| 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 | 30.7 | Very low | 27 | Very low | 240 Ų | 240 | 146.3 Ų | 146.3 | 100% | 1.182 | 81% | 0.807 | S | S | * | * | 0 | 76.4 | 0 | -77.4 | 175.1 | 162.7 | 0 | 0 | 105.6 | |||||
| 2 | E | 27.3 | Very low | 26.9 | Very low | 175 Ų | 175 | 148.1 Ų | 148.1 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | 74.3 | 132.1 | 68.8 | -157.1 | 178.5 | -133.1 | 0 | 0 | 111.4 | |||||
| 3 | T | 28.1 | Very low | 26.7 | Very low | 136 Ų | 136 | 142.4 Ų | 142.4 | 83% | 0.834 | 81% | 0.811 | S | S | * | * | trans | 120.6 | 95.4 | 175.4 | 62.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 4 | D | 26.9 | Very low | 27.8 | Very low | 146 Ų | 146 | 141 Ų | 141 | 78% | 0.781 | 81% | 0.81 | S | S | * | * | cis | 76.4 | 108 | 38 | -131.5 | 11.5 | 0 | 0 | 0 | 114.4 | ||||
| 5 | S | 26.8 | Very low | 27.9 | Very low | 93 Ų | 93 | 141.3 Ų | 141.3 | 65% | 0.65 | 82% | 0.815 | S | S | * | * | trans | 95.3 | 137.6 | 130.2 | 81.7 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 6 | I | 28.4 | Very low | 28.1 | Very low | 151 Ų | 151 | 141.3 Ų | 141.3 | 77% | 0.774 | 81% | 0.812 | S | S | * | * | trans | 96.2 | 96.9 | 145.4 | -45.3 | -170.9 | 0 | 0 | 0 | 120.7 | ||||
| 7 | S | 25.4 | Very low | 28.3 | Very low | 103 Ų | 103 | 145.2 Ų | 145.2 | 72% | 0.72 | 82% | 0.817 | S | S | * | * | 42.9 | 126.5 | 118.6 | -174.9 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 8 | K | 26.9 | Very low | 28.4 | Very low | 210 Ų | 210 | 145.9 Ų | 145.9 | 91% | 0.913 | 82% | 0.819 | S | S | * | * | trans | -155.4 | 143.5 | 130 | -108.6 | 169.1 | -172.3 | 179.3 | 0 | 112 | ||||
| 9 | A | 25.2 | Very low | 28.4 | Very low | 91 Ų | 91 | 141.2 Ų | 141.2 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | trans | -96.3 | -180 | -168.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 10 | S | 25.6 | Very low | 28.7 | Very low | 96 Ų | 96 | 140.6 Ų | 140.6 | 67% | 0.671 | 81% | 0.808 | S | S | * | * | trans | 91 | 135.9 | 153.7 | -157.4 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 11 | Q | 25.1 | Very low | 29 | Very low | 168 Ų | 168 | 142.1 Ų | 142.1 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | cis | -173.3 | 150.7 | -2.5 | -111.1 | 166.4 | 1.2 | 0 | 0 | 105.6 | ||||
| 12 | N | 26.4 | Very low | 29 | Very low | 168 Ų | 168 | 139.5 Ų | 139.5 | 90% | 0.898 | 80% | 0.797 | S | S | * | * | trans | 176.1 | 109 | 137.4 | -87.5 | -12.7 | 0 | 0 | 0 | 109.1 | ||||
| 13 | G | 23.9 | Very low | 29.2 | Very low | 74 Ų | 74 | 140.5 Ų | 140.5 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | trans | -96.4 | -154.9 | 165.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 14 | P | 42.6 | Very low | 29.3 | Very low | 123 Ų | 123 | 143.7 Ų | 143.7 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | cis | -129.7 | 163.8 | -25.8 | 38.2 | -23.3 | 0 | 0 | 0 | 112.1 | ||||
| 15 | T | 29 | Very low | 29.3 | Very low | 145 Ų | 145 | 147.4 Ų | 147.4 | 89% | 0.89 | 80% | 0.804 | S | S | * | * | trans | -155.8 | 119.9 | 146.8 | 39.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 16 | D | 30.5 | Very low | 29.6 | Very low | 142 Ų | 142 | 148.4 Ų | 148.4 | 76% | 0.759 | 81% | 0.809 | S | S | * | * | trans | -48.8 | 135.3 | 169.1 | -73.1 | -44.5 | 0 | 0 | 0 | 113.3 | ||||
| 17 | K | 31.4 | Very low | 30 | Very low | 207 Ų | 207 | 150.1 Ų | 150.1 | 90% | 0.9 | 81% | 0.813 | S | S | * | * | -148.8 | 101.3 | 127.4 | -73.7 | -157.4 | 178.6 | 175.6 | 0 | 109.2 | G19 | K17-G19 PolarHBondContact O-N 3.5Š| |||
| 18 | D | 31.3 | Very low | 30.3 | Very low | 159 Ų | 159 | 152.8 Ų | 152.8 | 85% | 0.85 | 81% | 0.812 | S | S | * | * | trans | -55.7 | 112.8 | 162.2 | -78 | -45.4 | 0 | 0 | 0 | 110.6 | ||||
| 19 | G | 28.9 | Very low | 30.6 | Very low | 55 Ų | 55 | 146.4 Ų | 146.4 | 57% | 0.567 | 80% | 0.798 | S | S | * | * | trans | -109.8 | 135.3 | 154.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | K17 L21 | K17-G19 PolarHBondContact O-N 3.5Å; G19-L21 PolarHBondContact O-N 3.3Å | ||
| 20 | P | 32.8 | Very low | 31.2 | Very low | 130 Ų | 130 | 147.6 Ų | 147.6 | 84% | 0.844 | 80% | 0.797 | S | S | * | * | trans | -62.4 | 117.4 | -176.1 | 23.8 | -29.7 | 0 | 0 | 0 | 108.9 | E22 | P20-E22 VanDerWaalsContact C-N 3.29Å; P20-E22 PolarHBondContact O-N 3Å | ||
| 21 | L | 34.8 | Very low | 31.8 | Very low | 173 Ų | 173 | 148.5 Ų | 148.5 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | -51.6 | 98.9 | 165.6 | -81.3 | 157.2 | 0 | 0 | 0 | 107.5 | G19 K23 | G19-L21 PolarHBondContact O-N 3.3Å; L21-K23 VanDerWaalsContact C-N 3.29Å; L21-K23 PolarHBondContact O-N 3.24Å | ||
| 22 | E | 31.3 | Very low | 32.9 | Very low | 185 Ų | 185 | 143.8 Ų | 143.8 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | -58.3 | 99.8 | 169.6 | -147.8 | 176.9 | -164.6 | 0 | 0 | 105.5 | P20 K24 | P20-E22 VanDerWaalsContact C-N 3.29Å; P20-E22 PolarHBondContact O-N 3Å; E22-K24 PolarHBondContact O-N 2.73Å | ||
| 23 | K | 31.1 | Very low | 34 | Very low | 196 Ų | 196 | 140.6 Ų | 140.6 | 85% | 0.852 | 76% | 0.757 | S | S | * | * | trans | -52 | 99.5 | 166.1 | -93.5 | 178.1 | 174.4 | 173.2 | 0 | 105.2 | L21 R25 | L21-K23 VanDerWaalsContact C-N 3.29Å; L21-K23 PolarHBondContact O-N 3.24Å; K23-R25 PolarHBondContact O-N 2.72Å | ||
| 24 | K | 31.2 | Very low | 35.7 | Very low | 202 Ų | 202 | 142.3 Ų | 142.3 | 88% | 0.878 | 75% | 0.745 | S | S | * | * | trans | -51.4 | 100.6 | 160.3 | -89.1 | -175.1 | 174.4 | -177.8 | 0 | 104.9 | E22 | E22-K24 PolarHBondContact O-N 2.73Š| ||
| 25 | R | 27.3 | Very low | 36.8 | Very low | 224 Ų | 224 | 141.5 Ų | 141.5 | 85% | 0.845 | 73% | 0.734 | S | S | * | * | trans | -50.1 | 131.6 | 166.1 | -70.3 | 177.3 | -179.2 | -179.7 | 0.4 | 104.2 | K23 E27 | K23-R25 PolarHBondContact O-N 2.72Å; R25-E27 PolarHBondContact O-N 3.2Å | ||
| 26 | P | 32.1 | Very low | 38.8 | Very low | 115 Ų | 115 | 135.6 Ų | 135.6 | 75% | 0.747 | 70% | 0.697 | S | S | * | * | trans | -55.4 | 114.4 | 169.2 | 24.4 | -29.7 | 0 | 0 | 0 | 104.9 | K28 | P26-K28 VanDerWaalsContact C-N 3.34Å; P26-K28 PolarHBondContact O-N 2.83Å | ||
| 27 | E | 36.8 | Very low | 41.1 | Very low | 186 Ų | 186 | 130 Ų | 130 | 87% | 0.869 | 67% | 0.673 | S | S | * | * | trans | -49.5 | 112.4 | 164 | -82.1 | 175.9 | 152.6 | 0 | 0 | 103.9 | R25 A29 | R25-E27 PolarHBondContact O-N 3.2Å; E27-A29 PolarHBondContact O-N 3.41Å | ||
| 28 | K | 31.8 | Very low | 43.4 | Very low | 159 Ų | 159 | 122.7 Ų | 122.7 | 69% | 0.691 | 64% | 0.644 | S | S | * | * | trans | -61.1 | 91.7 | 175.6 | -81.4 | -177 | 171.4 | -170.4 | 0 | 105 | P26 T30 | P26-K28 VanDerWaalsContact C-N 3.34Å; P26-K28 PolarHBondContact O-N 2.83Å; K28-T30 PolarHBondContact O-N 3.14Å | ||
| 29 | A | 34.1 | Very low | 45.6 | Very low | 77 Ų | 77 | 122.1 Ų | 122.1 | 64% | 0.636 | 64% | 0.64 | S | S | * | * | trans | -47.7 | 132.3 | 170 | 0 | 0 | 0 | 0 | 0 | 106.6 | E27 V31 | E27-A29 PolarHBondContact O-N 3.41Å; A29-V31 PolarHBondContact O-N 2.94Å | ||
| 30 | T | 37.9 | Very low | 47.7 | Very low | 116 Ų | 116 | 122.5 Ų | 122.5 | 71% | 0.712 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -64.3 | 48.9 | -172.4 | 38.9 | 0 | 0 | 0 | 0 | 112.9 | K28 | K28-T30 PolarHBondContact O-N 3.14Š|
| 31 | V | 37.1 | Very low | 49.7 | Very low | 115 Ų | 115 | 116.3 Ų | 116.3 | 70% | 0.697 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -80.4 | 121.5 | 160.7 | -176.3 | 0 | 0 | 0 | 0 | 105.9 | A29 Q33 | A29-V31 PolarHBondContact O-N 2.94Å; V31-Q33 PolarHBondContact O-N 3.47Å |
| 32 | L | 48 | Very low | 51.9 | Low | 68 Ų | 68 | 109.2 Ų | 109.2 | 36% | 0.356 | 56% | 0.556 | S | S | . | * | P | Polyproline II helix | trans | -51.7 | 116.6 | 172 | -78.4 | 147 | 0 | 0 | 0 | 108.4 | Q34 E254 R336 | L32-Q34 PolarHBondContact O-N 2.88Å; L32-E254 HydrophobicContact CB-CG 4.02Å; L32-E254 HydrophobicContact CD2-CG 4.19Å; L32-R336 VanDerWaalsContact CD1-NH1 3.32Å |
| 33 | Q | 50.7 | Low | 54.1 | Low | 102 Ų | 102 | 103.1 Ų | 103.1 | 48% | 0.477 | 53% | 0.534 | S | S | . | . | P | Polyproline II helix | trans | -68.1 | 129.3 | -175.1 | -58.3 | -155.5 | -75.9 | 0 | 0 | 108.5 | V31 D35 | V31-Q33 PolarHBondContact O-N 3.47Å; Q33-D35 WeakPolarHBondContact CB-OD2 3.5Å; Q33-D35 PolarHBondContact O-N 3.19Å |
| 34 | Q | 59.7 | Low | 56.2 | Low | 109 Ų | 109 | 96.4 Ų | 96.4 | 51% | 0.509 | 51% | 0.507 | S | S | . | . | trans | -71.5 | 76.7 | 174 | -72.5 | -179.9 | -12.3 | 0 | 0 | 109.8 | L32 E253 E254 K256 | L32-Q34 PolarHBondContact O-N 2.88Å; Q34-E253 WeakPolarHBondContact CG-O 3.33Å; Q34-E254 CarbonylContact C-O 2.88Å; Q34-E254 VanDerWaalsContact CA-O 3.31Å; Q34-E254 WeakPolarHBondContact CA-O 3.22Å; Q34-K256 HydrophobicContact CB-CG 4.32Å; Q34-K256 WeakPolarHBondContact O-CE 3.32Å; Q34-K256 WeakPolarHBondContact O-CG 3.32Å | ||
| 35 | D | 65.8 | Low | 58.4 | Low | 106 Ų | 106 | 86.8 Ų | 86.8 | 57% | 0.567 | 47% | 0.465 | S | S | * | . | trans | -97.5 | -17.9 | -173.9 | -73.1 | -25.3 | 0 | 0 | 0 | 112.7 | Q33 G37 E254 | Q33-D35 WeakPolarHBondContact CB-OD2 3.5Å; Q33-D35 PolarHBondContact O-N 3.19Å; D35-G37 PolarHBondContact O-N 3.08Å; D35-E254 PolarHBondContact N-O 3Å | ||
| 36 | I | 69.8 | Low | 61 | Low | 22 Ų | 22 | 76.5 Ų | 76.5 | 11% | 0.113 | 43% | 0.427 | C | S | . | . | B | Isolated β-bridge | trans | -86.4 | 109.9 | -170.8 | -53.5 | 178 | 0 | 0 | 0 | 110.7 | I251 E254 L255 K256 | I36-I251 HydrophobicContact CD1-CD1 3.8Å; I36-E254 HydrophobicContact CD1-CB 3.96Å; I36-E254 HydrophobicContact CG1-CB 4.4Å; I36-E254 PolarHBondContact N-O 2.99Å; I36-E254 VanDerWaalsContact N-O 3.14Å; I36-L255 HydrophobicContact CB-CD2 4.09Å; I36-L255 HydrophobicContact CG2-CD2 3.7Å; I36-K256 PolarHBondContact O-N 3.5Å |
| 37 | G | 79.7 | Confident | 63 | Low | 25 Ų | 25 | 71.1 Ų | 71.1 | 26% | 0.258 | 39% | 0.393 | S | S | . | . | trans | -83.4 | 175.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | D35 L39 S40 G41 | D35-G37 PolarHBondContact O-N 3.08Å; G37-L39 PolarHBondContact O-N 3.11Å; G37-S40 PolarHBondContact O-N 2.94Å; G37-G41 PolarHBondContact O-N 2.93Å | ||
| 38 | L | 78.6 | Confident | 64.9 | Low | 53 Ų | 53 | 63.4 Ų | 63.4 | 28% | 0.277 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -56.3 | -48.8 | -177.3 | 178.6 | 63.8 | 0 | 0 | 0 | 113.7 | S40 G41 I42 N261 L264 A265 | L38-S40 VanDerWaalsContact C-N 3.31Å; L38-S40 PolarHBondContact O-N 2.98Å; L38-G41 PolarHBondContact O-N 3.24Å; L38-I42 HydrophobicContact CD1-CD1 4.25Å; L38-I42 HydrophobicContact CD1-CG1 4.45Å; L38-I42 HydrophobicContact CG-CD1 4.09Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 2.76Å; L38-N261 HydrophobicContact CB-CB 4.5Å; L38-N261 HydrophobicContact CD1-CB 4.18Å; L38-L264 HydrophobicContact CD1-CB 3.78Å; L38-L264 HydrophobicContact CD2-CD1 4.46Å; L38-A265 HydrophobicContact CD1-CB 4.22Å |
| 39 | L | 77.3 | Confident | 67.3 | Low | 147 Ų | 147 | 56 Ų | 56 | 77% | 0.77 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -63.1 | -39 | 179.7 | -74.9 | 169.5 | 0 | 0 | 0 | 112 | G37 I42 S43 | G37-L39 PolarHBondContact O-N 3.11Å; L39-I42 PolarHBondContact O-N 3.42Å; L39-S43 WeakPolarHBondContact O-CB 3.26Å; L39-S43 PolarHBondContact O-N 3.19Å |
| 40 | S | 74.6 | Confident | 69.7 | Low | 62 Ų | 62 | 52.4 Ų | 52.4 | 43% | 0.434 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -67 | -38.6 | 175.2 | -176.9 | 0 | 0 | 0 | 0 | 111.1 | G37 L38 S43 L44 | G37-S40 PolarHBondContact O-N 2.94Å; L38-S40 VanDerWaalsContact C-N 3.31Å; L38-S40 PolarHBondContact O-N 2.98Å; S40-S43 PolarHBondContact O-N 3.4Å; S40-L44 WeakPolarHBondContact O-CB 3.44Å; S40-L44 PolarHBondContact O-N 2.69Å |
| 41 | G | 74.9 | Confident | 71.7 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 173 | 0 | 0 | 0 | 0 | 0 | 113.4 | G37 L38 L44 I45 | G37-G41 PolarHBondContact O-N 2.93Å; L38-G41 PolarHBondContact O-N 3.24Å; G41-L44 PolarHBondContact O-N 3.41Å; G41-I45 PolarHBondContact O-N 2.84Å |
| 42 | I | 80.8 | Confident | 73.7 | Confident | 24 Ų | 24 | 41.8 Ų | 41.8 | 12% | 0.123 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.1 | -48.7 | 173.9 | -66 | 164.1 | 0 | 0 | 0 | 110 | L38 L39 L44 I45 V46 A265 I268 | L38-I42 HydrophobicContact CD1-CD1 4.25Å; L38-I42 HydrophobicContact CD1-CG1 4.45Å; L38-I42 HydrophobicContact CG-CD1 4.09Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 2.76Å; L39-I42 PolarHBondContact O-N 3.42Å; I42-L44 PolarHBondContact O-N 2.87Å; I42-I45 PolarHBondContact O-N 2.89Å; I42-V46 HydrophobicContact CG2-CG2 4.15Å; I42-V46 WeakPolarHBondContact O-CB 3.18Å; I42-V46 VanDerWaalsContact O-CG2 3.28Å; I42-V46 WeakPolarHBondContact O-CG2 3.48Å; I42-V46 PolarHBondContact O-N 3.18Å; I42-A265 HydrophobicContact CG1-CB 4.02Å; I42-I268 HydrophobicContact CD1-CB 4.26Å; I42-I268 HydrophobicContact CD1-CD1 4.09Å; I42-I268 HydrophobicContact CD1-CG2 4.08Å |
| 43 | S | 76.4 | Confident | 75.5 | Confident | 57 Ų | 57 | 38.7 Ų | 38.7 | 40% | 0.399 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -60 | -34.4 | 178.3 | -174.7 | 0 | 0 | 0 | 0 | 112.2 | L39 S40 G47 | L39-S43 WeakPolarHBondContact O-CB 3.26Å; L39-S43 PolarHBondContact O-N 3.19Å; S40-S43 PolarHBondContact O-N 3.4Å; S43-G47 WeakPolarHBondContact O-CA 3.49Å; S43-G47 PolarHBondContact O-N 3.21Å |
| 44 | L | 74.7 | Confident | 77.4 | Confident | 55 Ų | 55 | 33.9 Ų | 33.9 | 29% | 0.288 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -70.4 | -47.5 | 177.4 | -169.9 | 138.2 | 0 | 0 | 0 | 110.9 | S40 G41 I42 V46 G47 T48 L248 I251 | S40-L44 WeakPolarHBondContact O-CB 3.44Å; S40-L44 PolarHBondContact O-N 2.69Å; G41-L44 PolarHBondContact O-N 3.41Å; I42-L44 PolarHBondContact O-N 2.87Å; L44-V46 PolarHBondContact O-N 2.8Å; L44-G47 PolarHBondContact O-N 3.21Å; L44-T48 HydrophobicContact CD2-CG2 4.3Å; L44-T48 HydrophobicContact CG-CG2 4.44Å; L44-T48 WeakPolarHBondContact O-CB 3.37Å; L44-T48 VanDerWaalsContact O-CG2 3.3Å; L44-T48 WeakPolarHBondContact O-CG2 3.35Å; L44-T48 PolarHBondContact O-N 3.43Å; L44-T48 PolarHBondContact O-OG1 3.24Å; L44-L248 HydrophobicContact CD2-CD1 3.86Å; L44-I251 HydrophobicContact CD1-CD1 3.76Å; L44-I251 HydrophobicContact CD2-CD1 3.9Å; L44-I251 HydrophobicContact CG-CD1 4.48Å |
| 45 | I | 78.4 | Confident | 78.7 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.4 | -51.3 | 174.7 | -71.2 | 177.1 | 0 | 0 | 0 | 110.8 | G41 I42 G47 T48 M49 L248 A265 I266 | G41-I45 PolarHBondContact O-N 2.84Å; I42-I45 PolarHBondContact O-N 2.89Å; I45-G47 VanDerWaalsContact C-N 3.32Å; I45-G47 PolarHBondContact O-N 3.16Å; I45-T48 PolarHBondContact O-N 2.75Å; I45-T48 PolarHBondContact O-OG1 2.75Å; I45-T48 VanDerWaalsContact O-OG1 3.1Å; I45-M49 HydrophobicContact CG2-CG 4.32Å; I45-M49 HydrophobicContact CG2-SD 3.61Å; I45-M49 WeakPolarHBondContact O-CB 3.4Å; I45-M49 VanDerWaalsContact O-CG 3.3Å; I45-M49 WeakPolarHBondContact O-CG 3.33Å; I45-M49 PolarHBondContact O-N 2.82Å; I45-L248 HydrophobicContact CD1-CB 4.32Å; I45-L248 HydrophobicContact CD1-CD2 3.61Å; I45-L248 HydrophobicContact CD1-CG 4.45Å; I45-L248 HydrophobicContact CG1-CB 4.08Å; I45-L248 HydrophobicContact CG1-CD1 4.41Å; I45-L248 HydrophobicContact CG1-CD2 4.03Å; I45-L248 HydrophobicContact CG1-CG 4.39Å; I45-A265 HydrophobicContact CD1-CB 3.86Å; I45-I266 HydrophobicContact CD1-CG1 3.86Å |
| 46 | V | 80.8 | Confident | 79.7 | Confident | 8 Ų | 8 | 24.4 Ų | 24.4 | 5% | 0.048 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.3 | -43.1 | -178.6 | 174.7 | 0 | 0 | 0 | 0 | 109.9 | I42 L44 T48 I50 L195 L272 V273 | I42-V46 HydrophobicContact CG2-CG2 4.15Å; I42-V46 WeakPolarHBondContact O-CB 3.18Å; I42-V46 VanDerWaalsContact O-CG2 3.28Å; I42-V46 WeakPolarHBondContact O-CG2 3.48Å; I42-V46 PolarHBondContact O-N 3.18Å; L44-V46 PolarHBondContact O-N 2.8Å; V46-T48 PolarHBondContact O-N 3.29Å; V46-I50 HydrophobicContact CG1-CD1 3.57Å; V46-I50 HydrophobicContact CG1-CG1 4.21Å; V46-I50 WeakPolarHBondContact O-CB 3.13Å; V46-I50 VanDerWaalsContact O-CG1 3.29Å; V46-I50 WeakPolarHBondContact O-CG1 3.34Å; V46-I50 PolarHBondContact O-N 3.09Å; V46-L195 HydrophobicContact CG1-CD2 3.9Å; V46-L272 HydrophobicContact CG2-CD2 4.17Å; V46-V273 HydrophobicContact CB-CG2 4.44Å; V46-V273 HydrophobicContact CG1-CG2 4.29Å; V46-V273 HydrophobicContact CG2-CG2 4.19Å |
| 47 | G | 75.8 | Confident | 80.7 | Confident | 2 Ų | 2 | 23.4 Ų | 23.4 | 2% | 0.021 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -70.3 | -26.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | S43 L44 I45 K194 | S43-G47 WeakPolarHBondContact O-CA 3.49Å; S43-G47 PolarHBondContact O-N 3.21Å; L44-G47 PolarHBondContact O-N 3.21Å; I45-G47 VanDerWaalsContact C-N 3.32Å; I45-G47 PolarHBondContact O-N 3.16Å; G47-K194 PolarHBondContact O-NZ 3.31Å |
| 48 | T | 75.9 | Confident | 81.3 | Confident | 24 Ų | 24 | 22.2 Ų | 22.2 | 15% | 0.147 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -86 | -38.9 | 175.5 | 54.8 | 0 | 0 | 0 | 0 | 112.6 | L44 I45 V46 G244 | L44-T48 HydrophobicContact CD2-CG2 4.3Å; L44-T48 HydrophobicContact CG-CG2 4.44Å; L44-T48 WeakPolarHBondContact O-CB 3.37Å; L44-T48 VanDerWaalsContact O-CG2 3.3Å; L44-T48 WeakPolarHBondContact O-CG2 3.35Å; L44-T48 PolarHBondContact O-N 3.43Å; L44-T48 PolarHBondContact O-OG1 3.24Å; I45-T48 PolarHBondContact O-N 2.75Å; I45-T48 PolarHBondContact O-OG1 2.75Å; I45-T48 VanDerWaalsContact O-OG1 3.1Å; V46-T48 PolarHBondContact O-N 3.29Å; T48-G244 PolarHBondContact OG1-O 3.44Å |
| 49 | M | 81.6 | Confident | 81.8 | Confident | 4 Ų | 4 | 22.8 Ų | 22.8 | 2% | 0.02 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -72.1 | -47.4 | 178.2 | -72.1 | -179.9 | 74.5 | 0 | 0 | 111.9 | I45 G51 Y242 W245 I270 V273 Y277 | I45-M49 HydrophobicContact CG2-CG 4.32Å; I45-M49 HydrophobicContact CG2-SD 3.61Å; I45-M49 WeakPolarHBondContact O-CB 3.4Å; I45-M49 VanDerWaalsContact O-CG 3.3Å; I45-M49 WeakPolarHBondContact O-CG 3.33Å; I45-M49 PolarHBondContact O-N 2.82Å; M49-G51 PolarHBondContact O-N 3.1Å; M49-Y242 HydrophobicContact CE-CD1 3.69Å; M49-Y242 HydrophobicContact CE-CG 4.37Å; M49-Y242 VanDerWaalsContact CE-O 3.23Å; M49-Y242 WeakPolarHBondContact CE-O 3.16Å; M49-W245 HydrophobicContact CE-CB 4.28Å; M49-W245 HydrophobicContact CG-CB 4.47Å; M49-W245 HydrophobicContact SD-CB 3.91Å; M49-I270 HydrophobicContact CE-CG1 4.37Å; M49-I270 HydrophobicContact CE-CG2 4.05Å; M49-I270 HydrophobicContact SD-CG1 4.03Å; M49-V273 HydrophobicContact CB-CG1 4.39Å; M49-V273 HydrophobicContact CB-CG2 4.33Å; M49-V273 HydrophobicContact CE-CB 4.48Å; M49-V273 HydrophobicContact CE-CG1 4.26Å; M49-V273 HydrophobicContact SD-CG2 4.42Å; M49-Y277 PolarHBondContact O-OH 2.87Å |
| 50 | I | 84.3 | Confident | 82.4 | Confident | 1 Ų | 1 | 16 Ų | 16 | 1% | 0.005 | 10% | 0.095 | C | C | . | . | S | Bend | trans | -70.7 | 101.6 | 174.9 | -61 | -176.2 | 0 | 0 | 0 | 107.8 | V46 K194 L195 I198 V273 Y277 | V46-I50 HydrophobicContact CG1-CD1 3.57Å; V46-I50 HydrophobicContact CG1-CG1 4.21Å; V46-I50 WeakPolarHBondContact O-CB 3.13Å; V46-I50 VanDerWaalsContact O-CG1 3.29Å; V46-I50 WeakPolarHBondContact O-CG1 3.34Å; V46-I50 PolarHBondContact O-N 3.09Å; I50-K194 HydrophobicContact CB-CD 4.22Å; I50-K194 HydrophobicContact CG2-CD 3.99Å; I50-K194 HydrophobicContact CG2-CG 4.39Å; I50-K194 WeakPolarHBondContact O-CD 3.01Å; I50-K194 WeakPolarHBondContact O-CE 3.48Å; I50-K194 PolarHBondContact O-NZ 2.92Å; I50-L195 HydrophobicContact CD1-CD2 3.9Å; I50-I198 HydrophobicContact CB-CD1 4.44Å; I50-I198 HydrophobicContact CD1-CD1 4.02Å; I50-I198 HydrophobicContact CG1-CD1 4.49Å; I50-I198 HydrophobicContact CG2-CD1 3.18Å; I50-V273 HydrophobicContact CD1-CG2 4.18Å; I50-V273 HydrophobicContact CG1-CG1 4.09Å; I50-V273 HydrophobicContact CG1-CG2 3.92Å; I50-Y277 WeakPolarHBondContact CA-OH 3.45Å; I50-Y277 HydrophobicContact CG1-CE1 4.12Å |
| 51 | G | 80.9 | Confident | 83.1 | Confident | 5 Ų | 5 | 13 Ų | 13 | 5% | 0.052 | 8% | 0.075 | C | C | . | . | S | Bend | trans | -140.8 | -141.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | M49 G53 F55 S326 | M49-G51 PolarHBondContact O-N 3.1Å; G51-G53 PolarHBondContact O-N 2.86Å; G51-F55 WeakPolarHBondContact O-CD2 3.43Å; G51-F55 WeakPolarHBondContact O-CE2 3.46Å; G51-S326 WeakPolarHBondContact CA-OG 3.43Å |
| 52 | S | 79.7 | Confident | 83.8 | Confident | 3 Ų | 3 | 13.1 Ų | 13.1 | 2% | 0.021 | 8% | 0.075 | C | C | . | . | S | Bend | trans | -70.9 | -20.6 | 176.1 | 59.3 | 0 | 0 | 0 | 0 | 113.4 | I54 F55 I56 S140 T323 | S52-I54 PolarHBondContact O-N 2.8Å; S52-F55 PolarHBondContact O-N 3.17Å; S52-F55 VanDerWaalsContact O-N 3.11Å; S52-I56 PolarHBondContact O-N 3.17Å; S52-S140 VanDerWaalsContact CB-CB 3.48Å; S52-S140 WeakPolarHBondContact CB-OG 3.4Å; S52-S140 PolarHBondContact OG-OG 3.4Å; S52-T323 VanDerWaalsContact CB-CG2 3.5Å |
| 53 | G | 85.8 | Confident | 84.2 | Confident | 4 Ų | 4 | 16.8 Ų | 16.8 | 4% | 0.041 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -59.4 | -46.1 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114 | G51 F55 I56 S57 | G51-G53 PolarHBondContact O-N 2.86Å; G53-F55 PolarHBondContact O-N 3.39Å; G53-F55 VanDerWaalsContact O-N 3.11Å; G53-I56 PolarHBondContact O-N 2.87Å; G53-I56 VanDerWaalsContact O-N 3.16Å; G53-S57 WeakPolarHBondContact O-CB 3.24Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 2.84Å; G53-S57 VanDerWaalsContact O-OG 3.06Å |
| 54 | I | 89.1 | Confident | 84.7 | Confident | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -63.9 | -19.7 | 179.6 | -167.7 | 54.3 | 0 | 0 | 0 | 113.4 | S52 P58 W75 Y277 V280 | S52-I54 PolarHBondContact O-N 2.8Å; I54-P58 WeakPolarHBondContact O-CD 3.29Å; I54-P58 WeakPolarHBondContact O-CG 3.23Å; I54-W75 HydrophobicContact CD1-CH2 3.64Å; I54-W75 HydrophobicContact CD1-CZ2 4.08Å; I54-W75 HydrophobicContact CD1-CZ3 3.96Å; I54-Y277 HydrophobicContact CB-CD1 3.98Å; I54-Y277 HydrophobicContact CB-CE1 3.63Å; I54-Y277 HydrophobicContact CD1-CD1 3.65Å; I54-Y277 HydrophobicContact CD1-CD2 4.3Å; I54-Y277 HydrophobicContact CD1-CE1 4.2Å; I54-Y277 HydrophobicContact CD1-CG 3.69Å; I54-Y277 HydrophobicContact CG1-CD1 3.65Å; I54-Y277 HydrophobicContact CG1-CE1 3.85Å; I54-Y277 HydrophobicContact CG1-CG 4.22Å; I54-Y277 HydrophobicContact CG2-CE1 4.12Å; I54-V280 HydrophobicContact CD1-CG1 4.29Å; I54-V280 HydrophobicContact CG1-CB 4.4Å; I54-V280 HydrophobicContact CG1-CG1 3.95Å |
| 55 | F | 87.3 | Confident | 85.2 | Confident | 2 Ų | 2 | 13.1 Ų | 13.1 | 1% | 0.009 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -91.6 | -18 | -179.4 | -58.4 | -58.9 | 0 | 0 | 0 | 112.9 | G51 S52 G53 Y144 I197 I201 A300 V319 | G51-F55 WeakPolarHBondContact O-CD2 3.43Å; G51-F55 WeakPolarHBondContact O-CE2 3.46Å; S52-F55 PolarHBondContact O-N 3.17Å; S52-F55 VanDerWaalsContact O-N 3.11Å; G53-F55 PolarHBondContact O-N 3.39Å; G53-F55 VanDerWaalsContact O-N 3.11Å; F55-Y144 HydrophobicContact CB-CE1 4.45Å; F55-Y144 HydrophobicContact CB-CE2 3.69Å; F55-Y144 WeakPolarHBondContact CB-OH 3.23Å; F55-Y144 PolarHBondContact O-OH 3.37Å; F55-I197 HydrophobicContact CZ-CG2 4.4Å; F55-I201 HydrophobicContact CE1-CD1 4.4Å; F55-A300 HydrophobicContact CD1-CB 3.8Å; F55-A300 HydrophobicContact CE1-CB 4.25Å; F55-V319 HydrophobicContact CB-CG1 4.22Å; F55-V319 HydrophobicContact CD1-CG1 4.39Å; F55-V319 HydrophobicContact CD1-CG2 3.92Å; F55-V319 HydrophobicContact CD2-CG1 3.66Å; F55-V319 HydrophobicContact CD2-CG2 4.29Å; F55-V319 HydrophobicContact CE1-CG2 3.73Å; F55-V319 HydrophobicContact CE2-CB 4.48Å; F55-V319 HydrophobicContact CE2-CG1 4.07Å; F55-V319 HydrophobicContact CE2-CG2 4.13Å; F55-V319 HydrophobicContact CG-CG1 3.83Å; F55-V319 HydrophobicContact CG-CG2 4.19Å; F55-V319 HydrophobicContact CZ-CG2 3.84Å |
| 56 | I | 87.5 | Confident | 85.4 | Confident | 15 Ų | 15 | 15.2 Ų | 15.2 | 8% | 0.077 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -110.6 | -46.3 | -178.9 | -70.9 | 175.7 | 0 | 0 | 0 | 111.7 | S52 G53 P58 K59 S140 Y144 I381 I385 | S52-I56 PolarHBondContact O-N 3.17Å; G53-I56 PolarHBondContact O-N 2.87Å; G53-I56 VanDerWaalsContact O-N 3.16Å; I56-P58 VanDerWaalsContact C-N 3.34Å; I56-K59 PolarHBondContact O-N 2.86Å; I56-S140 WeakPolarHBondContact CD1-OG 3.49Å; I56-Y144 HydrophobicContact CG1-CE2 4.23Å; I56-I381 HydrophobicContact CD1-CD1 4.42Å; I56-I381 HydrophobicContact CD1-CG2 4.41Å; I56-I381 HydrophobicContact CG2-CG2 4.01Å; I56-I385 HydrophobicContact CG2-CD1 4.48Å |
| 57 | S | 90.9 | Very high | 85.6 | Confident | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -56.9 | -33.8 | -174.2 | -63.4 | 0 | 0 | 0 | 0 | 114.8 | G53 K59 S60 V61 N237 | G53-S57 WeakPolarHBondContact O-CB 3.24Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 2.84Å; G53-S57 VanDerWaalsContact O-OG 3.06Å; S57-K59 VanDerWaalsContact C-N 3.26Å; S57-K59 PolarHBondContact O-N 2.68Å; S57-S60 PolarHBondContact O-N 3.47Å; S57-V61 WeakPolarHBondContact O-CB 3.25Å; S57-V61 VanDerWaalsContact O-CG2 3.23Å; S57-V61 WeakPolarHBondContact O-CG2 3.38Å; S57-V61 PolarHBondContact O-N 3.48Å; S57-N237 WeakPolarHBondContact CB-O 3.31Å; S57-N237 PolarHBondContact OG-O 2.93Å |
| 58 | P | 91.1 | Very high | 86 | Confident | 1 Ų | 1 | 15.7 Ų | 15.7 | 1% | 0.006 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -54.3 | -39.8 | -178.7 | -29.8 | 36.8 | 0 | 0 | 0 | 114.1 | I54 I56 L62 W75 N281 Y284 | I54-P58 WeakPolarHBondContact O-CD 3.29Å; I54-P58 WeakPolarHBondContact O-CG 3.23Å; I56-P58 VanDerWaalsContact C-N 3.34Å; P58-L62 VanDerWaalsContact O-CB 3.25Å; P58-L62 WeakPolarHBondContact O-CB 3.43Å; P58-L62 PolarHBondContact O-N 3.45Å; P58-W75 HydrophobicContact CG-CZ2 4.04Å; P58-N281 WeakPolarHBondContact CB-OD1 3.35Å; P58-Y284 HydrophobicContact CB-CD2 4.47Å; P58-Y284 HydrophobicContact CG-CD2 4.4Å; P58-Y284 HydrophobicContact CG-CE2 4.15Å |
| 59 | K | 90.5 | Very high | 86.5 | Confident | 65 Ų | 65 | 14.8 Ų | 14.8 | 28% | 0.283 | 9% | 0.088 | S | C | . | . | H | α-helix | trans | -62.5 | -51.2 | 177.8 | 176.3 | 175.9 | -178.9 | 159 | 0 | 111.7 | I56 S57 L62 L63 L293 L294 S296 V299 | I56-K59 PolarHBondContact O-N 2.86Å; S57-K59 VanDerWaalsContact C-N 3.26Å; S57-K59 PolarHBondContact O-N 2.68Å; K59-L62 PolarHBondContact O-N 2.81Å; K59-L63 WeakPolarHBondContact O-CB 3.4Å; K59-L63 PolarHBondContact O-N 3.39Å; K59-L293 HydrophobicContact CB-CD2 4.22Å; K59-L294 WeakPolarHBondContact CE-O 3.27Å; K59-L294 HydrophobicContact CG-CD2 4.44Å; K59-L294 PolarHBondContact NZ-O 3.45Å; K59-L294 WeakPolarHBondContact O-CD2 3.36Å; K59-S296 WeakPolarHBondContact CD-O 3.44Å; K59-S296 PolarHBondContact NZ-O 3.27Å; K59-V299 HydrophobicContact CB-CG2 4.35Å |
| 60 | S | 88.6 | Confident | 86.7 | Confident | 4 Ų | 4 | 15.5 Ų | 15.5 | 3% | 0.028 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -71.2 | -37.5 | -176.8 | -54.7 | 0 | 0 | 0 | 0 | 112 | S57 L63 Y64 N237 N382 | S57-S60 PolarHBondContact O-N 3.47Å; S60-L63 PolarHBondContact O-N 3.26Å; S60-Y64 WeakPolarHBondContact O-CD2 3.4Å; S60-Y64 PolarHBondContact O-N 3.32Å; S60-Y64 VanDerWaalsContact O-N 3.11Å; S60-N237 WeakPolarHBondContact CB-OD1 3.42Å; S60-N382 PolarHBondContact OG-OD1 3.15Å |
| 61 | V | 90.7 | Very high | 87 | Confident | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63.9 | -43.9 | 174.7 | 177.7 | 0 | 0 | 0 | 0 | 110.3 | S57 Y64 S65 C71 I74 W75 N237 | S57-V61 WeakPolarHBondContact O-CB 3.25Å; S57-V61 VanDerWaalsContact O-CG2 3.23Å; S57-V61 WeakPolarHBondContact O-CG2 3.38Å; S57-V61 PolarHBondContact O-N 3.48Å; V61-Y64 PolarHBondContact O-N 2.74Å; V61-S65 WeakPolarHBondContact O-CB 3.08Å; V61-S65 PolarHBondContact O-N 3.44Å; V61-S65 PolarHBondContact O-OG 2.92Å; V61-C71 HydrophobicContact CG1-CB 4.47Å; V61-I74 HydrophobicContact CG1-CB 4.3Å; V61-I74 HydrophobicContact CG1-CG2 3.99Å; V61-W75 HydrophobicContact CG2-CZ2 4.47Å; V61-N237 HydrophobicContact CG2-CB 3.86Å |
| 62 | L | 90.1 | Very high | 87.4 | Confident | 2 Ų | 2 | 16.6 Ų | 16.6 | 1% | 0.01 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -62.9 | -43.9 | 175.8 | -175.8 | 63.3 | 0 | 0 | 0 | 111.7 | P58 K59 Y64 S65 G66 C71 F285 P290 L293 L294 | P58-L62 VanDerWaalsContact O-CB 3.25Å; P58-L62 WeakPolarHBondContact O-CB 3.43Å; P58-L62 PolarHBondContact O-N 3.45Å; K59-L62 PolarHBondContact O-N 2.81Å; L62-Y64 VanDerWaalsContact C-N 3.3Å; L62-Y64 PolarHBondContact O-N 3.41Å; L62-S65 WeakPolarHBondContact CA-OG 3.11Å; L62-S65 PolarHBondContact O-N 3.06Å; L62-S65 PolarHBondContact O-OG 2.98Å; L62-G66 PolarHBondContact O-N 3.28Å; L62-C71 HydrophobicContact CD1-CB 4.23Å; L62-F285 HydrophobicContact CD1-CE1 4.16Å; L62-F285 HydrophobicContact CD1-CZ 4.17Å; L62-F285 HydrophobicContact CD2-CE1 4.01Å; L62-P290 HydrophobicContact CD2-CB 4.07Å; L62-L293 HydrophobicContact CB-CD2 4.48Å; L62-L293 HydrophobicContact CD2-CB 4.11Å; L62-L293 HydrophobicContact CD2-CD1 4.41Å; L62-L293 HydrophobicContact CD2-CD2 3.82Å; L62-L293 HydrophobicContact CD2-CG 4.32Å; L62-L294 HydrophobicContact CB-CD2 4.22Å; L62-L294 HydrophobicContact CD2-CD2 4.18Å; L62-L294 HydrophobicContact CD2-CG 4.07Å; L62-L294 HydrophobicContact CG-CD2 4.2Å; L62-L294 HydrophobicContact CG-CG 4.44Å |
| 63 | L | 88.7 | Confident | 87.9 | Confident | 101 Ų | 101 | 21.5 Ų | 21.5 | 53% | 0.529 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -56.9 | -42.8 | 178.9 | -178.3 | 66.5 | 0 | 0 | 0 | 112.5 | K59 S60 L294 | K59-L63 WeakPolarHBondContact O-CB 3.4Å; K59-L63 PolarHBondContact O-N 3.39Å; S60-L63 PolarHBondContact O-N 3.26Å; L63-L294 HydrophobicContact CB-CD2 3.82Å; L63-L294 HydrophobicContact CD1-CD2 4.27Å |
| 64 | Y | 86.8 | Confident | 88.2 | Confident | 33 Ų | 33 | 21.9 Ų | 21.9 | 13% | 0.129 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -86.1 | -28.8 | -177.1 | -68.1 | -54.5 | 0 | 0 | 0 | 114 | S60 V61 L62 S225 A230 L233 | S60-Y64 WeakPolarHBondContact O-CD2 3.4Å; S60-Y64 PolarHBondContact O-N 3.32Å; S60-Y64 VanDerWaalsContact O-N 3.11Å; V61-Y64 PolarHBondContact O-N 2.74Å; L62-Y64 VanDerWaalsContact C-N 3.3Å; L62-Y64 PolarHBondContact O-N 3.41Å; Y64-S225 WeakPolarHBondContact O-CB 2.91Å; Y64-A230 WeakPolarHBondContact CB-O 3.45Å; Y64-L233 HydrophobicContact CD1-CB 4.08Å; Y64-L233 HydrophobicContact CD1-CD1 4.12Å; Y64-L233 HydrophobicContact CD2-CB 3.81Å; Y64-L233 HydrophobicContact CE1-CB 4.17Å; Y64-L233 HydrophobicContact CE1-CD1 3.66Å; Y64-L233 HydrophobicContact CE2-CB 3.92Å; Y64-L233 HydrophobicContact CG-CB 3.92Å |
| 65 | S | 84.6 | Confident | 88.3 | Confident | 2 Ų | 2 | 21.9 Ų | 21.9 | 1% | 0.014 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -79.1 | -24.5 | 177.3 | 63.1 | 0 | 0 | 0 | 0 | 113.1 | V61 L62 D67 C71 S225 | V61-S65 WeakPolarHBondContact O-CB 3.08Å; V61-S65 PolarHBondContact O-N 3.44Å; V61-S65 PolarHBondContact O-OG 2.92Å; L62-S65 WeakPolarHBondContact CA-OG 3.11Å; L62-S65 PolarHBondContact O-N 3.06Å; L62-S65 PolarHBondContact O-OG 2.98Å; S65-D67 PolarHBondContact O-N 3.12Å; S65-D67 PolarHBondContact OG-O 3.32Å; S65-C71 WeakPolarHBondContact OG-CB 3.49Å; S65-S225 PolarHBondContact O-N 2.89Å; S65-S225 VanDerWaalsContact O-N 3.08Å |
| 66 | G | 83.1 | Confident | 88.4 | Confident | 44 Ų | 44 | 24.7 Ų | 24.7 | 45% | 0.454 | 14% | 0.141 | S | C | . | . | trans | 87.9 | -37.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | L62 | L62-G66 PolarHBondContact O-N 3.28Š| ||
| 67 | D | 84.5 | Confident | 88.5 | Confident | 18 Ų | 18 | 25.5 Ų | 25.5 | 10% | 0.096 | 15% | 0.15 | C | C | . | . | S | Bend | trans | -145.6 | 166.7 | -173.5 | -157.1 | -2.3 | 0 | 0 | 0 | 112.8 | S65 P70 C71 F221 E222 G223 | S65-D67 PolarHBondContact O-N 3.12Å; S65-D67 PolarHBondContact OG-O 3.32Å; D67-P70 HydrophobicContact CB-CG 4.45Å; D67-C71 WeakPolarHBondContact O-CB 3.2Å; D67-C71 PolarHBondContact O-N 2.76Å; D67-C71 VanDerWaalsContact O-N 3.11Å; D67-F221 VanDerWaalsContact OD2-CA 3.29Å; D67-F221 WeakPolarHBondContact OD2-CA 3.46Å; D67-F221 PolarHBondContact OD2-N 3.3Å; D67-E222 PolarHBondContact OD2-N 3.35Å; D67-G223 PolarHBondContact OD2-N 3Å |
| 68 | V | 85.4 | Confident | 88.4 | Confident | 1 Ų | 1 | 25.5 Ų | 25.5 | 1% | 0.006 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -64.1 | -45.4 | -171 | -180 | 0 | 0 | 0 | 0 | 112.6 | C71 L72 L217 A220 F285 P290 | V68-C71 WeakPolarHBondContact O-CB 3.14Å; V68-C71 PolarHBondContact O-N 2.72Å; V68-L72 HydrophobicContact CG1-CD1 4.35Å; V68-L72 WeakPolarHBondContact O-CG 3.07Å; V68-L72 PolarHBondContact O-N 3.36Å; V68-L217 HydrophobicContact CG1-CD2 4.19Å; V68-A220 HydrophobicContact CB-CB 4.33Å; V68-F285 HydrophobicContact CG1-CB 4.31Å; V68-F285 HydrophobicContact CG1-CD1 4.02Å; V68-F285 HydrophobicContact CG1-CD2 3.6Å; V68-F285 HydrophobicContact CG1-CE1 4.22Å; V68-F285 HydrophobicContact CG1-CE2 3.83Å; V68-F285 HydrophobicContact CG1-CG 3.71Å; V68-F285 HydrophobicContact CG1-CZ 4.14Å; V68-F285 HydrophobicContact CG2-CD1 3.91Å; V68-F285 HydrophobicContact CG2-CE1 3.92Å; V68-F285 HydrophobicContact CG2-CG 4.43Å; V68-F285 HydrophobicContact CG2-CZ 4.43Å; V68-P290 HydrophobicContact CG2-CG 3.66Å |
| 69 | G | 85.8 | Confident | 88 | Confident | 6 Ų | 6 | 25.5 Ų | 25.5 | 6% | 0.062 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.3 | -55.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | C71 L72 L73 A220 | G69-C71 VanDerWaalsContact C-N 3.27Å; G69-C71 PolarHBondContact O-N 2.88Å; G69-L72 PolarHBondContact O-N 3.39Å; G69-L73 WeakPolarHBondContact O-CG 3.19Å; G69-L73 PolarHBondContact O-N 3.36Å; G69-A220 WeakPolarHBondContact CA-O 3.37Å; G69-A220 PolarHBondContact N-O 2.84Å |
| 70 | P | 86.3 | Confident | 87.7 | Confident | 19 Ų | 19 | 24.6 Ų | 24.6 | 12% | 0.123 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -55.6 | -38.3 | 172.3 | -27.4 | 36.2 | 0 | 0 | 0 | 113.5 | D67 L73 I74 A220 F221 | D67-P70 HydrophobicContact CB-CG 4.45Å; P70-L73 PolarHBondContact O-N 3.02Å; P70-I74 WeakPolarHBondContact O-CD1 3.41Å; P70-I74 VanDerWaalsContact O-CG1 3.25Å; P70-I74 WeakPolarHBondContact O-CG1 2.84Å; P70-I74 PolarHBondContact O-N 3.32Å; P70-A220 WeakPolarHBondContact CD-O 3.34Å; P70-F221 HydrophobicContact CG-CD1 4.26Å |
| 71 | C | 88.9 | Confident | 87.3 | Confident | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -58.9 | -49.4 | 175.4 | -177.5 | 0 | 0 | 0 | 0 | 112.1 | V61 L62 S65 D67 V68 G69 L73 I74 W75 F285 | V61-C71 HydrophobicContact CG1-CB 4.47Å; L62-C71 HydrophobicContact CD1-CB 4.23Å; S65-C71 WeakPolarHBondContact OG-CB 3.49Å; D67-C71 WeakPolarHBondContact O-CB 3.2Å; D67-C71 PolarHBondContact O-N 2.76Å; D67-C71 VanDerWaalsContact O-N 3.11Å; V68-C71 WeakPolarHBondContact O-CB 3.14Å; V68-C71 PolarHBondContact O-N 2.72Å; G69-C71 VanDerWaalsContact C-N 3.27Å; G69-C71 PolarHBondContact O-N 2.88Å; C71-L73 PolarHBondContact O-N 2.71Å; C71-I74 PolarHBondContact O-N 3.26Å; C71-W75 VanDerWaalsContact O-CD1 3.24Å; C71-W75 PolarHBondContact O-N 3.02Å; C71-F285 HydrophobicContact CB-CZ 4.46Å |
| 72 | L | 90 | Very high | 86.5 | Confident | 29 Ų | 29 | 27 Ų | 27 | 15% | 0.152 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -65.7 | -36.7 | 178 | -67.7 | 176.1 | 0 | 0 | 0 | 112.6 | V68 G69 I74 W75 T76 N281 I282 F285 | V68-L72 HydrophobicContact CG1-CD1 4.35Å; V68-L72 WeakPolarHBondContact O-CG 3.07Å; V68-L72 PolarHBondContact O-N 3.36Å; G69-L72 PolarHBondContact O-N 3.39Å; L72-I74 VanDerWaalsContact C-N 3.34Å; L72-W75 PolarHBondContact O-N 3.18Å; L72-T76 WeakPolarHBondContact O-CB 3.41Å; L72-T76 PolarHBondContact O-N 2.83Å; L72-T76 PolarHBondContact O-OG1 3.44Å; L72-N281 HydrophobicContact CD2-CB 3.8Å; L72-I282 HydrophobicContact CD1-CG1 4.12Å; L72-I282 HydrophobicContact CD2-CG1 3.94Å; L72-F285 HydrophobicContact CD2-CD2 4.34Å; L72-F285 HydrophobicContact CD2-CE2 4.14Å; L72-F285 HydrophobicContact CG-CE2 4.33Å |
| 73 | L | 90.6 | Very high | 85.3 | Confident | 105 Ų | 105 | 28.6 Ų | 28.6 | 55% | 0.55 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -63.1 | -40.7 | 172.9 | -71.9 | 176.5 | 0 | 0 | 0 | 111.3 | G69 P70 C71 T76 A77 F221 | G69-L73 WeakPolarHBondContact O-CG 3.19Å; G69-L73 PolarHBondContact O-N 3.36Å; P70-L73 PolarHBondContact O-N 3.02Å; C71-L73 PolarHBondContact O-N 2.71Å; L73-T76 PolarHBondContact O-N 3.28Å; L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 2.95Å; L73-F221 HydrophobicContact CD1-CE1 4.01Å; L73-F221 HydrophobicContact CD1-CZ 4.37Å |
| 74 | I | 91.2 | Very high | 83.5 | Confident | 13 Ų | 13 | 30.3 Ų | 30.3 | 7% | 0.067 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -67 | -40.9 | 176.9 | -70.3 | 160.7 | 0 | 0 | 0 | 110.8 | V61 P70 C71 L72 T76 A77 C78 A234 | V61-I74 HydrophobicContact CG1-CB 4.3Å; V61-I74 HydrophobicContact CG1-CG2 3.99Å; P70-I74 WeakPolarHBondContact O-CD1 3.41Å; P70-I74 VanDerWaalsContact O-CG1 3.25Å; P70-I74 WeakPolarHBondContact O-CG1 2.84Å; P70-I74 PolarHBondContact O-N 3.32Å; C71-I74 PolarHBondContact O-N 3.26Å; L72-I74 VanDerWaalsContact C-N 3.34Å; I74-T76 VanDerWaalsContact C-N 3.33Å; I74-T76 PolarHBondContact O-N 2.89Å; I74-A77 PolarHBondContact O-N 3.2Å; I74-C78 VanDerWaalsContact O-CB 3.31Å; I74-C78 WeakPolarHBondContact O-CB 3.12Å; I74-C78 PolarHBondContact O-N 3.39Å; I74-C78 PolarHBondContact O-SG 3.42Å; I74-A234 HydrophobicContact CD1-CB 3.74Å; I74-A234 HydrophobicContact CG2-CB 4.33Å |
| 75 | W | 91.9 | Very high | 81.6 | Confident | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.2 | -42.8 | 174.3 | -84.2 | 106.3 | 0 | 0 | 0 | 112.6 | I54 P58 V61 C71 L72 G79 A241 Y242 Y277 V278 N281 | I54-W75 HydrophobicContact CD1-CH2 3.64Å; I54-W75 HydrophobicContact CD1-CZ2 4.08Å; I54-W75 HydrophobicContact CD1-CZ3 3.96Å; P58-W75 HydrophobicContact CG-CZ2 4.04Å; V61-W75 HydrophobicContact CG2-CZ2 4.47Å; C71-W75 VanDerWaalsContact O-CD1 3.24Å; C71-W75 PolarHBondContact O-N 3.02Å; L72-W75 PolarHBondContact O-N 3.18Å; W75-G79 PolarHBondContact O-N 2.99Å; W75-A241 HydrophobicContact CH2-CB 3.46Å; W75-A241 VanDerWaalsContact CH2-CB 3.46Å; W75-A241 HydrophobicContact CZ3-CB 3.59Å; W75-Y242 AromaticContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CZ3-CD2 4.5Å; W75-Y242 AromaticContact CZ3-CE2 3.97Å; W75-Y242 HydrophobicContact CZ3-CE2 3.97Å; W75-Y242 PolarHBondContact O-OH 3.36Å; W75-Y277 AromaticContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CG 4.41Å; W75-Y277 HydrophobicContact CH2-CD2 4.49Å; W75-Y277 AromaticContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CD2 3.48Å; W75-Y277 VanDerWaalsContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CE2 4.09Å; W75-Y277 HydrophobicContact CZ3-CG 4.08Å; W75-V278 HydrophobicContact CB-CG2 4.34Å; W75-N281 VanDerWaalsContact CE2-ND2 3.27Å; W75-N281 PolarHBondContact NE1-ND2 3.02Å; W75-N281 PolarHBondContact NE1-OD1 3.02Å; W75-N281 VanDerWaalsContact NE1-OD1 3.14Å |
| 76 | T | 90.2 | Very high | 79.3 | Confident | 60 Ų | 60 | 37.5 Ų | 37.5 | 37% | 0.368 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -66.8 | -43.7 | 176.1 | -53.5 | 0 | 0 | 0 | 0 | 110.5 | L72 L73 I74 G79 V80 | L72-T76 WeakPolarHBondContact O-CB 3.41Å; L72-T76 PolarHBondContact O-N 2.83Å; L72-T76 PolarHBondContact O-OG1 3.44Å; L73-T76 PolarHBondContact O-N 3.28Å; I74-T76 VanDerWaalsContact C-N 3.33Å; I74-T76 PolarHBondContact O-N 2.89Å; T76-G79 CarbonylContact O-C 3.05Å; T76-G79 PolarHBondContact O-N 3.35Å; T76-V80 WeakPolarHBondContact O-CB 3.34Å; T76-V80 WeakPolarHBondContact O-CG2 3.31Å; T76-V80 PolarHBondContact O-N 3.28Å |
| 77 | A | 89.4 | Confident | 77.6 | Confident | 32 Ų | 32 | 35.4 Ų | 35.4 | 26% | 0.264 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -65.6 | -39.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | L73 I74 V80 L81 F235 | L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 2.95Å; I74-A77 PolarHBondContact O-N 3.2Å; A77-V80 CarbonylContact O-C 3.49Å; A77-V80 WeakPolarHBondContact O-CB 3.29Å; A77-V80 PolarHBondContact O-N 2.93Å; A77-L81 WeakPolarHBondContact O-CB 3.33Å; A77-L81 VanDerWaalsContact O-CG 3.26Å; A77-L81 WeakPolarHBondContact O-CG 3.35Å; A77-L81 PolarHBondContact O-N 3.47Å; A77-F235 HydrophobicContact CB-CE1 3.8Å; A77-F235 HydrophobicContact CB-CZ 3.85Å |
| 78 | C | 88 | Confident | 76.2 | Confident | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.1 | -45.9 | 172.6 | -69.2 | 0 | 0 | 0 | 0 | 110.9 | I74 V80 L81 A82 F235 L239 Y242 | I74-C78 VanDerWaalsContact O-CB 3.31Å; I74-C78 WeakPolarHBondContact O-CB 3.12Å; I74-C78 PolarHBondContact O-N 3.39Å; I74-C78 PolarHBondContact O-SG 3.42Å; C78-V80 VanDerWaalsContact C-N 3.29Å; C78-V80 PolarHBondContact O-N 2.9Å; C78-L81 PolarHBondContact O-N 2.78Å; C78-A82 WeakPolarHBondContact O-CB 3.07Å; C78-A82 PolarHBondContact O-N 3.07Å; C78-F235 WeakPolarHBondContact SG-CD1 3.42Å; C78-L239 HydrophobicContact CB-CD2 3.97Å; C78-L239 HydrophobicContact CB-CG 4.37Å; C78-Y242 HydrophobicContact CB-CD2 3.61Å; C78-Y242 HydrophobicContact CB-CE2 3.46Å; C78-Y242 VanDerWaalsContact CB-CE2 3.46Å |
| 79 | G | 83.4 | Confident | 74.9 | Confident | 1 Ų | 1 | 34.8 Ų | 34.8 | 1% | 0.01 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.7 | -39.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | W75 T76 A82 T83 Y242 T274 | W75-G79 PolarHBondContact O-N 2.99Å; T76-G79 CarbonylContact O-C 3.05Å; T76-G79 PolarHBondContact O-N 3.35Å; G79-A82 CarbonylContact O-C 3.46Å; G79-A82 PolarHBondContact O-N 3.18Å; G79-T83 WeakPolarHBondContact O-CA 2.84Å; G79-T83 WeakPolarHBondContact O-CB 3.34Å; G79-T83 PolarHBondContact O-N 2.87Å; G79-T83 PolarHBondContact O-OG1 2.84Å; G79-Y242 WeakPolarHBondContact CA-OH 2.91Å; G79-T274 WeakPolarHBondContact CA-OG1 3.49Å |
| 80 | V | 83.4 | Confident | 74.2 | Confident | 47 Ų | 47 | 35.4 Ų | 35.4 | 29% | 0.285 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -65.8 | -41.4 | 171.7 | 146 | 0 | 0 | 0 | 0 | 111.7 | T76 A77 C78 A82 T83 M84 G85 | T76-V80 WeakPolarHBondContact O-CB 3.34Å; T76-V80 WeakPolarHBondContact O-CG2 3.31Å; T76-V80 PolarHBondContact O-N 3.28Å; A77-V80 CarbonylContact O-C 3.49Å; A77-V80 WeakPolarHBondContact O-CB 3.29Å; A77-V80 PolarHBondContact O-N 2.93Å; C78-V80 VanDerWaalsContact C-N 3.29Å; C78-V80 PolarHBondContact O-N 2.9Å; V80-A82 VanDerWaalsContact C-N 3.27Å; V80-A82 PolarHBondContact O-N 2.78Å; V80-T83 CarbonylContact O-C 3.54Å; V80-T83 PolarHBondContact O-N 2.74Å; V80-T83 VanDerWaalsContact O-N 3.08Å; V80-M84 HydrophobicContact CB-CB 4.41Å; V80-M84 HydrophobicContact CB-CG 4.07Å; V80-M84 HydrophobicContact CB-SD 4.08Å; V80-M84 HydrophobicContact CG1-CB 3.78Å; V80-M84 HydrophobicContact CG1-CE 4.26Å; V80-M84 HydrophobicContact CG1-CG 3.6Å; V80-M84 HydrophobicContact CG1-SD 3.25Å; V80-M84 WeakPolarHBondContact CG1-SD 3.35Å; V80-M84 HydrophobicContact CG2-CG 3.93Å; V80-M84 HydrophobicContact CG2-SD 3.83Å; V80-M84 CarbonylContact O-C 3.49Å; V80-M84 WeakPolarHBondContact O-CA 3.35Å; V80-M84 WeakPolarHBondContact O-CB 3.35Å; V80-M84 PolarHBondContact O-N 3.23Å; V80-G85 PolarHBondContact O-N 2.95Å |
| 81 | L | 80.1 | Confident | 73.7 | Confident | 47 Ų | 47 | 34.5 Ų | 34.5 | 25% | 0.246 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -65.6 | -36.3 | 175.1 | -73.1 | 172.2 | 0 | 0 | 0 | 110.8 | A77 C78 G85 F235 L239 V430 | A77-L81 WeakPolarHBondContact O-CB 3.33Å; A77-L81 VanDerWaalsContact O-CG 3.26Å; A77-L81 WeakPolarHBondContact O-CG 3.35Å; A77-L81 PolarHBondContact O-N 3.47Å; C78-L81 PolarHBondContact O-N 2.78Å; L81-G85 PolarHBondContact O-N 2.86Å; L81-F235 HydrophobicContact CD1-CD1 3.93Å; L81-F235 HydrophobicContact CD1-CE1 3.65Å; L81-L239 HydrophobicContact CB-CD2 4.41Å; L81-V430 HydrophobicContact CD1-CG1 4.07Å; L81-V430 HydrophobicContact CD2-CG1 4Å; L81-V430 HydrophobicContact CD2-CG2 4.04Å |
| 82 | A | 74.8 | Confident | 73.2 | Confident | 6 Ų | 6 | 34.6 Ų | 34.6 | 5% | 0.05 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -69.4 | -35.4 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | C78 G79 V80 Y242 I270 | C78-A82 WeakPolarHBondContact O-CB 3.07Å; C78-A82 PolarHBondContact O-N 3.07Å; G79-A82 CarbonylContact O-C 3.46Å; G79-A82 PolarHBondContact O-N 3.18Å; V80-A82 VanDerWaalsContact C-N 3.27Å; V80-A82 PolarHBondContact O-N 2.78Å; A82-Y242 HydrophobicContact CB-CD1 4.34Å; A82-Y242 HydrophobicContact CB-CG 4.49Å; A82-I270 HydrophobicContact CB-CG2 3.57Å; A82-I270 WeakPolarHBondContact O-CD1 3.02Å |
| 83 | T | 64 | Low | 72.5 | Confident | 37 Ų | 37 | 33.2 Ų | 33.2 | 23% | 0.227 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -109.3 | -51.5 | -169.1 | -44 | 0 | 0 | 0 | 0 | 116.2 | G79 V80 G85 R86 I270 P271 | G79-T83 WeakPolarHBondContact O-CA 2.84Å; G79-T83 WeakPolarHBondContact O-CB 3.34Å; G79-T83 PolarHBondContact O-N 2.87Å; G79-T83 PolarHBondContact O-OG1 2.84Å; V80-T83 CarbonylContact O-C 3.54Å; V80-T83 PolarHBondContact O-N 2.74Å; V80-T83 VanDerWaalsContact O-N 3.08Å; T83-G85 VanDerWaalsContact C-C 3.47Å; T83-G85 CarbonylContact O-C 3.57Å; T83-G85 PolarHBondContact O-N 3.02Å; T83-R86 PolarHBondContact O-N 3.28Å; T83-I270 WeakPolarHBondContact OG1-CG2 3.25Å; T83-P271 HydrophobicContact CG2-CB 3.93Å; T83-P271 HydrophobicContact CG2-CG 3.67Å |
| 84 | M | 51.5 | Low | 72.2 | Confident | 137 Ų | 137 | 28.2 Ų | 28.2 | 68% | 0.675 | 15% | 0.147 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -7.1 | 158 | -64.1 | -178.3 | 42.6 | 0 | 0 | 112.1 | V80 R86 | V80-M84 HydrophobicContact CB-CB 4.41Å; V80-M84 HydrophobicContact CB-CG 4.07Å; V80-M84 HydrophobicContact CB-SD 4.08Å; V80-M84 HydrophobicContact CG1-CB 3.78Å; V80-M84 HydrophobicContact CG1-CE 4.26Å; V80-M84 HydrophobicContact CG1-CG 3.6Å; V80-M84 HydrophobicContact CG1-SD 3.25Å; V80-M84 WeakPolarHBondContact CG1-SD 3.35Å; V80-M84 HydrophobicContact CG2-CG 3.93Å; V80-M84 HydrophobicContact CG2-SD 3.83Å; V80-M84 CarbonylContact O-C 3.49Å; V80-M84 WeakPolarHBondContact O-CA 3.35Å; V80-M84 WeakPolarHBondContact O-CB 3.35Å; V80-M84 PolarHBondContact O-N 3.23Å; M84-R86 PolarHBondContact O-N 3.5Å |
| 85 | G | 46 | Very low | 71.8 | Confident | 3 Ų | 3 | 27.6 Ų | 27.6 | 3% | 0.031 | 14% | 0.144 | C | C | . | . | -48.7 | 41.2 | 126.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | V80 L81 T83 S87 G88 | V80-G85 PolarHBondContact O-N 2.95Å; L81-G85 PolarHBondContact O-N 2.86Å; T83-G85 VanDerWaalsContact C-C 3.47Å; T83-G85 CarbonylContact O-C 3.57Å; T83-G85 PolarHBondContact O-N 3.02Å; G85-S87 PolarHBondContact O-N 3.01Å; G85-G88 PolarHBondContact O-N 3.47Å | |||
| 86 | R | 36.2 | Very low | 71 | Confident | 183 Ų | 183 | 27.6 Ų | 27.6 | 69% | 0.691 | 14% | 0.144 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62 | 1.3 | 155 | -144.2 | 179.7 | -174 | 131.6 | -0.4 | 108.9 | T83 M84 L90 | T83-R86 PolarHBondContact O-N 3.28Å; M84-R86 PolarHBondContact O-N 3.5Å; R86-L90 VanDerWaalsContact C-CB 3.42Å; R86-L90 VanDerWaalsContact C-CD1 3.49Å; R86-L90 HydrophobicContact CB-CD1 4.29Å; R86-L90 HydrophobicContact CG-CD1 3.73Å; R86-L90 WeakPolarHBondContact O-CB 3.5Å; R86-L90 WeakPolarHBondContact O-CD1 3.32Å |
| 87 | S | 47.2 | Very low | 70.5 | Confident | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 13% | 0.127 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -143.3 | 17.9 | 158.9 | -33.3 | 0 | 0 | 0 | 0 | 114 | G85 C91 V419 I423 | G85-S87 PolarHBondContact O-N 3.01Å; S87-C91 WeakPolarHBondContact O-CA 3.3Å; S87-C91 WeakPolarHBondContact O-CB 3.44Å; S87-C91 PolarHBondContact O-N 3.38Å; S87-C91 PolarHBondContact O-SG 3.05Å; S87-V419 WeakPolarHBondContact OG-CB 3.4Å; S87-I423 VanDerWaalsContact CB-CB 3.47Å; S87-I423 WeakPolarHBondContact OG-CB 3.26Å; S87-I423 WeakPolarHBondContact OG-CD1 3.5Å; S87-I423 WeakPolarHBondContact OG-CG2 3.26Å |
| 88 | G | 55.6 | Low | 70.2 | Confident | 5 Ų | 5 | 24.6 Ų | 24.6 | 5% | 0.052 | 12% | 0.12 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | -77.7 | 171.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | G85 L90 C91 Y92 | G85-G88 PolarHBondContact O-N 3.47Å; G88-L90 PolarHBondContact O-N 3.33Å; G88-C91 WeakPolarHBondContact O-CB 3.23Å; G88-C91 PolarHBondContact O-N 3.04Å; G88-Y92 WeakPolarHBondContact O-CD2 3.21Å; G88-Y92 PolarHBondContact O-N 2.9Å |
| 89 | A | 59.5 | Low | 69.8 | Low | 1 Ų | 1 | 25.2 Ų | 25.2 | 1% | 0.008 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -57.8 | -28.3 | 164 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y92 A93 W245 I266 I270 | A89-Y92 CarbonylContact O-C 3.44Å; A89-Y92 WeakPolarHBondContact O-CB 3.43Å; A89-Y92 PolarHBondContact O-N 2.99Å; A89-A93 WeakPolarHBondContact O-CB 3.34Å; A89-A93 PolarHBondContact O-N 3.43Å; A89-W245 HydrophobicContact CB-CD2 4.41Å; A89-W245 HydrophobicContact CB-CE3 3.64Å; A89-W245 HydrophobicContact CB-CZ3 4.1Å; A89-I266 HydrophobicContact CB-CB 4.43Å; A89-I266 HydrophobicContact CB-CD1 4.08Å; A89-I266 HydrophobicContact CB-CG1 4.31Å; A89-I266 HydrophobicContact CB-CG2 3.31Å; A89-I270 HydrophobicContact CB-CD1 3.8Å |
| 90 | L | 69.9 | Low | 69.2 | Low | 19 Ų | 19 | 28.7 Ų | 28.7 | 10% | 0.099 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -79.8 | -27.7 | 172.8 | -86.4 | -177.5 | 0 | 0 | 0 | 114.4 | R86 G88 A93 E94 P263 V267 V417 V419 | R86-L90 VanDerWaalsContact C-CB 3.42Å; R86-L90 VanDerWaalsContact C-CD1 3.49Å; R86-L90 HydrophobicContact CB-CD1 4.29Å; R86-L90 HydrophobicContact CG-CD1 3.73Å; R86-L90 WeakPolarHBondContact O-CB 3.5Å; R86-L90 WeakPolarHBondContact O-CD1 3.32Å; G88-L90 PolarHBondContact O-N 3.33Å; L90-A93 HydrophobicContact CD2-CB 3.88Å; L90-A93 PolarHBondContact O-N 3.34Å; L90-E94 PolarHBondContact O-N 3.38Å; L90-P263 HydrophobicContact CD2-CB 3.53Å; L90-V267 HydrophobicContact CD1-CG2 4.18Å; L90-V417 HydrophobicContact CD2-CG1 4.44Å; L90-V419 HydrophobicContact CB-CG1 3.82Å; L90-V419 WeakPolarHBondContact O-CG1 3.18Å |
| 91 | C | 76.4 | Confident | 68.7 | Low | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.7 | -42.7 | 164.8 | -86.7 | 0 | 0 | 0 | 0 | 108.2 | S87 G88 A93 E94 L95 L403 | S87-C91 WeakPolarHBondContact O-CA 3.3Å; S87-C91 WeakPolarHBondContact O-CB 3.44Å; S87-C91 PolarHBondContact O-N 3.38Å; S87-C91 PolarHBondContact O-SG 3.05Å; G88-C91 WeakPolarHBondContact O-CB 3.23Å; G88-C91 PolarHBondContact O-N 3.04Å; C91-A93 VanDerWaalsContact C-N 3.31Å; C91-A93 PolarHBondContact O-N 2.75Å; C91-E94 PolarHBondContact O-N 3.44Å; C91-L95 VanDerWaalsContact O-CG 3.31Å; C91-L95 WeakPolarHBondContact O-CG 3.42Å; C91-L95 PolarHBondContact O-N 3.17Å; C91-L403 HydrophobicContact CB-CD1 3.58Å; C91-L403 WeakPolarHBondContact O-CD1 3.42Å |
| 92 | Y | 77.1 | Confident | 68.1 | Low | 1 Ų | 1 | 29.6 Ų | 29.6 | 0% | 0.004 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.3 | -34.6 | 174 | -88 | -109.8 | 0 | 0 | 0 | 113 | G88 A89 L95 G96 E105 Y108 W245 N246 Y396 T399 | G88-Y92 WeakPolarHBondContact O-CD2 3.21Å; G88-Y92 PolarHBondContact O-N 2.9Å; A89-Y92 CarbonylContact O-C 3.44Å; A89-Y92 WeakPolarHBondContact O-CB 3.43Å; A89-Y92 PolarHBondContact O-N 2.99Å; Y92-L95 PolarHBondContact O-N 3.41Å; Y92-G96 PolarHBondContact O-N 3.37Å; Y92-E105 HydrophobicContact CE1-CG 3.41Å; Y92-E105 VanDerWaalsContact CE1-CG 3.41Å; Y92-E105 WeakPolarHBondContact CE1-OE1 3.11Å; Y92-E105 VanDerWaalsContact CZ-OE1 3.24Å; Y92-E105 WeakPolarHBondContact OH-CG 3.44Å; Y92-E105 PolarHBondContact OH-OE1 3.3Å; Y92-Y108 HydrophobicContact CD1-CE2 4.23Å; Y92-W245 HydrophobicContact CD1-CZ3 4.1Å; Y92-W245 AromaticContact CD2-CH2 3.82Å; Y92-W245 HydrophobicContact CD2-CH2 3.82Å; Y92-W245 AromaticContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CE1-CH2 4.39Å; Y92-W245 HydrophobicContact CE1-CZ3 4.39Å; Y92-W245 AromaticContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CZ3 4.14Å; Y92-W245 HydrophobicContact CG-CH2 4.21Å; Y92-W245 AromaticContact CG-CZ3 3.75Å; Y92-W245 HydrophobicContact CG-CZ3 3.75Å; Y92-N246 HydrophobicContact CD1-CB 4.33Å; Y92-N246 HydrophobicContact CE1-CB 4.23Å; Y92-Y396 WeakPolarHBondContact OH-CD1 3.41Å; Y92-T399 HydrophobicContact CE1-CG2 4.15Å; Y92-T399 HydrophobicContact CE2-CG2 3.9Å |
| 93 | A | 77.1 | Confident | 67.8 | Low | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -69.9 | -38.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A89 L90 C91 G96 T97 L262 I266 | A89-A93 WeakPolarHBondContact O-CB 3.34Å; A89-A93 PolarHBondContact O-N 3.43Å; L90-A93 HydrophobicContact CD2-CB 3.88Å; L90-A93 PolarHBondContact O-N 3.34Å; C91-A93 VanDerWaalsContact C-N 3.31Å; C91-A93 PolarHBondContact O-N 2.75Å; A93-G96 PolarHBondContact O-N 3.02Å; A93-T97 VanDerWaalsContact O-CB 3.29Å; A93-T97 WeakPolarHBondContact O-CB 3.34Å; A93-T97 VanDerWaalsContact O-CG2 3.23Å; A93-T97 WeakPolarHBondContact O-CG2 3.42Å; A93-T97 PolarHBondContact O-N 3.28Å; A93-T97 PolarHBondContact O-OG1 3.36Å; A93-L262 HydrophobicContact CB-CD2 4.06Å; A93-L262 HydrophobicContact CB-CG 4.24Å; A93-I266 HydrophobicContact CB-CD1 4.22Å |
| 94 | E | 84 | Confident | 68.5 | Low | 1 Ų | 1 | 27.6 Ų | 27.6 | 1% | 0.005 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -60.2 | -47.7 | 169.8 | 171.6 | 168.6 | 166 | 0 | 0 | 110.1 | L90 C91 G96 T97 M98 L403 R407 R415 V417 V419 | L90-E94 PolarHBondContact O-N 3.38Å; C91-E94 PolarHBondContact O-N 3.44Å; E94-G96 PolarHBondContact O-N 2.9Å; E94-T97 PolarHBondContact O-N 2.96Å; E94-T97 PolarHBondContact O-OG1 3.48Å; E94-M98 WeakPolarHBondContact O-CB 3.33Å; E94-M98 PolarHBondContact O-N 3.27Å; E94-L403 HydrophobicContact CB-CD1 4.13Å; E94-L403 HydrophobicContact CG-CD1 4.09Å; E94-R407 IonicContact OE1-CZ 3.48Å; E94-R407 IonicContact OE1-NE 3.41Å; E94-R407 PolarHBondContact OE1-NE 2.92Å; E94-R407 IonicContact OE1-NH2 2.83Å; E94-R407 PolarHBondContact OE1-NH2 3.39Å; E94-R407 IonicContact OE2-CZ 3.89Å; E94-R407 IonicContact OE2-NH2 2.72Å; E94-R407 PolarHBondContact OE2-NH2 3.39Å; E94-R415 IonicContact OE1-NH1 3.24Å; E94-R415 PolarHBondContact OE1-NH1 3.07Å; E94-V417 WeakPolarHBondContact CB-O 3.18Å; E94-V417 VanDerWaalsContact CG-O 3.23Å; E94-V417 WeakPolarHBondContact CG-O 3.43Å; E94-V419 WeakPolarHBondContact OE2-CG2 3.37Å; E94-V419 PolarHBondContact OE2-N 3.26Å |
| 95 | L | 81.8 | Confident | 70 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -62.7 | -42.9 | 177 | -69.5 | 174.2 | 0 | 0 | 0 | 112.7 | C91 Y92 M98 I99 Y108 T399 L403 M406 | C91-L95 VanDerWaalsContact O-CG 3.31Å; C91-L95 WeakPolarHBondContact O-CG 3.42Å; C91-L95 PolarHBondContact O-N 3.17Å; Y92-L95 PolarHBondContact O-N 3.41Å; L95-M98 HydrophobicContact CD2-CE 3.81Å; L95-M98 PolarHBondContact O-N 3.37Å; L95-I99 PolarHBondContact O-N 3.22Å; L95-Y108 HydrophobicContact CB-CD1 3.99Å; L95-Y108 HydrophobicContact CB-CD2 3.81Å; L95-Y108 HydrophobicContact CB-CE1 3.99Å; L95-Y108 HydrophobicContact CB-CE2 3.79Å; L95-Y108 HydrophobicContact CB-CG 3.93Å; L95-Y108 HydrophobicContact CD1-CD2 3.81Å; L95-Y108 HydrophobicContact CD1-CE2 4.41Å; L95-Y108 HydrophobicContact CD1-CG 4.14Å; L95-Y108 HydrophobicContact CG-CD2 4.39Å; L95-Y108 HydrophobicContact CG-CG 4.46Å; L95-Y108 WeakPolarHBondContact O-CE1 3.32Å; L95-T399 HydrophobicContact CD1-CG2 3.61Å; L95-L403 HydrophobicContact CD1-CB 4.32Å; L95-L403 HydrophobicContact CD1-CD1 4.5Å; L95-L403 HydrophobicContact CD2-CB 4.08Å; L95-L403 HydrophobicContact CD2-CD1 4.29Å; L95-L403 HydrophobicContact CD2-CG 4.27Å; L95-L403 HydrophobicContact CG-CB 4.32Å; L95-L403 HydrophobicContact CG-CD1 3.99Å; L95-L403 HydrophobicContact CG-CG 4.47Å; L95-M406 HydrophobicContact CD2-CE 3.21Å |
| 96 | G | 76.3 | Confident | 71.9 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -74.7 | -22.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y92 A93 E94 Y108 | Y92-G96 PolarHBondContact O-N 3.37Å; A93-G96 PolarHBondContact O-N 3.02Å; E94-G96 PolarHBondContact O-N 2.9Å; G96-Y108 WeakPolarHBondContact CA-OH 3.31Å; G96-Y108 PolarHBondContact N-OH 2.82Å |
| 97 | T | 79.6 | Confident | 74.2 | Confident | 5 Ų | 5 | 12.9 Ų | 12.9 | 3% | 0.031 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -88.4 | -26.8 | 171.3 | 53.7 | 0 | 0 | 0 | 0 | 112.7 | A93 E94 Y259 L262 V417 | A93-T97 VanDerWaalsContact O-CB 3.29Å; A93-T97 WeakPolarHBondContact O-CB 3.34Å; A93-T97 VanDerWaalsContact O-CG2 3.23Å; A93-T97 WeakPolarHBondContact O-CG2 3.42Å; A93-T97 PolarHBondContact O-N 3.28Å; A93-T97 PolarHBondContact O-OG1 3.36Å; E94-T97 PolarHBondContact O-N 2.96Å; E94-T97 PolarHBondContact O-OG1 3.48Å; T97-Y259 HydrophobicContact CG2-CD1 3.92Å; T97-L262 HydrophobicContact CG2-CD2 4.27Å; T97-V417 HydrophobicContact CG2-CG2 4.09Å |
| 98 | M | 82.3 | Confident | 76.1 | Confident | 23 Ų | 23 | 12.9 Ų | 12.9 | 11% | 0.113 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -79.5 | -40.7 | 174.6 | -177.1 | -178.6 | 69.9 | 0 | 0 | 112.1 | E94 L95 M406 L413 R415 | E94-M98 WeakPolarHBondContact O-CB 3.33Å; E94-M98 PolarHBondContact O-N 3.27Å; L95-M98 HydrophobicContact CD2-CE 3.81Å; L95-M98 PolarHBondContact O-N 3.37Å; M98-M406 HydrophobicContact CE-CE 3.75Å; M98-M406 HydrophobicContact CE-SD 3.62Å; M98-L413 HydrophobicContact CG-CB 4.27Å; M98-L413 HydrophobicContact CG-CD1 4.25Å; M98-L413 HydrophobicContact SD-CB 4.27Å; M98-L413 HydrophobicContact SD-CD1 3.95Å; M98-R415 HydrophobicContact SD-CG 4.32Å |
| 99 | I | 79.6 | Confident | 77.7 | Confident | 13 Ų | 13 | 12.7 Ų | 12.7 | 7% | 0.067 | 7% | 0.066 | C | C | . | . | trans | -118.2 | 87.8 | -179.8 | -55.8 | 171.1 | 0 | 0 | 0 | 107.6 | L95 K101 Y108 E111 M406 | L95-I99 PolarHBondContact O-N 3.22Å; I99-K101 HydrophobicContact CG2-CB 4.07Å; I99-K101 HydrophobicContact CG2-CD 4.19Å; I99-K101 HydrophobicContact CG2-CG 4.09Å; I99-K101 PolarHBondContact O-N 3.26Å; I99-Y108 HydrophobicContact CB-CD1 4.07Å; I99-Y108 HydrophobicContact CB-CE1 4.12Å; I99-Y108 HydrophobicContact CD1-CD1 4.07Å; I99-Y108 HydrophobicContact CG2-CD1 4.4Å; I99-E111 HydrophobicContact CD1-CB 3.73Å; I99-E111 HydrophobicContact CD1-CG 3.92Å; I99-M406 HydrophobicContact CD1-CE 4.49Å; I99-M406 HydrophobicContact CD1-SD 4.17Å | ||
| 100 | T | 71.4 | Confident | 79 | Confident | 75 Ų | 75 | 14.9 Ų | 14.9 | 46% | 0.46 | 8% | 0.077 | S | C | . | . | trans | -79.9 | 45.8 | 178.1 | 61.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 101 | K | 71.6 | Confident | 79.9 | Confident | 111 Ų | 111 | 16.4 Ų | 16.4 | 48% | 0.483 | 8% | 0.083 | S | C | . | . | trans | -105.3 | 132.8 | 173.5 | -65.7 | 179.1 | -178.8 | 170.3 | 0 | 109 | I99 E111 | I99-K101 HydrophobicContact CG2-CB 4.07Å; I99-K101 HydrophobicContact CG2-CD 4.19Å; I99-K101 HydrophobicContact CG2-CG 4.09Å; I99-K101 PolarHBondContact O-N 3.26Å; K101-E111 IonicContact NZ-OE2 3.31Å | ||
| 102 | S | 67.3 | Low | 80.4 | Confident | 1 Ų | 1 | 17.4 Ų | 17.4 | 1% | 0.007 | 9% | 0.091 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.4 | 135.4 | 170.2 | 165.6 | 0 | 0 | 0 | 0 | 110.7 | S107 E253 R336 V340 | S102-S107 PolarHBondContact O-OG 3.22Å; S102-E253 WeakPolarHBondContact CB-OE1 3.43Å; S102-E253 VanDerWaalsContact CB-OE2 3.32Å; S102-E253 WeakPolarHBondContact CB-OE2 3.19Å; S102-E253 PolarHBondContact N-OE1 2.94Å; S102-R336 PolarHBondContact OG-NE 3.27Å; S102-R336 PolarHBondContact OG-NH2 3.47Å; S102-V340 WeakPolarHBondContact O-CG1 3.4Å; S102-V340 WeakPolarHBondContact OG-CG2 3.34Å |
| 103 | G | 69 | Low | 80.9 | Confident | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 11% | 0.106 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 131.4 | -12.9 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | E105 Y106 | G103-E105 PolarHBondContact O-N 3.31Å; G103-Y106 WeakPolarHBondContact O-CB 3.08Å; G103-Y106 PolarHBondContact O-N 3.18Å |
| 104 | A | 78.1 | Confident | 81.4 | Confident | 1 Ų | 1 | 22 Ų | 22 | 1% | 0.008 | 12% | 0.119 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 47.9 | -118.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112 | Y106 S107 Y108 N249 F250 | A104-Y106 PolarHBondContact O-N 3.03Å; A104-S107 WeakPolarHBondContact O-CB 3.25Å; A104-S107 PolarHBondContact O-N 3.49Å; A104-Y108 VanDerWaalsContact C-CE2 3.45Å; A104-Y108 HydrophobicContact CB-CE2 4.37Å; A104-Y108 WeakPolarHBondContact O-CD1 3.41Å; A104-Y108 WeakPolarHBondContact O-CD2 3.22Å; A104-Y108 PolarHBondContact O-N 3.32Å; A104-N249 HydrophobicContact CB-CB 4.08Å; A104-F250 HydrophobicContact CB-CD1 3.62Å; A104-F250 HydrophobicContact CB-CD2 3.87Å; A104-F250 HydrophobicContact CB-CE1 3.61Å; A104-F250 HydrophobicContact CB-CE2 3.88Å; A104-F250 HydrophobicContact CB-CG 3.76Å; A104-F250 HydrophobicContact CB-CZ 3.76Å |
| 105 | E | 84 | Confident | 81.5 | Confident | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -54 | -37 | -177.2 | -66.1 | 169.3 | -176.9 | 0 | 0 | 113.1 | Y92 G103 S107 Y108 L109 Y121 N246 Y396 T399 | Y92-E105 HydrophobicContact CE1-CG 3.41Å; Y92-E105 VanDerWaalsContact CE1-CG 3.41Å; Y92-E105 WeakPolarHBondContact CE1-OE1 3.11Å; Y92-E105 VanDerWaalsContact CZ-OE1 3.24Å; Y92-E105 WeakPolarHBondContact OH-CG 3.44Å; Y92-E105 PolarHBondContact OH-OE1 3.3Å; G103-E105 PolarHBondContact O-N 3.31Å; E105-S107 VanDerWaalsContact C-N 3.34Å; E105-S107 PolarHBondContact O-N 3.43Å; E105-Y108 PolarHBondContact O-N 3.41Å; E105-L109 WeakPolarHBondContact O-CB 3.49Å; E105-L109 VanDerWaalsContact O-CG 3.22Å; E105-L109 WeakPolarHBondContact O-CG 3.25Å; E105-L109 PolarHBondContact O-N 3.36Å; E105-Y121 HydrophobicContact CB-CD1 4.43Å; E105-Y121 HydrophobicContact CB-CD2 4.45Å; E105-Y121 HydrophobicContact CB-CE1 3.79Å; E105-Y121 HydrophobicContact CB-CE2 3.8Å; E105-Y121 VanDerWaalsContact CB-CZ 3.42Å; E105-Y121 WeakPolarHBondContact CB-OH 3.39Å; E105-Y121 HydrophobicContact CG-CE2 4.5Å; E105-Y121 WeakPolarHBondContact OE2-CE2 3.14Å; E105-Y121 PolarHBondContact OE2-OH 3.2Å; E105-N246 PolarHBondContact OE1-ND2 3.04Å; E105-Y396 WeakPolarHBondContact OE1-CD1 3.18Å; E105-Y396 WeakPolarHBondContact OE1-CE1 3.44Å; E105-T399 HydrophobicContact CG-CG2 4.35Å |
| 106 | Y | 86.1 | Confident | 81.8 | Confident | 3 Ų | 3 | 27.8 Ų | 27.8 | 1% | 0.012 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.5 | -46.4 | 176.7 | 173.4 | -100.6 | 0 | 0 | 0 | 111.7 | G103 A104 M110 A118 Y121 V340 E344 H346 | G103-Y106 WeakPolarHBondContact O-CB 3.08Å; G103-Y106 PolarHBondContact O-N 3.18Å; A104-Y106 PolarHBondContact O-N 3.03Å; Y106-M110 HydrophobicContact CE1-CE 4.39Å; Y106-M110 HydrophobicContact CE2-CE 4.28Å; Y106-M110 WeakPolarHBondContact O-CB 3.42Å; Y106-M110 PolarHBondContact O-N 3.14Å; Y106-M110 WeakPolarHBondContact OH-CE 3.47Å; Y106-A118 HydrophobicContact CD2-CB 3.99Å; Y106-A118 VanDerWaalsContact CD2-O 3.24Å; Y106-A118 WeakPolarHBondContact CD2-O 3.19Å; Y106-A118 HydrophobicContact CE2-CB 3.74Å; Y106-A118 WeakPolarHBondContact CE2-O 3.41Å; Y106-Y121 HydrophobicContact CD2-CD1 4.39Å; Y106-V340 HydrophobicContact CD1-CG1 3.86Å; Y106-V340 HydrophobicContact CE1-CG1 4.04Å; Y106-E344 HydrophobicContact CE1-CB 4.41Å; Y106-E344 HydrophobicContact CE1-CG 3.91Å; Y106-E344 VanDerWaalsContact OH-CB 3.25Å; Y106-E344 WeakPolarHBondContact OH-CB 3.49Å; Y106-H346 PolarHBondContact OH-CD2 2.88Å |
| 107 | S | 84.4 | Confident | 82.4 | Confident | 12 Ų | 12 | 29.1 Ų | 29.1 | 8% | 0.084 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -70.3 | -35.5 | 179.6 | -56.8 | 0 | 0 | 0 | 0 | 111.7 | S102 A104 E105 M110 E111 | S102-S107 PolarHBondContact O-OG 3.22Å; A104-S107 WeakPolarHBondContact O-CB 3.25Å; A104-S107 PolarHBondContact O-N 3.49Å; E105-S107 VanDerWaalsContact C-N 3.34Å; E105-S107 PolarHBondContact O-N 3.43Å; S107-M110 PolarHBondContact O-N 3.22Å; S107-E111 PolarHBondContact O-N 2.92Å |
| 108 | Y | 86.9 | Confident | 82.8 | Confident | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -67.8 | -44.9 | 177.7 | -51.2 | -27 | 0 | 0 | 0 | 111.6 | Y92 L95 G96 I99 A104 E105 M110 E111 A112 T399 | Y92-Y108 HydrophobicContact CD1-CE2 4.23Å; L95-Y108 HydrophobicContact CB-CD1 3.99Å; L95-Y108 HydrophobicContact CB-CD2 3.81Å; L95-Y108 HydrophobicContact CB-CE1 3.99Å; L95-Y108 HydrophobicContact CB-CE2 3.79Å; L95-Y108 HydrophobicContact CB-CG 3.93Å; L95-Y108 HydrophobicContact CD1-CD2 3.81Å; L95-Y108 HydrophobicContact CD1-CE2 4.41Å; L95-Y108 HydrophobicContact CD1-CG 4.14Å; L95-Y108 HydrophobicContact CG-CD2 4.39Å; L95-Y108 HydrophobicContact CG-CG 4.46Å; L95-Y108 WeakPolarHBondContact O-CE1 3.32Å; G96-Y108 WeakPolarHBondContact CA-OH 3.31Å; G96-Y108 PolarHBondContact N-OH 2.82Å; I99-Y108 HydrophobicContact CB-CD1 4.07Å; I99-Y108 HydrophobicContact CB-CE1 4.12Å; I99-Y108 HydrophobicContact CD1-CD1 4.07Å; I99-Y108 HydrophobicContact CG2-CD1 4.4Å; A104-Y108 VanDerWaalsContact C-CE2 3.45Å; A104-Y108 HydrophobicContact CB-CE2 4.37Å; A104-Y108 WeakPolarHBondContact O-CD1 3.41Å; A104-Y108 WeakPolarHBondContact O-CD2 3.22Å; A104-Y108 PolarHBondContact O-N 3.32Å; E105-Y108 PolarHBondContact O-N 3.41Å; Y108-M110 VanDerWaalsContact C-N 3.32Å; Y108-E111 PolarHBondContact O-N 2.88Å; Y108-A112 WeakPolarHBondContact O-CB 2.91Å; Y108-A112 PolarHBondContact O-N 3.36Å; Y108-A112 VanDerWaalsContact O-N 3.17Å; Y108-T399 HydrophobicContact CD2-CG2 3.97Å |
| 109 | L | 88.9 | Confident | 83.1 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -68 | -34.2 | 177.8 | -68.1 | 174 | 0 | 0 | 0 | 111.9 | E105 F113 G114 V117 Y121 F395 L398 A402 | E105-L109 WeakPolarHBondContact O-CB 3.49Å; E105-L109 VanDerWaalsContact O-CG 3.22Å; E105-L109 WeakPolarHBondContact O-CG 3.25Å; E105-L109 PolarHBondContact O-N 3.36Å; L109-F113 HydrophobicContact CD2-CD2 3.9Å; L109-F113 HydrophobicContact CD2-CE2 4.17Å; L109-F113 PolarHBondContact O-N 3.29Å; L109-G114 PolarHBondContact O-N 3.26Å; L109-V117 HydrophobicContact CB-CG1 4.2Å; L109-V117 HydrophobicContact CD1-CG1 4.28Å; L109-V117 HydrophobicContact CD2-CG1 4.06Å; L109-V117 HydrophobicContact CG-CG1 4.42Å; L109-Y121 HydrophobicContact CD1-CD2 4.05Å; L109-Y121 HydrophobicContact CD1-CG 3.81Å; L109-F395 HydrophobicContact CD1-CD1 4.36Å; L109-L398 HydrophobicContact CD2-CB 4.32Å; L109-L398 HydrophobicContact CD2-CD2 4.11Å; L109-L398 HydrophobicContact CD2-CG 3.76Å; L109-A402 HydrophobicContact CD2-CB 4.34Å |
| 110 | M | 88.1 | Confident | 83.6 | Confident | 48 Ų | 48 | 28.8 Ų | 28.8 | 24% | 0.236 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.2 | -45.4 | 174.2 | -175.6 | 64.6 | 78.8 | 0 | 0 | 111.7 | Y106 S107 Y108 G114 A118 H346 | Y106-M110 HydrophobicContact CE1-CE 4.39Å; Y106-M110 HydrophobicContact CE2-CE 4.28Å; Y106-M110 WeakPolarHBondContact O-CB 3.42Å; Y106-M110 PolarHBondContact O-N 3.14Å; Y106-M110 WeakPolarHBondContact OH-CE 3.47Å; S107-M110 PolarHBondContact O-N 3.22Å; Y108-M110 VanDerWaalsContact C-N 3.32Å; M110-G114 VanDerWaalsContact O-CA 3.24Å; M110-G114 WeakPolarHBondContact O-CA 3.49Å; M110-G114 PolarHBondContact O-N 3.21Å; M110-G114 VanDerWaalsContact O-N 3.14Å; M110-A118 HydrophobicContact CB-CB 3.87Å; M110-A118 HydrophobicContact CE-CB 3.6Å; M110-A118 HydrophobicContact SD-CB 4.03Å; M110-H346 WeakPolarHBondContact CE-NE2 3.48Å |
| 111 | E | 86.9 | Confident | 84.5 | Confident | 51 Ų | 51 | 25.3 Ų | 25.3 | 24% | 0.238 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -72.8 | -30.4 | -177.2 | -161 | 65.9 | -140.4 | 0 | 0 | 112.9 | I99 K101 S107 Y108 M406 R410 | I99-E111 HydrophobicContact CD1-CB 3.73Å; I99-E111 HydrophobicContact CD1-CG 3.92Å; K101-E111 IonicContact NZ-OE2 3.31Å; S107-E111 PolarHBondContact O-N 2.92Å; Y108-E111 PolarHBondContact O-N 2.88Å; E111-M406 HydrophobicContact CB-SD 4.48Å; E111-R410 IonicContact OE1-CZ 2.98Å; E111-R410 IonicContact OE1-NE 3.41Å; E111-R410 PolarHBondContact OE1-NE 3.48Å; E111-R410 IonicContact OE1-NH1 3.52Å; E111-R410 IonicContact OE1-NH2 3.81Å; E111-R410 PolarHBondContact OE1-NH2 3.46Å |
| 112 | A | 88.1 | Confident | 85.3 | Confident | 21 Ų | 21 | 20 Ų | 20 | 17% | 0.174 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -90.5 | -46.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y108 A402 M406 | Y108-A112 WeakPolarHBondContact O-CB 2.91Å; Y108-A112 PolarHBondContact O-N 3.36Å; Y108-A112 VanDerWaalsContact O-N 3.17Å; A112-A402 HydrophobicContact CB-CB 3.56Å; A112-M406 HydrophobicContact CB-CE 4.1Å; A112-M406 HydrophobicContact CB-CG 3.9Å; A112-M406 HydrophobicContact CB-SD 4.04Å |
| 113 | F | 87.8 | Confident | 86.4 | Confident | 72 Ų | 72 | 21.1 Ų | 21.1 | 32% | 0.316 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -117.1 | -6.6 | -172.5 | -62.2 | -65.1 | 0 | 0 | 0 | 113.5 | L109 V117 L398 L401 A402 V405 | L109-F113 HydrophobicContact CD2-CD2 3.9Å; L109-F113 HydrophobicContact CD2-CE2 4.17Å; L109-F113 PolarHBondContact O-N 3.29Å; F113-V117 HydrophobicContact CB-CB 3.8Å; F113-V117 HydrophobicContact CB-CG1 4.22Å; F113-V117 HydrophobicContact CB-CG2 3.68Å; F113-V117 HydrophobicContact CD2-CG1 4.21Å; F113-V117 HydrophobicContact CG-CG2 4.36Å; F113-L398 HydrophobicContact CD2-CD1 4.28Å; F113-L398 HydrophobicContact CD2-CG 4.37Å; F113-L398 HydrophobicContact CE2-CD1 3.69Å; F113-L398 HydrophobicContact CE2-CG 3.99Å; F113-L398 HydrophobicContact CZ-CD1 4.05Å; F113-L401 HydrophobicContact CZ-CD2 4.17Å; F113-L401 HydrophobicContact CZ-CG 4.16Å; F113-A402 HydrophobicContact CD2-CB 4.25Å; F113-A402 HydrophobicContact CE2-CB 3.66Å; F113-A402 HydrophobicContact CZ-CB 4.39Å; F113-V405 HydrophobicContact CE1-CG2 4.17Å; F113-V405 HydrophobicContact CZ-CG2 4.22Å |
| 114 | G | 86.9 | Confident | 87.4 | Confident | 25 Ų | 25 | 21.1 Ų | 21.1 | 26% | 0.258 | 12% | 0.119 | S | C | . | . | trans | 85.1 | -166.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | L109 M110 L116 A118 | L109-G114 PolarHBondContact O-N 3.26Å; M110-G114 VanDerWaalsContact O-CA 3.24Å; M110-G114 WeakPolarHBondContact O-CA 3.49Å; M110-G114 PolarHBondContact O-N 3.21Å; M110-G114 VanDerWaalsContact O-N 3.14Å; G114-L116 PolarHBondContact O-N 2.91Å; G114-A118 PolarHBondContact O-N 3.33Å | ||
| 115 | S | 85.5 | Confident | 87.9 | Confident | 53 Ų | 53 | 21.2 Ų | 21.2 | 37% | 0.371 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -68.8 | -29.6 | -165.5 | 51.1 | 0 | 0 | 0 | 0 | 115.4 | Y119 Y461 | S115-Y119 VanDerWaalsContact O-CB 3.25Å; S115-Y119 WeakPolarHBondContact O-CB 3.05Å; S115-Y119 PolarHBondContact O-N 2.96Å; S115-Y461 PolarHBondContact OG-OH 2.89Å; S115-Y461 VanDerWaalsContact OG-OH 3.04Å |
| 116 | L | 88.1 | Confident | 88.1 | Confident | 69 Ų | 69 | 21.5 Ų | 21.5 | 36% | 0.361 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -66.7 | -51.7 | -178.6 | -175.2 | 72.5 | 0 | 0 | 0 | 111.4 | G114 Y119 L120 L458 Y461 | G114-L116 PolarHBondContact O-N 2.91Å; L116-Y119 WeakPolarHBondContact O-CB 3.13Å; L116-Y119 PolarHBondContact O-N 3.47Å; L116-L120 WeakPolarHBondContact O-CG 3.07Å; L116-L120 PolarHBondContact O-N 3.02Å; L116-L458 HydrophobicContact CD1-CD2 3.58Å; L116-L458 HydrophobicContact CG-CD2 4.23Å; L116-Y461 HydrophobicContact CD1-CD1 3.43Å; L116-Y461 VanDerWaalsContact CD1-CD1 3.43Å; L116-Y461 HydrophobicContact CD1-CE1 3.37Å; L116-Y461 HydrophobicContact CD1-CE2 4.47Å; L116-Y461 HydrophobicContact CD1-CG 4.03Å |
| 117 | V | 89.6 | Confident | 88.1 | Confident | 29 Ų | 29 | 23.1 Ų | 23.1 | 18% | 0.176 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -69.5 | -41.3 | -177.1 | 176.6 | 0 | 0 | 0 | 0 | 110.7 | L109 F113 Y119 L120 Y121 L398 | L109-V117 HydrophobicContact CB-CG1 4.2Å; L109-V117 HydrophobicContact CD1-CG1 4.28Å; L109-V117 HydrophobicContact CD2-CG1 4.06Å; L109-V117 HydrophobicContact CG-CG1 4.42Å; F113-V117 HydrophobicContact CB-CB 3.8Å; F113-V117 HydrophobicContact CB-CG1 4.22Å; F113-V117 HydrophobicContact CB-CG2 3.68Å; F113-V117 HydrophobicContact CD2-CG1 4.21Å; F113-V117 HydrophobicContact CG-CG2 4.36Å; V117-Y119 VanDerWaalsContact C-N 3.29Å; V117-Y119 PolarHBondContact O-N 2.9Å; V117-L120 PolarHBondContact O-N 3.03Å; V117-Y121 PolarHBondContact O-N 3.46Å; V117-L398 HydrophobicContact CG1-CD2 3.31Å; V117-L398 HydrophobicContact CG1-CG 4.2Å |
| 118 | A | 87.9 | Confident | 88.3 | Confident | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -60.3 | -40 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y106 M110 G114 Y121 S122 | Y106-A118 HydrophobicContact CD2-CB 3.99Å; Y106-A118 VanDerWaalsContact CD2-O 3.24Å; Y106-A118 WeakPolarHBondContact CD2-O 3.19Å; Y106-A118 HydrophobicContact CE2-CB 3.74Å; Y106-A118 WeakPolarHBondContact CE2-O 3.41Å; M110-A118 HydrophobicContact CB-CB 3.87Å; M110-A118 HydrophobicContact CE-CB 3.6Å; M110-A118 HydrophobicContact SD-CB 4.03Å; G114-A118 PolarHBondContact O-N 3.33Å; A118-Y121 PolarHBondContact O-N 3.26Å; A118-S122 PolarHBondContact O-N 3.34Å |
| 119 | Y | 89 | Confident | 88.3 | Confident | 11 Ų | 11 | 22.8 Ų | 22.8 | 4% | 0.043 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.8 | -49 | 174.2 | 176.2 | -90.8 | 0 | 0 | 0 | 111.9 | S115 L116 V117 Y121 S122 W123 H346 G457 L460 Y461 V465 | S115-Y119 VanDerWaalsContact O-CB 3.25Å; S115-Y119 WeakPolarHBondContact O-CB 3.05Å; S115-Y119 PolarHBondContact O-N 2.96Å; L116-Y119 WeakPolarHBondContact O-CB 3.13Å; L116-Y119 PolarHBondContact O-N 3.47Å; V117-Y119 VanDerWaalsContact C-N 3.29Å; V117-Y119 PolarHBondContact O-N 2.9Å; Y119-Y121 VanDerWaalsContact C-N 3.26Å; Y119-Y121 PolarHBondContact O-N 3.37Å; Y119-S122 PolarHBondContact O-N 2.67Å; Y119-S122 PolarHBondContact O-OG 2.65Å; Y119-W123 HydrophobicContact CE1-CB 4.24Å; Y119-W123 WeakPolarHBondContact O-CB 3.43Å; Y119-W123 PolarHBondContact O-N 2.85Å; Y119-H346 HydrophobicContact CD2-CB 3.98Å; Y119-H346 AromaticContact CD2-ND1 3.8Å; Y119-H346 VanDerWaalsContact CD2-O 3.31Å; Y119-H346 WeakPolarHBondContact CD2-O 3.26Å; Y119-H346 WeakPolarHBondContact CE2-O 3.5Å; Y119-G457 VanDerWaalsContact CE1-O 3.22Å; Y119-G457 WeakPolarHBondContact CE1-O 3.3Å; Y119-L460 WeakPolarHBondContact OH-CB 3.4Å; Y119-Y461 AromaticContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CG 4.06Å; Y119-Y461 AromaticContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CE2 4.47Å; Y119-Y461 HydrophobicContact CE1-CD2 4.15Å; Y119-Y461 HydrophobicContact CE1-CG 4.39Å; Y119-Y461 HydrophobicContact CE2-CD2 4.32Å; Y119-Y461 AromaticContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CE2 4.03Å; Y119-Y461 HydrophobicContact CG-CG 4.32Å; Y119-V465 HydrophobicContact CD2-CG2 3.92Å; Y119-V465 HydrophobicContact CE2-CG2 3.8Å |
| 120 | L | 90.4 | Very high | 88.3 | Confident | 22 Ų | 22 | 24.2 Ų | 24.2 | 12% | 0.115 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -57.8 | -40.9 | 178.6 | -73.2 | 179 | 0 | 0 | 0 | 112.1 | L116 V117 W123 T124 I454 L458 | L116-L120 WeakPolarHBondContact O-CG 3.07Å; L116-L120 PolarHBondContact O-N 3.02Å; V117-L120 PolarHBondContact O-N 3.03Å; L120-W123 PolarHBondContact O-N 3.03Å; L120-T124 PolarHBondContact O-N 3.3Å; L120-T124 PolarHBondContact O-OG1 2.57Å; L120-I454 WeakPolarHBondContact CD2-O 3.47Å; L120-L458 HydrophobicContact CD1-CD2 4.04Å; L120-L458 HydrophobicContact CD2-CD2 3.87Å; L120-L458 HydrophobicContact CD2-CG 3.99Å; L120-L458 HydrophobicContact CG-CD2 4.18Å |
| 121 | Y | 89.8 | Confident | 88.3 | Confident | 3 Ų | 3 | 21.9 Ų | 21.9 | 1% | 0.012 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -60.2 | -51.9 | 172.1 | 174.3 | -99.2 | 0 | 0 | 0 | 111.6 | E105 Y106 L109 V117 A118 Y119 W123 T124 T125 L337 F395 | E105-Y121 HydrophobicContact CB-CD1 4.43Å; E105-Y121 HydrophobicContact CB-CD2 4.45Å; E105-Y121 HydrophobicContact CB-CE1 3.79Å; E105-Y121 HydrophobicContact CB-CE2 3.8Å; E105-Y121 VanDerWaalsContact CB-CZ 3.42Å; E105-Y121 WeakPolarHBondContact CB-OH 3.39Å; E105-Y121 HydrophobicContact CG-CE2 4.5Å; E105-Y121 WeakPolarHBondContact OE2-CE2 3.14Å; E105-Y121 PolarHBondContact OE2-OH 3.2Å; Y106-Y121 HydrophobicContact CD2-CD1 4.39Å; L109-Y121 HydrophobicContact CD1-CD2 4.05Å; L109-Y121 HydrophobicContact CD1-CG 3.81Å; V117-Y121 PolarHBondContact O-N 3.46Å; A118-Y121 PolarHBondContact O-N 3.26Å; Y119-Y121 VanDerWaalsContact C-N 3.26Å; Y119-Y121 PolarHBondContact O-N 3.37Å; Y121-W123 VanDerWaalsContact C-N 3.28Å; Y121-W123 PolarHBondContact O-N 3.03Å; Y121-T124 PolarHBondContact O-N 3.08Å; Y121-T125 VanDerWaalsContact CE2-OG1 3.24Å; Y121-T125 WeakPolarHBondContact CE2-OG1 2.93Å; Y121-T125 VanDerWaalsContact CZ-OG1 3.3Å; Y121-T125 WeakPolarHBondContact O-CB 3.46Å; Y121-T125 PolarHBondContact O-N 3.37Å; Y121-T125 PolarHBondContact O-OG1 3.26Å; Y121-L337 HydrophobicContact CE1-CD1 4.19Å; Y121-L337 HydrophobicContact CE1-CD2 4.47Å; Y121-F395 HydrophobicContact CD2-CB 3.95Å; Y121-F395 AromaticContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD2 4.27Å; Y121-F395 HydrophobicContact CD2-CE1 4.2Å; Y121-F395 AromaticContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CE2-CB 4.21Å; Y121-F395 HydrophobicContact CE2-CG 4.36Å; Y121-F395 HydrophobicContact CG-CD1 4.34Å |
| 122 | S | 89 | Confident | 88.5 | Confident | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -60.7 | -37.8 | -179.8 | 70.9 | 0 | 0 | 0 | 0 | 113 | A118 Y119 V126 | A118-S122 PolarHBondContact O-N 3.34Å; Y119-S122 PolarHBondContact O-N 2.67Å; Y119-S122 PolarHBondContact O-OG 2.65Å; S122-V126 VanDerWaalsContact O-CB 3.31Å; S122-V126 WeakPolarHBondContact O-CB 3.47Å; S122-V126 VanDerWaalsContact O-CG2 3.31Å; S122-V126 WeakPolarHBondContact O-CG2 3.24Å; S122-V126 PolarHBondContact O-N 3.4Å; S122-V126 VanDerWaalsContact O-N 3.07Å |
| 123 | W | 89.9 | Confident | 88.5 | Confident | 23 Ų | 23 | 19 Ų | 19 | 9% | 0.087 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.4 | -54.8 | 176.3 | 168.9 | -103.4 | 0 | 0 | 0 | 110.9 | Y119 L120 Y121 T125 M127 F453 L460 | Y119-W123 HydrophobicContact CE1-CB 4.24Å; Y119-W123 WeakPolarHBondContact O-CB 3.43Å; Y119-W123 PolarHBondContact O-N 2.85Å; L120-W123 PolarHBondContact O-N 3.03Å; Y121-W123 VanDerWaalsContact C-N 3.28Å; Y121-W123 PolarHBondContact O-N 3.03Å; W123-T125 VanDerWaalsContact C-N 3.34Å; W123-T125 PolarHBondContact O-N 2.96Å; W123-M127 HydrophobicContact CD2-CG 4.08Å; W123-M127 HydrophobicContact CE3-CG 3.83Å; W123-M127 HydrophobicContact CH2-CE 3.59Å; W123-M127 HydrophobicContact CH2-CG 4.09Å; W123-M127 HydrophobicContact CZ2-CE 4.35Å; W123-M127 HydrophobicContact CZ2-CG 4.31Å; W123-M127 HydrophobicContact CZ3-CE 3.82Å; W123-M127 HydrophobicContact CZ3-CG 3.83Å; W123-M127 HydrophobicContact CZ3-SD 4.32Å; W123-M127 VanDerWaalsContact O-CB 3.27Å; W123-M127 WeakPolarHBondContact O-CB 3.4Å; W123-M127 WeakPolarHBondContact O-CG 3.38Å; W123-M127 PolarHBondContact O-N 3.31Å; W123-F453 AromaticContact CE2-CE1 3.6Å; W123-F453 AromaticContact CE2-CZ 3.83Å; W123-F453 HydrophobicContact CH2-CZ 4.26Å; W123-F453 AromaticContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE2 4.15Å; W123-F453 AromaticContact CZ2-CZ 3.46Å; W123-F453 HydrophobicContact CZ2-CZ 3.46Å; W123-F453 VanDerWaalsContact CZ2-CZ 3.46Å; W123-F453 AromaticContact NE1-CD1 3.72Å; W123-F453 AromaticContact NE1-CE1 3.33Å; W123-F453 VanDerWaalsContact NE1-CE1 3.33Å; W123-F453 AromaticContact NE1-CZ 3.99Å; W123-F453 PolarHBondContact NE1-O 3.21Å; W123-L460 HydrophobicContact CE3-CD1 4.37Å; W123-L460 HydrophobicContact CH2-CD1 3.41Å; W123-L460 VanDerWaalsContact CH2-CD1 3.41Å; W123-L460 HydrophobicContact CZ2-CD1 4.18Å; W123-L460 HydrophobicContact CZ3-CD1 3.53Å |
| 124 | T | 90.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -65.5 | -39.5 | -179 | -53.5 | 0 | 0 | 0 | 0 | 111.3 | L120 Y121 V126 V128 L129 A391 F395 I454 | L120-T124 PolarHBondContact O-N 3.3Å; L120-T124 PolarHBondContact O-OG1 2.57Å; Y121-T124 PolarHBondContact O-N 3.08Å; T124-V126 PolarHBondContact O-N 3.41Å; T124-V128 HydrophobicContact CG2-CB 4.03Å; T124-V128 HydrophobicContact CG2-CG1 4.42Å; T124-V128 HydrophobicContact CG2-CG2 4.43Å; T124-V128 VanDerWaalsContact O-CA 3.32Å; T124-V128 WeakPolarHBondContact O-CA 3.36Å; T124-V128 VanDerWaalsContact O-CB 3.22Å; T124-V128 WeakPolarHBondContact O-CB 3.25Å; T124-V128 PolarHBondContact O-N 2.87Å; T124-L129 HydrophobicContact CG2-CG 4.39Å; T124-L129 PolarHBondContact O-N 3.05Å; T124-A391 HydrophobicContact CG2-CB 4.13Å; T124-F395 HydrophobicContact CG2-CE2 3.71Å; T124-I454 HydrophobicContact CG2-CD1 4.5Å; T124-I454 HydrophobicContact CG2-CG1 3.92Å |
| 125 | T | 88.4 | Confident | 88.7 | Confident | 3 Ų | 3 | 14.3 Ų | 14.3 | 2% | 0.018 | 8% | 0.078 | C | C | . | . | I | π-helix | trans | -68.9 | -40.6 | -177.7 | -54.5 | 0 | 0 | 0 | 0 | 112.5 | Y121 W123 L129 K130 L337 | Y121-T125 VanDerWaalsContact CE2-OG1 3.24Å; Y121-T125 WeakPolarHBondContact CE2-OG1 2.93Å; Y121-T125 VanDerWaalsContact CZ-OG1 3.3Å; Y121-T125 WeakPolarHBondContact O-CB 3.46Å; Y121-T125 PolarHBondContact O-N 3.37Å; Y121-T125 PolarHBondContact O-OG1 3.26Å; W123-T125 VanDerWaalsContact C-N 3.34Å; W123-T125 PolarHBondContact O-N 2.96Å; T125-L129 HydrophobicContact CG2-CB 4.26Å; T125-L129 HydrophobicContact CG2-CD1 4.28Å; T125-L129 PolarHBondContact O-N 3.09Å; T125-K130 HydrophobicContact CG2-CG 3.94Å; T125-K130 WeakPolarHBondContact O-CB 3.41Å; T125-K130 WeakPolarHBondContact O-CG 3.45Å; T125-K130 PolarHBondContact O-N 3.01Å; T125-L337 HydrophobicContact CG2-CD2 3.15Å |
| 126 | V | 86.8 | Confident | 88.9 | Confident | 7 Ų | 7 | 11.8 Ų | 11.8 | 4% | 0.042 | 6% | 0.06 | C | C | . | . | I | π-helix | trans | -76.1 | -35.8 | -179.5 | 170.3 | 0 | 0 | 0 | 0 | 112.3 | S122 T124 P131 L337 M347 F367 | S122-V126 VanDerWaalsContact O-CB 3.31Å; S122-V126 WeakPolarHBondContact O-CB 3.47Å; S122-V126 VanDerWaalsContact O-CG2 3.31Å; S122-V126 WeakPolarHBondContact O-CG2 3.24Å; S122-V126 PolarHBondContact O-N 3.4Å; S122-V126 VanDerWaalsContact O-N 3.07Å; T124-V126 PolarHBondContact O-N 3.41Å; V126-P131 VanDerWaalsContact O-CD 3.29Å; V126-P131 WeakPolarHBondContact O-CD 3.47Å; V126-P131 VanDerWaalsContact O-CG 3.26Å; V126-P131 WeakPolarHBondContact O-CG 3.37Å; V126-L337 HydrophobicContact CG2-CD2 4.27Å; V126-M347 HydrophobicContact CB-CE 3.92Å; V126-M347 HydrophobicContact CG1-CE 4.07Å; V126-M347 HydrophobicContact CG2-CE 3.99Å; V126-F367 HydrophobicContact CG1-CD1 4.15Å; V126-F367 HydrophobicContact CG1-CE1 3.81Å |
| 127 | M | 87.6 | Confident | 89 | Confident | 37 Ų | 37 | 9.1 Ų | 9.1 | 18% | 0.182 | 5% | 0.046 | C | C | . | . | I | π-helix | trans | -93.5 | -28.4 | -175.5 | -62.9 | -65.2 | -95 | 0 | 0 | 114.2 | W123 F367 L371 Y375 F453 | W123-M127 HydrophobicContact CD2-CG 4.08Å; W123-M127 HydrophobicContact CE3-CG 3.83Å; W123-M127 HydrophobicContact CH2-CE 3.59Å; W123-M127 HydrophobicContact CH2-CG 4.09Å; W123-M127 HydrophobicContact CZ2-CE 4.35Å; W123-M127 HydrophobicContact CZ2-CG 4.31Å; W123-M127 HydrophobicContact CZ3-CE 3.82Å; W123-M127 HydrophobicContact CZ3-CG 3.83Å; W123-M127 HydrophobicContact CZ3-SD 4.32Å; W123-M127 VanDerWaalsContact O-CB 3.27Å; W123-M127 WeakPolarHBondContact O-CB 3.4Å; W123-M127 WeakPolarHBondContact O-CG 3.38Å; W123-M127 PolarHBondContact O-N 3.31Å; M127-F367 HydrophobicContact CE-CZ 4.33Å; M127-F367 HydrophobicContact SD-CE1 3.71Å; M127-F367 HydrophobicContact SD-CZ 3.51Å; M127-F367 VanDerWaalsContact SD-CZ 3.51Å; M127-L371 HydrophobicContact SD-CD1 3.85Å; M127-Y375 WeakPolarHBondContact O-CE2 3.42Å; M127-Y375 PolarHBondContact O-OH 3.33Å; M127-F453 HydrophobicContact CB-CE1 3.49Å; M127-F453 VanDerWaalsContact CB-CE1 3.49Å; M127-F453 HydrophobicContact CB-CZ 3.49Å; M127-F453 VanDerWaalsContact CB-CZ 3.49Å; M127-F453 HydrophobicContact CE-CZ 4.33Å; M127-F453 HydrophobicContact CG-CE1 4.25Å; M127-F453 HydrophobicContact CG-CZ 4.06Å |
| 128 | V | 87.7 | Confident | 89 | Confident | 1 Ų | 1 | 7.8 Ų | 7.8 | 1% | 0.006 | 4% | 0.038 | C | C | . | . | I | π-helix | trans | -115.8 | -67.6 | -175 | 169.5 | 0 | 0 | 0 | 0 | 110.4 | T124 K130 P131 S132 Y387 A391 F453 | T124-V128 HydrophobicContact CG2-CB 4.03Å; T124-V128 HydrophobicContact CG2-CG1 4.42Å; T124-V128 HydrophobicContact CG2-CG2 4.43Å; T124-V128 VanDerWaalsContact O-CA 3.32Å; T124-V128 WeakPolarHBondContact O-CA 3.36Å; T124-V128 VanDerWaalsContact O-CB 3.22Å; T124-V128 WeakPolarHBondContact O-CB 3.25Å; T124-V128 PolarHBondContact O-N 2.87Å; V128-K130 PolarHBondContact O-N 2.98Å; V128-P131 WeakPolarHBondContact O-CD 3.42Å; V128-S132 WeakPolarHBondContact O-CB 3.46Å; V128-S132 PolarHBondContact O-N 3.02Å; V128-S132 PolarHBondContact O-OG 2.87Å; V128-Y387 HydrophobicContact CB-CE1 4.32Å; V128-Y387 HydrophobicContact CG1-CD1 4.04Å; V128-Y387 HydrophobicContact CG1-CE1 3.3Å; V128-Y387 HydrophobicContact CG2-CE1 4.28Å; V128-Y387 WeakPolarHBondContact CG2-OH 3.42Å; V128-A391 HydrophobicContact CG1-CB 4.47Å; V128-F453 HydrophobicContact CG2-CD1 3.35Å; V128-F453 HydrophobicContact CG2-CE1 3.52Å; V128-F453 HydrophobicContact CG2-CG 4.12Å; V128-F453 HydrophobicContact CG2-CZ 4.36Å |
| 129 | L | 88.3 | Confident | 89.1 | Confident | 3 Ų | 3 | 8 Ų | 8 | 2% | 0.016 | 4% | 0.039 | C | C | . | . | I | π-helix | trans | -63.3 | -49.3 | -164.3 | -61.9 | 172.3 | 0 | 0 | 0 | 113.1 | T124 T125 S133 F388 A391 Q392 | T124-L129 HydrophobicContact CG2-CG 4.39Å; T124-L129 PolarHBondContact O-N 3.05Å; T125-L129 HydrophobicContact CG2-CB 4.26Å; T125-L129 HydrophobicContact CG2-CD1 4.28Å; T125-L129 PolarHBondContact O-N 3.09Å; L129-S133 WeakPolarHBondContact O-CB 3.44Å; L129-S133 PolarHBondContact O-N 2.88Å; L129-F388 HydrophobicContact CB-CD2 4.26Å; L129-F388 HydrophobicContact CB-CE2 3.98Å; L129-F388 HydrophobicContact CD2-CD2 3.7Å; L129-F388 HydrophobicContact CD2-CE2 3.85Å; L129-F388 HydrophobicContact CD2-CG 4.4Å; L129-F388 WeakPolarHBondContact O-CE2 3.35Å; L129-A391 HydrophobicContact CD2-CB 3.64Å; L129-A391 HydrophobicContact CG-CB 4.45Å; L129-Q392 HydrophobicContact CD2-CB 3.96Å |
| 130 | K | 87.9 | Confident | 89.2 | Confident | 30 Ų | 30 | 7.5 Ų | 7.5 | 13% | 0.13 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -69.2 | -47.1 | -177.7 | -65.7 | -67.8 | 179.5 | -176.4 | 0 | 112.7 | T125 V128 F134 T333 A334 | T125-K130 HydrophobicContact CG2-CG 3.94Å; T125-K130 WeakPolarHBondContact O-CB 3.41Å; T125-K130 WeakPolarHBondContact O-CG 3.45Å; T125-K130 PolarHBondContact O-N 3.01Å; V128-K130 PolarHBondContact O-N 2.98Å; K130-F134 WeakPolarHBondContact O-CB 3.46Å; K130-F134 PolarHBondContact O-N 3.45Å; K130-T333 PolarHBondContact NZ-OG1 2.56Å; K130-A334 HydrophobicContact CB-CB 4.23Å; K130-A334 HydrophobicContact CD-CB 4.3Å; K130-A334 HydrophobicContact CG-CB 4.25Å |
| 131 | P | 89 | Confident | 89.2 | Confident | 0 Ų | 0 | 8.3 Ų | 8.3 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -63.4 | -42.7 | 175.4 | -24.9 | 34.8 | 0 | 0 | 0 | 113.2 | V126 V128 F134 A135 N368 L371 A372 Y375 | V126-P131 VanDerWaalsContact O-CD 3.29Å; V126-P131 WeakPolarHBondContact O-CD 3.47Å; V126-P131 VanDerWaalsContact O-CG 3.26Å; V126-P131 WeakPolarHBondContact O-CG 3.37Å; V128-P131 WeakPolarHBondContact O-CD 3.42Å; P131-F134 PolarHBondContact O-N 3.09Å; P131-A135 WeakPolarHBondContact O-CB 3.28Å; P131-A135 PolarHBondContact O-N 3.22Å; P131-N368 WeakPolarHBondContact CD-OD1 3.28Å; P131-N368 WeakPolarHBondContact CG-OD1 3.25Å; P131-L371 HydrophobicContact CB-CB 3.65Å; P131-L371 HydrophobicContact CG-CB 3.65Å; P131-L371 HydrophobicContact CG-CD1 3.78Å; P131-L371 HydrophobicContact CG-CG 4.4Å; P131-A372 HydrophobicContact CB-CB 4.41Å; P131-Y375 HydrophobicContact CB-CD2 3.71Å; P131-Y375 HydrophobicContact CB-CE2 3.76Å; P131-Y375 HydrophobicContact CG-CE2 4.49Å |
| 132 | S | 89.4 | Confident | 89.2 | Confident | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 4% | 0.039 | C | C | . | . | H | α-helix | trans | -65.2 | -44.7 | 178.9 | -60.2 | 0 | 0 | 0 | 0 | 111.5 | V128 F134 A135 I136 | V128-S132 WeakPolarHBondContact O-CB 3.46Å; V128-S132 PolarHBondContact O-N 3.02Å; V128-S132 PolarHBondContact O-OG 2.87Å; S132-F134 VanDerWaalsContact C-N 3.3Å; S132-F134 PolarHBondContact O-N 3.37Å; S132-A135 PolarHBondContact O-N 3.18Å; S132-I136 VanDerWaalsContact O-CG1 3.27Å; S132-I136 WeakPolarHBondContact O-CG1 3.38Å; S132-I136 PolarHBondContact O-N 2.97Å |
| 133 | S | 89.1 | Confident | 89.1 | Confident | 10 Ų | 10 | 9.9 Ų | 9.9 | 7% | 0.07 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -57.6 | -44.4 | 174.7 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | L129 I136 I137 | L129-S133 WeakPolarHBondContact O-CB 3.44Å; L129-S133 PolarHBondContact O-N 2.88Å; S133-I136 PolarHBondContact O-N 3.4Å; S133-I137 WeakPolarHBondContact O-CD1 3.47Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.33Å; S133-I137 PolarHBondContact O-N 3.44Å; S133-I137 VanDerWaalsContact O-N 3.08Å |
| 134 | F | 88.2 | Confident | 89 | Confident | 0 Ų | 0 | 8.8 Ų | 8.8 | 0% | 0 | 4% | 0.043 | C | C | . | . | H | α-helix | trans | -65.5 | -40.1 | 178.4 | -165.9 | -123.8 | 0 | 0 | 0 | 112.4 | K130 P131 S132 T138 I168 I171 I172 A327 C331 A372 | K130-F134 WeakPolarHBondContact O-CB 3.46Å; K130-F134 PolarHBondContact O-N 3.45Å; P131-F134 PolarHBondContact O-N 3.09Å; S132-F134 VanDerWaalsContact C-N 3.3Å; S132-F134 PolarHBondContact O-N 3.37Å; F134-T138 WeakPolarHBondContact O-CG2 3.5Å; F134-T138 PolarHBondContact O-N 3.46Å; F134-T138 VanDerWaalsContact O-N 3.09Å; F134-T138 PolarHBondContact O-OG1 2.83Å; F134-I168 HydrophobicContact CD1-CD1 3.93Å; F134-I168 HydrophobicContact CD1-CG1 3.96Å; F134-I168 HydrophobicContact CE1-CB 3.94Å; F134-I168 HydrophobicContact CE1-CD1 3.98Å; F134-I168 HydrophobicContact CE1-CG1 3.54Å; F134-I168 HydrophobicContact CE1-CG2 3.76Å; F134-I168 HydrophobicContact CZ-CG1 4.17Å; F134-I171 HydrophobicContact CE2-CG2 4.23Å; F134-I171 HydrophobicContact CZ-CB 4.35Å; F134-I171 HydrophobicContact CZ-CG2 4.08Å; F134-I172 HydrophobicContact CD1-CD1 4.43Å; F134-I172 HydrophobicContact CE1-CD1 3.52Å; F134-I172 HydrophobicContact CE1-CG1 3.97Å; F134-I172 HydrophobicContact CZ-CD1 3.99Å; F134-I172 HydrophobicContact CZ-CG1 3.9Å; F134-A327 HydrophobicContact CD2-CB 4.03Å; F134-A327 HydrophobicContact CE2-CB 3.62Å; F134-A327 WeakPolarHBondContact CE2-O 3.49Å; F134-C331 VanDerWaalsContact CE2-SG 3.51Å; F134-A372 HydrophobicContact CB-CB 4.28Å; F134-A372 HydrophobicContact CD1-CB 3.64Å; F134-A372 HydrophobicContact CG-CB 4.45Å |
| 135 | A | 90.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -62.9 | -45.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | P131 S132 I137 T138 L139 I376 L384 | P131-A135 WeakPolarHBondContact O-CB 3.28Å; P131-A135 PolarHBondContact O-N 3.22Å; S132-A135 PolarHBondContact O-N 3.18Å; A135-I137 PolarHBondContact O-N 3.08Å; A135-T138 PolarHBondContact O-N 2.81Å; A135-T138 PolarHBondContact O-OG1 3.37Å; A135-T138 VanDerWaalsContact O-OG1 3.11Å; A135-L139 WeakPolarHBondContact O-CB 3.42Å; A135-L139 VanDerWaalsContact O-CG 3.3Å; A135-L139 WeakPolarHBondContact O-CG 3.42Å; A135-L139 PolarHBondContact O-N 3.34Å; A135-I376 HydrophobicContact CB-CG1 3.93Å; A135-L384 HydrophobicContact CB-CD2 3.9Å |
| 136 | I | 90.3 | Very high | 88.9 | Confident | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -58.1 | -49.5 | 177.1 | -63.9 | 160.8 | 0 | 0 | 0 | 110.5 | S132 S133 T138 L139 S140 W240 I381 L384 I385 F388 | S132-I136 VanDerWaalsContact O-CG1 3.27Å; S132-I136 WeakPolarHBondContact O-CG1 3.38Å; S132-I136 PolarHBondContact O-N 2.97Å; S133-I136 PolarHBondContact O-N 3.4Å; I136-T138 VanDerWaalsContact C-N 3.33Å; I136-T138 PolarHBondContact O-N 3.4Å; I136-L139 PolarHBondContact O-N 3.15Å; I136-S140 PolarHBondContact O-N 3.3Å; I136-S140 PolarHBondContact O-OG 3.39Å; I136-W240 HydrophobicContact CB-CH2 3.91Å; I136-W240 HydrophobicContact CB-CZ2 3.75Å; I136-W240 HydrophobicContact CD1-CE3 4.37Å; I136-W240 HydrophobicContact CD1-CH2 3.85Å; I136-W240 HydrophobicContact CD1-CZ2 4.21Å; I136-W240 HydrophobicContact CD1-CZ3 3.93Å; I136-W240 HydrophobicContact CG1-CH2 4.5Å; I136-W240 HydrophobicContact CG2-CH2 3.96Å; I136-W240 HydrophobicContact CG2-CZ2 3.28Å; I136-I381 HydrophobicContact CG2-CG2 4.27Å; I136-L384 HydrophobicContact CD1-CB 4.36Å; I136-L384 HydrophobicContact CD1-CD2 4.39Å; I136-L384 HydrophobicContact CD1-CG 4.03Å; I136-L384 HydrophobicContact CG1-CB 4.01Å; I136-L384 HydrophobicContact CG1-CD2 3.56Å; I136-L384 HydrophobicContact CG1-CG 3.69Å; I136-I385 HydrophobicContact CD1-CG1 3.84Å; I136-I385 HydrophobicContact CG1-CG1 4.31Å; I136-I385 HydrophobicContact CG2-CD1 4.26Å; I136-I385 HydrophobicContact CG2-CG1 3.98Å; I136-F388 HydrophobicContact CD1-CB 4.25Å |
| 137 | I | 89.8 | Confident | 88.8 | Confident | 12 Ų | 12 | 10.2 Ų | 10.2 | 6% | 0.062 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -63.8 | -38.5 | -177.1 | -62.5 | 164.3 | 0 | 0 | 0 | 111.6 | S133 A135 S140 F141 W240 T323 A327 | S133-I137 WeakPolarHBondContact O-CD1 3.47Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.33Å; S133-I137 PolarHBondContact O-N 3.44Å; S133-I137 VanDerWaalsContact O-N 3.08Å; A135-I137 PolarHBondContact O-N 3.08Å; I137-S140 WeakPolarHBondContact O-CB 3.46Å; I137-S140 PolarHBondContact O-N 3.04Å; I137-F141 PolarHBondContact O-N 3.34Å; I137-W240 HydrophobicContact CG1-CH2 4.25Å; I137-W240 HydrophobicContact CG1-CZ2 4.07Å; I137-T323 WeakPolarHBondContact CG2-O 3.48Å; I137-A327 HydrophobicContact CB-CB 4.5Å; I137-A327 HydrophobicContact CG2-CB 3.8Å |
| 138 | T | 89.9 | Confident | 88.6 | Confident | 1 Ų | 1 | 11.2 Ų | 11.2 | 1% | 0.006 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -77.2 | -32.7 | 180 | 51.8 | 0 | 0 | 0 | 0 | 113.5 | F134 A135 I136 S140 F141 A142 S164 I168 I171 A327 | F134-T138 WeakPolarHBondContact O-CG2 3.5Å; F134-T138 PolarHBondContact O-N 3.46Å; F134-T138 VanDerWaalsContact O-N 3.09Å; F134-T138 PolarHBondContact O-OG1 2.83Å; A135-T138 PolarHBondContact O-N 2.81Å; A135-T138 PolarHBondContact O-OG1 3.37Å; A135-T138 VanDerWaalsContact O-OG1 3.11Å; I136-T138 VanDerWaalsContact C-N 3.33Å; I136-T138 PolarHBondContact O-N 3.4Å; T138-S140 VanDerWaalsContact C-N 3.3Å; T138-F141 WeakPolarHBondContact O-CB 3.34Å; T138-F141 PolarHBondContact O-N 3.1Å; T138-A142 PolarHBondContact O-N 3.33Å; T138-S164 PolarHBondContact O-OG 2.69Å; T138-I168 HydrophobicContact CG2-CD1 4.34Å; T138-I168 HydrophobicContact CG2-CG1 3.46Å; T138-I168 VanDerWaalsContact CG2-CG1 3.46Å; T138-I168 WeakPolarHBondContact OG1-CD1 3.48Å; T138-I168 WeakPolarHBondContact OG1-CG1 3.44Å; T138-I171 HydrophobicContact CG2-CD1 4.33Å; T138-A327 HydrophobicContact CG2-CB 4.29Å |
| 139 | L | 90.3 | Very high | 88.6 | Confident | 6 Ų | 6 | 19 Ų | 19 | 3% | 0.031 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -60.2 | -42.8 | 165.8 | -75.4 | 167.6 | 0 | 0 | 0 | 111.2 | A135 I136 F141 A142 E143 I160 K161 S164 I376 A379 I381 | A135-L139 WeakPolarHBondContact O-CB 3.42Å; A135-L139 VanDerWaalsContact O-CG 3.3Å; A135-L139 WeakPolarHBondContact O-CG 3.42Å; A135-L139 PolarHBondContact O-N 3.34Å; I136-L139 PolarHBondContact O-N 3.15Å; L139-F141 VanDerWaalsContact C-N 3.34Å; L139-F141 PolarHBondContact O-N 3.18Å; L139-A142 PolarHBondContact O-N 3.15Å; L139-E143 PolarHBondContact O-N 2.96Å; L139-I160 HydrophobicContact CD2-CG2 4.17Å; L139-K161 HydrophobicContact CD2-CG 4.44Å; L139-S164 VanDerWaalsContact CA-OG 3.3Å; L139-S164 WeakPolarHBondContact CA-OG 3.36Å; L139-I376 HydrophobicContact CD2-CG2 4.22Å; L139-I376 HydrophobicContact CG-CG1 4.35Å; L139-A379 HydrophobicContact CD1-CB 4.1Å; L139-I381 HydrophobicContact CB-CD1 3.96Å; L139-I381 HydrophobicContact CB-CG1 3.89Å; L139-I381 HydrophobicContact CD1-CG1 4.11Å |
| 140 | S | 89.7 | Confident | 88.4 | Confident | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -57.6 | -47.4 | 174.9 | -45.7 | 0 | 0 | 0 | 0 | 111.8 | S52 I56 I136 I137 T138 A142 E143 Y144 | S52-S140 VanDerWaalsContact CB-CB 3.48Å; S52-S140 WeakPolarHBondContact CB-OG 3.4Å; S52-S140 PolarHBondContact OG-OG 3.4Å; I56-S140 WeakPolarHBondContact CD1-OG 3.49Å; I136-S140 PolarHBondContact O-N 3.3Å; I136-S140 PolarHBondContact O-OG 3.39Å; I137-S140 WeakPolarHBondContact O-CB 3.46Å; I137-S140 PolarHBondContact O-N 3.04Å; T138-S140 VanDerWaalsContact C-N 3.3Å; S140-A142 VanDerWaalsContact C-N 3.3Å; S140-A142 PolarHBondContact O-N 3.35Å; S140-E143 PolarHBondContact O-N 3.36Å; S140-Y144 WeakPolarHBondContact O-CD2 3.34Å; S140-Y144 PolarHBondContact O-N 3.08Å; S140-Y144 VanDerWaalsContact O-N 3.12Å |
| 141 | F | 90.4 | Very high | 87.8 | Confident | 39 Ų | 39 | 26.7 Ų | 26.7 | 17% | 0.171 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -56.9 | -46.9 | 176.7 | 166.1 | -96.4 | 0 | 0 | 0 | 110.9 | I137 T138 L139 Y144 A145 L163 A167 A320 T323 | I137-F141 PolarHBondContact O-N 3.34Å; T138-F141 WeakPolarHBondContact O-CB 3.34Å; T138-F141 PolarHBondContact O-N 3.1Å; L139-F141 VanDerWaalsContact C-N 3.34Å; L139-F141 PolarHBondContact O-N 3.18Å; F141-Y144 PolarHBondContact O-N 3.07Å; F141-A145 HydrophobicContact CE1-CB 4.49Å; F141-A145 HydrophobicContact CZ-CB 4.4Å; F141-A145 WeakPolarHBondContact O-CB 3.26Å; F141-A145 PolarHBondContact O-N 3.47Å; F141-L163 HydrophobicContact CE1-CD1 4.46Å; F141-L163 HydrophobicContact CE1-CG 4.23Å; F141-A167 HydrophobicContact CD1-CB 3.65Å; F141-A167 HydrophobicContact CE1-CB 3.71Å; F141-A320 HydrophobicContact CD2-CB 3.88Å; F141-A320 HydrophobicContact CE2-CB 3.78Å; F141-T323 WeakPolarHBondContact CA-OG1 3.42Å; F141-T323 VanDerWaalsContact CB-OG1 3.28Å; F141-T323 WeakPolarHBondContact CB-OG1 3.21Å; F141-T323 WeakPolarHBondContact CD2-OG1 3.44Å |
| 142 | A | 90.1 | Very high | 87.2 | Confident | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -68.6 | -37.2 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | T138 L139 S140 S146 I160 L163 S164 | T138-A142 PolarHBondContact O-N 3.33Å; L139-A142 PolarHBondContact O-N 3.15Å; S140-A142 VanDerWaalsContact C-N 3.3Å; S140-A142 PolarHBondContact O-N 3.35Å; A142-S146 VanDerWaalsContact O-CB 3.26Å; A142-S146 WeakPolarHBondContact O-CB 3.43Å; A142-S146 PolarHBondContact O-N 3.28Å; A142-S146 PolarHBondContact O-OG 3.2Å; A142-I160 HydrophobicContact CB-CB 4.45Å; A142-I160 HydrophobicContact CB-CG2 3.74Å; A142-I160 WeakPolarHBondContact CB-O 3.25Å; A142-L163 HydrophobicContact CB-CB 3.93Å; A142-L163 HydrophobicContact CB-CD2 4.06Å; A142-L163 HydrophobicContact CB-CG 4.04Å; A142-S164 WeakPolarHBondContact CB-OG 3.25Å |
| 143 | E | 87.7 | Confident | 86.7 | Confident | 36 Ų | 36 | 38.1 Ų | 38.1 | 17% | 0.168 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62.9 | -47.8 | 175 | -171.2 | 166.1 | -162.9 | 0 | 0 | 110.9 | L139 S140 S146 A147 S297 I381 | L139-E143 PolarHBondContact O-N 2.96Å; S140-E143 PolarHBondContact O-N 3.36Å; E143-S146 PolarHBondContact O-N 2.99Å; E143-S146 PolarHBondContact O-OG 3.35Å; E143-A147 WeakPolarHBondContact O-CB 3.05Å; E143-A147 PolarHBondContact O-N 3.26Å; E143-S297 WeakPolarHBondContact OE1-CB 3.46Å; E143-I381 WeakPolarHBondContact OE2-CD1 3.36Å |
| 144 | Y | 87.7 | Confident | 86.1 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -69.8 | -33.1 | 178.4 | -87.9 | -83.7 | 0 | 0 | 0 | 114.2 | F55 I56 S140 F141 P148 A298 V299 A300 V301 V319 | F55-Y144 HydrophobicContact CB-CE1 4.45Å; F55-Y144 HydrophobicContact CB-CE2 3.69Å; F55-Y144 WeakPolarHBondContact CB-OH 3.23Å; F55-Y144 PolarHBondContact O-OH 3.37Å; I56-Y144 HydrophobicContact CG1-CE2 4.23Å; S140-Y144 WeakPolarHBondContact O-CD2 3.34Å; S140-Y144 PolarHBondContact O-N 3.08Å; S140-Y144 VanDerWaalsContact O-N 3.12Å; F141-Y144 PolarHBondContact O-N 3.07Å; Y144-P148 WeakPolarHBondContact O-CD 3.25Å; Y144-A298 HydrophobicContact CD1-CB 4Å; Y144-A298 HydrophobicContact CE1-CB 3.68Å; Y144-V299 PolarHBondContact OH-N 3.29Å; Y144-A300 HydrophobicContact CE1-CB 3.86Å; Y144-A300 PolarHBondContact OH-N 3.33Å; Y144-V301 HydrophobicContact CD1-CG2 3.78Å; Y144-V301 HydrophobicContact CE1-CG2 3.96Å; Y144-V319 HydrophobicContact CD1-CB 3.94Å; Y144-V319 HydrophobicContact CD1-CG1 3.45Å; Y144-V319 VanDerWaalsContact CD1-CG1 3.45Å; Y144-V319 HydrophobicContact CD1-CG2 4.3Å; Y144-V319 HydrophobicContact CD2-CG1 3.87Å; Y144-V319 HydrophobicContact CE1-CB 4.46Å; Y144-V319 HydrophobicContact CE1-CG1 3.89Å; Y144-V319 HydrophobicContact CE1-CG2 4.39Å; Y144-V319 HydrophobicContact CE2-CG1 4.27Å; Y144-V319 HydrophobicContact CG-CB 4.29Å; Y144-V319 HydrophobicContact CG-CG1 3.44Å; Y144-V319 VanDerWaalsContact CG-CG1 3.44Å |
| 145 | A | 88.6 | Confident | 85.8 | Confident | 25 Ų | 25 | 44.1 Ų | 44.1 | 21% | 0.207 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -75.7 | -29.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | F141 F149 L163 | F141-A145 HydrophobicContact CE1-CB 4.49Å; F141-A145 HydrophobicContact CZ-CB 4.4Å; F141-A145 WeakPolarHBondContact O-CB 3.26Å; F141-A145 PolarHBondContact O-N 3.47Å; A145-F149 WeakPolarHBondContact O-CD2 3.37Å; A145-F149 VanDerWaalsContact O-CE2 3.29Å; A145-F149 WeakPolarHBondContact O-CE2 3.5Å; A145-L163 HydrophobicContact CB-CD2 3.97Å |
| 146 | S | 88.2 | Confident | 85.7 | Confident | 4 Ų | 4 | 47 Ų | 47 | 3% | 0.028 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -88.2 | -29.1 | 179.5 | 60 | 0 | 0 | 0 | 0 | 113.4 | A142 E143 P148 F149 Y150 | A142-S146 VanDerWaalsContact O-CB 3.26Å; A142-S146 WeakPolarHBondContact O-CB 3.43Å; A142-S146 PolarHBondContact O-N 3.28Å; A142-S146 PolarHBondContact O-OG 3.2Å; E143-S146 PolarHBondContact O-N 2.99Å; E143-S146 PolarHBondContact O-OG 3.35Å; S146-P148 VanDerWaalsContact C-CD 3.42Å; S146-F149 PolarHBondContact O-N 3.17Å; S146-Y150 WeakPolarHBondContact O-CD2 3.21Å |
| 147 | A | 84.8 | Confident | 85.4 | Confident | 10 Ų | 10 | 53 Ų | 53 | 8% | 0.083 | 29% | 0.294 | C | S | . | . | G | 310 helix | trans | -50 | -43.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | E143 F149 Y150 A298 | E143-A147 WeakPolarHBondContact O-CB 3.05Å; E143-A147 PolarHBondContact O-N 3.26Å; A147-F149 PolarHBondContact O-N 3.01Å; A147-Y150 CarbonylContact O-C 3.48Å; A147-Y150 VanDerWaalsContact O-C 3.31Å; A147-Y150 PolarHBondContact O-N 2.9Å; A147-A298 HydrophobicContact CB-CB 3.85Å |
| 148 | P | 83.9 | Confident | 85.2 | Confident | 58 Ų | 58 | 57.4 Ų | 57.4 | 38% | 0.377 | 32% | 0.322 | S | S | . | . | G | 310 helix | trans | -66 | -22.5 | -179.7 | -22.1 | 35.4 | 0 | 0 | 0 | 114.2 | Y144 S146 Y150 P316 | Y144-P148 WeakPolarHBondContact O-CD 3.25Å; S146-P148 VanDerWaalsContact C-CD 3.42Å; P148-Y150 VanDerWaalsContact C-N 3.33Å; P148-P316 HydrophobicContact CG-CB 3.51Å; P148-P316 HydrophobicContact CG-CG 3.54Å |
| 149 | F | 86.1 | Confident | 85.1 | Confident | 165 Ų | 165 | 60.2 Ų | 60.2 | 72% | 0.724 | 34% | 0.339 | S | S | * | . | G | 310 helix | trans | -85.9 | -9.2 | 177.9 | -58.8 | -74.8 | 0 | 0 | 0 | 112.7 | A145 S146 A147 | A145-F149 WeakPolarHBondContact O-CD2 3.37Å; A145-F149 VanDerWaalsContact O-CE2 3.29Å; A145-F149 WeakPolarHBondContact O-CE2 3.5Å; S146-F149 PolarHBondContact O-N 3.17Å; A147-F149 PolarHBondContact O-N 3.01Å |
| 150 | Y | 85.6 | Confident | 84.8 | Confident | 89 Ų | 89 | 60.7 Ų | 60.7 | 35% | 0.349 | 34% | 0.341 | S | S | . | . | trans | -133.8 | 65.2 | 179.2 | -63.9 | -89.3 | 0 | 0 | 0 | 110.7 | S146 A147 P148 D152 C153 P155 | S146-Y150 WeakPolarHBondContact O-CD2 3.21Å; A147-Y150 CarbonylContact O-C 3.48Å; A147-Y150 VanDerWaalsContact O-C 3.31Å; A147-Y150 PolarHBondContact O-N 2.9Å; P148-Y150 VanDerWaalsContact C-N 3.33Å; Y150-D152 PolarHBondContact O-N 3.29Å; Y150-C153 WeakPolarHBondContact CB-O 3.34Å; Y150-C153 HydrophobicContact CD1-CB 4.42Å; Y150-C153 PolarHBondContact O-N 3.43Å; Y150-P155 HydrophobicContact CD2-CB 3.88Å; Y150-P155 HydrophobicContact CE2-CB 4.31Å; Y150-P155 HydrophobicContact CG-CB 4.25Å | ||
| 151 | P | 73.8 | Confident | 84.7 | Confident | 105 Ų | 105 | 63.4 Ų | 63.4 | 68% | 0.682 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -38.1 | -175.6 | 22.9 | -32.1 | 0 | 0 | 0 | 113.6 | ||
| 152 | D | 77 | Confident | 84.6 | Confident | 156 Ų | 156 | 65.3 Ų | 65.3 | 83% | 0.834 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.4 | 4 | -176.9 | -58.9 | -52.3 | 0 | 0 | 0 | 113.6 | Y150 | Y150-D152 PolarHBondContact O-N 3.29Š|
| 153 | C | 79.9 | Confident | 84.3 | Confident | 85 Ų | 85 | 68.3 Ų | 68.3 | 57% | 0.574 | 39% | 0.386 | S | S | * | . | S | Bend | trans | -140.6 | 148 | -170 | -66.8 | 0 | 0 | 0 | 0 | 111.4 | Y150 | Y150-C153 WeakPolarHBondContact CB-O 3.34Å; Y150-C153 HydrophobicContact CD1-CB 4.42Å; Y150-C153 PolarHBondContact O-N 3.43Å |
| 154 | T | 76.9 | Confident | 84 | Confident | 125 Ų | 125 | 66.6 Ų | 66.6 | 77% | 0.767 | 38% | 0.378 | S | S | * | . | P | Polyproline II helix | trans | -72.5 | 126.7 | 169.3 | 53.4 | 0 | 0 | 0 | 0 | 109.8 | ||
| 155 | P | 81.2 | Confident | 83.8 | Confident | 10 Ų | 10 | 67.8 Ų | 67.8 | 7% | 0.065 | 39% | 0.388 | C | S | . | . | P | Polyproline II helix | trans | -59.3 | 139 | 178.4 | 17.1 | -25.8 | 0 | 0 | 0 | 110.8 | Y150 L157 I160 | Y150-P155 HydrophobicContact CD2-CB 3.88Å; Y150-P155 HydrophobicContact CE2-CB 4.31Å; Y150-P155 HydrophobicContact CG-CB 4.25Å; P155-L157 PolarHBondContact O-N 2.89Å; P155-I160 HydrophobicContact CB-CD1 4.32Å; P155-I160 HydrophobicContact CB-CG1 4.24Å; P155-I160 HydrophobicContact CG-CD1 4.01Å; P155-I160 HydrophobicContact CG-CG1 4.34Å |
| 156 | P | 87.1 | Confident | 83.5 | Confident | 62 Ų | 62 | 68.9 Ų | 68.9 | 40% | 0.403 | 40% | 0.397 | S | S | . | . | P | Polyproline II helix | trans | -59.3 | 135.4 | 179.7 | -21.3 | 30.7 | 0 | 0 | 0 | 111.4 | V158 V159 I160 | P156-V158 PolarHBondContact O-N 3.13Å; P156-V159 HydrophobicContact CB-CG2 4.16Å; P156-V159 HydrophobicContact CG-CG2 4.22Å; P156-V159 WeakPolarHBondContact O-CB 3.49Å; P156-V159 PolarHBondContact O-N 3.06Å; P156-I160 PolarHBondContact O-N 3.39Å |
| 157 | L | 84.2 | Confident | 83.1 | Confident | 124 Ų | 124 | 69.1 Ų | 69.1 | 65% | 0.649 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -54.2 | -33 | -179 | -68.9 | 172 | 0 | 0 | 0 | 113.1 | P155 I160 K161 | P155-L157 PolarHBondContact O-N 2.89Å; L157-I160 PolarHBondContact O-N 3.32Å; L157-K161 WeakPolarHBondContact O-CB 3.44Å; L157-K161 VanDerWaalsContact O-CG 3.27Å; L157-K161 WeakPolarHBondContact O-CG 3.42Å; L157-K161 PolarHBondContact O-N 3.36Å |
| 158 | V | 86.7 | Confident | 82.8 | Confident | 106 Ų | 106 | 68.7 Ų | 68.7 | 64% | 0.642 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -63.5 | -41 | 177.4 | -179 | 0 | 0 | 0 | 0 | 111.3 | P156 K161 C162 | P156-V158 PolarHBondContact O-N 3.13Å; V158-K161 PolarHBondContact O-N 2.93Å; V158-C162 VanDerWaalsContact O-CB 3.31Å; V158-C162 WeakPolarHBondContact O-CB 3.22Å; V158-C162 PolarHBondContact O-N 2.91Å; V158-C162 PolarHBondContact O-SG 3.45Å |
| 159 | V | 86.9 | Confident | 82.5 | Confident | 59 Ų | 59 | 69 Ų | 69 | 36% | 0.358 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.5 | -46.2 | 179.2 | 177.2 | 0 | 0 | 0 | 0 | 110.1 | P156 K161 C162 L163 | P156-V159 HydrophobicContact CB-CG2 4.16Å; P156-V159 HydrophobicContact CG-CG2 4.22Å; P156-V159 WeakPolarHBondContact O-CB 3.49Å; P156-V159 PolarHBondContact O-N 3.06Å; V159-K161 PolarHBondContact O-N 3.25Å; V159-C162 PolarHBondContact O-N 2.82Å; V159-L163 WeakPolarHBondContact O-CB 3.25Å; V159-L163 PolarHBondContact O-N 2.86Å |
| 160 | I | 85.1 | Confident | 82.1 | Confident | 17 Ų | 17 | 65 Ų | 65 | 9% | 0.087 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -59.5 | -48.2 | 178 | -56.6 | 175.7 | 0 | 0 | 0 | 110.1 | L139 A142 P155 P156 L157 L163 S164 | L139-I160 HydrophobicContact CD2-CG2 4.17Å; A142-I160 HydrophobicContact CB-CB 4.45Å; A142-I160 HydrophobicContact CB-CG2 3.74Å; A142-I160 WeakPolarHBondContact CB-O 3.25Å; P155-I160 HydrophobicContact CB-CD1 4.32Å; P155-I160 HydrophobicContact CB-CG1 4.24Å; P155-I160 HydrophobicContact CG-CD1 4.01Å; P155-I160 HydrophobicContact CG-CG1 4.34Å; P156-I160 PolarHBondContact O-N 3.39Å; L157-I160 PolarHBondContact O-N 3.32Å; I160-L163 PolarHBondContact O-N 2.91Å; I160-S164 WeakPolarHBondContact O-CB 3.36Å; I160-S164 PolarHBondContact O-N 3.39Å; I160-S164 PolarHBondContact O-OG 3.25Å |
| 161 | K | 87.3 | Confident | 81.6 | Confident | 57 Ų | 57 | 60.9 Ų | 60.9 | 25% | 0.248 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -65.8 | -43.9 | -178.4 | -71.7 | -179.9 | 177.4 | -174.3 | 0 | 112.5 | L139 L157 V158 V159 S164 A165 I376 I377 | L139-K161 HydrophobicContact CD2-CG 4.44Å; L157-K161 WeakPolarHBondContact O-CB 3.44Å; L157-K161 VanDerWaalsContact O-CG 3.27Å; L157-K161 WeakPolarHBondContact O-CG 3.42Å; L157-K161 PolarHBondContact O-N 3.36Å; V158-K161 PolarHBondContact O-N 2.93Å; V159-K161 PolarHBondContact O-N 3.25Å; K161-S164 PolarHBondContact O-N 3.28Å; K161-A165 WeakPolarHBondContact O-CB 3.43Å; K161-A165 PolarHBondContact O-N 3.4Å; K161-I376 HydrophobicContact CB-CG2 3.85Å; K161-I376 WeakPolarHBondContact CE-O 3.4Å; K161-I376 HydrophobicContact CG-CG2 3.83Å; K161-I377 PolarHBondContact NZ-O 2.97Å |
| 162 | C | 87.2 | Confident | 81.5 | Confident | 79 Ų | 79 | 56.1 Ų | 56.1 | 53% | 0.534 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -64.2 | -43.6 | 176.3 | -72.6 | 0 | 0 | 0 | 0 | 112 | V158 V159 S164 A165 A166 | V158-C162 VanDerWaalsContact O-CB 3.31Å; V158-C162 WeakPolarHBondContact O-CB 3.22Å; V158-C162 PolarHBondContact O-N 2.91Å; V158-C162 PolarHBondContact O-SG 3.45Å; V159-C162 PolarHBondContact O-N 2.82Å; C162-S164 VanDerWaalsContact C-N 3.32Å; C162-S164 PolarHBondContact O-N 2.96Å; C162-A165 PolarHBondContact O-N 3.37Å; C162-A166 WeakPolarHBondContact O-CB 3.48Å; C162-A166 PolarHBondContact O-N 3.35Å |
| 163 | L | 85.5 | Confident | 81 | Confident | 62 Ų | 62 | 52 Ų | 52 | 33% | 0.325 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.7 | -36.8 | 177.8 | -174.4 | 60.8 | 0 | 0 | 0 | 111.6 | F141 A142 A145 V159 I160 A166 A167 | F141-L163 HydrophobicContact CE1-CD1 4.46Å; F141-L163 HydrophobicContact CE1-CG 4.23Å; A142-L163 HydrophobicContact CB-CB 3.93Å; A142-L163 HydrophobicContact CB-CD2 4.06Å; A142-L163 HydrophobicContact CB-CG 4.04Å; A145-L163 HydrophobicContact CB-CD2 3.97Å; V159-L163 WeakPolarHBondContact O-CB 3.25Å; V159-L163 PolarHBondContact O-N 2.86Å; I160-L163 PolarHBondContact O-N 2.91Å; L163-A166 PolarHBondContact O-N 2.87Å; L163-A167 WeakPolarHBondContact O-CB 3.2Å; L163-A167 PolarHBondContact O-N 3.49Å |
| 164 | S | 81.3 | Confident | 80.4 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64 | -47.6 | 174.2 | -56.2 | 0 | 0 | 0 | 0 | 111.7 | T138 L139 A142 I160 K161 C162 A166 A167 I168 | T138-S164 PolarHBondContact O-OG 2.69Å; L139-S164 VanDerWaalsContact CA-OG 3.3Å; L139-S164 WeakPolarHBondContact CA-OG 3.36Å; A142-S164 WeakPolarHBondContact CB-OG 3.25Å; I160-S164 WeakPolarHBondContact O-CB 3.36Å; I160-S164 PolarHBondContact O-N 3.39Å; I160-S164 PolarHBondContact O-OG 3.25Å; K161-S164 PolarHBondContact O-N 3.28Å; C162-S164 VanDerWaalsContact C-N 3.32Å; C162-S164 PolarHBondContact O-N 2.96Å; S164-A166 VanDerWaalsContact C-N 3.31Å; S164-A166 PolarHBondContact O-N 3.42Å; S164-A167 WeakPolarHBondContact O-CB 2.9Å; S164-A167 PolarHBondContact O-N 2.94Å; S164-I168 WeakPolarHBondContact O-CG1 3.3Å; S164-I168 PolarHBondContact O-N 3.26Å |
| 165 | A | 81.6 | Confident | 80.2 | Confident | 25 Ų | 25 | 44.1 Ų | 44.1 | 21% | 0.207 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.9 | -38.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | K161 C162 T169 | K161-A165 WeakPolarHBondContact O-CB 3.43Å; K161-A165 PolarHBondContact O-N 3.4Å; C162-A165 PolarHBondContact O-N 3.37Å; A165-T169 WeakPolarHBondContact O-CB 3.47Å; A165-T169 PolarHBondContact O-N 3.29Å; A165-T169 PolarHBondContact O-OG1 3.23Å |
| 166 | A | 83.4 | Confident | 79.9 | Confident | 49 Ų | 49 | 44 Ų | 44 | 41% | 0.405 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.2 | -46.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | C162 L163 S164 I168 T169 V170 | C162-A166 WeakPolarHBondContact O-CB 3.48Å; C162-A166 PolarHBondContact O-N 3.35Å; L163-A166 PolarHBondContact O-N 2.87Å; S164-A166 VanDerWaalsContact C-N 3.31Å; S164-A166 PolarHBondContact O-N 3.42Å; A166-I168 PolarHBondContact O-N 3.44Å; A166-T169 PolarHBondContact O-N 2.99Å; A166-V170 VanDerWaalsContact O-CG2 3.3Å; A166-V170 WeakPolarHBondContact O-CG2 3.29Å; A166-V170 PolarHBondContact O-N 3.25Å |
| 167 | A | 80.4 | Confident | 79.2 | Confident | 8 Ų | 8 | 41.4 Ų | 41.4 | 7% | 0.066 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.8 | -46.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | F141 L163 S164 T169 V170 I171 | F141-A167 HydrophobicContact CD1-CB 3.65Å; F141-A167 HydrophobicContact CE1-CB 3.71Å; L163-A167 WeakPolarHBondContact O-CB 3.2Å; L163-A167 PolarHBondContact O-N 3.49Å; S164-A167 WeakPolarHBondContact O-CB 2.9Å; S164-A167 PolarHBondContact O-N 2.94Å; A167-T169 VanDerWaalsContact C-N 3.3Å; A167-T169 PolarHBondContact O-N 2.7Å; A167-V170 PolarHBondContact O-N 3.32Å; A167-I171 WeakPolarHBondContact O-CB 3.23Å; A167-I171 WeakPolarHBondContact O-CD1 3.24Å; A167-I171 WeakPolarHBondContact O-CG1 3.49Å; A167-I171 PolarHBondContact O-N 2.75Å |
| 168 | I | 78.3 | Confident | 78.7 | Confident | 2 Ų | 2 | 39.2 Ų | 39.2 | 1% | 0.01 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -52.4 | -51.3 | 173.2 | -77.7 | -172 | 0 | 0 | 0 | 110.7 | F134 T138 S164 A166 V170 I171 I172 A372 I373 I376 | F134-I168 HydrophobicContact CD1-CD1 3.93Å; F134-I168 HydrophobicContact CD1-CG1 3.96Å; F134-I168 HydrophobicContact CE1-CB 3.94Å; F134-I168 HydrophobicContact CE1-CD1 3.98Å; F134-I168 HydrophobicContact CE1-CG1 3.54Å; F134-I168 HydrophobicContact CE1-CG2 3.76Å; F134-I168 HydrophobicContact CZ-CG1 4.17Å; T138-I168 HydrophobicContact CG2-CD1 4.34Å; T138-I168 HydrophobicContact CG2-CG1 3.46Å; T138-I168 VanDerWaalsContact CG2-CG1 3.46Å; T138-I168 WeakPolarHBondContact OG1-CD1 3.48Å; T138-I168 WeakPolarHBondContact OG1-CG1 3.44Å; S164-I168 WeakPolarHBondContact O-CG1 3.3Å; S164-I168 PolarHBondContact O-N 3.26Å; A166-I168 PolarHBondContact O-N 3.44Å; I168-V170 PolarHBondContact O-N 2.58Å; I168-I171 PolarHBondContact O-N 3.35Å; I168-I172 HydrophobicContact CG2-CD1 4.08Å; I168-I172 WeakPolarHBondContact O-CB 3.36Å; I168-I172 WeakPolarHBondContact O-CG1 3.4Å; I168-I172 PolarHBondContact O-N 3.19Å; I168-A372 HydrophobicContact CD1-CB 3.67Å; I168-I373 HydrophobicContact CD1-CG1 4.5Å; I168-I373 HydrophobicContact CG2-CD1 4.24Å; I168-I373 HydrophobicContact CG2-CG1 4.03Å; I168-I376 HydrophobicContact CD1-CD1 3.37Å; I168-I376 HydrophobicContact CD1-CG1 4.5Å; I168-I376 HydrophobicContact CG1-CD1 4.35Å |
| 169 | T | 76.5 | Confident | 77.9 | Confident | 64 Ų | 64 | 36.2 Ų | 36.2 | 39% | 0.393 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.7 | -47.3 | -176.5 | -56 | 0 | 0 | 0 | 0 | 110.1 | A165 A166 A167 I172 T173 | A165-T169 WeakPolarHBondContact O-CB 3.47Å; A165-T169 PolarHBondContact O-N 3.29Å; A165-T169 PolarHBondContact O-OG1 3.23Å; A166-T169 PolarHBondContact O-N 2.99Å; A167-T169 VanDerWaalsContact C-N 3.3Å; A167-T169 PolarHBondContact O-N 2.7Å; T169-I172 PolarHBondContact O-N 2.88Å; T169-T173 HydrophobicContact CG2-CG2 4.22Å; T169-T173 VanDerWaalsContact O-CB 3.32Å; T169-T173 WeakPolarHBondContact O-CB 3.44Å; T169-T173 PolarHBondContact O-N 3.15Å; T169-T173 PolarHBondContact O-OG1 2.87Å |
| 170 | V | 78.9 | Confident | 77.1 | Confident | 82 Ų | 82 | 36.5 Ų | 36.5 | 50% | 0.497 | 23% | 0.229 | S | C | . | . | I | π-helix | trans | -62.4 | -43.4 | 178.3 | 171.6 | 0 | 0 | 0 | 0 | 112 | A166 A167 I168 G174 V175 F324 | A166-V170 VanDerWaalsContact O-CG2 3.3Å; A166-V170 WeakPolarHBondContact O-CG2 3.29Å; A166-V170 PolarHBondContact O-N 3.25Å; A167-V170 PolarHBondContact O-N 3.32Å; I168-V170 PolarHBondContact O-N 2.58Å; V170-G174 WeakPolarHBondContact O-CA 3.46Å; V170-G174 PolarHBondContact O-N 3.32Å; V170-V175 PolarHBondContact O-N 3.33Å; V170-F324 HydrophobicContact CG1-CE2 4.49Å |
| 171 | I | 74.8 | Confident | 76.5 | Confident | 2 Ų | 2 | 43.2 Ų | 43.2 | 1% | 0.01 | 26% | 0.258 | C | S | . | . | I | π-helix | trans | -64.5 | -47.4 | 179.9 | -69.3 | 160.6 | 0 | 0 | 0 | 110.8 | F134 T138 A167 I168 V175 N176 F324 A327 N328 | F134-I171 HydrophobicContact CE2-CG2 4.23Å; F134-I171 HydrophobicContact CZ-CB 4.35Å; F134-I171 HydrophobicContact CZ-CG2 4.08Å; T138-I171 HydrophobicContact CG2-CD1 4.33Å; A167-I171 WeakPolarHBondContact O-CB 3.23Å; A167-I171 WeakPolarHBondContact O-CD1 3.24Å; A167-I171 WeakPolarHBondContact O-CG1 3.49Å; A167-I171 PolarHBondContact O-N 2.75Å; I168-I171 PolarHBondContact O-N 3.35Å; I171-V175 WeakPolarHBondContact O-CB 3.31Å; I171-V175 PolarHBondContact O-N 3.47Å; I171-N176 PolarHBondContact O-N 3.48Å; I171-N176 VanDerWaalsContact O-N 3.13Å; I171-N176 PolarHBondContact O-ND2 3.12Å; I171-F324 HydrophobicContact CB-CZ 4.42Å; I171-F324 HydrophobicContact CD1-CD2 3.84Å; I171-F324 HydrophobicContact CD1-CE2 3.88Å; I171-F324 HydrophobicContact CD1-CG 4.23Å; I171-F324 HydrophobicContact CD1-CZ 4.31Å; I171-F324 HydrophobicContact CG1-CD1 4.25Å; I171-F324 HydrophobicContact CG1-CD2 3.77Å; I171-F324 HydrophobicContact CG1-CE1 3.84Å; I171-F324 HydrophobicContact CG1-CE2 3.29Å; I171-F324 HydrophobicContact CG1-CG 4.24Å; I171-F324 HydrophobicContact CG1-CZ 3.35Å; I171-A327 HydrophobicContact CD1-CB 3.67Å; I171-N328 HydrophobicContact CG2-CB 4.43Å |
| 172 | I | 71.3 | Confident | 75.9 | Confident | 5 Ų | 5 | 44.3 Ų | 44.3 | 3% | 0.026 | 27% | 0.266 | C | S | . | . | I | π-helix | trans | -71.2 | -59.5 | -177.7 | -69.5 | 179.3 | 0 | 0 | 0 | 109.8 | F134 I168 T169 N176 C177 L365 L366 | F134-I172 HydrophobicContact CD1-CD1 4.43Å; F134-I172 HydrophobicContact CE1-CD1 3.52Å; F134-I172 HydrophobicContact CE1-CG1 3.97Å; F134-I172 HydrophobicContact CZ-CD1 3.99Å; F134-I172 HydrophobicContact CZ-CG1 3.9Å; I168-I172 HydrophobicContact CG2-CD1 4.08Å; I168-I172 WeakPolarHBondContact O-CB 3.36Å; I168-I172 WeakPolarHBondContact O-CG1 3.4Å; I168-I172 PolarHBondContact O-N 3.19Å; T169-I172 PolarHBondContact O-N 2.88Å; I172-N176 PolarHBondContact O-N 2.87Å; I172-C177 WeakPolarHBondContact O-CB 3.08Å; I172-C177 PolarHBondContact O-N 3.14Å; I172-C177 PolarHBondContact O-SG 2.92Å; I172-L365 HydrophobicContact CG2-CB 4.24Å; I172-L366 HydrophobicContact CG2-CD2 4.3Å |
| 173 | T | 66.5 | Low | 75.2 | Confident | 68 Ų | 68 | 40.6 Ų | 40.6 | 42% | 0.417 | 24% | 0.241 | S | C | . | . | I | π-helix | trans | -76.8 | -34.9 | -172.1 | 65 | 0 | 0 | 0 | 0 | 113.1 | T169 | T169-T173 HydrophobicContact CG2-CG2 4.22Å; T169-T173 VanDerWaalsContact O-CB 3.32Å; T169-T173 WeakPolarHBondContact O-CB 3.44Å; T169-T173 PolarHBondContact O-N 3.15Å; T169-T173 PolarHBondContact O-OG1 2.87Å |
| 174 | G | 67.4 | Low | 74.7 | Confident | 29 Ų | 29 | 40.4 Ų | 40.4 | 30% | 0.299 | 25% | 0.245 | S | C | . | . | I | π-helix | trans | -87.7 | -28.7 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115 | V170 L178 | V170-G174 WeakPolarHBondContact O-CA 3.46Å; V170-G174 PolarHBondContact O-N 3.32Å; G174-L178 WeakPolarHBondContact O-CD1 3.31Å |
| 175 | V | 73.2 | Confident | 74.5 | Confident | 16 Ų | 16 | 48.6 Ų | 48.6 | 10% | 0.097 | 28% | 0.277 | C | S | . | . | I | π-helix | trans | -116.1 | -58.4 | -174.9 | -177.3 | 0 | 0 | 0 | 0 | 111 | V170 I171 L178 S179 A183 F324 | V170-V175 PolarHBondContact O-N 3.33Å; I171-V175 WeakPolarHBondContact O-CB 3.31Å; I171-V175 PolarHBondContact O-N 3.47Å; V175-L178 PolarHBondContact O-N 3.01Å; V175-S179 PolarHBondContact O-N 2.98Å; V175-A183 HydrophobicContact CG1-CB 3.79Å; V175-F324 HydrophobicContact CG2-CE1 4.5Å; V175-F324 HydrophobicContact CG2-CZ 4.36Å |
| 176 | N | 75 | Confident | 74.5 | Confident | 8 Ų | 8 | 48.9 Ų | 48.9 | 4% | 0.043 | 28% | 0.276 | C | S | . | . | I | π-helix | trans | -76.4 | -32.7 | -170.3 | -73.8 | -85.5 | 0 | 0 | 0 | 113.5 | I171 I172 N328 T360 L365 | I171-N176 PolarHBondContact O-N 3.48Å; I171-N176 VanDerWaalsContact O-N 3.13Å; I171-N176 PolarHBondContact O-ND2 3.12Å; I172-N176 PolarHBondContact O-N 2.87Å; N176-N328 PolarHBondContact ND2-OD1 2.9Å; N176-N328 PolarHBondContact OD1-OD1 2.92Å; N176-T360 VanDerWaalsContact O-CG2 3.26Å; N176-T360 WeakPolarHBondContact O-CG2 3.35Å; N176-L365 HydrophobicContact CB-CD1 3.95Å |
| 177 | C | 72.4 | Confident | 74.3 | Confident | 8 Ų | 8 | 47.6 Ų | 47.6 | 5% | 0.054 | 26% | 0.262 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -15.6 | 177.6 | -66.7 | 0 | 0 | 0 | 0 | 113.8 | I172 R358 L362 | I172-C177 WeakPolarHBondContact O-CB 3.08Å; I172-C177 PolarHBondContact O-N 3.14Å; I172-C177 PolarHBondContact O-SG 2.92Å; C177-R358 WeakPolarHBondContact O-CD 3.3Å; C177-R358 PolarHBondContact O-NH1 3.38Å; C177-L362 HydrophobicContact CB-CD1 3.84Å; C177-L362 WeakPolarHBondContact SG-CD1 3.37Å |
| 178 | L | 72.8 | Confident | 74.2 | Confident | 78 Ų | 78 | 52.1 Ų | 52.1 | 41% | 0.408 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.8 | -46.8 | -175.5 | -89.8 | 153.7 | 0 | 0 | 0 | 112.8 | G174 V175 R358 | G174-L178 WeakPolarHBondContact O-CD1 3.31Å; V175-L178 PolarHBondContact O-N 3.01Å; L178-R358 WeakPolarHBondContact O-CD 3.34Å |
| 179 | S | 71.1 | Confident | 74.5 | Confident | 42 Ų | 42 | 58.3 Ų | 58.3 | 29% | 0.294 | 31% | 0.312 | S | S | . | . | trans | -161 | 127.2 | 178.1 | 174.1 | 0 | 0 | 0 | 0 | 112.1 | V175 K181 L182 A183 | V175-S179 PolarHBondContact O-N 2.98Å; S179-K181 PolarHBondContact O-N 3.17Å; S179-K181 PolarHBondContact OG-N 3.08Å; S179-L182 PolarHBondContact O-N 3.12Å; S179-L182 PolarHBondContact OG-N 3.46Å; S179-A183 PolarHBondContact O-N 2.91Å | ||
| 180 | V | 68.8 | Low | 74.8 | Confident | 66 Ų | 66 | 56.3 Ų | 56.3 | 40% | 0.4 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -58.1 | -38.3 | 171.4 | -177.9 | 0 | 0 | 0 | 0 | 111 | A183 S184 F332 T360 | V180-A183 PolarHBondContact O-N 2.91Å; V180-S184 PolarHBondContact O-N 3.07Å; V180-F332 HydrophobicContact CG1-CE1 4.1Å; V180-T360 HydrophobicContact CG2-CG2 3.54Å |
| 181 | K | 72.8 | Confident | 74.9 | Confident | 157 Ų | 157 | 53 Ų | 53 | 68% | 0.683 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -66.8 | -44 | 179.5 | -66.1 | -177 | -179 | 177.7 | 0 | 111.3 | S179 S184 Y185 | S179-K181 PolarHBondContact O-N 3.17Å; S179-K181 PolarHBondContact OG-N 3.08Å; K181-S184 PolarHBondContact O-N 2.85Å; K181-Y185 WeakPolarHBondContact O-CD2 3.3Å; K181-Y185 PolarHBondContact O-N 3.07Å |
| 182 | L | 74.6 | Confident | 75.2 | Confident | 81 Ų | 81 | 54.5 Ų | 54.5 | 42% | 0.424 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.9 | -47.5 | 176.6 | -178.8 | 65.5 | 0 | 0 | 0 | 110.5 | S179 S184 Y185 V186 | S179-L182 PolarHBondContact O-N 3.12Å; S179-L182 PolarHBondContact OG-N 3.46Å; L182-S184 PolarHBondContact O-N 3.32Å; L182-Y185 PolarHBondContact O-N 3.29Å; L182-V186 HydrophobicContact CD1-CG2 4.07Å; L182-V186 HydrophobicContact CG-CG2 4.19Å; L182-V186 WeakPolarHBondContact O-CB 3.33Å; L182-V186 WeakPolarHBondContact O-CG2 3.47Å; L182-V186 PolarHBondContact O-N 3.36Å |
| 183 | A | 73.3 | Confident | 75.8 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -58 | -36.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V175 S179 V180 Q187 N328 F332 | V175-A183 HydrophobicContact CG1-CB 3.79Å; S179-A183 PolarHBondContact O-N 2.91Å; V180-A183 PolarHBondContact O-N 2.91Å; A183-Q187 WeakPolarHBondContact O-CB 3.43Å; A183-Q187 PolarHBondContact O-N 3.35Å; A183-N328 PolarHBondContact O-ND2 2.89Å; A183-F332 HydrophobicContact CB-CE1 4.24Å; A183-F332 HydrophobicContact CB-CE2 3.86Å; A183-F332 HydrophobicContact CB-CZ 3.34Å |
| 184 | S | 74.2 | Confident | 76.6 | Confident | 58 Ų | 58 | 51.3 Ų | 51.3 | 41% | 0.406 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -70.5 | -45.1 | 174.3 | -175.5 | 0 | 0 | 0 | 0 | 113.4 | V180 K181 L182 V186 Q187 N188 | V180-S184 PolarHBondContact O-N 3.07Å; K181-S184 PolarHBondContact O-N 2.85Å; L182-S184 PolarHBondContact O-N 3.32Å; S184-V186 PolarHBondContact O-N 3.31Å; S184-Q187 WeakPolarHBondContact O-CB 3.31Å; S184-Q187 PolarHBondContact O-N 2.82Å; S184-N188 PolarHBondContact O-N 2.76Å |
| 185 | Y | 78.3 | Confident | 77.4 | Confident | 172 Ų | 172 | 52.8 Ų | 52.8 | 68% | 0.675 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -61.6 | -44.5 | 176.2 | -79 | -65.8 | 0 | 0 | 0 | 112.1 | K181 L182 Q187 N188 F189 | K181-Y185 WeakPolarHBondContact O-CD2 3.3Å; K181-Y185 PolarHBondContact O-N 3.07Å; L182-Y185 PolarHBondContact O-N 3.29Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 3.01Å; Y185-N188 PolarHBondContact O-N 3.3Å; Y185-F189 PolarHBondContact O-N 3.24Å |
| 186 | V | 80.6 | Confident | 78.1 | Confident | 31 Ų | 31 | 56.6 Ų | 56.6 | 19% | 0.188 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.9 | -41.2 | 176.3 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | L182 S184 N188 F189 F190 F324 | L182-V186 HydrophobicContact CD1-CG2 4.07Å; L182-V186 HydrophobicContact CG-CG2 4.19Å; L182-V186 WeakPolarHBondContact O-CB 3.33Å; L182-V186 WeakPolarHBondContact O-CG2 3.47Å; L182-V186 PolarHBondContact O-N 3.36Å; S184-V186 PolarHBondContact O-N 3.31Å; V186-N188 PolarHBondContact O-N 3.46Å; V186-F189 PolarHBondContact O-N 3.49Å; V186-F190 HydrophobicContact CG1-CD2 3.51Å; V186-F190 HydrophobicContact CG1-CE2 3.12Å; V186-F190 HydrophobicContact CG1-CZ 4.09Å; V186-F190 WeakPolarHBondContact O-CD2 3.35Å; V186-F190 WeakPolarHBondContact O-CG 3.47Å; V186-F190 PolarHBondContact O-N 2.9Å; V186-F324 HydrophobicContact CG1-CE1 4.41Å |
| 187 | Q | 78.3 | Confident | 78.6 | Confident | 23 Ų | 23 | 56.3 Ų | 56.3 | 11% | 0.107 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.5 | -46.7 | 174.7 | -169.5 | 64.9 | 26.9 | 0 | 0 | 112.6 | A183 S184 Y185 F190 T191 G325 N328 | A183-Q187 WeakPolarHBondContact O-CB 3.43Å; A183-Q187 PolarHBondContact O-N 3.35Å; S184-Q187 WeakPolarHBondContact O-CB 3.31Å; S184-Q187 PolarHBondContact O-N 2.82Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 3.01Å; Q187-F190 PolarHBondContact O-N 3.21Å; Q187-T191 WeakPolarHBondContact O-CB 3.19Å; Q187-T191 PolarHBondContact O-N 3.19Å; Q187-T191 PolarHBondContact O-OG1 3Å; Q187-G325 VanDerWaalsContact CD-O 3.3Å; Q187-G325 PolarHBondContact NE2-O 3.43Å; Q187-G325 PolarHBondContact OE1-O 2.88Å; Q187-N328 PolarHBondContact OE1-ND2 3.04Å |
| 188 | N | 79 | Confident | 79.3 | Confident | 102 Ų | 102 | 56.1 Ų | 56.1 | 55% | 0.545 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.2 | -42.6 | -178.5 | -69.9 | -20.8 | 0 | 0 | 0 | 111.3 | S184 Y185 V186 T191 G192 | S184-N188 PolarHBondContact O-N 2.76Å; Y185-N188 PolarHBondContact O-N 3.3Å; V186-N188 PolarHBondContact O-N 3.46Å; N188-T191 PolarHBondContact O-N 3.46Å; N188-G192 PolarHBondContact O-N 3.12Å |
| 189 | F | 84.8 | Confident | 80 | Confident | 133 Ų | 133 | 57.5 Ų | 57.5 | 58% | 0.583 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -59 | -50.5 | 175 | 176.2 | -99.4 | 0 | 0 | 0 | 111.7 | Y185 V186 T191 G192 A193 | Y185-F189 PolarHBondContact O-N 3.24Å; V186-F189 PolarHBondContact O-N 3.49Å; F189-T191 VanDerWaalsContact C-N 3.29Å; F189-T191 PolarHBondContact O-N 3.41Å; F189-G192 PolarHBondContact O-N 3.42Å; F189-A193 PolarHBondContact O-N 3.45Å |
| 190 | F | 83.9 | Confident | 80.9 | Confident | 22 Ų | 22 | 58.1 Ų | 58.1 | 10% | 0.096 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.8 | -27.8 | 179.1 | -67.5 | -41.9 | 0 | 0 | 0 | 113.7 | V186 Q187 A193 K194 F321 F324 | V186-F190 HydrophobicContact CG1-CD2 3.51Å; V186-F190 HydrophobicContact CG1-CE2 3.12Å; V186-F190 HydrophobicContact CG1-CZ 4.09Å; V186-F190 WeakPolarHBondContact O-CD2 3.35Å; V186-F190 WeakPolarHBondContact O-CG 3.47Å; V186-F190 PolarHBondContact O-N 2.9Å; Q187-F190 PolarHBondContact O-N 3.21Å; F190-A193 PolarHBondContact O-N 3.49Å; F190-K194 WeakPolarHBondContact O-CG 3.3Å; F190-K194 PolarHBondContact O-N 2.85Å; F190-F321 HydrophobicContact CD1-CB 3.61Å; F190-F321 HydrophobicContact CD1-CD1 4.23Å; F190-F321 AromaticContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CE1-CB 3.89Å; F190-F321 AromaticContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD2 4.48Å; F190-F321 HydrophobicContact CE1-CE1 4.22Å; F190-F321 AromaticContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CZ-CD1 4.44Å; F190-F324 AromaticContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CE2-CB 4.41Å; F190-F324 AromaticContact CE2-CD1 3.2Å; F190-F324 HydrophobicContact CE2-CD1 3.2Å; F190-F324 AromaticContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CG 4.08Å; F190-F324 AromaticContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CE1 4.28Å; F190-F324 HydrophobicContact CZ-CG 4.36Å |
| 191 | T | 79 | Confident | 81.8 | Confident | 11 Ų | 11 | 55 Ų | 55 | 7% | 0.067 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -68.4 | -40.5 | 172.9 | -56.4 | 0 | 0 | 0 | 0 | 111.3 | Q187 N188 F189 K194 L195 | Q187-T191 WeakPolarHBondContact O-CB 3.19Å; Q187-T191 PolarHBondContact O-N 3.19Å; Q187-T191 PolarHBondContact O-OG1 3Å; N188-T191 PolarHBondContact O-N 3.46Å; F189-T191 VanDerWaalsContact C-N 3.29Å; F189-T191 PolarHBondContact O-N 3.41Å; T191-K194 WeakPolarHBondContact O-CG 3.43Å; T191-L195 WeakPolarHBondContact O-CG 3.44Å; T191-L195 PolarHBondContact O-N 3.48Å |
| 192 | G | 82.6 | Confident | 82.6 | Confident | 34 Ų | 34 | 48.7 Ų | 48.7 | 35% | 0.351 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62 | -47.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | N188 F189 K194 L195 I196 | N188-G192 PolarHBondContact O-N 3.12Å; F189-G192 PolarHBondContact O-N 3.42Å; G192-K194 PolarHBondContact O-N 2.84Å; G192-L195 PolarHBondContact O-N 2.93Å; G192-I196 WeakPolarHBondContact O-CG1 3.47Å; G192-I196 PolarHBondContact O-N 2.94Å |
| 193 | A | 83.8 | Confident | 83.3 | Confident | 6 Ų | 6 | 48.7 Ų | 48.7 | 5% | 0.05 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.5 | -45.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | F189 F190 L195 I196 I197 F318 F321 | F189-A193 PolarHBondContact O-N 3.45Å; F190-A193 PolarHBondContact O-N 3.49Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.1Å; A193-I196 PolarHBondContact O-N 2.86Å; A193-I197 PolarHBondContact O-N 3.05Å; A193-F318 HydrophobicContact CB-CD1 3.8Å; A193-F318 HydrophobicContact CB-CE1 3.91Å; A193-F318 WeakPolarHBondContact O-CD1 3.29Å; A193-F321 HydrophobicContact CB-CB 4.38Å; A193-F321 HydrophobicContact CB-CD2 4.36Å |
| 194 | K | 82.8 | Confident | 84 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.6 | -32.6 | -179.7 | 68.5 | 177.1 | 65.5 | -174.6 | 0 | 113.6 | G47 I50 F190 T191 G192 I197 I198 S322 S326 | G47-K194 PolarHBondContact O-NZ 3.31Å; I50-K194 HydrophobicContact CB-CD 4.22Å; I50-K194 HydrophobicContact CG2-CD 3.99Å; I50-K194 HydrophobicContact CG2-CG 4.39Å; I50-K194 WeakPolarHBondContact O-CD 3.01Å; I50-K194 WeakPolarHBondContact O-CE 3.48Å; I50-K194 PolarHBondContact O-NZ 2.92Å; F190-K194 WeakPolarHBondContact O-CG 3.3Å; F190-K194 PolarHBondContact O-N 2.85Å; T191-K194 WeakPolarHBondContact O-CG 3.43Å; G192-K194 PolarHBondContact O-N 2.84Å; K194-I197 VanDerWaalsContact O-CG2 3.23Å; K194-I197 WeakPolarHBondContact O-CG2 3.1Å; K194-I198 WeakPolarHBondContact O-CG1 3.25Å; K194-I198 PolarHBondContact O-N 2.91Å; K194-S322 WeakPolarHBondContact CB-OG 3.38Å; K194-S326 PolarHBondContact NZ-OG 3.47Å |
| 195 | L | 84.1 | Confident | 84.6 | Confident | 60 Ų | 60 | 46.8 Ų | 46.8 | 31% | 0.314 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -70.7 | -38.9 | 177.2 | -70.7 | 176.8 | 0 | 0 | 0 | 111.3 | V46 I50 T191 G192 A193 I197 I198 I199 | V46-L195 HydrophobicContact CG1-CD2 3.9Å; I50-L195 HydrophobicContact CD1-CD2 3.9Å; T191-L195 WeakPolarHBondContact O-CG 3.44Å; T191-L195 PolarHBondContact O-N 3.48Å; G192-L195 PolarHBondContact O-N 2.93Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.1Å; L195-I197 PolarHBondContact O-N 3.37Å; L195-I198 PolarHBondContact O-N 3.19Å; L195-I199 VanDerWaalsContact O-CG1 3.29Å; L195-I199 WeakPolarHBondContact O-CG1 3.35Å; L195-I199 PolarHBondContact O-N 3.23Å |
| 196 | I | 87 | Confident | 85 | Confident | 96 Ų | 96 | 42.5 Ų | 42.5 | 49% | 0.492 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -59.1 | -49.7 | 177.5 | -67.9 | 165.1 | 0 | 0 | 0 | 110.6 | G192 A193 I198 I199 V200 | G192-I196 WeakPolarHBondContact O-CG1 3.47Å; G192-I196 PolarHBondContact O-N 2.94Å; A193-I196 PolarHBondContact O-N 2.86Å; I196-I198 VanDerWaalsContact C-N 3.33Å; I196-I198 PolarHBondContact O-N 3.29Å; I196-I199 PolarHBondContact O-N 3.42Å; I196-V200 HydrophobicContact CG2-CG2 4.46Å; I196-V200 WeakPolarHBondContact O-CG2 3.44Å; I196-V200 PolarHBondContact O-N 3.44Å |
| 197 | I | 85.8 | Confident | 85.4 | Confident | 2 Ų | 2 | 44.5 Ų | 44.5 | 1% | 0.01 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.9 | -35.2 | -176.8 | -169.7 | 61.4 | 0 | 0 | 0 | 112.6 | F55 A193 K194 L195 V200 I201 V315 F318 | F55-I197 HydrophobicContact CZ-CG2 4.4Å; A193-I197 PolarHBondContact O-N 3.05Å; K194-I197 VanDerWaalsContact O-CG2 3.23Å; K194-I197 WeakPolarHBondContact O-CG2 3.1Å; L195-I197 PolarHBondContact O-N 3.37Å; I197-V200 PolarHBondContact O-N 3.39Å; I197-I201 HydrophobicContact CG1-CD1 4.23Å; I197-I201 WeakPolarHBondContact O-CG1 3.33Å; I197-I201 PolarHBondContact O-N 3.3Å; I197-V315 HydrophobicContact CD1-CG1 4.48Å; I197-V315 HydrophobicContact CD1-CG2 4.27Å; I197-F318 HydrophobicContact CB-CB 3.76Å; I197-F318 HydrophobicContact CB-CD1 4.49Å; I197-F318 HydrophobicContact CB-CG 4.28Å; I197-F318 HydrophobicContact CD1-CB 4.23Å; I197-F318 HydrophobicContact CG1-CB 3.93Å; I197-F318 HydrophobicContact CG2-CB 4.09Å |
| 198 | I | 87.1 | Confident | 85.8 | Confident | 4 Ų | 4 | 44.1 Ų | 44.1 | 2% | 0.021 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66.3 | -43.9 | 175.6 | -72.6 | 174.4 | 0 | 0 | 0 | 110.9 | I50 K194 L195 I196 V200 I201 V202 C276 V280 | I50-I198 HydrophobicContact CB-CD1 4.44Å; I50-I198 HydrophobicContact CD1-CD1 4.02Å; I50-I198 HydrophobicContact CG1-CD1 4.49Å; I50-I198 HydrophobicContact CG2-CD1 3.18Å; K194-I198 WeakPolarHBondContact O-CG1 3.25Å; K194-I198 PolarHBondContact O-N 2.91Å; L195-I198 PolarHBondContact O-N 3.19Å; I196-I198 VanDerWaalsContact C-N 3.33Å; I196-I198 PolarHBondContact O-N 3.29Å; I198-V200 VanDerWaalsContact C-N 3.27Å; I198-V200 PolarHBondContact O-N 3.48Å; I198-I201 PolarHBondContact O-N 3.4Å; I198-V202 HydrophobicContact CG2-CG2 4.29Å; I198-V202 WeakPolarHBondContact O-CB 3.4Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.48Å; I198-V202 PolarHBondContact O-N 3.24Å; I198-C276 HydrophobicContact CG2-CB 4.12Å; I198-V280 HydrophobicContact CG2-CG2 4.03Å |
| 199 | I | 88.6 | Confident | 86.1 | Confident | 107 Ų | 107 | 41.9 Ų | 41.9 | 55% | 0.549 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -59.4 | -43.3 | 175.6 | -68.3 | 166.1 | 0 | 0 | 0 | 110.1 | L195 I196 I201 V202 V203 | L195-I199 VanDerWaalsContact O-CG1 3.29Å; L195-I199 WeakPolarHBondContact O-CG1 3.35Å; L195-I199 PolarHBondContact O-N 3.23Å; I196-I199 PolarHBondContact O-N 3.42Å; I199-I201 PolarHBondContact O-N 2.91Å; I199-V202 PolarHBondContact O-N 3.24Å; I199-V203 HydrophobicContact CG2-CG2 4.1Å; I199-V203 WeakPolarHBondContact O-CB 3.37Å; I199-V203 VanDerWaalsContact O-CG2 3.25Å; I199-V203 WeakPolarHBondContact O-CG2 3.36Å; I199-V203 PolarHBondContact O-N 3.3Å |
| 200 | V | 88.7 | Confident | 86.1 | Confident | 56 Ų | 56 | 39.8 Ų | 39.8 | 34% | 0.339 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -58.9 | -48 | 176.8 | 170.6 | 0 | 0 | 0 | 0 | 111.4 | I196 I197 I198 A204 L308 | I196-V200 HydrophobicContact CG2-CG2 4.46Å; I196-V200 WeakPolarHBondContact O-CG2 3.44Å; I196-V200 PolarHBondContact O-N 3.44Å; I197-V200 PolarHBondContact O-N 3.39Å; I198-V200 VanDerWaalsContact C-N 3.27Å; I198-V200 PolarHBondContact O-N 3.48Å; V200-A204 WeakPolarHBondContact O-CB 3.39Å; V200-A204 PolarHBondContact O-N 3.02Å; V200-L308 HydrophobicContact CG1-CD1 4.04Å; V200-L308 HydrophobicContact CG1-CD2 4.49Å |
| 201 | I | 88.5 | Confident | 86.2 | Confident | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 179.3 | -67 | 166.8 | 0 | 0 | 0 | 111.1 | F55 I197 I198 I199 A204 G205 V280 A283 Y284 F303 | F55-I201 HydrophobicContact CE1-CD1 4.4Å; I197-I201 HydrophobicContact CG1-CD1 4.23Å; I197-I201 WeakPolarHBondContact O-CG1 3.33Å; I197-I201 PolarHBondContact O-N 3.3Å; I198-I201 PolarHBondContact O-N 3.4Å; I199-I201 PolarHBondContact O-N 2.91Å; I201-A204 PolarHBondContact O-N 2.68Å; I201-G205 PolarHBondContact O-N 3.02Å; I201-V280 HydrophobicContact CG2-CG1 4.22Å; I201-V280 HydrophobicContact CG2-CG2 4.24Å; I201-A283 HydrophobicContact CG2-CB 3.96Å; I201-Y284 HydrophobicContact CG2-CE1 4.24Å; I201-F303 HydrophobicContact CB-CE1 4.29Å; I201-F303 HydrophobicContact CG1-CD1 4.24Å; I201-F303 HydrophobicContact CG1-CE1 4.03Å; I201-F303 HydrophobicContact CG2-CD1 4.5Å; I201-F303 HydrophobicContact CG2-CE1 4.06Å; I201-F303 HydrophobicContact CG2-CZ 4.1Å |
| 202 | V | 89.6 | Confident | 86.2 | Confident | 24 Ų | 24 | 46.5 Ų | 46.5 | 15% | 0.145 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -65.1 | -47.3 | -179.4 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | I198 I199 A204 G205 I206 F279 V280 | I198-V202 HydrophobicContact CG2-CG2 4.29Å; I198-V202 WeakPolarHBondContact O-CB 3.4Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.48Å; I198-V202 PolarHBondContact O-N 3.24Å; I199-V202 PolarHBondContact O-N 3.24Å; V202-A204 PolarHBondContact O-N 3.07Å; V202-G205 PolarHBondContact O-N 3.09Å; V202-I206 HydrophobicContact CG1-CD1 3.91Å; V202-I206 WeakPolarHBondContact O-CG1 3.26Å; V202-I206 PolarHBondContact O-N 3.24Å; V202-F279 HydrophobicContact CB-CB 4.49Å; V202-F279 HydrophobicContact CG1-CB 3.93Å; V202-F279 HydrophobicContact CG1-CG 4.3Å; V202-F279 HydrophobicContact CG2-CB 3.82Å; V202-V280 HydrophobicContact CG2-CG2 3.8Å |
| 203 | V | 89.9 | Confident | 86.1 | Confident | 80 Ų | 80 | 50.1 Ų | 50.1 | 49% | 0.485 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.8 | -44.4 | 178.8 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | I199 G205 I206 V207 | I199-V203 HydrophobicContact CG2-CG2 4.1Å; I199-V203 WeakPolarHBondContact O-CB 3.37Å; I199-V203 VanDerWaalsContact O-CG2 3.25Å; I199-V203 WeakPolarHBondContact O-CG2 3.36Å; I199-V203 PolarHBondContact O-N 3.3Å; V203-G205 VanDerWaalsContact C-N 3.34Å; V203-G205 PolarHBondContact O-N 2.99Å; V203-I206 PolarHBondContact O-N 3.47Å; V203-V207 WeakPolarHBondContact O-CG2 2.95Å; V203-V207 PolarHBondContact O-N 3.44Å |
| 204 | A | 87.6 | Confident | 85.8 | Confident | 17 Ų | 17 | 53 Ų | 53 | 14% | 0.14 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.4 | -43.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V200 I201 V202 I206 V207 L208 F303 V307 | V200-A204 WeakPolarHBondContact O-CB 3.39Å; V200-A204 PolarHBondContact O-N 3.02Å; I201-A204 PolarHBondContact O-N 2.68Å; V202-A204 PolarHBondContact O-N 3.07Å; A204-I206 PolarHBondContact O-N 3.03Å; A204-V207 PolarHBondContact O-N 3.22Å; A204-L208 WeakPolarHBondContact O-CD1 3.48Å; A204-L208 VanDerWaalsContact O-CG 3.26Å; A204-L208 WeakPolarHBondContact O-CG 3.32Å; A204-L208 PolarHBondContact O-N 2.9Å; A204-F303 HydrophobicContact CB-CE1 4.37Å; A204-F303 HydrophobicContact CB-CZ 4.03Å; A204-V307 HydrophobicContact CB-CG1 4.06Å |
| 205 | G | 86.4 | Confident | 85.3 | Confident | 1 Ų | 1 | 60.6 Ų | 60.6 | 1% | 0.01 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -60.1 | -43.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | I201 V202 V203 V207 L208 M209 | I201-G205 PolarHBondContact O-N 3.02Å; V202-G205 PolarHBondContact O-N 3.09Å; V203-G205 VanDerWaalsContact C-N 3.34Å; V203-G205 PolarHBondContact O-N 2.99Å; G205-V207 PolarHBondContact O-N 3.49Å; G205-L208 PolarHBondContact O-N 3.06Å; G205-M209 WeakPolarHBondContact O-CG 3.11Å; G205-M209 PolarHBondContact O-N 3.05Å |
| 206 | I | 87.8 | Confident | 84.8 | Confident | 83 Ų | 83 | 60.2 Ų | 60.2 | 43% | 0.426 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.9 | -43 | 177.7 | -67.5 | 166.7 | 0 | 0 | 0 | 111.3 | V202 V203 A204 L208 M209 A210 | V202-I206 HydrophobicContact CG1-CD1 3.91Å; V202-I206 WeakPolarHBondContact O-CG1 3.26Å; V202-I206 PolarHBondContact O-N 3.24Å; V203-I206 PolarHBondContact O-N 3.47Å; A204-I206 PolarHBondContact O-N 3.03Å; I206-L208 VanDerWaalsContact C-N 3.35Å; I206-L208 PolarHBondContact O-N 3.27Å; I206-M209 HydrophobicContact CB-CE 4.48Å; I206-M209 HydrophobicContact CG1-CE 4.09Å; I206-M209 PolarHBondContact O-N 3.24Å; I206-A210 PolarHBondContact O-N 2.9Å |
| 207 | V | 88.7 | Confident | 83.9 | Confident | 73 Ų | 73 | 58 Ų | 58 | 44% | 0.442 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 177.3 | 172.3 | 0 | 0 | 0 | 0 | 111.1 | V203 A204 G205 A210 Q211 | V203-V207 WeakPolarHBondContact O-CG2 2.95Å; V203-V207 PolarHBondContact O-N 3.44Å; A204-V207 PolarHBondContact O-N 3.22Å; G205-V207 PolarHBondContact O-N 3.49Å; V207-A210 WeakPolarHBondContact O-CB 3.33Å; V207-A210 PolarHBondContact O-N 2.84Å; V207-Q211 WeakPolarHBondContact O-CG 3.27Å; V207-Q211 PolarHBondContact O-N 3.43Å |
| 208 | L | 85.8 | Confident | 82.9 | Confident | 15 Ų | 15 | 62.1 Ų | 62.1 | 8% | 0.079 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67.3 | -36 | 178.7 | -69.7 | 165.3 | 0 | 0 | 0 | 112.5 | A204 G205 I206 Q211 K213 V287 V307 | A204-L208 WeakPolarHBondContact O-CD1 3.48Å; A204-L208 VanDerWaalsContact O-CG 3.26Å; A204-L208 WeakPolarHBondContact O-CG 3.32Å; A204-L208 PolarHBondContact O-N 2.9Å; G205-L208 PolarHBondContact O-N 3.06Å; I206-L208 VanDerWaalsContact C-N 3.35Å; I206-L208 PolarHBondContact O-N 3.27Å; L208-Q211 PolarHBondContact O-N 3.3Å; L208-K213 HydrophobicContact CD2-CD 3.98Å; L208-K213 PolarHBondContact O-N 3.26Å; L208-V287 HydrophobicContact CD1-CG2 3.45Å; L208-V287 VanDerWaalsContact CD1-CG2 3.45Å; L208-V307 HydrophobicContact CD1-CG1 4.05Å; L208-V307 HydrophobicContact CD1-CG2 3.82Å |
| 209 | M | 84.9 | Confident | 81.9 | Confident | 54 Ų | 54 | 66.8 Ų | 66.8 | 27% | 0.266 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 170.7 | -73.8 | -170.1 | -66 | 0 | 0 | 111.7 | G205 I206 Q211 G212 I282 T286 | G205-M209 WeakPolarHBondContact O-CG 3.11Å; G205-M209 PolarHBondContact O-N 3.05Å; I206-M209 HydrophobicContact CB-CE 4.48Å; I206-M209 HydrophobicContact CG1-CE 4.09Å; I206-M209 PolarHBondContact O-N 3.24Å; M209-Q211 PolarHBondContact O-N 3.23Å; M209-G212 PolarHBondContact O-N 2.97Å; M209-I282 HydrophobicContact CE-CG2 4.07Å; M209-I282 HydrophobicContact SD-CG2 3.56Å; M209-I282 VanDerWaalsContact SD-CG2 3.56Å; M209-T286 HydrophobicContact CG-CG2 3.4Å; M209-T286 HydrophobicContact SD-CG2 4.12Å |
| 210 | A | 86.2 | Confident | 80.9 | Confident | 90 Ų | 90 | 62.3 Ų | 62.3 | 74% | 0.744 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -63.8 | -25.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | I206 V207 G212 | I206-A210 PolarHBondContact O-N 2.9Å; V207-A210 WeakPolarHBondContact O-CB 3.33Å; V207-A210 PolarHBondContact O-N 2.84Å; A210-G212 PolarHBondContact O-N 3.2Å |
| 211 | Q | 85.8 | Confident | 80.3 | Confident | 127 Ų | 127 | 65.8 Ų | 65.8 | 59% | 0.593 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -0.8 | 172.6 | -69.1 | 173.3 | 1.4 | 0 | 0 | 113.8 | V207 L208 M209 | V207-Q211 WeakPolarHBondContact O-CG 3.27Å; V207-Q211 PolarHBondContact O-N 3.43Å; L208-Q211 PolarHBondContact O-N 3.3Å; M209-Q211 PolarHBondContact O-N 3.23Å |
| 212 | G | 79.5 | Confident | 79 | Confident | 46 Ų | 46 | 73.1 Ų | 73.1 | 47% | 0.474 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91.5 | 5.7 | 175 | 0 | 0 | 0 | 0 | 0 | 115.6 | M209 A210 T214 | M209-G212 PolarHBondContact O-N 2.97Å; A210-G212 PolarHBondContact O-N 3.2Å; G212-T214 PolarHBondContact O-N 3.35Å |
| 213 | K | 79.6 | Confident | 77.9 | Confident | 111 Ų | 111 | 74.3 Ų | 74.3 | 48% | 0.483 | 42% | 0.424 | S | S | . | . | trans | -75.4 | 69.4 | 178.1 | -65.5 | -177.8 | -179 | 177.2 | 0 | 112.1 | L208 | L208-K213 HydrophobicContact CD2-CD 3.98Å; L208-K213 PolarHBondContact O-N 3.26Å | ||
| 214 | T | 77.4 | Confident | 76.9 | Confident | 67 Ų | 67 | 73.4 Ų | 73.4 | 41% | 0.411 | 42% | 0.421 | S | S | . | . | trans | -118 | 6.5 | -176.5 | 57 | 0 | 0 | 0 | 0 | 113.4 | G212 N216 L217 | G212-T214 PolarHBondContact O-N 3.35Å; T214-N216 VanDerWaalsContact C-N 3.3Å; T214-N216 PolarHBondContact O-N 3.28Å; T214-L217 WeakPolarHBondContact O-CB 3.17Å; T214-L217 PolarHBondContact O-N 2.89Å | ||
| 215 | E | 73.3 | Confident | 75.8 | Confident | 159 Ų | 159 | 74.5 Ų | 74.5 | 74% | 0.743 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -56.4 | -41.8 | -175.1 | -62.9 | 179.2 | -179.7 | 0 | 0 | 112.3 | L217 S218 | E215-L217 PolarHBondContact O-N 3.49Å; E215-L217 VanDerWaalsContact O-N 3.17Å; E215-S218 WeakPolarHBondContact O-CB 3.4Å; E215-S218 PolarHBondContact O-N 3.16Å; E215-S218 PolarHBondContact O-OG 2.91Å |
| 216 | N | 71.9 | Confident | 74.9 | Confident | 52 Ų | 52 | 80.5 Ų | 80.5 | 28% | 0.278 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -68.4 | -12.2 | 178.5 | -63.8 | -29.4 | 0 | 0 | 0 | 114.5 | T214 F285 M288 | T214-N216 VanDerWaalsContact C-N 3.3Å; T214-N216 PolarHBondContact O-N 3.28Å; N216-F285 VanDerWaalsContact CB-O 3.28Å; N216-F285 WeakPolarHBondContact CB-O 3.32Å; N216-F285 PolarHBondContact ND2-O 3.38Å; N216-M288 PolarHBondContact ND2-O 3Å |
| 217 | L | 68.8 | Low | 74.3 | Confident | 49 Ų | 49 | 78.9 Ų | 78.9 | 26% | 0.257 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -98.1 | -8.8 | 179 | -67.1 | 158 | 0 | 0 | 0 | 112.3 | V68 T214 E215 F285 T286 | V68-L217 HydrophobicContact CG1-CD2 4.19Å; T214-L217 WeakPolarHBondContact O-CB 3.17Å; T214-L217 PolarHBondContact O-N 2.89Å; E215-L217 PolarHBondContact O-N 3.49Å; E215-L217 VanDerWaalsContact O-N 3.17Å; L217-F285 HydrophobicContact CD2-CB 4.42Å; L217-T286 HydrophobicContact CD1-CG2 4.28Å |
| 218 | S | 64.1 | Low | 73.7 | Confident | 88 Ų | 88 | 80.8 Ų | 80.8 | 62% | 0.615 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -75 | -37.7 | -172.3 | 63 | 0 | 0 | 0 | 0 | 113.8 | E215 | E215-S218 WeakPolarHBondContact O-CB 3.4Å; E215-S218 PolarHBondContact O-N 3.16Å; E215-S218 PolarHBondContact O-OG 2.91Å |
| 219 | N | 67.6 | Low | 73.3 | Confident | 102 Ų | 102 | 80.1 Ų | 80.1 | 55% | 0.545 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.4 | 48 | 177.6 | -66.8 | -10.8 | 0 | 0 | 0 | 112 | F221 | N219-F221 PolarHBondContact O-N 3.35Å; N219-F221 VanDerWaalsContact O-N 3.09Å |
| 220 | A | 67.6 | Low | 73.2 | Confident | 14 Ų | 14 | 77.7 Ų | 77.7 | 12% | 0.116 | 45% | 0.448 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -0.1 | -167.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | V68 G69 P70 | V68-A220 HydrophobicContact CB-CB 4.33Å; G69-A220 WeakPolarHBondContact CA-O 3.37Å; G69-A220 PolarHBondContact N-O 2.84Å; P70-A220 WeakPolarHBondContact CD-O 3.34Å |
| 221 | F | 74.9 | Confident | 73.1 | Confident | 128 Ų | 128 | 76 Ų | 76 | 56% | 0.561 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128.1 | 3.3 | -176.1 | -68.3 | -85.2 | 0 | 0 | 0 | 114.2 | D67 P70 L73 N219 G223 | D67-F221 VanDerWaalsContact OD2-CA 3.29Å; D67-F221 WeakPolarHBondContact OD2-CA 3.46Å; D67-F221 PolarHBondContact OD2-N 3.3Å; P70-F221 HydrophobicContact CG-CD1 4.26Å; L73-F221 HydrophobicContact CD1-CE1 4.01Å; L73-F221 HydrophobicContact CD1-CZ 4.37Å; N219-F221 PolarHBondContact O-N 3.35Å; N219-F221 VanDerWaalsContact O-N 3.09Å; F221-G223 PolarHBondContact O-N 2.74Å |
| 222 | E | 62.5 | Low | 73.1 | Confident | 156 Ų | 156 | 69.9 Ų | 69.9 | 73% | 0.729 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.9 | 63.3 | -179.2 | -67.1 | -170.9 | 157.3 | 0 | 0 | 111.6 | D67 | D67-E222 PolarHBondContact OD2-N 3.35Š|
| 223 | G | 65.8 | Low | 73.4 | Confident | 49 Ų | 49 | 67.8 Ų | 67.8 | 51% | 0.505 | 38% | 0.375 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 160.5 | 15.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | D67 F221 S225 | D67-G223 PolarHBondContact OD2-N 3Å; F221-G223 PolarHBondContact O-N 2.74Å; G223-S225 PolarHBondContact O-N 3.47Å |
| 224 | S | 68.5 | Low | 73.9 | Confident | 60 Ų | 60 | 62.5 Ų | 62.5 | 42% | 0.42 | 35% | 0.352 | S | S | . | . | trans | -59.5 | 124.4 | -172.9 | 63.1 | 0 | 0 | 0 | 0 | 112.2 | T226 | S224-T226 PolarHBondContact O-N 3.2Š| ||
| 225 | S | 64.5 | Low | 74.4 | Confident | 41 Ų | 41 | 60.7 Ų | 60.7 | 29% | 0.287 | 34% | 0.339 | S | S | . | . | trans | -68.1 | 121.8 | 169.5 | 179.4 | 0 | 0 | 0 | 0 | 109.6 | Y64 S65 G223 | Y64-S225 WeakPolarHBondContact O-CB 2.91Å; S65-S225 PolarHBondContact O-N 2.89Å; S65-S225 VanDerWaalsContact O-N 3.08Å; G223-S225 PolarHBondContact O-N 3.47Å | ||
| 226 | T | 68 | Low | 75.2 | Confident | 127 Ų | 127 | 53.1 Ų | 53.1 | 78% | 0.779 | 30% | 0.303 | S | S | * | . | trans | -96.4 | 4 | 176 | 54.3 | 0 | 0 | 0 | 0 | 112.9 | S224 F228 | S224-T226 PolarHBondContact O-N 3.2Å; T226-F228 PolarHBondContact O-N 2.74Å | ||
| 227 | S | 74.4 | Confident | 76 | Confident | 49 Ų | 49 | 50.7 Ų | 50.7 | 34% | 0.343 | 29% | 0.29 | S | S | . | . | trans | -71 | 123.9 | -179.1 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | G229 A230 I231 | S227-G229 VanDerWaalsContact C-N 3.29Å; S227-G229 PolarHBondContact O-N 3.44Å; S227-A230 PolarHBondContact O-N 3.37Å; S227-I231 WeakPolarHBondContact O-CG1 3.14Å; S227-I231 PolarHBondContact O-N 3.26Å; S227-I231 VanDerWaalsContact O-N 3.09Å | ||
| 228 | F | 76 | Confident | 77 | Confident | 113 Ų | 113 | 48.3 Ų | 48.3 | 50% | 0.496 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -57.5 | -38.1 | -176.7 | -175.9 | -103.9 | 0 | 0 | 0 | 113 | T226 G232 Y433 A437 D441 | T226-F228 PolarHBondContact O-N 2.74Å; F228-G232 PolarHBondContact O-N 3.39Å; F228-Y433 HydrophobicContact CD1-CE2 4.05Å; F228-Y433 AromaticContact CD2-CE2 3.87Å; F228-Y433 HydrophobicContact CD2-CE2 3.87Å; F228-Y433 AromaticContact CE1-CD2 3.93Å; F228-Y433 HydrophobicContact CE1-CD2 3.93Å; F228-Y433 AromaticContact CE1-CE2 3.55Å; F228-Y433 HydrophobicContact CE1-CE2 3.55Å; F228-Y433 AromaticContact CE2-CD2 3.87Å; F228-Y433 HydrophobicContact CE2-CD2 3.87Å; F228-Y433 AromaticContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CG-CE2 4.22Å; F228-Y433 AromaticContact CZ-CD2 3.39Å; F228-Y433 HydrophobicContact CZ-CD2 3.39Å; F228-Y433 AromaticContact CZ-CE2 3.18Å; F228-Y433 HydrophobicContact CZ-CE2 3.18Å; F228-Y433 PolarHBondContact O-OH 3.37Å; F228-A437 HydrophobicContact CD1-CB 3.78Å; F228-A437 HydrophobicContact CE1-CB 3.52Å; F228-A437 HydrophobicContact CZ-CB 4.38Å; F228-D441 WeakPolarHBondContact CB-OD2 3.2Å |
| 229 | G | 77.8 | Confident | 78.2 | Confident | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -81.9 | -32.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114 | S227 I231 G232 L233 D441 | S227-G229 VanDerWaalsContact C-N 3.29Å; S227-G229 PolarHBondContact O-N 3.44Å; G229-I231 VanDerWaalsContact C-N 3.32Å; G229-G232 PolarHBondContact O-N 3.47Å; G229-L233 WeakPolarHBondContact O-CG 3.15Å; G229-L233 PolarHBondContact O-N 2.81Å; G229-D441 WeakPolarHBondContact CA-OD2 3.32Å; G229-D441 PolarHBondContact N-OD2 2.98Å |
| 230 | A | 82.1 | Confident | 79.3 | Confident | 4 Ų | 4 | 40.6 Ų | 40.6 | 3% | 0.033 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -62.7 | -42.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | Y64 S227 G232 L233 A234 | Y64-A230 WeakPolarHBondContact CB-O 3.45Å; S227-A230 PolarHBondContact O-N 3.37Å; A230-G232 VanDerWaalsContact C-N 3.33Å; A230-G232 PolarHBondContact O-N 3.26Å; A230-L233 PolarHBondContact O-N 3.32Å; A230-A234 PolarHBondContact O-N 3.08Å |
| 231 | I | 85.8 | Confident | 80.4 | Confident | 53 Ų | 53 | 40 Ų | 40 | 27% | 0.272 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -60.2 | -43.4 | 173.5 | -65.6 | 168 | 0 | 0 | 0 | 110.7 | S227 G229 L233 A234 F235 | S227-I231 WeakPolarHBondContact O-CG1 3.14Å; S227-I231 PolarHBondContact O-N 3.26Å; S227-I231 VanDerWaalsContact O-N 3.09Å; G229-I231 VanDerWaalsContact C-N 3.32Å; I231-L233 PolarHBondContact O-N 3.08Å; I231-A234 WeakPolarHBondContact O-CB 3.49Å; I231-A234 PolarHBondContact O-N 3.3Å; I231-F235 HydrophobicContact CG2-CD2 3.71Å; I231-F235 HydrophobicContact CG2-CE2 3.6Å; I231-F235 VanDerWaalsContact O-CD2 3.27Å; I231-F235 WeakPolarHBondContact O-CD2 3.35Å; I231-F235 PolarHBondContact O-N 3.17Å |
| 232 | G | 84.9 | Confident | 81 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -58.4 | -43.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | F228 G229 A230 F235 Y236 | F228-G232 PolarHBondContact O-N 3.39Å; G229-G232 PolarHBondContact O-N 3.47Å; A230-G232 VanDerWaalsContact C-N 3.33Å; A230-G232 PolarHBondContact O-N 3.26Å; G232-F235 WeakPolarHBondContact O-CB 3.47Å; G232-F235 PolarHBondContact O-N 2.86Å; G232-Y236 PolarHBondContact O-N 2.75Å |
| 233 | L | 86.1 | Confident | 82.1 | Confident | 1 Ų | 1 | 27.8 Ų | 27.8 | 1% | 0.005 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -67.6 | -35.1 | 175.4 | -68 | 176.2 | 0 | 0 | 0 | 112.6 | Y64 G229 A230 I231 Y236 N237 K442 Y447 | Y64-L233 HydrophobicContact CD1-CB 4.08Å; Y64-L233 HydrophobicContact CD1-CD1 4.12Å; Y64-L233 HydrophobicContact CD2-CB 3.81Å; Y64-L233 HydrophobicContact CE1-CB 4.17Å; Y64-L233 HydrophobicContact CE1-CD1 3.66Å; Y64-L233 HydrophobicContact CE2-CB 3.92Å; Y64-L233 HydrophobicContact CG-CB 3.92Å; G229-L233 WeakPolarHBondContact O-CG 3.15Å; G229-L233 PolarHBondContact O-N 2.81Å; A230-L233 PolarHBondContact O-N 3.32Å; I231-L233 PolarHBondContact O-N 3.08Å; L233-Y236 HydrophobicContact CD2-CD2 4.17Å; L233-Y236 PolarHBondContact O-N 3.3Å; L233-N237 PolarHBondContact O-N 2.9Å; L233-N237 VanDerWaalsContact O-N 3.13Å; L233-N237 PolarHBondContact O-ND2 3.38Å; L233-K442 HydrophobicContact CD1-CD 3.81Å; L233-Y447 WeakPolarHBondContact CD2-OH 3.27Å |
| 234 | A | 89.1 | Confident | 82.7 | Confident | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.2 | -42.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111 | I74 A230 I231 N237 G238 | I74-A234 HydrophobicContact CD1-CB 3.74Å; I74-A234 HydrophobicContact CG2-CB 4.33Å; A230-A234 PolarHBondContact O-N 3.08Å; I231-A234 WeakPolarHBondContact O-CB 3.49Å; I231-A234 PolarHBondContact O-N 3.3Å; A234-N237 PolarHBondContact O-N 2.92Å; A234-G238 PolarHBondContact O-N 2.99Å |
| 235 | F | 89.5 | Confident | 83.2 | Confident | 30 Ų | 30 | 23.7 Ų | 23.7 | 13% | 0.132 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -61.7 | -41.3 | 172.4 | -87.4 | -72.4 | 0 | 0 | 0 | 112.1 | A77 C78 L81 I231 G232 N237 G238 L239 L434 | A77-F235 HydrophobicContact CB-CE1 3.8Å; A77-F235 HydrophobicContact CB-CZ 3.85Å; C78-F235 WeakPolarHBondContact SG-CD1 3.42Å; L81-F235 HydrophobicContact CD1-CD1 3.93Å; L81-F235 HydrophobicContact CD1-CE1 3.65Å; I231-F235 HydrophobicContact CG2-CD2 3.71Å; I231-F235 HydrophobicContact CG2-CE2 3.6Å; I231-F235 VanDerWaalsContact O-CD2 3.27Å; I231-F235 WeakPolarHBondContact O-CD2 3.35Å; I231-F235 PolarHBondContact O-N 3.17Å; G232-F235 WeakPolarHBondContact O-CB 3.47Å; G232-F235 PolarHBondContact O-N 2.86Å; F235-N237 PolarHBondContact O-N 2.98Å; F235-G238 PolarHBondContact O-N 3.4Å; F235-L239 HydrophobicContact CB-CD1 4.03Å; F235-L239 HydrophobicContact CD1-CD1 4.23Å; F235-L239 WeakPolarHBondContact O-CB 3.36Å; F235-L239 VanDerWaalsContact O-CD1 3.27Å; F235-L239 WeakPolarHBondContact O-CD1 3.47Å; F235-L239 WeakPolarHBondContact O-CG 3.27Å; F235-L239 PolarHBondContact O-N 3.46Å; F235-L434 HydrophobicContact CB-CD2 3.72Å; F235-L434 HydrophobicContact CG-CD2 4.38Å |
| 236 | Y | 89 | Confident | 83.9 | Confident | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -57.1 | -48.1 | 174.7 | -78.4 | -7 | 0 | 0 | 0 | 112.7 | G232 L233 L239 W240 F390 L434 P438 Y447 | G232-Y236 PolarHBondContact O-N 2.75Å; L233-Y236 HydrophobicContact CD2-CD2 4.17Å; L233-Y236 PolarHBondContact O-N 3.3Å; Y236-L239 PolarHBondContact O-N 3.33Å; Y236-W240 WeakPolarHBondContact O-CB 3.47Å; Y236-W240 PolarHBondContact O-N 3.45Å; Y236-F390 WeakPolarHBondContact OH-CA 3.44Å; Y236-L434 HydrophobicContact CD1-CD2 4.37Å; Y236-L434 HydrophobicContact CE1-CB 4.01Å; Y236-L434 HydrophobicContact CE1-CD2 4.33Å; Y236-L434 PolarHBondContact OH-O 2.95Å; Y236-P438 HydrophobicContact CE2-CB 4.23Å; Y236-P438 HydrophobicContact CE2-CG 3.65Å; Y236-Y447 HydrophobicContact CE2-CE1 4.24Å |
| 237 | N | 89.3 | Confident | 84 | Confident | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -68.5 | -37.7 | 179.8 | -75.1 | -85.4 | 0 | 0 | 0 | 112.1 | S57 S60 V61 L233 A234 F235 | S57-N237 WeakPolarHBondContact CB-O 3.31Å; S57-N237 PolarHBondContact OG-O 2.93Å; S60-N237 WeakPolarHBondContact CB-OD1 3.42Å; V61-N237 HydrophobicContact CG2-CB 3.86Å; L233-N237 PolarHBondContact O-N 2.9Å; L233-N237 VanDerWaalsContact O-N 3.13Å; L233-N237 PolarHBondContact O-ND2 3.38Å; A234-N237 PolarHBondContact O-N 2.92Å; F235-N237 PolarHBondContact O-N 2.98Å |
| 238 | G | 90.4 | Very high | 83.8 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -65.9 | -47.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | A234 F235 W240 A241 Y242 | A234-G238 PolarHBondContact O-N 2.99Å; F235-G238 PolarHBondContact O-N 3.4Å; G238-W240 VanDerWaalsContact C-N 3.31Å; G238-W240 PolarHBondContact O-N 3.07Å; G238-A241 WeakPolarHBondContact O-CB 3.09Å; G238-A241 PolarHBondContact O-N 2.77Å; G238-Y242 VanDerWaalsContact O-CD2 3.29Å; G238-Y242 WeakPolarHBondContact O-CD2 3.49Å; G238-Y242 PolarHBondContact O-N 2.9Å |
| 239 | L | 89.3 | Confident | 83.8 | Confident | 13 Ų | 13 | 9.6 Ų | 9.6 | 7% | 0.068 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -69.3 | -27.9 | -178.4 | -66.9 | 161.9 | 0 | 0 | 0 | 112.4 | C78 L81 F235 Y236 A241 Y242 D243 W393 L434 | C78-L239 HydrophobicContact CB-CD2 3.97Å; C78-L239 HydrophobicContact CB-CG 4.37Å; L81-L239 HydrophobicContact CB-CD2 4.41Å; F235-L239 HydrophobicContact CB-CD1 4.03Å; F235-L239 HydrophobicContact CD1-CD1 4.23Å; F235-L239 WeakPolarHBondContact O-CB 3.36Å; F235-L239 VanDerWaalsContact O-CD1 3.27Å; F235-L239 WeakPolarHBondContact O-CD1 3.47Å; F235-L239 WeakPolarHBondContact O-CG 3.27Å; F235-L239 PolarHBondContact O-N 3.46Å; Y236-L239 PolarHBondContact O-N 3.33Å; L239-A241 VanDerWaalsContact C-N 3.28Å; L239-A241 PolarHBondContact O-N 3.44Å; L239-Y242 CarbonylContact O-C 3.49Å; L239-Y242 PolarHBondContact O-N 3.38Å; L239-Y242 VanDerWaalsContact O-N 3.17Å; L239-D243 PolarHBondContact O-N 2.94Å; L239-W393 HydrophobicContact CB-CZ2 4.22Å; L239-W393 HydrophobicContact CD1-CH2 4.33Å; L239-W393 HydrophobicContact CD1-CZ2 3.48Å; L239-W393 VanDerWaalsContact CD1-CZ2 3.48Å; L239-W393 HydrophobicContact CD2-CZ2 3.86Å; L239-W393 HydrophobicContact CG-CZ2 4.02Å; L239-L434 HydrophobicContact CD1-CD1 3.66Å |
| 240 | W | 90.7 | Very high | 83.4 | Confident | 15 Ų | 15 | 9.9 Ų | 9.9 | 6% | 0.057 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -56.3 | -42.9 | 166.6 | 167.4 | -108 | 0 | 0 | 0 | 111.8 | I136 I137 Y236 G238 Y242 D243 I385 F388 | I136-W240 HydrophobicContact CB-CH2 3.91Å; I136-W240 HydrophobicContact CB-CZ2 3.75Å; I136-W240 HydrophobicContact CD1-CE3 4.37Å; I136-W240 HydrophobicContact CD1-CH2 3.85Å; I136-W240 HydrophobicContact CD1-CZ2 4.21Å; I136-W240 HydrophobicContact CD1-CZ3 3.93Å; I136-W240 HydrophobicContact CG1-CH2 4.5Å; I136-W240 HydrophobicContact CG2-CH2 3.96Å; I136-W240 HydrophobicContact CG2-CZ2 3.28Å; I137-W240 HydrophobicContact CG1-CH2 4.25Å; I137-W240 HydrophobicContact CG1-CZ2 4.07Å; Y236-W240 WeakPolarHBondContact O-CB 3.47Å; Y236-W240 PolarHBondContact O-N 3.45Å; G238-W240 VanDerWaalsContact C-N 3.31Å; G238-W240 PolarHBondContact O-N 3.07Å; W240-Y242 PolarHBondContact O-N 3.4Å; W240-D243 WeakPolarHBondContact O-CB 3.33Å; W240-D243 PolarHBondContact O-N 3.32Å; W240-D243 VanDerWaalsContact O-N 3.1Å; W240-I385 HydrophobicContact CB-CG2 3.9Å; W240-I385 HydrophobicContact CD2-CG1 4.26Å; W240-I385 HydrophobicContact CG-CD1 4.24Å; W240-I385 HydrophobicContact CG-CG1 4.17Å; W240-I385 HydrophobicContact CG-CG2 4.17Å; W240-F388 AromaticContact CE3-CD1 3.65Å; W240-F388 HydrophobicContact CE3-CD1 3.65Å; W240-F388 AromaticContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CG 4.49Å; W240-F388 HydrophobicContact CE3-CZ 4.37Å; W240-F388 AromaticContact CZ3-CD1 3.77Å; W240-F388 HydrophobicContact CZ3-CD1 3.77Å; W240-F388 AromaticContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE2 4.42Å; W240-F388 HydrophobicContact CZ3-CG 4.25Å; W240-F388 AromaticContact CZ3-CZ 3.96Å; W240-F388 HydrophobicContact CZ3-CZ 3.96Å |
| 241 | A | 90.3 | Very high | 82.7 | Confident | 1 Ų | 1 | 11.1 Ų | 11.1 | 1% | 0.008 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -69.2 | -24.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | W75 G238 L239 Y277 | W75-A241 HydrophobicContact CH2-CB 3.46Å; W75-A241 VanDerWaalsContact CH2-CB 3.46Å; W75-A241 HydrophobicContact CZ3-CB 3.59Å; G238-A241 WeakPolarHBondContact O-CB 3.09Å; G238-A241 PolarHBondContact O-N 2.77Å; L239-A241 VanDerWaalsContact C-N 3.28Å; L239-A241 PolarHBondContact O-N 3.44Å; A241-Y277 HydrophobicContact CB-CE2 3.99Å; A241-Y277 WeakPolarHBondContact O-CE2 3.44Å; A241-Y277 PolarHBondContact O-OH 3.46Å |
| 242 | Y | 87.5 | Confident | 81.9 | Confident | 1 Ų | 1 | 8.9 Ų | 8.9 | 0% | 0.004 | 4% | 0.042 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | -3.3 | 172.9 | -72.3 | -81.4 | 0 | 0 | 0 | 113.2 | M49 W75 C78 G79 A82 G238 L239 W240 W245 V273 T274 Y277 | M49-Y242 HydrophobicContact CE-CD1 3.69Å; M49-Y242 HydrophobicContact CE-CG 4.37Å; M49-Y242 VanDerWaalsContact CE-O 3.23Å; M49-Y242 WeakPolarHBondContact CE-O 3.16Å; W75-Y242 AromaticContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CZ3-CD2 4.5Å; W75-Y242 AromaticContact CZ3-CE2 3.97Å; W75-Y242 HydrophobicContact CZ3-CE2 3.97Å; W75-Y242 PolarHBondContact O-OH 3.36Å; C78-Y242 HydrophobicContact CB-CD2 3.61Å; C78-Y242 HydrophobicContact CB-CE2 3.46Å; C78-Y242 VanDerWaalsContact CB-CE2 3.46Å; G79-Y242 WeakPolarHBondContact CA-OH 2.91Å; A82-Y242 HydrophobicContact CB-CD1 4.34Å; A82-Y242 HydrophobicContact CB-CG 4.49Å; G238-Y242 VanDerWaalsContact O-CD2 3.29Å; G238-Y242 WeakPolarHBondContact O-CD2 3.49Å; G238-Y242 PolarHBondContact O-N 2.9Å; L239-Y242 CarbonylContact O-C 3.49Å; L239-Y242 PolarHBondContact O-N 3.38Å; L239-Y242 VanDerWaalsContact O-N 3.17Å; W240-Y242 PolarHBondContact O-N 3.4Å; Y242-W245 VanDerWaalsContact O-CD1 3.27Å; Y242-V273 HydrophobicContact CD1-CG1 4.36Å; Y242-V273 HydrophobicContact CE1-CG1 4.26Å; Y242-T274 WeakPolarHBondContact CE1-OG1 3.44Å; Y242-T274 WeakPolarHBondContact OH-CA 3.47Å; Y242-Y277 HydrophobicContact CD1-CD2 4.21Å; Y242-Y277 HydrophobicContact CD1-CE2 4.15Å; Y242-Y277 HydrophobicContact CD2-CD2 4.43Å; Y242-Y277 AromaticContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CE2 4.11Å; Y242-Y277 AromaticContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CE2 4.5Å; Y242-Y277 HydrophobicContact CG-CE2 4.37Å; Y242-Y277 AromaticContact CZ-CD2 3.59Å |
| 243 | D | 85.3 | Confident | 81.1 | Confident | 27 Ų | 27 | 11.8 Ų | 11.8 | 14% | 0.144 | 6% | 0.056 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61 | 146.8 | -177.6 | -171 | 60.9 | 0 | 0 | 0 | 111.6 | L239 W240 Y396 | L239-D243 PolarHBondContact O-N 2.94Å; W240-D243 WeakPolarHBondContact O-CB 3.33Å; W240-D243 PolarHBondContact O-N 3.32Å; W240-D243 VanDerWaalsContact O-N 3.1Å; D243-Y396 PolarHBondContact OD1-OH 3.41Å; D243-Y396 VanDerWaalsContact OD1-OH 3.12Å |
| 244 | G | 78.6 | Confident | 80.5 | Confident | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 7% | 0.066 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 107 | -3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | T48 N246 Q247 | T48-G244 PolarHBondContact OG1-O 3.44Å; G244-N246 PolarHBondContact O-N 3.02Å; G244-Q247 VanDerWaalsContact CA-NE2 3.35Å; G244-Q247 WeakPolarHBondContact O-CB 3.48Å; G244-Q247 WeakPolarHBondContact O-CG 3.46Å; G244-Q247 PolarHBondContact O-N 2.63Å; G244-Q247 VanDerWaalsContact O-N 3.15Å |
| 245 | W | 79.3 | Confident | 79.7 | Confident | 23 Ų | 23 | 14 Ų | 14 | 9% | 0.087 | 7% | 0.066 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61 | -27.6 | 171.1 | 57.7 | -98.5 | 0 | 0 | 0 | 112.9 | M49 A89 Y92 Y242 Q247 I270 Y396 | M49-W245 HydrophobicContact CE-CB 4.28Å; M49-W245 HydrophobicContact CG-CB 4.47Å; M49-W245 HydrophobicContact SD-CB 3.91Å; A89-W245 HydrophobicContact CB-CD2 4.41Å; A89-W245 HydrophobicContact CB-CE3 3.64Å; A89-W245 HydrophobicContact CB-CZ3 4.1Å; Y92-W245 HydrophobicContact CD1-CZ3 4.1Å; Y92-W245 AromaticContact CD2-CH2 3.82Å; Y92-W245 HydrophobicContact CD2-CH2 3.82Å; Y92-W245 AromaticContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CE1-CH2 4.39Å; Y92-W245 HydrophobicContact CE1-CZ3 4.39Å; Y92-W245 AromaticContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CZ3 4.14Å; Y92-W245 HydrophobicContact CG-CH2 4.21Å; Y92-W245 AromaticContact CG-CZ3 3.75Å; Y92-W245 HydrophobicContact CG-CZ3 3.75Å; Y242-W245 VanDerWaalsContact O-CD1 3.27Å; W245-Q247 VanDerWaalsContact C-N 3.33Å; W245-I270 HydrophobicContact CB-CD1 3.86Å; W245-I270 HydrophobicContact CB-CG1 4.38Å; W245-Y396 HydrophobicContact CZ2-CD2 4.07Å; W245-Y396 AromaticContact CZ2-CE2 3.74Å; W245-Y396 HydrophobicContact CZ2-CE2 3.74Å; W245-Y396 AromaticContact CZ2-CZ 3.98Å |
| 246 | N | 77.9 | Confident | 79.2 | Confident | 8 Ų | 8 | 17.2 Ų | 17.2 | 4% | 0.043 | 8% | 0.08 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.8 | -9.8 | 178.2 | 64.6 | -17.6 | 0 | 0 | 0 | 113.5 | Y92 E105 G244 L248 N249 F250 Y396 | Y92-N246 HydrophobicContact CD1-CB 4.33Å; Y92-N246 HydrophobicContact CE1-CB 4.23Å; E105-N246 PolarHBondContact OE1-ND2 3.04Å; G244-N246 PolarHBondContact O-N 3.02Å; N246-L248 VanDerWaalsContact C-N 3.3Å; N246-L248 PolarHBondContact O-N 3.25Å; N246-N249 WeakPolarHBondContact O-CB 3.29Å; N246-N249 PolarHBondContact O-N 3.41Å; N246-N249 VanDerWaalsContact O-N 3.1Å; N246-N249 PolarHBondContact O-ND2 3.28Å; N246-F250 WeakPolarHBondContact O-CD2 3.4Å; N246-Y396 WeakPolarHBondContact ND2-CE1 3.43Å; N246-Y396 PolarHBondContact ND2-OH 2.95Å; N246-Y396 VanDerWaalsContact ND2-OH 3.08Å |
| 247 | Q | 71.7 | Confident | 78.9 | Confident | 26 Ų | 26 | 22.7 Ų | 22.7 | 12% | 0.121 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -63.4 | -34.4 | -175.8 | -69.9 | -172.7 | 62.3 | 0 | 0 | 113 | G244 W245 N249 F250 T333 | G244-Q247 VanDerWaalsContact CA-NE2 3.35Å; G244-Q247 WeakPolarHBondContact O-CB 3.48Å; G244-Q247 WeakPolarHBondContact O-CG 3.46Å; G244-Q247 PolarHBondContact O-N 2.63Å; G244-Q247 VanDerWaalsContact O-N 3.15Å; W245-Q247 VanDerWaalsContact C-N 3.33Å; Q247-N249 PolarHBondContact O-N 3.03Å; Q247-F250 WeakPolarHBondContact O-CB 3.38Å; Q247-F250 PolarHBondContact O-N 3.48Å; Q247-T333 HydrophobicContact CG-CG2 4.22Å |
| 248 | L | 70 | Confident | 78.2 | Confident | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -61 | -27 | 177.7 | -161.3 | 74 | 0 | 0 | 0 | 111.9 | L44 I45 N246 F250 I251 T252 L255 L262 A265 | L44-L248 HydrophobicContact CD2-CD1 3.86Å; I45-L248 HydrophobicContact CD1-CB 4.32Å; I45-L248 HydrophobicContact CD1-CD2 3.61Å; I45-L248 HydrophobicContact CD1-CG 4.45Å; I45-L248 HydrophobicContact CG1-CB 4.08Å; I45-L248 HydrophobicContact CG1-CD1 4.41Å; I45-L248 HydrophobicContact CG1-CD2 4.03Å; I45-L248 HydrophobicContact CG1-CG 4.39Å; N246-L248 VanDerWaalsContact C-N 3.3Å; N246-L248 PolarHBondContact O-N 3.25Å; L248-F250 VanDerWaalsContact C-N 3.28Å; L248-F250 PolarHBondContact O-N 3.37Å; L248-I251 HydrophobicContact CD1-CD1 4.11Å; L248-I251 HydrophobicContact CD1-CG1 4.35Å; L248-I251 WeakPolarHBondContact O-CG1 3.48Å; L248-I251 PolarHBondContact O-N 3.35Å; L248-T252 PolarHBondContact O-N 3.41Å; L248-L255 HydrophobicContact CD1-CD1 4.41Å; L248-L255 HydrophobicContact CD1-CD2 4.27Å; L248-L255 HydrophobicContact CD2-CD1 4.26Å; L248-L255 HydrophobicContact CG-CD1 4Å; L248-L262 HydrophobicContact CB-CD1 4.22Å; L248-L262 HydrophobicContact CD2-CD1 3.52Å; L248-L262 HydrophobicContact CG-CD1 3.83Å; L248-A265 HydrophobicContact CD2-CB 3.84Å |
| 249 | N | 75.4 | Confident | 77.8 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -68.4 | -26.2 | 177.2 | -62.8 | -57.1 | 0 | 0 | 0 | 112.9 | A104 N246 Q247 I251 T252 | A104-N249 HydrophobicContact CB-CB 4.08Å; N246-N249 WeakPolarHBondContact O-CB 3.29Å; N246-N249 PolarHBondContact O-N 3.41Å; N246-N249 VanDerWaalsContact O-N 3.1Å; N246-N249 PolarHBondContact O-ND2 3.28Å; Q247-N249 PolarHBondContact O-N 3.03Å; N249-I251 VanDerWaalsContact C-N 3.29Å; N249-I251 PolarHBondContact O-N 2.97Å; N249-T252 PolarHBondContact O-OG1 3.48Å |
| 250 | F | 69.5 | Low | 77.4 | Confident | 6 Ų | 6 | 37.4 Ų | 37.4 | 3% | 0.026 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -74.2 | -21.1 | 178.6 | -67.8 | -92.5 | 0 | 0 | 0 | 113 | A104 N246 Q247 L248 L337 | A104-F250 HydrophobicContact CB-CD1 3.62Å; A104-F250 HydrophobicContact CB-CD2 3.87Å; A104-F250 HydrophobicContact CB-CE1 3.61Å; A104-F250 HydrophobicContact CB-CE2 3.88Å; A104-F250 HydrophobicContact CB-CG 3.76Å; A104-F250 HydrophobicContact CB-CZ 3.76Å; N246-F250 WeakPolarHBondContact O-CD2 3.4Å; Q247-F250 WeakPolarHBondContact O-CB 3.38Å; Q247-F250 PolarHBondContact O-N 3.48Å; L248-F250 VanDerWaalsContact C-N 3.28Å; L248-F250 PolarHBondContact O-N 3.37Å; F250-L337 HydrophobicContact CE1-CD1 4.45Å |
| 251 | I | 68.2 | Low | 77 | Confident | 30 Ų | 30 | 37.9 Ų | 37.9 | 15% | 0.154 | 17% | 0.171 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -114.3 | 25.9 | -179 | 58.4 | 168.7 | 0 | 0 | 0 | 111.9 | I36 L44 L248 N249 E253 E254 L255 | I36-I251 HydrophobicContact CD1-CD1 3.8Å; L44-I251 HydrophobicContact CD1-CD1 3.76Å; L44-I251 HydrophobicContact CD2-CD1 3.9Å; L44-I251 HydrophobicContact CG-CD1 4.48Å; L248-I251 HydrophobicContact CD1-CD1 4.11Å; L248-I251 HydrophobicContact CD1-CG1 4.35Å; L248-I251 WeakPolarHBondContact O-CG1 3.48Å; L248-I251 PolarHBondContact O-N 3.35Å; N249-I251 VanDerWaalsContact C-N 3.29Å; N249-I251 PolarHBondContact O-N 2.97Å; I251-E253 PolarHBondContact O-N 3.45Å; I251-E254 PolarHBondContact O-N 3.17Å; I251-L255 PolarHBondContact O-N 3.03Å |
| 252 | T | 68.7 | Low | 76.6 | Confident | 6 Ų | 6 | 37.8 Ų | 37.8 | 4% | 0.037 | 17% | 0.17 | C | C | . | . | G | 310 helix | trans | -60.6 | -31.1 | 179.2 | 34.2 | 0 | 0 | 0 | 0 | 113.4 | L248 N249 E254 L255 L262 | L248-T252 PolarHBondContact O-N 3.41Å; N249-T252 PolarHBondContact O-OG1 3.48Å; T252-E254 PolarHBondContact O-N 3.1Å; T252-L255 HydrophobicContact CG2-CD1 4.27Å; T252-L255 PolarHBondContact O-N 3.01Å; T252-L262 HydrophobicContact CG2-CD1 4.17Å; T252-L262 HydrophobicContact CG2-CD2 3.84Å |
| 253 | E | 68.1 | Low | 76.3 | Confident | 61 Ų | 61 | 38.8 Ų | 38.8 | 29% | 0.285 | 18% | 0.177 | S | C | . | . | G | 310 helix | trans | -64.5 | -23.7 | 174.9 | -67.8 | 177.1 | 177 | 0 | 0 | 113 | Q34 S102 I251 R336 | Q34-E253 WeakPolarHBondContact CG-O 3.33Å; S102-E253 WeakPolarHBondContact CB-OE1 3.43Å; S102-E253 VanDerWaalsContact CB-OE2 3.32Å; S102-E253 WeakPolarHBondContact CB-OE2 3.19Å; S102-E253 PolarHBondContact N-OE1 2.94Å; I251-E253 PolarHBondContact O-N 3.45Å; E253-R336 IonicContact OE2-NH2 2.71Å; E253-R336 PolarHBondContact OE2-NH2 3.49Å |
| 254 | E | 72.4 | Confident | 76.2 | Confident | 45 Ų | 45 | 40.4 Ų | 40.4 | 21% | 0.21 | 19% | 0.185 | C | C | . | . | G | 310 helix | trans | -97.2 | -7.3 | -176.5 | -64.6 | 170.5 | -143.7 | 0 | 0 | 113 | L32 Q34 D35 I36 I251 T252 | L32-E254 HydrophobicContact CB-CG 4.02Å; L32-E254 HydrophobicContact CD2-CG 4.19Å; Q34-E254 CarbonylContact C-O 2.88Å; Q34-E254 VanDerWaalsContact CA-O 3.31Å; Q34-E254 WeakPolarHBondContact CA-O 3.22Å; D35-E254 PolarHBondContact N-O 3Å; I36-E254 HydrophobicContact CD1-CB 3.96Å; I36-E254 HydrophobicContact CG1-CB 4.4Å; I36-E254 PolarHBondContact N-O 2.99Å; I36-E254 VanDerWaalsContact N-O 3.14Å; I251-E254 PolarHBondContact O-N 3.17Å; T252-E254 PolarHBondContact O-N 3.1Å |
| 255 | L | 73.2 | Confident | 76.4 | Confident | 2 Ų | 2 | 40.5 Ų | 40.5 | 1% | 0.01 | 19% | 0.186 | C | C | . | . | B | Isolated β-bridge | trans | -79.7 | 131.1 | 179.1 | -75.4 | 165.4 | 0 | 0 | 0 | 111.1 | I36 L248 I251 T252 N257 P258 L262 | I36-L255 HydrophobicContact CB-CD2 4.09Å; I36-L255 HydrophobicContact CG2-CD2 3.7Å; L248-L255 HydrophobicContact CD1-CD1 4.41Å; L248-L255 HydrophobicContact CD1-CD2 4.27Å; L248-L255 HydrophobicContact CD2-CD1 4.26Å; L248-L255 HydrophobicContact CG-CD1 4Å; I251-L255 PolarHBondContact O-N 3.03Å; T252-L255 HydrophobicContact CG2-CD1 4.27Å; T252-L255 PolarHBondContact O-N 3.01Å; L255-N257 PolarHBondContact O-N 3.44Å; L255-P258 HydrophobicContact CB-CB 4.36Å; L255-L262 HydrophobicContact CD1-CB 4.38Å; L255-L262 HydrophobicContact CD1-CD1 3.99Å |
| 256 | K | 79.4 | Confident | 76.5 | Confident | 97 Ų | 97 | 39.5 Ų | 39.5 | 42% | 0.422 | 18% | 0.182 | S | C | . | . | S | Bend | trans | -66.5 | 127.4 | 165.8 | -67.3 | -179.7 | 179 | 173.6 | 0 | 108.7 | Q34 I36 N261 | Q34-K256 HydrophobicContact CB-CG 4.32Å; Q34-K256 WeakPolarHBondContact O-CE 3.32Å; Q34-K256 WeakPolarHBondContact O-CG 3.32Å; I36-K256 PolarHBondContact O-N 3.5Å; K256-N261 PolarHBondContact O-ND2 2.83Å |
| 257 | N | 80.9 | Confident | 76.8 | Confident | 116 Ų | 116 | 42 Ų | 42 | 62% | 0.62 | 20% | 0.198 | S | C | * | . | S | Bend | trans | 48.4 | 65.9 | 178.7 | -67.6 | -29.2 | 0 | 0 | 0 | 113.6 | L255 Y259 R260 N261 | L255-N257 PolarHBondContact O-N 3.44Å; N257-Y259 PolarHBondContact O-N 2.86Å; N257-R260 PolarHBondContact O-N 2.91Å; N257-N261 WeakPolarHBondContact O-CB 3.23Å; N257-N261 PolarHBondContact O-N 3.24Å |
| 258 | P | 76.3 | Confident | 77.5 | Confident | 18 Ų | 18 | 44.6 Ų | 44.6 | 12% | 0.117 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.4 | -35.5 | -173.1 | 23.3 | -33.1 | 0 | 0 | 0 | 112.6 | L255 R260 L262 | L255-P258 HydrophobicContact CB-CB 4.36Å; P258-R260 PolarHBondContact O-N 2.83Å; P258-R260 VanDerWaalsContact O-N 3.12Å; P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 PolarHBondContact O-N 3.45Å |
| 259 | Y | 80.6 | Confident | 78.2 | Confident | 124 Ų | 124 | 44.6 Ų | 44.6 | 49% | 0.486 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -56 | -31.6 | -179.8 | -51.7 | -59.3 | 0 | 0 | 0 | 114.6 | T97 N257 P263 P416 | T97-Y259 HydrophobicContact CG2-CD1 3.92Å; N257-Y259 PolarHBondContact O-N 2.86Å; Y259-P263 WeakPolarHBondContact O-CG 3.27Å; Y259-P416 HydrophobicContact CD1-CB 3.62Å; Y259-P416 HydrophobicContact CD1-CG 3.61Å; Y259-P416 HydrophobicContact CE1-CB 4.21Å; Y259-P416 HydrophobicContact CE1-CG 3.66Å; Y259-P416 HydrophobicContact CG-CB 4.18Å; Y259-P416 HydrophobicContact CG-CG 4.47Å |
| 260 | R | 81.9 | Confident | 78.7 | Confident | 180 Ų | 180 | 44.7 Ų | 44.7 | 68% | 0.679 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -105.7 | -42.4 | -179.7 | -178.1 | 177.1 | 176.1 | -170.3 | 0.1 | 111.8 | N257 P258 P263 L264 | N257-R260 PolarHBondContact O-N 2.91Å; P258-R260 PolarHBondContact O-N 2.83Å; P258-R260 VanDerWaalsContact O-N 3.12Å; R260-P263 WeakPolarHBondContact O-CD 3.41Å; R260-P263 WeakPolarHBondContact O-CG 3.49Å; R260-L264 HydrophobicContact CG-CD1 3.64Å; R260-L264 WeakPolarHBondContact O-CB 3.21Å; R260-L264 WeakPolarHBondContact O-CD1 3.15Å; R260-L264 VanDerWaalsContact O-CG 3.25Å; R260-L264 WeakPolarHBondContact O-CG 3.38Å; R260-L264 PolarHBondContact O-N 2.89Å |
| 261 | N | 82.5 | Confident | 79.7 | Confident | 24 Ų | 24 | 46.5 Ų | 46.5 | 13% | 0.128 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -78.3 | -33.5 | -170.9 | -72.3 | -9.5 | 0 | 0 | 0 | 112.9 | L38 K256 N257 A265 | L38-N261 HydrophobicContact CB-CB 4.5Å; L38-N261 HydrophobicContact CD1-CB 4.18Å; K256-N261 PolarHBondContact O-ND2 2.83Å; N257-N261 WeakPolarHBondContact O-CB 3.23Å; N257-N261 PolarHBondContact O-N 3.24Å; N261-A265 WeakPolarHBondContact O-CB 3.43Å; N261-A265 PolarHBondContact O-N 3.31Å |
| 262 | L | 80.6 | Confident | 80.6 | Confident | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.5 | -55.8 | 175.6 | -178.4 | 68.1 | 0 | 0 | 0 | 112.2 | A93 T97 L248 T252 L255 P258 L264 A265 I266 | A93-L262 HydrophobicContact CB-CD2 4.06Å; A93-L262 HydrophobicContact CB-CG 4.24Å; T97-L262 HydrophobicContact CG2-CD2 4.27Å; L248-L262 HydrophobicContact CB-CD1 4.22Å; L248-L262 HydrophobicContact CD2-CD1 3.52Å; L248-L262 HydrophobicContact CG-CD1 3.83Å; T252-L262 HydrophobicContact CG2-CD1 4.17Å; T252-L262 HydrophobicContact CG2-CD2 3.84Å; L255-L262 HydrophobicContact CD1-CB 4.38Å; L255-L262 HydrophobicContact CD1-CD1 3.99Å; P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 PolarHBondContact O-N 3.45Å; L262-L264 PolarHBondContact O-N 2.97Å; L262-A265 PolarHBondContact O-N 3.02Å; L262-I266 HydrophobicContact CD1-CD1 4.24Å; L262-I266 HydrophobicContact CG-CD1 4.26Å; L262-I266 WeakPolarHBondContact O-CG1 3.29Å; L262-I266 PolarHBondContact O-N 2.71Å |
| 263 | P | 81.9 | Confident | 81.6 | Confident | 21 Ų | 21 | 48.9 Ų | 48.9 | 14% | 0.136 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.1 | -37.1 | -179.5 | 25.8 | -35.1 | 0 | 0 | 0 | 112.5 | L90 Y259 R260 I266 V267 V417 | L90-P263 HydrophobicContact CD2-CB 3.53Å; Y259-P263 WeakPolarHBondContact O-CG 3.27Å; R260-P263 WeakPolarHBondContact O-CD 3.41Å; R260-P263 WeakPolarHBondContact O-CG 3.49Å; P263-I266 PolarHBondContact O-N 3.2Å; P263-V267 WeakPolarHBondContact O-CB 3.26Å; P263-V267 VanDerWaalsContact O-CG2 3.25Å; P263-V267 WeakPolarHBondContact O-CG2 3.38Å; P263-V267 PolarHBondContact O-N 2.77Å; P263-V417 HydrophobicContact CG-CG2 4.34Å |
| 264 | L | 83.3 | Confident | 82.6 | Confident | 62 Ų | 62 | 46.8 Ų | 46.8 | 33% | 0.325 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -65.6 | -41.9 | 177.1 | -75.4 | 172.6 | 0 | 0 | 0 | 112.2 | L38 R260 L262 I266 V267 I268 | L38-L264 HydrophobicContact CD1-CB 3.78Å; L38-L264 HydrophobicContact CD2-CD1 4.46Å; R260-L264 HydrophobicContact CG-CD1 3.64Å; R260-L264 WeakPolarHBondContact O-CB 3.21Å; R260-L264 WeakPolarHBondContact O-CD1 3.15Å; R260-L264 VanDerWaalsContact O-CG 3.25Å; R260-L264 WeakPolarHBondContact O-CG 3.38Å; R260-L264 PolarHBondContact O-N 2.89Å; L262-L264 PolarHBondContact O-N 2.97Å; L264-I266 VanDerWaalsContact C-N 3.26Å; L264-I266 PolarHBondContact O-N 2.93Å; L264-V267 PolarHBondContact O-N 2.89Å; L264-I268 WeakPolarHBondContact O-CB 3.46Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.44Å; L264-I268 PolarHBondContact O-N 3.01Å |
| 265 | A | 83 | Confident | 83.5 | Confident | 1 Ų | 1 | 48.1 Ų | 48.1 | 1% | 0.008 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61 | -39.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | L38 I42 I45 L248 N261 L262 G269 | L38-A265 HydrophobicContact CD1-CB 4.22Å; I42-A265 HydrophobicContact CG1-CB 4.02Å; I45-A265 HydrophobicContact CD1-CB 3.86Å; L248-A265 HydrophobicContact CD2-CB 3.84Å; N261-A265 WeakPolarHBondContact O-CB 3.43Å; N261-A265 PolarHBondContact O-N 3.31Å; L262-A265 PolarHBondContact O-N 3.02Å; A265-G269 WeakPolarHBondContact O-CA 3.19Å; A265-G269 PolarHBondContact O-N 3.42Å |
| 266 | I | 81.9 | Confident | 84.3 | Confident | 3 Ų | 3 | 49.4 Ų | 49.4 | 2% | 0.015 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -66.5 | -50.7 | 176.4 | -72.2 | 166.3 | 0 | 0 | 0 | 111.5 | I45 A89 A93 L262 P263 L264 I268 G269 I270 | I45-I266 HydrophobicContact CD1-CG1 3.86Å; A89-I266 HydrophobicContact CB-CB 4.43Å; A89-I266 HydrophobicContact CB-CD1 4.08Å; A89-I266 HydrophobicContact CB-CG1 4.31Å; A89-I266 HydrophobicContact CB-CG2 3.31Å; A93-I266 HydrophobicContact CB-CD1 4.22Å; L262-I266 HydrophobicContact CD1-CD1 4.24Å; L262-I266 HydrophobicContact CG-CD1 4.26Å; L262-I266 WeakPolarHBondContact O-CG1 3.29Å; L262-I266 PolarHBondContact O-N 2.71Å; P263-I266 PolarHBondContact O-N 3.2Å; L264-I266 VanDerWaalsContact C-N 3.26Å; L264-I266 PolarHBondContact O-N 2.93Å; I266-I268 PolarHBondContact O-N 3.21Å; I266-G269 PolarHBondContact O-N 3.3Å; I266-I270 HydrophobicContact CG2-CD1 3.76Å; I266-I270 HydrophobicContact CG2-CG1 4.44Å; I266-I270 WeakPolarHBondContact O-CG1 3.23Å; I266-I270 PolarHBondContact O-N 3.36Å; I266-I270 VanDerWaalsContact O-N 3.15Å |
| 267 | V | 83.4 | Confident | 84.9 | Confident | 61 Ų | 61 | 44.8 Ų | 44.8 | 37% | 0.37 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -65.9 | -26 | -176.2 | 170.6 | 0 | 0 | 0 | 0 | 112.3 | L90 P263 L264 P271 | L90-V267 HydrophobicContact CD1-CG2 4.18Å; P263-V267 WeakPolarHBondContact O-CB 3.26Å; P263-V267 VanDerWaalsContact O-CG2 3.25Å; P263-V267 WeakPolarHBondContact O-CG2 3.38Å; P263-V267 PolarHBondContact O-N 2.77Å; L264-V267 PolarHBondContact O-N 2.89Å; V267-P271 VanDerWaalsContact O-CD 3.23Å; V267-P271 WeakPolarHBondContact O-CD 3.27Å; V267-P271 WeakPolarHBondContact O-CG 3.28Å |
| 268 | I | 86.3 | Confident | 85.4 | Confident | 80 Ų | 80 | 40.6 Ų | 40.6 | 41% | 0.41 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -91.4 | -45.8 | 176.6 | -62.4 | 167.1 | 0 | 0 | 0 | 110.8 | I42 L264 I266 L272 | I42-I268 HydrophobicContact CD1-CB 4.26Å; I42-I268 HydrophobicContact CD1-CD1 4.09Å; I42-I268 HydrophobicContact CD1-CG2 4.08Å; L264-I268 WeakPolarHBondContact O-CB 3.46Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.44Å; L264-I268 PolarHBondContact O-N 3.01Å; I266-I268 PolarHBondContact O-N 3.21Å; I268-L272 WeakPolarHBondContact O-CB 3.44Å; I268-L272 PolarHBondContact O-N 3.39Å |
| 269 | G | 84.7 | Confident | 86.2 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -68.1 | -47.8 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114 | A265 I266 L272 V273 | A265-G269 WeakPolarHBondContact O-CA 3.19Å; A265-G269 PolarHBondContact O-N 3.42Å; I266-G269 PolarHBondContact O-N 3.3Å; G269-L272 WeakPolarHBondContact O-CB 3.46Å; G269-L272 PolarHBondContact O-N 2.97Å; G269-V273 WeakPolarHBondContact O-CG2 3.45Å; G269-V273 PolarHBondContact O-N 3.39Å; G269-V273 VanDerWaalsContact O-N 3.08Å |
| 270 | I | 86.9 | Confident | 86.7 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.005 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -66.9 | -46.8 | -175.5 | -53.5 | -179 | 0 | 0 | 0 | 112.7 | M49 A82 T83 A89 W245 I266 L272 V273 T274 | M49-I270 HydrophobicContact CE-CG1 4.37Å; M49-I270 HydrophobicContact CE-CG2 4.05Å; M49-I270 HydrophobicContact SD-CG1 4.03Å; A82-I270 HydrophobicContact CB-CG2 3.57Å; A82-I270 WeakPolarHBondContact O-CD1 3.02Å; T83-I270 WeakPolarHBondContact OG1-CG2 3.25Å; A89-I270 HydrophobicContact CB-CD1 3.8Å; W245-I270 HydrophobicContact CB-CD1 3.86Å; W245-I270 HydrophobicContact CB-CG1 4.38Å; I266-I270 HydrophobicContact CG2-CD1 3.76Å; I266-I270 HydrophobicContact CG2-CG1 4.44Å; I266-I270 WeakPolarHBondContact O-CG1 3.23Å; I266-I270 PolarHBondContact O-N 3.36Å; I266-I270 VanDerWaalsContact O-N 3.15Å; I270-L272 VanDerWaalsContact C-N 3.29Å; I270-L272 PolarHBondContact O-N 3.42Å; I270-V273 PolarHBondContact O-N 3.34Å; I270-T274 PolarHBondContact O-N 3.18Å; I270-T274 PolarHBondContact O-OG1 3.36Å |
| 271 | P | 88.6 | Confident | 87.2 | Confident | 44 Ų | 44 | 29.4 Ų | 29.4 | 29% | 0.286 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -65.8 | -32.4 | 176.7 | 11.7 | -14.8 | 0 | 0 | 0 | 112.5 | T83 V267 V273 T274 V275 | T83-P271 HydrophobicContact CG2-CB 3.93Å; T83-P271 HydrophobicContact CG2-CG 3.67Å; V267-P271 VanDerWaalsContact O-CD 3.23Å; V267-P271 WeakPolarHBondContact O-CD 3.27Å; V267-P271 WeakPolarHBondContact O-CG 3.28Å; P271-V273 PolarHBondContact O-N 3.21Å; P271-T274 WeakPolarHBondContact O-CB 3.27Å; P271-T274 PolarHBondContact O-N 3.27Å; P271-V275 VanDerWaalsContact O-CG2 3.3Å; P271-V275 WeakPolarHBondContact O-CG2 3.29Å; P271-V275 PolarHBondContact O-N 2.72Å |
| 272 | L | 87.9 | Confident | 87.6 | Confident | 87 Ų | 87 | 29.8 Ų | 29.8 | 46% | 0.455 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -58.9 | -47.5 | 172.3 | 180 | 65.7 | 0 | 0 | 0 | 111.1 | V46 I268 G269 I270 T274 V275 C276 | V46-L272 HydrophobicContact CG2-CD2 4.17Å; I268-L272 WeakPolarHBondContact O-CB 3.44Å; I268-L272 PolarHBondContact O-N 3.39Å; G269-L272 WeakPolarHBondContact O-CB 3.46Å; G269-L272 PolarHBondContact O-N 2.97Å; I270-L272 VanDerWaalsContact C-N 3.29Å; I270-L272 PolarHBondContact O-N 3.42Å; L272-T274 VanDerWaalsContact C-N 3.33Å; L272-T274 PolarHBondContact O-N 3.45Å; L272-V275 PolarHBondContact O-N 3.37Å; L272-C276 PolarHBondContact O-N 2.85Å; L272-C276 PolarHBondContact O-SG 3.49Å |
| 273 | V | 89.1 | Confident | 88 | Confident | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.7 | -41.9 | 175.6 | 175.1 | 0 | 0 | 0 | 0 | 111.2 | V46 M49 I50 Y242 G269 I270 P271 V275 C276 Y277 | V46-V273 HydrophobicContact CB-CG2 4.44Å; V46-V273 HydrophobicContact CG1-CG2 4.29Å; V46-V273 HydrophobicContact CG2-CG2 4.19Å; M49-V273 HydrophobicContact CB-CG1 4.39Å; M49-V273 HydrophobicContact CB-CG2 4.33Å; M49-V273 HydrophobicContact CE-CB 4.48Å; M49-V273 HydrophobicContact CE-CG1 4.26Å; M49-V273 HydrophobicContact SD-CG2 4.42Å; I50-V273 HydrophobicContact CD1-CG2 4.18Å; I50-V273 HydrophobicContact CG1-CG1 4.09Å; I50-V273 HydrophobicContact CG1-CG2 3.92Å; Y242-V273 HydrophobicContact CD1-CG1 4.36Å; Y242-V273 HydrophobicContact CE1-CG1 4.26Å; G269-V273 WeakPolarHBondContact O-CG2 3.45Å; G269-V273 PolarHBondContact O-N 3.39Å; G269-V273 VanDerWaalsContact O-N 3.08Å; I270-V273 PolarHBondContact O-N 3.34Å; P271-V273 PolarHBondContact O-N 3.21Å; V273-V275 PolarHBondContact O-N 3.32Å; V273-C276 WeakPolarHBondContact O-CB 3.41Å; V273-C276 PolarHBondContact O-N 2.87Å; V273-Y277 HydrophobicContact CG1-CD1 4.11Å; V273-Y277 HydrophobicContact CG1-CD2 3.91Å; V273-Y277 HydrophobicContact CG1-CE1 3.78Å; V273-Y277 HydrophobicContact CG1-CE2 3.57Å; V273-Y277 HydrophobicContact CG1-CG 4.19Å; V273-Y277 WeakPolarHBondContact O-CB 3.36Å; V273-Y277 PolarHBondContact O-N 3.46Å |
| 274 | T | 90.4 | Very high | 88.4 | Confident | 16 Ų | 16 | 28.8 Ų | 28.8 | 10% | 0.098 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -58.8 | -48.1 | 178.4 | -57 | 0 | 0 | 0 | 0 | 111.4 | G79 Y242 I270 P271 L272 C276 Y277 V278 | G79-T274 WeakPolarHBondContact CA-OG1 3.49Å; Y242-T274 WeakPolarHBondContact CE1-OG1 3.44Å; Y242-T274 WeakPolarHBondContact OH-CA 3.47Å; I270-T274 PolarHBondContact O-N 3.18Å; I270-T274 PolarHBondContact O-OG1 3.36Å; P271-T274 WeakPolarHBondContact O-CB 3.27Å; P271-T274 PolarHBondContact O-N 3.27Å; L272-T274 VanDerWaalsContact C-N 3.33Å; L272-T274 PolarHBondContact O-N 3.45Å; T274-C276 PolarHBondContact O-N 3.42Å; T274-Y277 PolarHBondContact O-N 3.29Å; T274-V278 WeakPolarHBondContact O-CG2 3.49Å; T274-V278 PolarHBondContact O-N 3.31Å |
| 275 | V | 90.7 | Very high | 88.7 | Confident | 74 Ų | 74 | 25.9 Ų | 25.9 | 45% | 0.448 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -60.9 | -45.8 | 177.5 | 171 | 0 | 0 | 0 | 0 | 110.4 | P271 L272 V273 Y277 V278 F279 | P271-V275 VanDerWaalsContact O-CG2 3.3Å; P271-V275 WeakPolarHBondContact O-CG2 3.29Å; P271-V275 PolarHBondContact O-N 2.72Å; L272-V275 PolarHBondContact O-N 3.37Å; V273-V275 PolarHBondContact O-N 3.32Å; V275-Y277 PolarHBondContact O-N 2.82Å; V275-V278 PolarHBondContact O-N 3.2Å; V275-F279 HydrophobicContact CG1-CD2 3.52Å; V275-F279 HydrophobicContact CG1-CE2 3.37Å; V275-F279 WeakPolarHBondContact O-CD2 3.39Å; V275-F279 PolarHBondContact O-N 3.35Å |
| 276 | C | 90.4 | Very high | 88.9 | Confident | 29 Ų | 29 | 26.1 Ų | 26.1 | 20% | 0.196 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -59.4 | -45 | 175.9 | -69.1 | 0 | 0 | 0 | 0 | 112.4 | I198 L272 V273 T274 F279 V280 | I198-C276 HydrophobicContact CG2-CB 4.12Å; L272-C276 PolarHBondContact O-N 2.85Å; L272-C276 PolarHBondContact O-SG 3.49Å; V273-C276 WeakPolarHBondContact O-CB 3.41Å; V273-C276 PolarHBondContact O-N 2.87Å; T274-C276 PolarHBondContact O-N 3.42Å; C276-F279 PolarHBondContact O-N 2.99Å; C276-V280 WeakPolarHBondContact O-CB 3.19Å; C276-V280 VanDerWaalsContact O-CG2 3.23Å; C276-V280 WeakPolarHBondContact O-CG2 3.43Å; C276-V280 PolarHBondContact O-N 3Å |
| 277 | Y | 91.9 | Very high | 89.1 | Confident | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67 | -42.2 | -178.4 | -74.2 | -0.1 | 0 | 0 | 0 | 112.6 | M49 I50 I54 W75 A241 Y242 V273 T274 V275 V280 N281 | M49-Y277 PolarHBondContact O-OH 2.87Å; I50-Y277 WeakPolarHBondContact CA-OH 3.45Å; I50-Y277 HydrophobicContact CG1-CE1 4.12Å; I54-Y277 HydrophobicContact CB-CD1 3.98Å; I54-Y277 HydrophobicContact CB-CE1 3.63Å; I54-Y277 HydrophobicContact CD1-CD1 3.65Å; I54-Y277 HydrophobicContact CD1-CD2 4.3Å; I54-Y277 HydrophobicContact CD1-CE1 4.2Å; I54-Y277 HydrophobicContact CD1-CG 3.69Å; I54-Y277 HydrophobicContact CG1-CD1 3.65Å; I54-Y277 HydrophobicContact CG1-CE1 3.85Å; I54-Y277 HydrophobicContact CG1-CG 4.22Å; I54-Y277 HydrophobicContact CG2-CE1 4.12Å; W75-Y277 AromaticContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CG 4.41Å; W75-Y277 HydrophobicContact CH2-CD2 4.49Å; W75-Y277 AromaticContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CD2 3.48Å; W75-Y277 VanDerWaalsContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CE2 4.09Å; W75-Y277 HydrophobicContact CZ3-CG 4.08Å; A241-Y277 HydrophobicContact CB-CE2 3.99Å; A241-Y277 WeakPolarHBondContact O-CE2 3.44Å; A241-Y277 PolarHBondContact O-OH 3.46Å; Y242-Y277 HydrophobicContact CD1-CD2 4.21Å; Y242-Y277 HydrophobicContact CD1-CE2 4.15Å; Y242-Y277 HydrophobicContact CD2-CD2 4.43Å; Y242-Y277 AromaticContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CE2 4.11Å; Y242-Y277 AromaticContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CE2 4.5Å; Y242-Y277 HydrophobicContact CG-CE2 4.37Å; Y242-Y277 AromaticContact CZ-CD2 3.59Å; V273-Y277 HydrophobicContact CG1-CD1 4.11Å; V273-Y277 HydrophobicContact CG1-CD2 3.91Å; V273-Y277 HydrophobicContact CG1-CE1 3.78Å; V273-Y277 HydrophobicContact CG1-CE2 3.57Å; V273-Y277 HydrophobicContact CG1-CG 4.19Å; V273-Y277 WeakPolarHBondContact O-CB 3.36Å; V273-Y277 PolarHBondContact O-N 3.46Å; T274-Y277 PolarHBondContact O-N 3.29Å; V275-Y277 PolarHBondContact O-N 2.82Å; Y277-V280 PolarHBondContact O-N 2.95Å; Y277-N281 PolarHBondContact O-N 2.84Å; Y277-N281 PolarHBondContact O-ND2 3Å |
| 278 | V | 92 | Very high | 89.2 | Confident | 27 Ų | 27 | 24.3 Ų | 24.3 | 16% | 0.164 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.4 | -46.2 | 175.5 | 172.6 | 0 | 0 | 0 | 0 | 110.2 | W75 T274 V275 V280 N281 I282 | W75-V278 HydrophobicContact CB-CG2 4.34Å; T274-V278 WeakPolarHBondContact O-CG2 3.49Å; T274-V278 PolarHBondContact O-N 3.31Å; V275-V278 PolarHBondContact O-N 3.2Å; V278-V280 PolarHBondContact O-N 3.43Å; V278-N281 PolarHBondContact O-N 3.49Å; V278-I282 HydrophobicContact CG1-CD1 3.8Å; V278-I282 HydrophobicContact CG1-CG1 4.44Å; V278-I282 VanDerWaalsContact O-CG1 3.3Å; V278-I282 WeakPolarHBondContact O-CG1 3.11Å; V278-I282 PolarHBondContact O-N 3.41Å |
| 279 | F | 91.9 | Very high | 89.3 | Confident | 86 Ų | 86 | 22.9 Ų | 22.9 | 38% | 0.377 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -64.7 | -36.9 | 178.1 | -79 | -54.5 | 0 | 0 | 0 | 113.7 | V202 V275 C276 I282 A283 | V202-F279 HydrophobicContact CB-CB 4.49Å; V202-F279 HydrophobicContact CG1-CB 3.93Å; V202-F279 HydrophobicContact CG1-CG 4.3Å; V202-F279 HydrophobicContact CG2-CB 3.82Å; V275-F279 HydrophobicContact CG1-CD2 3.52Å; V275-F279 HydrophobicContact CG1-CE2 3.37Å; V275-F279 WeakPolarHBondContact O-CD2 3.39Å; V275-F279 PolarHBondContact O-N 3.35Å; C276-F279 PolarHBondContact O-N 2.99Å; F279-I282 HydrophobicContact CD1-CD1 4.4Å; F279-I282 PolarHBondContact O-N 2.95Å; F279-A283 WeakPolarHBondContact O-CB 3.39Å; F279-A283 PolarHBondContact O-N 2.92Å |
| 280 | V | 91.6 | Very high | 89.3 | Confident | 1 Ų | 1 | 24.7 Ų | 24.7 | 1% | 0.006 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64 | -43.7 | 174.7 | 166.5 | 0 | 0 | 0 | 0 | 111 | I54 I198 I201 V202 C276 Y277 V278 A283 Y284 | I54-V280 HydrophobicContact CD1-CG1 4.29Å; I54-V280 HydrophobicContact CG1-CB 4.4Å; I54-V280 HydrophobicContact CG1-CG1 3.95Å; I198-V280 HydrophobicContact CG2-CG2 4.03Å; I201-V280 HydrophobicContact CG2-CG1 4.22Å; I201-V280 HydrophobicContact CG2-CG2 4.24Å; V202-V280 HydrophobicContact CG2-CG2 3.8Å; C276-V280 WeakPolarHBondContact O-CB 3.19Å; C276-V280 VanDerWaalsContact O-CG2 3.23Å; C276-V280 WeakPolarHBondContact O-CG2 3.43Å; C276-V280 PolarHBondContact O-N 3Å; Y277-V280 PolarHBondContact O-N 2.95Å; V278-V280 PolarHBondContact O-N 3.43Å; V280-A283 WeakPolarHBondContact O-CB 3.34Å; V280-A283 PolarHBondContact O-N 2.8Å; V280-Y284 HydrophobicContact CG1-CD2 4.1Å; V280-Y284 HydrophobicContact CG1-CE1 4.32Å; V280-Y284 HydrophobicContact CG1-CE2 3.44Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.44Å; V280-Y284 PolarHBondContact O-N 3Å |
| 281 | N | 91.8 | Very high | 89.3 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65 | -42.3 | 176.8 | -78.8 | -83.7 | 0 | 0 | 0 | 111.7 | P58 L72 W75 Y277 V278 A283 Y284 F285 | P58-N281 WeakPolarHBondContact CB-OD1 3.35Å; L72-N281 HydrophobicContact CD2-CB 3.8Å; W75-N281 VanDerWaalsContact CE2-ND2 3.27Å; W75-N281 PolarHBondContact NE1-ND2 3.02Å; W75-N281 PolarHBondContact NE1-OD1 3.02Å; W75-N281 VanDerWaalsContact NE1-OD1 3.14Å; Y277-N281 PolarHBondContact O-N 2.84Å; Y277-N281 PolarHBondContact O-ND2 3Å; V278-N281 PolarHBondContact O-N 3.49Å; N281-A283 VanDerWaalsContact C-N 3.29Å; N281-A283 PolarHBondContact O-N 3.23Å; N281-Y284 PolarHBondContact O-N 3.39Å; N281-F285 HydrophobicContact CB-CE2 4.31Å; N281-F285 WeakPolarHBondContact O-CD2 3.39Å; N281-F285 PolarHBondContact O-N 2.99Å; N281-F285 VanDerWaalsContact O-N 3.1Å |
| 282 | I | 90.3 | Very high | 89.3 | Confident | 32 Ų | 32 | 29.1 Ų | 29.1 | 16% | 0.164 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -57.6 | -45.1 | 172.9 | -67.4 | 167.4 | 0 | 0 | 0 | 110.2 | L72 M209 V278 F279 Y284 F285 T286 | L72-I282 HydrophobicContact CD1-CG1 4.12Å; L72-I282 HydrophobicContact CD2-CG1 3.94Å; M209-I282 HydrophobicContact CE-CG2 4.07Å; M209-I282 HydrophobicContact SD-CG2 3.56Å; M209-I282 VanDerWaalsContact SD-CG2 3.56Å; V278-I282 HydrophobicContact CG1-CD1 3.8Å; V278-I282 HydrophobicContact CG1-CG1 4.44Å; V278-I282 VanDerWaalsContact O-CG1 3.3Å; V278-I282 WeakPolarHBondContact O-CG1 3.11Å; V278-I282 PolarHBondContact O-N 3.41Å; F279-I282 HydrophobicContact CD1-CD1 4.4Å; F279-I282 PolarHBondContact O-N 2.95Å; I282-Y284 VanDerWaalsContact C-N 3.32Å; I282-Y284 PolarHBondContact O-N 3.31Å; I282-F285 PolarHBondContact O-N 3.21Å; I282-T286 HydrophobicContact CG2-CG2 4.44Å; I282-T286 VanDerWaalsContact O-CG2 3.28Å; I282-T286 WeakPolarHBondContact O-CG2 3.36Å; I282-T286 PolarHBondContact O-N 3.04Å; I282-T286 VanDerWaalsContact O-N 3.07Å |
| 283 | A | 90.6 | Very high | 89.3 | Confident | 1 Ų | 1 | 25 Ų | 25 | 1% | 0.008 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -58.7 | -41.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | I201 F279 V280 N281 F285 T286 F303 | I201-A283 HydrophobicContact CG2-CB 3.96Å; F279-A283 WeakPolarHBondContact O-CB 3.39Å; F279-A283 PolarHBondContact O-N 2.92Å; V280-A283 WeakPolarHBondContact O-CB 3.34Å; V280-A283 PolarHBondContact O-N 2.8Å; N281-A283 VanDerWaalsContact C-N 3.29Å; N281-A283 PolarHBondContact O-N 3.23Å; A283-F285 PolarHBondContact O-N 3.02Å; A283-T286 PolarHBondContact O-N 3.06Å; A283-T286 PolarHBondContact O-OG1 3.49Å; A283-F303 HydrophobicContact CB-CE2 4.24Å |
| 284 | Y | 90.3 | Very high | 89.2 | Confident | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.5 | -44.6 | 175.1 | -65.2 | -32.1 | 0 | 0 | 0 | 112.6 | P58 I201 V280 N281 I282 T286 V287 M288 V299 F303 | P58-Y284 HydrophobicContact CB-CD2 4.47Å; P58-Y284 HydrophobicContact CG-CD2 4.4Å; P58-Y284 HydrophobicContact CG-CE2 4.15Å; I201-Y284 HydrophobicContact CG2-CE1 4.24Å; V280-Y284 HydrophobicContact CG1-CD2 4.1Å; V280-Y284 HydrophobicContact CG1-CE1 4.32Å; V280-Y284 HydrophobicContact CG1-CE2 3.44Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.44Å; V280-Y284 PolarHBondContact O-N 3Å; N281-Y284 PolarHBondContact O-N 3.39Å; I282-Y284 VanDerWaalsContact C-N 3.32Å; I282-Y284 PolarHBondContact O-N 3.31Å; Y284-T286 VanDerWaalsContact C-N 3.29Å; Y284-T286 PolarHBondContact O-N 3.44Å; Y284-V287 PolarHBondContact O-N 3.26Å; Y284-M288 PolarHBondContact O-N 2.82Å; Y284-V299 HydrophobicContact CD1-CG1 4.11Å; Y284-V299 HydrophobicContact CD2-CG1 3.78Å; Y284-V299 HydrophobicContact CE1-CG1 4.25Å; Y284-V299 HydrophobicContact CE2-CG1 3.92Å; Y284-V299 HydrophobicContact CG-CG1 3.89Å; Y284-F303 HydrophobicContact CD1-CB 4.02Å; Y284-F303 AromaticContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CG 4.05Å; Y284-F303 HydrophobicContact CE1-CB 3.96Å; Y284-F303 HydrophobicContact CE1-CD2 4.3Å; Y284-F303 HydrophobicContact CE1-CG 4.09Å |
| 285 | F | 89.1 | Confident | 89 | Confident | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -69.4 | -23 | 179.7 | -64.7 | -55.9 | 0 | 0 | 0 | 114.1 | L62 V68 C71 L72 N216 L217 N281 I282 A283 V287 L293 | L62-F285 HydrophobicContact CD1-CE1 4.16Å; L62-F285 HydrophobicContact CD1-CZ 4.17Å; L62-F285 HydrophobicContact CD2-CE1 4.01Å; V68-F285 HydrophobicContact CG1-CB 4.31Å; V68-F285 HydrophobicContact CG1-CD1 4.02Å; V68-F285 HydrophobicContact CG1-CD2 3.6Å; V68-F285 HydrophobicContact CG1-CE1 4.22Å; V68-F285 HydrophobicContact CG1-CE2 3.83Å; V68-F285 HydrophobicContact CG1-CG 3.71Å; V68-F285 HydrophobicContact CG1-CZ 4.14Å; V68-F285 HydrophobicContact CG2-CD1 3.91Å; V68-F285 HydrophobicContact CG2-CE1 3.92Å; V68-F285 HydrophobicContact CG2-CG 4.43Å; V68-F285 HydrophobicContact CG2-CZ 4.43Å; C71-F285 HydrophobicContact CB-CZ 4.46Å; L72-F285 HydrophobicContact CD2-CD2 4.34Å; L72-F285 HydrophobicContact CD2-CE2 4.14Å; L72-F285 HydrophobicContact CG-CE2 4.33Å; N216-F285 VanDerWaalsContact CB-O 3.28Å; N216-F285 WeakPolarHBondContact CB-O 3.32Å; N216-F285 PolarHBondContact ND2-O 3.38Å; L217-F285 HydrophobicContact CD2-CB 4.42Å; N281-F285 HydrophobicContact CB-CE2 4.31Å; N281-F285 WeakPolarHBondContact O-CD2 3.39Å; N281-F285 PolarHBondContact O-N 2.99Å; N281-F285 VanDerWaalsContact O-N 3.1Å; I282-F285 PolarHBondContact O-N 3.21Å; A283-F285 PolarHBondContact O-N 3.02Å; F285-V287 PolarHBondContact O-N 3.46Å; F285-L293 HydrophobicContact CD1-CD1 4.35Å; F285-L293 HydrophobicContact CE1-CD1 3.92Å; F285-L293 HydrophobicContact CZ-CD1 4.47Å |
| 286 | T | 86.8 | Confident | 88.8 | Confident | 7 Ų | 7 | 28.4 Ų | 28.4 | 4% | 0.043 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -71.5 | -19.6 | 174.3 | 64 | 0 | 0 | 0 | 0 | 113.5 | M209 L217 I282 A283 Y284 | M209-T286 HydrophobicContact CG-CG2 3.4Å; M209-T286 HydrophobicContact SD-CG2 4.12Å; L217-T286 HydrophobicContact CD1-CG2 4.28Å; I282-T286 HydrophobicContact CG2-CG2 4.44Å; I282-T286 VanDerWaalsContact O-CG2 3.28Å; I282-T286 WeakPolarHBondContact O-CG2 3.36Å; I282-T286 PolarHBondContact O-N 3.04Å; I282-T286 VanDerWaalsContact O-N 3.07Å; A283-T286 PolarHBondContact O-N 3.06Å; A283-T286 PolarHBondContact O-OG1 3.49Å; Y284-T286 VanDerWaalsContact C-N 3.29Å; Y284-T286 PolarHBondContact O-N 3.44Å |
| 287 | V | 86 | Confident | 88.2 | Confident | 25 Ų | 25 | 28.9 Ų | 28.9 | 15% | 0.152 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -112 | -32.5 | -173.5 | 175.7 | 0 | 0 | 0 | 0 | 112.5 | L208 Y284 F285 F303 K306 V307 | L208-V287 HydrophobicContact CD1-CG2 3.45Å; L208-V287 VanDerWaalsContact CD1-CG2 3.45Å; Y284-V287 PolarHBondContact O-N 3.26Å; F285-V287 PolarHBondContact O-N 3.46Å; V287-F303 HydrophobicContact CB-CD2 4.04Å; V287-F303 HydrophobicContact CB-CE2 4.25Å; V287-F303 HydrophobicContact CG1-CD2 4.3Å; V287-F303 HydrophobicContact CG2-CD2 3.87Å; V287-F303 HydrophobicContact CG2-CE2 3.58Å; V287-K306 HydrophobicContact CG1-CB 3.62Å; V287-K306 HydrophobicContact CG1-CD 3.53Å; V287-K306 HydrophobicContact CG1-CG 4.24Å; V287-K306 PolarHBondContact O-NZ 3.03Å; V287-V307 HydrophobicContact CB-CG2 4.39Å; V287-V307 HydrophobicContact CG1-CG2 3.89Å; V287-V307 HydrophobicContact CG2-CG2 3.56Å |
| 288 | M | 86.8 | Confident | 87.8 | Confident | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 17% | 0.173 | C | C | . | . | S | Bend | trans | -121.1 | 146.4 | -175.7 | -61.7 | 179.2 | -154.5 | 0 | 0 | 111.4 | N216 Y284 E292 V299 T302 F303 K306 | N216-M288 PolarHBondContact ND2-O 3Å; Y284-M288 PolarHBondContact O-N 2.82Å; M288-E292 HydrophobicContact CB-CB 4.47Å; M288-E292 HydrophobicContact CB-CG 4.49Å; M288-E292 HydrophobicContact CG-CG 4.5Å; M288-V299 WeakPolarHBondContact CE-O 3.37Å; M288-T302 VanDerWaalsContact CE-CB 3.47Å; M288-T302 HydrophobicContact CE-CG2 3.58Å; M288-T302 HydrophobicContact SD-CG2 3.86Å; M288-F303 HydrophobicContact CE-CB 3.62Å; M288-K306 HydrophobicContact CG-CD 4.5Å |
| 289 | T | 88.2 | Confident | 87.6 | Confident | 51 Ų | 51 | 27.8 Ų | 27.8 | 31% | 0.313 | 17% | 0.166 | S | C | . | . | trans | -75.7 | 158.1 | 167.4 | 60.1 | 0 | 0 | 0 | 0 | 110.3 | S291 E292 L293 | T289-S291 VanDerWaalsContact C-N 3.28Å; T289-S291 PolarHBondContact O-N 2.97Å; T289-S291 PolarHBondContact OG1-OG 3.37Å; T289-E292 PolarHBondContact O-N 3.13Å; T289-E292 VanDerWaalsContact OG1-CB 3.31Å; T289-E292 WeakPolarHBondContact OG1-CB 3.18Å; T289-E292 PolarHBondContact OG1-N 3.48Å; T289-L293 PolarHBondContact O-N 3.46Å | ||
| 290 | P | 85.1 | Confident | 87.4 | Confident | 38 Ų | 38 | 23.7 Ų | 23.7 | 25% | 0.247 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -56 | -40.5 | 177.1 | -28.5 | 36.9 | 0 | 0 | 0 | 113.4 | L62 V68 L293 L294 | L62-P290 HydrophobicContact CD2-CB 4.07Å; V68-P290 HydrophobicContact CG2-CG 3.66Å; P290-L293 PolarHBondContact O-N 2.96Å; P290-L294 VanDerWaalsContact O-CG 3.29Å; P290-L294 WeakPolarHBondContact O-CG 3.46Å; P290-L294 PolarHBondContact O-N 3.42Å |
| 291 | S | 86.3 | Confident | 87.2 | Confident | 86 Ų | 86 | 24.2 Ų | 24.2 | 60% | 0.601 | 15% | 0.151 | S | C | * | . | H | α-helix | trans | -64.8 | -41.4 | 178.1 | 49.8 | 0 | 0 | 0 | 0 | 112.3 | T289 L294 S295 | T289-S291 VanDerWaalsContact C-N 3.28Å; T289-S291 PolarHBondContact O-N 2.97Å; T289-S291 PolarHBondContact OG1-OG 3.37Å; S291-L294 PolarHBondContact O-N 3.01Å; S291-S295 PolarHBondContact O-N 3.03Å |
| 292 | E | 87.9 | Confident | 87 | Confident | 51 Ų | 51 | 25.8 Ų | 25.8 | 24% | 0.238 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65.1 | -43 | 176.5 | -175.6 | 174.6 | -159.9 | 0 | 0 | 111.9 | M288 T289 L294 S295 S296 K306 | M288-E292 HydrophobicContact CB-CB 4.47Å; M288-E292 HydrophobicContact CB-CG 4.49Å; M288-E292 HydrophobicContact CG-CG 4.5Å; T289-E292 PolarHBondContact O-N 3.13Å; T289-E292 VanDerWaalsContact OG1-CB 3.31Å; T289-E292 WeakPolarHBondContact OG1-CB 3.18Å; T289-E292 PolarHBondContact OG1-N 3.48Å; E292-L294 VanDerWaalsContact C-N 3.3Å; E292-L294 PolarHBondContact O-N 3.08Å; E292-S295 WeakPolarHBondContact CA-OG 3.33Å; E292-S295 PolarHBondContact O-N 3.3Å; E292-S295 VanDerWaalsContact O-N 3.13Å; E292-S295 PolarHBondContact O-OG 2.9Å; E292-S296 PolarHBondContact O-N 3.04Å; E292-K306 WeakPolarHBondContact OE1-CE 3.08Å; E292-K306 IonicContact OE1-NZ 2.76Å; E292-K306 PolarHBondContact OE1-NZ 3.31Å; E292-K306 IonicContact OE2-NZ 2.65Å; E292-K306 PolarHBondContact OE2-NZ 2.86Å |
| 293 | L | 88.2 | Confident | 86.9 | Confident | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.2 | -41.1 | 176.2 | -165.2 | 154.3 | 0 | 0 | 0 | 111.5 | K59 L62 F285 T289 P290 S295 S296 V299 | K59-L293 HydrophobicContact CB-CD2 4.22Å; L62-L293 HydrophobicContact CB-CD2 4.48Å; L62-L293 HydrophobicContact CD2-CB 4.11Å; L62-L293 HydrophobicContact CD2-CD1 4.41Å; L62-L293 HydrophobicContact CD2-CD2 3.82Å; L62-L293 HydrophobicContact CD2-CG 4.32Å; F285-L293 HydrophobicContact CD1-CD1 4.35Å; F285-L293 HydrophobicContact CE1-CD1 3.92Å; F285-L293 HydrophobicContact CZ-CD1 4.47Å; T289-L293 PolarHBondContact O-N 3.46Å; P290-L293 PolarHBondContact O-N 2.96Å; L293-S295 VanDerWaalsContact C-N 3.34Å; L293-S296 PolarHBondContact O-N 3.37Å; L293-V299 HydrophobicContact CD1-CG1 4.16Å; L293-V299 HydrophobicContact CD2-CG2 4.1Å; L293-V299 HydrophobicContact CG-CG1 4.02Å; L293-V299 HydrophobicContact CG-CG2 4.21Å |
| 294 | L | 87.4 | Confident | 86.7 | Confident | 60 Ų | 60 | 24.2 Ų | 24.2 | 31% | 0.314 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -68.2 | -31.9 | 176.4 | -68.2 | 175.6 | 0 | 0 | 0 | 113 | K59 L62 L63 P290 S291 E292 | K59-L294 WeakPolarHBondContact CE-O 3.27Å; K59-L294 HydrophobicContact CG-CD2 4.44Å; K59-L294 PolarHBondContact NZ-O 3.45Å; K59-L294 WeakPolarHBondContact O-CD2 3.36Å; L62-L294 HydrophobicContact CB-CD2 4.22Å; L62-L294 HydrophobicContact CD2-CD2 4.18Å; L62-L294 HydrophobicContact CD2-CG 4.07Å; L62-L294 HydrophobicContact CG-CD2 4.2Å; L62-L294 HydrophobicContact CG-CG 4.44Å; L63-L294 HydrophobicContact CB-CD2 3.82Å; L63-L294 HydrophobicContact CD1-CD2 4.27Å; P290-L294 VanDerWaalsContact O-CG 3.29Å; P290-L294 WeakPolarHBondContact O-CG 3.46Å; P290-L294 PolarHBondContact O-N 3.42Å; S291-L294 PolarHBondContact O-N 3.01Å; E292-L294 VanDerWaalsContact C-N 3.3Å; E292-L294 PolarHBondContact O-N 3.08Å |
| 295 | S | 86.7 | Confident | 86.6 | Confident | 91 Ų | 91 | 28.3 Ų | 28.3 | 64% | 0.636 | 17% | 0.174 | S | C | * | . | H | α-helix | trans | -75.6 | -28.3 | 177.7 | 72.6 | 0 | 0 | 0 | 0 | 113.3 | S291 E292 L293 | S291-S295 PolarHBondContact O-N 3.03Å; E292-S295 WeakPolarHBondContact CA-OG 3.33Å; E292-S295 PolarHBondContact O-N 3.3Å; E292-S295 VanDerWaalsContact O-N 3.13Å; E292-S295 PolarHBondContact O-OG 2.9Å; L293-S295 VanDerWaalsContact C-N 3.34Å |
| 296 | S | 85.2 | Confident | 86.5 | Confident | 11 Ų | 11 | 33 Ų | 33 | 8% | 0.077 | 20% | 0.195 | C | C | . | . | trans | -70.8 | 136 | -179 | -178.4 | 0 | 0 | 0 | 0 | 111.8 | K59 E292 L293 A298 T302 | K59-S296 WeakPolarHBondContact CD-O 3.44Å; K59-S296 PolarHBondContact NZ-O 3.27Å; E292-S296 PolarHBondContact O-N 3.04Å; L293-S296 PolarHBondContact O-N 3.37Å; S296-A298 VanDerWaalsContact OG-C 3.27Å; S296-A298 PolarHBondContact OG-N 3.06Å; S296-A298 PolarHBondContact OG-O 2.71Å; S296-T302 PolarHBondContact OG-OG1 3.18Å | ||
| 297 | S | 77.4 | Confident | 86.5 | Confident | 40 Ų | 40 | 34.7 Ų | 34.7 | 28% | 0.28 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -76.8 | -38.2 | 167.5 | 48.8 | 0 | 0 | 0 | 0 | 111.3 | E143 | E143-S297 WeakPolarHBondContact OE1-CB 3.46Š|
| 298 | A | 85.1 | Confident | 86.3 | Confident | 2 Ų | 2 | 35.2 Ų | 35.2 | 2% | 0.017 | 21% | 0.207 | C | C | . | . | trans | -125.4 | 85.1 | -175 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y144 A147 S296 A300 V301 T302 | Y144-A298 HydrophobicContact CD1-CB 4Å; Y144-A298 HydrophobicContact CE1-CB 3.68Å; A147-A298 HydrophobicContact CB-CB 3.85Å; S296-A298 VanDerWaalsContact OG-C 3.27Å; S296-A298 PolarHBondContact OG-N 3.06Å; S296-A298 PolarHBondContact OG-O 2.71Å; A298-A300 VanDerWaalsContact C-N 3.26Å; A298-A300 PolarHBondContact O-N 3.14Å; A298-A300 VanDerWaalsContact O-N 3.16Å; A298-V301 HydrophobicContact CB-CB 4.01Å; A298-V301 HydrophobicContact CB-CG2 3.83Å; A298-V301 PolarHBondContact O-N 3.06Å; A298-T302 PolarHBondContact O-N 3.38Å; A298-T302 VanDerWaalsContact O-N 3.17Å; A298-T302 PolarHBondContact O-OG1 2.66Å | ||
| 299 | V | 87.3 | Confident | 85.9 | Confident | 2 Ų | 2 | 44.7 Ų | 44.7 | 1% | 0.012 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -52.8 | -41.3 | -174.2 | -178 | 0 | 0 | 0 | 0 | 112.6 | K59 Y144 Y284 M288 L293 V301 F303 | K59-V299 HydrophobicContact CB-CG2 4.35Å; Y144-V299 PolarHBondContact OH-N 3.29Å; Y284-V299 HydrophobicContact CD1-CG1 4.11Å; Y284-V299 HydrophobicContact CD2-CG1 3.78Å; Y284-V299 HydrophobicContact CE1-CG1 4.25Å; Y284-V299 HydrophobicContact CE2-CG1 3.92Å; Y284-V299 HydrophobicContact CG-CG1 3.89Å; M288-V299 WeakPolarHBondContact CE-O 3.37Å; L293-V299 HydrophobicContact CD1-CG1 4.16Å; L293-V299 HydrophobicContact CD2-CG2 4.1Å; L293-V299 HydrophobicContact CG-CG1 4.02Å; L293-V299 HydrophobicContact CG-CG2 4.21Å; V299-V301 PolarHBondContact O-N 3.05Å; V299-F303 PolarHBondContact O-N 3.33Å; V299-F303 VanDerWaalsContact O-N 3.15Å |
| 300 | A | 86.9 | Confident | 85.5 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -69.7 | -34.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | F55 Y144 A298 F303 G304 V315 V319 | F55-A300 HydrophobicContact CD1-CB 3.8Å; F55-A300 HydrophobicContact CE1-CB 4.25Å; Y144-A300 HydrophobicContact CE1-CB 3.86Å; Y144-A300 PolarHBondContact OH-N 3.33Å; A298-A300 VanDerWaalsContact C-N 3.26Å; A298-A300 PolarHBondContact O-N 3.14Å; A298-A300 VanDerWaalsContact O-N 3.16Å; A300-F303 WeakPolarHBondContact O-CB 3.39Å; A300-F303 PolarHBondContact O-N 3.43Å; A300-G304 PolarHBondContact O-N 2.94Å; A300-V315 HydrophobicContact CB-CG1 3.86Å; A300-V315 VanDerWaalsContact O-CG1 3.26Å; A300-V315 WeakPolarHBondContact O-CG1 3.19Å; A300-V319 HydrophobicContact CB-CG2 4.09Å |
| 301 | V | 87.1 | Confident | 85.4 | Confident | 12 Ų | 12 | 48.3 Ų | 48.3 | 7% | 0.073 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -67.1 | -47.7 | 178.7 | 179.9 | 0 | 0 | 0 | 0 | 109.7 | Y144 A298 V299 F303 G304 D305 P316 | Y144-V301 HydrophobicContact CD1-CG2 3.78Å; Y144-V301 HydrophobicContact CE1-CG2 3.96Å; A298-V301 HydrophobicContact CB-CB 4.01Å; A298-V301 HydrophobicContact CB-CG2 3.83Å; A298-V301 PolarHBondContact O-N 3.06Å; V299-V301 PolarHBondContact O-N 3.05Å; V301-F303 PolarHBondContact O-N 3.21Å; V301-F303 VanDerWaalsContact O-N 3.16Å; V301-G304 WeakPolarHBondContact O-CA 3.2Å; V301-G304 PolarHBondContact O-N 2.81Å; V301-D305 PolarHBondContact O-N 3.42Å; V301-P316 HydrophobicContact CG2-CB 3.88Å; V301-P316 HydrophobicContact CG2-CG 4.42Å |
| 302 | T | 88.3 | Confident | 85.1 | Confident | 32 Ų | 32 | 44.9 Ų | 44.9 | 20% | 0.196 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.7 | -32.8 | 175.4 | -48.7 | 0 | 0 | 0 | 0 | 111.8 | M288 S296 A298 K306 | M288-T302 VanDerWaalsContact CE-CB 3.47Å; M288-T302 HydrophobicContact CE-CG2 3.58Å; M288-T302 HydrophobicContact SD-CG2 3.86Å; S296-T302 PolarHBondContact OG-OG1 3.18Å; A298-T302 PolarHBondContact O-N 3.38Å; A298-T302 VanDerWaalsContact O-N 3.17Å; A298-T302 PolarHBondContact O-OG1 2.66Å; T302-K306 PolarHBondContact O-N 3.33Å |
| 303 | F | 88.9 | Confident | 84.9 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -69.8 | -44.5 | 175.8 | 175.2 | -87.9 | 0 | 0 | 0 | 110.6 | I201 A204 A283 Y284 V287 M288 V299 A300 V301 D305 K306 V307 | I201-F303 HydrophobicContact CB-CE1 4.29Å; I201-F303 HydrophobicContact CG1-CD1 4.24Å; I201-F303 HydrophobicContact CG1-CE1 4.03Å; I201-F303 HydrophobicContact CG2-CD1 4.5Å; I201-F303 HydrophobicContact CG2-CE1 4.06Å; I201-F303 HydrophobicContact CG2-CZ 4.1Å; A204-F303 HydrophobicContact CB-CE1 4.37Å; A204-F303 HydrophobicContact CB-CZ 4.03Å; A283-F303 HydrophobicContact CB-CE2 4.24Å; Y284-F303 HydrophobicContact CD1-CB 4.02Å; Y284-F303 AromaticContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CG 4.05Å; Y284-F303 HydrophobicContact CE1-CB 3.96Å; Y284-F303 HydrophobicContact CE1-CD2 4.3Å; Y284-F303 HydrophobicContact CE1-CG 4.09Å; V287-F303 HydrophobicContact CB-CD2 4.04Å; V287-F303 HydrophobicContact CB-CE2 4.25Å; V287-F303 HydrophobicContact CG1-CD2 4.3Å; V287-F303 HydrophobicContact CG2-CD2 3.87Å; V287-F303 HydrophobicContact CG2-CE2 3.58Å; M288-F303 HydrophobicContact CE-CB 3.62Å; V299-F303 PolarHBondContact O-N 3.33Å; V299-F303 VanDerWaalsContact O-N 3.15Å; A300-F303 WeakPolarHBondContact O-CB 3.39Å; A300-F303 PolarHBondContact O-N 3.43Å; V301-F303 PolarHBondContact O-N 3.21Å; V301-F303 VanDerWaalsContact O-N 3.16Å; F303-D305 VanDerWaalsContact C-N 3.34Å; F303-D305 PolarHBondContact O-N 3.09Å; F303-K306 PolarHBondContact O-N 3.2Å; F303-V307 HydrophobicContact CD2-CG2 4.24Å; F303-V307 HydrophobicContact CE1-CB 4.35Å; F303-V307 HydrophobicContact CE1-CG2 4.27Å; F303-V307 HydrophobicContact CE2-CG2 3.97Å; F303-V307 HydrophobicContact CZ-CB 4.43Å; F303-V307 HydrophobicContact CZ-CG1 4.5Å; F303-V307 HydrophobicContact CZ-CG2 3.99Å; F303-V307 WeakPolarHBondContact O-CB 3.16Å; F303-V307 WeakPolarHBondContact O-CG2 3.38Å; F303-V307 PolarHBondContact O-N 3.22Å; F303-V307 VanDerWaalsContact O-N 3.09Å |
| 304 | G | 86.5 | Confident | 84.8 | Confident | 0 Ų | 0 | 52.6 Ų | 52.6 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -57.3 | -44.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A300 V301 K306 V307 L308 | A300-G304 PolarHBondContact O-N 2.94Å; V301-G304 WeakPolarHBondContact O-CA 3.2Å; V301-G304 PolarHBondContact O-N 2.81Å; G304-K306 VanDerWaalsContact C-N 3.31Å; G304-K306 PolarHBondContact O-N 3.11Å; G304-V307 PolarHBondContact O-N 2.89Å; G304-L308 WeakPolarHBondContact O-CA 3.44Å; G304-L308 WeakPolarHBondContact O-CB 3.37Å; G304-L308 PolarHBondContact O-N 3.27Å |
| 305 | D | 87.2 | Confident | 84.7 | Confident | 86 Ų | 86 | 49.8 Ų | 49.8 | 46% | 0.46 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.4 | -36.4 | -178.8 | -66.1 | -31.7 | 0 | 0 | 0 | 112.5 | V301 F303 A312 | V301-D305 PolarHBondContact O-N 3.42Å; F303-D305 VanDerWaalsContact C-N 3.34Å; F303-D305 PolarHBondContact O-N 3.09Å; D305-A312 WeakPolarHBondContact OD1-CB 3.43Å |
| 306 | K | 86.6 | Confident | 84.8 | Confident | 99 Ų | 99 | 45.9 Ų | 45.9 | 43% | 0.43 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -82.2 | -31.4 | -178.8 | -73.6 | -174.5 | 169.8 | -159.2 | 0 | 114.8 | V287 M288 E292 T302 F303 G304 | V287-K306 HydrophobicContact CG1-CB 3.62Å; V287-K306 HydrophobicContact CG1-CD 3.53Å; V287-K306 HydrophobicContact CG1-CG 4.24Å; V287-K306 PolarHBondContact O-NZ 3.03Å; M288-K306 HydrophobicContact CG-CD 4.5Å; E292-K306 WeakPolarHBondContact OE1-CE 3.08Å; E292-K306 IonicContact OE1-NZ 2.76Å; E292-K306 PolarHBondContact OE1-NZ 3.31Å; E292-K306 IonicContact OE2-NZ 2.65Å; E292-K306 PolarHBondContact OE2-NZ 2.86Å; T302-K306 PolarHBondContact O-N 3.33Å; F303-K306 PolarHBondContact O-N 3.2Å; G304-K306 VanDerWaalsContact C-N 3.31Å; G304-K306 PolarHBondContact O-N 3.11Å |
| 307 | V | 86.6 | Confident | 84.9 | Confident | 43 Ų | 43 | 48.5 Ų | 48.5 | 26% | 0.261 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -107.1 | -39.9 | -170.1 | -177.6 | 0 | 0 | 0 | 0 | 112.5 | A204 L208 V287 F303 G304 | A204-V307 HydrophobicContact CB-CG1 4.06Å; L208-V307 HydrophobicContact CD1-CG1 4.05Å; L208-V307 HydrophobicContact CD1-CG2 3.82Å; V287-V307 HydrophobicContact CB-CG2 4.39Å; V287-V307 HydrophobicContact CG1-CG2 3.89Å; V287-V307 HydrophobicContact CG2-CG2 3.56Å; F303-V307 HydrophobicContact CD2-CG2 4.24Å; F303-V307 HydrophobicContact CE1-CB 4.35Å; F303-V307 HydrophobicContact CE1-CG2 4.27Å; F303-V307 HydrophobicContact CE2-CG2 3.97Å; F303-V307 HydrophobicContact CZ-CB 4.43Å; F303-V307 HydrophobicContact CZ-CG1 4.5Å; F303-V307 HydrophobicContact CZ-CG2 3.99Å; F303-V307 WeakPolarHBondContact O-CB 3.16Å; F303-V307 WeakPolarHBondContact O-CG2 3.38Å; F303-V307 PolarHBondContact O-N 3.22Å; F303-V307 VanDerWaalsContact O-N 3.09Å; G304-V307 PolarHBondContact O-N 2.89Å |
| 308 | L | 82.4 | Confident | 85.4 | Confident | 36 Ų | 36 | 48.9 Ų | 48.9 | 19% | 0.188 | 24% | 0.241 | C | C | . | . | S | Bend | trans | -105.1 | 23.5 | -167.7 | -62.9 | 175.4 | 0 | 0 | 0 | 112.6 | V200 G304 P310 V311 A312 V315 | V200-L308 HydrophobicContact CG1-CD1 4.04Å; V200-L308 HydrophobicContact CG1-CD2 4.49Å; G304-L308 WeakPolarHBondContact O-CA 3.44Å; G304-L308 WeakPolarHBondContact O-CB 3.37Å; G304-L308 PolarHBondContact O-N 3.27Å; L308-P310 CarbonylContact O-C 3.43Å; L308-V311 HydrophobicContact CB-CG2 4.17Å; L308-V311 CarbonylContact O-C 3.33Å; L308-V311 WeakPolarHBondContact O-CA 3.36Å; L308-V311 VanDerWaalsContact O-CG2 3.28Å; L308-V311 WeakPolarHBondContact O-CG2 3.48Å; L308-V311 PolarHBondContact O-N 3.2Å; L308-A312 PolarHBondContact O-N 2.91Å; L308-V315 HydrophobicContact CD1-CG2 3.82Å |
| 309 | Y | 79.4 | Confident | 85.6 | Confident | 199 Ų | 199 | 48.8 Ų | 48.8 | 78% | 0.78 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | 118.2 | 173.2 | -168.7 | -97.7 | 0 | 0 | 0 | 109.5 | ||
| 310 | P | 79.3 | Confident | 85.6 | Confident | 102 Ų | 102 | 49.1 Ų | 49.1 | 66% | 0.662 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | cis | -108.1 | 7 | 24.7 | 19.9 | -0.5 | 0 | 0 | 0 | 116.8 | L308 | L308-P310 CarbonylContact O-C 3.43Š|
| 311 | V | 81.7 | Confident | 85.6 | Confident | 62 Ų | 62 | 52 Ų | 52 | 38% | 0.376 | 26% | 0.256 | S | S | . | . | trans | -96.2 | 25.9 | -177.3 | -64.2 | 0 | 0 | 0 | 0 | 113.7 | L308 W313 I314 | L308-V311 HydrophobicContact CB-CG2 4.17Å; L308-V311 CarbonylContact O-C 3.33Å; L308-V311 WeakPolarHBondContact O-CA 3.36Å; L308-V311 VanDerWaalsContact O-CG2 3.28Å; L308-V311 WeakPolarHBondContact O-CG2 3.48Å; L308-V311 PolarHBondContact O-N 3.2Å; V311-W313 PolarHBondContact O-N 2.86Å; V311-W313 VanDerWaalsContact O-N 3.12Å; V311-I314 HydrophobicContact CB-CD1 3.82Å; V311-I314 HydrophobicContact CB-CG1 4.27Å; V311-I314 HydrophobicContact CG1-CD1 4.41Å; V311-I314 HydrophobicContact CG2-CD1 4.31Å; V311-I314 VanDerWaalsContact O-CB 3.3Å; V311-I314 WeakPolarHBondContact O-CB 3.42Å; V311-I314 WeakPolarHBondContact O-CG1 3.31Å; V311-I314 PolarHBondContact O-N 3.45Å | ||
| 312 | A | 80.1 | Confident | 85.6 | Confident | 15 Ų | 15 | 51.4 Ų | 51.4 | 12% | 0.124 | 25% | 0.253 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -29.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114 | D305 L308 I314 V315 P316 | D305-A312 WeakPolarHBondContact OD1-CB 3.43Å; L308-A312 PolarHBondContact O-N 2.91Å; A312-I314 PolarHBondContact O-N 3.32Å; A312-I314 VanDerWaalsContact O-N 3.1Å; A312-V315 PolarHBondContact O-N 2.95Å; A312-V315 VanDerWaalsContact O-N 3.12Å; A312-P316 WeakPolarHBondContact O-CD 3.46Å |
| 313 | W | 83.8 | Confident | 85.6 | Confident | 164 Ų | 164 | 49.9 Ų | 49.9 | 62% | 0.621 | 24% | 0.244 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60 | -19.8 | 176.9 | 64.9 | -92.7 | 0 | 0 | 0 | 114.4 | V311 V315 P316 L317 | V311-W313 PolarHBondContact O-N 2.86Å; V311-W313 VanDerWaalsContact O-N 3.12Å; W313-V315 VanDerWaalsContact C-N 3.34Å; W313-P316 WeakPolarHBondContact O-CD 3.43Å; W313-P316 WeakPolarHBondContact O-CG 3.47Å; W313-L317 HydrophobicContact CE3-CD2 4.25Å; W313-L317 HydrophobicContact CZ3-CD2 3.83Å |
| 314 | I | 86.1 | Confident | 85.4 | Confident | 49 Ų | 49 | 51.4 Ų | 51.4 | 25% | 0.251 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 175.9 | -69.8 | -175.2 | 0 | 0 | 0 | 110.3 | V311 A312 L317 F318 | V311-I314 HydrophobicContact CB-CD1 3.82Å; V311-I314 HydrophobicContact CB-CG1 4.27Å; V311-I314 HydrophobicContact CG1-CD1 4.41Å; V311-I314 HydrophobicContact CG2-CD1 4.31Å; V311-I314 VanDerWaalsContact O-CB 3.3Å; V311-I314 WeakPolarHBondContact O-CB 3.42Å; V311-I314 WeakPolarHBondContact O-CG1 3.31Å; V311-I314 PolarHBondContact O-N 3.45Å; A312-I314 PolarHBondContact O-N 3.32Å; A312-I314 VanDerWaalsContact O-N 3.1Å; I314-L317 PolarHBondContact O-N 3.13Å; I314-F318 HydrophobicContact CB-CD2 4.43Å; I314-F318 HydrophobicContact CG2-CD2 3.38Å; I314-F318 HydrophobicContact CG2-CE2 3.55Å; I314-F318 VanDerWaalsContact O-CD2 3.28Å; I314-F318 WeakPolarHBondContact O-CD2 3.45Å; I314-F318 PolarHBondContact O-N 2.98Å |
| 315 | V | 86.5 | Confident | 85.2 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -61 | -55.8 | -174.3 | -173.1 | 0 | 0 | 0 | 0 | 113.2 | I197 A300 L308 A312 W313 L317 F318 V319 | I197-V315 HydrophobicContact CD1-CG1 4.48Å; I197-V315 HydrophobicContact CD1-CG2 4.27Å; A300-V315 HydrophobicContact CB-CG1 3.86Å; A300-V315 VanDerWaalsContact O-CG1 3.26Å; A300-V315 WeakPolarHBondContact O-CG1 3.19Å; L308-V315 HydrophobicContact CD1-CG2 3.82Å; A312-V315 PolarHBondContact O-N 2.95Å; A312-V315 VanDerWaalsContact O-N 3.12Å; W313-V315 VanDerWaalsContact C-N 3.34Å; V315-L317 VanDerWaalsContact C-N 3.25Å; V315-L317 PolarHBondContact O-N 3.24Å; V315-F318 PolarHBondContact O-N 3.19Å; V315-V319 HydrophobicContact CG1-CG2 4.22Å; V315-V319 WeakPolarHBondContact O-CB 3.42Å; V315-V319 VanDerWaalsContact O-CG2 3.25Å; V315-V319 WeakPolarHBondContact O-CG2 3.36Å; V315-V319 PolarHBondContact O-N 3.26Å |
| 316 | P | 87.4 | Confident | 85 | Confident | 10 Ų | 10 | 47.9 Ų | 47.9 | 7% | 0.065 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.4 | -34.8 | 178 | 23 | -32.9 | 0 | 0 | 0 | 112.4 | P148 V301 A312 W313 A320 | P148-P316 HydrophobicContact CG-CB 3.51Å; P148-P316 HydrophobicContact CG-CG 3.54Å; V301-P316 HydrophobicContact CG2-CB 3.88Å; V301-P316 HydrophobicContact CG2-CG 4.42Å; A312-P316 WeakPolarHBondContact O-CD 3.46Å; W313-P316 WeakPolarHBondContact O-CD 3.43Å; W313-P316 WeakPolarHBondContact O-CG 3.47Å; P316-A320 WeakPolarHBondContact O-CB 3.28Å; P316-A320 PolarHBondContact O-N 3.36Å |
| 317 | L | 88.6 | Confident | 84.9 | Confident | 66 Ų | 66 | 43.1 Ų | 43.1 | 35% | 0.346 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.8 | -49.6 | 177.4 | -178.7 | 65.4 | 0 | 0 | 0 | 112.1 | W313 I314 V315 A320 F321 | W313-L317 HydrophobicContact CE3-CD2 4.25Å; W313-L317 HydrophobicContact CZ3-CD2 3.83Å; I314-L317 PolarHBondContact O-N 3.13Å; V315-L317 VanDerWaalsContact C-N 3.25Å; V315-L317 PolarHBondContact O-N 3.24Å; L317-A320 PolarHBondContact O-N 3.41Å; L317-F321 HydrophobicContact CD1-CE1 3.84Å; L317-F321 HydrophobicContact CD1-CE2 4.07Å; L317-F321 HydrophobicContact CD1-CZ 3.56Å; L317-F321 HydrophobicContact CD2-CE2 4.3Å; L317-F321 HydrophobicContact CD2-CZ 4.41Å; L317-F321 HydrophobicContact CG-CD2 4.42Å; L317-F321 HydrophobicContact CG-CE1 4.47Å; L317-F321 HydrophobicContact CG-CE2 3.86Å; L317-F321 HydrophobicContact CG-CZ 3.9Å; L317-F321 WeakPolarHBondContact O-CG 3.25Å; L317-F321 PolarHBondContact O-N 2.91Å |
| 318 | F | 88.6 | Confident | 84.7 | Confident | 47 Ų | 47 | 41.1 Ų | 41.1 | 21% | 0.206 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -70.4 | -33.2 | 179.8 | -84.8 | -87.8 | 0 | 0 | 0 | 112.6 | A193 I197 I314 V315 F321 S322 | A193-F318 HydrophobicContact CB-CD1 3.8Å; A193-F318 HydrophobicContact CB-CE1 3.91Å; A193-F318 WeakPolarHBondContact O-CD1 3.29Å; I197-F318 HydrophobicContact CB-CB 3.76Å; I197-F318 HydrophobicContact CB-CD1 4.49Å; I197-F318 HydrophobicContact CB-CG 4.28Å; I197-F318 HydrophobicContact CD1-CB 4.23Å; I197-F318 HydrophobicContact CG1-CB 3.93Å; I197-F318 HydrophobicContact CG2-CB 4.09Å; I314-F318 HydrophobicContact CB-CD2 4.43Å; I314-F318 HydrophobicContact CG2-CD2 3.38Å; I314-F318 HydrophobicContact CG2-CE2 3.55Å; I314-F318 VanDerWaalsContact O-CD2 3.28Å; I314-F318 WeakPolarHBondContact O-CD2 3.45Å; I314-F318 PolarHBondContact O-N 2.98Å; V315-F318 PolarHBondContact O-N 3.19Å; F318-F321 PolarHBondContact O-N 2.91Å; F318-S322 PolarHBondContact O-N 3.04Å |
| 319 | V | 87.8 | Confident | 84.4 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.2 | -45.3 | 171.9 | 175.8 | 0 | 0 | 0 | 0 | 110.3 | F55 Y144 A300 V315 F321 S322 T323 | F55-V319 HydrophobicContact CB-CG1 4.22Å; F55-V319 HydrophobicContact CD1-CG1 4.39Å; F55-V319 HydrophobicContact CD1-CG2 3.92Å; F55-V319 HydrophobicContact CD2-CG1 3.66Å; F55-V319 HydrophobicContact CD2-CG2 4.29Å; F55-V319 HydrophobicContact CE1-CG2 3.73Å; F55-V319 HydrophobicContact CE2-CB 4.48Å; F55-V319 HydrophobicContact CE2-CG1 4.07Å; F55-V319 HydrophobicContact CE2-CG2 4.13Å; F55-V319 HydrophobicContact CG-CG1 3.83Å; F55-V319 HydrophobicContact CG-CG2 4.19Å; F55-V319 HydrophobicContact CZ-CG2 3.84Å; Y144-V319 HydrophobicContact CD1-CB 3.94Å; Y144-V319 HydrophobicContact CD1-CG1 3.45Å; Y144-V319 VanDerWaalsContact CD1-CG1 3.45Å; Y144-V319 HydrophobicContact CD1-CG2 4.3Å; Y144-V319 HydrophobicContact CD2-CG1 3.87Å; Y144-V319 HydrophobicContact CE1-CB 4.46Å; Y144-V319 HydrophobicContact CE1-CG1 3.89Å; Y144-V319 HydrophobicContact CE1-CG2 4.39Å; Y144-V319 HydrophobicContact CE2-CG1 4.27Å; Y144-V319 HydrophobicContact CG-CB 4.29Å; Y144-V319 HydrophobicContact CG-CG1 3.44Å; Y144-V319 VanDerWaalsContact CG-CG1 3.44Å; A300-V319 HydrophobicContact CB-CG2 4.09Å; V315-V319 HydrophobicContact CG1-CG2 4.22Å; V315-V319 WeakPolarHBondContact O-CB 3.42Å; V315-V319 VanDerWaalsContact O-CG2 3.25Å; V315-V319 WeakPolarHBondContact O-CG2 3.36Å; V315-V319 PolarHBondContact O-N 3.26Å; V319-F321 VanDerWaalsContact C-N 3.3Å; V319-F321 PolarHBondContact O-N 2.94Å; V319-S322 WeakPolarHBondContact O-CA 3.31Å; V319-S322 WeakPolarHBondContact O-CB 3.2Å; V319-S322 PolarHBondContact O-N 3.14Å; V319-T323 HydrophobicContact CG1-CG2 4.34Å; V319-T323 WeakPolarHBondContact O-CG2 3.23Å; V319-T323 PolarHBondContact O-N 3.34Å; V319-T323 PolarHBondContact O-OG1 3.01Å |
| 320 | A | 87.9 | Confident | 84.4 | Confident | 9 Ų | 9 | 30.7 Ų | 30.7 | 7% | 0.074 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.6 | -40.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | F141 P316 L317 T323 F324 | F141-A320 HydrophobicContact CD2-CB 3.88Å; F141-A320 HydrophobicContact CE2-CB 3.78Å; P316-A320 WeakPolarHBondContact O-CB 3.28Å; P316-A320 PolarHBondContact O-N 3.36Å; L317-A320 PolarHBondContact O-N 3.41Å; A320-T323 WeakPolarHBondContact CA-OG1 3.41Å; A320-T323 PolarHBondContact O-N 2.89Å; A320-T323 PolarHBondContact O-OG1 2.73Å; A320-F324 VanDerWaalsContact O-CB 3.32Å; A320-F324 WeakPolarHBondContact O-CB 3.3Å; A320-F324 PolarHBondContact O-N 3.43Å |
| 321 | F | 87.2 | Confident | 84.3 | Confident | 60 Ų | 60 | 25.9 Ų | 25.9 | 26% | 0.263 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -62 | -41.7 | 171.2 | -72.2 | -11.8 | 0 | 0 | 0 | 112.6 | F190 A193 L317 F318 V319 F324 G325 | F190-F321 HydrophobicContact CD1-CB 3.61Å; F190-F321 HydrophobicContact CD1-CD1 4.23Å; F190-F321 AromaticContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CE1-CB 3.89Å; F190-F321 AromaticContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD2 4.48Å; F190-F321 HydrophobicContact CE1-CE1 4.22Å; F190-F321 AromaticContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CZ-CD1 4.44Å; A193-F321 HydrophobicContact CB-CB 4.38Å; A193-F321 HydrophobicContact CB-CD2 4.36Å; L317-F321 HydrophobicContact CD1-CE1 3.84Å; L317-F321 HydrophobicContact CD1-CE2 4.07Å; L317-F321 HydrophobicContact CD1-CZ 3.56Å; L317-F321 HydrophobicContact CD2-CE2 4.3Å; L317-F321 HydrophobicContact CD2-CZ 4.41Å; L317-F321 HydrophobicContact CG-CD2 4.42Å; L317-F321 HydrophobicContact CG-CE1 4.47Å; L317-F321 HydrophobicContact CG-CE2 3.86Å; L317-F321 HydrophobicContact CG-CZ 3.9Å; L317-F321 WeakPolarHBondContact O-CG 3.25Å; L317-F321 PolarHBondContact O-N 2.91Å; F318-F321 PolarHBondContact O-N 2.91Å; V319-F321 VanDerWaalsContact C-N 3.3Å; V319-F321 PolarHBondContact O-N 2.94Å; F321-F324 PolarHBondContact O-N 2.84Å; F321-G325 PolarHBondContact O-N 2.92Å |
| 322 | S | 87.8 | Confident | 83.8 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -63.1 | -45.9 | 176.9 | -173.5 | 0 | 0 | 0 | 0 | 112.3 | K194 F318 V319 G325 S326 | K194-S322 WeakPolarHBondContact CB-OG 3.38Å; F318-S322 PolarHBondContact O-N 3.04Å; V319-S322 WeakPolarHBondContact O-CA 3.31Å; V319-S322 WeakPolarHBondContact O-CB 3.2Å; V319-S322 PolarHBondContact O-N 3.14Å; S322-G325 PolarHBondContact O-N 3.44Å; S322-S326 PolarHBondContact O-N 3.43Å; S322-S326 PolarHBondContact O-OG 3.44Å |
| 323 | T | 87.3 | Confident | 83.5 | Confident | 1 Ų | 1 | 26.9 Ų | 26.9 | 1% | 0.006 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -66.1 | -41.1 | 179 | 56.1 | 0 | 0 | 0 | 0 | 111.1 | S52 I137 F141 V319 A320 S326 A327 | S52-T323 VanDerWaalsContact CB-CG2 3.5Å; I137-T323 WeakPolarHBondContact CG2-O 3.48Å; F141-T323 WeakPolarHBondContact CA-OG1 3.42Å; F141-T323 VanDerWaalsContact CB-OG1 3.28Å; F141-T323 WeakPolarHBondContact CB-OG1 3.21Å; F141-T323 WeakPolarHBondContact CD2-OG1 3.44Å; V319-T323 HydrophobicContact CG1-CG2 4.34Å; V319-T323 WeakPolarHBondContact O-CG2 3.23Å; V319-T323 PolarHBondContact O-N 3.34Å; V319-T323 PolarHBondContact O-OG1 3.01Å; A320-T323 WeakPolarHBondContact CA-OG1 3.41Å; A320-T323 PolarHBondContact O-N 2.89Å; A320-T323 PolarHBondContact O-OG1 2.73Å; T323-S326 PolarHBondContact O-N 3.36Å; T323-A327 WeakPolarHBondContact O-CB 3.38Å; T323-A327 PolarHBondContact O-N 2.92Å |
| 324 | F | 84.4 | Confident | 83.1 | Confident | 31 Ų | 31 | 19.2 Ų | 19.2 | 14% | 0.136 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -63 | -44.8 | 175.9 | -167.5 | -75.5 | 0 | 0 | 0 | 111.9 | V170 I171 V175 V186 F190 A320 F321 S326 A327 N328 | V170-F324 HydrophobicContact CG1-CE2 4.49Å; I171-F324 HydrophobicContact CB-CZ 4.42Å; I171-F324 HydrophobicContact CD1-CD2 3.84Å; I171-F324 HydrophobicContact CD1-CE2 3.88Å; I171-F324 HydrophobicContact CD1-CG 4.23Å; I171-F324 HydrophobicContact CD1-CZ 4.31Å; I171-F324 HydrophobicContact CG1-CD1 4.25Å; I171-F324 HydrophobicContact CG1-CD2 3.77Å; I171-F324 HydrophobicContact CG1-CE1 3.84Å; I171-F324 HydrophobicContact CG1-CE2 3.29Å; I171-F324 HydrophobicContact CG1-CG 4.24Å; I171-F324 HydrophobicContact CG1-CZ 3.35Å; V175-F324 HydrophobicContact CG2-CE1 4.5Å; V175-F324 HydrophobicContact CG2-CZ 4.36Å; V186-F324 HydrophobicContact CG1-CE1 4.41Å; F190-F324 AromaticContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CE2-CB 4.41Å; F190-F324 AromaticContact CE2-CD1 3.2Å; F190-F324 HydrophobicContact CE2-CD1 3.2Å; F190-F324 AromaticContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CG 4.08Å; F190-F324 AromaticContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CE1 4.28Å; F190-F324 HydrophobicContact CZ-CG 4.36Å; A320-F324 VanDerWaalsContact O-CB 3.32Å; A320-F324 WeakPolarHBondContact O-CB 3.3Å; A320-F324 PolarHBondContact O-N 3.43Å; F321-F324 PolarHBondContact O-N 2.84Å; F324-S326 VanDerWaalsContact C-N 3.3Å; F324-S326 PolarHBondContact O-N 3.27Å; F324-A327 PolarHBondContact O-N 3.4Å; F324-N328 WeakPolarHBondContact O-CB 3.21Å; F324-N328 PolarHBondContact O-N 3.06Å |
| 325 | G | 82.1 | Confident | 82.5 | Confident | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.1 | -34.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | Q187 F321 S322 G329 | Q187-G325 VanDerWaalsContact CD-O 3.3Å; Q187-G325 PolarHBondContact NE2-O 3.43Å; Q187-G325 PolarHBondContact OE1-O 2.88Å; F321-G325 PolarHBondContact O-N 2.92Å; S322-G325 PolarHBondContact O-N 3.44Å; G325-G329 PolarHBondContact O-N 2.94Å |
| 326 | S | 83.6 | Confident | 81.9 | Confident | 12 Ų | 12 | 19.7 Ų | 19.7 | 8% | 0.084 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -70.6 | -40 | 177.7 | -51.7 | 0 | 0 | 0 | 0 | 111.6 | G51 K194 S322 T323 F324 G329 S330 | G51-S326 WeakPolarHBondContact CA-OG 3.43Å; K194-S326 PolarHBondContact NZ-OG 3.47Å; S322-S326 PolarHBondContact O-N 3.43Å; S322-S326 PolarHBondContact O-OG 3.44Å; T323-S326 PolarHBondContact O-N 3.36Å; F324-S326 VanDerWaalsContact C-N 3.3Å; F324-S326 PolarHBondContact O-N 3.27Å; S326-G329 PolarHBondContact O-N 3.03Å; S326-S330 PolarHBondContact O-N 3.22Å |
| 327 | A | 84.4 | Confident | 81.4 | Confident | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -62.5 | -45 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | F134 I137 T138 I171 T323 F324 G329 S330 C331 | F134-A327 HydrophobicContact CD2-CB 4.03Å; F134-A327 HydrophobicContact CE2-CB 3.62Å; F134-A327 WeakPolarHBondContact CE2-O 3.49Å; I137-A327 HydrophobicContact CB-CB 4.5Å; I137-A327 HydrophobicContact CG2-CB 3.8Å; T138-A327 HydrophobicContact CG2-CB 4.29Å; I171-A327 HydrophobicContact CD1-CB 3.67Å; T323-A327 WeakPolarHBondContact O-CB 3.38Å; T323-A327 PolarHBondContact O-N 2.92Å; F324-A327 PolarHBondContact O-N 3.4Å; A327-G329 PolarHBondContact O-N 2.8Å; A327-S330 WeakPolarHBondContact O-CB 3.28Å; A327-S330 PolarHBondContact O-N 2.97Å; A327-C331 PolarHBondContact O-N 3.5Å; A327-C331 PolarHBondContact O-SG 2.66Å |
| 328 | N | 82.7 | Confident | 81 | Confident | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -60 | -44.1 | 174.7 | -176.2 | 69.2 | 0 | 0 | 0 | 112.4 | I171 N176 A183 Q187 F324 S330 C331 F332 | I171-N328 HydrophobicContact CG2-CB 4.43Å; N176-N328 PolarHBondContact ND2-OD1 2.9Å; N176-N328 PolarHBondContact OD1-OD1 2.92Å; A183-N328 PolarHBondContact O-ND2 2.89Å; Q187-N328 PolarHBondContact OE1-ND2 3.04Å; F324-N328 WeakPolarHBondContact O-CB 3.21Å; F324-N328 PolarHBondContact O-N 3.06Å; N328-S330 VanDerWaalsContact C-N 3.33Å; N328-S330 PolarHBondContact O-N 3.36Å; N328-C331 WeakPolarHBondContact O-CB 3.17Å; N328-C331 PolarHBondContact O-N 3.27Å; N328-F332 WeakPolarHBondContact O-CD2 3.42Å |
| 329 | G | 76.2 | Confident | 80.3 | Confident | 9 Ų | 9 | 16.7 Ų | 16.7 | 9% | 0.093 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -58.7 | -41.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | G325 S326 A327 C331 F332 | G325-G329 PolarHBondContact O-N 2.94Å; S326-G329 PolarHBondContact O-N 3.03Å; A327-G329 PolarHBondContact O-N 2.8Å; G329-C331 VanDerWaalsContact C-N 3.32Å; G329-C331 PolarHBondContact O-N 3.4Å; G329-F332 PolarHBondContact O-N 2.92Å |
| 330 | S | 78.9 | Confident | 79.6 | Confident | 8 Ų | 8 | 16.7 Ų | 16.7 | 6% | 0.056 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -62.2 | -38 | 178.2 | -168.5 | 0 | 0 | 0 | 0 | 112.4 | S326 A327 N328 F332 T333 A334 | S326-S330 PolarHBondContact O-N 3.22Å; A327-S330 WeakPolarHBondContact O-CB 3.28Å; A327-S330 PolarHBondContact O-N 2.97Å; N328-S330 VanDerWaalsContact C-N 3.33Å; N328-S330 PolarHBondContact O-N 3.36Å; S330-F332 PolarHBondContact O-N 3.49Å; S330-T333 PolarHBondContact O-N 2.96Å; S330-T333 PolarHBondContact O-OG1 3.22Å; S330-A334 PolarHBondContact O-N 2.98Å |
| 331 | C | 78.1 | Confident | 79.1 | Confident | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.007 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -58.9 | -41.5 | 176.8 | -69.2 | 0 | 0 | 0 | 0 | 113.2 | F134 A327 N328 G329 T333 A334 G335 L365 | F134-C331 VanDerWaalsContact CE2-SG 3.51Å; A327-C331 PolarHBondContact O-N 3.5Å; A327-C331 PolarHBondContact O-SG 2.66Å; N328-C331 WeakPolarHBondContact O-CB 3.17Å; N328-C331 PolarHBondContact O-N 3.27Å; G329-C331 VanDerWaalsContact C-N 3.32Å; G329-C331 PolarHBondContact O-N 3.4Å; C331-T333 VanDerWaalsContact C-N 3.33Å; C331-T333 PolarHBondContact O-N 2.96Å; C331-A334 PolarHBondContact O-N 3.42Å; C331-G335 PolarHBondContact O-N 3.16Å; C331-L365 HydrophobicContact CB-CD2 3.87Å; C331-L365 WeakPolarHBondContact O-CD2 3.16Å |
| 332 | F | 71.3 | Confident | 78.6 | Confident | 81 Ų | 81 | 13.5 Ų | 13.5 | 36% | 0.355 | 7% | 0.066 | S | C | . | . | H | α-helix | trans | -58.7 | -44.9 | 177.3 | -77.3 | -73.4 | 0 | 0 | 0 | 111.9 | V180 A183 N328 G329 S330 R336 | V180-F332 HydrophobicContact CG1-CE1 4.1Å; A183-F332 HydrophobicContact CB-CE1 4.24Å; A183-F332 HydrophobicContact CB-CE2 3.86Å; A183-F332 HydrophobicContact CB-CZ 3.34Å; N328-F332 WeakPolarHBondContact O-CD2 3.42Å; G329-F332 PolarHBondContact O-N 2.92Å; S330-F332 PolarHBondContact O-N 3.49Å; F332-R336 PolarHBondContact O-N 3.46Å |
| 333 | T | 72.4 | Confident | 77.9 | Confident | 16 Ų | 16 | 20 Ų | 20 | 10% | 0.098 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -72.3 | -35.2 | -178.7 | 66.5 | 0 | 0 | 0 | 0 | 113.2 | K130 Q247 S330 C331 G335 R336 L337 | K130-T333 PolarHBondContact NZ-OG1 2.56Å; Q247-T333 HydrophobicContact CG-CG2 4.22Å; S330-T333 PolarHBondContact O-N 2.96Å; S330-T333 PolarHBondContact O-OG1 3.22Å; C331-T333 VanDerWaalsContact C-N 3.33Å; C331-T333 PolarHBondContact O-N 2.96Å; T333-G335 VanDerWaalsContact C-N 3.35Å; T333-G335 PolarHBondContact O-N 3.32Å; T333-R336 PolarHBondContact O-N 3.49Å; T333-L337 PolarHBondContact O-N 2.89Å |
| 334 | A | 76.8 | Confident | 77.4 | Confident | 4 Ų | 4 | 24.8 Ų | 24.8 | 3% | 0.033 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -62.8 | -40.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | K130 S330 C331 S338 | K130-A334 HydrophobicContact CB-CB 4.23Å; K130-A334 HydrophobicContact CD-CB 4.3Å; K130-A334 HydrophobicContact CG-CB 4.25Å; S330-A334 PolarHBondContact O-N 2.98Å; C331-A334 PolarHBondContact O-N 3.42Å; A334-S338 PolarHBondContact O-N 3.05Å; A334-S338 PolarHBondContact O-OG 2.9Å |
| 335 | G | 73.3 | Confident | 77 | Confident | 2 Ų | 2 | 25 Ų | 25 | 2% | 0.021 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -62.9 | -42.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | C331 T333 S338 Y339 | C331-G335 PolarHBondContact O-N 3.16Å; T333-G335 VanDerWaalsContact C-N 3.35Å; T333-G335 PolarHBondContact O-N 3.32Å; G335-S338 PolarHBondContact O-N 3.23Å; G335-Y339 WeakPolarHBondContact O-CB 3.34Å; G335-Y339 PolarHBondContact O-N 3.11Å |
| 336 | R | 73.7 | Confident | 76.8 | Confident | 56 Ų | 56 | 26 Ų | 26 | 21% | 0.211 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -66.4 | -42.6 | -177.2 | -167.5 | 69.9 | -175.4 | -162.2 | 2.1 | 113 | L32 S102 E253 F332 T333 Y339 V340 | L32-R336 VanDerWaalsContact CD1-NH1 3.32Å; S102-R336 PolarHBondContact OG-NE 3.27Å; S102-R336 PolarHBondContact OG-NH2 3.47Å; E253-R336 IonicContact OE2-NH2 2.71Å; E253-R336 PolarHBondContact OE2-NH2 3.49Å; F332-R336 PolarHBondContact O-N 3.46Å; T333-R336 PolarHBondContact O-N 3.49Å; R336-Y339 WeakPolarHBondContact O-CB 3.34Å; R336-Y339 PolarHBondContact O-N 3.36Å; R336-V340 WeakPolarHBondContact O-CG2 3.37Å; R336-V340 PolarHBondContact O-N 3.08Å; R336-V340 VanDerWaalsContact O-N 3.13Å |
| 337 | L | 77.4 | Confident | 76.6 | Confident | 1 Ų | 1 | 26.6 Ų | 26.6 | 1% | 0.005 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -65.4 | -43.8 | 177.8 | -180 | 65.2 | 0 | 0 | 0 | 111.6 | Y121 T125 V126 F250 T333 Y339 V340 A341 | Y121-L337 HydrophobicContact CE1-CD1 4.19Å; Y121-L337 HydrophobicContact CE1-CD2 4.47Å; T125-L337 HydrophobicContact CG2-CD2 3.15Å; V126-L337 HydrophobicContact CG2-CD2 4.27Å; F250-L337 HydrophobicContact CE1-CD1 4.45Å; T333-L337 PolarHBondContact O-N 2.89Å; L337-Y339 PolarHBondContact O-N 3.37Å; L337-V340 PolarHBondContact O-N 3.38Å; L337-A341 WeakPolarHBondContact O-CB 3.49Å; L337-A341 PolarHBondContact O-N 3.33Å |
| 338 | S | 79.1 | Confident | 76.4 | Confident | 7 Ų | 7 | 29.2 Ų | 29.2 | 5% | 0.049 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.7 | -37.4 | 177.7 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | A334 G335 G342 | A334-S338 PolarHBondContact O-N 3.05Å; A334-S338 PolarHBondContact O-OG 2.9Å; G335-S338 PolarHBondContact O-N 3.23Å; S338-G342 PolarHBondContact O-N 3.49Å |
| 339 | Y | 74.1 | Confident | 76.3 | Confident | 52 Ų | 52 | 35.6 Ų | 35.6 | 20% | 0.204 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.7 | -52 | 174.8 | 178 | -90.4 | 0 | 0 | 0 | 112.6 | G335 R336 L337 G342 R343 S352 I354 P492 | G335-Y339 WeakPolarHBondContact O-CB 3.34Å; G335-Y339 PolarHBondContact O-N 3.11Å; R336-Y339 WeakPolarHBondContact O-CB 3.34Å; R336-Y339 PolarHBondContact O-N 3.36Å; L337-Y339 PolarHBondContact O-N 3.37Å; Y339-G342 PolarHBondContact O-N 2.96Å; Y339-R343 PolarHBondContact O-N 2.89Å; Y339-S352 WeakPolarHBondContact CD2-O 3.38Å; Y339-I354 HydrophobicContact CE2-CD1 4.21Å; Y339-P492 HydrophobicContact CE2-CB 3.71Å; Y339-P492 HydrophobicContact CE2-CG 3.5Å; Y339-P492 VanDerWaalsContact CE2-CG 3.5Å |
| 340 | V | 74.1 | Confident | 76.5 | Confident | 1 Ų | 1 | 35.8 Ų | 35.8 | 1% | 0.006 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.6 | -46.1 | -179.1 | 175.7 | 0 | 0 | 0 | 0 | 111.2 | S102 Y106 R336 L337 G342 R343 E344 | S102-V340 WeakPolarHBondContact O-CG1 3.4Å; S102-V340 WeakPolarHBondContact OG-CG2 3.34Å; Y106-V340 HydrophobicContact CD1-CG1 3.86Å; Y106-V340 HydrophobicContact CE1-CG1 4.04Å; R336-V340 WeakPolarHBondContact O-CG2 3.37Å; R336-V340 PolarHBondContact O-N 3.08Å; R336-V340 VanDerWaalsContact O-N 3.13Å; L337-V340 PolarHBondContact O-N 3.38Å; V340-G342 VanDerWaalsContact C-N 3.28Å; V340-G342 PolarHBondContact O-N 2.88Å; V340-R343 WeakPolarHBondContact O-CB 3.41Å; V340-R343 PolarHBondContact O-N 3.03Å; V340-R343 VanDerWaalsContact O-N 3.17Å; V340-E344 PolarHBondContact O-N 3.37Å |
| 341 | A | 77.3 | Confident | 76.6 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.3 | -33.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L337 G345 H346 M347 | L337-A341 WeakPolarHBondContact O-CB 3.49Å; L337-A341 PolarHBondContact O-N 3.33Å; A341-G345 PolarHBondContact O-N 3.36Å; A341-H346 PolarHBondContact O-N 3.45Å; A341-H346 VanDerWaalsContact O-N 3.07Å; A341-M347 HydrophobicContact CB-CB 3.83Å; A341-M347 PolarHBondContact O-N 3.49Å; A341-M347 VanDerWaalsContact O-N 3.08Å |
| 342 | G | 76.4 | Confident | 76.6 | Confident | 2 Ų | 2 | 36.3 Ų | 36.3 | 2% | 0.021 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -68.5 | -36.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S338 Y339 V340 G345 | S338-G342 PolarHBondContact O-N 3.49Å; Y339-G342 PolarHBondContact O-N 2.96Å; V340-G342 VanDerWaalsContact C-N 3.28Å; V340-G342 PolarHBondContact O-N 2.88Å; G342-G345 PolarHBondContact O-N 2.92Å |
| 343 | R | 73.5 | Confident | 77.1 | Confident | 137 Ų | 137 | 33.9 Ų | 33.9 | 52% | 0.517 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -64 | -43.6 | 177.7 | -171.5 | 176.7 | 69.9 | -172.8 | -0.7 | 112.3 | Y339 V340 G345 | Y339-R343 PolarHBondContact O-N 2.89Å; V340-R343 WeakPolarHBondContact O-CB 3.41Å; V340-R343 PolarHBondContact O-N 3.03Å; V340-R343 VanDerWaalsContact O-N 3.17Å; R343-G345 PolarHBondContact O-N 3.28Å |
| 344 | E | 75.6 | Confident | 77.5 | Confident | 100 Ų | 100 | 35.3 Ų | 35.3 | 47% | 0.467 | 17% | 0.171 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76.6 | -0.8 | 177.9 | -60.8 | -59.7 | 148.8 | 0 | 0 | 113.1 | Y106 V340 H346 | Y106-E344 HydrophobicContact CE1-CB 4.41Å; Y106-E344 HydrophobicContact CE1-CG 3.91Å; Y106-E344 VanDerWaalsContact OH-CB 3.25Å; Y106-E344 WeakPolarHBondContact OH-CB 3.49Å; V340-E344 PolarHBondContact O-N 3.37Å; E344-H346 VanDerWaalsContact C-N 3.26Å; E344-H346 PolarHBondContact O-CD2 3.49Å; E344-H346 PolarHBondContact O-N 2.92Å |
| 345 | G | 75.3 | Confident | 77.7 | Confident | 37 Ų | 37 | 35.6 Ų | 35.6 | 38% | 0.381 | 17% | 0.172 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 74.4 | 13.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | A341 G342 R343 | A341-G345 PolarHBondContact O-N 3.36Å; G342-G345 PolarHBondContact O-N 2.92Å; R343-G345 PolarHBondContact O-N 3.28Å |
| 346 | H | 78.8 | Confident | 77.8 | Confident | 19 Ų | 19 | 40.2 Ų | 40.2 | 9% | 0.088 | 20% | 0.196 | C | C | . | . | S | Bend | trans | -86.1 | -16.4 | 175.7 | -74.6 | -71.3 | 0 | 0 | 0 | 112.9 | Y106 M110 Y119 A341 E344 | Y106-H346 PolarHBondContact OH-CD2 2.88Å; M110-H346 WeakPolarHBondContact CE-NE2 3.48Å; Y119-H346 HydrophobicContact CD2-CB 3.98Å; Y119-H346 AromaticContact CD2-ND1 3.8Å; Y119-H346 VanDerWaalsContact CD2-O 3.31Å; Y119-H346 WeakPolarHBondContact CD2-O 3.26Å; Y119-H346 WeakPolarHBondContact CE2-O 3.5Å; A341-H346 PolarHBondContact O-N 3.45Å; A341-H346 VanDerWaalsContact O-N 3.07Å; E344-H346 VanDerWaalsContact C-N 3.26Å; E344-H346 PolarHBondContact O-CD2 3.49Å; E344-H346 PolarHBondContact O-N 2.92Å |
| 347 | M | 79.7 | Confident | 77.9 | Confident | 26 Ų | 26 | 44.6 Ų | 44.6 | 13% | 0.128 | 22% | 0.217 | C | C | . | . | S | Bend | trans | -124.4 | 164.1 | 175.2 | -166.8 | 56.5 | 72.2 | 0 | 0 | 111 | V126 A341 K349 L351 | V126-M347 HydrophobicContact CB-CE 3.92Å; V126-M347 HydrophobicContact CG1-CE 4.07Å; V126-M347 HydrophobicContact CG2-CE 3.99Å; A341-M347 HydrophobicContact CB-CB 3.83Å; A341-M347 PolarHBondContact O-N 3.49Å; A341-M347 VanDerWaalsContact O-N 3.08Å; M347-K349 PolarHBondContact O-N 3.25Å; M347-L351 HydrophobicContact CG-CD1 3.8Å; M347-L351 HydrophobicContact SD-CD1 4.09Å |
| 348 | V | 80.3 | Confident | 77.6 | Confident | 55 Ų | 55 | 50.1 Ų | 50.1 | 33% | 0.333 | 24% | 0.238 | S | C | . | . | trans | -59.5 | 121.8 | 174.4 | -173.7 | 0 | 0 | 0 | 0 | 109.7 | I350 L351 M476 | V348-I350 HydrophobicContact CG1-CB 4.41Å; V348-I350 HydrophobicContact CG1-CG2 3.74Å; V348-I350 PolarHBondContact O-N 2.98Å; V348-L351 WeakPolarHBondContact O-CB 3.41Å; V348-L351 PolarHBondContact O-N 3.24Å; V348-M476 HydrophobicContact CB-CE 4.17Å; V348-M476 HydrophobicContact CG1-CE 3.25Å; V348-M476 HydrophobicContact CG2-CE 3.78Å | ||
| 349 | K | 79.3 | Confident | 77.3 | Confident | 133 Ų | 133 | 57.5 Ų | 57.5 | 58% | 0.578 | 27% | 0.269 | S | S | * | . | G | 310 helix | trans | -54.6 | -27.9 | -175.5 | -67.2 | -173.6 | 176.8 | -172.7 | 0 | 114.4 | M347 L351 S352 Y353 | M347-K349 PolarHBondContact O-N 3.25Å; K349-L351 PolarHBondContact O-N 3.04Å; K349-S352 PolarHBondContact O-N 3.4Å; K349-S352 VanDerWaalsContact O-N 3.09Å; K349-S352 PolarHBondContact O-OG 3.4Å; K349-Y353 HydrophobicContact CB-CE1 4.37Å; K349-Y353 WeakPolarHBondContact O-CD1 3.41Å; K349-Y353 WeakPolarHBondContact O-CE1 3.39Å |
| 350 | I | 81 | Confident | 77.3 | Confident | 13 Ų | 13 | 55.1 Ų | 55.1 | 7% | 0.067 | 26% | 0.26 | C | S | . | . | G | 310 helix | trans | -63.9 | -30 | 179.1 | -158.8 | 173.2 | 0 | 0 | 0 | 113 | V348 S352 Y353 P363 T480 L483 M487 | V348-I350 HydrophobicContact CG1-CB 4.41Å; V348-I350 HydrophobicContact CG1-CG2 3.74Å; V348-I350 PolarHBondContact O-N 2.98Å; I350-S352 PolarHBondContact O-N 3.38Å; I350-Y353 HydrophobicContact CG1-CD2 4.07Å; I350-Y353 HydrophobicContact CG1-CE2 4.49Å; I350-Y353 HydrophobicContact CG1-CG 4.42Å; I350-Y353 WeakPolarHBondContact O-CB 3.21Å; I350-Y353 PolarHBondContact O-N 3.36Å; I350-P363 HydrophobicContact CG1-CB 4.47Å; I350-P363 HydrophobicContact CG1-CG 4.49Å; I350-P363 WeakPolarHBondContact O-CB 3.38Å; I350-T480 HydrophobicContact CB-CG2 4.23Å; I350-T480 HydrophobicContact CD1-CG2 4.44Å; I350-T480 HydrophobicContact CG1-CG2 4.41Å; I350-L483 HydrophobicContact CD1-CB 3.1Å; I350-L483 HydrophobicContact CD1-CD1 3.64Å; I350-L483 HydrophobicContact CD1-CG 4.02Å; I350-M487 HydrophobicContact CD1-CE 4.16Å |
| 351 | L | 80.8 | Confident | 77.5 | Confident | 12 Ų | 12 | 56.9 Ų | 56.9 | 6% | 0.063 | 27% | 0.272 | C | S | . | . | G | 310 helix | trans | -68.9 | -16.8 | 178.1 | -61.4 | 179.2 | 0 | 0 | 0 | 111.9 | M347 V348 K349 P363 A364 F367 | M347-L351 HydrophobicContact CG-CD1 3.8Å; M347-L351 HydrophobicContact SD-CD1 4.09Å; V348-L351 WeakPolarHBondContact O-CB 3.41Å; V348-L351 PolarHBondContact O-N 3.24Å; K349-L351 PolarHBondContact O-N 3.04Å; L351-P363 HydrophobicContact CD2-CB 4.49Å; L351-A364 WeakPolarHBondContact O-CB 3.42Å; L351-F367 HydrophobicContact CD1-CD1 4.19Å; L351-F367 HydrophobicContact CD1-CE1 4.41Å; L351-F367 HydrophobicContact CD2-CB 3.78Å; L351-F367 HydrophobicContact CD2-CD1 4.36Å; L351-F367 HydrophobicContact CD2-CG 3.98Å |
| 352 | S | 78.3 | Confident | 77.6 | Confident | 9 Ų | 9 | 58.3 Ų | 58.3 | 6% | 0.063 | 28% | 0.279 | C | S | . | . | G | 310 helix | trans | -93.8 | 3.8 | 172.9 | 69.9 | 0 | 0 | 0 | 0 | 113.8 | Y339 K349 I350 P492 | Y339-S352 WeakPolarHBondContact CD2-O 3.38Å; K349-S352 PolarHBondContact O-N 3.4Å; K349-S352 VanDerWaalsContact O-N 3.09Å; K349-S352 PolarHBondContact O-OG 3.4Å; I350-S352 PolarHBondContact O-N 3.38Å; S352-P492 WeakPolarHBondContact O-CD 3.37Å |
| 353 | Y | 82.7 | Confident | 78 | Confident | 30 Ų | 30 | 58.6 Ų | 58.6 | 12% | 0.118 | 28% | 0.281 | C | S | . | . | trans | -80.3 | 151.9 | -179.5 | -71.9 | 9.8 | 0 | 0 | 0 | 111.7 | K349 I350 T480 Q484 V489 V490 P491 | K349-Y353 HydrophobicContact CB-CE1 4.37Å; K349-Y353 WeakPolarHBondContact O-CD1 3.41Å; K349-Y353 WeakPolarHBondContact O-CE1 3.39Å; I350-Y353 HydrophobicContact CG1-CD2 4.07Å; I350-Y353 HydrophobicContact CG1-CE2 4.49Å; I350-Y353 HydrophobicContact CG1-CG 4.42Å; I350-Y353 WeakPolarHBondContact O-CB 3.21Å; I350-Y353 PolarHBondContact O-N 3.36Å; Y353-T480 HydrophobicContact CE2-CG2 4.07Å; Y353-Q484 HydrophobicContact CD2-CG 4.19Å; Y353-Q484 HydrophobicContact CE2-CB 4.41Å; Y353-Q484 HydrophobicContact CE2-CG 4Å; Y353-V489 HydrophobicContact CD2-CB 4.48Å; Y353-V489 HydrophobicContact CD2-CG2 3.88Å; Y353-V489 HydrophobicContact CG-CG2 4.47Å; Y353-V490 WeakPolarHBondContact CA-O 3.49Å; Y353-V490 WeakPolarHBondContact CB-O 3.25Å; Y353-P491 HydrophobicContact CD1-CB 4.16Å; Y353-P491 HydrophobicContact CE1-CB 3.78Å | ||
| 354 | I | 80.6 | Confident | 78.5 | Confident | 45 Ų | 45 | 52.2 Ų | 52.2 | 23% | 0.231 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 140.1 | -175.6 | -57.6 | 177.7 | 0 | 0 | 0 | 108.9 | Y339 F359 V489 V490 P492 | Y339-I354 HydrophobicContact CE2-CD1 4.21Å; I354-F359 VanDerWaalsContact CG2-C 3.4Å; I354-F359 HydrophobicContact CG2-CB 4.4Å; I354-V489 CarbonylContact O-C 3.57Å; I354-V489 WeakPolarHBondContact O-CA 3.34Å; I354-V490 PolarHBondContact N-O 3.06Å; I354-V490 PolarHBondContact O-N 3.39Å; I354-P492 HydrophobicContact CD1-CB 4.11Å |
| 355 | S | 80.4 | Confident | 78.8 | Confident | 10 Ų | 10 | 47.7 Ų | 47.7 | 7% | 0.07 | 24% | 0.236 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 132.8 | 176.3 | 179.8 | 0 | 0 | 0 | 0 | 111.7 | K357 F359 T360 | S355-K357 PolarHBondContact O-N 2.74Å; S355-F359 WeakPolarHBondContact O-CA 3.46Å; S355-F359 PolarHBondContact O-N 3.25Å; S355-T360 PolarHBondContact N-O 3.49Å |
| 356 | L | 76.1 | Confident | 79.3 | Confident | 100 Ų | 100 | 48.7 Ų | 48.7 | 52% | 0.524 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63 | -41.3 | -179.1 | -78.8 | 169.8 | 0 | 0 | 0 | 113.5 | E488 V490 | L356-E488 PolarHBondContact N-O 3.32Å; L356-E488 VanDerWaalsContact N-O 3.16Å; L356-V490 HydrophobicContact CD1-CG1 3.73Å; L356-V490 HydrophobicContact CD2-CB 4.25Å; L356-V490 HydrophobicContact CD2-CG1 3.77Å; L356-V490 HydrophobicContact CD2-CG2 3.47Å; L356-V490 VanDerWaalsContact CD2-CG2 3.47Å; L356-V490 HydrophobicContact CG-CB 4.39Å; L356-V490 HydrophobicContact CG-CG1 3.7Å; L356-V490 HydrophobicContact CG-CG2 3.84Å |
| 357 | K | 74.9 | Confident | 79.7 | Confident | 148 Ų | 148 | 50.8 Ų | 50.8 | 64% | 0.643 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -28.4 | -174.3 | -73.3 | 175 | 177.6 | 151.6 | 0 | 113 | S355 E488 | S355-K357 PolarHBondContact O-N 2.74Å; K357-E488 WeakPolarHBondContact CD-OE2 3.29Å; K357-E488 WeakPolarHBondContact CE-OE2 3.34Å; K357-E488 VanDerWaalsContact NZ-CD 3.31Å; K357-E488 IonicContact NZ-OE1 2.65Å; K357-E488 PolarHBondContact NZ-OE1 3.31Å; K357-E488 IonicContact NZ-OE2 3.06Å; K357-E488 PolarHBondContact NZ-OE2 2.9Å |
| 358 | R | 70.5 | Confident | 80.1 | Confident | 116 Ų | 116 | 49.9 Ų | 49.9 | 44% | 0.438 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -127.5 | -8.2 | -164.5 | -61.6 | 179.8 | -178.4 | 178.6 | 1.1 | 114.6 | C177 L178 T360 | C177-R358 WeakPolarHBondContact O-CD 3.3Å; C177-R358 PolarHBondContact O-NH1 3.38Å; L178-R358 WeakPolarHBondContact O-CD 3.34Å; R358-T360 HydrophobicContact CB-CG2 4.37Å; R358-T360 PolarHBondContact O-N 2.98Å |
| 359 | F | 74.1 | Confident | 80.4 | Confident | 163 Ų | 163 | 47.5 Ų | 47.5 | 72% | 0.715 | 22% | 0.223 | S | C | * | . | trans | 54.9 | 31.7 | -178.2 | -57.3 | -81.4 | 0 | 0 | 0 | 114 | I354 S355 | I354-F359 VanDerWaalsContact CG2-C 3.4Å; I354-F359 HydrophobicContact CG2-CB 4.4Å; S355-F359 WeakPolarHBondContact O-CA 3.46Å; S355-F359 PolarHBondContact O-N 3.25Å | ||
| 360 | T | 73.7 | Confident | 80.9 | Confident | 2 Ų | 2 | 45.7 Ų | 45.7 | 1% | 0.012 | 22% | 0.219 | C | C | . | . | trans | -107.2 | 145.8 | 179.5 | 51.4 | 0 | 0 | 0 | 0 | 111.5 | N176 V180 S355 R358 L362 | N176-T360 VanDerWaalsContact O-CG2 3.26Å; N176-T360 WeakPolarHBondContact O-CG2 3.35Å; V180-T360 HydrophobicContact CG2-CG2 3.54Å; S355-T360 PolarHBondContact N-O 3.49Å; R358-T360 HydrophobicContact CB-CG2 4.37Å; R358-T360 PolarHBondContact O-N 2.98Å; T360-L362 PolarHBondContact O-N 3.49Å | ||
| 361 | P | 77.8 | Confident | 81.3 | Confident | 38 Ų | 38 | 46.4 Ų | 46.4 | 25% | 0.247 | 22% | 0.223 | C | C | . | . | trans | -78.6 | 65.1 | 176.3 | 33.3 | -35.5 | 0 | 0 | 0 | 111.4 | A364 L365 | P361-A364 PolarHBondContact O-N 2.95Å; P361-L365 HydrophobicContact CG-CD1 4.37Å; P361-L365 HydrophobicContact CG-CG 4.4Å; P361-L365 WeakPolarHBondContact O-CG 3.44Å; P361-L365 PolarHBondContact O-N 3.07Å | ||
| 362 | L | 80.5 | Confident | 81.6 | Confident | 30 Ų | 30 | 45.8 Ų | 45.8 | 16% | 0.157 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -53.2 | -46.9 | -173.6 | 178.5 | 64.8 | 0 | 0 | 0 | 114 | C177 T360 A364 L365 L366 M487 V489 | C177-L362 HydrophobicContact CB-CD1 3.84Å; C177-L362 WeakPolarHBondContact SG-CD1 3.37Å; T360-L362 PolarHBondContact O-N 3.49Å; L362-A364 PolarHBondContact O-N 3.42Å; L362-L365 PolarHBondContact O-N 3.42Å; L362-L366 HydrophobicContact CD1-CD1 3.87Å; L362-L366 HydrophobicContact CD1-CD2 4.48Å; L362-L366 HydrophobicContact CD1-CG 3.95Å; L362-L366 HydrophobicContact CG-CD1 3.97Å; L362-L366 HydrophobicContact CG-CG 4.4Å; L362-L366 WeakPolarHBondContact O-CG 3.48Å; L362-L366 PolarHBondContact O-N 3.34Å; L362-M487 HydrophobicContact CD2-CB 4.01Å; L362-M487 HydrophobicContact CD2-CG 4.23Å; L362-M487 HydrophobicContact CD2-SD 4.42Å; L362-M487 HydrophobicContact CG-SD 4.37Å; L362-V489 HydrophobicContact CB-CG1 4.4Å |
| 363 | P | 84.6 | Confident | 82.2 | Confident | 8 Ų | 8 | 48.3 Ų | 48.3 | 5% | 0.052 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -65.5 | -38.9 | -176.4 | -22 | 35.5 | 0 | 0 | 0 | 113.1 | I350 L351 F367 M487 V489 | I350-P363 HydrophobicContact CG1-CB 4.47Å; I350-P363 HydrophobicContact CG1-CG 4.49Å; I350-P363 WeakPolarHBondContact O-CB 3.38Å; L351-P363 HydrophobicContact CD2-CB 4.49Å; P363-F367 VanDerWaalsContact O-CB 3.25Å; P363-F367 WeakPolarHBondContact O-CB 3.37Å; P363-F367 PolarHBondContact O-N 3.48Å; P363-M487 HydrophobicContact CB-CE 4Å; P363-M487 HydrophobicContact CB-SD 4.33Å; P363-M487 HydrophobicContact CG-CE 3.85Å; P363-M487 HydrophobicContact CG-SD 4.09Å; P363-V489 HydrophobicContact CG-CB 4.42Å; P363-V489 HydrophobicContact CG-CG1 3.94Å; P363-V489 HydrophobicContact CG-CG2 4.13Å |
| 364 | A | 82.8 | Confident | 82.5 | Confident | 2 Ų | 2 | 53.2 Ų | 53.2 | 2% | 0.017 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.9 | -41.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L351 P361 L362 F367 N368 | L351-A364 WeakPolarHBondContact O-CB 3.42Å; P361-A364 PolarHBondContact O-N 2.95Å; L362-A364 PolarHBondContact O-N 3.42Å; A364-F367 PolarHBondContact O-N 3.27Å; A364-N368 WeakPolarHBondContact O-CB 3.12Å; A364-N368 PolarHBondContact O-N 3.39Å |
| 365 | L | 82.9 | Confident | 82.8 | Confident | 6 Ų | 6 | 53.1 Ų | 53.1 | 3% | 0.031 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.4 | -46.8 | 178.4 | -68.3 | 173.2 | 0 | 0 | 0 | 111.4 | I172 N176 C331 P361 L362 F367 N368 G369 | I172-L365 HydrophobicContact CG2-CB 4.24Å; N176-L365 HydrophobicContact CB-CD1 3.95Å; C331-L365 HydrophobicContact CB-CD2 3.87Å; C331-L365 WeakPolarHBondContact O-CD2 3.16Å; P361-L365 HydrophobicContact CG-CD1 4.37Å; P361-L365 HydrophobicContact CG-CG 4.4Å; P361-L365 WeakPolarHBondContact O-CG 3.44Å; P361-L365 PolarHBondContact O-N 3.07Å; L362-L365 PolarHBondContact O-N 3.42Å; L365-F367 VanDerWaalsContact C-N 3.34Å; L365-F367 PolarHBondContact O-N 2.91Å; L365-N368 PolarHBondContact O-N 3.42Å; L365-G369 PolarHBondContact O-N 3.01Å |
| 366 | L | 86.4 | Confident | 83.1 | Confident | 57 Ų | 57 | 52.9 Ų | 52.9 | 30% | 0.298 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62.1 | -42.5 | 176.5 | -69.8 | 177.2 | 0 | 0 | 0 | 111.7 | I172 L362 G369 I370 M487 | I172-L366 HydrophobicContact CG2-CD2 4.3Å; L362-L366 HydrophobicContact CD1-CD1 3.87Å; L362-L366 HydrophobicContact CD1-CD2 4.48Å; L362-L366 HydrophobicContact CD1-CG 3.95Å; L362-L366 HydrophobicContact CG-CD1 3.97Å; L362-L366 HydrophobicContact CG-CG 4.4Å; L362-L366 WeakPolarHBondContact O-CG 3.48Å; L362-L366 PolarHBondContact O-N 3.34Å; L366-G369 PolarHBondContact O-N 2.96Å; L366-I370 VanDerWaalsContact O-CG1 3.28Å; L366-I370 WeakPolarHBondContact O-CG1 3.11Å; L366-I370 PolarHBondContact O-N 2.96Å; L366-M487 HydrophobicContact CD1-SD 3.86Å |
| 367 | F | 87.4 | Confident | 83.4 | Confident | 64 Ų | 64 | 53.3 Ų | 53.3 | 28% | 0.281 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.3 | -48 | 177.4 | -174.4 | -106.1 | 0 | 0 | 0 | 112.1 | V126 M127 L351 P363 A364 L365 G369 I370 L371 | V126-F367 HydrophobicContact CG1-CD1 4.15Å; V126-F367 HydrophobicContact CG1-CE1 3.81Å; M127-F367 HydrophobicContact CE-CZ 4.33Å; M127-F367 HydrophobicContact SD-CE1 3.71Å; M127-F367 HydrophobicContact SD-CZ 3.51Å; M127-F367 VanDerWaalsContact SD-CZ 3.51Å; L351-F367 HydrophobicContact CD1-CD1 4.19Å; L351-F367 HydrophobicContact CD1-CE1 4.41Å; L351-F367 HydrophobicContact CD2-CB 3.78Å; L351-F367 HydrophobicContact CD2-CD1 4.36Å; L351-F367 HydrophobicContact CD2-CG 3.98Å; P363-F367 VanDerWaalsContact O-CB 3.25Å; P363-F367 WeakPolarHBondContact O-CB 3.37Å; P363-F367 PolarHBondContact O-N 3.48Å; A364-F367 PolarHBondContact O-N 3.27Å; L365-F367 VanDerWaalsContact C-N 3.34Å; L365-F367 PolarHBondContact O-N 2.91Å; F367-G369 VanDerWaalsContact C-N 3.32Å; F367-G369 PolarHBondContact O-N 2.98Å; F367-I370 PolarHBondContact O-N 2.96Å; F367-L371 HydrophobicContact CD1-CD1 3.95Å; F367-L371 HydrophobicContact CE1-CD1 3.4Å; F367-L371 VanDerWaalsContact CE1-CD1 3.4Å; F367-L371 HydrophobicContact CE1-CG 4.3Å; F367-L371 HydrophobicContact CE2-CD1 4.42Å; F367-L371 HydrophobicContact CZ-CD1 3.68Å; F367-L371 HydrophobicContact CZ-CG 4.28Å; F367-L371 WeakPolarHBondContact O-CG 3.23Å; F367-L371 PolarHBondContact O-N 3.29Å |
| 368 | N | 87 | Confident | 83.7 | Confident | 6 Ų | 6 | 51.3 Ų | 51.3 | 3% | 0.032 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62 | -39.5 | 176.5 | -172.3 | 65.6 | 0 | 0 | 0 | 112.1 | P131 A364 L365 A372 | P131-N368 WeakPolarHBondContact CD-OD1 3.28Å; P131-N368 WeakPolarHBondContact CG-OD1 3.25Å; A364-N368 WeakPolarHBondContact O-CB 3.12Å; A364-N368 PolarHBondContact O-N 3.39Å; L365-N368 PolarHBondContact O-N 3.42Å; N368-A372 VanDerWaalsContact O-CB 3.3Å; N368-A372 WeakPolarHBondContact O-CB 3.3Å; N368-A372 PolarHBondContact O-N 2.95Å |
| 369 | G | 86.9 | Confident | 83.6 | Confident | 5 Ų | 5 | 46.4 Ų | 46.4 | 5% | 0.052 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.9 | -46.8 | 177 | 0 | 0 | 0 | 0 | 0 | 113.7 | L365 L366 F367 L371 A372 I373 | L365-G369 PolarHBondContact O-N 3.01Å; L366-G369 PolarHBondContact O-N 2.96Å; F367-G369 VanDerWaalsContact C-N 3.32Å; F367-G369 PolarHBondContact O-N 2.98Å; G369-L371 VanDerWaalsContact C-N 3.35Å; G369-L371 PolarHBondContact O-N 3.41Å; G369-A372 PolarHBondContact O-N 3.47Å; G369-I373 WeakPolarHBondContact O-CG1 3.32Å; G369-I373 PolarHBondContact O-N 2.91Å |
| 370 | I | 89.1 | Confident | 84 | Confident | 95 Ų | 95 | 42.7 Ų | 42.7 | 49% | 0.487 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -60.1 | -47.4 | 177.2 | -69.9 | 165.3 | 0 | 0 | 0 | 110 | L366 F367 A372 I373 F374 | L366-I370 VanDerWaalsContact O-CG1 3.28Å; L366-I370 WeakPolarHBondContact O-CG1 3.11Å; L366-I370 PolarHBondContact O-N 2.96Å; F367-I370 PolarHBondContact O-N 2.96Å; I370-A372 VanDerWaalsContact C-N 3.35Å; I370-A372 PolarHBondContact O-N 2.96Å; I370-I373 PolarHBondContact O-N 2.96Å; I370-F374 HydrophobicContact CG2-CD2 3.91Å; I370-F374 HydrophobicContact CG2-CE2 3.55Å; I370-F374 WeakPolarHBondContact O-CD2 3.46Å; I370-F374 PolarHBondContact O-N 2.96Å; I370-F374 VanDerWaalsContact O-N 3.12Å |
| 371 | L | 89.6 | Confident | 84.4 | Confident | 28 Ų | 28 | 43.4 Ų | 43.4 | 15% | 0.147 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.6 | -42.8 | 176.9 | -70.9 | -178.1 | 0 | 0 | 0 | 112 | M127 P131 F367 G369 I373 F374 Y375 | M127-L371 HydrophobicContact SD-CD1 3.85Å; P131-L371 HydrophobicContact CB-CB 3.65Å; P131-L371 HydrophobicContact CG-CB 3.65Å; P131-L371 HydrophobicContact CG-CD1 3.78Å; P131-L371 HydrophobicContact CG-CG 4.4Å; F367-L371 HydrophobicContact CD1-CD1 3.95Å; F367-L371 HydrophobicContact CE1-CD1 3.4Å; F367-L371 VanDerWaalsContact CE1-CD1 3.4Å; F367-L371 HydrophobicContact CE1-CG 4.3Å; F367-L371 HydrophobicContact CE2-CD1 4.42Å; F367-L371 HydrophobicContact CZ-CD1 3.68Å; F367-L371 HydrophobicContact CZ-CG 4.28Å; F367-L371 WeakPolarHBondContact O-CG 3.23Å; F367-L371 PolarHBondContact O-N 3.29Å; G369-L371 VanDerWaalsContact C-N 3.35Å; G369-L371 PolarHBondContact O-N 3.41Å; L371-I373 VanDerWaalsContact C-N 3.31Å; L371-I373 PolarHBondContact O-N 3.42Å; L371-F374 WeakPolarHBondContact O-CB 3.34Å; L371-F374 PolarHBondContact O-N 3.47Å; L371-F374 VanDerWaalsContact O-N 3.09Å; L371-Y375 WeakPolarHBondContact O-CD2 3.17Å; L371-Y375 PolarHBondContact O-N 3.45Å |
| 372 | A | 88.6 | Confident | 84.7 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63 | -37.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | P131 F134 I168 N368 G369 I370 F374 Y375 I376 | P131-A372 HydrophobicContact CB-CB 4.41Å; F134-A372 HydrophobicContact CB-CB 4.28Å; F134-A372 HydrophobicContact CD1-CB 3.64Å; F134-A372 HydrophobicContact CG-CB 4.45Å; I168-A372 HydrophobicContact CD1-CB 3.67Å; N368-A372 VanDerWaalsContact O-CB 3.3Å; N368-A372 WeakPolarHBondContact O-CB 3.3Å; N368-A372 PolarHBondContact O-N 2.95Å; G369-A372 PolarHBondContact O-N 3.47Å; I370-A372 VanDerWaalsContact C-N 3.35Å; I370-A372 PolarHBondContact O-N 2.96Å; A372-F374 VanDerWaalsContact C-N 3.33Å; A372-F374 PolarHBondContact O-N 3.39Å; A372-Y375 PolarHBondContact O-N 2.82Å; A372-I376 WeakPolarHBondContact O-CG1 3.33Å; A372-I376 PolarHBondContact O-N 3.49Å |
| 373 | I | 88.9 | Confident | 85 | Confident | 61 Ų | 61 | 44.8 Ų | 44.8 | 31% | 0.313 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.7 | -41.9 | 172.2 | -67.5 | 166.1 | 0 | 0 | 0 | 110.8 | I168 G369 I370 L371 Y375 I376 | I168-I373 HydrophobicContact CD1-CG1 4.5Å; I168-I373 HydrophobicContact CG2-CD1 4.24Å; I168-I373 HydrophobicContact CG2-CG1 4.03Å; G369-I373 WeakPolarHBondContact O-CG1 3.32Å; G369-I373 PolarHBondContact O-N 2.91Å; I370-I373 PolarHBondContact O-N 2.96Å; L371-I373 VanDerWaalsContact C-N 3.31Å; L371-I373 PolarHBondContact O-N 3.42Å; I373-Y375 VanDerWaalsContact C-N 3.31Å; I373-Y375 PolarHBondContact O-N 3.06Å; I373-I376 PolarHBondContact O-N 3.17Å |
| 374 | F | 89.4 | Confident | 85.1 | Confident | 133 Ų | 133 | 44.9 Ų | 44.9 | 58% | 0.583 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -61.5 | -38.6 | 174.8 | -78 | -64.5 | 0 | 0 | 0 | 112.6 | I370 L371 A372 I377 P378 | I370-F374 HydrophobicContact CG2-CD2 3.91Å; I370-F374 HydrophobicContact CG2-CE2 3.55Å; I370-F374 WeakPolarHBondContact O-CD2 3.46Å; I370-F374 PolarHBondContact O-N 2.96Å; I370-F374 VanDerWaalsContact O-N 3.12Å; L371-F374 WeakPolarHBondContact O-CB 3.34Å; L371-F374 PolarHBondContact O-N 3.47Å; L371-F374 VanDerWaalsContact O-N 3.09Å; A372-F374 VanDerWaalsContact C-N 3.33Å; A372-F374 PolarHBondContact O-N 3.39Å; F374-I377 HydrophobicContact CD1-CD1 4.45Å; F374-I377 PolarHBondContact O-N 2.85Å; F374-P378 WeakPolarHBondContact O-CD 3.41Å |
| 375 | Y | 86.9 | Confident | 85.3 | Confident | 43 Ų | 43 | 44.8 Ų | 44.8 | 17% | 0.169 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -67.8 | -31.5 | 175.8 | -80 | -74.8 | 0 | 0 | 0 | 113 | M127 P131 L371 A372 I373 I377 P378 A379 L384 Y387 | M127-Y375 WeakPolarHBondContact O-CE2 3.42Å; M127-Y375 PolarHBondContact O-OH 3.33Å; P131-Y375 HydrophobicContact CB-CD2 3.71Å; P131-Y375 HydrophobicContact CB-CE2 3.76Å; P131-Y375 HydrophobicContact CG-CE2 4.49Å; L371-Y375 WeakPolarHBondContact O-CD2 3.17Å; L371-Y375 PolarHBondContact O-N 3.45Å; A372-Y375 PolarHBondContact O-N 2.82Å; I373-Y375 VanDerWaalsContact C-N 3.31Å; I373-Y375 PolarHBondContact O-N 3.06Å; Y375-I377 VanDerWaalsContact C-N 3.31Å; Y375-I377 PolarHBondContact O-N 2.8Å; Y375-P378 WeakPolarHBondContact O-CD 3.32Å; Y375-A379 WeakPolarHBondContact O-CB 3.5Å; Y375-A379 PolarHBondContact O-N 3.09Å; Y375-L384 HydrophobicContact CD1-CD1 3.98Å; Y375-Y387 HydrophobicContact CE1-CE1 4.01Å |
| 376 | I | 86.9 | Confident | 85.5 | Confident | 5 Ų | 5 | 44.6 Ų | 44.6 | 3% | 0.026 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.4 | -32.6 | 178.8 | -72.5 | 169.4 | 0 | 0 | 0 | 112.6 | A135 L139 K161 I168 A372 I373 A379 | A135-I376 HydrophobicContact CB-CG1 3.93Å; L139-I376 HydrophobicContact CD2-CG2 4.22Å; L139-I376 HydrophobicContact CG-CG1 4.35Å; K161-I376 HydrophobicContact CB-CG2 3.85Å; K161-I376 WeakPolarHBondContact CE-O 3.4Å; K161-I376 HydrophobicContact CG-CG2 3.83Å; I168-I376 HydrophobicContact CD1-CD1 3.37Å; I168-I376 HydrophobicContact CD1-CG1 4.5Å; I168-I376 HydrophobicContact CG1-CD1 4.35Å; A372-I376 WeakPolarHBondContact O-CG1 3.33Å; A372-I376 PolarHBondContact O-N 3.49Å; I373-I376 PolarHBondContact O-N 3.17Å; I376-A379 PolarHBondContact O-N 3.19Å |
| 377 | I | 82.9 | Confident | 85.5 | Confident | 110 Ų | 110 | 43 Ų | 43 | 56% | 0.564 | 22% | 0.224 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -61 | -55.3 | -173.9 | -62.2 | 167.1 | 0 | 0 | 0 | 111.9 | K161 F374 Y375 | K161-I377 PolarHBondContact NZ-O 2.97Å; F374-I377 HydrophobicContact CD1-CD1 4.45Å; F374-I377 PolarHBondContact O-N 2.85Å; Y375-I377 VanDerWaalsContact C-N 3.31Å; Y375-I377 PolarHBondContact O-N 2.8Å |
| 378 | P | 79.9 | Confident | 85.6 | Confident | 105 Ų | 105 | 40.1 Ų | 40.1 | 68% | 0.682 | 21% | 0.212 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -13.2 | 177.9 | 34.7 | -37.4 | 0 | 0 | 0 | 113.8 | F374 Y375 | F374-P378 WeakPolarHBondContact O-CD 3.41Å; Y375-P378 WeakPolarHBondContact O-CD 3.32Å |
| 379 | A | 68.6 | Low | 85.7 | Confident | 14 Ų | 14 | 40 Ų | 40 | 12% | 0.116 | 21% | 0.211 | C | C | . | . | trans | -71.4 | 136.1 | -164.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | L139 Y375 I376 L384 | L139-A379 HydrophobicContact CD1-CB 4.1Å; Y375-A379 WeakPolarHBondContact O-CB 3.5Å; Y375-A379 PolarHBondContact O-N 3.09Å; I376-A379 PolarHBondContact O-N 3.19Å; A379-L384 HydrophobicContact CB-CB 4.44Å; A379-L384 HydrophobicContact CB-CD2 3.89Å | ||
| 380 | D | 83.2 | Confident | 85.8 | Confident | 84 Ų | 84 | 40.2 Ų | 40.2 | 45% | 0.449 | 21% | 0.21 | S | C | . | . | trans | -102.1 | 141.1 | 147.2 | 171.8 | 43.5 | 0 | 0 | 0 | 108.7 | N382 T383 L384 | D380-N382 VanDerWaalsContact C-N 3.33Å; D380-N382 PolarHBondContact O-N 3.24Å; D380-T383 HydrophobicContact CB-CG2 4.2Å; D380-T383 PolarHBondContact O-N 3.08Å; D380-T383 PolarHBondContact O-OG1 3.27Å; D380-L384 WeakPolarHBondContact O-CB 3.06Å; D380-L384 PolarHBondContact O-N 2.92Å | ||
| 381 | I | 82.9 | Confident | 85.9 | Confident | 17 Ų | 17 | 35.7 Ų | 35.7 | 9% | 0.087 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -58.2 | -45.4 | -172 | -66.6 | 174.8 | 0 | 0 | 0 | 110.9 | I56 I136 L139 E143 L384 I385 | I56-I381 HydrophobicContact CD1-CD1 4.42Å; I56-I381 HydrophobicContact CD1-CG2 4.41Å; I56-I381 HydrophobicContact CG2-CG2 4.01Å; I136-I381 HydrophobicContact CG2-CG2 4.27Å; L139-I381 HydrophobicContact CB-CD1 3.96Å; L139-I381 HydrophobicContact CB-CG1 3.89Å; L139-I381 HydrophobicContact CD1-CG1 4.11Å; E143-I381 WeakPolarHBondContact OE2-CD1 3.36Å; I381-L384 PolarHBondContact O-N 3.1Å; I381-I385 HydrophobicContact CG2-CD1 3.78Å; I381-I385 HydrophobicContact CG2-CG1 4.44Å; I381-I385 VanDerWaalsContact O-CG1 3.31Å; I381-I385 WeakPolarHBondContact O-CG1 3.29Å; I381-I385 PolarHBondContact O-N 3.25Å |
| 382 | N | 83.9 | Confident | 85.8 | Confident | 43 Ų | 43 | 35 Ų | 35 | 23% | 0.23 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -66.2 | -45.7 | -177.6 | -69.1 | -47.5 | 0 | 0 | 0 | 111.8 | S60 D380 L384 I385 N386 | S60-N382 PolarHBondContact OG-OD1 3.15Å; D380-N382 VanDerWaalsContact C-N 3.33Å; D380-N382 PolarHBondContact O-N 3.24Å; N382-L384 VanDerWaalsContact C-N 3.26Å; N382-L384 PolarHBondContact O-N 3.08Å; N382-I385 PolarHBondContact O-N 3.49Å; N382-N386 VanDerWaalsContact O-CG 3.3Å; N382-N386 PolarHBondContact O-N 3.47Å |
| 383 | T | 85.8 | Confident | 85.8 | Confident | 55 Ų | 55 | 36 Ų | 36 | 34% | 0.337 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -61.6 | -36.9 | 176.7 | 64.7 | 0 | 0 | 0 | 0 | 112 | D380 N386 Y387 | D380-T383 HydrophobicContact CB-CG2 4.2Å; D380-T383 PolarHBondContact O-N 3.08Å; D380-T383 PolarHBondContact O-OG1 3.27Å; T383-N386 PolarHBondContact O-N 2.94Å; T383-Y387 WeakPolarHBondContact O-CB 3.24Å; T383-Y387 PolarHBondContact O-N 3.27Å |
| 384 | L | 86.6 | Confident | 85.9 | Confident | 10 Ų | 10 | 34.9 Ų | 34.9 | 5% | 0.052 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -72.6 | -36.2 | 179 | -164.3 | 62.1 | 0 | 0 | 0 | 111.8 | A135 I136 Y375 A379 D380 I381 N382 Y387 F388 | A135-L384 HydrophobicContact CB-CD2 3.9Å; I136-L384 HydrophobicContact CD1-CB 4.36Å; I136-L384 HydrophobicContact CD1-CD2 4.39Å; I136-L384 HydrophobicContact CD1-CG 4.03Å; I136-L384 HydrophobicContact CG1-CB 4.01Å; I136-L384 HydrophobicContact CG1-CD2 3.56Å; I136-L384 HydrophobicContact CG1-CG 3.69Å; Y375-L384 HydrophobicContact CD1-CD1 3.98Å; A379-L384 HydrophobicContact CB-CB 4.44Å; A379-L384 HydrophobicContact CB-CD2 3.89Å; D380-L384 WeakPolarHBondContact O-CB 3.06Å; D380-L384 PolarHBondContact O-N 2.92Å; I381-L384 PolarHBondContact O-N 3.1Å; N382-L384 VanDerWaalsContact C-N 3.26Å; N382-L384 PolarHBondContact O-N 3.08Å; L384-Y387 HydrophobicContact CD1-CD1 4.32Å; L384-Y387 PolarHBondContact O-N 2.68Å; L384-F388 VanDerWaalsContact O-CB 3.28Å; L384-F388 WeakPolarHBondContact O-CB 3.49Å; L384-F388 PolarHBondContact O-N 3.41Å |
| 385 | I | 88 | Confident | 85.9 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62.5 | -44.9 | 171 | -71.6 | 167.9 | 0 | 0 | 0 | 110.5 | I56 I136 W240 I381 N382 F388 S389 | I56-I385 HydrophobicContact CG2-CD1 4.48Å; I136-I385 HydrophobicContact CD1-CG1 3.84Å; I136-I385 HydrophobicContact CG1-CG1 4.31Å; I136-I385 HydrophobicContact CG2-CD1 4.26Å; I136-I385 HydrophobicContact CG2-CG1 3.98Å; W240-I385 HydrophobicContact CB-CG2 3.9Å; W240-I385 HydrophobicContact CD2-CG1 4.26Å; W240-I385 HydrophobicContact CG-CD1 4.24Å; W240-I385 HydrophobicContact CG-CG1 4.17Å; W240-I385 HydrophobicContact CG-CG2 4.17Å; I381-I385 HydrophobicContact CG2-CD1 3.78Å; I381-I385 HydrophobicContact CG2-CG1 4.44Å; I381-I385 VanDerWaalsContact O-CG1 3.31Å; I381-I385 WeakPolarHBondContact O-CG1 3.29Å; I381-I385 PolarHBondContact O-N 3.25Å; N382-I385 PolarHBondContact O-N 3.49Å; I385-F388 PolarHBondContact O-N 2.76Å; I385-S389 WeakPolarHBondContact O-CB 3.41Å; I385-S389 PolarHBondContact O-N 3.11Å; I385-S389 PolarHBondContact O-OG 2.98Å |
| 386 | N | 86.6 | Confident | 85.9 | Confident | 1 Ų | 1 | 27.4 Ų | 27.4 | 1% | 0.005 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.5 | -45.9 | 176.9 | -69 | -12.4 | 0 | 0 | 0 | 111.1 | N382 T383 S389 F390 Y447 | N382-N386 VanDerWaalsContact O-CG 3.3Å; N382-N386 PolarHBondContact O-N 3.47Å; T383-N386 PolarHBondContact O-N 2.94Å; N386-S389 PolarHBondContact O-N 3.34Å; N386-F390 WeakPolarHBondContact O-CB 3.15Å; N386-F390 PolarHBondContact O-N 3.2Å; N386-Y447 HydrophobicContact CB-CE1 4.28Å |
| 387 | Y | 86.8 | Confident | 85.9 | Confident | 23 Ų | 23 | 27.5 Ų | 27.5 | 9% | 0.09 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.5 | -47.7 | 176.9 | -179.2 | -104.6 | 0 | 0 | 0 | 112.5 | V128 Y375 T383 L384 A391 A446 C450 | V128-Y387 HydrophobicContact CB-CE1 4.32Å; V128-Y387 HydrophobicContact CG1-CD1 4.04Å; V128-Y387 HydrophobicContact CG1-CE1 3.3Å; V128-Y387 HydrophobicContact CG2-CE1 4.28Å; V128-Y387 WeakPolarHBondContact CG2-OH 3.42Å; Y375-Y387 HydrophobicContact CE1-CE1 4.01Å; T383-Y387 WeakPolarHBondContact O-CB 3.24Å; T383-Y387 PolarHBondContact O-N 3.27Å; L384-Y387 HydrophobicContact CD1-CD1 4.32Å; L384-Y387 PolarHBondContact O-N 2.68Å; Y387-A391 PolarHBondContact O-N 2.95Å; Y387-A446 HydrophobicContact CD2-CB 4.28Å; Y387-A446 WeakPolarHBondContact CD2-O 3.41Å; Y387-C450 HydrophobicContact CD2-CB 3.73Å; Y387-C450 VanDerWaalsContact CE2-CA 3.46Å; Y387-C450 HydrophobicContact CE2-CB 3.35Å |
| 388 | F | 89.3 | Confident | 86.3 | Confident | 5 Ų | 5 | 24.5 Ų | 24.5 | 2% | 0.022 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62.5 | -49.7 | 176.6 | 169.8 | -92.8 | 0 | 0 | 0 | 111.5 | L129 I136 W240 L384 I385 F390 A391 Q392 | L129-F388 HydrophobicContact CB-CD2 4.26Å; L129-F388 HydrophobicContact CB-CE2 3.98Å; L129-F388 HydrophobicContact CD2-CD2 3.7Å; L129-F388 HydrophobicContact CD2-CE2 3.85Å; L129-F388 HydrophobicContact CD2-CG 4.4Å; L129-F388 WeakPolarHBondContact O-CE2 3.35Å; I136-F388 HydrophobicContact CD1-CB 4.25Å; W240-F388 AromaticContact CE3-CD1 3.65Å; W240-F388 HydrophobicContact CE3-CD1 3.65Å; W240-F388 AromaticContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CG 4.49Å; W240-F388 HydrophobicContact CE3-CZ 4.37Å; W240-F388 AromaticContact CZ3-CD1 3.77Å; W240-F388 HydrophobicContact CZ3-CD1 3.77Å; W240-F388 AromaticContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE2 4.42Å; W240-F388 HydrophobicContact CZ3-CG 4.25Å; W240-F388 AromaticContact CZ3-CZ 3.96Å; W240-F388 HydrophobicContact CZ3-CZ 3.96Å; L384-F388 VanDerWaalsContact O-CB 3.28Å; L384-F388 WeakPolarHBondContact O-CB 3.49Å; L384-F388 PolarHBondContact O-N 3.41Å; I385-F388 PolarHBondContact O-N 2.76Å; F388-F390 VanDerWaalsContact C-N 3.32Å; F388-F390 PolarHBondContact O-N 2.92Å; F388-A391 PolarHBondContact O-N 3.32Å; F388-Q392 HydrophobicContact CE1-CB 4.32Å; F388-Q392 HydrophobicContact CE1-CG 4.41Å; F388-Q392 HydrophobicContact CZ-CB 4.45Å; F388-Q392 HydrophobicContact CZ-CG 4.34Å; F388-Q392 WeakPolarHBondContact O-CB 3.41Å; F388-Q392 PolarHBondContact O-N 3.44Å |
| 389 | S | 88.9 | Confident | 86.7 | Confident | 3 Ų | 3 | 19.5 Ų | 19.5 | 2% | 0.021 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.5 | -40.2 | -174.6 | -60.3 | 0 | 0 | 0 | 0 | 111.4 | I385 N386 Q392 W393 | I385-S389 WeakPolarHBondContact O-CB 3.41Å; I385-S389 PolarHBondContact O-N 3.11Å; I385-S389 PolarHBondContact O-OG 2.98Å; N386-S389 PolarHBondContact O-N 3.34Å; S389-Q392 PolarHBondContact O-N 3.46Å; S389-W393 WeakPolarHBondContact O-CB 3.4Å; S389-W393 VanDerWaalsContact O-CD1 3.25Å; S389-W393 PolarHBondContact O-N 3.25Å |
| 390 | F | 89.1 | Confident | 87.5 | Confident | 9 Ų | 9 | 18.9 Ų | 18.9 | 4% | 0.039 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -58.3 | -51.7 | 176.2 | 177 | -98.4 | 0 | 0 | 0 | 112.5 | Y236 N386 F388 A394 V435 I439 Y447 C450 | Y236-F390 WeakPolarHBondContact OH-CA 3.44Å; N386-F390 WeakPolarHBondContact O-CB 3.15Å; N386-F390 PolarHBondContact O-N 3.2Å; F388-F390 VanDerWaalsContact C-N 3.32Å; F388-F390 PolarHBondContact O-N 2.92Å; F390-A394 PolarHBondContact O-N 2.98Å; F390-V435 HydrophobicContact CD2-CG1 4.45Å; F390-V435 HydrophobicContact CE2-CG1 3.72Å; F390-V435 HydrophobicContact CZ-CG1 4.24Å; F390-I439 HydrophobicContact CE2-CD1 3.72Å; F390-I439 HydrophobicContact CE2-CG1 4.07Å; F390-I439 HydrophobicContact CZ-CD1 4.04Å; F390-Y447 HydrophobicContact CB-CD1 3.78Å; F390-Y447 HydrophobicContact CB-CE1 3.9Å; F390-Y447 HydrophobicContact CD1-CD1 4.27Å; F390-Y447 AromaticContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CE1 4.3Å; F390-Y447 HydrophobicContact CD2-CG 4.47Å; F390-Y447 HydrophobicContact CE2-CD1 4.49Å; F390-Y447 AromaticContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CE1 4.23Å; F390-C450 HydrophobicContact CD1-CB 3.87Å; F390-C450 HydrophobicContact CE1-CB 4.16Å |
| 391 | A | 90.3 | Very high | 87.8 | Confident | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.5 | -45.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | T124 V128 L129 Y387 F388 A394 F395 | T124-A391 HydrophobicContact CG2-CB 4.13Å; V128-A391 HydrophobicContact CG1-CB 4.47Å; L129-A391 HydrophobicContact CD2-CB 3.64Å; L129-A391 HydrophobicContact CG-CB 4.45Å; Y387-A391 PolarHBondContact O-N 2.95Å; F388-A391 PolarHBondContact O-N 3.32Å; A391-A394 PolarHBondContact O-N 3.43Å; A391-F395 VanDerWaalsContact O-CD2 3.25Å; A391-F395 WeakPolarHBondContact O-CD2 3.33Å; A391-F395 PolarHBondContact O-N 2.69Å |
| 392 | Q | 88.6 | Confident | 88.1 | Confident | 14 Ų | 14 | 17.3 Ų | 17.3 | 7% | 0.065 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63.3 | -47.3 | -176.1 | -171.6 | 75.2 | -69 | 0 | 0 | 111.3 | L129 F388 S389 A394 F395 Y396 | L129-Q392 HydrophobicContact CD2-CB 3.96Å; F388-Q392 HydrophobicContact CE1-CB 4.32Å; F388-Q392 HydrophobicContact CE1-CG 4.41Å; F388-Q392 HydrophobicContact CZ-CB 4.45Å; F388-Q392 HydrophobicContact CZ-CG 4.34Å; F388-Q392 WeakPolarHBondContact O-CB 3.41Å; F388-Q392 PolarHBondContact O-N 3.44Å; S389-Q392 PolarHBondContact O-N 3.46Å; Q392-A394 VanDerWaalsContact C-N 3.31Å; Q392-A394 PolarHBondContact O-N 2.85Å; Q392-F395 PolarHBondContact O-N 3.17Å; Q392-F395 VanDerWaalsContact O-N 3.15Å; Q392-Y396 VanDerWaalsContact CD-CZ 3.41Å; Q392-Y396 VanDerWaalsContact CD-OH 3.3Å; Q392-Y396 HydrophobicContact CG-CD1 4.27Å; Q392-Y396 HydrophobicContact CG-CD2 4.04Å; Q392-Y396 HydrophobicContact CG-CE1 3.71Å; Q392-Y396 HydrophobicContact CG-CE2 3.46Å; Q392-Y396 VanDerWaalsContact CG-CE2 3.46Å; Q392-Y396 HydrophobicContact CG-CG 4.44Å; Q392-Y396 WeakPolarHBondContact CG-OH 3.01Å; Q392-Y396 PolarHBondContact NE2-OH 3.36Å; Q392-Y396 PolarHBondContact O-N 3.37Å |
| 393 | W | 88.8 | Confident | 88.3 | Confident | 22 Ų | 22 | 15.4 Ų | 15.4 | 8% | 0.083 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -67.1 | -30.3 | -178.9 | -84.1 | 100 | 0 | 0 | 0 | 113.3 | L239 S389 Y396 G397 S431 L434 V435 | L239-W393 HydrophobicContact CB-CZ2 4.22Å; L239-W393 HydrophobicContact CD1-CH2 4.33Å; L239-W393 HydrophobicContact CD1-CZ2 3.48Å; L239-W393 VanDerWaalsContact CD1-CZ2 3.48Å; L239-W393 HydrophobicContact CD2-CZ2 3.86Å; L239-W393 HydrophobicContact CG-CZ2 4.02Å; S389-W393 WeakPolarHBondContact O-CB 3.4Å; S389-W393 VanDerWaalsContact O-CD1 3.25Å; S389-W393 PolarHBondContact O-N 3.25Å; W393-Y396 HydrophobicContact CD2-CD2 4.18Å; W393-Y396 HydrophobicContact CE3-CD2 4.26Å; W393-Y396 HydrophobicContact CZ2-CD2 4.39Å; W393-Y396 HydrophobicContact CZ3-CD2 4.46Å; W393-G397 PolarHBondContact O-N 2.98Å; W393-S431 PolarHBondContact O-OG 3.31Å; W393-L434 HydrophobicContact CD2-CD1 3.58Å; W393-L434 HydrophobicContact CE3-CD1 3.8Å; W393-L434 HydrophobicContact CG-CB 4.49Å; W393-L434 HydrophobicContact CG-CD1 4.05Å; W393-L434 HydrophobicContact CH2-CD1 4.29Å; W393-L434 HydrophobicContact CZ2-CD1 4.14Å; W393-L434 HydrophobicContact CZ3-CD1 4.12Å; W393-V435 HydrophobicContact CB-CG2 4.41Å |
| 394 | A | 89.8 | Confident | 88.4 | Confident | 36 Ų | 36 | 14.4 Ų | 14.4 | 30% | 0.298 | 8% | 0.078 | S | C | . | . | H | α-helix | trans | -61.8 | -43.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | F390 A391 Q392 G397 L398 V435 | F390-A394 PolarHBondContact O-N 2.98Å; A391-A394 PolarHBondContact O-N 3.43Å; Q392-A394 VanDerWaalsContact C-N 3.31Å; Q392-A394 PolarHBondContact O-N 2.85Å; A394-G397 PolarHBondContact O-N 3.31Å; A394-L398 PolarHBondContact O-N 2.83Å; A394-V435 HydrophobicContact CB-CG2 4.14Å |
| 395 | F | 89.4 | Confident | 88.5 | Confident | 13 Ų | 13 | 16 Ų | 16 | 6% | 0.057 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -76.4 | -31 | 178 | -73.5 | -69.1 | 0 | 0 | 0 | 113.7 | L109 Y121 T124 A391 Q392 G397 L398 T399 I454 | L109-F395 HydrophobicContact CD1-CD1 4.36Å; Y121-F395 HydrophobicContact CD2-CB 3.95Å; Y121-F395 AromaticContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD2 4.27Å; Y121-F395 HydrophobicContact CD2-CE1 4.2Å; Y121-F395 AromaticContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CE2-CB 4.21Å; Y121-F395 HydrophobicContact CE2-CG 4.36Å; Y121-F395 HydrophobicContact CG-CD1 4.34Å; T124-F395 HydrophobicContact CG2-CE2 3.71Å; A391-F395 VanDerWaalsContact O-CD2 3.25Å; A391-F395 WeakPolarHBondContact O-CD2 3.33Å; A391-F395 PolarHBondContact O-N 2.69Å; Q392-F395 PolarHBondContact O-N 3.17Å; Q392-F395 VanDerWaalsContact O-N 3.15Å; F395-G397 VanDerWaalsContact C-N 3.34Å; F395-L398 HydrophobicContact CD1-CD2 4.26Å; F395-L398 HydrophobicContact CE1-CD2 4.49Å; F395-L398 PolarHBondContact O-N 3.31Å; F395-T399 WeakPolarHBondContact O-CB 3.43Å; F395-T399 PolarHBondContact O-N 3.07Å; F395-T399 PolarHBondContact O-OG1 3.36Å; F395-I454 HydrophobicContact CZ-CG2 4.45Å |
| 396 | Y | 87.3 | Confident | 88.5 | Confident | 6 Ų | 6 | 16 Ų | 16 | 2% | 0.024 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -62.9 | -41.8 | 169.8 | -69.9 | -7.4 | 0 | 0 | 0 | 111.1 | Y92 E105 D243 W245 N246 Q392 W393 T399 T400 | Y92-Y396 WeakPolarHBondContact OH-CD1 3.41Å; E105-Y396 WeakPolarHBondContact OE1-CD1 3.18Å; E105-Y396 WeakPolarHBondContact OE1-CE1 3.44Å; D243-Y396 PolarHBondContact OD1-OH 3.41Å; D243-Y396 VanDerWaalsContact OD1-OH 3.12Å; W245-Y396 HydrophobicContact CZ2-CD2 4.07Å; W245-Y396 AromaticContact CZ2-CE2 3.74Å; W245-Y396 HydrophobicContact CZ2-CE2 3.74Å; W245-Y396 AromaticContact CZ2-CZ 3.98Å; N246-Y396 WeakPolarHBondContact ND2-CE1 3.43Å; N246-Y396 PolarHBondContact ND2-OH 2.95Å; N246-Y396 VanDerWaalsContact ND2-OH 3.08Å; Q392-Y396 VanDerWaalsContact CD-CZ 3.41Å; Q392-Y396 VanDerWaalsContact CD-OH 3.3Å; Q392-Y396 HydrophobicContact CG-CD1 4.27Å; Q392-Y396 HydrophobicContact CG-CD2 4.04Å; Q392-Y396 HydrophobicContact CG-CE1 3.71Å; Q392-Y396 HydrophobicContact CG-CE2 3.46Å; Q392-Y396 VanDerWaalsContact CG-CE2 3.46Å; Q392-Y396 HydrophobicContact CG-CG 4.44Å; Q392-Y396 WeakPolarHBondContact CG-OH 3.01Å; Q392-Y396 PolarHBondContact NE2-OH 3.36Å; Q392-Y396 PolarHBondContact O-N 3.37Å; W393-Y396 HydrophobicContact CD2-CD2 4.18Å; W393-Y396 HydrophobicContact CE3-CD2 4.26Å; W393-Y396 HydrophobicContact CZ2-CD2 4.39Å; W393-Y396 HydrophobicContact CZ3-CD2 4.46Å; Y396-T399 PolarHBondContact O-N 3.17Å; Y396-T400 WeakPolarHBondContact O-CG2 3.28Å; Y396-T400 PolarHBondContact O-N 3.31Å; Y396-T400 PolarHBondContact O-OG1 3.38Å |
| 397 | G | 88 | Confident | 88.4 | Confident | 8 Ų | 8 | 17.5 Ų | 17.5 | 8% | 0.082 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -59.9 | -45.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | W393 A394 F395 T399 T400 L401 S431 | W393-G397 PolarHBondContact O-N 2.98Å; A394-G397 PolarHBondContact O-N 3.31Å; F395-G397 VanDerWaalsContact C-N 3.34Å; G397-T399 PolarHBondContact O-N 3.27Å; G397-T400 PolarHBondContact O-N 3.18Å; G397-T400 PolarHBondContact O-OG1 3.17Å; G397-L401 WeakPolarHBondContact O-CB 3.14Å; G397-L401 PolarHBondContact O-N 3.41Å; G397-S431 WeakPolarHBondContact CA-OG 3.01Å; G397-S431 PolarHBondContact N-OG 3.31Å |
| 398 | L | 90.2 | Very high | 88.4 | Confident | 47 Ų | 47 | 22.7 Ų | 22.7 | 25% | 0.246 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -66.3 | -37.2 | 179.3 | -166.3 | 59.1 | 0 | 0 | 0 | 112.7 | L109 F113 V117 A394 F395 L401 A402 | L109-L398 HydrophobicContact CD2-CB 4.32Å; L109-L398 HydrophobicContact CD2-CD2 4.11Å; L109-L398 HydrophobicContact CD2-CG 3.76Å; F113-L398 HydrophobicContact CD2-CD1 4.28Å; F113-L398 HydrophobicContact CD2-CG 4.37Å; F113-L398 HydrophobicContact CE2-CD1 3.69Å; F113-L398 HydrophobicContact CE2-CG 3.99Å; F113-L398 HydrophobicContact CZ-CD1 4.05Å; V117-L398 HydrophobicContact CG1-CD2 3.31Å; V117-L398 HydrophobicContact CG1-CG 4.2Å; A394-L398 PolarHBondContact O-N 2.83Å; F395-L398 HydrophobicContact CD1-CD2 4.26Å; F395-L398 HydrophobicContact CE1-CD2 4.49Å; F395-L398 PolarHBondContact O-N 3.31Å; L398-L401 HydrophobicContact CD1-CD2 4.41Å; L398-L401 PolarHBondContact O-N 3.2Å; L398-A402 WeakPolarHBondContact O-CB 3.25Å; L398-A402 PolarHBondContact O-N 3.37Å |
| 399 | T | 87.9 | Confident | 88.2 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -70.4 | -38.6 | 177.6 | -57.2 | 0 | 0 | 0 | 0 | 111.7 | Y92 L95 E105 Y108 F395 Y396 G397 A402 L403 | Y92-T399 HydrophobicContact CE1-CG2 4.15Å; Y92-T399 HydrophobicContact CE2-CG2 3.9Å; L95-T399 HydrophobicContact CD1-CG2 3.61Å; E105-T399 HydrophobicContact CG-CG2 4.35Å; Y108-T399 HydrophobicContact CD2-CG2 3.97Å; F395-T399 WeakPolarHBondContact O-CB 3.43Å; F395-T399 PolarHBondContact O-N 3.07Å; F395-T399 PolarHBondContact O-OG1 3.36Å; Y396-T399 PolarHBondContact O-N 3.17Å; G397-T399 PolarHBondContact O-N 3.27Å; T399-A402 VanDerWaalsContact O-CB 3.29Å; T399-A402 WeakPolarHBondContact O-CB 3.36Å; T399-A402 PolarHBondContact O-N 2.85Å; T399-L403 PolarHBondContact O-N 2.92Å |
| 400 | T | 87.3 | Confident | 88 | Confident | 1 Ų | 1 | 32.3 Ų | 32.3 | 1% | 0.006 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -69.1 | -37.5 | 173.7 | 52.5 | 0 | 0 | 0 | 0 | 111.9 | Y396 G397 A402 L403 I404 V427 T428 | Y396-T400 WeakPolarHBondContact O-CG2 3.28Å; Y396-T400 PolarHBondContact O-N 3.31Å; Y396-T400 PolarHBondContact O-OG1 3.38Å; G397-T400 PolarHBondContact O-N 3.18Å; G397-T400 PolarHBondContact O-OG1 3.17Å; T400-A402 VanDerWaalsContact C-N 3.31Å; T400-A402 PolarHBondContact O-N 3.48Å; T400-L403 WeakPolarHBondContact O-CB 3.34Å; T400-L403 PolarHBondContact O-N 3.1Å; T400-I404 PolarHBondContact O-N 3.27Å; T400-V427 HydrophobicContact CG2-CB 4.29Å; T400-V427 HydrophobicContact CG2-CG1 3.77Å; T400-T428 PolarHBondContact OG1-OG1 3.35Å |
| 401 | L | 89.4 | Confident | 87.6 | Confident | 68 Ų | 68 | 39 Ų | 39 | 36% | 0.356 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -61.9 | -39.6 | 170.3 | -175.3 | 65.3 | 0 | 0 | 0 | 111.5 | F113 G397 L398 L403 I404 V405 | F113-L401 HydrophobicContact CZ-CD2 4.17Å; F113-L401 HydrophobicContact CZ-CG 4.16Å; G397-L401 WeakPolarHBondContact O-CB 3.14Å; G397-L401 PolarHBondContact O-N 3.41Å; L398-L401 HydrophobicContact CD1-CD2 4.41Å; L398-L401 PolarHBondContact O-N 3.2Å; L401-L403 VanDerWaalsContact C-N 3.27Å; L401-L403 PolarHBondContact O-N 3.46Å; L401-I404 WeakPolarHBondContact O-CB 3.27Å; L401-I404 PolarHBondContact O-N 3.28Å; L401-I404 VanDerWaalsContact O-N 3.1Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CG2 3.19Å; L401-V405 PolarHBondContact O-N 3.03Å |
| 402 | A | 88 | Confident | 87.1 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -56.9 | -40.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L109 A112 F113 L398 T399 T400 V405 M406 | L109-A402 HydrophobicContact CD2-CB 4.34Å; A112-A402 HydrophobicContact CB-CB 3.56Å; F113-A402 HydrophobicContact CD2-CB 4.25Å; F113-A402 HydrophobicContact CE2-CB 3.66Å; F113-A402 HydrophobicContact CZ-CB 4.39Å; L398-A402 WeakPolarHBondContact O-CB 3.25Å; L398-A402 PolarHBondContact O-N 3.37Å; T399-A402 VanDerWaalsContact O-CB 3.29Å; T399-A402 WeakPolarHBondContact O-CB 3.36Å; T399-A402 PolarHBondContact O-N 2.85Å; T400-A402 VanDerWaalsContact C-N 3.31Å; T400-A402 PolarHBondContact O-N 3.48Å; A402-V405 PolarHBondContact O-N 2.69Å; A402-M406 HydrophobicContact CB-CE 4.23Å; A402-M406 WeakPolarHBondContact O-CB 3.46Å; A402-M406 WeakPolarHBondContact O-CE 3.31Å; A402-M406 WeakPolarHBondContact O-CG 3.07Å; A402-M406 PolarHBondContact O-N 3.33Å |
| 403 | L | 87.5 | Confident | 86.6 | Confident | 3 Ų | 3 | 49.1 Ų | 49.1 | 2% | 0.016 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.7 | -46.2 | 174.8 | -172.2 | 153.4 | 0 | 0 | 0 | 111.5 | C91 E94 L95 T399 T400 L401 M406 R407 V419 A424 | C91-L403 HydrophobicContact CB-CD1 3.58Å; C91-L403 WeakPolarHBondContact O-CD1 3.42Å; E94-L403 HydrophobicContact CB-CD1 4.13Å; E94-L403 HydrophobicContact CG-CD1 4.09Å; L95-L403 HydrophobicContact CD1-CB 4.32Å; L95-L403 HydrophobicContact CD1-CD1 4.5Å; L95-L403 HydrophobicContact CD2-CB 4.08Å; L95-L403 HydrophobicContact CD2-CD1 4.29Å; L95-L403 HydrophobicContact CD2-CG 4.27Å; L95-L403 HydrophobicContact CG-CB 4.32Å; L95-L403 HydrophobicContact CG-CD1 3.99Å; L95-L403 HydrophobicContact CG-CG 4.47Å; T399-L403 PolarHBondContact O-N 2.92Å; T400-L403 WeakPolarHBondContact O-CB 3.34Å; T400-L403 PolarHBondContact O-N 3.1Å; L401-L403 VanDerWaalsContact C-N 3.27Å; L401-L403 PolarHBondContact O-N 3.46Å; L403-M406 PolarHBondContact O-N 2.95Å; L403-R407 HydrophobicContact CD2-CG 4.2Å; L403-R407 WeakPolarHBondContact O-CG 2.91Å; L403-R407 PolarHBondContact O-N 3.11Å; L403-R407 VanDerWaalsContact O-N 3.11Å; L403-V419 HydrophobicContact CD1-CG2 4.25Å; L403-V419 HydrophobicContact CD2-CG2 4.46Å; L403-A424 HydrophobicContact CD2-CB 4.29Å |
| 404 | I | 88.6 | Confident | 86.3 | Confident | 34 Ų | 34 | 54.3 Ų | 54.3 | 17% | 0.174 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.6 | -49.3 | 178.1 | -61 | 171 | 0 | 0 | 0 | 109.7 | T400 L401 M406 R407 F408 A424 | T400-I404 PolarHBondContact O-N 3.27Å; L401-I404 WeakPolarHBondContact O-CB 3.27Å; L401-I404 PolarHBondContact O-N 3.28Å; L401-I404 VanDerWaalsContact O-N 3.1Å; I404-M406 PolarHBondContact O-N 3.06Å; I404-R407 VanDerWaalsContact O-CB 3.26Å; I404-R407 WeakPolarHBondContact O-CB 3.48Å; I404-R407 PolarHBondContact O-N 2.63Å; I404-R407 VanDerWaalsContact O-N 3.08Å; I404-F408 HydrophobicContact CG2-CD2 4.49Å; I404-F408 HydrophobicContact CG2-CE2 4.01Å; I404-F408 WeakPolarHBondContact O-CD2 3.3Å; I404-A424 HydrophobicContact CD1-CB 4.09Å; I404-A424 HydrophobicContact CG1-CB 3.8Å |
| 405 | V | 89.4 | Confident | 85.9 | Confident | 42 Ų | 42 | 54.6 Ų | 54.6 | 26% | 0.255 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -59.1 | -46.4 | 178.6 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | F113 L401 A402 R407 F408 T409 | F113-V405 HydrophobicContact CE1-CG2 4.17Å; F113-V405 HydrophobicContact CZ-CG2 4.22Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CG2 3.19Å; L401-V405 PolarHBondContact O-N 3.03Å; A402-V405 PolarHBondContact O-N 2.69Å; V405-R407 PolarHBondContact O-N 3.38Å; V405-F408 WeakPolarHBondContact O-CA 3.21Å; V405-F408 PolarHBondContact O-N 3.11Å; V405-T409 HydrophobicContact CG1-CG2 4.25Å; V405-T409 PolarHBondContact O-N 3.21Å; V405-T409 PolarHBondContact O-OG1 3Å |
| 406 | M | 86.8 | Confident | 85.4 | Confident | 1 Ų | 1 | 56.9 Ų | 56.9 | 1% | 0.005 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64.4 | -20.3 | 178.1 | -75.8 | -172.1 | -73 | 0 | 0 | 113.5 | L95 M98 I99 E111 A112 A402 L403 I404 F408 R410 R415 | L95-M406 HydrophobicContact CD2-CE 3.21Å; M98-M406 HydrophobicContact CE-CE 3.75Å; M98-M406 HydrophobicContact CE-SD 3.62Å; I99-M406 HydrophobicContact CD1-CE 4.49Å; I99-M406 HydrophobicContact CD1-SD 4.17Å; E111-M406 HydrophobicContact CB-SD 4.48Å; A112-M406 HydrophobicContact CB-CE 4.1Å; A112-M406 HydrophobicContact CB-CG 3.9Å; A112-M406 HydrophobicContact CB-SD 4.04Å; A402-M406 HydrophobicContact CB-CE 4.23Å; A402-M406 WeakPolarHBondContact O-CB 3.46Å; A402-M406 WeakPolarHBondContact O-CE 3.31Å; A402-M406 WeakPolarHBondContact O-CG 3.07Å; A402-M406 PolarHBondContact O-N 3.33Å; L403-M406 PolarHBondContact O-N 2.95Å; I404-M406 PolarHBondContact O-N 3.06Å; M406-F408 PolarHBondContact O-N 3.34Å; M406-R410 CarbonylContact O-C 3.48Å; M406-R410 PolarHBondContact O-N 3.43Å; M406-R410 VanDerWaalsContact O-N 3.14Å; M406-R415 PolarHBondContact O-NH2 2.59Å |
| 407 | R | 85.1 | Confident | 85.1 | Confident | 33 Ų | 33 | 57.8 Ų | 57.8 | 13% | 0.125 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -65.8 | -29.3 | 168.6 | -58.6 | -132 | 157.6 | -175 | -1.2 | 112.6 | E94 L403 I404 V405 K411 V419 M421 | E94-R407 IonicContact OE1-CZ 3.48Å; E94-R407 IonicContact OE1-NE 3.41Å; E94-R407 PolarHBondContact OE1-NE 2.92Å; E94-R407 IonicContact OE1-NH2 2.83Å; E94-R407 PolarHBondContact OE1-NH2 3.39Å; E94-R407 IonicContact OE2-CZ 3.89Å; E94-R407 IonicContact OE2-NH2 2.72Å; E94-R407 PolarHBondContact OE2-NH2 3.39Å; L403-R407 HydrophobicContact CD2-CG 4.2Å; L403-R407 WeakPolarHBondContact O-CG 2.91Å; L403-R407 PolarHBondContact O-N 3.11Å; L403-R407 VanDerWaalsContact O-N 3.11Å; I404-R407 VanDerWaalsContact O-CB 3.26Å; I404-R407 WeakPolarHBondContact O-CB 3.48Å; I404-R407 PolarHBondContact O-N 2.63Å; I404-R407 VanDerWaalsContact O-N 3.08Å; V405-R407 PolarHBondContact O-N 3.38Å; R407-K411 WeakPolarHBondContact O-CG 3.37Å; R407-V419 VanDerWaalsContact CZ-O 3.32Å; R407-V419 PolarHBondContact NH1-O 3.44Å; R407-V419 PolarHBondContact NH2-O 2.9Å; R407-M421 HydrophobicContact CB-CE 4.13Å; R407-M421 HydrophobicContact CG-CE 4.32Å |
| 408 | F | 87.3 | Confident | 84.7 | Confident | 131 Ų | 131 | 64.6 Ų | 64.6 | 58% | 0.575 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -95.2 | -40.3 | -178.8 | -64.9 | -77.9 | 0 | 0 | 0 | 112.5 | I404 V405 M406 K411 M421 | I404-F408 HydrophobicContact CG2-CD2 4.49Å; I404-F408 HydrophobicContact CG2-CE2 4.01Å; I404-F408 WeakPolarHBondContact O-CD2 3.3Å; V405-F408 WeakPolarHBondContact O-CA 3.21Å; V405-F408 PolarHBondContact O-N 3.11Å; M406-F408 PolarHBondContact O-N 3.34Å; F408-K411 WeakPolarHBondContact O-CE 3.4Å; F408-M421 HydrophobicContact CE2-CE 4.33Å; F408-M421 HydrophobicContact CZ-CE 4.16Å; F408-M421 HydrophobicContact CZ-SD 4.42Å |
| 409 | T | 85.6 | Confident | 84.3 | Confident | 96 Ų | 96 | 62.7 Ų | 62.7 | 59% | 0.589 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -85.1 | -33.4 | -176.2 | 45.4 | 0 | 0 | 0 | 0 | 114.3 | V405 | V405-T409 HydrophobicContact CG1-CG2 4.25Å; V405-T409 PolarHBondContact O-N 3.21Å; V405-T409 PolarHBondContact O-OG1 3Å |
| 410 | R | 82.9 | Confident | 84 | Confident | 114 Ų | 114 | 66.3 Ų | 66.3 | 43% | 0.43 | 33% | 0.332 | S | S | . | . | trans | -127.1 | 75.5 | -178.2 | -64.2 | -163.5 | -176.8 | -114.3 | 9.9 | 112 | E111 M406 L413 R415 | E111-R410 IonicContact OE1-CZ 2.98Å; E111-R410 IonicContact OE1-NE 3.41Å; E111-R410 PolarHBondContact OE1-NE 3.48Å; E111-R410 IonicContact OE1-NH1 3.52Å; E111-R410 IonicContact OE1-NH2 3.81Å; E111-R410 PolarHBondContact OE1-NH2 3.46Å; M406-R410 CarbonylContact O-C 3.48Å; M406-R410 PolarHBondContact O-N 3.43Å; M406-R410 VanDerWaalsContact O-N 3.14Å; R410-L413 HydrophobicContact CB-CD1 3.61Å; R410-L413 HydrophobicContact CB-CG 4.21Å; R410-L413 HydrophobicContact CG-CD1 4.28Å; R410-R415 PolarHBondContact O-NH2 3.46Å | ||
| 411 | K | 81.3 | Confident | 83.7 | Confident | 149 Ų | 149 | 70.2 Ų | 70.2 | 65% | 0.648 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.9 | -29.4 | -177.7 | -66.8 | 179.1 | -176.6 | 176.9 | 0 | 113.5 | R407 F408 L413 | R407-K411 WeakPolarHBondContact O-CG 3.37Å; F408-K411 WeakPolarHBondContact O-CE 3.4Å; K411-L413 PolarHBondContact O-N 3.09Å |
| 412 | D | 79.3 | Confident | 83.5 | Confident | 165 Ų | 165 | 72.2 Ų | 72.2 | 88% | 0.882 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.6 | -1.9 | -170.7 | -49.9 | -45 | 0 | 0 | 0 | 114.3 | ||
| 413 | L | 80.1 | Confident | 83.1 | Confident | 63 Ų | 63 | 74 Ų | 74 | 33% | 0.33 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -68.7 | 133.1 | 173.8 | -77.1 | 167.8 | 0 | 0 | 0 | 110 | M98 R410 K411 | M98-L413 HydrophobicContact CG-CB 4.27Å; M98-L413 HydrophobicContact CG-CD1 4.25Å; M98-L413 HydrophobicContact SD-CB 4.27Å; M98-L413 HydrophobicContact SD-CD1 3.95Å; R410-L413 HydrophobicContact CB-CD1 3.61Å; R410-L413 HydrophobicContact CB-CG 4.21Å; R410-L413 HydrophobicContact CG-CD1 4.28Å; K411-L413 PolarHBondContact O-N 3.09Å |
| 414 | D | 81.4 | Confident | 82.8 | Confident | 130 Ų | 130 | 73.9 Ų | 73.9 | 70% | 0.695 | 38% | 0.375 | S | S | * | . | trans | -64.6 | 134.2 | 172.7 | -171.1 | 16.5 | 0 | 0 | 0 | 110.3 | ||||
| 415 | R | 81.9 | Confident | 82.6 | Confident | 42 Ų | 42 | 73.4 Ų | 73.4 | 16% | 0.158 | 38% | 0.379 | C | S | . | . | trans | -128.1 | 87.7 | -175.2 | -63.7 | 178.7 | -161.9 | -142.4 | -1.4 | 109.4 | E94 M98 M406 R410 V417 | E94-R415 IonicContact OE1-NH1 3.24Å; E94-R415 PolarHBondContact OE1-NH1 3.07Å; M98-R415 HydrophobicContact SD-CG 4.32Å; M406-R415 PolarHBondContact O-NH2 2.59Å; R410-R415 PolarHBondContact O-NH2 3.46Å; R415-V417 PolarHBondContact O-N 3.12Å | ||
| 416 | P | 79.1 | Confident | 82.4 | Confident | 62 Ų | 62 | 75.5 Ų | 75.5 | 40% | 0.403 | 39% | 0.388 | S | S | . | . | S | Bend | trans | -61.5 | -33.5 | -179.9 | -25.9 | 36.4 | 0 | 0 | 0 | 112.8 | Y259 | Y259-P416 HydrophobicContact CD1-CB 3.62Å; Y259-P416 HydrophobicContact CD1-CG 3.61Å; Y259-P416 HydrophobicContact CE1-CB 4.21Å; Y259-P416 HydrophobicContact CE1-CG 3.66Å; Y259-P416 HydrophobicContact CG-CB 4.18Å; Y259-P416 HydrophobicContact CG-CG 4.47Å |
| 417 | V | 79.3 | Confident | 82.3 | Confident | 24 Ų | 24 | 76.5 Ų | 76.5 | 15% | 0.145 | 39% | 0.394 | C | S | . | . | S | Bend | trans | -117.3 | 125.6 | 174.5 | -179 | 0 | 0 | 0 | 0 | 108.3 | L90 E94 T97 P263 R415 | L90-V417 HydrophobicContact CD2-CG1 4.44Å; E94-V417 WeakPolarHBondContact CB-O 3.18Å; E94-V417 VanDerWaalsContact CG-O 3.23Å; E94-V417 WeakPolarHBondContact CG-O 3.43Å; T97-V417 HydrophobicContact CG2-CG2 4.09Å; P263-V417 HydrophobicContact CG-CG2 4.34Å; R415-V417 PolarHBondContact O-N 3.12Å |
| 418 | K | 79.4 | Confident | 82.4 | Confident | 152 Ų | 152 | 76 Ų | 76 | 66% | 0.661 | 39% | 0.394 | S | S | * | . | trans | -125 | 118.3 | -178.9 | -168.1 | 176.6 | -176.4 | 175.2 | 0 | 110.7 | ||||
| 419 | V | 81.9 | Confident | 82.5 | Confident | 6 Ų | 6 | 75.7 Ų | 75.7 | 4% | 0.036 | 40% | 0.398 | C | S | . | . | trans | -90.1 | 150.4 | 175 | -66.4 | 0 | 0 | 0 | 0 | 112.5 | S87 L90 E94 L403 R407 | S87-V419 WeakPolarHBondContact OG-CB 3.4Å; L90-V419 HydrophobicContact CB-CG1 3.82Å; L90-V419 WeakPolarHBondContact O-CG1 3.18Å; E94-V419 WeakPolarHBondContact OE2-CG2 3.37Å; E94-V419 PolarHBondContact OE2-N 3.26Å; L403-V419 HydrophobicContact CD1-CG2 4.25Å; L403-V419 HydrophobicContact CD2-CG2 4.46Å; R407-V419 VanDerWaalsContact CZ-O 3.32Å; R407-V419 PolarHBondContact NH1-O 3.44Å; R407-V419 PolarHBondContact NH2-O 2.9Å | ||
| 420 | P | 83.2 | Confident | 82.6 | Confident | 76 Ų | 76 | 72.6 Ų | 72.6 | 49% | 0.494 | 38% | 0.379 | S | S | . | . | trans | -60 | 133.8 | 168.1 | -23.5 | 32.6 | 0 | 0 | 0 | 112.2 | V422 I423 | P420-V422 VanDerWaalsContact C-N 3.27Å; P420-V422 PolarHBondContact O-N 3Å; P420-I423 HydrophobicContact CB-CD1 4Å; P420-I423 HydrophobicContact CB-CG1 4.21Å; P420-I423 HydrophobicContact CG-CD1 3.88Å; P420-I423 PolarHBondContact O-N 2.91Å; P420-I423 VanDerWaalsContact O-N 3.16Å | ||
| 421 | M | 80.7 | Confident | 82.8 | Confident | 84 Ų | 84 | 67.4 Ų | 67.4 | 41% | 0.414 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.7 | -32 | -176.4 | -171.4 | -178.8 | -74.7 | 0 | 0 | 113 | R407 F408 I423 A424 G425 | R407-M421 HydrophobicContact CB-CE 4.13Å; R407-M421 HydrophobicContact CG-CE 4.32Å; F408-M421 HydrophobicContact CE2-CE 4.33Å; F408-M421 HydrophobicContact CZ-CE 4.16Å; F408-M421 HydrophobicContact CZ-SD 4.42Å; M421-I423 PolarHBondContact O-N 3.4Å; M421-A424 PolarHBondContact O-N 2.89Å; M421-G425 PolarHBondContact O-N 3.32Å; M421-G425 VanDerWaalsContact O-N 3.09Å |
| 422 | V | 83.8 | Confident | 83.2 | Confident | 110 Ų | 110 | 63.2 Ų | 63.2 | 67% | 0.667 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -54.7 | -38.2 | 176.8 | 178.8 | 0 | 0 | 0 | 0 | 111 | P420 G425 I426 | P420-V422 VanDerWaalsContact C-N 3.27Å; P420-V422 PolarHBondContact O-N 3Å; V422-G425 PolarHBondContact O-N 3.44Å; V422-I426 HydrophobicContact CG1-CD1 3.98Å; V422-I426 WeakPolarHBondContact O-CG1 3.42Å; V422-I426 PolarHBondContact O-N 3.33Å |
| 423 | I | 79.9 | Confident | 83.7 | Confident | 37 Ų | 37 | 58.1 Ų | 58.1 | 19% | 0.19 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -75.7 | -37.7 | -175.4 | -52 | 171.5 | 0 | 0 | 0 | 110.8 | S87 P420 M421 G425 I426 V427 | S87-I423 VanDerWaalsContact CB-CB 3.47Å; S87-I423 WeakPolarHBondContact OG-CB 3.26Å; S87-I423 WeakPolarHBondContact OG-CD1 3.5Å; S87-I423 WeakPolarHBondContact OG-CG2 3.26Å; P420-I423 HydrophobicContact CB-CD1 4Å; P420-I423 HydrophobicContact CB-CG1 4.21Å; P420-I423 HydrophobicContact CG-CD1 3.88Å; P420-I423 PolarHBondContact O-N 2.91Å; P420-I423 VanDerWaalsContact O-N 3.16Å; M421-I423 PolarHBondContact O-N 3.4Å; I423-G425 VanDerWaalsContact C-N 3.28Å; I423-G425 PolarHBondContact O-N 3.49Å; I423-I426 PolarHBondContact O-N 2.95Å; I423-V427 WeakPolarHBondContact O-CG2 3.25Å; I423-V427 PolarHBondContact O-N 2.84Å |
| 424 | A | 81.1 | Confident | 84 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -58.1 | -43.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L403 I404 M421 V427 T428 | L403-A424 HydrophobicContact CD2-CB 4.29Å; I404-A424 HydrophobicContact CD1-CB 4.09Å; I404-A424 HydrophobicContact CG1-CB 3.8Å; M421-A424 PolarHBondContact O-N 2.89Å; A424-V427 PolarHBondContact O-N 3.09Å; A424-T428 PolarHBondContact O-N 3.3Å; A424-T428 PolarHBondContact O-OG1 2.99Å |
| 425 | G | 84.9 | Confident | 84.3 | Confident | 25 Ų | 25 | 50.2 Ų | 50.2 | 26% | 0.258 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.8 | -43.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | M421 V422 I423 T428 L429 | M421-G425 PolarHBondContact O-N 3.32Å; M421-G425 VanDerWaalsContact O-N 3.09Å; V422-G425 PolarHBondContact O-N 3.44Å; I423-G425 VanDerWaalsContact C-N 3.28Å; I423-G425 PolarHBondContact O-N 3.49Å; G425-T428 PolarHBondContact O-N 3.31Å; G425-L429 WeakPolarHBondContact O-CG 3.43Å; G425-L429 PolarHBondContact O-N 2.88Å |
| 426 | I | 86.2 | Confident | 84.5 | Confident | 86 Ų | 86 | 52.9 Ų | 52.9 | 44% | 0.441 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -60.9 | -46.2 | 176.7 | -68.8 | 165.3 | 0 | 0 | 0 | 110.9 | V422 I423 T428 L429 V430 | V422-I426 HydrophobicContact CG1-CD1 3.98Å; V422-I426 WeakPolarHBondContact O-CG1 3.42Å; V422-I426 PolarHBondContact O-N 3.33Å; I423-I426 PolarHBondContact O-N 2.95Å; I426-T428 VanDerWaalsContact C-N 3.34Å; I426-T428 PolarHBondContact O-N 3.29Å; I426-L429 PolarHBondContact O-N 3.38Å; I426-V430 HydrophobicContact CG2-CG2 4.33Å; I426-V430 WeakPolarHBondContact O-CG2 3.28Å; I426-V430 PolarHBondContact O-N 2.95Å |
| 427 | V | 83.3 | Confident | 84.7 | Confident | 21 Ų | 21 | 50 Ų | 50 | 13% | 0.127 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.9 | -39.7 | -179.8 | 179.2 | 0 | 0 | 0 | 0 | 111.1 | T400 I423 A424 V430 S431 | T400-V427 HydrophobicContact CG2-CB 4.29Å; T400-V427 HydrophobicContact CG2-CG1 3.77Å; I423-V427 WeakPolarHBondContact O-CG2 3.25Å; I423-V427 PolarHBondContact O-N 2.84Å; A424-V427 PolarHBondContact O-N 3.09Å; V427-V430 PolarHBondContact O-N 3Å; V427-S431 WeakPolarHBondContact O-CB 3.43Å; V427-S431 PolarHBondContact O-N 3.29Å |
| 428 | T | 87.2 | Confident | 84.6 | Confident | 23 Ų | 23 | 48.8 Ų | 48.8 | 14% | 0.141 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 173.9 | -54.6 | 0 | 0 | 0 | 0 | 111.4 | T400 A424 G425 I426 S431 C432 | T400-T428 PolarHBondContact OG1-OG1 3.35Å; A424-T428 PolarHBondContact O-N 3.3Å; A424-T428 PolarHBondContact O-OG1 2.99Å; G425-T428 PolarHBondContact O-N 3.31Å; I426-T428 VanDerWaalsContact C-N 3.34Å; I426-T428 PolarHBondContact O-N 3.29Å; T428-S431 PolarHBondContact O-N 3.37Å; T428-C432 PolarHBondContact O-N 3.45Å; T428-C432 PolarHBondContact O-SG 2.97Å |
| 429 | L | 89.5 | Confident | 84.8 | Confident | 124 Ų | 124 | 45 Ų | 45 | 65% | 0.649 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -63.1 | -42.7 | 175.8 | -73.2 | 172.4 | 0 | 0 | 0 | 112.6 | G425 I426 C432 Y433 | G425-L429 WeakPolarHBondContact O-CG 3.43Å; G425-L429 PolarHBondContact O-N 2.88Å; I426-L429 PolarHBondContact O-N 3.38Å; L429-C432 WeakPolarHBondContact O-CB 3.44Å; L429-C432 PolarHBondContact O-N 3.19Å; L429-Y433 PolarHBondContact O-N 3.39Å |
| 430 | V | 87.9 | Confident | 84.8 | Confident | 32 Ų | 32 | 50.4 Ų | 50.4 | 19% | 0.194 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 176 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | L81 I426 V427 C432 Y433 L434 | L81-V430 HydrophobicContact CD1-CG1 4.07Å; L81-V430 HydrophobicContact CD2-CG1 4Å; L81-V430 HydrophobicContact CD2-CG2 4.04Å; I426-V430 HydrophobicContact CG2-CG2 4.33Å; I426-V430 WeakPolarHBondContact O-CG2 3.28Å; I426-V430 PolarHBondContact O-N 2.95Å; V427-V430 PolarHBondContact O-N 3Å; V430-C432 PolarHBondContact O-N 3.37Å; V430-Y433 WeakPolarHBondContact O-CB 3.46Å; V430-Y433 PolarHBondContact O-N 3.06Å; V430-L434 HydrophobicContact CG1-CD1 4.02Å; V430-L434 HydrophobicContact CG1-CG 4.33Å; V430-L434 WeakPolarHBondContact O-CB 3.41Å; V430-L434 WeakPolarHBondContact O-CG 3.5Å; V430-L434 PolarHBondContact O-N 3.49Å |
| 431 | S | 87.9 | Confident | 84.2 | Confident | 4 Ų | 4 | 49.8 Ų | 49.8 | 3% | 0.028 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59.8 | -44.6 | 173.7 | 165.7 | 0 | 0 | 0 | 0 | 111.6 | W393 G397 V427 T428 Y433 L434 V435 | W393-S431 PolarHBondContact O-OG 3.31Å; G397-S431 WeakPolarHBondContact CA-OG 3.01Å; G397-S431 PolarHBondContact N-OG 3.31Å; V427-S431 WeakPolarHBondContact O-CB 3.43Å; V427-S431 PolarHBondContact O-N 3.29Å; T428-S431 PolarHBondContact O-N 3.37Å; S431-Y433 VanDerWaalsContact C-N 3.35Å; S431-Y433 PolarHBondContact O-N 3.19Å; S431-L434 PolarHBondContact O-N 3.48Å; S431-V435 WeakPolarHBondContact O-CG2 3.48Å; S431-V435 PolarHBondContact O-N 2.86Å |
| 432 | C | 89.8 | Confident | 83.6 | Confident | 61 Ų | 61 | 50.3 Ų | 50.3 | 41% | 0.412 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -60.2 | -43.4 | 174.7 | -69.6 | 0 | 0 | 0 | 0 | 112.1 | T428 L429 V430 V435 L436 | T428-C432 PolarHBondContact O-N 3.45Å; T428-C432 PolarHBondContact O-SG 2.97Å; L429-C432 WeakPolarHBondContact O-CB 3.44Å; L429-C432 PolarHBondContact O-N 3.19Å; V430-C432 PolarHBondContact O-N 3.37Å; C432-V435 PolarHBondContact O-N 2.58Å; C432-L436 VanDerWaalsContact O-CB 3.32Å; C432-L436 WeakPolarHBondContact O-CB 3.34Å; C432-L436 VanDerWaalsContact O-CG 3.27Å; C432-L436 WeakPolarHBondContact O-CG 3.39Å; C432-L436 PolarHBondContact O-N 2.67Å |
| 433 | Y | 88.5 | Confident | 83.3 | Confident | 58 Ų | 58 | 49.8 Ų | 49.8 | 23% | 0.227 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.3 | -49.2 | 174.5 | 163.7 | -108.2 | 0 | 0 | 0 | 111.4 | F228 L429 V430 S431 V435 L436 A437 | F228-Y433 HydrophobicContact CD1-CE2 4.05Å; F228-Y433 AromaticContact CD2-CE2 3.87Å; F228-Y433 HydrophobicContact CD2-CE2 3.87Å; F228-Y433 AromaticContact CE1-CD2 3.93Å; F228-Y433 HydrophobicContact CE1-CD2 3.93Å; F228-Y433 AromaticContact CE1-CE2 3.55Å; F228-Y433 HydrophobicContact CE1-CE2 3.55Å; F228-Y433 AromaticContact CE2-CD2 3.87Å; F228-Y433 HydrophobicContact CE2-CD2 3.87Å; F228-Y433 AromaticContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CG-CE2 4.22Å; F228-Y433 AromaticContact CZ-CD2 3.39Å; F228-Y433 HydrophobicContact CZ-CD2 3.39Å; F228-Y433 AromaticContact CZ-CE2 3.18Å; F228-Y433 HydrophobicContact CZ-CE2 3.18Å; F228-Y433 PolarHBondContact O-OH 3.37Å; L429-Y433 PolarHBondContact O-N 3.39Å; V430-Y433 WeakPolarHBondContact O-CB 3.46Å; V430-Y433 PolarHBondContact O-N 3.06Å; S431-Y433 VanDerWaalsContact C-N 3.35Å; S431-Y433 PolarHBondContact O-N 3.19Å; Y433-V435 VanDerWaalsContact C-N 3.3Å; Y433-V435 PolarHBondContact O-N 3.31Å; Y433-L436 PolarHBondContact O-N 3Å; Y433-A437 HydrophobicContact CD2-CB 3.84Å; Y433-A437 HydrophobicContact CE2-CB 3.5Å; Y433-A437 VanDerWaalsContact CE2-CB 3.5Å; Y433-A437 WeakPolarHBondContact O-CB 3.42Å; Y433-A437 PolarHBondContact O-N 3.39Å |
| 434 | L | 86.6 | Confident | 83.1 | Confident | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.005 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64 | -33.5 | -178.6 | -73.6 | 178 | 0 | 0 | 0 | 112.7 | F235 Y236 L239 W393 V430 S431 P438 | F235-L434 HydrophobicContact CB-CD2 3.72Å; F235-L434 HydrophobicContact CG-CD2 4.38Å; Y236-L434 HydrophobicContact CD1-CD2 4.37Å; Y236-L434 HydrophobicContact CE1-CB 4.01Å; Y236-L434 HydrophobicContact CE1-CD2 4.33Å; Y236-L434 PolarHBondContact OH-O 2.95Å; L239-L434 HydrophobicContact CD1-CD1 3.66Å; W393-L434 HydrophobicContact CD2-CD1 3.58Å; W393-L434 HydrophobicContact CE3-CD1 3.8Å; W393-L434 HydrophobicContact CG-CB 4.49Å; W393-L434 HydrophobicContact CG-CD1 4.05Å; W393-L434 HydrophobicContact CH2-CD1 4.29Å; W393-L434 HydrophobicContact CZ2-CD1 4.14Å; W393-L434 HydrophobicContact CZ3-CD1 4.12Å; V430-L434 HydrophobicContact CG1-CD1 4.02Å; V430-L434 HydrophobicContact CG1-CG 4.33Å; V430-L434 WeakPolarHBondContact O-CB 3.41Å; V430-L434 WeakPolarHBondContact O-CG 3.5Å; V430-L434 PolarHBondContact O-N 3.49Å; S431-L434 PolarHBondContact O-N 3.48Å; L434-P438 WeakPolarHBondContact O-CD 3.28Å; L434-P438 WeakPolarHBondContact O-CG 3.37Å |
| 435 | V | 87.9 | Confident | 83.1 | Confident | 26 Ų | 26 | 60 Ų | 60 | 16% | 0.158 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -75.6 | -41.6 | 175.8 | 172.1 | 0 | 0 | 0 | 0 | 111.8 | F390 W393 A394 S431 C432 Y433 I439 | F390-V435 HydrophobicContact CD2-CG1 4.45Å; F390-V435 HydrophobicContact CE2-CG1 3.72Å; F390-V435 HydrophobicContact CZ-CG1 4.24Å; W393-V435 HydrophobicContact CB-CG2 4.41Å; A394-V435 HydrophobicContact CB-CG2 4.14Å; S431-V435 WeakPolarHBondContact O-CG2 3.48Å; S431-V435 PolarHBondContact O-N 2.86Å; C432-V435 PolarHBondContact O-N 2.58Å; Y433-V435 VanDerWaalsContact C-N 3.3Å; Y433-V435 PolarHBondContact O-N 3.31Å; V435-I439 WeakPolarHBondContact O-CD1 3.33Å; V435-I439 WeakPolarHBondContact O-CG1 3.19Å |
| 436 | L | 85.9 | Confident | 82.7 | Confident | 98 Ų | 98 | 59.7 Ų | 59.7 | 51% | 0.513 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -82.1 | -40.7 | -173.8 | -67.9 | 172.9 | 0 | 0 | 0 | 113.4 | C432 Y433 I439 I440 | C432-L436 VanDerWaalsContact O-CB 3.32Å; C432-L436 WeakPolarHBondContact O-CB 3.34Å; C432-L436 VanDerWaalsContact O-CG 3.27Å; C432-L436 WeakPolarHBondContact O-CG 3.39Å; C432-L436 PolarHBondContact O-N 2.67Å; Y433-L436 PolarHBondContact O-N 3Å; L436-I439 PolarHBondContact O-N 2.81Å; L436-I440 HydrophobicContact CB-CD1 4.34Å; L436-I440 WeakPolarHBondContact O-CG1 3.1Å; L436-I440 PolarHBondContact O-N 2.94Å; L436-I440 VanDerWaalsContact O-N 3.14Å |
| 437 | A | 82.9 | Confident | 82.5 | Confident | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.008 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -59.8 | -44 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | F228 Y433 I439 I440 D441 | F228-A437 HydrophobicContact CD1-CB 3.78Å; F228-A437 HydrophobicContact CE1-CB 3.52Å; F228-A437 HydrophobicContact CZ-CB 4.38Å; Y433-A437 HydrophobicContact CD2-CB 3.84Å; Y433-A437 HydrophobicContact CE2-CB 3.5Å; Y433-A437 VanDerWaalsContact CE2-CB 3.5Å; Y433-A437 WeakPolarHBondContact O-CB 3.42Å; Y433-A437 PolarHBondContact O-N 3.39Å; A437-I439 VanDerWaalsContact C-N 3.32Å; A437-I439 PolarHBondContact O-N 3.2Å; A437-I440 PolarHBondContact O-N 3.4Å; A437-D441 PolarHBondContact O-N 3.19Å |
| 438 | P | 78.6 | Confident | 82.6 | Confident | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -67.2 | -31.6 | 177.7 | -21.5 | 35.3 | 0 | 0 | 0 | 113.2 | Y236 L434 K442 Y447 | Y236-P438 HydrophobicContact CE2-CB 4.23Å; Y236-P438 HydrophobicContact CE2-CG 3.65Å; L434-P438 WeakPolarHBondContact O-CD 3.28Å; L434-P438 WeakPolarHBondContact O-CG 3.37Å; P438-K442 CarbonylContact O-C 3.31Å; P438-K442 PolarHBondContact O-N 3.45Å; P438-K442 VanDerWaalsContact O-N 3.17Å; P438-Y447 HydrophobicContact CB-CE1 4.43Å; P438-Y447 HydrophobicContact CB-CE2 3.76Å |
| 439 | I | 82.7 | Confident | 82.4 | Confident | 73 Ų | 73 | 64.8 Ų | 64.8 | 37% | 0.374 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -67.2 | -40.2 | 176.9 | -63.4 | 174.2 | 0 | 0 | 0 | 110.6 | F390 V435 L436 A437 P443 | F390-I439 HydrophobicContact CE2-CD1 3.72Å; F390-I439 HydrophobicContact CE2-CG1 4.07Å; F390-I439 HydrophobicContact CZ-CD1 4.04Å; V435-I439 WeakPolarHBondContact O-CD1 3.33Å; V435-I439 WeakPolarHBondContact O-CG1 3.19Å; L436-I439 PolarHBondContact O-N 2.81Å; A437-I439 VanDerWaalsContact C-N 3.32Å; A437-I439 PolarHBondContact O-N 3.2Å; I439-P443 WeakPolarHBondContact O-CB 3.44Å |
| 440 | I | 81.4 | Confident | 82.2 | Confident | 118 Ų | 118 | 58.9 Ų | 58.9 | 61% | 0.605 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -77.7 | -46.8 | -174.3 | -63.3 | 165.4 | 0 | 0 | 0 | 111 | L436 A437 | L436-I440 HydrophobicContact CB-CD1 4.34Å; L436-I440 WeakPolarHBondContact O-CG1 3.1Å; L436-I440 PolarHBondContact O-N 2.94Å; L436-I440 VanDerWaalsContact O-N 3.14Å; A437-I440 PolarHBondContact O-N 3.4Å |
| 441 | D | 70.7 | Confident | 82.1 | Confident | 64 Ų | 64 | 59.6 Ų | 59.6 | 34% | 0.342 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -88.7 | -36.5 | -170.2 | -85.1 | 26.5 | 0 | 0 | 0 | 113.4 | F228 G229 A437 | F228-D441 WeakPolarHBondContact CB-OD2 3.2Å; G229-D441 WeakPolarHBondContact CA-OD2 3.32Å; G229-D441 PolarHBondContact N-OD2 2.98Å; A437-D441 PolarHBondContact O-N 3.19Å |
| 442 | K | 69.9 | Low | 82.1 | Confident | 94 Ų | 94 | 64.1 Ų | 64.1 | 41% | 0.409 | 32% | 0.319 | S | S | . | . | trans | -142.6 | 71.9 | -178.2 | -70.6 | -172.1 | 178.5 | -179.5 | 0 | 111.2 | L233 P438 E444 | L233-K442 HydrophobicContact CD1-CD 3.81Å; P438-K442 CarbonylContact O-C 3.31Å; P438-K442 PolarHBondContact O-N 3.45Å; P438-K442 VanDerWaalsContact O-N 3.17Å; K442-E444 PolarHBondContact O-N 3.32Å | ||
| 443 | P | 76.6 | Confident | 82 | Confident | 100 Ų | 100 | 63.6 Ų | 63.6 | 65% | 0.649 | 31% | 0.31 | S | S | * | . | trans | -65.2 | 101.8 | 179.4 | 25.6 | -32.9 | 0 | 0 | 0 | 110.8 | I439 | I439-P443 WeakPolarHBondContact O-CB 3.44Š| ||
| 444 | E | 75.8 | Confident | 81.9 | Confident | 63 Ų | 63 | 61.9 Ų | 61.9 | 29% | 0.294 | 31% | 0.305 | S | S | . | . | trans | -89.6 | 149.4 | 170 | -69.7 | -178.4 | -179.1 | 0 | 0 | 111 | K442 A446 Y447 | K442-E444 PolarHBondContact O-N 3.32Å; E444-A446 HydrophobicContact CB-CB 4.39Å; E444-A446 PolarHBondContact O-N 3.31Å; E444-A446 VanDerWaalsContact O-N 3.08Å; E444-Y447 HydrophobicContact CB-CD2 4.15Å; E444-Y447 HydrophobicContact CB-CE2 4.04Å; E444-Y447 HydrophobicContact CG-CE2 4.48Å; E444-Y447 PolarHBondContact O-N 3.45Å; E444-Y447 VanDerWaalsContact O-N 3.1Å | ||
| 445 | W | 81.3 | Confident | 81.9 | Confident | 187 Ų | 187 | 67.5 Ų | 67.5 | 71% | 0.708 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -55.1 | -28.1 | 173.9 | -64.6 | 107.8 | 0 | 0 | 0 | 113 | Y447 L448 Y449 | W445-Y447 VanDerWaalsContact C-N 3.3Å; W445-Y447 PolarHBondContact O-N 3.38Å; W445-L448 HydrophobicContact CE3-CD2 4.06Å; W445-L448 HydrophobicContact CZ3-CD2 4.08Å; W445-L448 PolarHBondContact O-N 3.16Å; W445-Y449 HydrophobicContact CB-CD2 4.28Å; W445-Y449 HydrophobicContact CB-CE2 3.78Å; W445-Y449 WeakPolarHBondContact O-CD2 3.29Å; W445-Y449 PolarHBondContact O-N 3.15Å |
| 446 | A | 76.5 | Confident | 82 | Confident | 19 Ų | 19 | 67.8 Ų | 67.8 | 16% | 0.157 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -55 | -42.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y387 E444 Y449 C450 | Y387-A446 HydrophobicContact CD2-CB 4.28Å; Y387-A446 WeakPolarHBondContact CD2-O 3.41Å; E444-A446 HydrophobicContact CB-CB 4.39Å; E444-A446 PolarHBondContact O-N 3.31Å; E444-A446 VanDerWaalsContact O-N 3.08Å; A446-Y449 PolarHBondContact O-N 3.38Å; A446-C450 VanDerWaalsContact O-CB 3.31Å; A446-C450 WeakPolarHBondContact O-CB 3.42Å; A446-C450 PolarHBondContact O-N 3.36Å |
| 447 | Y | 82.5 | Confident | 81.9 | Confident | 8 Ų | 8 | 63.1 Ų | 63.1 | 3% | 0.031 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -70.2 | -37.1 | -178.6 | -55.1 | -48.4 | 0 | 0 | 0 | 112.3 | L233 Y236 N386 F390 P438 E444 W445 C450 T451 | L233-Y447 WeakPolarHBondContact CD2-OH 3.27Å; Y236-Y447 HydrophobicContact CE2-CE1 4.24Å; N386-Y447 HydrophobicContact CB-CE1 4.28Å; F390-Y447 HydrophobicContact CB-CD1 3.78Å; F390-Y447 HydrophobicContact CB-CE1 3.9Å; F390-Y447 HydrophobicContact CD1-CD1 4.27Å; F390-Y447 AromaticContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CE1 4.3Å; F390-Y447 HydrophobicContact CD2-CG 4.47Å; F390-Y447 HydrophobicContact CE2-CD1 4.49Å; F390-Y447 AromaticContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CE1 4.23Å; P438-Y447 HydrophobicContact CB-CE1 4.43Å; P438-Y447 HydrophobicContact CB-CE2 3.76Å; E444-Y447 HydrophobicContact CB-CD2 4.15Å; E444-Y447 HydrophobicContact CB-CE2 4.04Å; E444-Y447 HydrophobicContact CG-CE2 4.48Å; E444-Y447 PolarHBondContact O-N 3.45Å; E444-Y447 VanDerWaalsContact O-N 3.1Å; W445-Y447 VanDerWaalsContact C-N 3.3Å; W445-Y447 PolarHBondContact O-N 3.38Å; Y447-C450 PolarHBondContact O-N 3.5Å; Y447-T451 WeakPolarHBondContact O-CB 2.98Å; Y447-T451 PolarHBondContact O-N 3.36Å; Y447-T451 PolarHBondContact O-OG1 3.25Å |
| 448 | L | 84.3 | Confident | 82 | Confident | 86 Ų | 86 | 65.2 Ų | 65.2 | 45% | 0.45 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64.4 | -49.3 | 174.7 | -177.5 | 67.5 | 0 | 0 | 0 | 110.7 | W445 C450 T451 I452 | W445-L448 HydrophobicContact CE3-CD2 4.06Å; W445-L448 HydrophobicContact CZ3-CD2 4.08Å; W445-L448 PolarHBondContact O-N 3.16Å; L448-C450 VanDerWaalsContact C-N 3.27Å; L448-C450 PolarHBondContact O-N 3.28Å; L448-T451 PolarHBondContact O-N 3.17Å; L448-I452 HydrophobicContact CD1-CD1 4.06Å; L448-I452 HydrophobicContact CD1-CG1 4.43Å; L448-I452 HydrophobicContact CD2-CD1 4.46Å; L448-I452 HydrophobicContact CG-CD1 3.83Å; L448-I452 VanDerWaalsContact O-CG1 3.31Å; L448-I452 WeakPolarHBondContact O-CG1 3.11Å; L448-I452 PolarHBondContact O-N 3.28Å |
| 449 | Y | 84.1 | Confident | 82.3 | Confident | 143 Ų | 143 | 71.2 Ų | 71.2 | 56% | 0.561 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -60.1 | -38.9 | 176.6 | -63.7 | -38.5 | 0 | 0 | 0 | 112 | W445 A446 F453 | W445-Y449 HydrophobicContact CB-CD2 4.28Å; W445-Y449 HydrophobicContact CB-CE2 3.78Å; W445-Y449 WeakPolarHBondContact O-CD2 3.29Å; W445-Y449 PolarHBondContact O-N 3.15Å; A446-Y449 PolarHBondContact O-N 3.38Å; Y449-F453 WeakPolarHBondContact O-CB 3.28Å; Y449-F453 PolarHBondContact O-N 3.16Å |
| 450 | C | 84.3 | Confident | 82.2 | Confident | 0 Ų | 0 | 70.9 Ų | 70.9 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62 | -49.5 | 177.1 | -162.7 | 0 | 0 | 0 | 0 | 111.3 | Y387 F390 A446 Y447 L448 F453 I454 | Y387-C450 HydrophobicContact CD2-CB 3.73Å; Y387-C450 VanDerWaalsContact CE2-CA 3.46Å; Y387-C450 HydrophobicContact CE2-CB 3.35Å; F390-C450 HydrophobicContact CD1-CB 3.87Å; F390-C450 HydrophobicContact CE1-CB 4.16Å; A446-C450 VanDerWaalsContact O-CB 3.31Å; A446-C450 WeakPolarHBondContact O-CB 3.42Å; A446-C450 PolarHBondContact O-N 3.36Å; Y447-C450 PolarHBondContact O-N 3.5Å; L448-C450 VanDerWaalsContact C-N 3.27Å; L448-C450 PolarHBondContact O-N 3.28Å; C450-F453 PolarHBondContact O-N 3.38Å; C450-I454 VanDerWaalsContact O-CG1 3.28Å; C450-I454 WeakPolarHBondContact O-CG1 3.37Å; C450-I454 PolarHBondContact O-N 3.49Å |
| 451 | T | 85.7 | Confident | 82.2 | Confident | 47 Ų | 47 | 66 Ų | 66 | 29% | 0.288 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.6 | -47.4 | -179 | -55.1 | 0 | 0 | 0 | 0 | 111.3 | Y447 L448 F453 I454 F455 | Y447-T451 WeakPolarHBondContact O-CB 2.98Å; Y447-T451 PolarHBondContact O-N 3.36Å; Y447-T451 PolarHBondContact O-OG1 3.25Å; L448-T451 PolarHBondContact O-N 3.17Å; T451-F453 VanDerWaalsContact C-N 3.28Å; T451-F453 PolarHBondContact O-N 2.97Å; T451-I454 PolarHBondContact O-N 3.09Å; T451-F455 HydrophobicContact CG2-CD2 3.78Å; T451-F455 HydrophobicContact CG2-CE2 3.6Å; T451-F455 WeakPolarHBondContact O-CD2 3.33Å; T451-F455 PolarHBondContact O-N 2.99Å; T451-F455 VanDerWaalsContact O-N 3.08Å |
| 452 | I | 87.8 | Confident | 82.6 | Confident | 100 Ų | 100 | 68.3 Ų | 68.3 | 51% | 0.513 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.1 | -42.6 | 175.9 | -67.4 | 169.9 | 0 | 0 | 0 | 110.3 | L448 F455 S456 | L448-I452 HydrophobicContact CD1-CD1 4.06Å; L448-I452 HydrophobicContact CD1-CG1 4.43Å; L448-I452 HydrophobicContact CD2-CD1 4.46Å; L448-I452 HydrophobicContact CG-CD1 3.83Å; L448-I452 VanDerWaalsContact O-CG1 3.31Å; L448-I452 WeakPolarHBondContact O-CG1 3.11Å; L448-I452 PolarHBondContact O-N 3.28Å; I452-F455 PolarHBondContact O-N 3.46Å; I452-S456 WeakPolarHBondContact O-CB 3.39Å; I452-S456 PolarHBondContact O-N 3.44Å |
| 453 | F | 87.2 | Confident | 82.9 | Confident | 50 Ų | 50 | 65.4 Ų | 65.4 | 22% | 0.219 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -66.1 | -41.9 | -179.6 | -168.8 | -84.2 | 0 | 0 | 0 | 112.5 | W123 M127 V128 Y449 C450 T451 F455 S456 | W123-F453 AromaticContact CE2-CE1 3.6Å; W123-F453 AromaticContact CE2-CZ 3.83Å; W123-F453 HydrophobicContact CH2-CZ 4.26Å; W123-F453 AromaticContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE2 4.15Å; W123-F453 AromaticContact CZ2-CZ 3.46Å; W123-F453 HydrophobicContact CZ2-CZ 3.46Å; W123-F453 VanDerWaalsContact CZ2-CZ 3.46Å; W123-F453 AromaticContact NE1-CD1 3.72Å; W123-F453 AromaticContact NE1-CE1 3.33Å; W123-F453 VanDerWaalsContact NE1-CE1 3.33Å; W123-F453 AromaticContact NE1-CZ 3.99Å; W123-F453 PolarHBondContact NE1-O 3.21Å; M127-F453 HydrophobicContact CB-CE1 3.49Å; M127-F453 VanDerWaalsContact CB-CE1 3.49Å; M127-F453 HydrophobicContact CB-CZ 3.49Å; M127-F453 VanDerWaalsContact CB-CZ 3.49Å; M127-F453 HydrophobicContact CE-CZ 4.33Å; M127-F453 HydrophobicContact CG-CE1 4.25Å; M127-F453 HydrophobicContact CG-CZ 4.06Å; V128-F453 HydrophobicContact CG2-CD1 3.35Å; V128-F453 HydrophobicContact CG2-CE1 3.52Å; V128-F453 HydrophobicContact CG2-CG 4.12Å; V128-F453 HydrophobicContact CG2-CZ 4.36Å; Y449-F453 WeakPolarHBondContact O-CB 3.28Å; Y449-F453 PolarHBondContact O-N 3.16Å; C450-F453 PolarHBondContact O-N 3.38Å; T451-F453 VanDerWaalsContact C-N 3.28Å; T451-F453 PolarHBondContact O-N 2.97Å; F453-F455 VanDerWaalsContact C-N 3.35Å; F453-F455 PolarHBondContact O-N 3.34Å; F453-S456 WeakPolarHBondContact O-CB 3.45Å; F453-S456 PolarHBondContact O-N 3.12Å; F453-S456 PolarHBondContact O-OG 3.5Å |
| 454 | I | 87.2 | Confident | 82.8 | Confident | 22 Ų | 22 | 64.2 Ų | 64.2 | 11% | 0.113 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -58.1 | -49.8 | 175.2 | -67.6 | 164.5 | 0 | 0 | 0 | 109.6 | L120 T124 F395 C450 T451 S456 G457 | L120-I454 WeakPolarHBondContact CD2-O 3.47Å; T124-I454 HydrophobicContact CG2-CD1 4.5Å; T124-I454 HydrophobicContact CG2-CG1 3.92Å; F395-I454 HydrophobicContact CZ-CG2 4.45Å; C450-I454 VanDerWaalsContact O-CG1 3.28Å; C450-I454 WeakPolarHBondContact O-CG1 3.37Å; C450-I454 PolarHBondContact O-N 3.49Å; T451-I454 PolarHBondContact O-N 3.09Å; I454-S456 VanDerWaalsContact C-N 3.33Å; I454-S456 PolarHBondContact O-N 3.42Å; I454-G457 PolarHBondContact O-N 2.97Å |
| 455 | F | 87.6 | Confident | 82.6 | Confident | 118 Ų | 118 | 62.3 Ų | 62.3 | 52% | 0.518 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -72.1 | -24.4 | -179.9 | -71.1 | -64.2 | 0 | 0 | 0 | 113.7 | T451 I452 F453 G457 L458 | T451-F455 HydrophobicContact CG2-CD2 3.78Å; T451-F455 HydrophobicContact CG2-CE2 3.6Å; T451-F455 WeakPolarHBondContact O-CD2 3.33Å; T451-F455 PolarHBondContact O-N 2.99Å; T451-F455 VanDerWaalsContact O-N 3.08Å; I452-F455 PolarHBondContact O-N 3.46Å; F453-F455 VanDerWaalsContact C-N 3.35Å; F453-F455 PolarHBondContact O-N 3.34Å; F455-G457 PolarHBondContact O-N 2.92Å; F455-G457 VanDerWaalsContact O-N 3.17Å; F455-L458 HydrophobicContact CD1-CD1 3.83Å; F455-L458 VanDerWaalsContact O-CB 3.25Å; F455-L458 WeakPolarHBondContact O-CB 3.35Å; F455-L458 PolarHBondContact O-N 2.86Å |
| 456 | S | 88.8 | Confident | 82.3 | Confident | 33 Ų | 33 | 61.1 Ų | 61.1 | 23% | 0.231 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.5 | -26.9 | 173.5 | 79.2 | 0 | 0 | 0 | 0 | 112.3 | I452 F453 I454 L458 I459 | I452-S456 WeakPolarHBondContact O-CB 3.39Å; I452-S456 PolarHBondContact O-N 3.44Å; F453-S456 WeakPolarHBondContact O-CB 3.45Å; F453-S456 PolarHBondContact O-N 3.12Å; F453-S456 PolarHBondContact O-OG 3.5Å; I454-S456 VanDerWaalsContact C-N 3.33Å; I454-S456 PolarHBondContact O-N 3.42Å; S456-L458 PolarHBondContact O-N 3.43Å; S456-I459 WeakPolarHBondContact O-CB 3.5Å; S456-I459 PolarHBondContact O-N 2.66Å; S456-I459 VanDerWaalsContact O-N 3.08Å |
| 457 | G | 84.3 | Confident | 82.2 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -56.8 | -34.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y119 I454 F455 I459 L460 Y461 | Y119-G457 VanDerWaalsContact CE1-O 3.22Å; Y119-G457 WeakPolarHBondContact CE1-O 3.3Å; I454-G457 PolarHBondContact O-N 2.97Å; F455-G457 PolarHBondContact O-N 2.92Å; F455-G457 VanDerWaalsContact O-N 3.17Å; G457-I459 VanDerWaalsContact C-N 3.26Å; G457-I459 PolarHBondContact O-N 2.89Å; G457-L460 PolarHBondContact O-N 2.97Å; G457-L460 VanDerWaalsContact O-N 3.12Å; G457-Y461 PolarHBondContact O-N 3.38Å |
| 458 | L | 85.1 | Confident | 81.8 | Confident | 45 Ų | 45 | 74.2 Ų | 74.2 | 24% | 0.236 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -60.9 | -36.4 | 177.2 | -65.6 | 177.5 | 0 | 0 | 0 | 112.3 | L116 L120 F455 S456 L460 Y461 F462 | L116-L458 HydrophobicContact CD1-CD2 3.58Å; L116-L458 HydrophobicContact CG-CD2 4.23Å; L120-L458 HydrophobicContact CD1-CD2 4.04Å; L120-L458 HydrophobicContact CD2-CD2 3.87Å; L120-L458 HydrophobicContact CD2-CG 3.99Å; L120-L458 HydrophobicContact CG-CD2 4.18Å; F455-L458 HydrophobicContact CD1-CD1 3.83Å; F455-L458 VanDerWaalsContact O-CB 3.25Å; F455-L458 WeakPolarHBondContact O-CB 3.35Å; F455-L458 PolarHBondContact O-N 2.86Å; S456-L458 PolarHBondContact O-N 3.43Å; L458-L460 PolarHBondContact O-N 3.18Å; L458-Y461 PolarHBondContact O-N 3.04Å; L458-F462 VanDerWaalsContact O-CD2 3.25Å; L458-F462 WeakPolarHBondContact O-CD2 3.43Å; L458-F462 PolarHBondContact O-N 3.15Å |
| 459 | I | 84.3 | Confident | 81.4 | Confident | 126 Ų | 126 | 71 Ų | 71 | 65% | 0.646 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -62.5 | -36.5 | 179.3 | -57.4 | 174.4 | 0 | 0 | 0 | 110.2 | S456 G457 P463 | S456-I459 WeakPolarHBondContact O-CB 3.5Å; S456-I459 PolarHBondContact O-N 2.66Å; S456-I459 VanDerWaalsContact O-N 3.08Å; G457-I459 VanDerWaalsContact C-N 3.26Å; G457-I459 PolarHBondContact O-N 2.89Å; I459-P463 WeakPolarHBondContact O-CD 3.2Å; I459-P463 VanDerWaalsContact O-CG 3.25Å; I459-P463 WeakPolarHBondContact O-CG 3.35Å |
| 460 | L | 81.2 | Confident | 80.8 | Confident | 65 Ų | 65 | 69.9 Ų | 69.9 | 34% | 0.34 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -83.2 | -30.2 | 177.3 | -64 | 177.7 | 0 | 0 | 0 | 112.6 | Y119 W123 G457 L458 P463 L464 | Y119-L460 WeakPolarHBondContact OH-CB 3.4Å; W123-L460 HydrophobicContact CE3-CD1 4.37Å; W123-L460 HydrophobicContact CH2-CD1 3.41Å; W123-L460 VanDerWaalsContact CH2-CD1 3.41Å; W123-L460 HydrophobicContact CZ2-CD1 4.18Å; W123-L460 HydrophobicContact CZ3-CD1 3.53Å; G457-L460 PolarHBondContact O-N 2.97Å; G457-L460 VanDerWaalsContact O-N 3.12Å; L458-L460 PolarHBondContact O-N 3.18Å; L460-P463 WeakPolarHBondContact O-CD 3.48Å; L460-L464 HydrophobicContact CB-CD1 4.11Å; L460-L464 HydrophobicContact CD2-CD1 4.44Å; L460-L464 WeakPolarHBondContact O-CB 3.41Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 3.48Å; L460-L464 VanDerWaalsContact O-N 3.14Å |
| 461 | Y | 81 | Confident | 80.6 | Confident | 15 Ų | 15 | 77.3 Ų | 77.3 | 6% | 0.059 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.3 | -48.9 | 177.9 | -179.4 | -102.3 | 0 | 0 | 0 | 112.8 | S115 L116 Y119 G457 L458 V465 Y466 | S115-Y461 PolarHBondContact OG-OH 2.89Å; S115-Y461 VanDerWaalsContact OG-OH 3.04Å; L116-Y461 HydrophobicContact CD1-CD1 3.43Å; L116-Y461 VanDerWaalsContact CD1-CD1 3.43Å; L116-Y461 HydrophobicContact CD1-CE1 3.37Å; L116-Y461 HydrophobicContact CD1-CE2 4.47Å; L116-Y461 HydrophobicContact CD1-CG 4.03Å; Y119-Y461 AromaticContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CG 4.06Å; Y119-Y461 AromaticContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CE2 4.47Å; Y119-Y461 HydrophobicContact CE1-CD2 4.15Å; Y119-Y461 HydrophobicContact CE1-CG 4.39Å; Y119-Y461 HydrophobicContact CE2-CD2 4.32Å; Y119-Y461 AromaticContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CE2 4.03Å; Y119-Y461 HydrophobicContact CG-CG 4.32Å; G457-Y461 PolarHBondContact O-N 3.38Å; L458-Y461 PolarHBondContact O-N 3.04Å; Y461-V465 HydrophobicContact CD2-CB 3.73Å; Y461-V465 HydrophobicContact CD2-CG1 4.06Å; Y461-V465 HydrophobicContact CD2-CG2 3.96Å; Y461-V465 HydrophobicContact CE2-CB 3.8Å; Y461-V465 HydrophobicContact CE2-CG1 3.6Å; Y461-V465 HydrophobicContact CE2-CG2 4.34Å; Y461-V465 HydrophobicContact CG-CB 4.45Å; Y461-V465 WeakPolarHBondContact O-CA 3.17Å; Y461-V465 WeakPolarHBondContact O-CB 3.12Å; Y461-V465 PolarHBondContact O-N 2.96Å; Y461-Y466 PolarHBondContact O-N 3.36Å |
| 462 | F | 79.4 | Confident | 80.1 | Confident | 114 Ų | 114 | 75.4 Ų | 75.4 | 50% | 0.5 | 36% | 0.357 | S | S | . | . | I | π-helix | trans | -58.4 | -50.9 | -177.1 | -81.9 | -71.7 | 0 | 0 | 0 | 114.3 | L458 Y466 K467 | L458-F462 VanDerWaalsContact O-CD2 3.25Å; L458-F462 WeakPolarHBondContact O-CD2 3.43Å; L458-F462 PolarHBondContact O-N 3.15Å; F462-Y466 HydrophobicContact CD1-CD1 4.32Å; F462-Y466 WeakPolarHBondContact O-CB 3.28Å; F462-K467 WeakPolarHBondContact O-CB 3.45Å; F462-K467 PolarHBondContact O-N 3.21Å |
| 463 | P | 75.5 | Confident | 79.6 | Confident | 33 Ų | 33 | 76.4 Ų | 76.4 | 21% | 0.214 | 36% | 0.355 | C | S | . | . | I | π-helix | trans | -76.5 | -38.1 | 179.9 | 27.2 | -33 | 0 | 0 | 0 | 113.5 | I459 L460 K468 A469 W471 | I459-P463 WeakPolarHBondContact O-CD 3.2Å; I459-P463 VanDerWaalsContact O-CG 3.25Å; I459-P463 WeakPolarHBondContact O-CG 3.35Å; L460-P463 WeakPolarHBondContact O-CD 3.48Å; P463-K468 PolarHBondContact O-N 2.88Å; P463-A469 PolarHBondContact O-N 3.12Å; P463-W471 HydrophobicContact CB-CZ2 4.11Å |
| 464 | L | 74.3 | Confident | 79.3 | Confident | 74 Ų | 74 | 82 Ų | 82 | 39% | 0.387 | 38% | 0.379 | S | S | . | . | I | π-helix | trans | -84.9 | -45.2 | -171.8 | -60.9 | 176.3 | 0 | 0 | 0 | 112.8 | L460 A472 | L460-L464 HydrophobicContact CB-CD1 4.11Å; L460-L464 HydrophobicContact CD2-CD1 4.44Å; L460-L464 WeakPolarHBondContact O-CB 3.41Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 3.48Å; L460-L464 VanDerWaalsContact O-N 3.14Å; L464-A472 HydrophobicContact CD2-CB 3.42Å; L464-A472 VanDerWaalsContact CD2-CB 3.42Å |
| 465 | V | 73.4 | Confident | 79.1 | Confident | 23 Ų | 23 | 85.2 Ų | 85.2 | 14% | 0.139 | 40% | 0.395 | C | S | . | . | I | π-helix | trans | -98.8 | -50.1 | -172.5 | -176.6 | 0 | 0 | 0 | 0 | 111.1 | Y119 Y461 K468 | Y119-V465 HydrophobicContact CD2-CG2 3.92Å; Y119-V465 HydrophobicContact CE2-CG2 3.8Å; Y461-V465 HydrophobicContact CD2-CB 3.73Å; Y461-V465 HydrophobicContact CD2-CG1 4.06Å; Y461-V465 HydrophobicContact CD2-CG2 3.96Å; Y461-V465 HydrophobicContact CE2-CB 3.8Å; Y461-V465 HydrophobicContact CE2-CG1 3.6Å; Y461-V465 HydrophobicContact CE2-CG2 4.34Å; Y461-V465 HydrophobicContact CG-CB 4.45Å; Y461-V465 WeakPolarHBondContact O-CA 3.17Å; Y461-V465 WeakPolarHBondContact O-CB 3.12Å; Y461-V465 PolarHBondContact O-N 2.96Å; V465-K468 WeakPolarHBondContact O-CG 3.49Å |
| 466 | Y | 74.8 | Confident | 78.9 | Confident | 163 Ų | 163 | 82.5 Ų | 82.5 | 64% | 0.639 | 39% | 0.385 | S | S | * | . | I | π-helix | trans | -75.5 | -55.2 | -174.7 | -173.4 | -101.8 | 0 | 0 | 0 | 112.7 | Y461 F462 | Y461-Y466 PolarHBondContact O-N 3.36Å; F462-Y466 HydrophobicContact CD1-CD1 4.32Å; F462-Y466 WeakPolarHBondContact O-CB 3.28Å |
| 467 | K | 73.9 | Confident | 78.7 | Confident | 162 Ų | 162 | 89.4 Ų | 89.4 | 70% | 0.704 | 41% | 0.406 | S | S | * | . | S | Bend | trans | -86 | -10.4 | -179.5 | -71.7 | -164.5 | 174.6 | -177.1 | 0 | 114.5 | F462 A469 | F462-K467 WeakPolarHBondContact O-CB 3.45Å; F462-K467 PolarHBondContact O-N 3.21Å; K467-A469 PolarHBondContact O-N 3.43Å; K467-A469 VanDerWaalsContact O-N 3.09Å |
| 468 | K | 73.4 | Confident | 78.9 | Confident | 139 Ų | 139 | 92.2 Ų | 92.2 | 60% | 0.604 | 42% | 0.424 | S | S | * | . | trans | 41.3 | 47.5 | -176.3 | -64.9 | -177.7 | 179.2 | 172.7 | 0 | 112.8 | P463 V465 N470 R473 | P463-K468 PolarHBondContact O-N 2.88Å; V465-K468 WeakPolarHBondContact O-CG 3.49Å; K468-N470 PolarHBondContact O-N 2.73Å; K468-R473 PolarHBondContact O-NE 3.37Å; K468-R473 PolarHBondContact O-NH2 2.89Å; K468-R473 VanDerWaalsContact O-NH2 3.09Å | ||
| 469 | A | 75.8 | Confident | 79 | Confident | 18 Ų | 18 | 93.8 Ų | 93.8 | 15% | 0.149 | 43% | 0.432 | C | S | . | . | trans | -56.5 | 137.1 | -166.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | P463 K467 W471 A472 R473 | P463-A469 PolarHBondContact O-N 3.12Å; K467-A469 PolarHBondContact O-N 3.43Å; K467-A469 VanDerWaalsContact O-N 3.09Å; A469-W471 VanDerWaalsContact C-N 3.3Å; A469-W471 HydrophobicContact CB-CG 4.39Å; A469-W471 VanDerWaalsContact CB-NE1 3.33Å; A469-W471 PolarHBondContact O-N 3.1Å; A469-A472 PolarHBondContact O-N 3.42Å; A469-R473 PolarHBondContact O-N 3.12Å | ||
| 470 | N | 72.3 | Confident | 79.1 | Confident | 121 Ų | 121 | 88.9 Ų | 88.9 | 65% | 0.647 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -64.4 | -33.8 | -175.2 | -72.9 | -16.9 | 0 | 0 | 0 | 112.7 | K468 R473 K474 | K468-N470 PolarHBondContact O-N 2.73Å; N470-R473 PolarHBondContact O-N 2.9Å; N470-R473 PolarHBondContact OD1-NH2 2.87Å; N470-K474 WeakPolarHBondContact O-CB 3.44Å; N470-K474 PolarHBondContact O-N 3.07Å |
| 471 | W | 80.5 | Confident | 79.3 | Confident | 155 Ų | 155 | 90.7 Ų | 90.7 | 59% | 0.587 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -63 | -42.4 | 177.6 | 68.1 | -97.5 | 0 | 0 | 0 | 111.8 | P463 A469 R473 K474 I475 | P463-W471 HydrophobicContact CB-CZ2 4.11Å; A469-W471 VanDerWaalsContact C-N 3.3Å; A469-W471 HydrophobicContact CB-CG 4.39Å; A469-W471 VanDerWaalsContact CB-NE1 3.33Å; A469-W471 PolarHBondContact O-N 3.1Å; W471-R473 PolarHBondContact O-N 2.78Å; W471-K474 WeakPolarHBondContact O-CB 3.44Å; W471-K474 PolarHBondContact O-N 3.38Å; W471-K474 VanDerWaalsContact O-N 3.12Å; W471-I475 HydrophobicContact CE3-CD1 3.74Å; W471-I475 HydrophobicContact CZ3-CD1 4.02Å; W471-I475 WeakPolarHBondContact O-CG1 3.43Å; W471-I475 PolarHBondContact O-N 3.02Å |
| 472 | A | 75.3 | Confident | 79.8 | Confident | 7 Ų | 7 | 95.8 Ų | 95.8 | 6% | 0.058 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -64.4 | -42.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | L464 A469 K474 I475 M476 | L464-A472 HydrophobicContact CD2-CB 3.42Å; L464-A472 VanDerWaalsContact CD2-CB 3.42Å; A469-A472 PolarHBondContact O-N 3.42Å; A472-K474 VanDerWaalsContact C-N 3.3Å; A472-K474 PolarHBondContact O-N 3.19Å; A472-I475 PolarHBondContact O-N 2.87Å; A472-M476 WeakPolarHBondContact O-CB 3.3Å; A472-M476 VanDerWaalsContact O-CG 3.27Å; A472-M476 WeakPolarHBondContact O-CG 3.42Å; A472-M476 PolarHBondContact O-N 3.17Å |
| 473 | R | 75.6 | Confident | 80.2 | Confident | 121 Ų | 121 | 93.2 Ų | 93.2 | 46% | 0.457 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.1 | -36.5 | 173.2 | -78.1 | -172.6 | -80.3 | 165.1 | -7.3 | 112.5 | K468 A469 N470 W471 I475 R477 | K468-R473 PolarHBondContact O-NE 3.37Å; K468-R473 PolarHBondContact O-NH2 2.89Å; K468-R473 VanDerWaalsContact O-NH2 3.09Å; A469-R473 PolarHBondContact O-N 3.12Å; N470-R473 PolarHBondContact O-N 2.9Å; N470-R473 PolarHBondContact OD1-NH2 2.87Å; W471-R473 PolarHBondContact O-N 2.78Å; R473-I475 VanDerWaalsContact C-N 3.34Å; R473-R477 WeakPolarHBondContact O-CB 3.3Å; R473-R477 VanDerWaalsContact O-CG 3.25Å; R473-R477 WeakPolarHBondContact O-CG 3.31Å; R473-R477 PolarHBondContact O-N 3.04Å; R473-R477 VanDerWaalsContact O-N 3.07Å |
| 474 | K | 81.4 | Confident | 80.7 | Confident | 169 Ų | 169 | 94.5 Ų | 94.5 | 74% | 0.735 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -67.1 | -33.8 | 178.3 | -163.7 | 175.9 | -178.4 | -178.5 | 0 | 112.2 | N470 W471 A472 P478 | N470-K474 WeakPolarHBondContact O-CB 3.44Å; N470-K474 PolarHBondContact O-N 3.07Å; W471-K474 WeakPolarHBondContact O-CB 3.44Å; W471-K474 PolarHBondContact O-N 3.38Å; W471-K474 VanDerWaalsContact O-N 3.12Å; A472-K474 VanDerWaalsContact C-N 3.3Å; A472-K474 PolarHBondContact O-N 3.19Å; K474-P478 WeakPolarHBondContact O-CD 3.48Å; K474-P478 WeakPolarHBondContact O-CG 3.06Å |
| 475 | I | 84.4 | Confident | 81.4 | Confident | 88 Ų | 88 | 97.1 Ų | 97.1 | 45% | 0.451 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -78 | -44.8 | 174.7 | -64.1 | 174.1 | 0 | 0 | 0 | 111.4 | W471 A472 R473 R477 P478 I479 | W471-I475 HydrophobicContact CE3-CD1 3.74Å; W471-I475 HydrophobicContact CZ3-CD1 4.02Å; W471-I475 WeakPolarHBondContact O-CG1 3.43Å; W471-I475 PolarHBondContact O-N 3.02Å; A472-I475 PolarHBondContact O-N 2.87Å; R473-I475 VanDerWaalsContact C-N 3.34Å; I475-R477 PolarHBondContact O-N 2.74Å; I475-P478 VanDerWaalsContact O-CD 3.23Å; I475-P478 WeakPolarHBondContact O-CD 2.88Å; I475-P478 VanDerWaalsContact O-CG 3.27Å; I475-P478 WeakPolarHBondContact O-CG 3.2Å; I475-I479 HydrophobicContact CG2-CD1 3.94Å; I475-I479 WeakPolarHBondContact O-CG1 3.45Å |
| 476 | M | 82.4 | Confident | 82.1 | Confident | 61 Ų | 61 | 102.5 Ų | 102.5 | 30% | 0.3 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -73.2 | -29.8 | -173.5 | -68.8 | -54.9 | -66 | 0 | 0 | 113.7 | V348 A472 I479 T480 | V348-M476 HydrophobicContact CB-CE 4.17Å; V348-M476 HydrophobicContact CG1-CE 3.25Å; V348-M476 HydrophobicContact CG2-CE 3.78Å; A472-M476 WeakPolarHBondContact O-CB 3.3Å; A472-M476 VanDerWaalsContact O-CG 3.27Å; A472-M476 WeakPolarHBondContact O-CG 3.42Å; A472-M476 PolarHBondContact O-N 3.17Å; M476-I479 HydrophobicContact SD-CD1 4.44Å; M476-T480 VanDerWaalsContact O-CB 3.28Å; M476-T480 WeakPolarHBondContact O-CB 3.39Å; M476-T480 PolarHBondContact O-N 2.65Å; M476-T480 PolarHBondContact O-OG1 3.38Å |
| 477 | R | 83.9 | Confident | 82.6 | Confident | 178 Ų | 178 | 96.2 Ų | 96.2 | 67% | 0.672 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -59 | -54.4 | 177.9 | -83.3 | 178.3 | 177 | -174.2 | -1.5 | 113.9 | R473 I475 I479 T480 M481 | R473-R477 WeakPolarHBondContact O-CB 3.3Å; R473-R477 VanDerWaalsContact O-CG 3.25Å; R473-R477 WeakPolarHBondContact O-CG 3.31Å; R473-R477 PolarHBondContact O-N 3.04Å; R473-R477 VanDerWaalsContact O-N 3.07Å; I475-R477 PolarHBondContact O-N 2.74Å; R477-I479 VanDerWaalsContact C-N 3.33Å; R477-I479 PolarHBondContact O-N 2.8Å; R477-T480 PolarHBondContact O-N 2.74Å; R477-M481 PolarHBondContact O-N 3.39Å |
| 478 | P | 88.1 | Confident | 83.2 | Confident | 59 Ų | 59 | 92.8 Ų | 92.8 | 38% | 0.383 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.4 | -39.3 | 179.7 | 22.3 | -32.3 | 0 | 0 | 0 | 111.9 | K474 I475 T480 M481 H482 | K474-P478 WeakPolarHBondContact O-CD 3.48Å; K474-P478 WeakPolarHBondContact O-CG 3.06Å; I475-P478 VanDerWaalsContact O-CD 3.23Å; I475-P478 WeakPolarHBondContact O-CD 2.88Å; I475-P478 VanDerWaalsContact O-CG 3.27Å; I475-P478 WeakPolarHBondContact O-CG 3.2Å; P478-T480 VanDerWaalsContact C-N 3.34Å; P478-T480 PolarHBondContact O-N 2.98Å; P478-M481 PolarHBondContact O-N 3.07Å; P478-H482 PolarHBondContact O-N 3.2Å; P478-H482 PolarHBondContact O-ND1 3.13Å |
| 479 | I | 87.3 | Confident | 83.7 | Confident | 78 Ų | 78 | 86.3 Ų | 86.3 | 40% | 0.4 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.1 | -47.5 | 174.9 | -63.7 | 171.5 | 0 | 0 | 0 | 110.2 | I475 M476 R477 M481 H482 L483 | I475-I479 HydrophobicContact CG2-CD1 3.94Å; I475-I479 WeakPolarHBondContact O-CG1 3.45Å; M476-I479 HydrophobicContact SD-CD1 4.44Å; R477-I479 VanDerWaalsContact C-N 3.33Å; R477-I479 PolarHBondContact O-N 2.8Å; I479-M481 VanDerWaalsContact C-N 3.32Å; I479-M481 PolarHBondContact O-N 2.75Å; I479-H482 PolarHBondContact O-N 2.65Å; I479-L483 HydrophobicContact CG2-CD1 3.75Å; I479-L483 HydrophobicContact CG2-CG 4.38Å; I479-L483 WeakPolarHBondContact O-CB 3.41Å; I479-L483 WeakPolarHBondContact O-CG 3.43Å; I479-L483 PolarHBondContact O-N 2.96Å |
| 480 | T | 86.6 | Confident | 84.2 | Confident | 23 Ų | 23 | 87.7 Ų | 87.7 | 14% | 0.141 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -59.7 | -45.2 | 179 | -56.7 | 0 | 0 | 0 | 0 | 110.8 | I350 Y353 M476 R477 P478 Q484 | I350-T480 HydrophobicContact CB-CG2 4.23Å; I350-T480 HydrophobicContact CD1-CG2 4.44Å; I350-T480 HydrophobicContact CG1-CG2 4.41Å; Y353-T480 HydrophobicContact CE2-CG2 4.07Å; M476-T480 VanDerWaalsContact O-CB 3.28Å; M476-T480 WeakPolarHBondContact O-CB 3.39Å; M476-T480 PolarHBondContact O-N 2.65Å; M476-T480 PolarHBondContact O-OG1 3.38Å; R477-T480 PolarHBondContact O-N 2.74Å; P478-T480 VanDerWaalsContact C-N 3.34Å; P478-T480 PolarHBondContact O-N 2.98Å; T480-Q484 WeakPolarHBondContact O-CB 3.27Å; T480-Q484 PolarHBondContact O-N 3.46Å |
| 481 | M | 87.1 | Confident | 84.6 | Confident | 103 Ų | 103 | 85 Ų | 85 | 51% | 0.507 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.3 | -45.4 | 179.9 | -170.3 | -174.7 | 78.8 | 0 | 0 | 112.6 | R477 P478 I479 Q484 L485 | R477-M481 PolarHBondContact O-N 3.39Å; P478-M481 PolarHBondContact O-N 3.07Å; I479-M481 VanDerWaalsContact C-N 3.32Å; I479-M481 PolarHBondContact O-N 2.75Å; M481-Q484 WeakPolarHBondContact O-CB 3.35Å; M481-Q484 PolarHBondContact O-N 3Å; M481-L485 HydrophobicContact CG-CD1 4.38Å; M481-L485 WeakPolarHBondContact O-CG 3.49Å; M481-L485 PolarHBondContact O-N 2.69Å |
| 482 | H | 90.1 | Very high | 84.2 | Confident | 123 Ų | 123 | 79.3 Ų | 79.3 | 57% | 0.569 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -63.9 | -46.4 | 179 | -77.9 | 79.1 | 0 | 0 | 0 | 111.6 | P478 I479 Q484 L485 L486 | P478-H482 PolarHBondContact O-N 3.2Å; P478-H482 PolarHBondContact O-ND1 3.13Å; I479-H482 PolarHBondContact O-N 2.65Å; H482-Q484 VanDerWaalsContact C-N 3.29Å; H482-Q484 PolarHBondContact O-N 3.42Å; H482-L485 PolarHBondContact O-N 2.97Å; H482-L486 VanDerWaalsContact O-CB 3.24Å; H482-L486 WeakPolarHBondContact O-CB 3.26Å; H482-L486 PolarHBondContact O-N 3.46Å |
| 483 | L | 87.4 | Confident | 83.7 | Confident | 59 Ų | 59 | 87 Ų | 87 | 31% | 0.309 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.9 | -32.7 | 177.5 | -73.4 | 177.4 | 0 | 0 | 0 | 111.9 | I350 I479 L486 M487 | I350-L483 HydrophobicContact CD1-CB 3.1Å; I350-L483 HydrophobicContact CD1-CD1 3.64Å; I350-L483 HydrophobicContact CD1-CG 4.02Å; I479-L483 HydrophobicContact CG2-CD1 3.75Å; I479-L483 HydrophobicContact CG2-CG 4.38Å; I479-L483 WeakPolarHBondContact O-CB 3.41Å; I479-L483 WeakPolarHBondContact O-CG 3.43Å; I479-L483 PolarHBondContact O-N 2.96Å; L483-L486 HydrophobicContact CD2-CD2 4.45Å; L483-M487 HydrophobicContact CB-CE 3.67Å; L483-M487 HydrophobicContact CD2-CE 3.99Å; L483-M487 HydrophobicContact CG-CE 4.3Å; L483-M487 WeakPolarHBondContact O-CB 3.22Å; L483-M487 WeakPolarHBondContact O-CE 3.31Å; L483-M487 PolarHBondContact O-N 3.44Å |
| 484 | Q | 87.4 | Confident | 82.6 | Confident | 60 Ų | 60 | 90.5 Ų | 90.5 | 28% | 0.28 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.5 | -46.4 | 175 | -169 | -179.1 | -18.2 | 0 | 0 | 111.6 | Y353 T480 M481 H482 E488 V489 | Y353-Q484 HydrophobicContact CD2-CG 4.19Å; Y353-Q484 HydrophobicContact CE2-CB 4.41Å; Y353-Q484 HydrophobicContact CE2-CG 4Å; T480-Q484 WeakPolarHBondContact O-CB 3.27Å; T480-Q484 PolarHBondContact O-N 3.46Å; M481-Q484 WeakPolarHBondContact O-CB 3.35Å; M481-Q484 PolarHBondContact O-N 3Å; H482-Q484 VanDerWaalsContact C-N 3.29Å; H482-Q484 PolarHBondContact O-N 3.42Å; Q484-E488 WeakPolarHBondContact O-CA 3.35Å; Q484-E488 PolarHBondContact O-N 3.24Å; Q484-E488 VanDerWaalsContact O-N 3.08Å; Q484-V489 HydrophobicContact CB-CG2 4.47Å; Q484-V489 HydrophobicContact CG-CG2 4.27Å; Q484-V489 WeakPolarHBondContact CG-O 3.44Å; Q484-V489 PolarHBondContact NE2-O 2.91Å; Q484-V489 PolarHBondContact O-N 3.46Å |
| 485 | L | 88.1 | Confident | 80.7 | Confident | 129 Ų | 129 | 88.3 Ų | 88.3 | 68% | 0.675 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -68.1 | -43.3 | 176.5 | -68.9 | 170.1 | 0 | 0 | 0 | 111.8 | M481 H482 M487 | M481-L485 HydrophobicContact CG-CD1 4.38Å; M481-L485 WeakPolarHBondContact O-CG 3.49Å; M481-L485 PolarHBondContact O-N 2.69Å; H482-L485 PolarHBondContact O-N 2.97Å; L485-M487 VanDerWaalsContact C-N 3.34Å; L485-M487 PolarHBondContact O-N 3.43Å |
| 486 | L | 88.6 | Confident | 78.1 | Confident | 137 Ų | 137 | 96.5 Ų | 96.5 | 72% | 0.717 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.3 | -39.9 | -179 | -177.9 | 66.6 | 0 | 0 | 0 | 112.6 | H482 L483 | H482-L486 VanDerWaalsContact O-CB 3.24Å; H482-L486 WeakPolarHBondContact O-CB 3.26Å; H482-L486 PolarHBondContact O-N 3.46Å; L483-L486 HydrophobicContact CD2-CD2 4.45Å |
| 487 | M | 84.4 | Confident | 77.8 | Confident | 31 Ų | 31 | 98.3 Ų | 98.3 | 15% | 0.153 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -100 | -0.8 | -174.6 | -68 | -175.4 | -77 | 0 | 0 | 113.9 | I350 L362 P363 L366 L483 L485 V489 | I350-M487 HydrophobicContact CD1-CE 4.16Å; L362-M487 HydrophobicContact CD2-CB 4.01Å; L362-M487 HydrophobicContact CD2-CG 4.23Å; L362-M487 HydrophobicContact CD2-SD 4.42Å; L362-M487 HydrophobicContact CG-SD 4.37Å; P363-M487 HydrophobicContact CB-CE 4Å; P363-M487 HydrophobicContact CB-SD 4.33Å; P363-M487 HydrophobicContact CG-CE 3.85Å; P363-M487 HydrophobicContact CG-SD 4.09Å; L366-M487 HydrophobicContact CD1-SD 3.86Å; L483-M487 HydrophobicContact CB-CE 3.67Å; L483-M487 HydrophobicContact CD2-CE 3.99Å; L483-M487 HydrophobicContact CG-CE 4.3Å; L483-M487 WeakPolarHBondContact O-CB 3.22Å; L483-M487 WeakPolarHBondContact O-CE 3.31Å; L483-M487 PolarHBondContact O-N 3.44Å; L485-M487 VanDerWaalsContact C-N 3.34Å; L485-M487 PolarHBondContact O-N 3.43Å; M487-V489 HydrophobicContact CB-CG1 3.83Å; M487-V489 HydrophobicContact CB-CG2 4.13Å; M487-V489 PolarHBondContact O-N 3.26Å |
| 488 | E | 86.6 | Confident | 77.5 | Confident | 90 Ų | 90 | 94.1 Ų | 94.1 | 42% | 0.421 | 48% | 0.479 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 49.2 | 45.8 | -174.3 | -60.2 | 180 | 171.5 | 0 | 0 | 112.6 | L356 K357 Q484 | L356-E488 PolarHBondContact N-O 3.32Å; L356-E488 VanDerWaalsContact N-O 3.16Å; K357-E488 WeakPolarHBondContact CD-OE2 3.29Å; K357-E488 WeakPolarHBondContact CE-OE2 3.34Å; K357-E488 VanDerWaalsContact NZ-CD 3.31Å; K357-E488 IonicContact NZ-OE1 2.65Å; K357-E488 PolarHBondContact NZ-OE1 3.31Å; K357-E488 IonicContact NZ-OE2 3.06Å; K357-E488 PolarHBondContact NZ-OE2 2.9Å; Q484-E488 WeakPolarHBondContact O-CA 3.35Å; Q484-E488 PolarHBondContact O-N 3.24Å; Q484-E488 VanDerWaalsContact O-N 3.08Å |
| 489 | V | 85.2 | Confident | 76.9 | Confident | 2 Ų | 2 | 96.1 Ų | 96.1 | 1% | 0.012 | 49% | 0.485 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 150.3 | -178 | -66.8 | 0 | 0 | 0 | 0 | 110.9 | Y353 I354 L362 P363 Q484 M487 | Y353-V489 HydrophobicContact CD2-CB 4.48Å; Y353-V489 HydrophobicContact CD2-CG2 3.88Å; Y353-V489 HydrophobicContact CG-CG2 4.47Å; I354-V489 CarbonylContact O-C 3.57Å; I354-V489 WeakPolarHBondContact O-CA 3.34Å; L362-V489 HydrophobicContact CB-CG1 4.4Å; P363-V489 HydrophobicContact CG-CB 4.42Å; P363-V489 HydrophobicContact CG-CG1 3.94Å; P363-V489 HydrophobicContact CG-CG2 4.13Å; Q484-V489 HydrophobicContact CB-CG2 4.47Å; Q484-V489 HydrophobicContact CG-CG2 4.27Å; Q484-V489 WeakPolarHBondContact CG-O 3.44Å; Q484-V489 PolarHBondContact NE2-O 2.91Å; Q484-V489 PolarHBondContact O-N 3.46Å; M487-V489 HydrophobicContact CB-CG1 3.83Å; M487-V489 HydrophobicContact CB-CG2 4.13Å; M487-V489 PolarHBondContact O-N 3.26Å |
| 490 | V | 85.1 | Confident | 76.3 | Confident | 47 Ų | 47 | 97.1 Ų | 97.1 | 29% | 0.285 | 49% | 0.49 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.1 | 152.5 | 177.8 | -69.7 | 0 | 0 | 0 | 0 | 111 | Y353 I354 L356 | Y353-V490 WeakPolarHBondContact CA-O 3.49Å; Y353-V490 WeakPolarHBondContact CB-O 3.25Å; I354-V490 PolarHBondContact N-O 3.06Å; I354-V490 PolarHBondContact O-N 3.39Å; L356-V490 HydrophobicContact CD1-CG1 3.73Å; L356-V490 HydrophobicContact CD2-CB 4.25Å; L356-V490 HydrophobicContact CD2-CG1 3.77Å; L356-V490 HydrophobicContact CD2-CG2 3.47Å; L356-V490 VanDerWaalsContact CD2-CG2 3.47Å; L356-V490 HydrophobicContact CG-CB 4.39Å; L356-V490 HydrophobicContact CG-CG1 3.7Å; L356-V490 HydrophobicContact CG-CG2 3.84Å |
| 491 | P | 81.7 | Confident | 75.7 | Confident | 65 Ų | 65 | 101.8 Ų | 101.8 | 42% | 0.422 | 51% | 0.512 | S | S | . | . | P | Polyproline II helix | trans | -58.8 | 140.7 | 166.8 | 25 | -32.4 | 0 | 0 | 0 | 109.6 | Y353 | Y353-P491 HydrophobicContact CD1-CB 4.16Å; Y353-P491 HydrophobicContact CE1-CB 3.78Å |
| 492 | P | 70.9 | Confident | 74.9 | Confident | 35 Ų | 35 | 101.7 Ų | 101.7 | 23% | 0.227 | 51% | 0.512 | C | S | . | . | P | Polyproline II helix | trans | -60 | 142.1 | 172 | 30 | -38.6 | 0 | 0 | 0 | 109.7 | Y339 S352 I354 K494 | Y339-P492 HydrophobicContact CE2-CB 3.71Å; Y339-P492 HydrophobicContact CE2-CG 3.5Å; Y339-P492 VanDerWaalsContact CE2-CG 3.5Å; S352-P492 WeakPolarHBondContact O-CD 3.37Å; I354-P492 HydrophobicContact CD1-CB 4.11Å; P492-K494 PolarHBondContact O-N 3.43Å |
| 493 | E | 65.4 | Low | 73.9 | Confident | 169 Ų | 169 | 100.1 Ų | 100.1 | 79% | 0.79 | 51% | 0.508 | S | S | * | . | P | Polyproline II helix | trans | -56.4 | 125.7 | 171.3 | -73.5 | -179.8 | 166 | 0 | 0 | 109 | T495 | E493-T495 PolarHBondContact O-N 2.91Š|
| 494 | K | 52.4 | Low | 72.8 | Confident | 195 Ų | 195 | 103.3 Ų | 103.3 | 85% | 0.848 | 52% | 0.523 | S | S | * | . | P | Polyproline II helix | trans | -71.6 | 123.1 | 175.1 | -74.8 | -178.2 | 175 | -175.4 | 0 | 107.6 | P492 E496 | P492-K494 PolarHBondContact O-N 3.43Å; K494-E496 PolarHBondContact O-N 3.49Å |
| 495 | T | 42.3 | Very low | 71.6 | Confident | 123 Ų | 123 | 106.9 Ų | 106.9 | 76% | 0.755 | 54% | 0.543 | S | S | * | . | trans | -63.9 | 109.1 | 155.9 | -4.1 | 0 | 0 | 0 | 0 | 106 | E493 | E493-T495 PolarHBondContact O-N 2.91Š| ||
| 496 | E | 28.5 | Very low | 70.1 | Confident | 260 Ų | 260 | 104.9 Ų | 104.9 | 100% | 1.215 | 53% | 0.531 | S | S | * | . | trans | -66.2 | 0 | 166.1 | -74.5 | -169.7 | 155.9 | 0 | 0 | 111 | K494 | K494-E496 PolarHBondContact O-N 3.49Š|
Retrieved 496 of 496 residues in 862.2 ms
(Link to these results)