG 3.3Å; L122-K126 WeakPolarHBondContact O-CG 3.38Å; L122-K126 PolarHBondContact O-N 3.49Å; L122-K126 VanDerWaalsContact O-N 3.09Å; D123-K126 WeakPolarHBondContact O-CB 3.42Å; D123-K126 PolarHBondContact O-N 2.85Å; D123-K126 IonicContact OD1-NZ 3.72Å; D123-K126 PolarHBondContact OD1-NZ 3.02Å; E124-K126 VanDerWaalsContact C-N 3.29Å; E124-K126 PolarHBondContact O-N 3.28Å; K126-D128 PolarHBondContact O-N 2.9Å; K126-L129 WeakPolarHBondContact O-CB 3.46Å; K126-L129 PolarHBondContact O-N 3.28Å; K126-E130 WeakPolarHBondContact O-CG 3.38Å; K126-E130 PolarHBondContact O-N 3.35Å |
| 127 | E | 94.9 | Very high | 92.7 | Very high | 102 Ų | 102 | 79.8 Ų | 79.8 | 48% | 0.477 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60.3 | -44.3 | 178.4 | -72.5 | -172.5 | -167.4 | 0 | 0 | 112.2 | D123 E124 L129 E130 K131 | D123-E127 PolarHBondContact O-N 3.27Å; E124-E127 PolarHBondContact O-N 2.96Å; E127-L129 VanDerWaalsContact C-N 3.29Å; E127-L129 PolarHBondContact O-N 3.15Å; E127-E130 PolarHBondContact O-N 3.48Å; E127-K131 VanDerWaalsContact O-CG 3.32Å; E127-K131 WeakPolarHBondContact O-CG 3.28Å; E127-K131 PolarHBondContact O-N 3.45Å; E127-K131 IonicContact OE2-NZ 3.94Å; E127-K131 PolarHBondContact OE2-NZ 3Å |
| 128 | D | 92.9 | Very high | 93.1 | Very high | 80 Ų | 80 | 86.4 Ų | 86.4 | 43% | 0.428 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63 | -38.7 | 177.9 | -74.8 | -18.9 | 0 | 0 | 0 | 111.3 | R63 E124 K126 K131 L132 | R63-D128 IonicContact NH1-OD2 2.67Å; E124-D128 PolarHBondContact O-N 2.99Å; K126-D128 PolarHBondContact O-N 2.9Å; D128-K131 PolarHBondContact O-N 3.19Å; D128-L132 VanDerWaalsContact O-CB 3.3Å; D128-L132 WeakPolarHBondContact O-CB 3.4Å; D128-L132 PolarHBondContact O-N 3.48Å |
| 129 | L | 94.6 | Very high | 93.5 | Very high | 88 Ų | 88 | 87.8 Ų | 87.8 | 46% | 0.461 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -66.8 | -37.9 | 175.9 | -175.4 | 150.7 | 0 | 0 | 0 | 111.8 | T125 K126 E127 K133 | T125-L129 WeakPolarHBondContact O-CB 3.41Å; T125-L129 PolarHBondContact O-N 3.5Å; K126-L129 WeakPolarHBondContact O-CB 3.46Å; K126-L129 PolarHBondContact O-N 3.28Å; E127-L129 VanDerWaalsContact C-N 3.29Å; E127-L129 PolarHBondContact O-N 3.15Å; L129-K133 HydrophobicContact CD2-CD 3.77Å; L129-K133 HydrophobicContact CD2-CG 4.38Å; L129-K133 WeakPolarHBondContact O-CB 3.48Å; L129-K133 VanDerWaalsContact O-CG 3.3Å; L129-K133 WeakPolarHBondContact O-CG 3.4Å; L129-K133 PolarHBondContact O-N 2.73Å |
| 130 | E | 94.8 | Very high | 93.8 | Very high | 115 Ų | 115 | 87.8 Ų | 87.8 | 54% | 0.537 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.5 | -47.5 | 173.5 | -74 | 179.8 | 175.6 | 0 | 0 | 111.9 | K126 E127 L132 K133 E134 | K126-E130 WeakPolarHBondContact O-CG 3.38Å; K126-E130 PolarHBondContact O-N 3.35Å; E127-E130 PolarHBondContact O-N 3.48Å; E130-L132 VanDerWaalsContact C-N 3.28Å; E130-L132 PolarHBondContact O-N 3.3Å; E130-K133 WeakPolarHBondContact O-CB 3.41Å; E130-K133 PolarHBondContact O-N 3.22Å; E130-K133 VanDerWaalsContact O-N 3.14Å; E130-E134 WeakPolarHBondContact O-CG 3.43Å; E130-E134 PolarHBondContact O-N 3.35Å |
| 131 | K | 95.8 | Very high | 94.1 | Very high | 112 Ų | 112 | 87.4 Ų | 87.4 | 49% | 0.487 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -58.1 | -41.4 | 174.7 | -69.2 | 165.3 | -166.9 | 154.1 | 0 | 111.4 | E127 D128 S135 | E127-K131 VanDerWaalsContact O-CG 3.32Å; E127-K131 WeakPolarHBondContact O-CG 3.28Å; E127-K131 PolarHBondContact O-N 3.45Å; E127-K131 IonicContact OE2-NZ 3.94Å; E127-K131 PolarHBondContact OE2-NZ 3Å; D128-K131 PolarHBondContact O-N 3.19Å; K131-S135 WeakPolarHBondContact O-CB 3.3Å; K131-S135 PolarHBondContact O-N 2.96Å; K131-S135 PolarHBondContact O-OG 2.93Å |
| 132 | L | 95.3 | Very high | 94.4 | Very high | 119 Ų | 119 | 92.2 Ų | 92.2 | 62% | 0.623 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -64.9 | -44.7 | 176.2 | -174.7 | 61.6 | 0 | 0 | 0 | 111.5 | D128 E130 S135 S136 | D128-L132 VanDerWaalsContact O-CB 3.3Å; D128-L132 WeakPolarHBondContact O-CB 3.4Å; D128-L132 PolarHBondContact O-N 3.48Å; E130-L132 VanDerWaalsContact C-N 3.28Å; E130-L132 PolarHBondContact O-N 3.3Å; L132-S135 WeakPolarHBondContact CA-OG 3.39Å; L132-S135 PolarHBondContact O-N 3.27Å; L132-S135 PolarHBondContact O-OG 3.46Å; L132-S136 VanDerWaalsContact O-CB 3.3Å; L132-S136 WeakPolarHBondContact O-CB 3.35Å; L132-S136 PolarHBondContact O-N 3.45Å; L132-S136 PolarHBondContact O-OG 2.91Å |
| 133 | K | 95.7 | Very high | 94.7 | Very high | 115 Ų | 115 | 95.7 Ų | 95.7 | 50% | 0.5 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.1 | -53.3 | 174.8 | -79.8 | 173.9 | 176.2 | 170.3 | 0 | 111.1 | L129 E130 S135 S136 E137 | L129-K133 HydrophobicContact CD2-CD 3.77Å; L129-K133 HydrophobicContact CD2-CG 4.38Å; L129-K133 WeakPolarHBondContact O-CB 3.48Å; L129-K133 VanDerWaalsContact O-CG 3.3Å; L129-K133 WeakPolarHBondContact O-CG 3.4Å; L129-K133 PolarHBondContact O-N 2.73Å; E130-K133 WeakPolarHBondContact O-CB 3.41Å; E130-K133 PolarHBondContact O-N 3.22Å; E130-K133 VanDerWaalsContact O-N 3.14Å; K133-S135 VanDerWaalsContact C-N 3.34Å; K133-S135 PolarHBondContact O-N 2.98Å; K133-S136 PolarHBondContact O-N 3.46Å; K133-S136 VanDerWaalsContact O-N 3.15Å; K133-S136 PolarHBondContact O-OG 3.36Å; K133-E137 WeakPolarHBondContact O-CG 3.36Å; K133-E137 PolarHBondContact O-N 3.45Å |
| 134 | E | 95.8 | Very high | 94.9 | Very high | 97 Ų | 97 | 98.4 Ų | 98.4 | 45% | 0.453 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.3 | -45.4 | -179.6 | -72 | -173.9 | -175.7 | 0 | 0 | 112.2 | E130 E137 R138 | E130-E134 WeakPolarHBondContact O-CG 3.43Å; E130-E134 PolarHBondContact O-N 3.35Å; E134-E137 PolarHBondContact O-N 2.99Å; E134-R138 WeakPolarHBondContact O-CB 3.32Å; E134-R138 WeakPolarHBondContact O-CG 3.41Å; E134-R138 PolarHBondContact O-N 3.4Å; E134-R138 IonicContact OE2-CZ 3.89Å; E134-R138 IonicContact OE2-NH2 3.61Å; E134-R138 PolarHBondContact OE2-NH2 3.33Å |
| 135 | S | 96 | Very high | 95 | Very high | 52 Ų | 52 | 97.9 Ų | 97.9 | 36% | 0.364 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.4 | -40.9 | 177.8 | 61.1 | 0 | 0 | 0 | 0 | 112 | K131 L132 K133 R138 V139 | K131-S135 WeakPolarHBondContact O-CB 3.3Å; K131-S135 PolarHBondContact O-N 2.96Å; K131-S135 PolarHBondContact O-OG 2.93Å; L132-S135 WeakPolarHBondContact CA-OG 3.39Å; L132-S135 PolarHBondContact O-N 3.27Å; L132-S135 PolarHBondContact O-OG 3.46Å; K133-S135 VanDerWaalsContact C-N 3.34Å; K133-S135 PolarHBondContact O-N 2.98Å; S135-R138 PolarHBondContact O-N 2.85Å; S135-V139 VanDerWaalsContact O-CG2 3.29Å; S135-V139 WeakPolarHBondContact O-CG2 3.39Å; S135-V139 PolarHBondContact O-N 3.46Å |
| 136 | S | 95.1 | Very high | 95.2 | Very high | 53 Ų | 53 | 98.7 Ų | 98.7 | 37% | 0.371 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 176.2 | 76 | 0 | 0 | 0 | 0 | 112.3 | L132 K133 V139 L140 | L132-S136 VanDerWaalsContact O-CB 3.3Å; L132-S136 WeakPolarHBondContact O-CB 3.35Å; L132-S136 PolarHBondContact O-N 3.45Å; L132-S136 PolarHBondContact O-OG 2.91Å; K133-S136 PolarHBondContact O-N 3.46Å; K133-S136 VanDerWaalsContact O-N 3.15Å; K133-S136 PolarHBondContact O-OG 3.36Å; S136-V139 PolarHBondContact O-N 3.34Å; S136-L140 WeakPolarHBondContact O-CB 3.48Å; S136-L140 WeakPolarHBondContact O-CG 3.4Å; S136-L140 PolarHBondContact O-N 3.05Å |
| 137 | E | 95 | Very high | 95.4 | Very high | 106 Ų | 106 | 99.1 Ų | 99.1 | 50% | 0.495 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.4 | -44.8 | 177 | -74.6 | 178.3 | 177 | 0 | 0 | 111.1 | K133 E134 V139 L140 H141 | K133-E137 WeakPolarHBondContact O-CG 3.36Å; K133-E137 PolarHBondContact O-N 3.45Å; E134-E137 PolarHBondContact O-N 2.99Å; E137-V139 VanDerWaalsContact C-N 3.3Å; E137-V139 PolarHBondContact O-N 2.96Å; E137-L140 PolarHBondContact O-N 2.93Å; E137-H141 WeakPolarHBondContact O-CB 3.39Å; E137-H141 PolarHBondContact O-CD2 2.93Å; E137-H141 PolarHBondContact O-N 2.88Å |
| 138 | R | 96.1 | Very high | 95.4 | Very high | 149 Ų | 149 | 100.2 Ų | 100.2 | 56% | 0.562 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -56.2 | -45.6 | 174 | -70.6 | 170.3 | -154.1 | 173.8 | 5.9 | 111.2 | E134 S135 H141 N142 | E134-R138 WeakPolarHBondContact O-CB 3.32Å; E134-R138 WeakPolarHBondContact O-CG 3.41Å; E134-R138 PolarHBondContact O-N 3.4Å; E134-R138 IonicContact OE2-CZ 3.89Å; E134-R138 IonicContact OE2-NH2 3.61Å; E134-R138 PolarHBondContact OE2-NH2 3.33Å; S135-R138 PolarHBondContact O-N 2.85Å; R138-H141 PolarHBondContact O-N 3.12Å; R138-N142 VanDerWaalsContact O-CG 3.25Å; R138-N142 PolarHBondContact O-N 3.49Å; R138-N142 PolarHBondContact O-ND2 2.8Å |
| 139 | V | 96.4 | Very high | 95.4 | Very high | 68 Ų | 68 | 101.7 Ų | 101.7 | 41% | 0.412 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -44.9 | 177.6 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | S135 S136 E137 H141 N142 Y143 | S135-V139 VanDerWaalsContact O-CG2 3.29Å; S135-V139 WeakPolarHBondContact O-CG2 3.39Å; S135-V139 PolarHBondContact O-N 3.46Å; S136-V139 PolarHBondContact O-N 3.34Å; E137-V139 VanDerWaalsContact C-N 3.3Å; E137-V139 PolarHBondContact O-N 2.96Å; V139-H141 PolarHBondContact O-N 3.2Å; V139-N142 PolarHBondContact O-N 3.24Å; V139-Y143 HydrophobicContact CG1-CD2 3.61Å; V139-Y143 HydrophobicContact CG1-CE2 3.26Å; V139-Y143 VanDerWaalsContact O-CD2 3.28Å; V139-Y143 WeakPolarHBondContact O-CD2 3.34Å; V139-Y143 PolarHBondContact O-N 3.31Å |
| 140 | L | 96.1 | Very high | 95.4 | Very high | 96 Ų | 96 | 99.7 Ų | 99.7 | 50% | 0.503 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 176.3 | -75.7 | 173.1 | 0 | 0 | 0 | 112.3 | S136 E137 N142 Y143 K144 | S136-L140 WeakPolarHBondContact O-CB 3.48Å; S136-L140 WeakPolarHBondContact O-CG 3.4Å; S136-L140 PolarHBondContact O-N 3.05Å; E137-L140 PolarHBondContact O-N 2.93Å; L140-N142 VanDerWaalsContact C-N 3.35Å; L140-Y143 PolarHBondContact O-N 2.83Å; L140-K144 WeakPolarHBondContact O-CG 3.2Å; L140-K144 PolarHBondContact O-N 3.32Å |
| 141 | H | 95.2 | Very high | 95.4 | Very high | 116 Ų | 116 | 99.1 Ų | 99.1 | 54% | 0.537 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 176 | -75.3 | -57.9 | 0 | 0 | 0 | 112 | E137 R138 V139 K144 A145 | E137-H141 WeakPolarHBondContact O-CB 3.39Å; E137-H141 PolarHBondContact O-CD2 2.93Å; E137-H141 PolarHBondContact O-N 2.88Å; R138-H141 PolarHBondContact O-N 3.12Å; V139-H141 PolarHBondContact O-N 3.2Å; H141-K144 PolarHBondContact O-N 2.85Å; H141-A145 WeakPolarHBondContact O-CB 3.24Å; H141-A145 PolarHBondContact O-N 2.83Å |
| 142 | N | 95.9 | Very high | 95.3 | Very high | 106 Ų | 106 | 98.6 Ų | 98.6 | 57% | 0.567 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62 | -47.2 | 174.5 | -71.9 | -25.5 | 0 | 0 | 0 | 111.4 | R138 V139 L140 K144 A145 T146 | R138-N142 VanDerWaalsContact O-CG 3.25Å; R138-N142 PolarHBondContact O-N 3.49Å; R138-N142 PolarHBondContact O-ND2 2.8Å; V139-N142 PolarHBondContact O-N 3.24Å; L140-N142 VanDerWaalsContact C-N 3.35Å; N142-K144 VanDerWaalsContact C-N 3.34Å; N142-K144 PolarHBondContact O-N 3.34Å; N142-A145 PolarHBondContact O-N 3.48Å; N142-T146 WeakPolarHBondContact O-CG2 3.44Å; N142-T146 PolarHBondContact O-N 2.93Å; N142-T146 PolarHBondContact O-OG1 3.16Å |
| 143 | Y | 95.9 | Very high | 95.2 | Very high | 150 Ų | 150 | 97.6 Ų | 97.6 | 59% | 0.588 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.6 | -41.8 | 177.8 | -75.9 | -52.2 | 0 | 0 | 0 | 112.6 | V139 L140 T146 L147 | V139-Y143 HydrophobicContact CG1-CD2 3.61Å; V139-Y143 HydrophobicContact CG1-CE2 3.26Å; V139-Y143 VanDerWaalsContact O-CD2 3.28Å; V139-Y143 WeakPolarHBondContact O-CD2 3.34Å; V139-Y143 PolarHBondContact O-N 3.31Å; L140-Y143 PolarHBondContact O-N 2.83Å; Y143-T146 WeakPolarHBondContact CA-OG1 3.37Å; Y143-T146 PolarHBondContact O-N 3Å; Y143-T146 PolarHBondContact O-OG1 3.02Å; Y143-L147 WeakPolarHBondContact O-CG 3.49Å; Y143-L147 PolarHBondContact O-N 3.34Å |
| 144 | K | 96.4 | Very high | 95.1 | Very high | 119 Ų | 119 | 96.3 Ų | 96.3 | 52% | 0.517 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.3 | -47.6 | 174.1 | -74.1 | 174.9 | -178.4 | 179.2 | 0 | 111.5 | L140 H141 N142 T146 L147 E148 | L140-K144 WeakPolarHBondContact O-CG 3.2Å; L140-K144 PolarHBondContact O-N 3.32Å; H141-K144 PolarHBondContact O-N 2.85Å; N142-K144 VanDerWaalsContact C-N 3.34Å; N142-K144 PolarHBondContact O-N 3.34Å; K144-T146 VanDerWaalsContact C-N 3.33Å; K144-T146 PolarHBondContact O-N 3.4Å; K144-L147 PolarHBondContact O-N 3.22Å; K144-E148 WeakPolarHBondContact O-CG 3.38Å; K144-E148 PolarHBondContact O-N 2.88Å |
| 145 | A | 93.9 | Very high | 95.1 | Very high | 53 Ų | 53 | 96.4 Ų | 96.4 | 44% | 0.438 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | H141 N142 L147 E148 E149 | H141-A145 WeakPolarHBondContact O-CB 3.24Å; H141-A145 PolarHBondContact O-N 2.83Å; N142-A145 PolarHBondContact O-N 3.48Å; A145-L147 PolarHBondContact O-N 3.09Å; A145-E148 PolarHBondContact O-N 3.49Å; A145-E149 WeakPolarHBondContact O-CB 3.47Å; A145-E149 PolarHBondContact O-N 2.94Å |
| 146 | T | 95.4 | Very high | 94.8 | Very high | 74 Ų | 74 | 97.5 Ų | 97.5 | 45% | 0.454 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.5 | -35.6 | 177.3 | 56.2 | 0 | 0 | 0 | 0 | 113.1 | N142 Y143 K144 A150 | N142-T146 WeakPolarHBondContact O-CG2 3.44Å; N142-T146 PolarHBondContact O-N 2.93Å; N142-T146 PolarHBondContact O-OG1 3.16Å; Y143-T146 WeakPolarHBondContact CA-OG1 3.37Å; Y143-T146 PolarHBondContact O-N 3Å; Y143-T146 PolarHBondContact O-OG1 3.02Å; K144-T146 VanDerWaalsContact C-N 3.33Å; K144-T146 PolarHBondContact O-N 3.4Å; T146-A150 WeakPolarHBondContact O-CB 3.33Å; T146-A150 PolarHBondContact O-N 3.27Å |
| 147 | L | 95.8 | Very high | 94.7 | Very high | 111 Ų | 111 | 99.4 Ų | 99.4 | 58% | 0.581 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -68.1 | -47.1 | 175.8 | -77.2 | 169.4 | 0 | 0 | 0 | 111 | Y143 K144 A145 E149 A150 D151 | Y143-L147 WeakPolarHBondContact O-CG 3.49Å; Y143-L147 PolarHBondContact O-N 3.34Å; K144-L147 PolarHBondContact O-N 3.22Å; A145-L147 PolarHBondContact O-N 3.09Å; L147-E149 VanDerWaalsContact C-N 3.31Å; L147-E149 PolarHBondContact O-N 3.44Å; L147-A150 PolarHBondContact O-N 2.87Å; L147-D151 PolarHBondContact O-N 2.98Å |
| 148 | E | 94.6 | Very high | 94.7 | Very high | 126 Ų | 126 | 100.6 Ų | 100.6 | 59% | 0.589 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.1 | -41.7 | 176.6 | -71.7 | 174.1 | -169.5 | 0 | 0 | 111.6 | K144 A145 D151 I152 | K144-E148 WeakPolarHBondContact O-CG 3.38Å; K144-E148 PolarHBondContact O-N 2.88Å; A145-E148 PolarHBondContact O-N 3.49Å; E148-D151 PolarHBondContact O-N 3.4Å; E148-I152 WeakPolarHBondContact O-CD1 3.37Å; E148-I152 VanDerWaalsContact O-CG1 3.26Å; E148-I152 WeakPolarHBondContact O-CG1 3.4Å; E148-I152 PolarHBondContact O-N 3.28Å |
| 149 | E | 93.4 | Very high | 94.5 | Very high | 110 Ų | 110 | 99.6 Ų | 99.6 | 51% | 0.514 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62 | -46.8 | 174.2 | -174.7 | -178.3 | 173.6 | 0 | 0 | 111.6 | A145 L147 D151 I152 Q153 | A145-E149 WeakPolarHBondContact O-CB 3.47Å; A145-E149 PolarHBondContact O-N 2.94Å; L147-E149 VanDerWaalsContact C-N 3.31Å; L147-E149 PolarHBondContact O-N 3.44Å; E149-D151 VanDerWaalsContact C-N 3.32Å; E149-D151 PolarHBondContact O-N 3.13Å; E149-I152 PolarHBondContact O-N 3.45Å; E149-Q153 HydrophobicContact CG-CG 4.36Å; E149-Q153 WeakPolarHBondContact O-CB 3.44Å; E149-Q153 VanDerWaalsContact O-CG 3.31Å; E149-Q153 WeakPolarHBondContact O-CG 3.44Å; E149-Q153 PolarHBondContact O-N 2.65Å; E149-Q153 PolarHBondContact OE1-NE2 3.37Å |
| 150 | A | 94.5 | Very high | 94.2 | Very high | 47 Ų | 47 | 96.8 Ų | 96.8 | 39% | 0.388 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.6 | -39.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | T146 L147 Q153 L154 | T146-A150 WeakPolarHBondContact O-CB 3.33Å; T146-A150 PolarHBondContact O-N 3.27Å; L147-A150 PolarHBondContact O-N 2.87Å; A150-Q153 PolarHBondContact O-N 2.96Å; A150-L154 VanDerWaalsContact O-CB 3.32Å; A150-L154 WeakPolarHBondContact O-CB 3.39Å; A150-L154 PolarHBondContact O-N 2.95Å |
| 151 | D | 95.4 | Very high | 93.9 | Very high | 103 Ų | 103 | 95.3 Ų | 95.3 | 55% | 0.551 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.7 | -44.2 | 175.8 | -78.6 | -23.1 | 0 | 0 | 0 | 111.6 | L147 E148 E149 L154 V155 | L147-D151 PolarHBondContact O-N 2.98Å; E148-D151 PolarHBondContact O-N 3.4Å; E149-D151 VanDerWaalsContact C-N 3.32Å; E149-D151 PolarHBondContact O-N 3.13Å; D151-L154 PolarHBondContact O-N 2.85Å; D151-V155 WeakPolarHBondContact O-CG2 3.4Å; D151-V155 PolarHBondContact O-N 3.33Å; D151-V155 VanDerWaalsContact O-N 3.1Å |
| 152 | I | 92.8 | Very high | 93.8 | Very high | 100 Ų | 100 | 97 Ų | 97 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -48.7 | 174.9 | -67.4 | 165.8 | 0 | 0 | 0 | 110.1 | E148 E149 L154 V155 E156 | E148-I152 WeakPolarHBondContact O-CD1 3.37Å; E148-I152 VanDerWaalsContact O-CG1 3.26Å; E148-I152 WeakPolarHBondContact O-CG1 3.4Å; E148-I152 PolarHBondContact O-N 3.28Å; E149-I152 PolarHBondContact O-N 3.45Å; I152-L154 VanDerWaalsContact C-N 3.32Å; I152-L154 PolarHBondContact O-N 3.01Å; I152-V155 PolarHBondContact O-N 3.48Å; I152-E156 HydrophobicContact CG2-CG 4.41Å; I152-E156 WeakPolarHBondContact O-CG 3.4Å; I152-E156 PolarHBondContact O-N 3.02Å |
| 153 | Q | 93.3 | Very high | 93.5 | Very high | 99 Ų | 99 | 94.7 Ų | 94.7 | 46% | 0.463 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60 | -41.5 | 178.9 | -72.8 | -177 | 11.5 | 0 | 0 | 111.7 | E149 A150 V155 E156 V157 | E149-Q153 HydrophobicContact CG-CG 4.36Å; E149-Q153 WeakPolarHBondContact O-CB 3.44Å; E149-Q153 VanDerWaalsContact O-CG 3.31Å; E149-Q153 WeakPolarHBondContact O-CG 3.44Å; E149-Q153 PolarHBondContact O-N 2.65Å; E149-Q153 PolarHBondContact OE1-NE2 3.37Å; A150-Q153 PolarHBondContact O-N 2.96Å; Q153-V155 PolarHBondContact O-N 3.47Å; Q153-E156 PolarHBondContact O-N 2.98Å; Q153-V157 WeakPolarHBondContact O-CB 3.42Å; Q153-V157 VanDerWaalsContact O-CG2 3.27Å; Q153-V157 WeakPolarHBondContact O-CG2 3.39Å; Q153-V157 PolarHBondContact O-N 3.27Å |
| 154 | L | 95.1 | Very high | 93.1 | Very high | 88 Ų | 88 | 90.7 Ų | 90.7 | 46% | 0.461 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61 | -45.5 | 178 | -179 | 66.4 | 0 | 0 | 0 | 111.5 | A150 D151 I152 K158 | A150-L154 VanDerWaalsContact O-CB 3.32Å; A150-L154 WeakPolarHBondContact O-CB 3.39Å; A150-L154 PolarHBondContact O-N 2.95Å; D151-L154 PolarHBondContact O-N 2.85Å; I152-L154 VanDerWaalsContact C-N 3.32Å; I152-L154 PolarHBondContact O-N 3.01Å; L154-K158 HydrophobicContact CG-CD 4.41Å; L154-K158 WeakPolarHBondContact O-CB 3.46Å; L154-K158 WeakPolarHBondContact O-CG 3.46Å; L154-K158 PolarHBondContact O-N 3.17Å |
| 155 | V | 94.9 | Very high | 92.7 | Very high | 99 Ų | 99 | 88.6 Ų | 88.6 | 60% | 0.6 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -64 | -44 | 176.9 | 173.6 | 0 | 0 | 0 | 0 | 110.7 | D151 I152 Q153 K158 K159 | D151-V155 WeakPolarHBondContact O-CG2 3.4Å; D151-V155 PolarHBondContact O-N 3.33Å; D151-V155 VanDerWaalsContact O-N 3.1Å; I152-V155 PolarHBondContact O-N 3.48Å; Q153-V155 PolarHBondContact O-N 3.47Å; V155-K158 PolarHBondContact O-N 3.32Å; V155-K159 WeakPolarHBondContact O-CB 3.48Å; V155-K159 PolarHBondContact O-N 3.47Å |
| 156 | E | 89.9 | Confident | 92.4 | Very high | 75 Ų | 75 | 91.5 Ų | 91.5 | 35% | 0.35 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.1 | -43.4 | 177.5 | -74.7 | -169.4 | 179.8 | 0 | 0 | 112.7 | I152 Q153 K159 A160 K196 | I152-E156 HydrophobicContact CG2-CG 4.41Å; I152-E156 WeakPolarHBondContact O-CG 3.4Å; I152-E156 PolarHBondContact O-N 3.02Å; Q153-E156 PolarHBondContact O-N 2.98Å; E156-K159 PolarHBondContact O-N 3.49Å; E156-A160 VanDerWaalsContact O-CB 3.27Å; E156-A160 WeakPolarHBondContact O-CB 3.43Å; E156-A160 PolarHBondContact O-N 3.42Å; E156-K196 IonicContact OE2-NZ 2.83Å; E156-K196 PolarHBondContact OE2-NZ 3.45Å |
| 157 | V | 93.5 | Very high | 91.8 | Very high | 92 Ų | 92 | 90.8 Ų | 90.8 | 56% | 0.558 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.7 | -44.7 | 179.1 | 169.3 | 0 | 0 | 0 | 0 | 110.8 | Q153 K159 A160 S161 | Q153-V157 WeakPolarHBondContact O-CB 3.42Å; Q153-V157 VanDerWaalsContact O-CG2 3.27Å; Q153-V157 WeakPolarHBondContact O-CG2 3.39Å; Q153-V157 PolarHBondContact O-N 3.27Å; V157-K159 VanDerWaalsContact C-N 3.34Å; V157-K159 PolarHBondContact O-N 3.26Å; V157-A160 PolarHBondContact O-N 2.86Å; V157-S161 WeakPolarHBondContact O-CB 3.29Å; V157-S161 PolarHBondContact O-N 3.18Å |
| 158 | K | 94.6 | Very high | 91.2 | Very high | 132 Ų | 132 | 85.5 Ų | 85.5 | 57% | 0.574 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -58.9 | -46.3 | 175.7 | -76 | 175.6 | 179.8 | 175 | 0 | 111.4 | L154 V155 S161 Y162 | L154-K158 HydrophobicContact CG-CD 4.41Å; L154-K158 WeakPolarHBondContact O-CB 3.46Å; L154-K158 WeakPolarHBondContact O-CG 3.46Å; L154-K158 PolarHBondContact O-N 3.17Å; V155-K158 PolarHBondContact O-N 3.32Å; K158-S161 PolarHBondContact O-N 2.99Å; K158-Y162 PolarHBondContact O-N 3.06Å |
| 159 | K | 91.9 | Very high | 90.6 | Very high | 128 Ų | 128 | 80.2 Ų | 80.2 | 56% | 0.557 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -62 | -46.6 | 176.9 | -177.8 | 175.6 | 172.6 | -179.4 | 0 | 111.4 | V155 E156 V157 S161 Y162 E163 | V155-K159 WeakPolarHBondContact O-CB 3.48Å; V155-K159 PolarHBondContact O-N 3.47Å; E156-K159 PolarHBondContact O-N 3.49Å; V157-K159 VanDerWaalsContact C-N 3.34Å; V157-K159 PolarHBondContact O-N 3.26Å; K159-S161 VanDerWaalsContact C-N 3.35Å; K159-S161 PolarHBondContact O-N 3.4Å; K159-Y162 PolarHBondContact O-N 3.39Å; K159-E163 WeakPolarHBondContact CE-OE1 3.2Å; K159-E163 HydrophobicContact CG-CG 4.42Å; K159-E163 IonicContact NZ-OE1 3.76Å; K159-E163 WeakPolarHBondContact O-CB 3.45Å; K159-E163 WeakPolarHBondContact O-CG 3.43Å; K159-E163 PolarHBondContact O-N 3.37Å |
| 160 | A | 89.3 | Confident | 90.1 | Very high | 9 Ų | 9 | 80.1 Ų | 80.1 | 7% | 0.074 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.6 | -38.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E156 V157 F164 Y188 | E156-A160 VanDerWaalsContact O-CB 3.27Å; E156-A160 WeakPolarHBondContact O-CB 3.43Å; E156-A160 PolarHBondContact O-N 3.42Å; V157-A160 PolarHBondContact O-N 2.86Å; A160-F164 VanDerWaalsContact O-CB 3.28Å; A160-F164 WeakPolarHBondContact O-CB 3.43Å; A160-F164 PolarHBondContact O-N 2.84Å; A160-Y188 PolarHBondContact O-OH 2.96Å |
| 161 | S | 90.9 | Very high | 89.2 | Confident | 64 Ų | 64 | 79.8 Ų | 79.8 | 45% | 0.448 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.5 | -48.3 | 174.3 | -169.9 | 0 | 0 | 0 | 0 | 110.9 | V157 K158 K159 F164 D165 | V157-S161 WeakPolarHBondContact O-CB 3.29Å; V157-S161 PolarHBondContact O-N 3.18Å; K158-S161 PolarHBondContact O-N 2.99Å; K159-S161 VanDerWaalsContact C-N 3.35Å; K159-S161 PolarHBondContact O-N 3.4Å; S161-F164 PolarHBondContact O-N 3.35Å; S161-D165 WeakPolarHBondContact O-CB 3.34Å; S161-D165 PolarHBondContact O-N 2.9Å |
| 162 | Y | 92.8 | Very high | 88.3 | Confident | 152 Ų | 152 | 78.4 Ų | 78.4 | 60% | 0.596 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -62.7 | -44.3 | 178.8 | 177.7 | -96.8 | 0 | 0 | 0 | 112.5 | K158 K159 D165 R166 | K158-Y162 PolarHBondContact O-N 3.06Å; K159-Y162 PolarHBondContact O-N 3.39Å; Y162-D165 PolarHBondContact O-N 3.41Å; Y162-R166 WeakPolarHBondContact O-CB 3.43Å; Y162-R166 PolarHBondContact O-N 2.8Å |
| 163 | E | 89 | Confident | 87.3 | Confident | 58 Ų | 58 | 82.2 Ų | 82.2 | 27% | 0.271 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 177 | -73.1 | 173.7 | 172.5 | 0 | 0 | 111.5 | K159 R166 D167 | K159-E163 WeakPolarHBondContact CE-OE1 3.2Å; K159-E163 HydrophobicContact CG-CG 4.42Å; K159-E163 IonicContact NZ-OE1 3.76Å; K159-E163 WeakPolarHBondContact O-CB 3.45Å; K159-E163 WeakPolarHBondContact O-CG 3.43Å; K159-E163 PolarHBondContact O-N 3.37Å; E163-R166 PolarHBondContact O-N 3.28Å; E163-D167 VanDerWaalsContact O-CB 3.26Å; E163-D167 WeakPolarHBondContact O-CB 3.39Å; E163-D167 PolarHBondContact O-N 3.48Å |
| 164 | F | 88.7 | Confident | 86.2 | Confident | 65 Ų | 65 | 83.5 Ų | 83.5 | 29% | 0.285 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 174.8 | -176 | -99.1 | 0 | 0 | 0 | 111.8 | A160 S161 R166 V168 A169 Y188 | A160-F164 VanDerWaalsContact O-CB 3.28Å; A160-F164 WeakPolarHBondContact O-CB 3.43Å; A160-F164 PolarHBondContact O-N 2.84Å; S161-F164 PolarHBondContact O-N 3.35Å; F164-R166 VanDerWaalsContact C-N 3.32Å; F164-R166 PolarHBondContact O-N 3.33Å; F164-V168 HydrophobicContact CD2-CB 3.9Å; F164-V168 HydrophobicContact CD2-CG1 4.35Å; F164-V168 HydrophobicContact CD2-CG2 3.77Å; F164-V168 HydrophobicContact CE2-CB 3.79Å; F164-V168 HydrophobicContact CE2-CG1 3.72Å; F164-V168 HydrophobicContact CE2-CG2 3.86Å; F164-V168 HydrophobicContact CG-CB 4.37Å; F164-V168 HydrophobicContact CZ-CB 4.14Å; F164-V168 HydrophobicContact CZ-CG1 3.82Å; F164-V168 WeakPolarHBondContact O-CA 3.32Å; F164-V168 VanDerWaalsContact O-CB 3.27Å; F164-V168 WeakPolarHBondContact O-CB 3.38Å; F164-V168 PolarHBondContact O-N 3.25Å; F164-A169 PolarHBondContact O-N 3.43Å; F164-Y188 HydrophobicContact CB-CE1 4.41Å; F164-Y188 HydrophobicContact CB-CE2 4.28Å; F164-Y188 AromaticContact CD2-CD1 3.71Å; F164-Y188 HydrophobicContact CD2-CD1 3.71Å; F164-Y188 HydrophobicContact CD2-CD2 4.49Å; F164-Y188 AromaticContact CD2-CE1 3.53Å; F164-Y188 HydrophobicContact CD2-CE1 3.53Å; F164-Y188 HydrophobicContact CD2-CE2 4.32Å; F164-Y188 HydrophobicContact CD2-CG 4.21Å; F164-Y188 AromaticContact CD2-CZ 3.86Å; F164-Y188 HydrophobicContact CE2-CD1 4.15Å; F164-Y188 HydrophobicContact CE2-CE1 4.3Å; F164-Y188 HydrophobicContact CG-CE1 4.41Å |
| 165 | D | 88.1 | Confident | 84.7 | Confident | 76 Ų | 76 | 86.9 Ų | 86.9 | 41% | 0.406 | 41% | 0.412 | S | S | . | . | I | π-helix | trans | -62.4 | -40.3 | 178.5 | -77 | -33.4 | 0 | 0 | 0 | 112.2 | S161 Y162 A169 K170 | S161-D165 WeakPolarHBondContact O-CB 3.34Å; S161-D165 PolarHBondContact O-N 2.9Å; Y162-D165 PolarHBondContact O-N 3.41Å; D165-A169 PolarHBondContact O-N 2.82Å; D165-K170 WeakPolarHBondContact O-CB 3.46Å; D165-K170 PolarHBondContact O-N 2.92Å |
| 166 | R | 86.4 | Confident | 83 | Confident | 114 Ų | 114 | 94.6 Ų | 94.6 | 43% | 0.43 | 43% | 0.43 | S | S | . | . | I | π-helix | trans | -69.4 | -51.6 | 177.8 | -175.3 | -171.3 | 69.6 | -159.3 | -9.5 | 112.1 | Y162 E163 F164 | Y162-R166 WeakPolarHBondContact O-CB 3.43Å; Y162-R166 PolarHBondContact O-N 2.8Å; E163-R166 PolarHBondContact O-N 3.28Å; F164-R166 VanDerWaalsContact C-N 3.32Å; F164-R166 PolarHBondContact O-N 3.33Å |
| 167 | D | 82.8 | Confident | 81.5 | Confident | 58 Ų | 58 | 92.9 Ų | 92.9 | 31% | 0.31 | 43% | 0.432 | S | S | . | . | I | π-helix | trans | -88.4 | -30.6 | -165.9 | -62 | -26.1 | 0 | 0 | 0 | 111.9 | E163 K184 | E163-D167 VanDerWaalsContact O-CB 3.26Å; E163-D167 WeakPolarHBondContact O-CB 3.39Å; E163-D167 PolarHBondContact O-N 3.48Å; D167-K184 WeakPolarHBondContact O-CE 3.38Å; D167-K184 PolarHBondContact O-NZ 3.28Å |
| 168 | V | 83.4 | Confident | 79.8 | Confident | 1 Ų | 1 | 95.2 Ų | 95.2 | 1% | 0.006 | 45% | 0.446 | C | S | . | . | I | π-helix | trans | -108 | -63.1 | -177.5 | -176 | 0 | 0 | 0 | 0 | 110.5 | F164 K170 V171 L172 V185 Y188 | F164-V168 HydrophobicContact CD2-CB 3.9Å; F164-V168 HydrophobicContact CD2-CG1 4.35Å; F164-V168 HydrophobicContact CD2-CG2 3.77Å; F164-V168 HydrophobicContact CE2-CB 3.79Å; F164-V168 HydrophobicContact CE2-CG1 3.72Å; F164-V168 HydrophobicContact CE2-CG2 3.86Å; F164-V168 HydrophobicContact CG-CB 4.37Å; F164-V168 HydrophobicContact CZ-CB 4.14Å; F164-V168 HydrophobicContact CZ-CG1 3.82Å; F164-V168 WeakPolarHBondContact O-CA 3.32Å; F164-V168 VanDerWaalsContact O-CB 3.27Å; F164-V168 WeakPolarHBondContact O-CB 3.38Å; F164-V168 PolarHBondContact O-N 3.25Å; V168-K170 PolarHBondContact O-N 2.91Å; V168-V171 PolarHBondContact O-N 3.11Å; V168-L172 HydrophobicContact CG1-CD1 3.65Å; V168-L172 HydrophobicContact CG1-CG 4.41Å; V168-L172 WeakPolarHBondContact O-CB 3.47Å; V168-L172 WeakPolarHBondContact O-CG 3.33Å; V168-L172 PolarHBondContact O-N 2.88Å; V168-V185 HydrophobicContact CG1-CG2 3.57Å; V168-Y188 HydrophobicContact CG2-CD2 4.07Å; V168-Y188 HydrophobicContact CG2-CG 3.89Å |
| 169 | A | 82.6 | Confident | 78.1 | Confident | 15 Ų | 15 | 97.3 Ų | 97.3 | 12% | 0.124 | 46% | 0.46 | C | S | . | . | I | π-helix | trans | -66.5 | -41.8 | -168.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | F164 D165 R173 | F164-A169 PolarHBondContact O-N 3.43Å; D165-A169 PolarHBondContact O-N 2.82Å; A169-R173 WeakPolarHBondContact O-CG 3.3Å; A169-R173 PolarHBondContact O-N 3.41Å |
| 170 | K | 82 | Confident | 76.7 | Confident | 108 Ų | 108 | 97.7 Ų | 97.7 | 47% | 0.47 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 177.6 | -175.2 | 176.5 | 175.4 | 179.9 | 0 | 111.7 | D165 V168 L172 R173 E174 | D165-K170 WeakPolarHBondContact O-CB 3.46Å; D165-K170 PolarHBondContact O-N 2.92Å; V168-K170 PolarHBondContact O-N 2.91Å; K170-L172 VanDerWaalsContact C-N 3.34Å; K170-L172 PolarHBondContact O-N 2.98Å; K170-R173 PolarHBondContact O-N 3.01Å; K170-E174 WeakPolarHBondContact CE-OE1 3.36Å; K170-E174 WeakPolarHBondContact CG-OE1 3.37Å; K170-E174 WeakPolarHBondContact O-CG 3.29Å; K170-E174 PolarHBondContact O-N 3.47Å; K170-E174 VanDerWaalsContact O-N 3.15Å |
| 171 | V | 75.9 | Confident | 75.9 | Confident | 39 Ų | 39 | 97.6 Ų | 97.6 | 24% | 0.236 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -70.1 | -33 | -179.2 | -179 | 0 | 0 | 0 | 0 | 112.3 | V168 R173 E174 K175 K184 | V168-V171 PolarHBondContact O-N 3.11Å; V171-R173 VanDerWaalsContact C-N 3.33Å; V171-E174 PolarHBondContact O-N 3.24Å; V171-K175 PolarHBondContact O-N 2.95Å; V171-K175 VanDerWaalsContact O-N 3.11Å; V171-K184 HydrophobicContact CB-CD 4.42Å; V171-K184 VanDerWaalsContact CB-NZ 3.33Å; V171-K184 HydrophobicContact CG1-CD 4.22Å; V171-K184 VanDerWaalsContact CG1-NZ 3.35Å |
| 172 | L | 76.4 | Confident | 75.3 | Confident | 75 Ų | 75 | 97.3 Ų | 97.3 | 39% | 0.393 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.4 | -35.8 | 171.8 | -74.2 | 171 | 0 | 0 | 0 | 112.7 | V168 K170 V185 | V168-L172 HydrophobicContact CG1-CD1 3.65Å; V168-L172 HydrophobicContact CG1-CG 4.41Å; V168-L172 WeakPolarHBondContact O-CB 3.47Å; V168-L172 WeakPolarHBondContact O-CG 3.33Å; V168-L172 PolarHBondContact O-N 2.88Å; K170-L172 VanDerWaalsContact C-N 3.34Å; K170-L172 PolarHBondContact O-N 2.98Å; L172-V185 HydrophobicContact CD1-CG2 4.44Å |
| 173 | R | 71.9 | Confident | 74.8 | Confident | 180 Ų | 180 | 94.8 Ų | 94.8 | 68% | 0.679 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -70.6 | -33.9 | 176.1 | -73.6 | -173.5 | -68.6 | -94.7 | 3.3 | 112.7 | A169 K170 V171 | A169-R173 WeakPolarHBondContact O-CG 3.3Å; A169-R173 PolarHBondContact O-N 3.41Å; K170-R173 PolarHBondContact O-N 3.01Å; V171-R173 VanDerWaalsContact C-N 3.33Å |
| 174 | E | 70.3 | Confident | 74.5 | Confident | 126 Ų | 126 | 95 Ų | 95 | 59% | 0.589 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -83.8 | -29.9 | -175.7 | -70.5 | 169.6 | -179.2 | 0 | 0 | 113.8 | K170 V171 | K170-E174 WeakPolarHBondContact CE-OE1 3.36Å; K170-E174 WeakPolarHBondContact CG-OE1 3.37Å; K170-E174 WeakPolarHBondContact O-CG 3.29Å; K170-E174 PolarHBondContact O-N 3.47Å; K170-E174 VanDerWaalsContact O-N 3.15Å; V171-E174 PolarHBondContact O-N 3.24Å |
| 175 | K | 63.9 | Low | 74.4 | Confident | 158 Ų | 158 | 93.9 Ų | 93.9 | 69% | 0.687 | 46% | 0.459 | S | S | * | . | S | Bend | trans | -120.8 | 102 | -178.1 | -66.6 | -177.1 | -179.2 | -177.8 | 0 | 110.9 | V171 G177 | V171-K175 PolarHBondContact O-N 2.95Å; V171-K175 VanDerWaalsContact O-N 3.11Å; K175-G177 VanDerWaalsContact C-N 3.26Å; K175-G177 PolarHBondContact O-N 3.42Å |
| 176 | R | 58.5 | Low | 74.3 | Confident | 262 Ų | 262 | 94.9 Ų | 94.9 | 99% | 0.989 | 46% | 0.464 | S | S | * | . | trans | -77.5 | 65.5 | -176.7 | -155.8 | 175.7 | -169.6 | -177.4 | 2.5 | 112.1 | ||||
| 177 | G | 59.1 | Low | 74.4 | Confident | 38 Ų | 38 | 94.7 Ų | 94.7 | 39% | 0.392 | 46% | 0.463 | S | S | . | . | trans | -131.2 | 109.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | K175 M179 M180 G181 | K175-G177 VanDerWaalsContact C-N 3.26Å; K175-G177 PolarHBondContact O-N 3.42Å; G177-M179 VanDerWaalsContact C-N 3.34Å; G177-M179 PolarHBondContact O-N 2.92Å; G177-M180 PolarHBondContact O-N 3.33Å; G177-G181 PolarHBondContact O-N 3.44Å | ||
| 178 | V | 58.2 | Low | 74.7 | Confident | 141 Ų | 141 | 93.4 Ų | 93.4 | 86% | 0.855 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -61.8 | -37.5 | -170 | 179.4 | 0 | 0 | 0 | 0 | 112.9 | G181 | V178-G181 PolarHBondContact O-N 3.5Å |
| 179 | M | 57.9 | Low | 75 | Confident | 176 Ų | 176 | 98.1 Ų | 98.1 | 87% | 0.867 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -72.8 | -40.2 | -176.7 | -153.1 | -176.6 | -145.2 | 0 | 0 | 112.8 | G177 G181 | G177-M179 VanDerWaalsContact C-N 3.34Å; G177-M179 PolarHBondContact O-N 2.92Å; M179-G181 PolarHBondContact O-N 3.29Å |
| 180 | M | 63.1 | Low | 75.4 | Confident | 136 Ų | 136 | 101 Ų | 101 | 67% | 0.67 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -67 | -24.6 | 176.3 | -71.1 | -69.5 | -67.7 | 0 | 0 | 112.5 | G177 K184 | G177-M180 PolarHBondContact O-N 3.33Å; M180-K184 PolarHBondContact O-N 2.99Å |
| 181 | G | 72.1 | Confident | 75.9 | Confident | 8 Ų | 8 | 99.8 Ų | 99.8 | 8% | 0.082 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -72.7 | -46.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | G177 V178 M179 K184 V185 | G177-G181 PolarHBondContact O-N 3.44Å; V178-G181 PolarHBondContact O-N 3.5Å; M179-G181 PolarHBondContact O-N 3.29Å; G181-K184 PolarHBondContact O-N 2.84Å; G181-V185 WeakPolarHBondContact O-CG2 3.47Å; G181-V185 PolarHBondContact O-N 3.37Å |
| 182 | A | 78 | Confident | 76.5 | Confident | 57 Ų | 57 | 102.5 Ų | 102.5 | 47% | 0.471 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.6 | -43.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | K184 V185 I186 | A182-K184 VanDerWaalsContact C-N 3.29Å; A182-K184 PolarHBondContact O-N 2.92Å; A182-V185 PolarHBondContact O-N 2.84Å; A182-I186 WeakPolarHBondContact O-CG1 3.24Å; A182-I186 PolarHBondContact O-N 3.38Å |
| 183 | E | 83.4 | Confident | 77.2 | Confident | 99 Ų | 99 | 104.6 Ų | 104.6 | 46% | 0.463 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.3 | -39 | 177.8 | -164.6 | -166.4 | 150.1 | 0 | 0 | 112.1 | I186 R187 | E183-I186 PolarHBondContact O-N 3.42Å; E183-R187 WeakPolarHBondContact O-CB 3.36Å; E183-R187 PolarHBondContact O-N 3.47Å; E183-R187 IonicContact OE1-CZ 3.55Å; E183-R187 IonicContact OE1-NH2 3.51Å; E183-R187 PolarHBondContact OE1-NH2 2.9Å |
| 184 | K | 82.6 | Confident | 78.3 | Confident | 62 Ų | 62 | 102.2 Ų | 102.2 | 27% | 0.27 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.9 | -36.2 | -180 | -156.4 | 176.5 | -166.6 | -165 | 0 | 112.8 | D167 V171 M180 G181 A182 Y188 | D167-K184 WeakPolarHBondContact O-CE 3.38Å; D167-K184 PolarHBondContact O-NZ 3.28Å; V171-K184 HydrophobicContact CB-CD 4.42Å; V171-K184 VanDerWaalsContact CB-NZ 3.33Å; V171-K184 HydrophobicContact CG1-CD 4.22Å; V171-K184 VanDerWaalsContact CG1-NZ 3.35Å; M180-K184 PolarHBondContact O-N 2.99Å; G181-K184 PolarHBondContact O-N 2.84Å; A182-K184 VanDerWaalsContact C-N 3.29Å; A182-K184 PolarHBondContact O-N 2.92Å; K184-Y188 PolarHBondContact O-N 3.29Å |
| 185 | V | 85.1 | Confident | 79.3 | Confident | 43 Ų | 43 | 99.1 Ų | 99.1 | 26% | 0.261 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.2 | -46.4 | 173.6 | 175.1 | 0 | 0 | 0 | 0 | 110.2 | V168 L172 G181 A182 R187 Y188 F189 | V168-V185 HydrophobicContact CG1-CG2 3.57Å; L172-V185 HydrophobicContact CD1-CG2 4.44Å; G181-V185 WeakPolarHBondContact O-CG2 3.47Å; G181-V185 PolarHBondContact O-N 3.37Å; A182-V185 PolarHBondContact O-N 2.84Å; V185-R187 PolarHBondContact O-N 2.88Å; V185-Y188 PolarHBondContact O-N 3.43Å; V185-F189 HydrophobicContact CG1-CD2 3.8Å; V185-F189 HydrophobicContact CG1-CE2 3.61Å; V185-F189 VanDerWaalsContact O-CD2 3.23Å; V185-F189 WeakPolarHBondContact O-CD2 3.29Å; V185-F189 PolarHBondContact O-N 3.21Å; V185-F189 VanDerWaalsContact O-N 3.11Å |
| 186 | I | 87.6 | Confident | 80.5 | Confident | 96 Ų | 96 | 95.7 Ų | 95.7 | 49% | 0.492 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.5 | -49.1 | 178.1 | -67.4 | 166.5 | 0 | 0 | 0 | 110.3 | A182 E183 Y188 F189 E190 | A182-I186 WeakPolarHBondContact O-CG1 3.24Å; A182-I186 PolarHBondContact O-N 3.38Å; E183-I186 PolarHBondContact O-N 3.42Å; I186-Y188 VanDerWaalsContact C-N 3.32Å; I186-Y188 PolarHBondContact O-N 2.94Å; I186-F189 PolarHBondContact O-N 2.9Å; I186-F189 VanDerWaalsContact O-N 3.1Å; I186-E190 HydrophobicContact CG2-CG 4.35Å; I186-E190 WeakPolarHBondContact O-CG 3.24Å; I186-E190 PolarHBondContact O-N 3.41Å |
| 187 | R | 88.4 | Confident | 82.3 | Confident | 111 Ų | 111 | 88.4 Ų | 88.4 | 42% | 0.419 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59 | -41.7 | 179.1 | -161.8 | -176.1 | -53.7 | 139.4 | 3.3 | 112.5 | E183 V185 F189 E190 D191 | E183-R187 WeakPolarHBondContact O-CB 3.36Å; E183-R187 PolarHBondContact O-N 3.47Å; E183-R187 IonicContact OE1-CZ 3.55Å; E183-R187 IonicContact OE1-NH2 3.51Å; E183-R187 PolarHBondContact OE1-NH2 2.9Å; V185-R187 PolarHBondContact O-N 2.88Å; R187-F189 PolarHBondContact O-N 3.28Å; R187-E190 PolarHBondContact O-N 3.15Å; R187-D191 WeakPolarHBondContact O-CB 3.4Å; R187-D191 PolarHBondContact O-N 2.94Å |
| 188 | Y | 88.9 | Confident | 84 | Confident | 30 Ų | 30 | 91 Ų | 91 | 12% | 0.118 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -59 | -45.6 | 174.8 | 170.7 | -90.5 | 0 | 0 | 0 | 112 | A160 F164 V168 K184 V185 I186 R192 | A160-Y188 PolarHBondContact O-OH 2.96Å; F164-Y188 HydrophobicContact CB-CE1 4.41Å; F164-Y188 HydrophobicContact CB-CE2 4.28Å; F164-Y188 AromaticContact CD2-CD1 3.71Å; F164-Y188 HydrophobicContact CD2-CD1 3.71Å; F164-Y188 HydrophobicContact CD2-CD2 4.49Å; F164-Y188 AromaticContact CD2-CE1 3.53Å; F164-Y188 HydrophobicContact CD2-CE1 3.53Å; F164-Y188 HydrophobicContact CD2-CE2 4.32Å; F164-Y188 HydrophobicContact CD2-CG 4.21Å; F164-Y188 AromaticContact CD2-CZ 3.86Å; F164-Y188 HydrophobicContact CE2-CD1 4.15Å; F164-Y188 HydrophobicContact CE2-CE1 4.3Å; F164-Y188 HydrophobicContact CG-CE1 4.41Å; V168-Y188 HydrophobicContact CG2-CD2 4.07Å; V168-Y188 HydrophobicContact CG2-CG 3.89Å; K184-Y188 PolarHBondContact O-N 3.29Å; V185-Y188 PolarHBondContact O-N 3.43Å; I186-Y188 VanDerWaalsContact C-N 3.32Å; I186-Y188 PolarHBondContact O-N 2.94Å; Y188-R192 VanDerWaalsContact O-CB 3.27Å; Y188-R192 WeakPolarHBondContact O-CB 3.39Å; Y188-R192 PolarHBondContact O-N 3.38Å |
| 189 | F | 88.9 | Confident | 85.6 | Confident | 101 Ų | 101 | 87.2 Ų | 87.2 | 44% | 0.443 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.2 | -41 | 178 | -78.7 | -67.7 | 0 | 0 | 0 | 112.2 | V185 I186 R187 R192 M193 | V185-F189 HydrophobicContact CG1-CD2 3.8Å; V185-F189 HydrophobicContact CG1-CE2 3.61Å; V185-F189 VanDerWaalsContact O-CD2 3.23Å; V185-F189 WeakPolarHBondContact O-CD2 3.29Å; V185-F189 PolarHBondContact O-N 3.21Å; V185-F189 VanDerWaalsContact O-N 3.11Å; I186-F189 PolarHBondContact O-N 2.9Å; I186-F189 VanDerWaalsContact O-N 3.1Å; R187-F189 PolarHBondContact O-N 3.28Å; F189-R192 PolarHBondContact O-N 2.9Å; F189-M193 WeakPolarHBondContact O-CB 3.3Å; F189-M193 VanDerWaalsContact O-CG 3.32Å; F189-M193 WeakPolarHBondContact O-CG 3.34Å; F189-M193 PolarHBondContact O-N 3.44Å |
| 190 | E | 92.3 | Very high | 87.3 | Confident | 76 Ų | 76 | 83.3 Ų | 83.3 | 36% | 0.355 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -60 | -48.5 | 175 | -73.1 | -178.1 | -172.1 | 0 | 0 | 112.3 | I186 R187 R192 M193 R194 | I186-E190 HydrophobicContact CG2-CG 4.35Å; I186-E190 WeakPolarHBondContact O-CG 3.24Å; I186-E190 PolarHBondContact O-N 3.41Å; R187-E190 PolarHBondContact O-N 3.15Å; E190-R192 VanDerWaalsContact C-N 3.31Å; E190-R192 PolarHBondContact O-N 3.3Å; E190-M193 PolarHBondContact O-N 3.03Å; E190-R194 WeakPolarHBondContact O-CG 3.48Å; E190-R194 PolarHBondContact O-N 2.88Å; E190-R194 IonicContact OE2-CZ 3.36Å; E190-R194 IonicContact OE2-NH1 3.66Å; E190-R194 IonicContact OE2-NH2 2.83Å; E190-R194 PolarHBondContact OE2-NH2 2.87Å |
| 191 | D | 90.9 | Very high | 88.9 | Confident | 81 Ų | 81 | 81 Ų | 81 | 43% | 0.433 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64.1 | -38.3 | 179.1 | -71.3 | -23.6 | 0 | 0 | 0 | 111.4 | R187 R194 A195 | R187-D191 WeakPolarHBondContact O-CB 3.4Å; R187-D191 PolarHBondContact O-N 2.94Å; D191-R194 PolarHBondContact O-N 3.22Å; D191-R194 IonicContact OD1-CZ 3.83Å; D191-R194 IonicContact OD1-NH1 2.72Å; D191-R194 PolarHBondContact OD1-NH1 2.97Å; D191-A195 WeakPolarHBondContact O-CB 3.42Å; D191-A195 PolarHBondContact O-N 3.42Å |
| 192 | R | 89.1 | Confident | 90 | Very high | 96 Ų | 96 | 86.3 Ų | 86.3 | 36% | 0.362 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -66.5 | -39.9 | 175.4 | -169.2 | 176.6 | -177.1 | -173 | -2.8 | 112.2 | Y188 F189 E190 A195 K196 | Y188-R192 VanDerWaalsContact O-CB 3.27Å; Y188-R192 WeakPolarHBondContact O-CB 3.39Å; Y188-R192 PolarHBondContact O-N 3.38Å; F189-R192 PolarHBondContact O-N 2.9Å; E190-R192 VanDerWaalsContact C-N 3.31Å; E190-R192 PolarHBondContact O-N 3.3Å; R192-A195 PolarHBondContact O-N 3.05Å; R192-K196 WeakPolarHBondContact O-CG 3.32Å; R192-K196 PolarHBondContact O-N 2.94Å |
| 193 | M | 91.6 | Very high | 90.8 | Very high | 119 Ų | 119 | 88.2 Ų | 88.2 | 59% | 0.586 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -63.2 | -48.9 | 174.1 | -73.8 | -163.3 | -55.1 | 0 | 0 | 110.8 | F189 E190 A195 K196 D197 | F189-M193 WeakPolarHBondContact O-CB 3.3Å; F189-M193 VanDerWaalsContact O-CG 3.32Å; F189-M193 WeakPolarHBondContact O-CG 3.34Å; F189-M193 PolarHBondContact O-N 3.44Å; E190-M193 PolarHBondContact O-N 3.03Å; M193-A195 VanDerWaalsContact C-N 3.28Å; M193-A195 PolarHBondContact O-N 3.23Å; M193-K196 PolarHBondContact O-N 2.92Å; M193-D197 PolarHBondContact O-N 2.96Å |
| 194 | R | 94.6 | Very high | 91.4 | Very high | 130 Ų | 130 | 91.8 Ų | 91.8 | 49% | 0.491 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -56.4 | -41.1 | 176 | -69.3 | 174 | -167.7 | 132.3 | 9 | 112.5 | E190 D191 D197 T198 | E190-R194 WeakPolarHBondContact O-CG 3.48Å; E190-R194 PolarHBondContact O-N 2.88Å; E190-R194 IonicContact OE2-CZ 3.36Å; E190-R194 IonicContact OE2-NH1 3.66Å; E190-R194 IonicContact OE2-NH2 2.83Å; E190-R194 PolarHBondContact OE2-NH2 2.87Å; D191-R194 PolarHBondContact O-N 3.22Å; D191-R194 IonicContact OD1-CZ 3.83Å; D191-R194 IonicContact OD1-NH1 2.72Å; D191-R194 PolarHBondContact OD1-NH1 2.97Å; R194-D197 PolarHBondContact O-N 3.29Å; R194-T198 PolarHBondContact O-N 3.48Å; R194-T198 PolarHBondContact O-OG1 2.86Å |
| 195 | A | 90.6 | Very high | 92.1 | Very high | 62 Ų | 62 | 94.1 Ų | 94.1 | 51% | 0.512 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.5 | -40.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | D191 R192 M193 T198 L199 | D191-A195 WeakPolarHBondContact O-CB 3.42Å; D191-A195 PolarHBondContact O-N 3.42Å; R192-A195 PolarHBondContact O-N 3.05Å; M193-A195 VanDerWaalsContact C-N 3.28Å; M193-A195 PolarHBondContact O-N 3.23Å; A195-T198 PolarHBondContact O-N 3.48Å; A195-L199 PolarHBondContact O-N 3.25Å |
| 196 | K | 90.6 | Very high | 92.6 | Very high | 86 Ų | 86 | 98 Ų | 98 | 37% | 0.374 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.1 | -42.8 | 174.4 | -76.7 | -74.4 | -178.5 | 179.6 | 0 | 111.4 | E156 R192 M193 T198 L199 V200 | E156-K196 IonicContact OE2-NZ 2.83Å; E156-K196 PolarHBondContact OE2-NZ 3.45Å; R192-K196 WeakPolarHBondContact O-CG 3.32Å; R192-K196 PolarHBondContact O-N 2.94Å; M193-K196 PolarHBondContact O-N 2.92Å; K196-T198 VanDerWaalsContact C-N 3.33Å; K196-T198 PolarHBondContact O-N 3.2Å; K196-L199 WeakPolarHBondContact O-CB 3.48Å; K196-L199 PolarHBondContact O-N 3.42Å; K196-L199 VanDerWaalsContact O-N 3.11Å; K196-V200 WeakPolarHBondContact O-CG2 3.33Å; K196-V200 PolarHBondContact O-N 3.07Å |
| 197 | D | 94.5 | Very high | 93 | Very high | 108 Ų | 108 | 97.8 Ų | 97.8 | 58% | 0.578 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -59.7 | -43.5 | 175.8 | -66.9 | -26.5 | 0 | 0 | 0 | 111.7 | M193 R194 L199 V200 E201 | M193-D197 PolarHBondContact O-N 2.96Å; R194-D197 PolarHBondContact O-N 3.29Å; D197-L199 VanDerWaalsContact C-N 3.31Å; D197-L199 PolarHBondContact O-N 3.24Å; D197-V200 PolarHBondContact O-N 3.49Å; D197-E201 PolarHBondContact O-N 3.49Å |
| 198 | T | 95 | Very high | 93.4 | Very high | 92 Ų | 92 | 95 Ų | 95 | 56% | 0.564 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -62.5 | -38.2 | 175.7 | -54.5 | 0 | 0 | 0 | 0 | 111.9 | R194 A195 K196 K202 | R194-T198 PolarHBondContact O-N 3.48Å; R194-T198 PolarHBondContact O-OG1 2.86Å; A195-T198 PolarHBondContact O-N 3.48Å; K196-T198 VanDerWaalsContact C-N 3.33Å; K196-T198 PolarHBondContact O-N 3.2Å; T198-K202 WeakPolarHBondContact O-CB 3.45Å; T198-K202 PolarHBondContact O-N 2.89Å; T198-K202 VanDerWaalsContact O-N 3.1Å |
| 199 | L | 92.1 | Very high | 93.7 | Very high | 63 Ų | 63 | 96.4 Ų | 96.4 | 33% | 0.33 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -68.2 | -42.1 | 176.4 | 179.4 | 61.7 | 0 | 0 | 0 | 111.5 | A195 K196 D197 E201 K202 L203 | A195-L199 PolarHBondContact O-N 3.25Å; K196-L199 WeakPolarHBondContact O-CB 3.48Å; K196-L199 PolarHBondContact O-N 3.42Å; K196-L199 VanDerWaalsContact O-N 3.11Å; D197-L199 VanDerWaalsContact C-N 3.31Å; D197-L199 PolarHBondContact O-N 3.24Å; L199-E201 VanDerWaalsContact C-N 3.34Å; L199-E201 PolarHBondContact O-N 3Å; L199-K202 PolarHBondContact O-N 2.89Å; L199-L203 HydrophobicContact CD1-CD1 4.31Å; L199-L203 HydrophobicContact CD1-CG 4.19Å; L199-L203 HydrophobicContact CG-CD1 4.09Å; L199-L203 HydrophobicContact CG-CG 4.39Å; L199-L203 WeakPolarHBondContact O-CB 3.36Å; L199-L203 WeakPolarHBondContact O-CG 3.4Å; L199-L203 PolarHBondContact O-N 3.23Å |
| 200 | V | 95.1 | Very high | 94.1 | Very high | 93 Ų | 93 | 96.8 Ų | 96.8 | 56% | 0.564 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -57.4 | -48.5 | 176.2 | 169.1 | 0 | 0 | 0 | 0 | 110.3 | K196 D197 K202 L203 R204 | K196-V200 WeakPolarHBondContact O-CG2 3.33Å; K196-V200 PolarHBondContact O-N 3.07Å; D197-V200 PolarHBondContact O-N 3.49Å; V200-K202 VanDerWaalsContact C-N 3.35Å; V200-K202 PolarHBondContact O-N 3.05Å; V200-L203 PolarHBondContact O-N 3.38Å; V200-R204 WeakPolarHBondContact O-CB 3.46Å; V200-R204 PolarHBondContact O-N 2.7Å |
| 201 | E | 95.6 | Very high | 94.3 | Very high | 89 Ų | 89 | 97.8 Ų | 97.8 | 42% | 0.416 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.7 | -39.9 | 179.6 | -166.4 | 56.8 | -151.3 | 0 | 0 | 111.7 | D197 L199 L203 R204 L205 | D197-E201 PolarHBondContact O-N 3.49Å; L199-E201 VanDerWaalsContact C-N 3.34Å; L199-E201 PolarHBondContact O-N 3Å; E201-L203 PolarHBondContact O-N 2.83Å; E201-R204 WeakPolarHBondContact O-CB 3.4Å; E201-R204 PolarHBondContact O-N 3.07Å; E201-L205 WeakPolarHBondContact O-CG 3.45Å; E201-L205 PolarHBondContact O-N 3.38Å |
| 202 | K | 95.9 | Very high | 94.6 | Very high | 119 Ų | 119 | 98.4 Ų | 98.4 | 52% | 0.517 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.9 | -43.8 | 173.9 | -177.3 | 178.6 | -70 | 177.8 | 0 | 112.1 | T198 L199 V200 K206 | T198-K202 WeakPolarHBondContact O-CB 3.45Å; T198-K202 PolarHBondContact O-N 2.89Å; T198-K202 VanDerWaalsContact O-N 3.1Å; L199-K202 PolarHBondContact O-N 2.89Å; V200-K202 VanDerWaalsContact C-N 3.35Å; V200-K202 PolarHBondContact O-N 3.05Å; K202-K206 WeakPolarHBondContact O-CG 3.3Å; K202-K206 PolarHBondContact O-N 2.93Å; K202-K206 VanDerWaalsContact O-N 3.09Å |
| 203 | L | 93.5 | Very high | 94.9 | Very high | 97 Ų | 97 | 99.1 Ų | 99.1 | 51% | 0.508 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -67.1 | -38.9 | 178 | -71.8 | 175.1 | 0 | 0 | 0 | 111.3 | L199 V200 E201 K206 N207 | L199-L203 HydrophobicContact CD1-CD1 4.31Å; L199-L203 HydrophobicContact CD1-CG 4.19Å; L199-L203 HydrophobicContact CG-CD1 4.09Å; L199-L203 HydrophobicContact CG-CG 4.39Å; L199-L203 WeakPolarHBondContact O-CB 3.36Å; L199-L203 WeakPolarHBondContact O-CG 3.4Å; L199-L203 PolarHBondContact O-N 3.23Å; V200-L203 PolarHBondContact O-N 3.38Å; E201-L203 PolarHBondContact O-N 2.83Å; L203-K206 PolarHBondContact O-N 2.99Å; L203-N207 VanDerWaalsContact O-CB 3.27Å; L203-N207 WeakPolarHBondContact O-CB 3.4Å; L203-N207 PolarHBondContact O-N 3.08Å |
| 204 | R | 97 | Very high | 95.2 | Very high | 173 Ų | 173 | 99.2 Ų | 99.2 | 65% | 0.653 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58.9 | -48.2 | 175.2 | -173.9 | -176.2 | -179.7 | 173 | 1.5 | 112 | V200 E201 N207 A208 | V200-R204 WeakPolarHBondContact O-CB 3.46Å; V200-R204 PolarHBondContact O-N 2.7Å; E201-R204 WeakPolarHBondContact O-CB 3.4Å; E201-R204 PolarHBondContact O-N 3.07Å; R204-N207 PolarHBondContact O-N 3.43Å; R204-A208 PolarHBondContact O-N 3.22Å |
| 205 | L | 96.5 | Very high | 95.2 | Very high | 112 Ų | 112 | 101.5 Ų | 101.5 | 59% | 0.586 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.6 | -42.3 | 177.3 | -67.5 | 175.5 | 0 | 0 | 0 | 112.1 | E201 A208 A209 | E201-L205 WeakPolarHBondContact O-CG 3.45Å; E201-L205 PolarHBondContact O-N 3.38Å; L205-A208 PolarHBondContact O-N 3.41Å; L205-A209 PolarHBondContact O-N 3.01Å |
| 206 | K | 96.3 | Very high | 95.5 | Very high | 124 Ų | 124 | 104.9 Ų | 104.9 | 54% | 0.539 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 174.9 | -76.3 | -178.6 | 177.1 | -172.6 | 0 | 112.1 | K202 L203 A209 L210 | K202-K206 WeakPolarHBondContact O-CG 3.3Å; K202-K206 PolarHBondContact O-N 2.93Å; K202-K206 VanDerWaalsContact O-N 3.09Å; L203-K206 PolarHBondContact O-N 2.99Å; K206-A209 PolarHBondContact O-N 2.81Å; K206-L210 WeakPolarHBondContact O-CG 3.39Å; K206-L210 PolarHBondContact O-N 2.87Å |
| 207 | N | 95.3 | Very high | 95.7 | Very high | 92 Ų | 92 | 105.4 Ų | 105.4 | 49% | 0.492 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.3 | -44.5 | 178.5 | -173.1 | -69.7 | 0 | 0 | 0 | 111 | L203 R204 A209 L210 H211 | L203-N207 VanDerWaalsContact O-CB 3.27Å; L203-N207 WeakPolarHBondContact O-CB 3.4Å; L203-N207 PolarHBondContact O-N 3.08Å; R204-N207 PolarHBondContact O-N 3.43Å; N207-A209 PolarHBondContact O-N 3.24Å; N207-L210 PolarHBondContact O-N 2.99Å; N207-H211 PolarHBondContact O-CD2 2.91Å; N207-H211 VanDerWaalsContact O-CD2 3.28Å; N207-H211 PolarHBondContact O-N 3.32Å; N207-H211 PolarHBondContact OD1-CD2 2.96Å; N207-H211 PolarHBondContact OD1-NE2 3.46Å; N207-H211 VanDerWaalsContact OD1-NE2 3.17Å |
| 208 | A | 96.6 | Very high | 95.7 | Very high | 53 Ų | 53 | 104.5 Ų | 104.5 | 44% | 0.438 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.1 | -43.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | R204 L205 H211 V212 | R204-A208 PolarHBondContact O-N 3.22Å; L205-A208 PolarHBondContact O-N 3.41Å; A208-H211 WeakPolarHBondContact O-CB 3.42Å; A208-H211 PolarHBondContact O-N 3.31Å; A208-V212 PolarHBondContact O-N 3.47Å; A208-V212 VanDerWaalsContact O-N 3.13Å |
| 209 | A | 96.3 | Very high | 95.6 | Very high | 59 Ų | 59 | 104.7 Ų | 104.7 | 49% | 0.488 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63 | -43.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L205 K206 N207 H211 V212 Q213 | L205-A209 PolarHBondContact O-N 3.01Å; K206-A209 PolarHBondContact O-N 2.81Å; N207-A209 PolarHBondContact O-N 3.24Å; A209-H211 VanDerWaalsContact C-N 3.33Å; A209-H211 PolarHBondContact O-N 3.5Å; A209-V212 PolarHBondContact O-N 3.09Å; A209-Q213 PolarHBondContact O-N 3.32Å |
| 210 | L | 96.7 | Very high | 95.4 | Very high | 109 Ų | 109 | 106 Ų | 106 | 57% | 0.571 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.4 | -37.5 | 175.8 | -73 | 173.1 | 0 | 0 | 0 | 112 | K206 N207 V212 Q213 K214 | K206-L210 WeakPolarHBondContact O-CG 3.39Å; K206-L210 PolarHBondContact O-N 2.87Å; N207-L210 PolarHBondContact O-N 2.99Å; L210-V212 PolarHBondContact O-N 2.84Å; L210-Q213 PolarHBondContact O-N 2.76Å; L210-K214 WeakPolarHBondContact O-CB 3.5Å; L210-K214 PolarHBondContact O-N 3.09Å |
| 211 | H | 96.8 | Very high | 95 | Very high | 96 Ų | 96 | 106.4 Ų | 106.4 | 44% | 0.444 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.2 | -42.5 | 173.4 | -85 | -58.6 | 0 | 0 | 0 | 112.6 | N207 A208 A209 K214 R215 | N207-H211 PolarHBondContact O-CD2 2.91Å; N207-H211 VanDerWaalsContact O-CD2 3.28Å; N207-H211 PolarHBondContact O-N 3.32Å; N207-H211 PolarHBondContact OD1-CD2 2.96Å; N207-H211 PolarHBondContact OD1-NE2 3.46Å; N207-H211 VanDerWaalsContact OD1-NE2 3.17Å; A208-H211 WeakPolarHBondContact O-CB 3.42Å; A208-H211 PolarHBondContact O-N 3.31Å; A209-H211 VanDerWaalsContact C-N 3.33Å; A209-H211 PolarHBondContact O-N 3.5Å; H211-K214 PolarHBondContact O-N 3.44Å; H211-R215 WeakPolarHBondContact O-CG 3.49Å; H211-R215 PolarHBondContact O-N 2.85Å |
| 212 | V | 97.1 | Very high | 94.5 | Very high | 95 Ų | 95 | 109.3 Ų | 109.3 | 58% | 0.576 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.4 | -43.9 | 175.6 | 174.3 | 0 | 0 | 0 | 0 | 110.9 | A208 A209 L210 R215 K216 | A208-V212 PolarHBondContact O-N 3.47Å; A208-V212 VanDerWaalsContact O-N 3.13Å; A209-V212 PolarHBondContact O-N 3.09Å; L210-V212 PolarHBondContact O-N 2.84Å; V212-R215 PolarHBondContact O-N 3.3Å; V212-K216 PolarHBondContact O-N 2.92Å |
| 213 | Q | 96.3 | Very high | 93.9 | Very high | 110 Ų | 110 | 108.7 Ų | 108.7 | 51% | 0.514 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 177.5 | -172.7 | 177.7 | -2.2 | 0 | 0 | 112 | A209 L210 R215 K216 L217 | A209-Q213 PolarHBondContact O-N 3.32Å; L210-Q213 PolarHBondContact O-N 2.76Å; Q213-R215 VanDerWaalsContact C-N 3.35Å; Q213-R215 PolarHBondContact O-N 2.92Å; Q213-K216 PolarHBondContact O-N 3.36Å; Q213-L217 HydrophobicContact CG-CD1 4.29Å; Q213-L217 WeakPolarHBondContact O-CG 3.32Å; Q213-L217 PolarHBondContact O-N 3.02Å |
| 214 | K | 96.3 | Very high | 93.3 | Very high | 122 Ų | 122 | 110.7 Ų | 110.7 | 53% | 0.53 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -56.5 | -48.6 | 173.9 | 179.4 | -179.9 | 177.1 | 176.9 | 0 | 110.9 | L210 H211 K216 L217 Q218 | L210-K214 WeakPolarHBondContact O-CB 3.5Å; L210-K214 PolarHBondContact O-N 3.09Å; H211-K214 PolarHBondContact O-N 3.44Å; K214-K216 VanDerWaalsContact C-N 3.34Å; K214-K216 PolarHBondContact O-N 3.06Å; K214-L217 PolarHBondContact O-N 3.48Å; K214-Q218 HydrophobicContact CG-CG 4.45Å; K214-Q218 WeakPolarHBondContact O-CB 3.22Å; K214-Q218 VanDerWaalsContact O-CG 3.29Å; K214-Q218 WeakPolarHBondContact O-CG 3.45Å; K214-Q218 PolarHBondContact O-N 3.36Å |
| 215 | R | 96.1 | Very high | 92.2 | Very high | 178 Ų | 178 | 107.8 Ų | 107.8 | 67% | 0.672 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.2 | -41.9 | 178 | -72.5 | 177.2 | -171.8 | 171.4 | 3.4 | 112 | H211 V212 Q213 Q218 L219 | H211-R215 WeakPolarHBondContact O-CG 3.49Å; H211-R215 PolarHBondContact O-N 2.85Å; V212-R215 PolarHBondContact O-N 3.3Å; Q213-R215 VanDerWaalsContact C-N 3.35Å; Q213-R215 PolarHBondContact O-N 2.92Å; R215-Q218 PolarHBondContact O-N 2.87Å; R215-L219 PolarHBondContact O-N 3.4Å |
| 216 | K | 96.1 | Very high | 91 | Very high | 133 Ų | 133 | 108.1 Ų | 108.1 | 58% | 0.578 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.6 | -46.8 | 176.3 | -176.5 | -179.5 | 178.4 | -178.9 | 0 | 111.8 | V212 Q213 K214 L219 Q220 | V212-K216 PolarHBondContact O-N 2.92Å; Q213-K216 PolarHBondContact O-N 3.36Å; K214-K216 VanDerWaalsContact C-N 3.34Å; K214-K216 PolarHBondContact O-N 3.06Å; K216-L219 PolarHBondContact O-N 3.28Å; K216-Q220 WeakPolarHBondContact O-CG 3.3Å; K216-Q220 PolarHBondContact O-N 3.21Å |
| 217 | L | 94.9 | Very high | 89.3 | Confident | 97 Ų | 97 | 108 Ų | 108 | 51% | 0.508 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.9 | -40.7 | 178 | -71.1 | 173.5 | 0 | 0 | 0 | 111.8 | Q213 K214 L219 Q220 L221 | Q213-L217 HydrophobicContact CG-CD1 4.29Å; Q213-L217 WeakPolarHBondContact O-CG 3.32Å; Q213-L217 PolarHBondContact O-N 3.02Å; K214-L217 PolarHBondContact O-N 3.48Å; L217-L219 VanDerWaalsContact C-N 3.32Å; L217-L219 PolarHBondContact O-N 3.49Å; L217-Q220 PolarHBondContact O-N 3.34Å; L217-L221 WeakPolarHBondContact O-CB 3.46Å; L217-L221 PolarHBondContact O-N 2.85Å |
| 218 | Q | 93.8 | Very high | 87.5 | Confident | 89 Ų | 89 | 105.8 Ų | 105.8 | 42% | 0.416 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.3 | -40.1 | 173.9 | -74.9 | 177.2 | -35.7 | 0 | 0 | 112 | K214 R215 L221 R222 | K214-Q218 HydrophobicContact CG-CG 4.45Å; K214-Q218 WeakPolarHBondContact O-CB 3.22Å; K214-Q218 VanDerWaalsContact O-CG 3.29Å; K214-Q218 WeakPolarHBondContact O-CG 3.45Å; K214-Q218 PolarHBondContact O-N 3.36Å; R215-Q218 PolarHBondContact O-N 2.87Å; Q218-L221 PolarHBondContact O-N 2.88Å; Q218-R222 WeakPolarHBondContact O-CG 3.36Å; Q218-R222 PolarHBondContact O-N 2.76Å |
| 219 | L | 92.6 | Very high | 85.5 | Confident | 95 Ų | 95 | 109 Ų | 109 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.4 | -41 | 175.5 | -175.5 | 65.5 | 0 | 0 | 0 | 111.8 | R215 K216 L217 L221 R222 Q223 | R215-L219 PolarHBondContact O-N 3.4Å; K216-L219 PolarHBondContact O-N 3.28Å; L217-L219 VanDerWaalsContact C-N 3.32Å; L217-L219 PolarHBondContact O-N 3.49Å; L219-L221 VanDerWaalsContact C-N 3.31Å; L219-L221 PolarHBondContact O-N 2.96Å; L219-R222 PolarHBondContact O-N 3.03Å; L219-Q223 WeakPolarHBondContact O-CB 3.48Å; L219-Q223 WeakPolarHBondContact O-CG 3.45Å; L219-Q223 PolarHBondContact O-N 2.9Å |
| 220 | Q | 89.6 | Confident | 83.6 | Confident | 90 Ų | 90 | 110 Ų | 110 | 42% | 0.421 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.1 | -38.6 | 174.8 | -74.2 | 179.8 | -22.2 | 0 | 0 | 111.9 | K216 L217 Q223 K224 | K216-Q220 WeakPolarHBondContact O-CG 3.3Å; K216-Q220 PolarHBondContact O-N 3.21Å; L217-Q220 PolarHBondContact O-N 3.34Å; Q220-Q223 PolarHBondContact O-N 3.06Å; Q220-K224 WeakPolarHBondContact O-CB 3.47Å; Q220-K224 VanDerWaalsContact O-CG 3.22Å; Q220-K224 WeakPolarHBondContact O-CG 3.42Å; Q220-K224 PolarHBondContact O-N 2.95Å |
| 221 | L | 86.3 | Confident | 81.8 | Confident | 102 Ų | 102 | 109 Ų | 109 | 53% | 0.534 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.8 | -49.8 | 174.5 | -175.9 | 66.5 | 0 | 0 | 0 | 110.4 | L217 Q218 L219 Q223 K224 E225 | L217-L221 WeakPolarHBondContact O-CB 3.46Å; L217-L221 PolarHBondContact O-N 2.85Å; Q218-L221 PolarHBondContact O-N 2.88Å; L219-L221 VanDerWaalsContact C-N 3.31Å; L219-L221 PolarHBondContact O-N 2.96Å; L221-Q223 PolarHBondContact O-N 3.34Å; L221-K224 CarbonylContact O-C 3.4Å; L221-K224 WeakPolarHBondContact O-CA 3.43Å; L221-K224 WeakPolarHBondContact O-CB 3.41Å; L221-K224 PolarHBondContact O-N 3.44Å; L221-E225 WeakPolarHBondContact O-CG 3.35Å; L221-E225 PolarHBondContact O-N 3.25Å |
| 222 | R | 85.2 | Confident | 80.7 | Confident | 151 Ų | 151 | 109.2 Ų | 109.2 | 57% | 0.57 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -58.3 | -44.6 | 175.9 | -72.8 | 178.7 | -176.3 | 175.1 | -1.6 | 113 | Q218 L219 K224 E225 E226 | Q218-R222 WeakPolarHBondContact O-CG 3.36Å; Q218-R222 PolarHBondContact O-N 2.76Å; L219-R222 PolarHBondContact O-N 3.03Å; R222-K224 VanDerWaalsContact C-N 3.26Å; R222-K224 PolarHBondContact O-N 2.88Å; R222-E225 CarbonylContact O-C 3.59Å; R222-E225 WeakPolarHBondContact O-CB 3.2Å; R222-E225 PolarHBondContact O-N 3.48Å; R222-E225 VanDerWaalsContact O-N 3.14Å; R222-E226 WeakPolarHBondContact O-CB 2.99Å; R222-E226 VanDerWaalsContact O-CG 3.27Å; R222-E226 WeakPolarHBondContact O-CG 3.29Å; R222-E226 PolarHBondContact O-N 3.47Å |
| 223 | Q | 83.3 | Confident | 79.5 | Confident | 106 Ų | 106 | 111.6 Ų | 111.6 | 50% | 0.495 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.6 | -33.8 | 175.4 | -74.1 | 175.1 | -6.1 | 0 | 0 | 112.4 | L219 Q220 L221 M227 | L219-Q223 WeakPolarHBondContact O-CB 3.48Å; L219-Q223 WeakPolarHBondContact O-CG 3.45Å; L219-Q223 PolarHBondContact O-N 2.9Å; Q220-Q223 PolarHBondContact O-N 3.06Å; L221-Q223 PolarHBondContact O-N 3.34Å; Q223-M227 WeakPolarHBondContact O-CB 3.48Å; Q223-M227 PolarHBondContact O-N 3.26Å |
| 224 | K | 80 | Confident | 78.7 | Confident | 139 Ų | 139 | 110.9 Ų | 110.9 | 60% | 0.604 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -73.6 | -34 | 174.6 | -72.4 | -68.2 | -173.9 | 179.6 | 0 | 112 | Q220 L221 R222 M227 G228 | Q220-K224 WeakPolarHBondContact O-CB 3.47Å; Q220-K224 VanDerWaalsContact O-CG 3.22Å; Q220-K224 WeakPolarHBondContact O-CG 3.42Å; Q220-K224 PolarHBondContact O-N 2.95Å; L221-K224 CarbonylContact O-C 3.4Å; L221-K224 WeakPolarHBondContact O-CA 3.43Å; L221-K224 WeakPolarHBondContact O-CB 3.41Å; L221-K224 PolarHBondContact O-N 3.44Å; R222-K224 VanDerWaalsContact C-N 3.26Å; R222-K224 PolarHBondContact O-N 2.88Å; K224-M227 HydrophobicContact CD-CE 3.81Å; K224-G228 PolarHBondContact O-N 3.26Å |
| 225 | E | 73.6 | Confident | 78.1 | Confident | 112 Ų | 112 | 107.6 Ų | 107.6 | 52% | 0.523 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.3 | -48.5 | 172.3 | -70.1 | 165.5 | 168.7 | 0 | 0 | 110.4 | L221 R222 M227 G228 E229 | L221-E225 WeakPolarHBondContact O-CG 3.35Å; L221-E225 PolarHBondContact O-N 3.25Å; R222-E225 CarbonylContact O-C 3.59Å; R222-E225 WeakPolarHBondContact O-CB 3.2Å; R222-E225 PolarHBondContact O-N 3.48Å; R222-E225 VanDerWaalsContact O-N 3.14Å; E225-M227 PolarHBondContact O-N 3.38Å; E225-G228 CarbonylContact O-C 3.6Å; E225-G228 VanDerWaalsContact O-CA 3.23Å; E225-G228 WeakPolarHBondContact O-CA 3.34Å; E225-G228 PolarHBondContact O-N 2.95Å; E225-E229 PolarHBondContact O-N 2.98Å |
| 226 | E | 71.8 | Confident | 77.6 | Confident | 118 Ų | 118 | 104 Ų | 104 | 55% | 0.551 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.5 | -34.4 | 174.9 | -68.8 | 165.7 | -170.8 | 0 | 0 | 112.3 | R222 G228 E229 | R222-E226 WeakPolarHBondContact O-CB 2.99Å; R222-E226 VanDerWaalsContact O-CG 3.27Å; R222-E226 WeakPolarHBondContact O-CG 3.29Å; R222-E226 PolarHBondContact O-N 3.47Å; E226-G228 VanDerWaalsContact C-N 3.28Å; E226-E229 WeakPolarHBondContact O-CB 3.46Å; E226-E229 PolarHBondContact O-N 3.15Å |
| 227 | M | 61.4 | Low | 77.3 | Confident | 123 Ų | 123 | 102.3 Ų | 102.3 | 61% | 0.606 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -74.3 | -22.6 | 171 | -166.1 | 175.9 | 74.4 | 0 | 0 | 111.9 | Q223 K224 E225 E229 A230 | Q223-M227 WeakPolarHBondContact O-CB 3.48Å; Q223-M227 PolarHBondContact O-N 3.26Å; K224-M227 HydrophobicContact CD-CE 3.81Å; E225-M227 PolarHBondContact O-N 3.38Å; M227-E229 VanDerWaalsContact C-N 3.35Å; M227-A230 WeakPolarHBondContact O-CB 3.42Å; M227-A230 PolarHBondContact O-N 2.83Å |
| 228 | G | 56.1 | Low | 77.2 | Confident | 44 Ų | 44 | 102.2 Ų | 102.2 | 45% | 0.454 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -73.6 | -23.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 113 | K224 E225 E226 A230 L231 | K224-G228 PolarHBondContact O-N 3.26Å; E225-G228 CarbonylContact O-C 3.6Å; E225-G228 VanDerWaalsContact O-CA 3.23Å; E225-G228 WeakPolarHBondContact O-CA 3.34Å; E225-G228 PolarHBondContact O-N 2.95Å; E226-G228 VanDerWaalsContact C-N 3.28Å; G228-A230 PolarHBondContact O-N 3.37Å; G228-L231 PolarHBondContact O-N 2.84Å |
| 229 | E | 54.9 | Low | 77.2 | Confident | 122 Ų | 122 | 102.7 Ų | 102.7 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.5 | -3.4 | 168.1 | -67.7 | -179.6 | 147 | 0 | 0 | 113 | E225 E226 M227 L231 H232 | E225-E229 PolarHBondContact O-N 2.98Å; E226-E229 WeakPolarHBondContact O-CB 3.46Å; E226-E229 PolarHBondContact O-N 3.15Å; M227-E229 VanDerWaalsContact C-N 3.35Å; E229-L231 PolarHBondContact O-N 2.89Å; E229-H232 PolarHBondContact O-CE1 3.48Å; E229-H232 PolarHBondContact O-ND1 2.96Å |
| 230 | A | 55.8 | Low | 77.4 | Confident | 79 Ų | 79 | 105.5 Ų | 105.5 | 65% | 0.653 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.7 | -10.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | M227 G228 | M227-A230 WeakPolarHBondContact O-CB 3.42Å; M227-A230 PolarHBondContact O-N 2.83Å; G228-A230 PolarHBondContact O-N 3.37Å |
| 231 | L | 60.7 | Low | 77.7 | Confident | 89 Ų | 89 | 105.8 Ų | 105.8 | 47% | 0.466 | 53% | 0.527 | S | S | . | . | S | Bend | trans | -132.9 | 79.2 | 175.9 | -159.6 | 67.4 | 0 | 0 | 0 | 107.8 | G228 E229 D235 F236 | G228-L231 PolarHBondContact O-N 2.84Å; E229-L231 PolarHBondContact O-N 2.89Å; L231-D235 HydrophobicContact CD1-CB 4.42Å; L231-F236 HydrophobicContact CB-CE2 4.18Å; L231-F236 HydrophobicContact CD2-CD2 4.29Å; L231-F236 HydrophobicContact CD2-CE1 3.81Å; L231-F236 HydrophobicContact CD2-CE2 3.32Å; L231-F236 HydrophobicContact CD2-CZ 3.04Å; L231-F236 HydrophobicContact CG-CD2 3.95Å; L231-F236 HydrophobicContact CG-CE1 4.35Å; L231-F236 HydrophobicContact CG-CE2 3.37Å; L231-F236 HydrophobicContact CG-CZ 3.64Å |
| 232 | H | 71.9 | Confident | 78.2 | Confident | 100 Ų | 100 | 104.1 Ų | 104.1 | 46% | 0.463 | 52% | 0.516 | S | S | . | . | trans | -62.4 | 149.8 | -179.5 | -68.5 | 84.9 | 0 | 0 | 0 | 109.1 | E229 V234 D235 F236 | E229-H232 PolarHBondContact O-CE1 3.48Å; E229-H232 PolarHBondContact O-ND1 2.96Å; H232-V234 HydrophobicContact CB-CB 4.13Å; H232-V234 PolarHBondContact O-N 3.37Å; H232-D235 IonicContact CG-OD2 3.76Å; H232-D235 PolarHBondContact N-OD2 3.05Å; H232-D235 IonicContact ND1-OD2 2.71Å; H232-D235 WeakPolarHBondContact O-CB 3.49Å; H232-D235 PolarHBondContact O-N 3.25Å; H232-F236 PolarHBondContact O-N 2.95Å | ||
| 233 | E | 73.4 | Confident | 78.8 | Confident | 145 Ų | 145 | 101.5 Ų | 101.5 | 68% | 0.678 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -52.4 | -30.9 | 167.7 | -171.2 | 174.7 | 176.5 | 0 | 0 | 111.3 | F236 Q237 | E233-F236 PolarHBondContact O-N 3.16Å; E233-Q237 WeakPolarHBondContact O-CB 3.26Å; E233-Q237 VanDerWaalsContact O-CG 3.25Å; E233-Q237 WeakPolarHBondContact O-CG 3.31Å; E233-Q237 PolarHBondContact O-N 2.88Å; E233-Q237 PolarHBondContact OE1-NE2 3.39Å |
| 234 | V | 78.8 | Confident | 79.5 | Confident | 95 Ų | 95 | 99.2 Ų | 99.2 | 58% | 0.576 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.9 | -42 | 172.2 | -177.1 | 0 | 0 | 0 | 0 | 112.4 | H232 F236 Q237 Q238 | H232-V234 HydrophobicContact CB-CB 4.13Å; H232-V234 PolarHBondContact O-N 3.37Å; V234-F236 VanDerWaalsContact C-N 3.35Å; V234-Q237 PolarHBondContact O-N 3.38Å; V234-Q238 WeakPolarHBondContact O-CB 3.46Å; V234-Q238 PolarHBondContact O-N 3.1Å |
| 235 | D | 84.1 | Confident | 80.3 | Confident | 53 Ų | 53 | 96.7 Ų | 96.7 | 28% | 0.283 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.1 | -38.7 | 178.2 | -58.7 | -42.8 | 0 | 0 | 0 | 110.9 | L231 H232 Q238 L239 | L231-D235 HydrophobicContact CD1-CB 4.42Å; H232-D235 IonicContact CG-OD2 3.76Å; H232-D235 PolarHBondContact N-OD2 3.05Å; H232-D235 IonicContact ND1-OD2 2.71Å; H232-D235 WeakPolarHBondContact O-CB 3.49Å; H232-D235 PolarHBondContact O-N 3.25Å; D235-Q238 PolarHBondContact O-N 3.38Å; D235-L239 WeakPolarHBondContact O-CB 3.43Å; D235-L239 WeakPolarHBondContact O-CG 3.42Å; D235-L239 PolarHBondContact O-N 2.9Å |
| 236 | F | 85.3 | Confident | 81.5 | Confident | 102 Ų | 102 | 97.8 Ų | 97.8 | 45% | 0.447 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.6 | -41.7 | 173 | -78 | -73.1 | 0 | 0 | 0 | 112.4 | L231 H232 E233 V234 Q238 L239 K240 | L231-F236 HydrophobicContact CB-CE2 4.18Å; L231-F236 HydrophobicContact CD2-CD2 4.29Å; L231-F236 HydrophobicContact CD2-CE1 3.81Å; L231-F236 HydrophobicContact CD2-CE2 3.32Å; L231-F236 HydrophobicContact CD2-CZ 3.04Å; L231-F236 HydrophobicContact CG-CD2 3.95Å; L231-F236 HydrophobicContact CG-CE1 4.35Å; L231-F236 HydrophobicContact CG-CE2 3.37Å; L231-F236 HydrophobicContact CG-CZ 3.64Å; H232-F236 PolarHBondContact O-N 2.95Å; E233-F236 PolarHBondContact O-N 3.16Å; V234-F236 VanDerWaalsContact C-N 3.35Å; F236-Q238 VanDerWaalsContact C-N 3.35Å; F236-L239 PolarHBondContact O-N 3.05Å; F236-K240 WeakPolarHBondContact O-CG 3.27Å; F236-K240 PolarHBondContact O-N 3.42Å |
| 237 | Q | 90.3 | Very high | 82.8 | Confident | 97 Ų | 97 | 96.6 Ų | 96.6 | 45% | 0.453 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.4 | -40.8 | 175.4 | -72.9 | 177.1 | 9.8 | 0 | 0 | 110.6 | E233 V234 K240 I241 | E233-Q237 WeakPolarHBondContact O-CB 3.26Å; E233-Q237 VanDerWaalsContact O-CG 3.25Å; E233-Q237 WeakPolarHBondContact O-CG 3.31Å; E233-Q237 PolarHBondContact O-N 2.88Å; E233-Q237 PolarHBondContact OE1-NE2 3.39Å; V234-Q237 PolarHBondContact O-N 3.38Å; Q237-K240 WeakPolarHBondContact O-CB 3.32Å; Q237-K240 PolarHBondContact O-N 3.45Å; Q237-I241 VanDerWaalsContact O-CG1 3.26Å; Q237-I241 WeakPolarHBondContact O-CG1 3.44Å; Q237-I241 PolarHBondContact O-N 2.84Å |
| 238 | Q | 93.1 | Very high | 84.5 | Confident | 95 Ų | 95 | 96.2 Ų | 96.2 | 44% | 0.444 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 174.1 | -179.7 | 175.7 | -13.5 | 0 | 0 | 111.2 | V234 D235 F236 K240 I241 E242 | V234-Q238 WeakPolarHBondContact O-CB 3.46Å; V234-Q238 PolarHBondContact O-N 3.1Å; D235-Q238 PolarHBondContact O-N 3.38Å; F236-Q238 VanDerWaalsContact C-N 3.35Å; Q238-K240 VanDerWaalsContact C-N 3.28Å; Q238-K240 PolarHBondContact O-N 3.45Å; Q238-I241 WeakPolarHBondContact O-CB 3.41Å; Q238-I241 PolarHBondContact O-N 2.95Å; Q238-I241 VanDerWaalsContact O-N 3.09Å; Q238-E242 HydrophobicContact CG-CG 4.35Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.4Å; Q238-E242 PolarHBondContact NE2-OE1 3.41Å; Q238-E242 WeakPolarHBondContact O-CG 3.29Å; Q238-E242 PolarHBondContact O-N 3.19Å |
| 239 | L | 93.6 | Very high | 86.5 | Confident | 100 Ų | 100 | 100.3 Ų | 100.3 | 52% | 0.524 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.4 | -38.1 | 175.9 | -80.6 | 168.9 | 0 | 0 | 0 | 112.4 | D235 F236 N243 | D235-L239 WeakPolarHBondContact O-CB 3.43Å; D235-L239 WeakPolarHBondContact O-CG 3.42Å; D235-L239 PolarHBondContact O-N 2.9Å; F236-L239 PolarHBondContact O-N 3.05Å; L239-N243 WeakPolarHBondContact O-CB 3.48Å; L239-N243 PolarHBondContact O-N 3.41Å |
| 240 | K | 96.1 | Very high | 88.6 | Confident | 153 Ų | 153 | 98.9 Ų | 98.9 | 67% | 0.665 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.5 | -42.9 | 174.1 | -76.2 | 174.6 | -178.8 | 176.3 | 0 | 111.7 | F236 Q237 Q238 N243 S244 | F236-K240 WeakPolarHBondContact O-CG 3.27Å; F236-K240 PolarHBondContact O-N 3.42Å; Q237-K240 WeakPolarHBondContact O-CB 3.32Å; Q237-K240 PolarHBondContact O-N 3.45Å; Q238-K240 VanDerWaalsContact C-N 3.28Å; Q238-K240 PolarHBondContact O-N 3.45Å; K240-N243 PolarHBondContact O-N 3.42Å; K240-S244 WeakPolarHBondContact O-CB 3.36Å; K240-S244 PolarHBondContact O-N 2.89Å |
| 241 | I | 96.4 | Very high | 90.6 | Very high | 97 Ų | 97 | 99.6 Ų | 99.6 | 50% | 0.497 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.9 | -48.6 | 177.3 | -68.4 | 164.8 | 0 | 0 | 0 | 110 | Q237 Q238 N243 S244 Q245 | Q237-I241 VanDerWaalsContact O-CG1 3.26Å; Q237-I241 WeakPolarHBondContact O-CG1 3.44Å; Q237-I241 PolarHBondContact O-N 2.84Å; Q238-I241 WeakPolarHBondContact O-CB 3.41Å; Q238-I241 PolarHBondContact O-N 2.95Å; Q238-I241 VanDerWaalsContact O-N 3.09Å; I241-N243 VanDerWaalsContact C-N 3.35Å; I241-N243 PolarHBondContact O-N 3.01Å; I241-S244 WeakPolarHBondContact O-CB 3.25Å; I241-S244 PolarHBondContact O-N 2.94Å; I241-Q245 HydrophobicContact CG2-CG 4.44Å; I241-Q245 VanDerWaalsContact CG2-NE2 3.35Å; I241-Q245 VanDerWaalsContact O-CG 3.31Å; I241-Q245 WeakPolarHBondContact O-CG 3.36Å; I241-Q245 PolarHBondContact O-N 3.43Å |
| 242 | E | 97.3 | Very high | 92.4 | Very high | 66 Ų | 66 | 99.7 Ų | 99.7 | 31% | 0.308 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.3 | -44.9 | 178.2 | -73.2 | 178 | -171.4 | 0 | 0 | 111.2 | Q238 S244 Q245 Y246 | Q238-E242 HydrophobicContact CG-CG 4.35Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.4Å; Q238-E242 PolarHBondContact NE2-OE1 3.41Å; Q238-E242 WeakPolarHBondContact O-CG 3.29Å; Q238-E242 PolarHBondContact O-N 3.19Å; E242-S244 PolarHBondContact O-N 3.27Å; E242-Q245 PolarHBondContact O-N 3.41Å; E242-Y246 HydrophobicContact CB-CD2 4.44Å; E242-Y246 HydrophobicContact CB-CE2 4.19Å; E242-Y246 WeakPolarHBondContact O-CD2 3.4Å; E242-Y246 PolarHBondContact O-N 3.22Å |
| 243 | N | 96.8 | Very high | 93.6 | Very high | 97 Ų | 97 | 101.2 Ų | 101.2 | 52% | 0.519 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.5 | -46 | 176.2 | -167.2 | -57.5 | 0 | 0 | 0 | 111.7 | L239 K240 I241 Q245 Y246 L247 | L239-N243 WeakPolarHBondContact O-CB 3.48Å; L239-N243 PolarHBondContact O-N 3.41Å; K240-N243 PolarHBondContact O-N 3.42Å; I241-N243 VanDerWaalsContact C-N 3.35Å; I241-N243 PolarHBondContact O-N 3.01Å; N243-Q245 VanDerWaalsContact C-N 3.33Å; N243-Q245 PolarHBondContact O-N 3.45Å; N243-Y246 PolarHBondContact O-N 2.83Å; N243-L247 WeakPolarHBondContact O-CG 2.83Å; N243-L247 PolarHBondContact O-N 3.37Å; N243-L247 WeakPolarHBondContact OD1-CD1 3.41Å |
| 244 | S | 97.8 | Very high | 94.8 | Very high | 58 Ų | 58 | 98.4 Ų | 98.4 | 41% | 0.406 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -58.2 | -44.8 | 175 | -165.6 | 0 | 0 | 0 | 0 | 111.8 | K240 I241 E242 Y246 L247 E248 | K240-S244 WeakPolarHBondContact O-CB 3.36Å; K240-S244 PolarHBondContact O-N 2.89Å; I241-S244 WeakPolarHBondContact O-CB 3.25Å; I241-S244 PolarHBondContact O-N 2.94Å; E242-S244 PolarHBondContact O-N 3.27Å; S244-Y246 PolarHBondContact O-N 3.06Å; S244-L247 PolarHBondContact O-N 3.35Å; S244-E248 WeakPolarHBondContact O-CG 3.44Å; S244-E248 PolarHBondContact O-N 3Å |
| 245 | Q | 98.1 | Very high | 95.7 | Very high | 86 Ų | 86 | 98.8 Ų | 98.8 | 40% | 0.402 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.7 | -38.4 | 177.3 | -71.3 | 175.9 | 11.4 | 0 | 0 | 112.4 | I241 E242 N243 R249 | I241-Q245 HydrophobicContact CG2-CG 4.44Å; I241-Q245 VanDerWaalsContact CG2-NE2 3.35Å; I241-Q245 VanDerWaalsContact O-CG 3.31Å; I241-Q245 WeakPolarHBondContact O-CG 3.36Å; I241-Q245 PolarHBondContact O-N 3.43Å; E242-Q245 PolarHBondContact O-N 3.41Å; N243-Q245 VanDerWaalsContact C-N 3.33Å; N243-Q245 PolarHBondContact O-N 3.45Å; Q245-R249 WeakPolarHBondContact O-CB 3.44Å; Q245-R249 VanDerWaalsContact O-CG 3.29Å; Q245-R249 WeakPolarHBondContact O-CG 2.95Å; Q245-R249 PolarHBondContact O-N 2.85Å |
| 246 | Y | 98.2 | Very high | 96.4 | Very high | 135 Ų | 135 | 99.1 Ų | 99.1 | 53% | 0.529 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -67.2 | -39.7 | 175.5 | -74 | -57.2 | 0 | 0 | 0 | 111.8 | E242 N243 S244 R249 I250 | E242-Y246 HydrophobicContact CB-CD2 4.44Å; E242-Y246 HydrophobicContact CB-CE2 4.19Å; E242-Y246 WeakPolarHBondContact O-CD2 3.4Å; E242-Y246 PolarHBondContact O-N 3.22Å; N243-Y246 PolarHBondContact O-N 2.83Å; S244-Y246 PolarHBondContact O-N 3.06Å; Y246-R249 PolarHBondContact O-N 3.44Å; Y246-I250 WeakPolarHBondContact O-CB 3.22Å; Y246-I250 WeakPolarHBondContact O-CD1 3.43Å; Y246-I250 WeakPolarHBondContact O-CG1 3.43Å; Y246-I250 PolarHBondContact O-N 3.29Å |
| 247 | L | 98 | Very high | 97 | Very high | 92 Ų | 92 | 98.2 Ų | 98.2 | 48% | 0.482 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.1 | -47 | 174.6 | -73.4 | 172.6 | 0 | 0 | 0 | 111.6 | N243 S244 R249 I250 D251 | N243-L247 WeakPolarHBondContact O-CG 2.83Å; N243-L247 PolarHBondContact O-N 3.37Å; N243-L247 WeakPolarHBondContact OD1-CD1 3.41Å; S244-L247 PolarHBondContact O-N 3.35Å; L247-R249 VanDerWaalsContact C-N 3.34Å; L247-R249 PolarHBondContact O-N 2.84Å; L247-I250 WeakPolarHBondContact O-CB 3.41Å; L247-I250 PolarHBondContact O-N 3.45Å; L247-I250 VanDerWaalsContact O-N 3.15Å; L247-D251 PolarHBondContact O-N 3.42Å |
| 248 | E | 97.9 | Very high | 97.4 | Very high | 116 Ų | 116 | 98.8 Ų | 98.8 | 54% | 0.542 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.3 | -45.7 | 175.5 | -74.9 | 173 | -168.1 | 0 | 0 | 111.6 | S244 I250 D251 E252 | S244-E248 WeakPolarHBondContact O-CG 3.44Å; S244-E248 PolarHBondContact O-N 3Å; E248-I250 VanDerWaalsContact C-N 3.33Å; E248-I250 PolarHBondContact O-N 3.46Å; E248-D251 PolarHBondContact O-N 2.86Å; E248-E252 WeakPolarHBondContact O-CG 3.33Å; E248-E252 PolarHBondContact O-N 3.3Å |
| 249 | R | 98.3 | Very high | 97.6 | Very high | 130 Ų | 130 | 101.3 Ų | 101.3 | 49% | 0.491 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.7 | -38.9 | 176.4 | -73.9 | 176.3 | -174.5 | 173 | 6.4 | 112.3 | Q245 Y246 L247 R253 | Q245-R249 WeakPolarHBondContact O-CB 3.44Å; Q245-R249 VanDerWaalsContact O-CG 3.29Å; Q245-R249 WeakPolarHBondContact O-CG 2.95Å; Q245-R249 PolarHBondContact O-N 2.85Å; Y246-R249 PolarHBondContact O-N 3.44Å; L247-R249 VanDerWaalsContact C-N 3.34Å; L247-R249 PolarHBondContact O-N 2.84Å; R249-R253 VanDerWaalsContact O-CG 3.32Å; R249-R253 WeakPolarHBondContact O-CG 3.46Å; R249-R253 PolarHBondContact O-N 2.93Å |
| 250 | I | 98.1 | Very high | 97.8 | Very high | 91 Ų | 91 | 102 Ų | 102 | 47% | 0.467 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.7 | -45 | 175.7 | -73.6 | 165.2 | 0 | 0 | 0 | 109.8 | Y246 L247 E248 R253 N254 | Y246-I250 WeakPolarHBondContact O-CB 3.22Å; Y246-I250 WeakPolarHBondContact O-CD1 3.43Å; Y246-I250 WeakPolarHBondContact O-CG1 3.43Å; Y246-I250 PolarHBondContact O-N 3.29Å; L247-I250 WeakPolarHBondContact O-CB 3.41Å; L247-I250 PolarHBondContact O-N 3.45Å; L247-I250 VanDerWaalsContact O-N 3.15Å; E248-I250 VanDerWaalsContact C-N 3.33Å; E248-I250 PolarHBondContact O-N 3.46Å; I250-R253 PolarHBondContact O-N 3.47Å; I250-N254 WeakPolarHBondContact CG2-ND2 3.44Å; I250-N254 WeakPolarHBondContact O-CB 3.23Å; I250-N254 PolarHBondContact O-N 3.26Å; I250-N254 PolarHBondContact O-ND2 3.06Å |
| 251 | D | 98.1 | Very high | 97.9 | Very high | 94 Ų | 94 | 101 Ų | 101 | 50% | 0.503 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 178.9 | -79.6 | -15.6 | 0 | 0 | 0 | 112.4 | L247 E248 N254 Q255 | L247-D251 PolarHBondContact O-N 3.42Å; E248-D251 PolarHBondContact O-N 2.86Å; D251-N254 PolarHBondContact O-N 2.86Å; D251-Q255 VanDerWaalsContact O-CG 3.3Å; D251-Q255 WeakPolarHBondContact O-CG 3.4Å; D251-Q255 PolarHBondContact O-N 3.4Å |
| 252 | E | 98.3 | Very high | 98 | Very high | 92 Ų | 92 | 101.5 Ų | 101.5 | 43% | 0.43 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -57.4 | -50.4 | 171.8 | -73.4 | 178 | 178.3 | 0 | 0 | 111.7 | E248 N254 Q255 D256 | E248-E252 WeakPolarHBondContact O-CG 3.33Å; E248-E252 PolarHBondContact O-N 3.3Å; E252-N254 VanDerWaalsContact C-N 3.28Å; E252-N254 PolarHBondContact O-N 3.26Å; E252-Q255 PolarHBondContact O-N 3.15Å; E252-D256 PolarHBondContact O-N 3.19Å |
| 253 | R | 98 | Very high | 98.1 | Very high | 132 Ų | 132 | 103.2 Ų | 103.2 | 50% | 0.498 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.9 | -35.4 | 179.1 | -66.9 | -53.3 | 91.2 | 67.2 | -0.2 | 111.7 | R249 I250 D256 L257 | R249-R253 VanDerWaalsContact O-CG 3.32Å; R249-R253 WeakPolarHBondContact O-CG 3.46Å; R249-R253 PolarHBondContact O-N 2.93Å; I250-R253 PolarHBondContact O-N 3.47Å; R253-D256 IonicContact NE-OD2 3.21Å; R253-D256 IonicContact NH2-OD2 2.68Å; R253-D256 PolarHBondContact O-N 3.47Å; R253-L257 WeakPolarHBondContact O-CB 3.28Å; R253-L257 PolarHBondContact O-N 3.44Å |
| 254 | N | 98.1 | Very high | 98.1 | Very high | 85 Ų | 85 | 101.2 Ų | 101.2 | 46% | 0.455 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.1 | -40.8 | 175.3 | -77 | -26.2 | 0 | 0 | 0 | 111.9 | I250 D251 E252 L257 L258 | I250-N254 WeakPolarHBondContact CG2-ND2 3.44Å; I250-N254 WeakPolarHBondContact O-CB 3.23Å; I250-N254 PolarHBondContact O-N 3.26Å; I250-N254 PolarHBondContact O-ND2 3.06Å; D251-N254 PolarHBondContact O-N 2.86Å; E252-N254 VanDerWaalsContact C-N 3.28Å; E252-N254 PolarHBondContact O-N 3.26Å; N254-L257 PolarHBondContact O-N 2.84Å; N254-L258 WeakPolarHBondContact O-CB 3.45Å; N254-L258 PolarHBondContact O-N 2.91Å |
| 255 | Q | 98.3 | Very high | 98.1 | Very high | 103 Ų | 103 | 100.3 Ų | 100.3 | 48% | 0.481 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.1 | -43.5 | 174.1 | -71.1 | 174.5 | 27.4 | 0 | 0 | 111.5 | D251 E252 L258 R259 | D251-Q255 VanDerWaalsContact O-CG 3.3Å; D251-Q255 WeakPolarHBondContact O-CG 3.4Å; D251-Q255 PolarHBondContact O-N 3.4Å; E252-Q255 PolarHBondContact O-N 3.15Å; Q255-L258 PolarHBondContact O-N 2.71Å; Q255-R259 WeakPolarHBondContact O-CG 3.32Å; Q255-R259 PolarHBondContact O-N 3.34Å |
| 256 | D | 98.1 | Very high | 98.1 | Very high | 60 Ų | 60 | 100.7 Ų | 100.7 | 32% | 0.321 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 176 | -68.9 | -24.7 | 0 | 0 | 0 | 111.5 | E252 R253 L258 R259 L260 | E252-D256 PolarHBondContact O-N 3.19Å; R253-D256 IonicContact NE-OD2 3.21Å; R253-D256 IonicContact NH2-OD2 2.68Å; R253-D256 PolarHBondContact O-N 3.47Å; D256-L258 VanDerWaalsContact C-N 3.31Å; D256-L258 PolarHBondContact O-N 2.83Å; D256-R259 PolarHBondContact O-N 3.47Å; D256-R259 IonicContact OD1-NH1 3.29Å; D256-R259 PolarHBondContact OD1-NH1 3.32Å; D256-L260 WeakPolarHBondContact O-CB 3.49Å; D256-L260 WeakPolarHBondContact O-CG 3.15Å; D256-L260 PolarHBondContact O-N 3.32Å |
| 257 | L | 98.3 | Very high | 98.1 | Very high | 84 Ų | 84 | 98.1 Ų | 98.1 | 44% | 0.44 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.6 | -42.6 | 174.4 | -179.7 | 64.4 | 0 | 0 | 0 | 111.6 | R253 N254 L260 K261 | R253-L257 WeakPolarHBondContact O-CB 3.28Å; R253-L257 PolarHBondContact O-N 3.44Å; N254-L257 PolarHBondContact O-N 2.84Å; L257-L260 PolarHBondContact O-N 3.41Å; L257-K261 HydrophobicContact CG-CD 4.37Å; L257-K261 WeakPolarHBondContact O-CB 3.44Å; L257-K261 WeakPolarHBondContact O-CG 3.46Å; L257-K261 PolarHBondContact O-N 3.4Å |
| 258 | L | 98.3 | Very high | 98.2 | Very high | 108 Ų | 108 | 98.4 Ų | 98.4 | 57% | 0.565 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.9 | -45.2 | 177.2 | -175.8 | 65.1 | 0 | 0 | 0 | 111.4 | N254 Q255 D256 L260 K261 L262 | N254-L258 WeakPolarHBondContact O-CB 3.45Å; N254-L258 PolarHBondContact O-N 2.91Å; Q255-L258 PolarHBondContact O-N 2.71Å; D256-L258 VanDerWaalsContact C-N 3.31Å; D256-L258 PolarHBondContact O-N 2.83Å; L258-L260 PolarHBondContact O-N 3.45Å; L258-K261 PolarHBondContact O-N 2.86Å; L258-L262 HydrophobicContact CG-CD1 4.48Å; L258-L262 WeakPolarHBondContact O-CG 3.46Å; L258-L262 PolarHBondContact O-N 3.27Å |
| 259 | R | 98.1 | Very high | 98.2 | Very high | 149 Ų | 149 | 99.6 Ų | 99.6 | 56% | 0.562 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -58.6 | -46.7 | 175.4 | -72.1 | 176.4 | -174 | 131.6 | 2 | 111.5 | Q255 D256 K261 L262 L263 | Q255-R259 WeakPolarHBondContact O-CG 3.32Å; Q255-R259 PolarHBondContact O-N 3.34Å; D256-R259 PolarHBondContact O-N 3.47Å; D256-R259 IonicContact OD1-NH1 3.29Å; D256-R259 PolarHBondContact OD1-NH1 3.32Å; R259-K261 PolarHBondContact O-N 3.48Å; R259-L262 PolarHBondContact O-N 3.45Å; R259-L263 WeakPolarHBondContact O-CB 3.45Å; R259-L263 PolarHBondContact O-N 3.49Å |
| 260 | L | 98.1 | Very high | 98.2 | Very high | 115 Ų | 115 | 97.1 Ų | 97.1 | 60% | 0.602 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.3 | -39.3 | 178.4 | -73.7 | 173.6 | 0 | 0 | 0 | 112.2 | D256 L257 L258 L263 A264 | D256-L260 WeakPolarHBondContact O-CB 3.49Å; D256-L260 WeakPolarHBondContact O-CG 3.15Å; D256-L260 PolarHBondContact O-N 3.32Å; L257-L260 PolarHBondContact O-N 3.41Å; L258-L260 PolarHBondContact O-N 3.45Å; L260-L263 PolarHBondContact O-N 2.89Å; L260-A264 VanDerWaalsContact O-CB 3.3Å; L260-A264 WeakPolarHBondContact O-CB 3.32Å; L260-A264 PolarHBondContact O-N 3.42Å |
| 261 | K | 98.3 | Very high | 98.2 | Very high | 132 Ų | 132 | 98 Ų | 98 | 57% | 0.574 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.1 | -44.3 | 174.5 | -78.9 | 177.1 | 177.3 | 178 | 0 | 112.1 | L257 L258 R259 A264 G265 | L257-K261 HydrophobicContact CG-CD 4.37Å; L257-K261 WeakPolarHBondContact O-CB 3.44Å; L257-K261 WeakPolarHBondContact O-CG 3.46Å; L257-K261 PolarHBondContact O-N 3.4Å; L258-K261 PolarHBondContact O-N 2.86Å; R259-K261 PolarHBondContact O-N 3.48Å; K261-A264 PolarHBondContact O-N 3Å; K261-G265 PolarHBondContact O-N 3.41Å |
| 262 | L | 98.1 | Very high | 98.2 | Very high | 106 Ų | 106 | 97.1 Ų | 97.1 | 56% | 0.555 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.2 | -44.9 | 176 | -71.4 | 171.8 | 0 | 0 | 0 | 111.2 | L258 R259 A264 G265 N266 | L258-L262 HydrophobicContact CG-CD1 4.48Å; L258-L262 WeakPolarHBondContact O-CG 3.46Å; L258-L262 PolarHBondContact O-N 3.27Å; R259-L262 PolarHBondContact O-N 3.45Å; L262-A264 PolarHBondContact O-N 3.14Å; L262-G265 PolarHBondContact O-N 2.82Å; L262-N266 VanDerWaalsContact O-CG 3.28Å; L262-N266 PolarHBondContact O-N 3.4Å |
| 263 | L | 98.1 | Very high | 98.2 | Very high | 103 Ų | 103 | 95.9 Ų | 95.9 | 54% | 0.539 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.7 | -45.4 | 176.5 | -175.8 | 63.8 | 0 | 0 | 0 | 111.4 | R259 L260 G265 N266 T267 | R259-L263 WeakPolarHBondContact O-CB 3.45Å; R259-L263 PolarHBondContact O-N 3.49Å; L260-L263 PolarHBondContact O-N 2.89Å; L263-G265 VanDerWaalsContact C-N 3.33Å; L263-G265 PolarHBondContact O-N 2.79Å; L263-N266 PolarHBondContact O-N 2.76Å; L263-T267 HydrophobicContact CD1-CG2 4.39Å; L263-T267 HydrophobicContact CG-CG2 4.49Å; L263-T267 WeakPolarHBondContact O-CG2 3.39Å; L263-T267 PolarHBondContact O-N 2.92Å; L263-T267 PolarHBondContact O-OG1 2.96Å; L263-T267 VanDerWaalsContact O-OG1 3.11Å |
| 264 | A | 98.1 | Very high | 98.2 | Very high | 55 Ų | 55 | 97.1 Ų | 97.1 | 46% | 0.455 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.1 | -39.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L260 K261 L262 T267 L268 | L260-A264 VanDerWaalsContact O-CB 3.3Å; L260-A264 WeakPolarHBondContact O-CB 3.32Å; L260-A264 PolarHBondContact O-N 3.42Å; K261-A264 PolarHBondContact O-N 3Å; L262-A264 PolarHBondContact O-N 3.14Å; A264-T267 WeakPolarHBondContact CA-OG1 3.36Å; A264-T267 PolarHBondContact O-OG1 2.95Å; A264-L268 VanDerWaalsContact O-CB 3.24Å; A264-L268 WeakPolarHBondContact O-CB 3.49Å; A264-L268 PolarHBondContact O-N 3.22Å |
| 265 | G | 98.3 | Very high | 98.2 | Very high | 38 Ų | 38 | 98.7 Ų | 98.7 | 39% | 0.392 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.5 | -46.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K261 L262 L263 L268 Q269 | K261-G265 PolarHBondContact O-N 3.41Å; L262-G265 PolarHBondContact O-N 2.82Å; L263-G265 VanDerWaalsContact C-N 3.33Å; L263-G265 PolarHBondContact O-N 2.79Å; G265-L268 PolarHBondContact O-N 3.33Å; G265-Q269 PolarHBondContact O-N 2.92Å |
| 266 | N | 98.1 | Very high | 98.2 | Very high | 95 Ų | 95 | 101 Ų | 101 | 51% | 0.508 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.1 | -45.7 | 178.5 | -69.6 | -14.8 | 0 | 0 | 0 | 111.9 | L262 L263 L268 Q269 V270 | L262-N266 VanDerWaalsContact O-CG 3.28Å; L262-N266 PolarHBondContact O-N 3.4Å; L263-N266 PolarHBondContact O-N 2.76Å; N266-L268 VanDerWaalsContact C-N 3.3Å; N266-L268 PolarHBondContact O-N 3.02Å; N266-Q269 WeakPolarHBondContact O-CB 3.4Å; N266-Q269 PolarHBondContact O-N 3.24Å; N266-V270 WeakPolarHBondContact O-CG2 3.33Å; N266-V270 PolarHBondContact O-N 3.28Å |
| 267 | T | 97.9 | Very high | 98.2 | Very high | 80 Ų | 80 | 104.9 Ų | 104.9 | 49% | 0.491 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64 | -37.1 | 177.2 | 55.5 | 0 | 0 | 0 | 0 | 111.5 | L263 A264 V270 L271 | L263-T267 HydrophobicContact CD1-CG2 4.39Å; L263-T267 HydrophobicContact CG-CG2 4.49Å; L263-T267 WeakPolarHBondContact O-CG2 3.39Å; L263-T267 PolarHBondContact O-N 2.92Å; L263-T267 PolarHBondContact O-OG1 2.96Å; L263-T267 VanDerWaalsContact O-OG1 3.11Å; A264-T267 WeakPolarHBondContact CA-OG1 3.36Å; A264-T267 PolarHBondContact O-OG1 2.95Å; T267-V270 PolarHBondContact O-N 2.95Å; T267-L271 VanDerWaalsContact O-CB 3.29Å; T267-L271 WeakPolarHBondContact O-CB 3.49Å; T267-L271 PolarHBondContact O-N 3.4Å |
| 268 | L | 98.4 | Very high | 98.2 | Very high | 98 Ų | 98 | 106.6 Ų | 106.6 | 51% | 0.513 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.3 | -39.6 | 173.4 | -176.9 | 65.9 | 0 | 0 | 0 | 112.1 | A264 G265 N266 L271 N272 | A264-L268 VanDerWaalsContact O-CB 3.24Å; A264-L268 WeakPolarHBondContact O-CB 3.49Å; A264-L268 PolarHBondContact O-N 3.22Å; G265-L268 PolarHBondContact O-N 3.33Å; N266-L268 VanDerWaalsContact C-N 3.3Å; N266-L268 PolarHBondContact O-N 3.02Å; L268-L271 PolarHBondContact O-N 3.48Å; L268-N272 WeakPolarHBondContact O-CB 3.32Å; L268-N272 PolarHBondContact O-N 3.01Å; L268-N272 PolarHBondContact O-ND2 2.97Å |
| 269 | Q | 98.1 | Very high | 98.2 | Very high | 142 Ų | 142 | 107 Ų | 107 | 66% | 0.664 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.5 | -45.4 | 176.1 | -172.6 | 179.8 | -2.9 | 0 | 0 | 111.3 | G265 N266 N272 S273 | G265-Q269 PolarHBondContact O-N 2.92Å; N266-Q269 WeakPolarHBondContact O-CB 3.4Å; N266-Q269 PolarHBondContact O-N 3.24Å; Q269-N272 PolarHBondContact O-N 2.93Å; Q269-S273 PolarHBondContact O-N 3.37Å |
| 270 | V | 98.3 | Very high | 98.2 | Very high | 77 Ų | 77 | 103.4 Ų | 103.4 | 47% | 0.467 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 175.4 | 174.1 | 0 | 0 | 0 | 0 | 110.8 | N266 T267 N272 S273 Y274 | N266-V270 WeakPolarHBondContact O-CG2 3.33Å; N266-V270 PolarHBondContact O-N 3.28Å; T267-V270 PolarHBondContact O-N 2.95Å; V270-N272 VanDerWaalsContact C-N 3.31Å; V270-N272 PolarHBondContact O-N 2.88Å; V270-S273 PolarHBondContact O-N 3Å; V270-S273 PolarHBondContact O-OG 3.21Å; V270-Y274 HydrophobicContact CG1-CD2 3.69Å; V270-Y274 HydrophobicContact CG1-CE2 3.51Å; V270-Y274 VanDerWaalsContact O-CD2 3.24Å; V270-Y274 WeakPolarHBondContact O-CD2 3.41Å; V270-Y274 PolarHBondContact O-N 2.9Å |
| 271 | L | 98.3 | Very high | 98.2 | Very high | 111 Ų | 111 | 102.8 Ų | 102.8 | 58% | 0.581 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.7 | -43 | 176.8 | -179.4 | 63.3 | 0 | 0 | 0 | 111.6 | T267 L268 S273 Y274 K275 | T267-L271 VanDerWaalsContact O-CB 3.29Å; T267-L271 WeakPolarHBondContact O-CB 3.49Å; T267-L271 PolarHBondContact O-N 3.4Å; L268-L271 PolarHBondContact O-N 3.48Å; L271-S273 VanDerWaalsContact C-N 3.34Å; L271-S273 PolarHBondContact O-N 3.08Å; L271-Y274 PolarHBondContact O-N 3.38Å; L271-K275 WeakPolarHBondContact O-CB 3.39Å; L271-K275 PolarHBondContact O-N 3.23Å |
| 272 | N | 98.3 | Very high | 98.2 | Very high | 74 Ų | 74 | 99.3 Ų | 99.3 | 40% | 0.396 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.5 | -35.3 | 177.2 | -85.5 | -41.3 | 0 | 0 | 0 | 112.7 | L268 Q269 V270 K275 K276 | L268-N272 WeakPolarHBondContact O-CB 3.32Å; L268-N272 PolarHBondContact O-N 3.01Å; L268-N272 PolarHBondContact O-ND2 2.97Å; Q269-N272 PolarHBondContact O-N 2.93Å; V270-N272 VanDerWaalsContact C-N 3.31Å; V270-N272 PolarHBondContact O-N 2.88Å; N272-K275 PolarHBondContact O-N 3.44Å; N272-K276 WeakPolarHBondContact O-CG 3.46Å; N272-K276 PolarHBondContact O-N 3.4Å |
| 273 | S | 98.3 | Very high | 98.2 | Very high | 67 Ų | 67 | 97.7 Ų | 97.7 | 47% | 0.469 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.4 | -44.5 | 175.6 | 76.4 | 0 | 0 | 0 | 0 | 111.2 | Q269 V270 L271 K276 K277 | Q269-S273 PolarHBondContact O-N 3.37Å; V270-S273 PolarHBondContact O-N 3Å; V270-S273 PolarHBondContact O-OG 3.21Å; L271-S273 VanDerWaalsContact C-N 3.34Å; L271-S273 PolarHBondContact O-N 3.08Å; S273-K276 PolarHBondContact O-N 2.82Å; S273-K277 PolarHBondContact O-N 3.4Å |
| 274 | Y | 98.2 | Very high | 98.2 | Very high | 158 Ų | 158 | 97.3 Ų | 97.3 | 62% | 0.62 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.3 | -39.6 | 174.4 | -78.6 | -68.6 | 0 | 0 | 0 | 112.5 | V270 L271 K276 K277 L278 | V270-Y274 HydrophobicContact CG1-CD2 3.69Å; V270-Y274 HydrophobicContact CG1-CE2 3.51Å; V270-Y274 VanDerWaalsContact O-CD2 3.24Å; V270-Y274 WeakPolarHBondContact O-CD2 3.41Å; V270-Y274 PolarHBondContact O-N 2.9Å; L271-Y274 PolarHBondContact O-N 3.38Å; Y274-K276 PolarHBondContact O-N 3Å; Y274-K277 PolarHBondContact O-N 3.35Å; Y274-L278 WeakPolarHBondContact O-CB 3.39Å; Y274-L278 PolarHBondContact O-N 3.37Å |
| 275 | K | 98.4 | Very high | 98.2 | Very high | 118 Ų | 118 | 98.3 Ų | 98.3 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.5 | -45.3 | 174.7 | -174.7 | 177.5 | -180 | 178.7 | 0 | 111.7 | L271 N272 L278 Q279 | L271-K275 WeakPolarHBondContact O-CB 3.39Å; L271-K275 PolarHBondContact O-N 3.23Å; N272-K275 PolarHBondContact O-N 3.44Å; K275-L278 PolarHBondContact O-N 2.96Å; K275-Q279 WeakPolarHBondContact O-CG 3.44Å; K275-Q279 PolarHBondContact O-N 3.49Å |
| 276 | K | 98.3 | Very high | 98.2 | Very high | 151 Ų | 151 | 103.5 Ų | 103.5 | 66% | 0.657 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.1 | -44.8 | 175.3 | -74.4 | 178.2 | -179.7 | -177 | 0 | 111.7 | N272 S273 Y274 L278 Q279 S280 | N272-K276 WeakPolarHBondContact O-CG 3.46Å; N272-K276 PolarHBondContact O-N 3.4Å; S273-K276 PolarHBondContact O-N 2.82Å; Y274-K276 PolarHBondContact O-N 3Å; K276-L278 PolarHBondContact O-N 2.97Å; K276-Q279 PolarHBondContact O-N 3.37Å; K276-S280 PolarHBondContact O-N 3.27Å |
| 277 | K | 98.4 | Very high | 98.2 | Very high | 142 Ų | 142 | 104.3 Ų | 104.3 | 62% | 0.617 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.9 | -44.3 | 178 | -168.1 | 168.3 | -176.3 | 175.9 | 0 | 111.4 | S273 Y274 Q279 S280 M281 | S273-K277 PolarHBondContact O-N 3.4Å; Y274-K277 PolarHBondContact O-N 3.35Å; K277-Q279 PolarHBondContact O-N 2.84Å; K277-S280 WeakPolarHBondContact O-CB 3.41Å; K277-S280 PolarHBondContact O-N 3.22Å; K277-M281 WeakPolarHBondContact O-CG 3.33Å; K277-M281 PolarHBondContact O-N 3.01Å |
| 278 | L | 98.2 | Very high | 98.2 | Very high | 119 Ų | 119 | 104.8 Ų | 104.8 | 62% | 0.623 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.1 | -44.2 | 175.6 | -177.6 | 65.3 | 0 | 0 | 0 | 111.6 | Y274 K275 K276 S280 M281 T282 | Y274-L278 WeakPolarHBondContact O-CB 3.39Å; Y274-L278 PolarHBondContact O-N 3.37Å; K275-L278 PolarHBondContact O-N 2.96Å; K276-L278 PolarHBondContact O-N 2.97Å; L278-S280 VanDerWaalsContact C-N 3.33Å; L278-S280 PolarHBondContact O-N 3.06Å; L278-M281 PolarHBondContact O-N 3.46Å; L278-T282 VanDerWaalsContact O-CB 3.3Å; L278-T282 WeakPolarHBondContact O-CB 3.27Å; L278-T282 PolarHBondContact O-N 3.32Å; L278-T282 PolarHBondContact O-OG1 2.91Å |
| 279 | Q | 98.3 | Very high | 98.2 | Very high | 116 Ų | 116 | 103.4 Ų | 103.4 | 54% | 0.542 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61 | -42.1 | 176.6 | -76.2 | 176.2 | -25 | 0 | 0 | 112 | K275 K276 K277 T282 C283 | K275-Q279 WeakPolarHBondContact O-CG 3.44Å; K275-Q279 PolarHBondContact O-N 3.49Å; K276-Q279 PolarHBondContact O-N 3.37Å; K277-Q279 PolarHBondContact O-N 2.84Å; Q279-T282 PolarHBondContact O-N 2.93Å; Q279-C283 WeakPolarHBondContact O-CB 3.42Å; Q279-C283 PolarHBondContact O-N 3.09Å |
| 280 | S | 98.4 | Very high | 98.2 | Very high | 74 Ų | 74 | 100.1 Ų | 100.1 | 52% | 0.517 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.2 | -53.1 | 175.5 | -168.6 | 0 | 0 | 0 | 0 | 111.6 | K276 K277 L278 T282 C283 E284 | K276-S280 PolarHBondContact O-N 3.27Å; K277-S280 WeakPolarHBondContact O-CB 3.41Å; K277-S280 PolarHBondContact O-N 3.22Å; L278-S280 VanDerWaalsContact C-N 3.33Å; L278-S280 PolarHBondContact O-N 3.06Å; S280-T282 VanDerWaalsContact C-N 3.26Å; S280-T282 PolarHBondContact O-N 3.43Å; S280-C283 WeakPolarHBondContact O-CB 3.49Å; S280-C283 PolarHBondContact O-N 3.19Å; S280-C283 VanDerWaalsContact O-N 3.13Å; S280-E284 PolarHBondContact O-N 3.25Å |
| 281 | M | 97.9 | Very high | 98.2 | Very high | 103 Ų | 103 | 100 Ų | 100 | 51% | 0.507 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.5 | -36.1 | 178.3 | -63.7 | -54.7 | -59.8 | 0 | 0 | 112 | K277 L278 E284 S285 | K277-M281 WeakPolarHBondContact O-CG 3.33Å; K277-M281 PolarHBondContact O-N 3.01Å; L278-M281 PolarHBondContact O-N 3.46Å; M281-E284 PolarHBondContact O-N 3.41Å; M281-S285 VanDerWaalsContact O-CB 3.29Å; M281-S285 WeakPolarHBondContact O-CB 3.26Å; M281-S285 PolarHBondContact O-N 3.36Å |
| 282 | T | 98.3 | Very high | 98.2 | Very high | 59 Ų | 59 | 99 Ų | 99 | 36% | 0.362 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.9 | -40.7 | 176.3 | -55.2 | 0 | 0 | 0 | 0 | 111.3 | L278 Q279 S280 K286 | L278-T282 VanDerWaalsContact O-CB 3.3Å; L278-T282 WeakPolarHBondContact O-CB 3.27Å; L278-T282 PolarHBondContact O-N 3.32Å; L278-T282 PolarHBondContact O-OG1 2.91Å; Q279-T282 PolarHBondContact O-N 2.93Å; S280-T282 VanDerWaalsContact C-N 3.26Å; S280-T282 PolarHBondContact O-N 3.43Å; T282-K286 WeakPolarHBondContact O-CG 3.35Å; T282-K286 PolarHBondContact O-N 2.76Å; T282-K286 VanDerWaalsContact O-N 3.09Å |
| 283 | C | 98.1 | Very high | 98.2 | Very high | 72 Ų | 72 | 98.6 Ų | 98.6 | 49% | 0.486 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.9 | -47.6 | 176 | -167.8 | 0 | 0 | 0 | 0 | 110.9 | Q279 S280 S285 K286 L287 | Q279-C283 WeakPolarHBondContact O-CB 3.42Å; Q279-C283 PolarHBondContact O-N 3.09Å; S280-C283 WeakPolarHBondContact O-CB 3.49Å; S280-C283 PolarHBondContact O-N 3.19Å; S280-C283 VanDerWaalsContact O-N 3.13Å; C283-S285 PolarHBondContact O-N 2.95Å; C283-K286 WeakPolarHBondContact O-CB 3.48Å; C283-K286 PolarHBondContact O-N 3.32Å; C283-K286 VanDerWaalsContact O-N 3.16Å; C283-L287 WeakPolarHBondContact O-CG 3.39Å; C283-L287 PolarHBondContact O-N 3.27Å |
| 284 | E | 98.3 | Very high | 98.2 | Very high | 95 Ų | 95 | 98.4 Ų | 98.4 | 44% | 0.444 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60 | -43.7 | 177 | -172.1 | 178.8 | -178.6 | 0 | 0 | 111.9 | S280 M281 K286 L287 L288 | S280-E284 PolarHBondContact O-N 3.25Å; M281-E284 PolarHBondContact O-N 3.41Å; E284-K286 VanDerWaalsContact C-N 3.33Å; E284-K286 PolarHBondContact O-N 3.16Å; E284-L287 PolarHBondContact O-N 2.94Å; E284-L288 HydrophobicContact CG-CD1 4.12Å; E284-L288 WeakPolarHBondContact O-CB 3.26Å; E284-L288 WeakPolarHBondContact O-CG 3.42Å; E284-L288 PolarHBondContact O-N 2.94Å |
| 285 | S | 97.9 | Very high | 98.2 | Very high | 76 Ų | 76 | 97.9 Ų | 97.9 | 53% | 0.531 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.2 | -41 | 175 | 176.2 | 0 | 0 | 0 | 0 | 112.4 | M281 C283 S289 | M281-S285 VanDerWaalsContact O-CB 3.29Å; M281-S285 WeakPolarHBondContact O-CB 3.26Å; M281-S285 PolarHBondContact O-N 3.36Å; C283-S285 PolarHBondContact O-N 2.95Å; S285-S289 WeakPolarHBondContact O-CB 3.45Å; S285-S289 PolarHBondContact O-N 3.02Å |
| 286 | K | 98.2 | Very high | 98.2 | Very high | 147 Ų | 147 | 98.6 Ų | 98.6 | 64% | 0.639 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.2 | -42.8 | 175.1 | -73.7 | 173.7 | -179.4 | -176.6 | 0 | 112 | T282 C283 E284 S289 S290 | T282-K286 WeakPolarHBondContact O-CG 3.35Å; T282-K286 PolarHBondContact O-N 2.76Å; T282-K286 VanDerWaalsContact O-N 3.09Å; C283-K286 WeakPolarHBondContact O-CB 3.48Å; C283-K286 PolarHBondContact O-N 3.32Å; C283-K286 VanDerWaalsContact O-N 3.16Å; E284-K286 VanDerWaalsContact C-N 3.33Å; E284-K286 PolarHBondContact O-N 3.16Å; K286-S289 PolarHBondContact O-N 2.94Å; K286-S290 PolarHBondContact O-N 3.41Å |
| 287 | L | 98.2 | Very high | 98.2 | Very high | 112 Ų | 112 | 97.2 Ų | 97.2 | 59% | 0.586 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.7 | -51.5 | 175.7 | -70.6 | 174 | 0 | 0 | 0 | 110.7 | C283 E284 S289 S290 D291 | C283-L287 WeakPolarHBondContact O-CG 3.39Å; C283-L287 PolarHBondContact O-N 3.27Å; E284-L287 PolarHBondContact O-N 2.94Å; L287-S289 VanDerWaalsContact C-N 3.28Å; L287-S289 PolarHBondContact O-N 3.47Å; L287-S290 WeakPolarHBondContact O-CB 3.34Å; L287-S290 PolarHBondContact O-N 2.88Å; L287-S290 VanDerWaalsContact O-N 3.12Å; L287-D291 WeakPolarHBondContact O-CB 3.4Å; L287-D291 PolarHBondContact O-N 3.21Å |
| 288 | L | 98.1 | Very high | 98.2 | Very high | 90 Ų | 90 | 96 Ų | 96 | 47% | 0.471 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.1 | -39.9 | 176.4 | -74.1 | 170 | 0 | 0 | 0 | 112.1 | E284 D291 I292 | E284-L288 HydrophobicContact CG-CD1 4.12Å; E284-L288 WeakPolarHBondContact O-CB 3.26Å; E284-L288 WeakPolarHBondContact O-CG 3.42Å; E284-L288 PolarHBondContact O-N 2.94Å; L288-D291 WeakPolarHBondContact O-CB 3.45Å; L288-D291 PolarHBondContact O-N 3.15Å; L288-I292 WeakPolarHBondContact O-CB 3.37Å; L288-I292 WeakPolarHBondContact O-CD1 3.44Å; L288-I292 WeakPolarHBondContact O-CG1 3.29Å; L288-I292 PolarHBondContact O-N 3.31Å |
| 289 | S | 98.3 | Very high | 98.2 | Very high | 69 Ų | 69 | 95 Ų | 95 | 48% | 0.483 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.4 | -45.9 | 175.5 | -174.5 | 0 | 0 | 0 | 0 | 111.7 | S285 K286 L287 D291 I292 T293 | S285-S289 WeakPolarHBondContact O-CB 3.45Å; S285-S289 PolarHBondContact O-N 3.02Å; K286-S289 PolarHBondContact O-N 2.94Å; L287-S289 VanDerWaalsContact C-N 3.28Å; L287-S289 PolarHBondContact O-N 3.47Å; S289-D291 VanDerWaalsContact C-N 3.31Å; S289-D291 PolarHBondContact O-N 2.91Å; S289-I292 PolarHBondContact O-N 3.38Å; S289-T293 WeakPolarHBondContact O-CG2 3.42Å; S289-T293 PolarHBondContact O-N 3.43Å; S289-T293 PolarHBondContact O-OG1 2.95Å |
| 290 | S | 98.2 | Very high | 98.2 | Very high | 73 Ų | 73 | 92.9 Ų | 92.9 | 51% | 0.51 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64 | -37.3 | 176.2 | -173.1 | 0 | 0 | 0 | 0 | 112.2 | K286 L287 T293 S294 | K286-S290 PolarHBondContact O-N 3.41Å; L287-S290 WeakPolarHBondContact O-CB 3.34Å; L287-S290 PolarHBondContact O-N 2.88Å; L287-S290 VanDerWaalsContact O-N 3.12Å; S290-T293 WeakPolarHBondContact CA-OG1 3.39Å; S290-T293 PolarHBondContact O-N 2.86Å; S290-T293 PolarHBondContact O-OG1 2.71Å; S290-S294 WeakPolarHBondContact O-CB 3.27Å; S290-S294 PolarHBondContact O-N 3.3Å |
| 291 | D | 98.5 | Very high | 98.1 | Very high | 74 Ų | 74 | 95.4 Ų | 95.4 | 40% | 0.396 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.5 | -42 | 176.2 | -106.2 | 37.3 | 0 | 0 | 0 | 111.7 | L287 L288 S289 R295 | L287-D291 WeakPolarHBondContact O-CB 3.4Å; L287-D291 PolarHBondContact O-N 3.21Å; L288-D291 WeakPolarHBondContact O-CB 3.45Å; L288-D291 PolarHBondContact O-N 3.15Å; S289-D291 VanDerWaalsContact C-N 3.31Å; S289-D291 PolarHBondContact O-N 2.91Å; D291-R295 WeakPolarHBondContact O-CB 3.33Å; D291-R295 WeakPolarHBondContact O-CG 3.43Å; D291-R295 PolarHBondContact O-N 3.14Å; D291-R295 IonicContact OD2-CZ 3.49Å; D291-R295 IonicContact OD2-NH1 2.83Å; D291-R295 PolarHBondContact OD2-NH1 3.36Å; D291-R295 IonicContact OD2-NH2 2.81Å |
| 292 | I | 98.3 | Very high | 98.1 | Very high | 90 Ų | 90 | 94.3 Ų | 94.3 | 46% | 0.462 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.2 | -43 | 176.3 | -72.1 | 164.1 | 0 | 0 | 0 | 110.1 | L288 S289 R295 K296 | L288-I292 WeakPolarHBondContact O-CB 3.37Å; L288-I292 WeakPolarHBondContact O-CD1 3.44Å; L288-I292 WeakPolarHBondContact O-CG1 3.29Å; L288-I292 PolarHBondContact O-N 3.31Å; S289-I292 PolarHBondContact O-N 3.38Å; I292-R295 PolarHBondContact O-N 2.9Å; I292-K296 HydrophobicContact CG2-CD 4.11Å; I292-K296 HydrophobicContact CG2-CG 4.46Å; I292-K296 WeakPolarHBondContact O-CB 3.27Å; I292-K296 VanDerWaalsContact O-CG 3.29Å; I292-K296 WeakPolarHBondContact O-CG 3.38Å; I292-K296 PolarHBondContact O-N 3.49Å |
| 293 | T | 98.3 | Very high | 98.1 | Very high | 66 Ų | 66 | 97 Ų | 97 | 41% | 0.405 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.9 | -45.8 | 177.7 | 51.5 | 0 | 0 | 0 | 0 | 111.3 | S289 S290 R295 K296 E297 | S289-T293 WeakPolarHBondContact O-CG2 3.42Å; S289-T293 PolarHBondContact O-N 3.43Å; S289-T293 PolarHBondContact O-OG1 2.95Å; S290-T293 WeakPolarHBondContact CA-OG1 3.39Å; S290-T293 PolarHBondContact O-N 2.86Å; S290-T293 PolarHBondContact O-OG1 2.71Å; T293-R295 PolarHBondContact O-N 3.33Å; T293-K296 PolarHBondContact O-N 3.46Å; T293-E297 WeakPolarHBondContact O-CG 3.44Å; T293-E297 PolarHBondContact O-N 2.97Å |
| 294 | S | 98.3 | Very high | 98.1 | Very high | 63 Ų | 63 | 99.4 Ų | 99.4 | 44% | 0.441 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.7 | -45.2 | 176 | 175.6 | 0 | 0 | 0 | 0 | 112.4 | S290 K296 E297 M298 | S290-S294 WeakPolarHBondContact O-CB 3.27Å; S290-S294 PolarHBondContact O-N 3.3Å; S294-K296 PolarHBondContact O-N 2.87Å; S294-E297 PolarHBondContact O-N 2.93Å; S294-M298 PolarHBondContact O-N 3.22Å |
| 295 | R | 98.1 | Very high | 98.1 | Very high | 146 Ų | 146 | 101 Ų | 101 | 55% | 0.551 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.4 | -38.7 | 175.5 | -75.9 | 179.9 | 177.2 | 97.7 | 0.1 | 112.5 | D291 I292 T293 M298 L299 | D291-R295 WeakPolarHBondContact O-CB 3.33Å; D291-R295 WeakPolarHBondContact O-CG 3.43Å; D291-R295 PolarHBondContact O-N 3.14Å; D291-R295 IonicContact OD2-CZ 3.49Å; D291-R295 IonicContact OD2-NH1 2.83Å; D291-R295 PolarHBondContact OD2-NH1 3.36Å; D291-R295 IonicContact OD2-NH2 2.81Å; I292-R295 PolarHBondContact O-N 2.9Å; T293-R295 PolarHBondContact O-N 3.33Å; R295-M298 PolarHBondContact O-N 3.24Å; R295-L299 WeakPolarHBondContact O-CG 3.5Å; R295-L299 PolarHBondContact O-N 2.97Å |
| 296 | K | 98 | Very high | 98 | Very high | 134 Ų | 134 | 100.8 Ų | 100.8 | 58% | 0.583 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64 | -43.7 | 175.5 | -77.4 | 177.1 | 177 | -176.4 | 0 | 111.8 | I292 T293 S294 M298 L299 V300 | I292-K296 HydrophobicContact CG2-CD 4.11Å; I292-K296 HydrophobicContact CG2-CG 4.46Å; I292-K296 WeakPolarHBondContact O-CB 3.27Å; I292-K296 VanDerWaalsContact O-CG 3.29Å; I292-K296 WeakPolarHBondContact O-CG 3.38Å; I292-K296 PolarHBondContact O-N 3.49Å; T293-K296 PolarHBondContact O-N 3.46Å; S294-K296 PolarHBondContact O-N 2.87Å; K296-M298 VanDerWaalsContact C-N 3.3Å; K296-M298 PolarHBondContact O-N 2.95Å; K296-L299 PolarHBondContact O-N 2.83Å; K296-V300 WeakPolarHBondContact O-CG2 3.44Å; K296-V300 PolarHBondContact O-N 3.29Å |
| 297 | E | 98 | Very high | 98 | Very high | 122 Ų | 122 | 98.8 Ų | 98.8 | 57% | 0.57 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.3 | -40.3 | 175 | -71.3 | 170.8 | -166.6 | 0 | 0 | 111.8 | T293 S294 V300 K301 | T293-E297 WeakPolarHBondContact O-CG 3.44Å; T293-E297 PolarHBondContact O-N 2.97Å; S294-E297 PolarHBondContact O-N 2.93Å; E297-V300 PolarHBondContact O-N 2.91Å; E297-K301 WeakPolarHBondContact O-CG 3.43Å; E297-K301 PolarHBondContact O-N 2.93Å |
| 298 | M | 97.9 | Very high | 98 | Very high | 116 Ų | 116 | 98.9 Ų | 98.9 | 57% | 0.571 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65 | -41.1 | 174.9 | -174.4 | 178.9 | -68 | 0 | 0 | 112.2 | S294 R295 K296 V300 K301 I302 | S294-M298 PolarHBondContact O-N 3.22Å; R295-M298 PolarHBondContact O-N 3.24Å; K296-M298 VanDerWaalsContact C-N 3.3Å; K296-M298 PolarHBondContact O-N 2.95Å; M298-V300 PolarHBondContact O-N 2.98Å; M298-K301 PolarHBondContact O-N 3.41Å; M298-I302 HydrophobicContact CG-CD1 4.02Å; M298-I302 WeakPolarHBondContact O-CG1 3.38Å; M298-I302 PolarHBondContact O-N 2.88Å |
| 299 | L | 98.3 | Very high | 97.9 | Very high | 97 Ų | 97 | 97.2 Ų | 97.2 | 51% | 0.508 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 176 | -78.8 | 169.7 | 0 | 0 | 0 | 111.8 | R295 K296 K301 I302 E303 | R295-L299 WeakPolarHBondContact O-CG 3.5Å; R295-L299 PolarHBondContact O-N 2.97Å; K296-L299 PolarHBondContact O-N 2.83Å; L299-K301 VanDerWaalsContact C-N 3.32Å; L299-K301 PolarHBondContact O-N 3.22Å; L299-I302 PolarHBondContact O-N 3.11Å; L299-E303 WeakPolarHBondContact O-CG 3.38Å; L299-E303 PolarHBondContact O-N 2.67Å |
| 300 | V | 98.3 | Very high | 97.9 | Very high | 73 Ų | 73 | 99.8 Ų | 99.8 | 44% | 0.442 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.6 | -44.2 | 176.7 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | K296 E297 M298 I302 E303 E304 | K296-V300 WeakPolarHBondContact O-CG2 3.44Å; K296-V300 PolarHBondContact O-N 3.29Å; E297-V300 PolarHBondContact O-N 2.91Å; M298-V300 PolarHBondContact O-N 2.98Å; V300-I302 PolarHBondContact O-N 2.98Å; V300-E303 PolarHBondContact O-N 3.27Å; V300-E304 WeakPolarHBondContact O-CG 3.46Å; V300-E304 PolarHBondContact O-N 3.18Å |
| 301 | K | 98 | Very high | 97.8 | Very high | 126 Ų | 126 | 101.7 Ų | 101.7 | 55% | 0.548 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 176.6 | -69.6 | 174.9 | -177.9 | 175.8 | 0 | 112.5 | E297 M298 L299 E303 E304 E305 | E297-K301 WeakPolarHBondContact O-CG 3.43Å; E297-K301 PolarHBondContact O-N 2.93Å; M298-K301 PolarHBondContact O-N 3.41Å; L299-K301 VanDerWaalsContact C-N 3.32Å; L299-K301 PolarHBondContact O-N 3.22Å; K301-E303 VanDerWaalsContact C-N 3.34Å; K301-E304 PolarHBondContact O-N 2.92Å; K301-E305 WeakPolarHBondContact O-CB 3.13Å; K301-E305 WeakPolarHBondContact O-CG 3.33Å; K301-E305 PolarHBondContact O-N 3.06Å |
| 302 | I | 97.8 | Very high | 97.8 | Very high | 80 Ų | 80 | 103.1 Ų | 103.1 | 41% | 0.41 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.4 | -42 | 177 | -67.8 | 168.1 | 0 | 0 | 0 | 110.1 | M298 L299 V300 E304 E305 T306 | M298-I302 HydrophobicContact CG-CD1 4.02Å; M298-I302 WeakPolarHBondContact O-CG1 3.38Å; M298-I302 PolarHBondContact O-N 2.88Å; L299-I302 PolarHBondContact O-N 3.11Å; V300-I302 PolarHBondContact O-N 2.98Å; I302-E304 PolarHBondContact O-N 3.05Å; I302-E305 PolarHBondContact O-N 2.87Å; I302-T306 HydrophobicContact CG2-CG2 4.16Å; I302-T306 WeakPolarHBondContact O-CB 3.44Å; I302-T306 VanDerWaalsContact O-CG2 3.24Å; I302-T306 WeakPolarHBondContact O-CG2 3.3Å; I302-T306 PolarHBondContact O-N 3.46Å; I302-T306 PolarHBondContact O-OG1 2.87Å |
| 303 | E | 97.7 | Very high | 97.7 | Very high | 117 Ų | 117 | 106.5 Ų | 106.5 | 55% | 0.547 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.4 | -45.2 | 175.7 | -74.6 | 172.9 | -178.6 | 0 | 0 | 111.3 | L299 V300 K301 T306 L307 | L299-E303 WeakPolarHBondContact O-CG 3.38Å; L299-E303 PolarHBondContact O-N 2.67Å; V300-E303 PolarHBondContact O-N 3.27Å; K301-E303 VanDerWaalsContact C-N 3.34Å; E303-T306 WeakPolarHBondContact CA-OG1 3.49Å; E303-T306 PolarHBondContact O-N 2.88Å; E303-T306 PolarHBondContact O-OG1 3.26Å; E303-L307 PolarHBondContact O-N 3.36Å |
| 304 | E | 97.6 | Very high | 97.7 | Very high | 122 Ų | 122 | 105.7 Ų | 105.7 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60 | -47.7 | 174 | -71.2 | 172.1 | 176.8 | 0 | 0 | 112.2 | V300 K301 I302 T306 L307 Q308 | V300-E304 WeakPolarHBondContact O-CG 3.46Å; V300-E304 PolarHBondContact O-N 3.18Å; K301-E304 PolarHBondContact O-N 2.92Å; I302-E304 PolarHBondContact O-N 3.05Å; E304-T306 VanDerWaalsContact C-N 3.33Å; E304-T306 PolarHBondContact O-N 3.27Å; E304-L307 PolarHBondContact O-N 3.43Å; E304-Q308 PolarHBondContact O-N 2.98Å |
| 305 | E | 97.6 | Very high | 97.6 | Very high | 128 Ų | 128 | 108.6 Ų | 108.6 | 60% | 0.598 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.7 | -39.6 | 176.6 | -74.5 | 174.8 | -169.9 | 0 | 0 | 111.9 | K301 I302 Q308 A309 | K301-E305 WeakPolarHBondContact O-CB 3.13Å; K301-E305 WeakPolarHBondContact O-CG 3.33Å; K301-E305 PolarHBondContact O-N 3.06Å; I302-E305 PolarHBondContact O-N 2.87Å; E305-Q308 PolarHBondContact O-N 2.99Å; E305-A309 WeakPolarHBondContact O-CB 3.49Å; E305-A309 PolarHBondContact O-N 3.04Å |
| 306 | T | 97.3 | Very high | 97.5 | Very high | 71 Ų | 71 | 104.4 Ų | 104.4 | 44% | 0.436 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.9 | -42 | 177.6 | 56.3 | 0 | 0 | 0 | 0 | 112.2 | I302 E303 E304 Q308 A309 E310 | I302-T306 HydrophobicContact CG2-CG2 4.16Å; I302-T306 WeakPolarHBondContact O-CB 3.44Å; I302-T306 VanDerWaalsContact O-CG2 3.24Å; I302-T306 WeakPolarHBondContact O-CG2 3.3Å; I302-T306 PolarHBondContact O-N 3.46Å; I302-T306 PolarHBondContact O-OG1 2.87Å; E303-T306 WeakPolarHBondContact CA-OG1 3.49Å; E303-T306 PolarHBondContact O-N 2.88Å; E303-T306 PolarHBondContact O-OG1 3.26Å; E304-T306 VanDerWaalsContact C-N 3.33Å; E304-T306 PolarHBondContact O-N 3.27Å; T306-Q308 VanDerWaalsContact C-N 3.34Å; T306-Q308 PolarHBondContact O-N 3.47Å; T306-A309 PolarHBondContact O-N 3.32Å; T306-E310 WeakPolarHBondContact O-CG 3.3Å; T306-E310 PolarHBondContact O-N 3.45Å |
| 307 | L | 97.7 | Very high | 97.5 | Very high | 105 Ų | 105 | 101.6 Ų | 101.6 | 55% | 0.55 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.2 | -45.8 | 174 | -79.6 | 169.4 | 0 | 0 | 0 | 111 | E303 E304 A309 E310 E311 | E303-L307 PolarHBondContact O-N 3.36Å; E304-L307 PolarHBondContact O-N 3.43Å; L307-A309 PolarHBondContact O-N 3.28Å; L307-E310 PolarHBondContact O-N 3.31Å; L307-E311 PolarHBondContact O-N 2.84Å |
| 308 | Q | 97.4 | Very high | 97.4 | Very high | 114 Ų | 114 | 98.8 Ų | 98.8 | 53% | 0.533 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.4 | -44.8 | 177.1 | -175 | 174.6 | -12.2 | 0 | 0 | 111.7 | E304 E305 T306 E310 E311 E312 | E304-Q308 PolarHBondContact O-N 2.98Å; E305-Q308 PolarHBondContact O-N 2.99Å; T306-Q308 VanDerWaalsContact C-N 3.34Å; T306-Q308 PolarHBondContact O-N 3.47Å; Q308-E310 VanDerWaalsContact C-N 3.32Å; Q308-E310 PolarHBondContact O-N 2.96Å; Q308-E311 PolarHBondContact O-N 3.33Å; Q308-E312 PolarHBondContact NE2-OE1 3.04Å; Q308-E312 VanDerWaalsContact NE2-OE1 3.12Å; Q308-E312 WeakPolarHBondContact O-CG 3.49Å; Q308-E312 PolarHBondContact O-N 3.31Å |
| 309 | A | 97.6 | Very high | 97.3 | Very high | 55 Ų | 55 | 98 Ų | 98 | 46% | 0.455 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.7 | -37.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | E305 T306 L307 R313 | E305-A309 WeakPolarHBondContact O-CB 3.49Å; E305-A309 PolarHBondContact O-N 3.04Å; T306-A309 PolarHBondContact O-N 3.32Å; L307-A309 PolarHBondContact O-N 3.28Å; A309-R313 WeakPolarHBondContact O-CB 3.46Å; A309-R313 PolarHBondContact O-N 3.28Å |
| 310 | E | 97.5 | Very high | 97.2 | Very high | 123 Ų | 123 | 97 Ų | 97 | 58% | 0.575 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.9 | -42 | 174.4 | -76.8 | -171.9 | 166.2 | 0 | 0 | 112.3 | T306 L307 Q308 R313 A314 | T306-E310 WeakPolarHBondContact O-CG 3.3Å; T306-E310 PolarHBondContact O-N 3.45Å; L307-E310 PolarHBondContact O-N 3.31Å; Q308-E310 VanDerWaalsContact C-N 3.32Å; Q308-E310 PolarHBondContact O-N 2.96Å; E310-R313 PolarHBondContact O-N 2.76Å; E310-A314 WeakPolarHBondContact O-CB 3.3Å; E310-A314 PolarHBondContact O-N 2.87Å |
| 311 | E | 97.1 | Very high | 97.1 | Very high | 113 Ų | 113 | 101 Ų | 101 | 53% | 0.528 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.6 | -46.2 | 174.1 | -73.8 | -171.8 | -173.2 | 0 | 0 | 112 | L307 Q308 A314 K315 | L307-E311 PolarHBondContact O-N 2.84Å; Q308-E311 PolarHBondContact O-N 3.33Å; E311-A314 PolarHBondContact O-N 3.47Å; E311-K315 VanDerWaalsContact O-CG 3.3Å; E311-K315 WeakPolarHBondContact O-CG 3.3Å; E311-K315 PolarHBondContact O-N 3.4Å; E311-K315 IonicContact OE2-NZ 3.93Å; E311-K315 PolarHBondContact OE2-NZ 3.46Å |
| 312 | E | 97.2 | Very high | 96.9 | Very high | 105 Ų | 105 | 101.9 Ų | 101.9 | 49% | 0.491 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 177 | -73.1 | 178.6 | -168.8 | 0 | 0 | 111.2 | Q308 A314 K315 A316 | Q308-E312 PolarHBondContact NE2-OE1 3.04Å; Q308-E312 VanDerWaalsContact NE2-OE1 3.12Å; Q308-E312 WeakPolarHBondContact O-CG 3.49Å; Q308-E312 PolarHBondContact O-N 3.31Å; E312-A314 PolarHBondContact O-N 3.46Å; E312-K315 PolarHBondContact O-N 3.1Å; E312-A316 WeakPolarHBondContact O-CB 3.41Å; E312-A316 PolarHBondContact O-N 3.22Å |
| 313 | R | 97.3 | Very high | 96.7 | Very high | 160 Ų | 160 | 102.5 Ų | 102.5 | 60% | 0.604 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.1 | -46 | 172.7 | 178 | -173.2 | 163.6 | -163.1 | -7 | 111.3 | A309 E310 A316 E317 | A309-R313 WeakPolarHBondContact O-CB 3.46Å; A309-R313 PolarHBondContact O-N 3.28Å; E310-R313 PolarHBondContact O-N 2.76Å; R313-A316 PolarHBondContact O-N 3.09Å; R313-E317 HydrophobicContact CG-CG 4.37Å; R313-E317 IonicContact CZ-OE1 2.69Å; R313-E317 VanDerWaalsContact CZ-OE1 3.29Å; R313-E317 IonicContact NE-OE1 3.38Å; R313-E317 PolarHBondContact NE-OE1 2.96Å; R313-E317 IonicContact NH2-OE1 2.7Å; R313-E317 PolarHBondContact NH2-OE1 3.02Å; R313-E317 WeakPolarHBondContact O-CB 3.21Å; R313-E317 WeakPolarHBondContact O-CG 3.34Å; R313-E317 PolarHBondContact O-N 3.45Å |
| 314 | A | 97.4 | Very high | 96.5 | Very high | 49 Ų | 49 | 105.4 Ų | 105.4 | 41% | 0.405 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -42.7 | 179 | 0 | 0 | 0 | 0 | 0 | 111.9 | E310 E311 E312 E317 T318 | E310-A314 WeakPolarHBondContact O-CB 3.3Å; E310-A314 PolarHBondContact O-N 2.87Å; E311-A314 PolarHBondContact O-N 3.47Å; E312-A314 PolarHBondContact O-N 3.46Å; A314-E317 PolarHBondContact O-N 3.43Å; A314-T318 WeakPolarHBondContact O-CG2 3.47Å; A314-T318 PolarHBondContact O-N 3.29Å; A314-T318 PolarHBondContact O-OG1 3.05Å |
| 315 | K | 97.1 | Very high | 96.2 | Very high | 125 Ų | 125 | 101.1 Ų | 101.1 | 54% | 0.543 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.1 | -47 | 173 | -70.3 | 164 | -170 | 157.2 | 0 | 110.8 | E311 E312 T318 L319 | E311-K315 VanDerWaalsContact O-CG 3.3Å; E311-K315 WeakPolarHBondContact O-CG 3.3Å; E311-K315 PolarHBondContact O-N 3.4Å; E311-K315 IonicContact OE2-NZ 3.93Å; E311-K315 PolarHBondContact OE2-NZ 3.46Å; E312-K315 PolarHBondContact O-N 3.1Å; K315-T318 PolarHBondContact O-N 2.98Å; K315-T318 PolarHBondContact O-OG1 3.45Å; K315-L319 PolarHBondContact O-N 3.4Å; K315-L319 VanDerWaalsContact O-N 3.08Å |
| 316 | A | 96 | Very high | 95.8 | Very high | 57 Ų | 57 | 101 Ų | 101 | 47% | 0.471 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | E312 R313 L319 N320 | E312-A316 WeakPolarHBondContact O-CB 3.41Å; E312-A316 PolarHBondContact O-N 3.22Å; R313-A316 PolarHBondContact O-N 3.09Å; A316-L319 PolarHBondContact O-N 2.99Å; A316-N320 VanDerWaalsContact O-CB 3.28Å; A316-N320 WeakPolarHBondContact O-CB 3.28Å; A316-N320 PolarHBondContact O-N 2.87Å |
| 317 | E | 96.9 | Very high | 95.3 | Very high | 75 Ų | 75 | 104.1 Ų | 104.1 | 35% | 0.35 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.6 | -41.2 | 177.7 | -80 | -175.5 | -172.8 | 0 | 0 | 112.5 | R313 A314 N320 R321 | R313-E317 HydrophobicContact CG-CG 4.37Å; R313-E317 IonicContact CZ-OE1 2.69Å; R313-E317 VanDerWaalsContact CZ-OE1 3.29Å; R313-E317 IonicContact NE-OE1 3.38Å; R313-E317 PolarHBondContact NE-OE1 2.96Å; R313-E317 IonicContact NH2-OE1 2.7Å; R313-E317 PolarHBondContact NH2-OE1 3.02Å; R313-E317 WeakPolarHBondContact O-CB 3.21Å; R313-E317 WeakPolarHBondContact O-CG 3.34Å; R313-E317 PolarHBondContact O-N 3.45Å; A314-E317 PolarHBondContact O-N 3.43Å; E317-N320 PolarHBondContact O-N 3.27Å; E317-R321 WeakPolarHBondContact O-CB 3.47Å; E317-R321 PolarHBondContact O-N 3.36Å; E317-R321 IonicContact OE2-NH2 3.68Å |
| 318 | T | 96.5 | Very high | 94.7 | Very high | 63 Ų | 63 | 102.2 Ų | 102.2 | 39% | 0.387 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 176.1 | 58 | 0 | 0 | 0 | 0 | 111.4 | A314 K315 R321 K322 | A314-T318 WeakPolarHBondContact O-CG2 3.47Å; A314-T318 PolarHBondContact O-N 3.29Å; A314-T318 PolarHBondContact O-OG1 3.05Å; K315-T318 PolarHBondContact O-N 2.98Å; K315-T318 PolarHBondContact O-OG1 3.45Å; T318-R321 PolarHBondContact O-N 3.48Å; T318-K322 WeakPolarHBondContact O-CG 3.45Å; T318-K322 PolarHBondContact O-N 2.69Å |
| 319 | L | 96.3 | Very high | 94 | Very high | 100 Ų | 100 | 103.2 Ų | 103.2 | 52% | 0.524 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.2 | -46.9 | 173.8 | -177.8 | 64.5 | 0 | 0 | 0 | 111.4 | K315 A316 R321 K322 L323 | K315-L319 PolarHBondContact O-N 3.4Å; K315-L319 VanDerWaalsContact O-N 3.08Å; A316-L319 PolarHBondContact O-N 2.99Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 3.35Å; L319-K322 WeakPolarHBondContact O-CB 3.44Å; L319-K322 PolarHBondContact O-N 2.89Å; L319-K322 VanDerWaalsContact O-N 3.12Å; L319-L323 HydrophobicContact CG-CD1 4.19Å; L319-L323 WeakPolarHBondContact O-CG 3.33Å; L319-L323 PolarHBondContact O-N 3.49Å |
| 320 | N | 95.9 | Very high | 93.2 | Very high | 77 Ų | 77 | 107.1 Ų | 107.1 | 41% | 0.412 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61 | -41.7 | 178.5 | -163.1 | -36.5 | 0 | 0 | 0 | 111.2 | A316 E317 K322 L323 R324 | A316-N320 VanDerWaalsContact O-CB 3.28Å; A316-N320 WeakPolarHBondContact O-CB 3.28Å; A316-N320 PolarHBondContact O-N 2.87Å; E317-N320 PolarHBondContact O-N 3.27Å; N320-K322 PolarHBondContact O-N 3.13Å; N320-L323 PolarHBondContact O-N 2.82Å; N320-R324 WeakPolarHBondContact O-CB 3.29Å; N320-R324 WeakPolarHBondContact O-CG 3.18Å; N320-R324 PolarHBondContact O-N 2.95Å; N320-R324 PolarHBondContact OD1-NE 3.14Å; N320-R324 VanDerWaalsContact OD1-NE 3.17Å |
| 321 | R | 95.4 | Very high | 92.2 | Very high | 157 Ų | 157 | 110.9 Ų | 110.9 | 59% | 0.592 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -57.9 | -46 | 171.7 | -96.7 | 178.7 | -85.2 | 154.9 | -9.4 | 112.4 | E317 T318 L319 R324 G325 | E317-R321 WeakPolarHBondContact O-CB 3.47Å; E317-R321 PolarHBondContact O-N 3.36Å; E317-R321 IonicContact OE2-NH2 3.68Å; T318-R321 PolarHBondContact O-N 3.48Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 3.35Å; R321-R324 PolarHBondContact O-N 2.84Å; R321-G325 PolarHBondContact O-N 3.07Å |
| 322 | K | 94.4 | Very high | 90.9 | Very high | 143 Ų | 143 | 110.9 Ų | 110.9 | 62% | 0.622 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -60.4 | -48.1 | 176.4 | -72.4 | 174.2 | -178.1 | 178.7 | 0 | 111.6 | T318 L319 N320 R324 G325 Q326 | T318-K322 WeakPolarHBondContact O-CG 3.45Å; T318-K322 PolarHBondContact O-N 2.69Å; L319-K322 WeakPolarHBondContact O-CB 3.44Å; L319-K322 PolarHBondContact O-N 2.89Å; L319-K322 VanDerWaalsContact O-N 3.12Å; N320-K322 PolarHBondContact O-N 3.13Å; K322-R324 PolarHBondContact O-N 3.32Å; K322-G325 PolarHBondContact O-N 3.41Å; K322-Q326 WeakPolarHBondContact O-CG 3.4Å; K322-Q326 PolarHBondContact O-N 2.7Å |
| 323 | L | 93.1 | Very high | 89.6 | Confident | 93 Ų | 93 | 109 Ų | 109 | 49% | 0.487 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.9 | -42 | 179.1 | -68.6 | 174.1 | 0 | 0 | 0 | 111.8 | L319 N320 G325 Q326 L327 | L319-L323 HydrophobicContact CG-CD1 4.19Å; L319-L323 WeakPolarHBondContact O-CG 3.33Å; L319-L323 PolarHBondContact O-N 3.49Å; N320-L323 PolarHBondContact O-N 2.82Å; L323-G325 VanDerWaalsContact C-N 3.34Å; L323-Q326 PolarHBondContact O-N 3.34Å; L323-L327 WeakPolarHBondContact O-CB 3.45Å; L323-L327 PolarHBondContact O-N 3.48Å |
| 324 | R | 93.1 | Very high | 88.6 | Confident | 179 Ų | 179 | 108 Ų | 108 | 68% | 0.675 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63.1 | -39.3 | 173.8 | -75.9 | -177.5 | 179.6 | 178.4 | -0.5 | 112.4 | N320 R321 K322 L327 A328 | N320-R324 WeakPolarHBondContact O-CB 3.29Å; N320-R324 WeakPolarHBondContact O-CG 3.18Å; N320-R324 PolarHBondContact O-N 2.95Å; N320-R324 PolarHBondContact OD1-NE 3.14Å; N320-R324 VanDerWaalsContact OD1-NE 3.17Å; R321-R324 PolarHBondContact O-N 2.84Å; K322-R324 PolarHBondContact O-N 3.32Å; R324-L327 PolarHBondContact O-N 3.01Å; R324-A328 WeakPolarHBondContact O-CB 3.4Å; R324-A328 PolarHBondContact O-N 3.14Å |
| 325 | G | 90.7 | Very high | 87.8 | Confident | 32 Ų | 32 | 110.8 Ų | 110.8 | 33% | 0.33 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.8 | -51.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | R321 K322 L323 L327 A328 D329 | R321-G325 PolarHBondContact O-N 3.07Å; K322-G325 PolarHBondContact O-N 3.41Å; L323-G325 VanDerWaalsContact C-N 3.34Å; G325-L327 VanDerWaalsContact C-N 3.27Å; G325-L327 PolarHBondContact O-N 3.39Å; G325-A328 WeakPolarHBondContact O-CB 3.45Å; G325-A328 PolarHBondContact O-N 3.5Å; G325-A328 VanDerWaalsContact O-N 3.09Å; G325-D329 PolarHBondContact O-N 2.9Å |
| 326 | Q | 89.7 | Confident | 86.9 | Confident | 124 Ų | 124 | 111 Ų | 111 | 58% | 0.579 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -57.5 | -39.1 | 174.9 | -71.5 | 177.2 | -20.2 | 0 | 0 | 112.5 | K322 L323 D329 F330 | K322-Q326 WeakPolarHBondContact O-CG 3.4Å; K322-Q326 PolarHBondContact O-N 2.7Å; L323-Q326 PolarHBondContact O-N 3.34Å; Q326-D329 PolarHBondContact O-N 3.04Å; Q326-F330 VanDerWaalsContact O-CB 3.28Å; Q326-F330 WeakPolarHBondContact O-CB 3.45Å; Q326-F330 PolarHBondContact O-N 3.29Å |
| 327 | L | 87.4 | Confident | 86.2 | Confident | 138 Ų | 138 | 113.7 Ų | 113.7 | 72% | 0.723 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -68.4 | -35.9 | 177.3 | -156 | 100.2 | 0 | 0 | 0 | 112.3 | L323 R324 G325 F330 | L323-L327 WeakPolarHBondContact O-CB 3.45Å; L323-L327 PolarHBondContact O-N 3.48Å; R324-L327 PolarHBondContact O-N 3.01Å; G325-L327 VanDerWaalsContact C-N 3.27Å; G325-L327 PolarHBondContact O-N 3.39Å; L327-F330 PolarHBondContact O-N 2.97Å |
| 328 | A | 85.8 | Confident | 85.5 | Confident | 64 Ų | 64 | 116.7 Ų | 116.7 | 53% | 0.529 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.1 | -39 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | R324 G325 F330 | R324-A328 WeakPolarHBondContact O-CB 3.4Å; R324-A328 PolarHBondContact O-N 3.14Å; G325-A328 WeakPolarHBondContact O-CB 3.45Å; G325-A328 PolarHBondContact O-N 3.5Å; G325-A328 VanDerWaalsContact O-N 3.09Å; A328-F330 VanDerWaalsContact C-N 3.3Å |
| 329 | D | 82.3 | Confident | 84.9 | Confident | 135 Ų | 135 | 118.1 Ų | 118.1 | 72% | 0.722 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -75.2 | -21 | 175.8 | -65.6 | -22.6 | 0 | 0 | 0 | 112.3 | G325 Q326 R331 | G325-D329 PolarHBondContact O-N 2.9Å; Q326-D329 PolarHBondContact O-N 3.04Å; D329-R331 PolarHBondContact O-N 3.2Å |
| 330 | F | 79.5 | Confident | 84.4 | Confident | 138 Ų | 138 | 117.8 Ų | 117.8 | 61% | 0.605 | 58% | 0.583 | S | S | * | * | trans | -66.9 | 108.6 | 178.4 | -174.1 | -102.9 | 0 | 0 | 0 | 110.5 | Q326 L327 A328 V332 | Q326-F330 VanDerWaalsContact O-CB 3.28Å; Q326-F330 WeakPolarHBondContact O-CB 3.45Å; Q326-F330 PolarHBondContact O-N 3.29Å; L327-F330 PolarHBondContact O-N 2.97Å; A328-F330 VanDerWaalsContact C-N 3.3Å; F330-V332 HydrophobicContact CD1-CG2 4.24Å; F330-V332 HydrophobicContact CE1-CG2 3.49Å; F330-V332 VanDerWaalsContact CE1-CG2 3.49Å; F330-V332 HydrophobicContact CZ-CG2 4.13Å | ||
| 331 | R | 76.8 | Confident | 83.8 | Confident | 201 Ų | 201 | 116.6 Ų | 116.6 | 76% | 0.758 | 58% | 0.584 | S | S | * | * | trans | -108.5 | 122.1 | 169.4 | -70.9 | -71.9 | -170.6 | -107.2 | 1.8 | 108.1 | D329 P333 | D329-R331 PolarHBondContact O-N 3.2Å; R331-P333 WeakPolarHBondContact O-CD 3.28Å | ||
| 332 | V | 70.9 | Confident | 83.5 | Confident | 114 Ų | 114 | 114.3 Ų | 114.3 | 69% | 0.691 | 58% | 0.578 | S | S | * | * | trans | -69.4 | 114.3 | 170.2 | 179.7 | 0 | 0 | 0 | 0 | 107.3 | F330 | F330-V332 HydrophobicContact CD1-CG2 4.24Å; F330-V332 HydrophobicContact CE1-CG2 3.49Å; F330-V332 VanDerWaalsContact CE1-CG2 3.49Å; F330-V332 HydrophobicContact CZ-CG2 4.13Å | ||
| 333 | P | 69.3 | Low | 83.1 | Confident | 66 Ų | 66 | 109.8 Ų | 109.8 | 43% | 0.429 | 57% | 0.568 | S | S | . | * | trans | -62.1 | 141.9 | 175.8 | -18.4 | 32.3 | 0 | 0 | 0 | 109 | R331 V335 | R331-P333 WeakPolarHBondContact O-CD 3.28Å; P333-V335 PolarHBondContact O-N 2.69Å | ||
| 334 | Q | 76.3 | Confident | 82.8 | Confident | 138 Ų | 138 | 107.8 Ų | 107.8 | 65% | 0.645 | 56% | 0.562 | S | S | * | * | trans | -56.3 | 134.4 | 176.7 | -160.1 | 170 | 20.8 | 0 | 0 | 109 | L336 Q337 Y338 | Q334-L336 PolarHBondContact O-N 3.09Å; Q334-Q337 HydrophobicContact CB-CG 4.32Å; Q334-Q337 WeakPolarHBondContact O-CA 3.27Å; Q334-Q337 WeakPolarHBondContact O-CB 3.44Å; Q334-Q337 PolarHBondContact O-N 3.41Å; Q334-Y338 PolarHBondContact O-N 3.24Å; Q334-Y338 VanDerWaalsContact O-N 3.11Å | ||
| 335 | V | 79.6 | Confident | 82.5 | Confident | 107 Ų | 107 | 103.3 Ų | 103.3 | 65% | 0.648 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -47.7 | -41.3 | -167.7 | 177.5 | 0 | 0 | 0 | 0 | 112.7 | P333 Y338 I339 | P333-V335 PolarHBondContact O-N 2.69Å; V335-Y338 PolarHBondContact O-N 2.92Å; V335-I339 HydrophobicContact CG1-CD1 3.85Å; V335-I339 WeakPolarHBondContact O-CD1 3.27Å; V335-I339 VanDerWaalsContact O-CG1 3.27Å; V335-I339 WeakPolarHBondContact O-CG1 3.44Å; V335-I339 PolarHBondContact O-N 2.83Å; V335-I339 VanDerWaalsContact O-N 3.08Å |
| 336 | L | 79.3 | Confident | 82.5 | Confident | 129 Ų | 129 | 104.1 Ų | 104.1 | 68% | 0.675 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.5 | -40.9 | 177.2 | -72.8 | 167.9 | 0 | 0 | 0 | 113.4 | Q334 Y338 I339 T340 | Q334-L336 PolarHBondContact O-N 3.09Å; L336-Y338 VanDerWaalsContact C-N 3.34Å; L336-I339 PolarHBondContact O-N 2.68Å; L336-T340 WeakPolarHBondContact O-CG2 3.31Å; L336-T340 PolarHBondContact O-N 2.98Å; L336-T340 PolarHBondContact O-OG1 3.35Å |
| 337 | Q | 80.6 | Confident | 82.4 | Confident | 115 Ų | 115 | 104.4 Ų | 104.4 | 54% | 0.537 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.7 | -35.7 | 176.8 | -65.4 | 179.5 | -7.2 | 0 | 0 | 111.9 | Q334 T340 A341 | Q334-Q337 HydrophobicContact CB-CG 4.32Å; Q334-Q337 WeakPolarHBondContact O-CA 3.27Å; Q334-Q337 WeakPolarHBondContact O-CB 3.44Å; Q334-Q337 PolarHBondContact O-N 3.41Å; Q337-T340 WeakPolarHBondContact CA-OG1 3.37Å; Q337-T340 PolarHBondContact O-OG1 2.89Å; Q337-T340 VanDerWaalsContact O-OG1 3.07Å; Q337-A341 WeakPolarHBondContact O-CB 3.47Å; Q337-A341 PolarHBondContact O-N 3.48Å |
| 338 | Y | 82.8 | Confident | 82.5 | Confident | 137 Ų | 137 | 102.8 Ų | 102.8 | 54% | 0.537 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.5 | -44.3 | 174.7 | -179.5 | -98.8 | 0 | 0 | 0 | 111.7 | Q334 V335 L336 A341 K342 | Q334-Y338 PolarHBondContact O-N 3.24Å; Q334-Y338 VanDerWaalsContact O-N 3.11Å; V335-Y338 PolarHBondContact O-N 2.92Å; L336-Y338 VanDerWaalsContact C-N 3.34Å; Y338-A341 PolarHBondContact O-N 3.05Å; Y338-K342 VanDerWaalsContact O-CB 3.27Å; Y338-K342 WeakPolarHBondContact O-CB 3.15Å; Y338-K342 PolarHBondContact O-N 2.98Å |
| 339 | I | 84.9 | Confident | 82.7 | Confident | 94 Ų | 94 | 103.7 Ų | 103.7 | 48% | 0.482 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 179.1 | -68 | 165.3 | 0 | 0 | 0 | 110.7 | V335 L336 K342 A343 | V335-I339 HydrophobicContact CG1-CD1 3.85Å; V335-I339 WeakPolarHBondContact O-CD1 3.27Å; V335-I339 VanDerWaalsContact O-CG1 3.27Å; V335-I339 WeakPolarHBondContact O-CG1 3.44Å; V335-I339 PolarHBondContact O-N 2.83Å; V335-I339 VanDerWaalsContact O-N 3.08Å; L336-I339 PolarHBondContact O-N 2.68Å; I339-K342 PolarHBondContact O-N 3.44Å; I339-A343 WeakPolarHBondContact O-CB 3.21Å; I339-A343 PolarHBondContact O-N 2.9Å |
| 340 | T | 84.6 | Confident | 83.1 | Confident | 92 Ų | 92 | 103 Ų | 103 | 56% | 0.564 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.9 | -42.1 | 178.8 | 55 | 0 | 0 | 0 | 0 | 112 | L336 Q337 A343 S344 | L336-T340 WeakPolarHBondContact O-CG2 3.31Å; L336-T340 PolarHBondContact O-N 2.98Å; L336-T340 PolarHBondContact O-OG1 3.35Å; Q337-T340 WeakPolarHBondContact CA-OG1 3.37Å; Q337-T340 PolarHBondContact O-OG1 2.89Å; Q337-T340 VanDerWaalsContact O-OG1 3.07Å; T340-A343 PolarHBondContact O-N 3.49Å; T340-S344 PolarHBondContact O-N 2.91Å; T340-S344 PolarHBondContact O-OG 3.11Å |
| 341 | A | 84.3 | Confident | 83.5 | Confident | 53 Ų | 53 | 98.5 Ų | 98.5 | 44% | 0.438 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.7 | -35.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q337 Y338 S344 H345 | Q337-A341 WeakPolarHBondContact O-CB 3.47Å; Q337-A341 PolarHBondContact O-N 3.48Å; Y338-A341 PolarHBondContact O-N 3.05Å; A341-S344 WeakPolarHBondContact CA-OG 3.44Å; A341-S344 PolarHBondContact O-OG 3.01Å; A341-H345 VanDerWaalsContact O-CB 3.25Å; A341-H345 WeakPolarHBondContact O-CB 3.35Å; A341-H345 PolarHBondContact O-N 3.21Å |
| 342 | K | 88 | Confident | 84.1 | Confident | 108 Ų | 108 | 92.4 Ų | 92.4 | 47% | 0.47 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -72.3 | -38.3 | 176.5 | -170.9 | 64.5 | 178.4 | 176.9 | 0 | 111.8 | Y338 I339 H345 S346 | Y338-K342 VanDerWaalsContact O-CB 3.27Å; Y338-K342 WeakPolarHBondContact O-CB 3.15Å; Y338-K342 PolarHBondContact O-N 2.98Å; I339-K342 PolarHBondContact O-N 3.44Å; K342-H345 PolarHBondContact O-N 2.71Å; K342-S346 PolarHBondContact O-N 3.44Å |
| 343 | A | 86.1 | Confident | 85 | Confident | 48 Ų | 48 | 94 Ų | 94 | 40% | 0.397 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.3 | -46.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | I339 T340 H345 S346 Q347 | I339-A343 WeakPolarHBondContact O-CB 3.21Å; I339-A343 PolarHBondContact O-N 2.9Å; T340-A343 PolarHBondContact O-N 3.49Å; A343-H345 PolarHBondContact O-N 2.92Å; A343-S346 PolarHBondContact O-N 3.33Å; A343-Q347 WeakPolarHBondContact O-CG 3.27Å; A343-Q347 PolarHBondContact O-N 3.36Å |
| 344 | S | 86.2 | Confident | 85.9 | Confident | 51 Ų | 51 | 92.4 Ų | 92.4 | 36% | 0.357 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.4 | -38.1 | 176.5 | 69 | 0 | 0 | 0 | 0 | 112.1 | T340 A341 Q347 L348 | T340-S344 PolarHBondContact O-N 2.91Å; T340-S344 PolarHBondContact O-OG 3.11Å; A341-S344 WeakPolarHBondContact CA-OG 3.44Å; A341-S344 PolarHBondContact O-OG 3.01Å; S344-Q347 PolarHBondContact O-N 3.2Å; S344-L348 WeakPolarHBondContact O-CB 3.27Å; S344-L348 WeakPolarHBondContact O-CG 3.41Å; S344-L348 PolarHBondContact O-N 2.89Å |
| 345 | H | 88.6 | Confident | 86.5 | Confident | 85 Ų | 85 | 93.3 Ų | 93.3 | 39% | 0.394 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.6 | -44.9 | 173.2 | -179.2 | 72.2 | 0 | 0 | 0 | 112 | A341 K342 A343 Q347 L348 E349 | A341-H345 VanDerWaalsContact O-CB 3.25Å; A341-H345 WeakPolarHBondContact O-CB 3.35Å; A341-H345 PolarHBondContact O-N 3.21Å; K342-H345 PolarHBondContact O-N 2.71Å; A343-H345 PolarHBondContact O-N 2.92Å; H345-Q347 VanDerWaalsContact C-N 3.33Å; H345-Q347 PolarHBondContact O-N 3.34Å; H345-L348 CarbonylContact O-C 3.58Å; H345-L348 PolarHBondContact O-N 3.32Å; H345-E349 IonicContact NE2-OE1 2.76Å; H345-E349 PolarHBondContact NE2-OE1 3.34Å; H345-E349 WeakPolarHBondContact O-CG 3.38Å; H345-E349 PolarHBondContact O-N 3.4Å |
| 346 | S | 90.3 | Very high | 86.9 | Confident | 49 Ų | 49 | 93.7 Ų | 93.7 | 34% | 0.343 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.6 | -37.7 | 176.7 | -170.4 | 0 | 0 | 0 | 0 | 112.3 | K342 A343 E349 Q350 | K342-S346 PolarHBondContact O-N 3.44Å; A343-S346 PolarHBondContact O-N 3.33Å; S346-E349 PolarHBondContact O-N 3.04Å; S346-Q350 VanDerWaalsContact O-CG 3.3Å; S346-Q350 WeakPolarHBondContact O-CG 3.46Å; S346-Q350 PolarHBondContact O-N 2.96Å |
| 347 | Q | 87.3 | Confident | 87.3 | Confident | 131 Ų | 131 | 94.5 Ų | 94.5 | 61% | 0.612 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -64.6 | -41 | 173.2 | -72.6 | 173.3 | -9.3 | 0 | 0 | 112 | A343 S344 H345 Q350 S351 | A343-Q347 WeakPolarHBondContact O-CG 3.27Å; A343-Q347 PolarHBondContact O-N 3.36Å; S344-Q347 PolarHBondContact O-N 3.2Å; H345-Q347 VanDerWaalsContact C-N 3.33Å; H345-Q347 PolarHBondContact O-N 3.34Å; Q347-Q350 PolarHBondContact O-N 2.9Å; Q347-S351 WeakPolarHBondContact O-CB 3.5Å; Q347-S351 PolarHBondContact O-N 3.11Å |
| 348 | L | 88.8 | Confident | 87.7 | Confident | 104 Ų | 104 | 94.6 Ų | 94.6 | 55% | 0.545 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66.3 | -41.1 | 174.3 | -81.5 | 158.2 | 0 | 0 | 0 | 111.8 | S344 H345 Q350 S351 V352 | S344-L348 WeakPolarHBondContact O-CB 3.27Å; S344-L348 WeakPolarHBondContact O-CG 3.41Å; S344-L348 PolarHBondContact O-N 2.89Å; H345-L348 CarbonylContact O-C 3.58Å; H345-L348 PolarHBondContact O-N 3.32Å; L348-Q350 VanDerWaalsContact C-N 3.33Å; L348-Q350 PolarHBondContact O-N 3.35Å; L348-S351 WeakPolarHBondContact CA-OG 3.44Å; L348-S351 PolarHBondContact O-N 3.47Å; L348-S351 PolarHBondContact O-OG 3.43Å; L348-V352 WeakPolarHBondContact O-CB 3.46Å; L348-V352 VanDerWaalsContact O-CG2 3.27Å; L348-V352 WeakPolarHBondContact O-CG2 3.47Å; L348-V352 PolarHBondContact O-N 3.38Å |
| 349 | E | 91.4 | Very high | 87.9 | Confident | 82 Ų | 82 | 91.4 Ų | 91.4 | 38% | 0.383 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.9 | -41.5 | 173.5 | -76.9 | -175.5 | 140.3 | 0 | 0 | 111.5 | H345 S346 S351 V352 R353 | H345-E349 IonicContact NE2-OE1 2.76Å; H345-E349 PolarHBondContact NE2-OE1 3.34Å; H345-E349 WeakPolarHBondContact O-CG 3.38Å; H345-E349 PolarHBondContact O-N 3.4Å; S346-E349 PolarHBondContact O-N 3.04Å; E349-S351 VanDerWaalsContact C-N 3.33Å; E349-V352 PolarHBondContact O-N 3.26Å; E349-R353 WeakPolarHBondContact O-CB 3.44Å; E349-R353 VanDerWaalsContact O-CG 3.32Å; E349-R353 WeakPolarHBondContact O-CG 3.5Å; E349-R353 PolarHBondContact O-N 3.06Å |
| 350 | Q | 89.8 | Confident | 87.9 | Confident | 121 Ų | 121 | 92.9 Ų | 92.9 | 57% | 0.565 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -64.7 | -38.7 | 174.9 | -73.8 | 176.1 | 23.1 | 0 | 0 | 111.9 | S346 Q347 L348 A354 | S346-Q350 VanDerWaalsContact O-CG 3.3Å; S346-Q350 WeakPolarHBondContact O-CG 3.46Å; S346-Q350 PolarHBondContact O-N 2.96Å; Q347-Q350 PolarHBondContact O-N 2.9Å; L348-Q350 VanDerWaalsContact C-N 3.33Å; L348-Q350 PolarHBondContact O-N 3.35Å; Q350-A354 VanDerWaalsContact O-CB 3.28Å; Q350-A354 WeakPolarHBondContact O-CB 3.4Å; Q350-A354 PolarHBondContact O-N 3.1Å |
| 351 | S | 88.2 | Confident | 87.9 | Confident | 44 Ų | 44 | 94.2 Ų | 94.2 | 31% | 0.308 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -70.1 | -41.3 | 177.2 | 79 | 0 | 0 | 0 | 0 | 111.4 | Q347 L348 E349 A354 W355 | Q347-S351 WeakPolarHBondContact O-CB 3.5Å; Q347-S351 PolarHBondContact O-N 3.11Å; L348-S351 WeakPolarHBondContact CA-OG 3.44Å; L348-S351 PolarHBondContact O-N 3.47Å; L348-S351 PolarHBondContact O-OG 3.43Å; E349-S351 VanDerWaalsContact C-N 3.33Å; S351-A354 CarbonylContact O-C 3.55Å; S351-A354 WeakPolarHBondContact O-CB 3.36Å; S351-A354 PolarHBondContact O-N 3.49Å; S351-A354 VanDerWaalsContact O-N 3.14Å; S351-W355 WeakPolarHBondContact O-CB 3.4Å; S351-W355 PolarHBondContact O-N 3.27Å |
| 352 | V | 89.9 | Confident | 87.7 | Confident | 72 Ų | 72 | 95 Ų | 95 | 44% | 0.436 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -57.6 | -51.1 | 171.5 | 169.2 | 0 | 0 | 0 | 0 | 109.8 | L348 E349 A354 W355 E356 | L348-V352 WeakPolarHBondContact O-CB 3.46Å; L348-V352 VanDerWaalsContact O-CG2 3.27Å; L348-V352 WeakPolarHBondContact O-CG2 3.47Å; L348-V352 PolarHBondContact O-N 3.38Å; E349-V352 PolarHBondContact O-N 3.26Å; V352-A354 PolarHBondContact O-N 2.87Å; V352-W355 CarbonylContact O-C 3.57Å; V352-W355 PolarHBondContact O-N 3.45Å; V352-W355 VanDerWaalsContact O-N 3.08Å; V352-E356 HydrophobicContact CG1-CG 4.24Å; V352-E356 WeakPolarHBondContact O-CB 3.18Å; V352-E356 WeakPolarHBondContact O-CG 3.47Å; V352-E356 PolarHBondContact O-N 3.35Å |
| 353 | R | 89.4 | Confident | 87.4 | Confident | 147 Ų | 147 | 94.5 Ų | 94.5 | 56% | 0.555 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62 | -30.5 | 176 | -72.1 | 179.7 | -171.1 | 175.5 | 6.2 | 113.6 | E349 E356 R357 | E349-R353 WeakPolarHBondContact O-CB 3.44Å; E349-R353 VanDerWaalsContact O-CG 3.32Å; E349-R353 WeakPolarHBondContact O-CG 3.5Å; E349-R353 PolarHBondContact O-N 3.06Å; R353-E356 WeakPolarHBondContact CA-OE2 3.23Å; R353-R357 WeakPolarHBondContact O-CB 3.28Å; R353-R357 WeakPolarHBondContact O-CG 3.25Å; R353-R357 PolarHBondContact O-N 3.31Å; R353-R357 PolarHBondContact O-NE 2.72Å |
| 354 | A | 88.1 | Confident | 87.2 | Confident | 34 Ų | 34 | 97.5 Ų | 97.5 | 28% | 0.281 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -74.1 | -38.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q350 S351 V352 R357 K358 | Q350-A354 VanDerWaalsContact O-CB 3.28Å; Q350-A354 WeakPolarHBondContact O-CB 3.4Å; Q350-A354 PolarHBondContact O-N 3.1Å; S351-A354 CarbonylContact O-C 3.55Å; S351-A354 WeakPolarHBondContact O-CB 3.36Å; S351-A354 PolarHBondContact O-N 3.49Å; S351-A354 VanDerWaalsContact O-N 3.14Å; V352-A354 PolarHBondContact O-N 2.87Å; A354-R357 PolarHBondContact O-N 3.26Å; A354-K358 WeakPolarHBondContact O-CG 3.31Å; A354-K358 PolarHBondContact O-N 2.86Å |
| 355 | W | 88.3 | Confident | 86.9 | Confident | 156 Ų | 156 | 97 Ų | 97 | 59% | 0.591 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -70.5 | -41.8 | 174.7 | -79.3 | 114.5 | 0 | 0 | 0 | 112 | S351 V352 R357 K358 V359 | S351-W355 WeakPolarHBondContact O-CB 3.4Å; S351-W355 PolarHBondContact O-N 3.27Å; V352-W355 CarbonylContact O-C 3.57Å; V352-W355 PolarHBondContact O-N 3.45Å; V352-W355 VanDerWaalsContact O-N 3.08Å; W355-R357 VanDerWaalsContact C-N 3.3Å; W355-R357 PolarHBondContact O-N 3.41Å; W355-K358 HydrophobicContact CD2-CD 4.35Å; W355-K358 HydrophobicContact CE3-CB 4.31Å; W355-K358 HydrophobicContact CE3-CD 3.85Å; W355-K358 HydrophobicContact CZ3-CD 3.99Å; W355-K358 CarbonylContact O-C 3.57Å; W355-K358 PolarHBondContact O-N 2.95Å; W355-K358 VanDerWaalsContact O-N 3.07Å; W355-V359 WeakPolarHBondContact O-CB 3.1Å; W355-V359 VanDerWaalsContact O-CG2 3.3Å; W355-V359 WeakPolarHBondContact O-CG2 3.39Å; W355-V359 PolarHBondContact O-N 3.05Å |
| 356 | E | 87.4 | Confident | 86.6 | Confident | 116 Ų | 116 | 98.6 Ų | 98.6 | 54% | 0.542 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -54 | -48.7 | 170 | -74.6 | 171.8 | 164.7 | 0 | 0 | 110.1 | V352 R353 K358 V359 E360 | V352-E356 HydrophobicContact CG1-CG 4.24Å; V352-E356 WeakPolarHBondContact O-CB 3.18Å; V352-E356 WeakPolarHBondContact O-CG 3.47Å; V352-E356 PolarHBondContact O-N 3.35Å; R353-E356 WeakPolarHBondContact CA-OE2 3.23Å; E356-K358 PolarHBondContact O-N 2.92Å; E356-V359 PolarHBondContact O-N 3.2Å; E356-E360 VanDerWaalsContact O-CB 3.32Å; E356-E360 WeakPolarHBondContact O-CB 3.23Å; E356-E360 PolarHBondContact O-N 3.11Å |
| 357 | R | 88.2 | Confident | 86.2 | Confident | 146 Ų | 146 | 101.5 Ų | 101.5 | 55% | 0.551 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62 | -39.9 | 173.7 | -82.1 | 179.2 | -76.1 | 157.1 | -6.6 | 113.4 | R353 A354 W355 E360 I361 | R353-R357 WeakPolarHBondContact O-CB 3.28Å; R353-R357 WeakPolarHBondContact O-CG 3.25Å; R353-R357 PolarHBondContact O-N 3.31Å; R353-R357 PolarHBondContact O-NE 2.72Å; A354-R357 PolarHBondContact O-N 3.26Å; W355-R357 VanDerWaalsContact C-N 3.3Å; W355-R357 PolarHBondContact O-N 3.41Å; R357-E360 PolarHBondContact O-N 3.17Å; R357-I361 WeakPolarHBondContact O-CB 3.28Å; R357-I361 WeakPolarHBondContact O-CD1 3.32Å; R357-I361 WeakPolarHBondContact O-CG1 3.4Å; R357-I361 PolarHBondContact O-N 3.03Å |
| 358 | K | 88.4 | Confident | 85.8 | Confident | 116 Ų | 116 | 99 Ų | 99 | 50% | 0.504 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.6 | -40.8 | 176.8 | -78.1 | 177.2 | 179.5 | -174.4 | 0 | 111.8 | A354 W355 E356 I361 S362 | A354-K358 WeakPolarHBondContact O-CG 3.31Å; A354-K358 PolarHBondContact O-N 2.86Å; W355-K358 HydrophobicContact CD2-CD 4.35Å; W355-K358 HydrophobicContact CE3-CB 4.31Å; W355-K358 HydrophobicContact CE3-CD 3.85Å; W355-K358 HydrophobicContact CZ3-CD 3.99Å; W355-K358 CarbonylContact O-C 3.57Å; W355-K358 PolarHBondContact O-N 2.95Å; W355-K358 VanDerWaalsContact O-N 3.07Å; E356-K358 PolarHBondContact O-N 2.92Å; K358-I361 PolarHBondContact O-N 3.02Å; K358-S362 WeakPolarHBondContact O-CB 3.37Å; K358-S362 PolarHBondContact O-N 3.46Å; K358-S362 PolarHBondContact O-OG 2.93Å |
| 359 | V | 87.9 | Confident | 85.3 | Confident | 70 Ų | 70 | 100.2 Ų | 100.2 | 42% | 0.424 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62 | -47.4 | 174.1 | 170.4 | 0 | 0 | 0 | 0 | 109 | W355 E356 I361 S362 E363 | W355-V359 WeakPolarHBondContact O-CB 3.1Å; W355-V359 VanDerWaalsContact O-CG2 3.3Å; W355-V359 WeakPolarHBondContact O-CG2 3.39Å; W355-V359 PolarHBondContact O-N 3.05Å; E356-V359 PolarHBondContact O-N 3.2Å; V359-I361 PolarHBondContact O-N 3.34Å; V359-S362 WeakPolarHBondContact CA-OG 3.35Å; V359-S362 CarbonylContact O-C 3.59Å; V359-S362 PolarHBondContact O-N 3.42Å; V359-S362 VanDerWaalsContact O-N 3.16Å; V359-S362 PolarHBondContact O-OG 3.47Å; V359-S362 VanDerWaalsContact O-OG 3.09Å; V359-E363 HydrophobicContact CG1-CG 4.24Å; V359-E363 WeakPolarHBondContact O-CB 3.45Å; V359-E363 WeakPolarHBondContact O-CG 3.37Å; V359-E363 PolarHBondContact O-N 3.37Å |
| 360 | E | 85.8 | Confident | 84.5 | Confident | 126 Ų | 126 | 99.6 Ų | 99.6 | 59% | 0.589 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.6 | -43.8 | 177.4 | -158.8 | 174.1 | -151.8 | 0 | 0 | 112 | E356 R357 E363 M364 | E356-E360 VanDerWaalsContact O-CB 3.32Å; E356-E360 WeakPolarHBondContact O-CB 3.23Å; E356-E360 PolarHBondContact O-N 3.11Å; R357-E360 PolarHBondContact O-N 3.17Å; E360-E363 PolarHBondContact O-N 2.69Å; E360-M364 WeakPolarHBondContact O-CB 3.23Å; E360-M364 WeakPolarHBondContact O-CG 3.45Å; E360-M364 PolarHBondContact O-N 3.26Å |
| 361 | I | 84.4 | Confident | 84 | Confident | 120 Ų | 120 | 100.7 Ų | 100.7 | 62% | 0.615 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.6 | -42.6 | 174.5 | -69.2 | 163.7 | 0 | 0 | 0 | 111.5 | R357 K358 V359 M364 A365 | R357-I361 WeakPolarHBondContact O-CB 3.28Å; R357-I361 WeakPolarHBondContact O-CD1 3.32Å; R357-I361 WeakPolarHBondContact O-CG1 3.4Å; R357-I361 PolarHBondContact O-N 3.03Å; K358-I361 PolarHBondContact O-N 3.02Å; V359-I361 PolarHBondContact O-N 3.34Å; I361-M364 PolarHBondContact O-N 3.35Å; I361-A365 VanDerWaalsContact O-CB 3.32Å; I361-A365 WeakPolarHBondContact O-CB 3.38Å; I361-A365 PolarHBondContact O-N 3.43Å |
| 362 | S | 79 | Confident | 83.4 | Confident | 68 Ų | 68 | 101.5 Ų | 101.5 | 48% | 0.476 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -73.9 | -32.8 | -179.4 | 44.4 | 0 | 0 | 0 | 0 | 112.6 | K358 V359 A365 L366 | K358-S362 WeakPolarHBondContact O-CB 3.37Å; K358-S362 PolarHBondContact O-N 3.46Å; K358-S362 PolarHBondContact O-OG 2.93Å; V359-S362 WeakPolarHBondContact CA-OG 3.35Å; V359-S362 CarbonylContact O-C 3.59Å; V359-S362 PolarHBondContact O-N 3.42Å; V359-S362 VanDerWaalsContact O-N 3.16Å; V359-S362 PolarHBondContact O-OG 3.47Å; V359-S362 VanDerWaalsContact O-OG 3.09Å; S362-A365 PolarHBondContact O-N 3.29Å; S362-L366 VanDerWaalsContact O-CB 3.23Å; S362-L366 WeakPolarHBondContact O-CB 3.32Å; S362-L366 PolarHBondContact O-N 2.86Å |
| 363 | E | 82.9 | Confident | 82.4 | Confident | 98 Ų | 98 | 106 Ų | 106 | 46% | 0.458 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 167.8 | -75.9 | -177.6 | -178.7 | 0 | 0 | 111.3 | V359 E360 L366 K367 | V359-E363 HydrophobicContact CG1-CG 4.24Å; V359-E363 WeakPolarHBondContact O-CB 3.45Å; V359-E363 WeakPolarHBondContact O-CG 3.37Å; V359-E363 PolarHBondContact O-N 3.37Å; E360-E363 PolarHBondContact O-N 2.69Å; E363-L366 PolarHBondContact O-N 3.45Å; E363-K367 WeakPolarHBondContact O-CB 3.49Å; E363-K367 VanDerWaalsContact O-CG 3.25Å; E363-K367 WeakPolarHBondContact O-CG 3.42Å; E363-K367 PolarHBondContact O-N 2.86Å |
| 364 | M | 81.4 | Confident | 81.6 | Confident | 112 Ų | 112 | 103.1 Ų | 103.1 | 55% | 0.552 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.6 | -39.6 | 175.5 | -72.4 | -65.6 | -75.7 | 0 | 0 | 112 | E360 I361 K367 T368 | E360-M364 WeakPolarHBondContact O-CB 3.23Å; E360-M364 WeakPolarHBondContact O-CG 3.45Å; E360-M364 PolarHBondContact O-N 3.26Å; I361-M364 PolarHBondContact O-N 3.35Å; M364-K367 PolarHBondContact O-N 3.46Å; M364-K367 HydrophobicContact SD-CD 4.34Å; M364-T368 WeakPolarHBondContact O-CB 3.37Å; M364-T368 PolarHBondContact O-N 2.8Å; M364-T368 PolarHBondContact O-OG1 2.87Å |
| 365 | A | 79.5 | Confident | 80.7 | Confident | 39 Ų | 39 | 108.5 Ų | 108.5 | 32% | 0.322 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.8 | -44.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | I361 S362 K367 T368 H369 | I361-A365 VanDerWaalsContact O-CB 3.32Å; I361-A365 WeakPolarHBondContact O-CB 3.38Å; I361-A365 PolarHBondContact O-N 3.43Å; S362-A365 PolarHBondContact O-N 3.29Å; A365-K367 PolarHBondContact O-N 3.36Å; A365-T368 CarbonylContact O-C 3.57Å; A365-T368 WeakPolarHBondContact O-CB 3.33Å; A365-T368 PolarHBondContact O-N 3.3Å; A365-T368 VanDerWaalsContact O-N 3.1Å; A365-H369 WeakPolarHBondContact O-CB 3.5Å; A365-H369 PolarHBondContact O-CD2 3.36Å; A365-H369 PolarHBondContact O-N 3.44Å |
| 366 | L | 81.6 | Confident | 79.6 | Confident | 119 Ų | 119 | 106.5 Ų | 106.5 | 62% | 0.623 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.8 | -46.1 | 175 | -175.1 | 75.1 | 0 | 0 | 0 | 110.7 | S362 E363 T368 H369 T370 | S362-L366 VanDerWaalsContact O-CB 3.23Å; S362-L366 WeakPolarHBondContact O-CB 3.32Å; S362-L366 PolarHBondContact O-N 2.86Å; E363-L366 PolarHBondContact O-N 3.45Å; L366-T368 VanDerWaalsContact C-N 3.27Å; L366-T368 PolarHBondContact O-N 3.34Å; L366-H369 PolarHBondContact O-N 3.25Å; L366-T370 PolarHBondContact O-N 3.32Å; L366-T370 PolarHBondContact O-OG1 3.46Å |
| 367 | K | 83.2 | Confident | 78.2 | Confident | 110 Ų | 110 | 107.2 Ų | 107.2 | 48% | 0.478 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.3 | -37.3 | 173.6 | -76.7 | 171 | -175.2 | 167.1 | 0 | 112 | E363 M364 A365 T370 K371 | E363-K367 WeakPolarHBondContact O-CB 3.49Å; E363-K367 VanDerWaalsContact O-CG 3.25Å; E363-K367 WeakPolarHBondContact O-CG 3.42Å; E363-K367 PolarHBondContact O-N 2.86Å; M364-K367 PolarHBondContact O-N 3.46Å; M364-K367 HydrophobicContact SD-CD 4.34Å; A365-K367 PolarHBondContact O-N 3.36Å; K367-T370 WeakPolarHBondContact CA-OG1 3.18Å; K367-T370 PolarHBondContact O-OG1 3.1Å; K367-K371 WeakPolarHBondContact O-CB 3.26Å; K367-K371 WeakPolarHBondContact O-CG 3.17Å; K367-K371 PolarHBondContact O-N 3.42Å; K367-K371 VanDerWaalsContact O-N 3.12Å |
| 368 | T | 77.6 | Confident | 76.7 | Confident | 80 Ų | 80 | 108.3 Ų | 108.3 | 49% | 0.491 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -72.7 | -44.1 | 177.8 | -53.8 | 0 | 0 | 0 | 0 | 111.3 | M364 A365 L366 K371 T372 | M364-T368 WeakPolarHBondContact O-CB 3.37Å; M364-T368 PolarHBondContact O-N 2.8Å; M364-T368 PolarHBondContact O-OG1 2.87Å; A365-T368 CarbonylContact O-C 3.57Å; A365-T368 WeakPolarHBondContact O-CB 3.33Å; A365-T368 PolarHBondContact O-N 3.3Å; A365-T368 VanDerWaalsContact O-N 3.1Å; L366-T368 VanDerWaalsContact C-N 3.27Å; L366-T368 PolarHBondContact O-N 3.34Å; T368-K371 WeakPolarHBondContact O-CB 3.41Å; T368-K371 PolarHBondContact O-N 3.19Å; T368-T372 WeakPolarHBondContact O-CG2 3.37Å; T368-T372 PolarHBondContact O-N 3.18Å; T368-T372 PolarHBondContact O-OG1 2.94Å |
| 369 | H | 79.1 | Confident | 75.3 | Confident | 129 Ų | 129 | 107 Ų | 107 | 60% | 0.597 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.9 | -37.4 | 176.1 | -75.6 | -60.2 | 0 | 0 | 0 | 112.7 | A365 L366 T372 W373 | A365-H369 WeakPolarHBondContact O-CB 3.5Å; A365-H369 PolarHBondContact O-CD2 3.36Å; A365-H369 PolarHBondContact O-N 3.44Å; L366-H369 PolarHBondContact O-N 3.25Å; H369-T372 WeakPolarHBondContact CA-OG1 3.37Å; H369-T372 PolarHBondContact O-N 3.31Å; H369-T372 PolarHBondContact O-OG1 3.2Å; H369-W373 WeakPolarHBondContact O-CA 3.43Å; H369-W373 WeakPolarHBondContact O-CB 3.36Å; H369-W373 PolarHBondContact O-N 3Å |
| 370 | T | 75.5 | Confident | 73.6 | Confident | 68 Ų | 68 | 106.7 Ų | 106.7 | 42% | 0.417 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -66.4 | -39.9 | 171.4 | 24.5 | 0 | 0 | 0 | 0 | 111.2 | L366 K367 N374 | L366-T370 PolarHBondContact O-N 3.32Å; L366-T370 PolarHBondContact O-OG1 3.46Å; K367-T370 WeakPolarHBondContact CA-OG1 3.18Å; K367-T370 PolarHBondContact O-OG1 3.1Å; T370-N374 VanDerWaalsContact O-CB 3.25Å; T370-N374 WeakPolarHBondContact O-CB 3.01Å; T370-N374 PolarHBondContact O-N 3.26Å; T370-N374 PolarHBondContact O-ND2 3.15Å |
| 371 | K | 78.4 | Confident | 72 | Confident | 144 Ų | 144 | 105.1 Ų | 105.1 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.9 | -42.9 | 174 | -76.2 | 174 | -177.7 | -178.2 | 0 | 112.6 | K367 T368 K375 | K367-K371 WeakPolarHBondContact O-CB 3.26Å; K367-K371 WeakPolarHBondContact O-CG 3.17Å; K367-K371 PolarHBondContact O-N 3.42Å; K367-K371 VanDerWaalsContact O-N 3.12Å; T368-K371 WeakPolarHBondContact O-CB 3.41Å; T368-K371 PolarHBondContact O-N 3.19Å; K371-K375 VanDerWaalsContact O-CG 3.29Å; K371-K375 WeakPolarHBondContact O-CG 3.35Å; K371-K375 PolarHBondContact O-N 3.19Å; K371-K375 VanDerWaalsContact O-N 3.1Å |
| 372 | T | 74.7 | Confident | 70 | Confident | 62 Ų | 62 | 103.2 Ų | 103.2 | 38% | 0.38 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -73.9 | -36.6 | 178 | 54 | 0 | 0 | 0 | 0 | 112.3 | T368 H369 K375 L376 | T368-T372 WeakPolarHBondContact O-CG2 3.37Å; T368-T372 PolarHBondContact O-N 3.18Å; T368-T372 PolarHBondContact O-OG1 2.94Å; H369-T372 WeakPolarHBondContact CA-OG1 3.37Å; H369-T372 PolarHBondContact O-N 3.31Å; H369-T372 PolarHBondContact O-OG1 3.2Å; T372-K375 PolarHBondContact O-N 3.22Å; T372-L376 WeakPolarHBondContact O-CB 3.48Å; T372-L376 PolarHBondContact O-N 3.08Å |
| 373 | W | 70.1 | Confident | 68.4 | Low | 167 Ų | 167 | 103.1 Ų | 103.1 | 63% | 0.633 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.1 | -44.2 | 172.1 | -179.1 | -103 | 0 | 0 | 0 | 111.6 | H369 K375 L376 K377 | H369-W373 WeakPolarHBondContact O-CA 3.43Å; H369-W373 WeakPolarHBondContact O-CB 3.36Å; H369-W373 PolarHBondContact O-N 3Å; W373-K375 VanDerWaalsContact C-N 3.33Å; W373-K375 PolarHBondContact O-N 2.85Å; W373-L376 PolarHBondContact O-N 3.13Å; W373-K377 VanDerWaalsContact O-CB 3.22Å; W373-K377 WeakPolarHBondContact O-CB 3.3Å; W373-K377 PolarHBondContact O-N 3.01Å |
| 374 | N | 71.5 | Confident | 67.4 | Low | 85 Ų | 85 | 104.2 Ų | 104.2 | 46% | 0.455 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -63.4 | -39.6 | 175.3 | -70.6 | -13.2 | 0 | 0 | 0 | 111.4 | T370 K377 E378 | T370-N374 VanDerWaalsContact O-CB 3.25Å; T370-N374 WeakPolarHBondContact O-CB 3.01Å; T370-N374 PolarHBondContact O-N 3.26Å; T370-N374 PolarHBondContact O-ND2 3.15Å; N374-K377 PolarHBondContact O-N 3.4Å; N374-E378 WeakPolarHBondContact O-CB 3.4Å; N374-E378 WeakPolarHBondContact O-CG 3.32Å; N374-E378 PolarHBondContact O-N 3.01Å |
| 375 | K | 70.4 | Confident | 65.6 | Low | 148 Ų | 148 | 104.6 Ų | 104.6 | 64% | 0.643 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.9 | -36.4 | 174 | -73.5 | 177.5 | 179.2 | -172 | 0 | 113.5 | K371 T372 W373 A379 | K371-K375 VanDerWaalsContact O-CG 3.29Å; K371-K375 WeakPolarHBondContact O-CG 3.35Å; K371-K375 PolarHBondContact O-N 3.19Å; K371-K375 VanDerWaalsContact O-N 3.1Å; T372-K375 PolarHBondContact O-N 3.22Å; W373-K375 VanDerWaalsContact C-N 3.33Å; W373-K375 PolarHBondContact O-N 2.85Å; K375-A379 WeakPolarHBondContact O-CB 3.5Å; K375-A379 PolarHBondContact O-N 2.95Å; K375-A379 VanDerWaalsContact O-N 3.12Å |
| 376 | L | 64.1 | Low | 64 | Low | 113 Ų | 113 | 108.5 Ų | 108.5 | 59% | 0.592 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -72.1 | -34.5 | 174.5 | -84.1 | 160.6 | 0 | 0 | 0 | 112 | T372 W373 E378 A379 A380 | T372-L376 WeakPolarHBondContact O-CB 3.48Å; T372-L376 PolarHBondContact O-N 3.08Å; W373-L376 PolarHBondContact O-N 3.13Å; L376-E378 VanDerWaalsContact C-N 3.34Å; L376-A379 PolarHBondContact O-N 3.29Å; L376-A380 WeakPolarHBondContact O-CB 3.47Å; L376-A380 PolarHBondContact O-N 3.34Å |
| 377 | K | 58.3 | Low | 62.2 | Low | 132 Ų | 132 | 106 Ų | 106 | 57% | 0.574 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -69.7 | -30.5 | 173.6 | -163.4 | 177.8 | -177.9 | -176.8 | 0 | 112.1 | W373 N374 | W373-K377 VanDerWaalsContact O-CB 3.22Å; W373-K377 WeakPolarHBondContact O-CB 3.3Å; W373-K377 PolarHBondContact O-N 3.01Å; N374-K377 PolarHBondContact O-N 3.4Å |
| 378 | E | 57.8 | Low | 60.3 | Low | 169 Ų | 169 | 116.4 Ų | 116.4 | 79% | 0.79 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -78.9 | -24.4 | 172.5 | -75.7 | 179.5 | 175.9 | 0 | 0 | 113.4 | N374 L376 | N374-E378 WeakPolarHBondContact O-CB 3.4Å; N374-E378 WeakPolarHBondContact O-CG 3.32Å; N374-E378 PolarHBondContact O-N 3.01Å; L376-E378 VanDerWaalsContact C-N 3.34Å |
| 379 | A | 58.2 | Low | 59.4 | Low | 87 Ų | 87 | 118.2 Ų | 118.2 | 72% | 0.719 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -93.8 | -24.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | K375 L376 | K375-A379 WeakPolarHBondContact O-CB 3.5Å; K375-A379 PolarHBondContact O-N 2.95Å; K375-A379 VanDerWaalsContact O-N 3.12Å; L376-A379 PolarHBondContact O-N 3.29Å |
| 380 | A | 51.3 | Low | 58.4 | Low | 65 Ų | 65 | 117.6 Ų | 117.6 | 54% | 0.537 | 67% | 0.669 | S | S | . | * | S | Bend | trans | -101.5 | 104.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | L376 A382 | L376-A380 WeakPolarHBondContact O-CB 3.47Å; L376-A380 PolarHBondContact O-N 3.34Å; A380-A382 PolarHBondContact O-N 3.05Å |
| 381 | G | 53.1 | Low | 57.5 | Low | 93 Ų | 93 | 120.4 Ų | 120.4 | 96% | 0.959 | 68% | 0.683 | S | S | * | * | trans | -52.5 | 95.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 382 | A | 42.1 | Very low | 56.2 | Low | 79 Ų | 79 | 119 Ų | 119 | 65% | 0.653 | 69% | 0.687 | S | S | * | * | trans | -139.1 | 111.6 | 159.5 | 0 | 0 | 0 | 0 | 0 | 106.9 | A380 | A380-A382 PolarHBondContact O-N 3.05Š| ||
| 383 | G | 45.3 | Very low | 55.1 | Low | 67 Ų | 67 | 122.6 Ų | 122.6 | 69% | 0.691 | 71% | 0.706 | S | S | * | * | trans | -59.9 | -179.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 384 | P | 62.8 | Low | 54.1 | Low | 120 Ų | 120 | 119.6 Ų | 119.6 | 78% | 0.779 | 71% | 0.711 | S | S | * | * | trans | -73.2 | 170.3 | -144.7 | 35.3 | -36.3 | 0 | 0 | 0 | 111.8 | ||||
| 385 | V | 42.2 | Very low | 52.8 | Low | 120 Ų | 120 | 122.1 Ų | 122.1 | 73% | 0.727 | 73% | 0.729 | S | S | * | * | -167.9 | 140.3 | 97.1 | 154.6 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 386 | T | 46.8 | Very low | 51.5 | Low | 122 Ų | 122 | 120.1 Ų | 120.1 | 75% | 0.748 | 74% | 0.735 | S | S | * | * | trans | -17.4 | 155.2 | 158.5 | 62.8 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 387 | A | 44.1 | Very low | 50.4 | Low | 67 Ų | 67 | 120.7 Ų | 120.7 | 55% | 0.554 | 75% | 0.747 | S | S | * | * | 175.7 | 166.6 | 55.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 388 | W | 43.3 | Very low | 49.7 | Very low | 327 Ų | 327 | 119.6 Ų | 119.6 | 100% | 1.239 | 76% | 0.763 | S | S | * | * | trans | 86.8 | 0 | 160.3 | -52.9 | 97.3 | 0 | 0 | 0 | 117.7 |
Retrieved 388 of 388 residues in 885.5 ms
(Link to these results)