| 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 | 48 | Very low | 67 | Low | 228 Ų | 228 | 120.2 Ų | 120.2 | 100% | 1.123 | 64% | 0.636 | S | S | * | * | 0 | 128.9 | 0 | -73.1 | 179.6 | 175.2 | 0 | 0 | 107.5 | |||||
| 2 | P | 57.4 | Low | 68.8 | Low | 119 Ų | 119 | 117.1 Ų | 117.1 | 77% | 0.773 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 140.5 | 170.8 | 23.7 | -30.2 | 0 | 0 | 0 | 109 | K4 | P2-K4 PolarHBondContact O-N 3.31Š|
| 3 | P | 60.7 | Low | 70.2 | Confident | 117 Ų | 117 | 110.1 Ų | 110.1 | 76% | 0.76 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 129 | -177 | 20.9 | -30.1 | 0 | 0 | 0 | 109.5 | L5 | P3-L5 PolarHBondContact O-N 3.05Å; P3-L5 VanDerWaalsContact O-N 3.13Å |
| 4 | K | 60.8 | Low | 71.5 | Confident | 194 Ų | 194 | 111.6 Ų | 111.6 | 84% | 0.843 | 58% | 0.578 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 117.2 | 171.7 | -72.4 | 176.9 | 179.7 | 172.9 | 0 | 106.4 | P2 D6 | P2-K4 PolarHBondContact O-N 3.31Å; K4-D6 PolarHBondContact O-N 3.21Å |
| 5 | L | 58.8 | Low | 72.5 | Confident | 90 Ų | 90 | 104.7 Ų | 104.7 | 47% | 0.471 | 54% | 0.542 | S | S | . | . | P | Polyproline II helix | trans | -60.3 | 127 | 175.1 | -87.4 | 94.1 | 0 | 0 | 0 | 109.1 | P3 K11 L35 | P3-L5 PolarHBondContact O-N 3.05Å; P3-L5 VanDerWaalsContact O-N 3.13Å; L5-K11 HydrophobicContact CD2-CD 3.92Å; L5-L35 HydrophobicContact CD2-CD2 3.98Å |
| 6 | D | 67.9 | Low | 73.3 | Confident | 116 Ų | 116 | 111.1 Ų | 111.1 | 62% | 0.62 | 56% | 0.558 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 125.1 | 172.8 | -70.1 | -43.2 | 0 | 0 | 0 | 109.4 | K4 N8 E9 | K4-D6 PolarHBondContact O-N 3.21Å; D6-N8 PolarHBondContact O-N 3.02Å; D6-N8 VanDerWaalsContact O-N 3.16Å; D6-E9 HydrophobicContact CB-CB 4.29Å; D6-E9 WeakPolarHBondContact O-CB 3.42Å; D6-E9 PolarHBondContact O-N 3Å; D6-E9 VanDerWaalsContact O-N 3.1Å |
| 7 | P | 65.2 | Low | 73.9 | Confident | 83 Ų | 83 | 105.3 Ų | 105.3 | 54% | 0.539 | 53% | 0.53 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -26.3 | -172.6 | 18.3 | -28.6 | 0 | 0 | 0 | 113.7 | N66 | P7-N66 WeakPolarHBondContact CB-OD1 3.29Å; P7-N66 PolarHBondContact O-N 3.06Å; P7-N66 PolarHBondContact O-OD1 3.25Å |
| 8 | N | 72.3 | Confident | 74.4 | Confident | 133 Ų | 133 | 101.1 Ų | 101.1 | 71% | 0.711 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.6 | -0.8 | 179.9 | -71.6 | -18.3 | 0 | 0 | 0 | 114.2 | D6 I10 | D6-N8 PolarHBondContact O-N 3.02Å; D6-N8 VanDerWaalsContact O-N 3.16Å; N8-I10 PolarHBondContact O-N 3.25Å |
| 9 | E | 78.3 | Confident | 74.8 | Confident | 96 Ų | 96 | 95.8 Ų | 95.8 | 45% | 0.449 | 48% | 0.484 | S | S | . | . | trans | -72.7 | 116.4 | 179.6 | -164 | -170.7 | 167.8 | 0 | 0 | 110.3 | D6 K11 | D6-E9 HydrophobicContact CB-CB 4.29Å; D6-E9 WeakPolarHBondContact O-CB 3.42Å; D6-E9 PolarHBondContact O-N 3Å; D6-E9 VanDerWaalsContact O-N 3.1Å; E9-K11 HydrophobicContact CG-CG 4.47Å; E9-K11 PolarHBondContact O-N 3.22Å; E9-K11 WeakPolarHBondContact OE1-CE 3.46Å; E9-K11 IonicContact OE1-NZ 2.69Å; E9-K11 WeakPolarHBondContact OE2-CE 3.47Å; E9-K11 IonicContact OE2-NZ 2.85Å; E9-K11 PolarHBondContact OE2-NZ 3.07Å | ||
| 10 | I | 83.2 | Confident | 75.1 | Confident | 95 Ų | 95 | 92.3 Ų | 92.3 | 49% | 0.487 | 47% | 0.472 | S | S | . | . | trans | -76.5 | 109.7 | 176.3 | -49.2 | -179.4 | 0 | 0 | 0 | 108.5 | N8 I12 T63 Q65 | N8-I10 PolarHBondContact O-N 3.25Å; I10-I12 HydrophobicContact CG2-CG1 4.39Å; I10-T63 HydrophobicContact CG2-CG2 3.49Å; I10-T63 VanDerWaalsContact CG2-CG2 3.49Å; I10-Q65 HydrophobicContact CB-CG 4.22Å; I10-Q65 HydrophobicContact CG1-CG 3.91Å; I10-Q65 HydrophobicContact CG2-CG 4.04Å | ||
| 11 | K | 84 | Confident | 75.4 | Confident | 51 Ų | 51 | 93.2 Ų | 93.2 | 22% | 0.222 | 48% | 0.475 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.5 | 116.7 | 176 | -66.4 | -172.1 | -179.9 | -171.4 | 0 | 110.3 | L5 E9 L35 I64 | L5-K11 HydrophobicContact CD2-CD 3.92Å; E9-K11 HydrophobicContact CG-CG 4.47Å; E9-K11 PolarHBondContact O-N 3.22Å; E9-K11 WeakPolarHBondContact OE1-CE 3.46Å; E9-K11 IonicContact OE1-NZ 2.69Å; E9-K11 WeakPolarHBondContact OE2-CE 3.47Å; E9-K11 IonicContact OE2-NZ 2.85Å; E9-K11 PolarHBondContact OE2-NZ 3.07Å; K11-L35 HydrophobicContact CD-CD2 3.58Å; K11-I64 HydrophobicContact CB-CB 4.4Å; K11-I64 PolarHBondContact N-O 3.31Å; K11-I64 PolarHBondContact O-N 3.1Å |
| 12 | I | 88.5 | Confident | 77 | Confident | 83 Ų | 83 | 86.4 Ų | 86.4 | 43% | 0.426 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 117 | 176.1 | -59.6 | 173.9 | 0 | 0 | 0 | 108.3 | I10 Y14 K61 L62 | I10-I12 HydrophobicContact CG2-CG1 4.39Å; I12-Y14 HydrophobicContact CG2-CD2 4.29Å; I12-Y14 HydrophobicContact CG2-CE2 3.67Å; I12-K61 HydrophobicContact CG2-CD 4.16Å; I12-K61 VanDerWaalsContact CG2-CE 3.46Å; I12-K61 HydrophobicContact CG2-CG 3.7Å; I12-L62 CarbonylContact C-O 3.57Å; I12-L62 WeakPolarHBondContact CA-O 3.26Å |
| 13 | V | 87.6 | Confident | 77.8 | Confident | 26 Ų | 26 | 81.5 Ų | 81.5 | 16% | 0.158 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 123.9 | 177.4 | -178.1 | 0 | 0 | 0 | 0 | 109.6 | L15 K31 L35 L62 I64 | V13-L15 HydrophobicContact CG1-CD1 4Å; V13-L15 HydrophobicContact CG1-CG 4.5Å; V13-K31 HydrophobicContact CG1-CB 4.35Å; V13-K31 HydrophobicContact CG1-CD 4.37Å; V13-L35 HydrophobicContact CG2-CD1 3.77Å; V13-L62 HydrophobicContact CB-CB 4.39Å; V13-L62 PolarHBondContact N-O 3.16Å; V13-L62 PolarHBondContact O-N 3.27Å; V13-I64 HydrophobicContact CG2-CD1 4.05Å |
| 14 | Y | 88.5 | Confident | 78.8 | Confident | 131 Ų | 131 | 78.6 Ų | 78.6 | 51% | 0.514 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | 127.5 | 171.7 | -64.4 | -82.5 | 0 | 0 | 0 | 110.8 | I12 K31 K61 V74 | I12-Y14 HydrophobicContact CG2-CD2 4.29Å; I12-Y14 HydrophobicContact CG2-CE2 3.67Å; Y14-K31 PolarHBondContact O-NZ 2.97Å; Y14-K61 HydrophobicContact CD1-CB 4.04Å; Y14-K61 HydrophobicContact CD1-CG 4.24Å; Y14-K61 HydrophobicContact CE1-CB 3.75Å; Y14-K61 HydrophobicContact CE1-CD 3.96Å; Y14-K61 HydrophobicContact CE1-CG 3.66Å; Y14-V74 HydrophobicContact CD1-CG2 4.32Å; Y14-V74 HydrophobicContact CE1-CG2 4.1Å |
| 15 | L | 86.4 | Confident | 79.8 | Confident | 8 Ų | 8 | 72.8 Ų | 72.8 | 4% | 0.042 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.3 | 135.7 | -177 | -108.3 | 150.5 | 0 | 0 | 0 | 110.4 | V13 L28 K31 I32 T59 V60 L62 | V13-L15 HydrophobicContact CG1-CD1 4Å; V13-L15 HydrophobicContact CG1-CG 4.5Å; L15-L28 HydrophobicContact CD1-CD2 4.04Å; L15-L28 HydrophobicContact CD2-CD2 3.64Å; L15-L28 HydrophobicContact CG-CD2 4.39Å; L15-K31 HydrophobicContact CD1-CB 4.05Å; L15-K31 HydrophobicContact CD1-CD 3.82Å; L15-K31 HydrophobicContact CD2-CD 3.71Å; L15-K31 HydrophobicContact CG-CD 3.52Å; L15-I32 HydrophobicContact CD1-CG2 4.33Å; L15-T59 CarbonylContact O-C 3.56Å; L15-T59 WeakPolarHBondContact O-CA 3.46Å; L15-V60 PolarHBondContact N-O 2.96Å; L15-V60 PolarHBondContact O-N 2.86Å; L15-L62 HydrophobicContact CD1-CD1 3.87Å |
| 16 | R | 85.4 | Confident | 81.1 | Confident | 208 Ų | 208 | 73.6 Ų | 73.6 | 79% | 0.785 | 39% | 0.392 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.2 | 115 | 171.5 | -80.3 | -164.4 | -88 | -163.8 | -4.3 | 108.7 | I58 T59 | R16-I58 WeakPolarHBondContact CA-O 3.49Å; R16-T59 HydrophobicContact CG-CG2 3.5Å |
| 17 | C | 82.8 | Confident | 81.8 | Confident | 12 Ų | 12 | 72 Ų | 72 | 8% | 0.081 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121 | 158.8 | 178.5 | -63.9 | 0 | 0 | 0 | 0 | 109.9 | I46 K57 I58 | C17-I46 HydrophobicContact CB-CG2 4.08Å; C17-K57 WeakPolarHBondContact O-CA 3.39Å; C17-I58 PolarHBondContact N-O 2.92Å; C17-I58 PolarHBondContact O-N 2.83Å |
| 18 | V | 83.7 | Confident | 82.7 | Confident | 30 Ų | 30 | 68.2 Ų | 68.2 | 18% | 0.182 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.5 | 124.8 | 167.8 | -177.5 | 0 | 0 | 0 | 0 | 106.8 | L56 K57 | V18-L56 CarbonylContact C-O 3.59Å; V18-L56 WeakPolarHBondContact CA-O 3.33Å; V18-K57 HydrophobicContact CG2-CG 4.35Å |
| 19 | G | 82.4 | Confident | 83.3 | Confident | 1 Ų | 1 | 63.7 Ų | 63.7 | 1% | 0.01 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | 145.6 | -180 | 0 | 0 | 0 | 0 | 0 | 111.5 | E21 T50 W53 K54 G55 L56 | G19-E21 PolarHBondContact O-N 3.24Å; G19-T50 WeakPolarHBondContact CA-OG1 3.42Å; G19-W53 CarbonylContact C-O 3.55Å; G19-W53 WeakPolarHBondContact CA-O 3.2Å; G19-K54 VanDerWaalsContact O-CA 3.28Å; G19-K54 WeakPolarHBondContact O-CA 3.37Å; G19-G55 PolarHBondContact O-N 3.03Å; G19-L56 PolarHBondContact N-O 3.18Å |
| 20 | G | 79.3 | Confident | 83.8 | Confident | 24 Ų | 24 | 63.7 Ų | 63.7 | 25% | 0.247 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 68 | -0.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | T50 | G20-T50 PolarHBondContact N-O 3.3Å; G20-T50 PolarHBondContact N-OG1 3.17Å; G20-T50 VanDerWaalsContact N-OG1 3.17Å |
| 21 | E | 81.7 | Confident | 83.8 | Confident | 113 Ų | 113 | 63.9 Ų | 63.9 | 53% | 0.528 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -115.7 | 144 | 172.3 | -67.9 | -173.3 | 167 | 0 | 0 | 109.9 | G19 G23 | G19-E21 PolarHBondContact O-N 3.24Å; E21-G23 PolarHBondContact O-N 3.2Å |
| 22 | V | 82.7 | Confident | 83.9 | Confident | 85 Ų | 85 | 61.5 Ų | 61.5 | 52% | 0.515 | 34% | 0.342 | S | S | . | . | trans | -67.3 | 110.9 | 173.4 | -176.4 | 0 | 0 | 0 | 0 | 107.8 | A47 | V22-A47 HydrophobicContact CG2-CB 4.11Š| ||
| 23 | G | 74.7 | Confident | 83.6 | Confident | 16 Ų | 16 | 59.5 Ų | 59.5 | 17% | 0.165 | 34% | 0.342 | C | S | . | . | trans | -55.8 | 141.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E21 T25 | E21-G23 PolarHBondContact O-N 3.2Å; G23-T25 PolarHBondContact O-N 3.19Å; G23-T25 VanDerWaalsContact O-N 3.1Å | ||
| 24 | A | 80.9 | Confident | 83.5 | Confident | 56 Ų | 56 | 62.8 Ų | 62.8 | 46% | 0.463 | 36% | 0.364 | S | S | . | . | trans | -54.7 | 121.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | T26 S27 L28 | A24-T26 PolarHBondContact O-N 3.43Å; A24-T26 VanDerWaalsContact O-N 3.07Å; A24-S27 WeakPolarHBondContact O-CB 3.37Å; A24-S27 PolarHBondContact O-N 3.41Å; A24-L28 PolarHBondContact O-N 2.95Å | ||
| 25 | T | 82.7 | Confident | 83.2 | Confident | 72 Ų | 72 | 58 Ų | 58 | 44% | 0.442 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -55.3 | -30.7 | -178.7 | 50.6 | 0 | 0 | 0 | 0 | 111.8 | G23 S27 L28 A29 | G23-T25 PolarHBondContact O-N 3.19Å; G23-T25 VanDerWaalsContact O-N 3.1Å; T25-S27 VanDerWaalsContact C-N 3.33Å; T25-S27 PolarHBondContact O-N 2.64Å; T25-L28 PolarHBondContact O-N 3.28Å; T25-A29 WeakPolarHBondContact O-CB 3.48Å; T25-A29 PolarHBondContact O-N 3.43Å |
| 26 | T | 85.6 | Confident | 82.9 | Confident | 107 Ų | 107 | 60 Ų | 60 | 66% | 0.656 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -63 | -32.7 | 174.9 | 55.1 | 0 | 0 | 0 | 0 | 113.8 | A24 P30 | A24-T26 PolarHBondContact O-N 3.43Å; A24-T26 VanDerWaalsContact O-N 3.07Å; T26-P30 WeakPolarHBondContact O-CD 3.14Å |
| 27 | S | 81.7 | Confident | 82.8 | Confident | 82 Ų | 82 | 51 Ų | 51 | 57% | 0.573 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -82.7 | -29.2 | 178.8 | -59.7 | 0 | 0 | 0 | 0 | 112.3 | A24 T25 | A24-S27 WeakPolarHBondContact O-CB 3.37Å; A24-S27 PolarHBondContact O-N 3.41Å; T25-S27 VanDerWaalsContact C-N 3.33Å; T25-S27 PolarHBondContact O-N 2.64Å |
| 28 | L | 83.7 | Confident | 83 | Confident | 3 Ų | 3 | 53.3 Ų | 53.3 | 2% | 0.016 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -82.9 | -44.4 | 179.2 | -63.3 | 177 | 0 | 0 | 0 | 111.7 | L15 A24 T25 P30 K31 I32 P39 I46 | L15-L28 HydrophobicContact CD1-CD2 4.04Å; L15-L28 HydrophobicContact CD2-CD2 3.64Å; L15-L28 HydrophobicContact CG-CD2 4.39Å; A24-L28 PolarHBondContact O-N 2.95Å; T25-L28 PolarHBondContact O-N 3.28Å; L28-P30 VanDerWaalsContact C-CD 3.42Å; L28-P30 VanDerWaalsContact C-N 3.34Å; L28-P30 VanDerWaalsContact O-N 3.13Å; L28-K31 PolarHBondContact O-N 2.89Å; L28-I32 HydrophobicContact CB-CD1 3.97Å; L28-I32 HydrophobicContact CB-CG1 4.29Å; L28-I32 VanDerWaalsContact O-CG1 3.29Å; L28-I32 WeakPolarHBondContact O-CG1 3.37Å; L28-I32 PolarHBondContact O-N 3.35Å; L28-P39 HydrophobicContact CB-CB 4.41Å; L28-I46 HydrophobicContact CD2-CD1 4.48Å |
| 29 | A | 85.8 | Confident | 83.2 | Confident | 39 Ų | 39 | 53.6 Ų | 53.6 | 32% | 0.322 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -49.7 | -41.2 | -171.9 | 0 | 0 | 0 | 0 | 0 | 115 | T25 K31 G33 P39 | T25-A29 WeakPolarHBondContact O-CB 3.48Å; T25-A29 PolarHBondContact O-N 3.43Å; A29-K31 VanDerWaalsContact C-N 3.26Å; A29-K31 PolarHBondContact O-N 2.93Å; A29-G33 VanDerWaalsContact O-CA 3.26Å; A29-G33 WeakPolarHBondContact O-CA 3.06Å; A29-G33 PolarHBondContact O-N 2.95Å; A29-P39 HydrophobicContact CB-CG 4.48Å |
| 30 | P | 88.9 | Confident | 83.4 | Confident | 96 Ų | 96 | 60.5 Ų | 60.5 | 62% | 0.623 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -62 | -29.9 | 178.3 | -25 | 35.4 | 0 | 0 | 0 | 114.2 | T26 L28 P34 | T26-P30 WeakPolarHBondContact O-CD 3.14Å; L28-P30 VanDerWaalsContact C-CD 3.42Å; L28-P30 VanDerWaalsContact C-N 3.34Å; L28-P30 VanDerWaalsContact O-N 3.13Å; P30-P34 WeakPolarHBondContact O-CD 3.32Å |
| 31 | K | 83.8 | Confident | 83.7 | Confident | 99 Ų | 99 | 66.5 Ų | 66.5 | 43% | 0.43 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -92.8 | -39.1 | -175.6 | -70.4 | -175.9 | 172.6 | -170.7 | 0 | 113.6 | V13 Y14 L15 L28 A29 | V13-K31 HydrophobicContact CG1-CB 4.35Å; V13-K31 HydrophobicContact CG1-CD 4.37Å; Y14-K31 PolarHBondContact O-NZ 2.97Å; L15-K31 HydrophobicContact CD1-CB 4.05Å; L15-K31 HydrophobicContact CD1-CD 3.82Å; L15-K31 HydrophobicContact CD2-CD 3.71Å; L15-K31 HydrophobicContact CG-CD 3.52Å; L28-K31 PolarHBondContact O-N 2.89Å; A29-K31 VanDerWaalsContact C-N 3.26Å; A29-K31 PolarHBondContact O-N 2.93Å |
| 32 | I | 84.7 | Confident | 84 | Confident | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -100.9 | -18.9 | -176.6 | 57.5 | 169.1 | 0 | 0 | 0 | 113.6 | L15 L28 L35 G36 L37 P39 V42 L62 | L15-I32 HydrophobicContact CD1-CG2 4.33Å; L28-I32 HydrophobicContact CB-CD1 3.97Å; L28-I32 HydrophobicContact CB-CG1 4.29Å; L28-I32 VanDerWaalsContact O-CG1 3.29Å; L28-I32 WeakPolarHBondContact O-CG1 3.37Å; L28-I32 PolarHBondContact O-N 3.35Å; I32-L35 WeakPolarHBondContact O-CB 3.36Å; I32-L35 PolarHBondContact O-N 3.37Å; I32-L35 VanDerWaalsContact O-N 3.09Å; I32-G36 PolarHBondContact O-N 3.44Å; I32-L37 HydrophobicContact CB-CB 4.27Å; I32-L37 PolarHBondContact O-N 2.69Å; I32-P39 HydrophobicContact CD1-CB 3.72Å; I32-P39 HydrophobicContact CG1-CB 4.34Å; I32-V42 HydrophobicContact CD1-CB 3.83Å; I32-V42 HydrophobicContact CD1-CG1 4.1Å; I32-V42 HydrophobicContact CD1-CG2 4.04Å; I32-L62 HydrophobicContact CG2-CD1 4.15Å |
| 33 | G | 83.3 | Confident | 84.3 | Confident | 41 Ų | 41 | 57.4 Ų | 57.4 | 42% | 0.423 | 36% | 0.357 | S | S | . | . | G | 310 helix | trans | -58 | -48.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | A29 L35 G36 | A29-G33 VanDerWaalsContact O-CA 3.26Å; A29-G33 WeakPolarHBondContact O-CA 3.06Å; A29-G33 PolarHBondContact O-N 2.95Å; G33-L35 PolarHBondContact O-N 3.19Å; G33-L35 VanDerWaalsContact O-N 3.16Å; G33-G36 PolarHBondContact O-N 3.42Å; G33-G36 VanDerWaalsContact O-N 3.13Å |
| 34 | P | 84.7 | Confident | 85 | Confident | 96 Ų | 96 | 59.7 Ų | 59.7 | 62% | 0.623 | 37% | 0.365 | S | S | * | . | G | 310 helix | trans | -63.1 | -18.7 | 175.5 | -24.2 | 35.1 | 0 | 0 | 0 | 114.4 | P30 G36 | P30-P34 WeakPolarHBondContact O-CD 3.32Å; P34-G36 VanDerWaalsContact C-N 3.33Å |
| 35 | L | 82.7 | Confident | 85.3 | Confident | 29 Ų | 29 | 60.6 Ų | 60.6 | 15% | 0.152 | 36% | 0.363 | C | S | . | . | G | 310 helix | trans | -90.5 | 0.9 | -179.5 | -57.1 | 178.2 | 0 | 0 | 0 | 112.6 | L5 K11 V13 I32 G33 L37 I64 | L5-L35 HydrophobicContact CD2-CD2 3.98Å; K11-L35 HydrophobicContact CD-CD2 3.58Å; V13-L35 HydrophobicContact CG2-CD1 3.77Å; I32-L35 WeakPolarHBondContact O-CB 3.36Å; I32-L35 PolarHBondContact O-N 3.37Å; I32-L35 VanDerWaalsContact O-N 3.09Å; G33-L35 PolarHBondContact O-N 3.19Å; G33-L35 VanDerWaalsContact O-N 3.16Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 2.85Å; L35-I64 HydrophobicContact CB-CD1 4.49Å; L35-I64 HydrophobicContact CD1-CD1 3.31Å |
| 36 | G | 80.7 | Confident | 85.6 | Confident | 50 Ų | 50 | 57.3 Ų | 57.3 | 52% | 0.515 | 34% | 0.342 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.6 | 15.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | I32 G33 P34 | I32-G36 PolarHBondContact O-N 3.44Å; G33-G36 PolarHBondContact O-N 3.42Å; G33-G36 VanDerWaalsContact O-N 3.13Å; P34-G36 VanDerWaalsContact C-N 3.33Å |
| 37 | L | 83.5 | Confident | 85.6 | Confident | 20 Ų | 20 | 53.1 Ų | 53.1 | 11% | 0.105 | 32% | 0.318 | C | S | . | . | trans | -92 | 137.3 | 175.4 | -74 | 168.9 | 0 | 0 | 0 | 110.6 | I32 L35 P39 V42 I64 R67 A69 | I32-L37 HydrophobicContact CB-CB 4.27Å; I32-L37 PolarHBondContact O-N 2.69Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 2.85Å; L37-P39 WeakPolarHBondContact O-CD 3.5Å; L37-V42 HydrophobicContact CB-CG2 3.96Å; L37-V42 HydrophobicContact CD1-CG2 4.22Å; L37-V42 HydrophobicContact CD2-CG2 4.39Å; L37-V42 HydrophobicContact CG-CG2 4.45Å; L37-I64 HydrophobicContact CD1-CB 4.45Å; L37-I64 HydrophobicContact CD1-CD1 3.57Å; L37-I64 HydrophobicContact CD1-CG1 3.74Å; L37-I64 HydrophobicContact CD1-CG2 3.86Å; L37-R67 WeakPolarHBondContact CD2-O 3.28Å; L37-A69 HydrophobicContact CD1-CB 3.98Å | ||
| 38 | S | 85.8 | Confident | 85.9 | Confident | 60 Ų | 60 | 57 Ų | 57 | 42% | 0.42 | 33% | 0.325 | S | S | . | . | trans | -71.9 | 123.8 | 174.4 | -179 | 0 | 0 | 0 | 0 | 110.1 | K40 K41 V42 | S38-K40 PolarHBondContact O-N 3.2Å; S38-K41 PolarHBondContact O-N 2.84Å; S38-V42 PolarHBondContact O-N 2.97Å | ||
| 39 | P | 87.1 | Confident | 86.1 | Confident | 37 Ų | 37 | 59.2 Ų | 59.2 | 24% | 0.24 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.7 | -22.5 | -179.1 | 25.7 | -34.2 | 0 | 0 | 0 | 114.3 | L28 A29 I32 L37 G43 | L28-P39 HydrophobicContact CB-CB 4.41Å; A29-P39 HydrophobicContact CB-CG 4.48Å; I32-P39 HydrophobicContact CD1-CB 3.72Å; I32-P39 HydrophobicContact CG1-CB 4.34Å; L37-P39 WeakPolarHBondContact O-CD 3.5Å; P39-G43 PolarHBondContact O-N 3.36Å |
| 40 | K | 87.4 | Confident | 86.1 | Confident | 145 Ų | 145 | 57.4 Ų | 57.4 | 63% | 0.63 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -70 | -51 | 175.5 | -165.2 | 174.5 | -178.2 | -179.2 | 0 | 111.3 | S38 G43 D44 | S38-K40 PolarHBondContact O-N 3.2Å; K40-G43 PolarHBondContact O-N 2.83Å; K40-D44 PolarHBondContact O-N 3.39Å |
| 41 | K | 86.5 | Confident | 85.8 | Confident | 151 Ų | 151 | 54.9 Ų | 54.9 | 66% | 0.657 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -61.3 | -48.4 | 179.7 | -68.4 | -169.9 | 176.5 | -175 | 0 | 111.9 | S38 G43 D44 D45 | S38-K41 PolarHBondContact O-N 2.84Å; K41-G43 VanDerWaalsContact C-N 3.28Å; K41-G43 PolarHBondContact O-N 3.05Å; K41-D44 PolarHBondContact O-N 3.24Å; K41-D45 PolarHBondContact O-N 3.23Å |
| 42 | V | 87.5 | Confident | 85.8 | Confident | 5 Ų | 5 | 56.5 Ų | 56.5 | 3% | 0.03 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.4 | -36.3 | 178.2 | 178.2 | 0 | 0 | 0 | 0 | 111.2 | I32 L37 S38 I46 L62 | I32-V42 HydrophobicContact CD1-CB 3.83Å; I32-V42 HydrophobicContact CD1-CG1 4.1Å; I32-V42 HydrophobicContact CD1-CG2 4.04Å; L37-V42 HydrophobicContact CB-CG2 3.96Å; L37-V42 HydrophobicContact CD1-CG2 4.22Å; L37-V42 HydrophobicContact CD2-CG2 4.39Å; L37-V42 HydrophobicContact CG-CG2 4.45Å; S38-V42 PolarHBondContact O-N 2.97Å; V42-I46 HydrophobicContact CG1-CD1 3.71Å; V42-I46 HydrophobicContact CG1-CG1 4.24Å; V42-I46 WeakPolarHBondContact O-CB 3.19Å; V42-I46 WeakPolarHBondContact O-CD1 3.38Å; V42-I46 WeakPolarHBondContact O-CG1 3.44Å; V42-I46 PolarHBondContact O-N 3.06Å; V42-L62 HydrophobicContact CG1-CD1 4.04Å |
| 43 | G | 88.3 | Confident | 85.6 | Confident | 1 Ų | 1 | 57.5 Ų | 57.5 | 1% | 0.01 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.2 | -43.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | P39 K40 K41 A47 | P39-G43 PolarHBondContact O-N 3.36Å; K40-G43 PolarHBondContact O-N 2.83Å; K41-G43 VanDerWaalsContact C-N 3.28Å; K41-G43 PolarHBondContact O-N 3.05Å; G43-A47 WeakPolarHBondContact O-CB 3.46Å; G43-A47 PolarHBondContact O-N 2.87Å |
| 44 | D | 88.9 | Confident | 85.4 | Confident | 64 Ų | 64 | 60.1 Ų | 60.1 | 34% | 0.342 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.3 | -40.9 | 177.8 | -66.1 | -31.8 | 0 | 0 | 0 | 111.8 | K40 K41 A47 K48 | K40-D44 PolarHBondContact O-N 3.39Å; K41-D44 PolarHBondContact O-N 3.24Å; D44-A47 PolarHBondContact O-N 3.1Å; D44-K48 WeakPolarHBondContact O-CG 3.33Å; D44-K48 PolarHBondContact O-N 3.23Å |
| 45 | D | 88.6 | Confident | 85 | Confident | 76 Ų | 76 | 56 Ų | 56 | 41% | 0.406 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -68.7 | -38.4 | 178.2 | -65.6 | -28.5 | 0 | 0 | 0 | 111.6 | K41 K48 A49 I71 | K41-D45 PolarHBondContact O-N 3.23Å; D45-K48 PolarHBondContact O-N 3.36Å; D45-A49 WeakPolarHBondContact O-CB 3.44Å; D45-A49 PolarHBondContact O-N 3Å; D45-I71 VanDerWaalsContact C-CD1 3.42Å; D45-I71 HydrophobicContact CB-CD1 3.37Å |
| 46 | I | 88.4 | Confident | 84.8 | Confident | 3 Ų | 3 | 55.3 Ų | 55.3 | 2% | 0.015 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.7 | -43.4 | 172.2 | -70.7 | 168.7 | 0 | 0 | 0 | 110.2 | C17 L28 V42 K48 A49 T50 V60 L62 I71 | C17-I46 HydrophobicContact CB-CG2 4.08Å; L28-I46 HydrophobicContact CD2-CD1 4.48Å; V42-I46 HydrophobicContact CG1-CD1 3.71Å; V42-I46 HydrophobicContact CG1-CG1 4.24Å; V42-I46 WeakPolarHBondContact O-CB 3.19Å; V42-I46 WeakPolarHBondContact O-CD1 3.38Å; V42-I46 WeakPolarHBondContact O-CG1 3.44Å; V42-I46 PolarHBondContact O-N 3.06Å; I46-K48 VanDerWaalsContact C-N 3.32Å; I46-K48 PolarHBondContact O-N 3Å; I46-A49 PolarHBondContact O-N 3.07Å; I46-T50 HydrophobicContact CG2-CG2 4.17Å; I46-T50 WeakPolarHBondContact O-CB 3.49Å; I46-T50 WeakPolarHBondContact O-CG2 3.45Å; I46-T50 PolarHBondContact O-N 3.33Å; I46-T50 PolarHBondContact O-OG1 2.86Å; I46-V60 HydrophobicContact CG2-CG2 4.38Å; I46-L62 HydrophobicContact CD1-CD1 4.44Å; I46-L62 HydrophobicContact CD1-CD2 4.31Å; I46-L62 HydrophobicContact CG1-CD2 4.33Å; I46-I71 HydrophobicContact CG1-CD1 3.96Å; I46-I71 HydrophobicContact CG1-CG2 4.27Å |
| 47 | A | 86.6 | Confident | 84.8 | Confident | 18 Ų | 18 | 59 Ų | 59 | 15% | 0.149 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.5 | -39.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | V22 G43 D44 G51 | V22-A47 HydrophobicContact CG2-CB 4.11Å; G43-A47 WeakPolarHBondContact O-CB 3.46Å; G43-A47 PolarHBondContact O-N 2.87Å; D44-A47 PolarHBondContact O-N 3.1Å; A47-G51 PolarHBondContact O-N 2.77Å |
| 48 | K | 88.1 | Confident | 84.9 | Confident | 165 Ų | 165 | 58.2 Ų | 58.2 | 72% | 0.717 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -67.2 | -47 | 174.5 | -70.2 | 173.1 | -174.1 | 170.9 | 0 | 112.3 | D44 D45 I46 T50 G51 | D44-K48 WeakPolarHBondContact O-CG 3.33Å; D44-K48 PolarHBondContact O-N 3.23Å; D45-K48 PolarHBondContact O-N 3.36Å; I46-K48 VanDerWaalsContact C-N 3.32Å; I46-K48 PolarHBondContact O-N 3Å; K48-T50 VanDerWaalsContact C-N 3.26Å; K48-T50 PolarHBondContact O-N 3.14Å; K48-G51 PolarHBondContact O-N 3.13Å |
| 49 | A | 87.7 | Confident | 85 | Confident | 48 Ų | 48 | 57.5 Ų | 57.5 | 40% | 0.397 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67.4 | -25.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | D45 I46 I71 | D45-A49 WeakPolarHBondContact O-CB 3.44Å; D45-A49 PolarHBondContact O-N 3Å; I46-A49 PolarHBondContact O-N 3.07Å; A49-I71 HydrophobicContact CB-CB 4.38Å; A49-I71 HydrophobicContact CB-CG2 3.94Å |
| 50 | T | 85.2 | Confident | 85.1 | Confident | 1 Ų | 1 | 55.7 Ų | 55.7 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.1 | 16.8 | -178.7 | 62.3 | 0 | 0 | 0 | 0 | 113.9 | G19 G20 I46 K48 E52 W53 V60 V73 | G19-T50 WeakPolarHBondContact CA-OG1 3.42Å; G20-T50 PolarHBondContact N-O 3.3Å; G20-T50 PolarHBondContact N-OG1 3.17Å; G20-T50 VanDerWaalsContact N-OG1 3.17Å; I46-T50 HydrophobicContact CG2-CG2 4.17Å; I46-T50 WeakPolarHBondContact O-CB 3.49Å; I46-T50 WeakPolarHBondContact O-CG2 3.45Å; I46-T50 PolarHBondContact O-N 3.33Å; I46-T50 PolarHBondContact O-OG1 2.86Å; K48-T50 VanDerWaalsContact C-N 3.26Å; K48-T50 PolarHBondContact O-N 3.14Å; T50-E52 VanDerWaalsContact C-N 3.28Å; T50-E52 PolarHBondContact O-N 3.16Å; T50-W53 PolarHBondContact O-N 3.07Å; T50-V60 HydrophobicContact CG2-CG2 4Å; T50-V73 HydrophobicContact CG2-CG2 4.05Å |
| 51 | G | 82.3 | Confident | 85.2 | Confident | 43 Ų | 43 | 51.7 Ų | 51.7 | 44% | 0.443 | 27% | 0.265 | S | S | . | . | G | 310 helix | trans | -57.4 | -36.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | A47 K48 W53 | A47-G51 PolarHBondContact O-N 2.77Å; K48-G51 PolarHBondContact O-N 3.13Å; G51-W53 PolarHBondContact O-N 3.49Å |
| 52 | E | 83.3 | Confident | 85.3 | Confident | 134 Ų | 134 | 44.5 Ų | 44.5 | 63% | 0.626 | 23% | 0.234 | S | C | * | . | G | 310 helix | trans | -65.7 | -17.8 | 177 | -60.2 | -172.6 | 152.6 | 0 | 0 | 113.3 | T50 R83 | T50-E52 VanDerWaalsContact C-N 3.28Å; T50-E52 PolarHBondContact O-N 3.16Å; E52-R83 VanDerWaalsContact CD-NH2 3.34Å; E52-R83 IonicContact OE1-NH2 2.67Å; E52-R83 IonicContact OE2-CZ 3.14Å; E52-R83 IonicContact OE2-NH1 2.91Å; E52-R83 PolarHBondContact OE2-NH1 3.09Å; E52-R83 IonicContact OE2-NH2 2.74Å; E52-R83 PolarHBondContact OE2-NH2 3.18Å |
| 53 | W | 80.6 | Confident | 85.3 | Confident | 21 Ų | 21 | 45.3 Ų | 45.3 | 8% | 0.08 | 24% | 0.239 | C | C | . | . | G | 310 helix | trans | -111.5 | 31.9 | -170.6 | -51.8 | 98.7 | 0 | 0 | 0 | 113.5 | G19 T50 G51 G55 L56 I58 S79 L80 R83 | G19-W53 CarbonylContact C-O 3.55Å; G19-W53 WeakPolarHBondContact CA-O 3.2Å; T50-W53 PolarHBondContact O-N 3.07Å; G51-W53 PolarHBondContact O-N 3.49Å; W53-G55 PolarHBondContact O-N 2.85Å; W53-L56 HydrophobicContact CB-CD1 4.49Å; W53-L56 HydrophobicContact CE3-CD1 4.12Å; W53-L56 WeakPolarHBondContact O-CB 3.41Å; W53-L56 PolarHBondContact O-N 3.21Å; W53-L56 VanDerWaalsContact O-N 3.07Å; W53-I58 HydrophobicContact CB-CD1 3.02Å; W53-I58 HydrophobicContact CB-CG1 4.44Å; W53-I58 HydrophobicContact CD2-CD1 3.41Å; W53-I58 VanDerWaalsContact CD2-CD1 3.41Å; W53-I58 HydrophobicContact CE3-CD1 3.79Å; W53-I58 HydrophobicContact CG-CD1 3.09Å; W53-S79 WeakPolarHBondContact CZ3-O 3.41Å; W53-L80 HydrophobicContact CH2-CD2 3.72Å; W53-L80 HydrophobicContact CH2-CG 4.23Å; W53-R83 HydrophobicContact CE3-CB 4.3Å; W53-R83 VanDerWaalsContact CZ2-NH1 3.35Å; W53-R83 HydrophobicContact CZ3-CB 3.77Å; W53-R83 HydrophobicContact CZ3-CG 4.27Å |
| 54 | K | 79.1 | Confident | 85.2 | Confident | 96 Ų | 96 | 45.7 Ų | 45.7 | 42% | 0.417 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | 124.2 | -172 | -165.1 | 174.9 | 176.1 | -155.8 | 0 | 112 | G19 L56 | G19-K54 VanDerWaalsContact O-CA 3.28Å; G19-K54 WeakPolarHBondContact O-CA 3.37Å; K54-L56 VanDerWaalsContact C-N 3.34Å |
| 55 | G | 76.8 | Confident | 85 | Confident | 9 Ų | 9 | 47 Ų | 47 | 9% | 0.093 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 84.2 | 0.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | G19 W53 | G19-G55 PolarHBondContact O-N 3.03Å; W53-G55 PolarHBondContact O-N 2.85Å |
| 56 | L | 79.1 | Confident | 84.8 | Confident | 15 Ų | 15 | 48 Ų | 48 | 8% | 0.079 | 25% | 0.25 | C | S | . | . | trans | -98.2 | 142.9 | 176.3 | -66.8 | 161.6 | 0 | 0 | 0 | 111 | V18 G19 W53 K54 I58 I82 | V18-L56 CarbonylContact C-O 3.59Å; V18-L56 WeakPolarHBondContact CA-O 3.33Å; G19-L56 PolarHBondContact N-O 3.18Å; W53-L56 HydrophobicContact CB-CD1 4.49Å; W53-L56 HydrophobicContact CE3-CD1 4.12Å; W53-L56 WeakPolarHBondContact O-CB 3.41Å; W53-L56 PolarHBondContact O-N 3.21Å; W53-L56 VanDerWaalsContact O-N 3.07Å; K54-L56 VanDerWaalsContact C-N 3.34Å; L56-I58 HydrophobicContact CB-CD1 4.24Å; L56-I58 HydrophobicContact CB-CG1 4.34Å; L56-I58 PolarHBondContact O-N 3.13Å; L56-I82 HydrophobicContact CD1-CB 4.46Å; L56-I82 HydrophobicContact CD1-CG2 4.35Å; L56-I82 HydrophobicContact CD2-CB 3.92Å; L56-I82 HydrophobicContact CD2-CD1 3.54Å; L56-I82 HydrophobicContact CD2-CG1 4.33Å; L56-I82 HydrophobicContact CD2-CG2 3.7Å | ||
| 57 | K | 80.7 | Confident | 84.2 | Confident | 126 Ų | 126 | 57.1 Ų | 57.1 | 55% | 0.548 | 28% | 0.284 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.2 | 115.4 | 172 | -74.2 | -174.8 | 178.6 | -179.1 | 0 | 109.3 | C17 V18 R92 | C17-K57 WeakPolarHBondContact O-CA 3.39Å; V18-K57 HydrophobicContact CG2-CG 4.35Å; K57-R92 VanDerWaalsContact CE-CZ 3.45Å; K57-R92 VanDerWaalsContact CE-NH2 3.35Å |
| 58 | I | 84.8 | Confident | 84.1 | Confident | 4 Ų | 4 | 63.3 Ų | 63.3 | 2% | 0.021 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 146.4 | -178.5 | -65.1 | 163 | 0 | 0 | 0 | 111.1 | R16 C17 W53 L56 V73 | R16-I58 WeakPolarHBondContact CA-O 3.49Å; C17-I58 PolarHBondContact N-O 2.92Å; C17-I58 PolarHBondContact O-N 2.83Å; W53-I58 HydrophobicContact CB-CD1 3.02Å; W53-I58 HydrophobicContact CB-CG1 4.44Å; W53-I58 HydrophobicContact CD2-CD1 3.41Å; W53-I58 VanDerWaalsContact CD2-CD1 3.41Å; W53-I58 HydrophobicContact CE3-CD1 3.79Å; W53-I58 HydrophobicContact CG-CD1 3.09Å; L56-I58 HydrophobicContact CB-CD1 4.24Å; L56-I58 HydrophobicContact CB-CG1 4.34Å; L56-I58 PolarHBondContact O-N 3.13Å; I58-V73 HydrophobicContact CG2-CG1 3.48Å; I58-V73 VanDerWaalsContact CG2-CG1 3.48Å |
| 59 | T | 88.1 | Confident | 83.9 | Confident | 45 Ų | 45 | 56.9 Ų | 56.9 | 28% | 0.276 | 29% | 0.288 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.8 | 120.2 | 168 | 42.6 | 0 | 0 | 0 | 0 | 110.3 | L15 R16 V74 | L15-T59 CarbonylContact O-C 3.56Å; L15-T59 WeakPolarHBondContact O-CA 3.46Å; R16-T59 HydrophobicContact CG-CG2 3.5Å; T59-V74 WeakPolarHBondContact O-CB 3.18Å; T59-V74 PolarHBondContact O-N 2.86Å |
| 60 | V | 88.1 | Confident | 83.9 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.6 | 132.4 | 174.7 | -178.8 | 0 | 0 | 0 | 0 | 108.3 | L15 I46 T50 L62 I71 | L15-V60 PolarHBondContact N-O 2.96Å; L15-V60 PolarHBondContact O-N 2.86Å; I46-V60 HydrophobicContact CG2-CG2 4.38Å; T50-V60 HydrophobicContact CG2-CG2 4Å; V60-L62 HydrophobicContact CG1-CD2 3.95Å; V60-L62 HydrophobicContact CG1-CG 4.45Å; V60-I71 HydrophobicContact CG1-CG2 3.29Å |
| 61 | K | 89.9 | Confident | 84 | Confident | 60 Ų | 60 | 62.5 Ų | 62.5 | 26% | 0.261 | 31% | 0.305 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.4 | 113 | 171.5 | -177.3 | -176.3 | 179.4 | -176.2 | 0 | 107.7 | I12 Y14 D72 V74 | I12-K61 HydrophobicContact CG2-CD 4.16Å; I12-K61 VanDerWaalsContact CG2-CE 3.46Å; I12-K61 HydrophobicContact CG2-CG 3.7Å; Y14-K61 HydrophobicContact CD1-CB 4.04Å; Y14-K61 HydrophobicContact CD1-CG 4.24Å; Y14-K61 HydrophobicContact CE1-CB 3.75Å; Y14-K61 HydrophobicContact CE1-CD 3.96Å; Y14-K61 HydrophobicContact CE1-CG 3.66Å; K61-D72 HydrophobicContact CB-CB 4.38Å; K61-D72 PolarHBondContact N-O 2.82Å; K61-D72 PolarHBondContact O-N 3.09Å; K61-V74 HydrophobicContact CB-CG2 3.77Å |
| 62 | L | 88.3 | Confident | 84.3 | Confident | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 114.3 | 173 | -60.7 | 177.5 | 0 | 0 | 0 | 108.3 | I12 V13 L15 I32 V42 I46 V60 I64 K70 I71 | I12-L62 CarbonylContact C-O 3.57Å; I12-L62 WeakPolarHBondContact CA-O 3.26Å; V13-L62 HydrophobicContact CB-CB 4.39Å; V13-L62 PolarHBondContact N-O 3.16Å; V13-L62 PolarHBondContact O-N 3.27Å; L15-L62 HydrophobicContact CD1-CD1 3.87Å; I32-L62 HydrophobicContact CG2-CD1 4.15Å; V42-L62 HydrophobicContact CG1-CD1 4.04Å; I46-L62 HydrophobicContact CD1-CD1 4.44Å; I46-L62 HydrophobicContact CD1-CD2 4.31Å; I46-L62 HydrophobicContact CG1-CD2 4.33Å; V60-L62 HydrophobicContact CG1-CD2 3.95Å; V60-L62 HydrophobicContact CG1-CG 4.45Å; L62-I64 HydrophobicContact CB-CD1 4.43Å; L62-I64 HydrophobicContact CB-CG1 4.33Å; L62-K70 WeakPolarHBondContact CA-O 3.42Å; L62-I71 HydrophobicContact CD2-CB 4.25Å; L62-I71 HydrophobicContact CD2-CD1 4.46Å; L62-I71 HydrophobicContact CD2-CG1 3.73Å; L62-I71 HydrophobicContact CD2-CG2 4.12Å |
| 63 | T | 89.3 | Confident | 84.5 | Confident | 22 Ų | 22 | 59 Ų | 59 | 14% | 0.135 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 107.3 | 171.2 | -55.8 | 0 | 0 | 0 | 0 | 107.7 | I10 K70 | I10-T63 HydrophobicContact CG2-CG2 3.49Å; I10-T63 VanDerWaalsContact CG2-CG2 3.49Å; T63-K70 PolarHBondContact N-O 3.07Å; T63-K70 PolarHBondContact O-N 3.44Å |
| 64 | I | 86 | Confident | 84.8 | Confident | 10 Ų | 10 | 59 Ų | 59 | 5% | 0.051 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 120.8 | -173.7 | -59.6 | 165.9 | 0 | 0 | 0 | 108.8 | K11 V13 L35 L37 L62 Q68 A69 | K11-I64 HydrophobicContact CB-CB 4.4Å; K11-I64 PolarHBondContact N-O 3.31Å; K11-I64 PolarHBondContact O-N 3.1Å; V13-I64 HydrophobicContact CG2-CD1 4.05Å; L35-I64 HydrophobicContact CB-CD1 4.49Å; L35-I64 HydrophobicContact CD1-CD1 3.31Å; L37-I64 HydrophobicContact CD1-CB 4.45Å; L37-I64 HydrophobicContact CD1-CD1 3.57Å; L37-I64 HydrophobicContact CD1-CG1 3.74Å; L37-I64 HydrophobicContact CD1-CG2 3.86Å; L62-I64 HydrophobicContact CB-CD1 4.43Å; L62-I64 HydrophobicContact CB-CG1 4.33Å; I64-Q68 VanDerWaalsContact CA-O 3.32Å; I64-Q68 WeakPolarHBondContact CA-O 3.35Å; I64-A69 HydrophobicContact CG1-CB 4.09Å |
| 65 | Q | 84.2 | Confident | 84.9 | Confident | 90 Ų | 90 | 56.3 Ų | 56.3 | 42% | 0.421 | 28% | 0.276 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 137.4 | 176 | -65.7 | 179.9 | 3.8 | 0 | 0 | 108.3 | I10 R67 Q68 | I10-Q65 HydrophobicContact CB-CG 4.22Å; I10-Q65 HydrophobicContact CG1-CG 3.91Å; I10-Q65 HydrophobicContact CG2-CG 4.04Å; Q65-R67 PolarHBondContact O-N 3.34Å; Q65-Q68 PolarHBondContact N-O 2.88Å; Q65-Q68 PolarHBondContact O-N 2.93Å; Q65-Q68 VanDerWaalsContact O-O 3.08Å |
| 66 | N | 84.6 | Confident | 85.3 | Confident | 97 Ų | 97 | 58 Ų | 58 | 52% | 0.519 | 29% | 0.287 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47 | 40.6 | 177.1 | -75.7 | -41.4 | 0 | 0 | 0 | 114.9 | P7 Q68 | P7-N66 WeakPolarHBondContact CB-OD1 3.29Å; P7-N66 PolarHBondContact O-N 3.06Å; P7-N66 PolarHBondContact O-OD1 3.25Å; N66-Q68 PolarHBondContact O-N 3.08Å |
| 67 | R | 76.3 | Confident | 85.5 | Confident | 195 Ų | 195 | 58 Ų | 58 | 74% | 0.736 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.8 | 24.1 | -175.8 | -53.1 | -180 | 179.5 | -175.6 | -0.3 | 114.8 | L37 Q65 | L37-R67 WeakPolarHBondContact CD2-O 3.28Å; Q65-R67 PolarHBondContact O-N 3.34Å |
| 68 | Q | 83.3 | Confident | 85.6 | Confident | 149 Ų | 149 | 54.6 Ų | 54.6 | 70% | 0.696 | 28% | 0.284 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116 | 139.8 | 169.7 | -61.5 | -177.8 | 4.8 | 0 | 0 | 108.4 | I64 Q65 N66 | I64-Q68 VanDerWaalsContact CA-O 3.32Å; I64-Q68 WeakPolarHBondContact CA-O 3.35Å; Q65-Q68 PolarHBondContact N-O 2.88Å; Q65-Q68 PolarHBondContact O-N 2.93Å; Q65-Q68 VanDerWaalsContact O-O 3.08Å; N66-Q68 PolarHBondContact O-N 3.08Å |
| 69 | A | 84.2 | Confident | 85.4 | Confident | 29 Ų | 29 | 54.8 Ų | 54.8 | 24% | 0.24 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 117.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | L37 I64 | L37-A69 HydrophobicContact CD1-CB 3.98Å; I64-A69 HydrophobicContact CG1-CB 4.09Å |
| 70 | K | 87.8 | Confident | 85.2 | Confident | 135 Ų | 135 | 53.6 Ų | 53.6 | 59% | 0.587 | 28% | 0.277 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.6 | 132 | 164.1 | -177.8 | 179.1 | 176.7 | -177.1 | 0 | 108.6 | L62 T63 D72 | L62-K70 WeakPolarHBondContact CA-O 3.42Å; T63-K70 PolarHBondContact N-O 3.07Å; T63-K70 PolarHBondContact O-N 3.44Å; K70-D72 WeakPolarHBondContact CE-OD1 3.16Å |
| 71 | I | 87.9 | Confident | 84.9 | Confident | 33 Ų | 33 | 54.2 Ų | 54.2 | 17% | 0.169 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 110.6 | -172.2 | -52.3 | 180 | 0 | 0 | 0 | 108.2 | D45 I46 A49 V60 L62 | D45-I71 VanDerWaalsContact C-CD1 3.42Å; D45-I71 HydrophobicContact CB-CD1 3.37Å; I46-I71 HydrophobicContact CG1-CD1 3.96Å; I46-I71 HydrophobicContact CG1-CG2 4.27Å; A49-I71 HydrophobicContact CB-CB 4.38Å; A49-I71 HydrophobicContact CB-CG2 3.94Å; V60-I71 HydrophobicContact CG1-CG2 3.29Å; L62-I71 HydrophobicContact CD2-CB 4.25Å; L62-I71 HydrophobicContact CD2-CD1 4.46Å; L62-I71 HydrophobicContact CD2-CG1 3.73Å; L62-I71 HydrophobicContact CD2-CG2 4.12Å |
| 72 | D | 88.7 | Confident | 84.5 | Confident | 60 Ų | 60 | 52.8 Ų | 52.8 | 32% | 0.321 | 28% | 0.276 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.6 | 128 | 174.3 | -60.8 | -47.2 | 0 | 0 | 0 | 109.1 | K61 K70 | K61-D72 HydrophobicContact CB-CB 4.38Å; K61-D72 PolarHBondContact N-O 2.82Å; K61-D72 PolarHBondContact O-N 3.09Å; K70-D72 WeakPolarHBondContact CE-OD1 3.16Å |
| 73 | V | 86.9 | Confident | 84.1 | Confident | 44 Ų | 44 | 57.6 Ų | 57.6 | 27% | 0.267 | 29% | 0.294 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.9 | 121.1 | 176.7 | -176 | 0 | 0 | 0 | 0 | 108.5 | T50 I58 P75 | T50-V73 HydrophobicContact CG2-CG2 4.05Å; I58-V73 HydrophobicContact CG2-CG1 3.48Å; I58-V73 VanDerWaalsContact CG2-CG1 3.48Å; V73-P75 WeakPolarHBondContact O-CD 3.4Å |
| 74 | V | 86 | Confident | 83.7 | Confident | 19 Ų | 19 | 58.5 Ų | 58.5 | 12% | 0.115 | 30% | 0.297 | C | S | . | . | P | Polyproline II helix | trans | -80.2 | 119 | 179 | 177.9 | 0 | 0 | 0 | 0 | 108.5 | Y14 T59 K61 S76 | Y14-V74 HydrophobicContact CD1-CG2 4.32Å; Y14-V74 HydrophobicContact CE1-CG2 4.1Å; T59-V74 WeakPolarHBondContact O-CB 3.18Å; T59-V74 PolarHBondContact O-N 2.86Å; K61-V74 HydrophobicContact CB-CG2 3.77Å; V74-S76 PolarHBondContact O-N 2.87Å |
| 75 | P | 82.6 | Confident | 83.3 | Confident | 41 Ų | 41 | 59.3 Ų | 59.3 | 27% | 0.266 | 30% | 0.301 | S | S | . | . | P | Polyproline II helix | trans | -64.7 | 133.2 | -179.7 | 26.1 | -32.9 | 0 | 0 | 0 | 110.1 | V73 L80 M116 R119 | V73-P75 WeakPolarHBondContact O-CD 3.4Å; P75-L80 HydrophobicContact CB-CD1 4.19Å; P75-M116 HydrophobicContact CB-SD 4.13Å; P75-R119 PolarHBondContact O-NH1 3.26Å; P75-R119 VanDerWaalsContact O-NH1 3.12Å |
| 76 | S | 84.9 | Confident | 82.7 | Confident | 45 Ų | 45 | 63.5 Ų | 63.5 | 32% | 0.315 | 32% | 0.318 | S | S | . | . | trans | -126.3 | 133.6 | 177 | 172.9 | 0 | 0 | 0 | 0 | 108 | V74 A78 S79 L80 | V74-S76 PolarHBondContact O-N 2.87Å; S76-A78 VanDerWaalsContact C-N 3.31Å; S76-A78 PolarHBondContact O-N 3.19Å; S76-S79 PolarHBondContact O-N 2.94Å; S76-L80 PolarHBondContact O-N 2.93Å | ||
| 77 | A | 83.4 | Confident | 81.8 | Confident | 15 Ų | 15 | 61.3 Ų | 61.3 | 12% | 0.124 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -50.8 | -51.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | S79 L80 I81 M116 I132 | A77-S79 VanDerWaalsContact C-N 3.31Å; A77-S79 PolarHBondContact O-N 3.5Å; A77-L80 PolarHBondContact O-N 2.88Å; A77-I81 WeakPolarHBondContact O-CB 3.46Å; A77-I81 WeakPolarHBondContact O-CD1 3.35Å; A77-I81 WeakPolarHBondContact O-CG1 3.48Å; A77-I81 PolarHBondContact O-N 2.99Å; A77-M116 HydrophobicContact CB-CE 4.31Å; A77-I132 HydrophobicContact CB-CD1 3.85Å |
| 78 | A | 81.5 | Confident | 81.2 | Confident | 54 Ų | 54 | 57.5 Ų | 57.5 | 45% | 0.446 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -57.9 | -41.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | S76 I81 I82 | S76-A78 VanDerWaalsContact C-N 3.31Å; S76-A78 PolarHBondContact O-N 3.19Å; A78-I81 PolarHBondContact O-N 3.38Å; A78-I82 WeakPolarHBondContact O-CD1 3.38Å; A78-I82 WeakPolarHBondContact O-CG1 3.33Å; A78-I82 PolarHBondContact O-N 3.06Å; A78-I82 VanDerWaalsContact O-N 3.09Å |
| 79 | S | 81.1 | Confident | 80.3 | Confident | 8 Ų | 8 | 56.6 Ų | 56.6 | 6% | 0.056 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.1 | -44.1 | -179 | -57.6 | 0 | 0 | 0 | 0 | 111.2 | W53 S76 A77 I82 R83 | W53-S79 WeakPolarHBondContact CZ3-O 3.41Å; S76-S79 PolarHBondContact O-N 2.94Å; A77-S79 VanDerWaalsContact C-N 3.31Å; A77-S79 PolarHBondContact O-N 3.5Å; S79-I82 PolarHBondContact O-N 3.46Å; S79-R83 WeakPolarHBondContact O-CB 3.43Å; S79-R83 PolarHBondContact O-N 3.09Å |
| 80 | L | 84.7 | Confident | 79.3 | Confident | 19 Ų | 19 | 59 Ų | 59 | 10% | 0.099 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -64 | -43.1 | 177.6 | -73.8 | 164.9 | 0 | 0 | 0 | 112 | W53 P75 S76 A77 I82 R83 E84 I112 T115 M116 | W53-L80 HydrophobicContact CH2-CD2 3.72Å; W53-L80 HydrophobicContact CH2-CG 4.23Å; P75-L80 HydrophobicContact CB-CD1 4.19Å; S76-L80 PolarHBondContact O-N 2.93Å; A77-L80 PolarHBondContact O-N 2.88Å; L80-I82 PolarHBondContact O-N 3.45Å; L80-R83 WeakPolarHBondContact O-CB 3.28Å; L80-R83 PolarHBondContact O-N 3.48Å; L80-E84 PolarHBondContact O-N 2.95Å; L80-I112 HydrophobicContact CB-CG1 4.2Å; L80-I112 HydrophobicContact CB-CG2 3.88Å; L80-I112 HydrophobicContact CD1-CG2 4.14Å; L80-T115 HydrophobicContact CD1-CG2 4.15Å; L80-T115 HydrophobicContact CD2-CG2 4.34Å; L80-M116 HydrophobicContact CD1-CG 3.71Å; L80-M116 HydrophobicContact CD1-SD 3.76Å |
| 81 | I | 82.2 | Confident | 78.1 | Confident | 14 Ų | 14 | 57.4 Ų | 57.4 | 7% | 0.072 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.5 | -48.9 | 177.1 | -69.7 | 161.9 | 0 | 0 | 0 | 110.6 | A77 A78 R83 E84 L85 L104 I112 I132 V136 | A77-I81 WeakPolarHBondContact O-CB 3.46Å; A77-I81 WeakPolarHBondContact O-CD1 3.35Å; A77-I81 WeakPolarHBondContact O-CG1 3.48Å; A77-I81 PolarHBondContact O-N 2.99Å; A78-I81 PolarHBondContact O-N 3.38Å; I81-R83 VanDerWaalsContact C-N 3.28Å; I81-R83 PolarHBondContact O-N 3.27Å; I81-E84 PolarHBondContact O-N 3.24Å; I81-L85 HydrophobicContact CG2-CD1 3.99Å; I81-L85 WeakPolarHBondContact O-CG 3.35Å; I81-L85 PolarHBondContact O-N 3.01Å; I81-L104 HydrophobicContact CG2-CD1 3.77Å; I81-I112 HydrophobicContact CG1-CD1 4.09Å; I81-I132 HydrophobicContact CD1-CG2 4.32Å; I81-I132 HydrophobicContact CG1-CG2 4.41Å; I81-V136 HydrophobicContact CD1-CG2 3.69Å; I81-V136 HydrophobicContact CG1-CG2 4.22Å; I81-V136 HydrophobicContact CG2-CG2 4.06Å |
| 82 | I | 79.9 | Confident | 76.8 | Confident | 30 Ų | 30 | 63 Ų | 63 | 15% | 0.154 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -68.9 | -31.4 | -177.5 | -58.4 | 154.1 | 0 | 0 | 0 | 111.6 | L56 A78 S79 L80 R90 | L56-I82 HydrophobicContact CD1-CB 4.46Å; L56-I82 HydrophobicContact CD1-CG2 4.35Å; L56-I82 HydrophobicContact CD2-CB 3.92Å; L56-I82 HydrophobicContact CD2-CD1 3.54Å; L56-I82 HydrophobicContact CD2-CG1 4.33Å; L56-I82 HydrophobicContact CD2-CG2 3.7Å; A78-I82 WeakPolarHBondContact O-CD1 3.38Å; A78-I82 WeakPolarHBondContact O-CG1 3.33Å; A78-I82 PolarHBondContact O-N 3.06Å; A78-I82 VanDerWaalsContact O-N 3.09Å; S79-I82 PolarHBondContact O-N 3.46Å; L80-I82 PolarHBondContact O-N 3.45Å; I82-R90 VanDerWaalsContact CG1-NH2 3.29Å |
| 83 | R | 79.7 | Confident | 75.6 | Confident | 100 Ų | 100 | 70.2 Ų | 70.2 | 38% | 0.377 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.4 | -44.2 | 172.9 | 176.7 | -177.4 | 174.2 | 150.9 | 7 | 111.5 | E52 W53 S79 L80 I81 K86 | E52-R83 VanDerWaalsContact CD-NH2 3.34Å; E52-R83 IonicContact OE1-NH2 2.67Å; E52-R83 IonicContact OE2-CZ 3.14Å; E52-R83 IonicContact OE2-NH1 2.91Å; E52-R83 PolarHBondContact OE2-NH1 3.09Å; E52-R83 IonicContact OE2-NH2 2.74Å; E52-R83 PolarHBondContact OE2-NH2 3.18Å; W53-R83 HydrophobicContact CE3-CB 4.3Å; W53-R83 VanDerWaalsContact CZ2-NH1 3.35Å; W53-R83 HydrophobicContact CZ3-CB 3.77Å; W53-R83 HydrophobicContact CZ3-CG 4.27Å; S79-R83 WeakPolarHBondContact O-CB 3.43Å; S79-R83 PolarHBondContact O-N 3.09Å; L80-R83 WeakPolarHBondContact O-CB 3.28Å; L80-R83 PolarHBondContact O-N 3.48Å; I81-R83 VanDerWaalsContact C-N 3.28Å; I81-R83 PolarHBondContact O-N 3.27Å; R83-K86 PolarHBondContact O-N 2.98Å |
| 84 | E | 81.5 | Confident | 74.4 | Confident | 42 Ų | 42 | 76.2 Ų | 76.2 | 20% | 0.196 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -72 | -29.3 | 179.3 | -75.4 | -58.3 | 154.6 | 0 | 0 | 113.6 | L80 I81 K86 L104 Q108 I112 | L80-E84 PolarHBondContact O-N 2.95Å; I81-E84 PolarHBondContact O-N 3.24Å; E84-K86 PolarHBondContact O-N 2.8Å; E84-K86 VanDerWaalsContact O-N 3.14Å; E84-L104 HydrophobicContact CB-CD2 3.75Å; E84-Q108 HydrophobicContact CB-CB 4.48Å; E84-Q108 HydrophobicContact CG-CB 4.38Å; E84-Q108 PolarHBondContact O-NE2 3.05Å; E84-Q108 PolarHBondContact OE2-NE2 3.31Å; E84-I112 HydrophobicContact CB-CD1 4.19Å; E84-I112 HydrophobicContact CG-CD1 3.83Å; E84-I112 HydrophobicContact CG-CG1 4Å |
| 85 | L | 77 | Confident | 73 | Confident | 27 Ų | 27 | 79.3 Ų | 79.3 | 14% | 0.141 | 39% | 0.39 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | -12.3 | 173.4 | -74.7 | 169.2 | 0 | 0 | 0 | 113.3 | I81 E87 G102 L104 | I81-L85 HydrophobicContact CG2-CD1 3.99Å; I81-L85 WeakPolarHBondContact O-CG 3.35Å; I81-L85 PolarHBondContact O-N 3.01Å; L85-E87 HydrophobicContact CB-CG 4.09Å; L85-E87 PolarHBondContact O-N 3.29Å; L85-G102 VanDerWaalsContact CD2-C 3.47Å; L85-G102 VanDerWaalsContact CD2-O 3.3Å; L85-G102 WeakPolarHBondContact CD2-O 3.38Å; L85-L104 HydrophobicContact CD1-CD1 4.32Å; L85-L104 HydrophobicContact CD2-CD1 3.78Å; L85-L104 HydrophobicContact CD2-CD2 4.3Å; L85-L104 HydrophobicContact CD2-CG 3.61Å; L85-L104 HydrophobicContact CG-CD1 3.98Å; L85-L104 HydrophobicContact CG-CD2 4.21Å; L85-L104 HydrophobicContact CG-CG 3.98Å |
| 86 | K | 71.7 | Confident | 71.9 | Confident | 178 Ų | 178 | 86.4 Ų | 86.4 | 77% | 0.774 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.4 | 31.7 | -178.8 | -64.7 | 177.7 | -177.3 | 172.1 | 0 | 113.2 | R83 E84 | R83-K86 PolarHBondContact O-N 2.98Å; E84-K86 PolarHBondContact O-N 2.8Å; E84-K86 VanDerWaalsContact O-N 3.14Å |
| 87 | E | 66 | Low | 70.8 | Confident | 51 Ų | 51 | 91.9 Ų | 91.9 | 24% | 0.238 | 44% | 0.442 | C | S | . | . | P | Polyproline II helix | trans | -70.2 | 148.2 | -178 | -81.5 | -175.6 | -170.2 | 0 | 0 | 111.6 | L85 H100 | L85-E87 HydrophobicContact CB-CG 4.09Å; L85-E87 PolarHBondContact O-N 3.29Å; E87-H100 WeakPolarHBondContact OE1-CA 3.38Å; E87-H100 WeakPolarHBondContact OE1-CB 2.83Å; E87-H100 IonicContact OE1-CD2 2.84Å; E87-H100 IonicContact OE1-CG 3.3Å; E87-H100 IonicContact OE2-CD2 2.62Å; E87-H100 PolarHBondContact OE2-CD2 2.99Å; E87-H100 IonicContact OE2-NE2 2.86Å |
| 88 | P | 64.8 | Low | 69.7 | Low | 114 Ų | 114 | 95.1 Ų | 95.1 | 74% | 0.74 | 46% | 0.457 | S | S | * | . | P | Polyproline II helix | trans | -60.4 | 155.2 | 179.8 | 25 | -33.6 | 0 | 0 | 0 | 112.1 | R90 | P88-R90 PolarHBondContact O-N 2.8Š|
| 89 | Q | 63.8 | Low | 68.8 | Low | 131 Ų | 131 | 101.9 Ų | 101.9 | 61% | 0.612 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -52.5 | 124.9 | -175.9 | -67.6 | -179.9 | 8.2 | 0 | 0 | 111.5 | D91 | Q89-D91 PolarHBondContact O-N 3.26Š|
| 90 | R | 63.3 | Low | 67.9 | Low | 79 Ų | 79 | 106 Ų | 106 | 30% | 0.298 | 49% | 0.494 | S | S | . | . | trans | -72.4 | 110 | -177.5 | -69.6 | -179.8 | 173 | 176.1 | 0.1 | 111.9 | I82 P88 R92 H100 | I82-R90 VanDerWaalsContact CG1-NH2 3.29Å; P88-R90 PolarHBondContact O-N 2.8Å; R90-R92 PolarHBondContact O-N 2.84Å; R90-R92 VanDerWaalsContact O-N 3.08Å; R90-H100 PolarHBondContact NH2-CD2 3.12Å; R90-H100 PolarHBondContact NH2-NE2 3.49Å | ||
| 91 | D | 62.6 | Low | 66.8 | Low | 102 Ų | 102 | 108.5 Ų | 108.5 | 55% | 0.545 | 53% | 0.525 | S | S | . | . | trans | -76.5 | 88.4 | 165.6 | -90.6 | -13.9 | 0 | 0 | 0 | 110.7 | Q89 K93 K94 | Q89-D91 PolarHBondContact O-N 3.26Å; D91-K93 PolarHBondContact O-N 3.43Å; D91-K94 PolarHBondContact O-N 3.05Å | ||
| 92 | R | 61 | Low | 66 | Low | 149 Ų | 149 | 109.5 Ų | 109.5 | 56% | 0.562 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.1 | -20.8 | 179.8 | -78.8 | -171.2 | 79 | -135.6 | -3.3 | 114.7 | K57 R90 | K57-R92 VanDerWaalsContact CE-CZ 3.45Å; K57-R92 VanDerWaalsContact CE-NH2 3.35Å; R90-R92 PolarHBondContact O-N 2.84Å; R90-R92 VanDerWaalsContact O-N 3.08Å |
| 93 | K | 63.1 | Low | 65.5 | Low | 212 Ų | 212 | 113.5 Ų | 113.5 | 92% | 0.922 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -23.6 | -171.4 | -67.4 | -177.2 | -178.3 | 175.3 | 0 | 114.2 | D91 | D91-K93 PolarHBondContact O-N 3.43Š|
| 94 | K | 61.8 | Low | 65.2 | Low | 170 Ų | 170 | 110.9 Ų | 110.9 | 74% | 0.739 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | -38 | -169.9 | -72.3 | 178.4 | -179.4 | 167.8 | 0 | 114 | D91 | D91-K94 PolarHBondContact O-N 3.05Š|
| 95 | V | 56.3 | Low | 65.1 | Low | 85 Ų | 85 | 111.4 Ų | 111.4 | 52% | 0.515 | 56% | 0.561 | S | S | . | * | trans | -137.6 | 117.9 | -177.6 | -172.1 | 0 | 0 | 0 | 0 | 109.4 | I98 | V95-I98 HydrophobicContact CB-CD1 4.28Å; V95-I98 HydrophobicContact CB-CG1 3.89Å; V95-I98 HydrophobicContact CG1-CG1 3.8Å | ||
| 96 | K | 58.7 | Low | 65 | Low | 189 Ų | 189 | 113.7 Ų | 113.7 | 82% | 0.822 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -81.4 | 140.6 | 166.9 | -64.2 | 178.6 | -177 | 174.3 | 0 | 107.4 | ||
| 97 | N | 62.1 | Low | 65.5 | Low | 160 Ų | 160 | 112.8 Ų | 112.8 | 86% | 0.856 | 57% | 0.572 | S | S | * | * | S | Bend | trans | 60.1 | 57.9 | 176.9 | -54.5 | -7 | 0 | 0 | 0 | 114.1 | K99 | N97-K99 PolarHBondContact O-N 3.25Š|
| 98 | I | 61.5 | Low | 66.3 | Low | 84 Ų | 84 | 112.2 Ų | 112.2 | 43% | 0.431 | 57% | 0.569 | S | S | . | * | P | Polyproline II helix | trans | -64.8 | 125 | 165 | -58.2 | 171.8 | 0 | 0 | 0 | 107 | V95 H100 | V95-I98 HydrophobicContact CB-CD1 4.28Å; V95-I98 HydrophobicContact CB-CG1 3.89Å; V95-I98 HydrophobicContact CG1-CG1 3.8Å; I98-H100 PolarHBondContact O-CE1 2.91Å; I98-H100 PolarHBondContact O-N 3.4Å; I98-H100 PolarHBondContact O-ND1 3.16Å |
| 99 | K | 63.2 | Low | 67.2 | Low | 196 Ų | 196 | 107.2 Ų | 107.2 | 85% | 0.852 | 54% | 0.537 | S | S | * | . | P | Polyproline II helix | trans | -69.1 | 128.3 | 172.4 | -67.7 | -173.8 | 177.3 | -173 | 0 | 108.3 | N97 | N97-K99 PolarHBondContact O-N 3.25Š|
| 100 | H | 61.8 | Low | 68.1 | Low | 94 Ų | 94 | 101.6 Ų | 101.6 | 44% | 0.435 | 51% | 0.511 | S | S | . | . | P | Polyproline II helix | trans | -82.7 | 117.2 | 177.5 | -53.2 | 80.8 | 0 | 0 | 0 | 106.4 | E87 R90 I98 | E87-H100 WeakPolarHBondContact OE1-CA 3.38Å; E87-H100 WeakPolarHBondContact OE1-CB 2.83Å; E87-H100 IonicContact OE1-CD2 2.84Å; E87-H100 IonicContact OE1-CG 3.3Å; E87-H100 IonicContact OE2-CD2 2.62Å; E87-H100 PolarHBondContact OE2-CD2 2.99Å; E87-H100 IonicContact OE2-NE2 2.86Å; R90-H100 PolarHBondContact NH2-CD2 3.12Å; R90-H100 PolarHBondContact NH2-NE2 3.49Å; I98-H100 PolarHBondContact O-CE1 2.91Å; I98-H100 PolarHBondContact O-N 3.4Å; I98-H100 PolarHBondContact O-ND1 3.16Å |
| 101 | G | 60 | Low | 69.2 | Low | 71 Ų | 71 | 103 Ų | 103 | 73% | 0.732 | 52% | 0.521 | S | S | * | . | trans | -109.8 | 7.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 102 | G | 66.4 | Low | 70.3 | Confident | 35 Ų | 35 | 98.2 Ų | 98.2 | 36% | 0.361 | 50% | 0.496 | S | S | . | . | P | Polyproline II helix | trans | -78.9 | 146.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L85 | L85-G102 VanDerWaalsContact CD2-C 3.47Å; L85-G102 VanDerWaalsContact CD2-O 3.3Å; L85-G102 WeakPolarHBondContact CD2-O 3.38Å |
| 103 | N | 69.4 | Low | 71.5 | Confident | 115 Ų | 115 | 91.2 Ų | 91.2 | 62% | 0.615 | 47% | 0.469 | S | S | * | . | P | Polyproline II helix | trans | -93 | 130.8 | 174.9 | -66.9 | -12.1 | 0 | 0 | 0 | 109.4 | Y142 | N103-Y142 PolarHBondContact OD1-OH 3.47Š|
| 104 | L | 73.7 | Confident | 72.5 | Confident | 45 Ų | 45 | 86.3 Ų | 86.3 | 24% | 0.236 | 45% | 0.448 | C | S | . | . | P | Polyproline II helix | trans | -95.9 | 129.5 | 170.6 | -76.9 | 140.2 | 0 | 0 | 0 | 108.8 | I81 E84 L85 Q108 V109 I112 V136 | I81-L104 HydrophobicContact CG2-CD1 3.77Å; E84-L104 HydrophobicContact CB-CD2 3.75Å; L85-L104 HydrophobicContact CD1-CD1 4.32Å; L85-L104 HydrophobicContact CD2-CD1 3.78Å; L85-L104 HydrophobicContact CD2-CD2 4.3Å; L85-L104 HydrophobicContact CD2-CG 3.61Å; L85-L104 HydrophobicContact CG-CD1 3.98Å; L85-L104 HydrophobicContact CG-CD2 4.21Å; L85-L104 HydrophobicContact CG-CG 3.98Å; L104-Q108 HydrophobicContact CD2-CB 4.49Å; L104-V109 HydrophobicContact CB-CG2 4.3Å; L104-I112 HydrophobicContact CD2-CD1 4.44Å; L104-V136 HydrophobicContact CD1-CG2 4.25Å |
| 105 | S | 79.8 | Confident | 73.7 | Confident | 52 Ų | 52 | 81 Ų | 81 | 36% | 0.364 | 43% | 0.43 | S | S | . | . | P | Polyproline II helix | trans | -73.6 | 149.3 | 169.3 | 62.7 | 0 | 0 | 0 | 0 | 110.5 | E107 Q108 V109 | S105-E107 PolarHBondContact O-N 2.96Å; S105-Q108 WeakPolarHBondContact O-CB 3.37Å; S105-Q108 PolarHBondContact O-N 3.33Å; S105-Q108 VanDerWaalsContact OG-CD 3.31Å; S105-Q108 WeakPolarHBondContact OG-CG 3.41Å; S105-Q108 PolarHBondContact OG-N 3.25Å; S105-Q108 PolarHBondContact OG-OE1 3.46Å; S105-V109 PolarHBondContact O-N 2.97Å; S105-V109 VanDerWaalsContact O-N 3.16Å |
| 106 | L | 75 | Confident | 75 | Confident | 75 Ų | 75 | 78 Ų | 78 | 39% | 0.393 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.4 | -31.3 | 179.2 | -168.4 | 142.6 | 0 | 0 | 0 | 112 | Q108 V109 V110 F152 L155 | L106-Q108 PolarHBondContact O-N 2.92Å; L106-V109 PolarHBondContact O-N 3.3Å; L106-V110 HydrophobicContact CD2-CG2 4.07Å; L106-V110 WeakPolarHBondContact O-CG2 3.37Å; L106-V110 PolarHBondContact O-N 2.91Å; L106-F152 HydrophobicContact CD1-CD2 3.75Å; L106-F152 HydrophobicContact CD1-CE2 3.83Å; L106-L155 HydrophobicContact CD2-CD1 4.06Å; L106-L155 HydrophobicContact CD2-CD2 3.5Å; L106-L155 HydrophobicContact CD2-CG 4.34Å |
| 107 | E | 80.9 | Confident | 76 | Confident | 160 Ų | 160 | 73.4 Ų | 73.4 | 75% | 0.748 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -61.4 | -41.7 | 173.2 | -63.8 | -177.2 | 176.2 | 0 | 0 | 112.5 | S105 V110 H111 | S105-E107 PolarHBondContact O-N 2.96Å; E107-V110 PolarHBondContact O-N 3.47Å; E107-H111 PolarHBondContact O-N 3.19Å |
| 108 | Q | 82.9 | Confident | 76.9 | Confident | 39 Ų | 39 | 71.3 Ų | 71.3 | 18% | 0.182 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.4 | -40 | 175.1 | -72.6 | 169.7 | -58.1 | 0 | 0 | 111.3 | E84 L104 S105 L106 V110 H111 I112 | E84-Q108 HydrophobicContact CB-CB 4.48Å; E84-Q108 HydrophobicContact CG-CB 4.38Å; E84-Q108 PolarHBondContact O-NE2 3.05Å; E84-Q108 PolarHBondContact OE2-NE2 3.31Å; L104-Q108 HydrophobicContact CD2-CB 4.49Å; S105-Q108 WeakPolarHBondContact O-CB 3.37Å; S105-Q108 PolarHBondContact O-N 3.33Å; S105-Q108 VanDerWaalsContact OG-CD 3.31Å; S105-Q108 WeakPolarHBondContact OG-CG 3.41Å; S105-Q108 PolarHBondContact OG-N 3.25Å; S105-Q108 PolarHBondContact OG-OE1 3.46Å; L106-Q108 PolarHBondContact O-N 2.92Å; Q108-V110 VanDerWaalsContact C-N 3.33Å; Q108-V110 PolarHBondContact O-N 3.19Å; Q108-H111 WeakPolarHBondContact O-CB 3.3Å; Q108-H111 PolarHBondContact O-N 3.45Å; Q108-I112 VanDerWaalsContact O-CG1 3.28Å; Q108-I112 WeakPolarHBondContact O-CG1 3.03Å; Q108-I112 PolarHBondContact O-N 3.45Å |
| 109 | V | 83.8 | Confident | 77.8 | Confident | 9 Ų | 9 | 74.3 Ų | 74.3 | 6% | 0.055 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.7 | -43 | 175.8 | 178.9 | 0 | 0 | 0 | 0 | 110.8 | L104 S105 L106 H111 I112 A113 V129 I132 L133 | L104-V109 HydrophobicContact CB-CG2 4.3Å; S105-V109 PolarHBondContact O-N 2.97Å; S105-V109 VanDerWaalsContact O-N 3.16Å; L106-V109 PolarHBondContact O-N 3.3Å; V109-H111 VanDerWaalsContact C-N 3.33Å; V109-H111 PolarHBondContact O-N 2.9Å; V109-I112 PolarHBondContact O-N 3.21Å; V109-A113 WeakPolarHBondContact O-CB 3.36Å; V109-A113 PolarHBondContact O-N 2.86Å; V109-V129 HydrophobicContact CG1-CG1 4.11Å; V109-I132 HydrophobicContact CG1-CB 4.41Å; V109-I132 HydrophobicContact CG1-CG2 4.03Å; V109-L133 HydrophobicContact CG1-CD2 4Å; V109-L133 HydrophobicContact CG1-CG 4.18Å; V109-L133 HydrophobicContact CG2-CD2 4.34Å |
| 110 | V | 83.6 | Confident | 78.5 | Confident | 13 Ų | 13 | 66 Ų | 66 | 8% | 0.079 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.2 | -39.5 | 175.3 | 173.5 | 0 | 0 | 0 | 0 | 111.2 | L106 E107 Q108 A113 K114 L155 V159 | L106-V110 HydrophobicContact CD2-CG2 4.07Å; L106-V110 WeakPolarHBondContact O-CG2 3.37Å; L106-V110 PolarHBondContact O-N 2.91Å; E107-V110 PolarHBondContact O-N 3.47Å; Q108-V110 VanDerWaalsContact C-N 3.33Å; Q108-V110 PolarHBondContact O-N 3.19Å; V110-A113 PolarHBondContact O-N 3.09Å; V110-K114 HydrophobicContact CG1-CD 4.44Å; V110-K114 WeakPolarHBondContact O-CG 3.04Å; V110-K114 PolarHBondContact O-N 3.47Å; V110-L155 HydrophobicContact CG2-CD2 4.45Å; V110-V159 HydrophobicContact CG1-CG1 3.98Å; V110-V159 HydrophobicContact CG1-CG2 4.42Å |
| 111 | H | 85.7 | Confident | 79.3 | Confident | 108 Ų | 108 | 70.2 Ų | 70.2 | 50% | 0.5 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 175 | -174.3 | 67.3 | 0 | 0 | 0 | 112.6 | E107 Q108 V109 K114 T115 | E107-H111 PolarHBondContact O-N 3.19Å; Q108-H111 WeakPolarHBondContact O-CB 3.3Å; Q108-H111 PolarHBondContact O-N 3.45Å; V109-H111 VanDerWaalsContact C-N 3.33Å; V109-H111 PolarHBondContact O-N 2.9Å; H111-K114 PolarHBondContact O-N 3.38Å; H111-T115 PolarHBondContact O-N 3.46Å; H111-T115 VanDerWaalsContact O-N 3.09Å; H111-T115 PolarHBondContact O-OG1 3.39Å; H111-T115 VanDerWaalsContact O-OG1 3.06Å |
| 112 | I | 85.6 | Confident | 80 | Confident | 2 Ų | 2 | 67.6 Ų | 67.6 | 1% | 0.01 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.8 | -45 | 174.2 | -65.6 | 167.5 | 0 | 0 | 0 | 110.2 | L80 I81 E84 L104 Q108 V109 K114 T115 M116 I132 | L80-I112 HydrophobicContact CB-CG1 4.2Å; L80-I112 HydrophobicContact CB-CG2 3.88Å; L80-I112 HydrophobicContact CD1-CG2 4.14Å; I81-I112 HydrophobicContact CG1-CD1 4.09Å; E84-I112 HydrophobicContact CB-CD1 4.19Å; E84-I112 HydrophobicContact CG-CD1 3.83Å; E84-I112 HydrophobicContact CG-CG1 4Å; L104-I112 HydrophobicContact CD2-CD1 4.44Å; Q108-I112 VanDerWaalsContact O-CG1 3.28Å; Q108-I112 WeakPolarHBondContact O-CG1 3.03Å; Q108-I112 PolarHBondContact O-N 3.45Å; V109-I112 PolarHBondContact O-N 3.21Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 3.34Å; I112-T115 PolarHBondContact O-N 3.27Å; I112-M116 HydrophobicContact CG2-CG 4.3Å; I112-M116 WeakPolarHBondContact O-CB 3.46Å; I112-M116 WeakPolarHBondContact O-CG 3.45Å; I112-M116 PolarHBondContact O-N 2.93Å; I112-I132 HydrophobicContact CB-CG2 4.43Å; I112-I132 HydrophobicContact CG2-CD1 4Å; I112-I132 HydrophobicContact CG2-CG1 4.18Å; I112-I132 HydrophobicContact CG2-CG2 3.86Å |
| 113 | A | 85.6 | Confident | 80.4 | Confident | 1 Ų | 1 | 75 Ų | 75 | 1% | 0.008 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -61.4 | -41.8 | 179 | 0 | 0 | 0 | 0 | 0 | 111.9 | V109 V110 T115 M116 R117 T128 V129 I132 | V109-A113 WeakPolarHBondContact O-CB 3.36Å; V109-A113 PolarHBondContact O-N 2.86Å; V110-A113 PolarHBondContact O-N 3.09Å; A113-T115 PolarHBondContact O-N 3.29Å; A113-M116 CarbonylContact O-C 3.56Å; A113-M116 PolarHBondContact O-N 3.08Å; A113-R117 PolarHBondContact O-N 3.25Å; A113-T128 HydrophobicContact CB-CG2 3.96Å; A113-T128 WeakPolarHBondContact O-CG2 3.43Å; A113-V129 HydrophobicContact CB-CG2 3.68Å; A113-I132 HydrophobicContact CB-CG1 4.35Å |
| 114 | K | 85.7 | Confident | 80.8 | Confident | 109 Ų | 109 | 77.9 Ų | 77.9 | 47% | 0.474 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.6 | -43.1 | 174 | -74.6 | 179.7 | 178.6 | -174.5 | 0 | 111.8 | V110 H111 I112 M116 R117 M125 | V110-K114 HydrophobicContact CG1-CD 4.44Å; V110-K114 WeakPolarHBondContact O-CG 3.04Å; V110-K114 PolarHBondContact O-N 3.47Å; H111-K114 PolarHBondContact O-N 3.38Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 3.34Å; K114-M116 VanDerWaalsContact C-N 3.31Å; K114-M116 PolarHBondContact O-N 3.02Å; K114-R117 VanDerWaalsContact O-CB 3.3Å; K114-R117 WeakPolarHBondContact O-CB 3.37Å; K114-R117 PolarHBondContact O-N 3Å; K114-M125 HydrophobicContact CG-SD 4.22Å |
| 115 | T | 85.6 | Confident | 80.9 | Confident | 58 Ų | 58 | 76.1 Ų | 76.1 | 36% | 0.356 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.3 | -34.1 | 176.6 | -54.9 | 0 | 0 | 0 | 0 | 112.3 | L80 H111 I112 A113 P118 | L80-T115 HydrophobicContact CD1-CG2 4.15Å; L80-T115 HydrophobicContact CD2-CG2 4.34Å; H111-T115 PolarHBondContact O-N 3.46Å; H111-T115 VanDerWaalsContact O-N 3.09Å; H111-T115 PolarHBondContact O-OG1 3.39Å; H111-T115 VanDerWaalsContact O-OG1 3.06Å; I112-T115 PolarHBondContact O-N 3.27Å; A113-T115 PolarHBondContact O-N 3.29Å; T115-P118 WeakPolarHBondContact O-CD 3.3Å |
| 116 | M | 84.3 | Confident | 80.7 | Confident | 24 Ų | 24 | 75.4 Ų | 75.4 | 12% | 0.118 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -83.6 | -10.7 | 179.6 | -73.7 | -69.4 | -59.3 | 0 | 0 | 113.8 | P75 A77 L80 I112 A113 K114 P118 R119 S120 T128 I132 | P75-M116 HydrophobicContact CB-SD 4.13Å; A77-M116 HydrophobicContact CB-CE 4.31Å; L80-M116 HydrophobicContact CD1-CG 3.71Å; L80-M116 HydrophobicContact CD1-SD 3.76Å; I112-M116 HydrophobicContact CG2-CG 4.3Å; I112-M116 WeakPolarHBondContact O-CB 3.46Å; I112-M116 WeakPolarHBondContact O-CG 3.45Å; I112-M116 PolarHBondContact O-N 2.93Å; A113-M116 CarbonylContact O-C 3.56Å; A113-M116 PolarHBondContact O-N 3.08Å; K114-M116 VanDerWaalsContact C-N 3.31Å; K114-M116 PolarHBondContact O-N 3.02Å; M116-P118 VanDerWaalsContact C-CD 3.42Å; M116-R119 PolarHBondContact O-N 2.68Å; M116-S120 PolarHBondContact O-N 3.11Å; M116-T128 HydrophobicContact CB-CG2 4.5Å; M116-I132 HydrophobicContact CB-CD1 4.18Å; M116-I132 HydrophobicContact CG-CD1 3.9Å |
| 117 | R | 79.3 | Confident | 81 | Confident | 91 Ų | 91 | 73 Ų | 73 | 34% | 0.343 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52 | -41.1 | -177.8 | -167.8 | 67.1 | 174.9 | 152.7 | 8.5 | 114.2 | A113 K114 R119 S120 A122 R123 R124 T128 | A113-R117 PolarHBondContact O-N 3.25Å; K114-R117 VanDerWaalsContact O-CB 3.3Å; K114-R117 WeakPolarHBondContact O-CB 3.37Å; K114-R117 PolarHBondContact O-N 3Å; R117-R119 PolarHBondContact O-N 3.5Å; R117-R119 VanDerWaalsContact O-N 3.15Å; R117-S120 PolarHBondContact O-N 3.07Å; R117-A122 PolarHBondContact NH1-O 3.34Å; R117-R123 PolarHBondContact NH2-O 3.39Å; R117-R124 PolarHBondContact NH1-O 2.99Å; R117-R124 VanDerWaalsContact NH1-O 3.17Å; R117-T128 PolarHBondContact NH1-OG1 3.02Å |
| 118 | P | 81.3 | Confident | 81 | Confident | 117 Ų | 117 | 65.4 Ų | 65.4 | 76% | 0.76 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68 | -12.6 | 178.9 | -20.2 | 33.7 | 0 | 0 | 0 | 114.7 | T115 M116 | T115-P118 WeakPolarHBondContact O-CD 3.3Å; M116-P118 VanDerWaalsContact C-CD 3.42Å |
| 119 | R | 80.1 | Confident | 81.1 | Confident | 146 Ų | 146 | 63.7 Ų | 63.7 | 55% | 0.551 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.4 | -14.8 | -178.9 | -62.8 | -159.9 | 71 | -154.3 | -1.2 | 114.1 | P75 M116 R117 | P75-R119 PolarHBondContact O-NH1 3.26Å; P75-R119 VanDerWaalsContact O-NH1 3.12Å; M116-R119 PolarHBondContact O-N 2.68Å; R117-R119 PolarHBondContact O-N 3.5Å; R117-R119 VanDerWaalsContact O-N 3.15Å |
| 120 | S | 77.2 | Confident | 80.9 | Confident | 22 Ų | 22 | 69.7 Ų | 69.7 | 15% | 0.154 | 33% | 0.327 | C | S | . | . | trans | -77.1 | 138.8 | -180 | 172 | 0 | 0 | 0 | 0 | 110 | M116 R117 A122 T128 E131 | M116-S120 PolarHBondContact O-N 3.11Å; R117-S120 PolarHBondContact O-N 3.07Å; S120-A122 VanDerWaalsContact C-N 3.28Å; S120-A122 WeakPolarHBondContact OG-CB 3.14Å; S120-A122 PolarHBondContact OG-N 2.83Å; S120-T128 PolarHBondContact OG-OG1 3.01Å; S120-E131 WeakPolarHBondContact CB-OE2 3.44Å; S120-E131 PolarHBondContact OG-OE2 2.89Å | ||
| 121 | M | 79 | Confident | 80.8 | Confident | 182 Ų | 182 | 73 Ų | 73 | 90% | 0.897 | 34% | 0.342 | S | S | * | . | trans | -87.4 | 0.7 | 177.1 | -64.9 | -65 | -69.2 | 0 | 0 | 112.2 | ||||
| 122 | A | 74.8 | Confident | 80.7 | Confident | 16 Ų | 16 | 68.1 Ų | 68.1 | 13% | 0.132 | 32% | 0.319 | C | S | . | . | trans | -69.8 | 129.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | R117 S120 R124 G127 T128 | R117-A122 PolarHBondContact NH1-O 3.34Å; S120-A122 VanDerWaalsContact C-N 3.28Å; S120-A122 WeakPolarHBondContact OG-CB 3.14Å; S120-A122 PolarHBondContact OG-N 2.83Å; A122-R124 PolarHBondContact O-N 3.31Å; A122-G127 VanDerWaalsContact CB-C 3.46Å; A122-T128 VanDerWaalsContact CB-N 3.32Å | ||
| 123 | R | 74.6 | Confident | 80.5 | Confident | 192 Ų | 192 | 70.8 Ų | 70.8 | 73% | 0.725 | 33% | 0.333 | S | S | * | . | S | Bend | trans | -55.1 | -49 | 177.5 | -67.6 | -176.8 | 177.9 | -170 | -3.5 | 112.6 | R117 | R117-R123 PolarHBondContact NH2-O 3.39Š|
| 124 | R | 79.2 | Confident | 80.2 | Confident | 175 Ų | 175 | 74 Ų | 74 | 66% | 0.66 | 37% | 0.366 | S | S | * | . | S | Bend | trans | -113.1 | 159.9 | -179 | -61.4 | -174.7 | -175 | 169.9 | 1.7 | 111.3 | R117 A122 N126 G127 T128 | R117-R124 PolarHBondContact NH1-O 2.99Å; R117-R124 VanDerWaalsContact NH1-O 3.17Å; A122-R124 PolarHBondContact O-N 3.31Å; R124-N126 PolarHBondContact O-N 2.83Å; R124-G127 PolarHBondContact O-N 3.46Å; R124-T128 PolarHBondContact O-N 3.27Å |
| 125 | M | 75.2 | Confident | 79.9 | Confident | 8 Ų | 8 | 72.1 Ų | 72.1 | 4% | 0.039 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -61.9 | -30.3 | 176.8 | -179.5 | 158.4 | 40.3 | 0 | 0 | 111.9 | K114 G127 T128 V129 V159 S163 | K114-M125 HydrophobicContact CG-SD 4.22Å; M125-G127 PolarHBondContact O-N 2.96Å; M125-T128 CarbonylContact O-C 3.59Å; M125-T128 WeakPolarHBondContact O-CA 3.36Å; M125-T128 WeakPolarHBondContact O-CB 3.2Å; M125-T128 PolarHBondContact O-N 2.96Å; M125-V129 HydrophobicContact CG-CG2 4.36Å; M125-V129 WeakPolarHBondContact O-CG2 3.49Å; M125-V129 PolarHBondContact O-N 3.03Å; M125-V159 HydrophobicContact CE-CB 3.48Å; M125-V159 VanDerWaalsContact CE-CB 3.48Å; M125-V159 HydrophobicContact CE-CG1 3.13Å; M125-V159 WeakPolarHBondContact CE-O 3.43Å; M125-V159 HydrophobicContact SD-CB 4.28Å; M125-V159 HydrophobicContact SD-CG1 3.5Å; M125-V159 VanDerWaalsContact SD-CG1 3.5Å; M125-S163 WeakPolarHBondContact CE-OG 3.45Å |
| 126 | N | 74.9 | Confident | 79.2 | Confident | 36 Ų | 36 | 71.4 Ų | 71.4 | 19% | 0.193 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -56.4 | -38.2 | 172.2 | -53.8 | -8.2 | 0 | 0 | 0 | 111.9 | R124 K130 L156 D160 | R124-N126 PolarHBondContact O-N 2.83Å; N126-K130 WeakPolarHBondContact O-CB 3.35Å; N126-K130 VanDerWaalsContact O-CG 3.29Å; N126-K130 WeakPolarHBondContact O-CG 3.3Å; N126-K130 PolarHBondContact O-N 3.01Å; N126-L156 HydrophobicContact CB-CD1 3.91Å; N126-L156 HydrophobicContact CB-CD2 4.28Å; N126-L156 WeakPolarHBondContact OD1-CB 3.45Å; N126-L156 VanDerWaalsContact OD1-CD2 3.29Å; N126-L156 WeakPolarHBondContact OD1-CD2 3.39Å; N126-D160 VanDerWaalsContact CG-OD2 3.31Å; N126-D160 PolarHBondContact ND2-OD2 3.27Å; N126-D160 PolarHBondContact OD1-OD2 3.29Å |
| 127 | G | 81.3 | Confident | 78.2 | Confident | 25 Ų | 25 | 79.3 Ų | 79.3 | 26% | 0.258 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -69.5 | -41.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A122 R124 M125 V129 K130 E131 | A122-G127 VanDerWaalsContact CB-C 3.46Å; R124-G127 PolarHBondContact O-N 3.46Å; M125-G127 PolarHBondContact O-N 2.96Å; G127-V129 PolarHBondContact O-N 3.5Å; G127-K130 PolarHBondContact O-N 3.49Å; G127-E131 WeakPolarHBondContact O-CG 3.19Å; G127-E131 PolarHBondContact O-N 3.16Å |
| 128 | T | 81.5 | Confident | 77 | Confident | 1 Ų | 1 | 77.9 Ų | 77.9 | 1% | 0.006 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -62.5 | -41.7 | 176 | -53.1 | 0 | 0 | 0 | 0 | 111.5 | A113 M116 R117 S120 A122 R124 M125 E131 I132 | A113-T128 HydrophobicContact CB-CG2 3.96Å; A113-T128 WeakPolarHBondContact O-CG2 3.43Å; M116-T128 HydrophobicContact CB-CG2 4.5Å; R117-T128 PolarHBondContact NH1-OG1 3.02Å; S120-T128 PolarHBondContact OG-OG1 3.01Å; A122-T128 VanDerWaalsContact CB-N 3.32Å; R124-T128 PolarHBondContact O-N 3.27Å; M125-T128 CarbonylContact O-C 3.59Å; M125-T128 WeakPolarHBondContact O-CA 3.36Å; M125-T128 WeakPolarHBondContact O-CB 3.2Å; M125-T128 PolarHBondContact O-N 2.96Å; T128-E131 WeakPolarHBondContact O-CB 3.29Å; T128-E131 PolarHBondContact O-N 3.41Å; T128-I132 WeakPolarHBondContact O-CG1 3.49Å; T128-I132 PolarHBondContact O-N 2.91Å |
| 129 | V | 83.9 | Confident | 75.1 | Confident | 2 Ų | 2 | 75.5 Ų | 75.5 | 1% | 0.012 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -62.7 | -45 | 175.2 | 174.5 | 0 | 0 | 0 | 0 | 110.7 | V109 A113 M125 G127 E131 I132 L133 F152 L156 | V109-V129 HydrophobicContact CG1-CG1 4.11Å; A113-V129 HydrophobicContact CB-CG2 3.68Å; M125-V129 HydrophobicContact CG-CG2 4.36Å; M125-V129 WeakPolarHBondContact O-CG2 3.49Å; M125-V129 PolarHBondContact O-N 3.03Å; G127-V129 PolarHBondContact O-N 3.5Å; V129-E131 VanDerWaalsContact C-N 3.33Å; V129-E131 PolarHBondContact O-N 3.15Å; V129-I132 PolarHBondContact O-N 3.13Å; V129-L133 HydrophobicContact CG1-CD1 4.05Å; V129-L133 HydrophobicContact CG1-CG 4.41Å; V129-L133 WeakPolarHBondContact O-CG 3.19Å; V129-L133 PolarHBondContact O-N 2.85Å; V129-F152 HydrophobicContact CG1-CZ 4.17Å; V129-L156 HydrophobicContact CB-CD2 4.35Å; V129-L156 HydrophobicContact CG1-CD2 4.48Å; V129-L156 HydrophobicContact CG2-CD2 4.22Å |
| 130 | K | 80.4 | Confident | 73.3 | Confident | 135 Ų | 135 | 73 Ų | 73 | 59% | 0.587 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -61.4 | -37.1 | 175.2 | -74.2 | 179.9 | 179.7 | -169.7 | 0 | 112.9 | N126 G127 L133 G134 | N126-K130 WeakPolarHBondContact O-CB 3.35Å; N126-K130 VanDerWaalsContact O-CG 3.29Å; N126-K130 WeakPolarHBondContact O-CG 3.3Å; N126-K130 PolarHBondContact O-N 3.01Å; G127-K130 PolarHBondContact O-N 3.49Å; K130-L133 PolarHBondContact O-N 2.93Å; K130-G134 PolarHBondContact O-N 2.76Å |
| 131 | E | 81.7 | Confident | 71.4 | Confident | 84 Ų | 84 | 78.9 Ų | 78.9 | 39% | 0.393 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.1 | -41.6 | 174.2 | -74.9 | 174.2 | -178.1 | 0 | 0 | 112.2 | S120 G127 T128 V129 G134 S135 | S120-E131 WeakPolarHBondContact CB-OE2 3.44Å; S120-E131 PolarHBondContact OG-OE2 2.89Å; G127-E131 WeakPolarHBondContact O-CG 3.19Å; G127-E131 PolarHBondContact O-N 3.16Å; T128-E131 WeakPolarHBondContact O-CB 3.29Å; T128-E131 PolarHBondContact O-N 3.41Å; V129-E131 VanDerWaalsContact C-N 3.33Å; V129-E131 PolarHBondContact O-N 3.15Å; E131-G134 PolarHBondContact O-N 3.29Å; E131-S135 PolarHBondContact O-N 3.31Å; E131-S135 PolarHBondContact O-OG 3.23Å |
| 132 | I | 83.4 | Confident | 69.7 | Low | 5 Ų | 5 | 75 Ų | 75 | 3% | 0.026 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -67.9 | -43 | 176.7 | -61.7 | -56.2 | 0 | 0 | 0 | 110.6 | A77 I81 V109 I112 A113 M116 T128 V129 G134 S135 V136 | A77-I132 HydrophobicContact CB-CD1 3.85Å; I81-I132 HydrophobicContact CD1-CG2 4.32Å; I81-I132 HydrophobicContact CG1-CG2 4.41Å; V109-I132 HydrophobicContact CG1-CB 4.41Å; V109-I132 HydrophobicContact CG1-CG2 4.03Å; I112-I132 HydrophobicContact CB-CG2 4.43Å; I112-I132 HydrophobicContact CG2-CD1 4Å; I112-I132 HydrophobicContact CG2-CG1 4.18Å; I112-I132 HydrophobicContact CG2-CG2 3.86Å; A113-I132 HydrophobicContact CB-CG1 4.35Å; M116-I132 HydrophobicContact CB-CD1 4.18Å; M116-I132 HydrophobicContact CG-CD1 3.9Å; T128-I132 WeakPolarHBondContact O-CG1 3.49Å; T128-I132 PolarHBondContact O-N 2.91Å; V129-I132 PolarHBondContact O-N 3.13Å; I132-G134 VanDerWaalsContact C-N 3.34Å; I132-G134 PolarHBondContact O-N 3.32Å; I132-S135 WeakPolarHBondContact O-CB 3.49Å; I132-S135 PolarHBondContact O-N 3.15Å; I132-S135 VanDerWaalsContact O-N 3.07Å; I132-V136 PolarHBondContact O-N 3.02Å |
| 133 | L | 81 | Confident | 68.1 | Low | 57 Ų | 57 | 80.3 Ų | 80.3 | 30% | 0.298 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61 | -42.1 | 175.1 | -71 | 173.4 | 0 | 0 | 0 | 111.6 | V109 V129 K130 S135 V136 F152 | V109-L133 HydrophobicContact CG1-CD2 4Å; V109-L133 HydrophobicContact CG1-CG 4.18Å; V109-L133 HydrophobicContact CG2-CD2 4.34Å; V129-L133 HydrophobicContact CG1-CD1 4.05Å; V129-L133 HydrophobicContact CG1-CG 4.41Å; V129-L133 WeakPolarHBondContact O-CG 3.19Å; V129-L133 PolarHBondContact O-N 2.85Å; K130-L133 PolarHBondContact O-N 2.93Å; L133-S135 PolarHBondContact O-N 2.86Å; L133-V136 PolarHBondContact O-N 2.8Å; L133-F152 HydrophobicContact CD1-CE2 4.2Å; L133-F152 HydrophobicContact CD1-CZ 3.93Å |
| 134 | G | 80 | Confident | 66.4 | Low | 68 Ų | 68 | 79.4 Ų | 79.4 | 70% | 0.701 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -66.3 | -17.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | K130 E131 I132 | K130-G134 PolarHBondContact O-N 2.76Å; E131-G134 PolarHBondContact O-N 3.29Å; I132-G134 VanDerWaalsContact C-N 3.34Å; I132-G134 PolarHBondContact O-N 3.32Å |
| 135 | S | 78.9 | Confident | 64.3 | Low | 71 Ų | 71 | 78.8 Ų | 78.8 | 50% | 0.497 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -82 | -20.4 | 173 | -58.7 | 0 | 0 | 0 | 0 | 112.9 | E131 I132 L133 | E131-S135 PolarHBondContact O-N 3.31Å; E131-S135 PolarHBondContact O-OG 3.23Å; I132-S135 WeakPolarHBondContact O-CB 3.49Å; I132-S135 PolarHBondContact O-N 3.15Å; I132-S135 VanDerWaalsContact O-N 3.07Å; L133-S135 PolarHBondContact O-N 2.86Å |
| 136 | V | 72.4 | Confident | 62.9 | Low | 42 Ų | 42 | 83.8 Ų | 83.8 | 26% | 0.255 | 45% | 0.452 | S | S | . | . | S | Bend | trans | -88.9 | 118.6 | 170.9 | -176.8 | 0 | 0 | 0 | 0 | 105.8 | I81 L104 I132 L133 V138 | I81-V136 HydrophobicContact CD1-CG2 3.69Å; I81-V136 HydrophobicContact CG1-CG2 4.22Å; I81-V136 HydrophobicContact CG2-CG2 4.06Å; L104-V136 HydrophobicContact CD1-CG2 4.25Å; I132-V136 PolarHBondContact O-N 3.02Å; L133-V136 PolarHBondContact O-N 2.8Å; V136-V138 VanDerWaalsContact C-N 3.26Å; V136-V138 PolarHBondContact O-N 3.06Å |
| 137 | E | 62.7 | Low | 61.2 | Low | 190 Ų | 190 | 87 Ų | 87 | 89% | 0.888 | 48% | 0.477 | S | S | * | . | trans | -64.3 | 97.4 | 169 | -170.2 | 177.3 | 177.9 | 0 | 0 | 106.8 | S139 | E137-S139 PolarHBondContact O-N 3.37Š| ||
| 138 | V | 54 | Low | 59.1 | Low | 62 Ų | 62 | 87.5 Ų | 87.5 | 38% | 0.376 | 48% | 0.483 | S | S | . | . | trans | -67.1 | 106.7 | 174.6 | -176.5 | 0 | 0 | 0 | 0 | 104.8 | V136 Y142 | V136-V138 VanDerWaalsContact C-N 3.26Å; V136-V138 PolarHBondContact O-N 3.06Å; V138-Y142 HydrophobicContact CG1-CD2 4.48Å | ||
| 139 | S | 40.9 | Very low | 57.5 | Low | 66 Ų | 66 | 95 Ų | 95 | 46% | 0.462 | 52% | 0.518 | S | S | . | . | trans | -59 | 133.3 | 166.7 | -159.7 | 0 | 0 | 0 | 0 | 106.5 | E137 L141 Y142 | E137-S139 PolarHBondContact O-N 3.37Å; S139-L141 PolarHBondContact O-N 3.04Å; S139-Y142 PolarHBondContact O-N 3.24Å | ||
| 140 | P | 42.2 | Very low | 55.9 | Low | 93 Ų | 93 | 101.3 Ų | 101.3 | 60% | 0.604 | 55% | 0.552 | S | S | * | * | G | 310 helix | trans | -59.5 | -2.3 | -170.9 | 18.3 | -30.8 | 0 | 0 | 0 | 114.8 | Y142 E143 | P140-Y142 PolarHBondContact O-N 3.48Å; P140-E143 WeakPolarHBondContact O-CB 3.49Å; P140-E143 PolarHBondContact O-N 3.47Å |
| 141 | L | 38 | Very low | 54.7 | Low | 146 Ų | 146 | 101.2 Ų | 101.2 | 76% | 0.764 | 56% | 0.557 | S | S | * | * | G | 310 helix | trans | -74.1 | -3.7 | 174.7 | -61 | 177.8 | 0 | 0 | 0 | 114.5 | S139 | S139-L141 PolarHBondContact O-N 3.04Š|
| 142 | Y | 43.1 | Very low | 53.3 | Low | 102 Ų | 102 | 99.6 Ų | 99.6 | 40% | 0.4 | 55% | 0.549 | S | S | . | . | G | 310 helix | trans | -107.5 | -3 | 170.2 | -58.8 | -74 | 0 | 0 | 0 | 113.7 | N103 V138 S139 P140 E144 M145 | N103-Y142 PolarHBondContact OD1-OH 3.47Å; V138-Y142 HydrophobicContact CG1-CD2 4.48Å; S139-Y142 PolarHBondContact O-N 3.24Å; P140-Y142 PolarHBondContact O-N 3.48Å; Y142-E144 PolarHBondContact O-N 2.89Å; Y142-M145 PolarHBondContact O-N 3.22Å |
| 143 | E | 41.1 | Very low | 51.9 | Low | 126 Ų | 126 | 103.1 Ų | 103.1 | 59% | 0.589 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -60.3 | -29.8 | 175.7 | -139.1 | 103.4 | -147.3 | 0 | 0 | 110.9 | P140 M145 | P140-E143 WeakPolarHBondContact O-CB 3.49Å; P140-E143 PolarHBondContact O-N 3.47Å; E143-M145 VanDerWaalsContact C-N 3.35Å; E143-M145 PolarHBondContact O-N 3.46Å |
| 144 | E | 37.6 | Very low | 50.6 | Low | 173 Ų | 173 | 102.7 Ų | 102.7 | 81% | 0.808 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -79.2 | -8.1 | 176.7 | -69 | -173 | 166.4 | 0 | 0 | 114.7 | Y142 | Y142-E144 PolarHBondContact O-N 2.89Š|
| 145 | M | 36.8 | Very low | 49.5 | Very low | 163 Ų | 163 | 103 Ų | 103 | 80% | 0.803 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -98.5 | -9.1 | 173.3 | -74.6 | -170 | 168.3 | 0 | 0 | 113.4 | Y142 E143 | Y142-M145 PolarHBondContact O-N 3.22Å; E143-M145 VanDerWaalsContact C-N 3.35Å; E143-M145 PolarHBondContact O-N 3.46Å |
| 146 | I | 44.8 | Very low | 48.3 | Very low | 112 Ų | 112 | 100.1 Ų | 100.1 | 57% | 0.574 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -96.1 | 2.6 | -179.1 | -60.2 | 173.7 | 0 | 0 | 0 | 111.4 | G148 | I146-G148 PolarHBondContact O-N 2.9Š|
| 147 | S | 39.6 | Very low | 47.5 | Very low | 104 Ų | 104 | 101.1 Ų | 101.1 | 73% | 0.727 | 55% | 0.554 | S | S | * | * | trans | -73.7 | 14.2 | 175.9 | 79.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 148 | G | 36.6 | Very low | 47.2 | Very low | 36 Ų | 36 | 99.4 Ų | 99.4 | 37% | 0.371 | 54% | 0.544 | S | S | . | . | trans | -103.6 | 77.2 | 165.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | I146 D150 D151 | I146-G148 PolarHBondContact O-N 2.9Å; G148-D150 PolarHBondContact O-N 3.02Å; G148-D151 PolarHBondContact O-N 3.19Å | ||
| 149 | E | 47.9 | Very low | 47.3 | Very low | 158 Ų | 158 | 97.2 Ų | 97.2 | 74% | 0.738 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -56 | -22 | 179.2 | -71.7 | -174.5 | 137.4 | 0 | 0 | 112.8 | C153 | E149-C153 WeakPolarHBondContact O-CB 3.32Å; E149-C153 PolarHBondContact O-N 3.25Å; E149-C153 PolarHBondContact O-SG 3.07Å |
| 150 | D | 50.2 | Low | 47.7 | Very low | 135 Ų | 135 | 96.5 Ų | 96.5 | 72% | 0.722 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -78.3 | -37.6 | -175.7 | -63.4 | -34 | 0 | 0 | 0 | 114 | G148 A154 | G148-D150 PolarHBondContact O-N 3.02Å; D150-A154 WeakPolarHBondContact O-CB 3.29Å; D150-A154 PolarHBondContact O-N 3.22Å |
| 151 | D | 55.5 | Low | 48.3 | Very low | 132 Ų | 132 | 95.4 Ų | 95.4 | 71% | 0.706 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -77.7 | -37 | -176.3 | -78.3 | -22.4 | 0 | 0 | 0 | 112.2 | G148 L155 | G148-D151 PolarHBondContact O-N 3.19Å; D151-L155 VanDerWaalsContact O-CB 3.3Å; D151-L155 WeakPolarHBondContact O-CB 3.47Å; D151-L155 PolarHBondContact O-N 3.01Å |
| 152 | F | 53.4 | Low | 49 | Very low | 50 Ų | 50 | 95.2 Ų | 95.2 | 22% | 0.219 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -68.6 | -42.2 | 177.8 | -167.2 | -104.4 | 0 | 0 | 0 | 111.1 | L106 V129 L133 L156 | L106-F152 HydrophobicContact CD1-CD2 3.75Å; L106-F152 HydrophobicContact CD1-CE2 3.83Å; V129-F152 HydrophobicContact CG1-CZ 4.17Å; L133-F152 HydrophobicContact CD1-CE2 4.2Å; L133-F152 HydrophobicContact CD1-CZ 3.93Å; F152-L156 HydrophobicContact CD1-CD1 3.55Å; F152-L156 HydrophobicContact CD1-CG 4.3Å; F152-L156 HydrophobicContact CE1-CD1 3.3Å; F152-L156 HydrophobicContact CE1-CG 4.18Å; F152-L156 HydrophobicContact CG-CD1 4.4Å; F152-L156 HydrophobicContact CZ-CD1 3.96Å; F152-L156 HydrophobicContact CZ-CG 4.47Å; F152-L156 VanDerWaalsContact O-CB 3.26Å; F152-L156 WeakPolarHBondContact O-CB 3.35Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 3.05Å |
| 153 | C | 52.9 | Low | 49.1 | Very low | 80 Ų | 80 | 93.2 Ų | 93.2 | 54% | 0.541 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.8 | -40.3 | 175.7 | -68.7 | 0 | 0 | 0 | 0 | 112.1 | E149 A157 | E149-C153 WeakPolarHBondContact O-CB 3.32Å; E149-C153 PolarHBondContact O-N 3.25Å; E149-C153 PolarHBondContact O-SG 3.07Å; C153-A157 VanDerWaalsContact O-CB 3.28Å; C153-A157 WeakPolarHBondContact O-CB 3.37Å; C153-A157 PolarHBondContact O-N 2.57Å |
| 154 | A | 54.8 | Low | 49 | Very low | 47 Ų | 47 | 94.4 Ų | 94.4 | 39% | 0.388 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -66.4 | -38.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | D150 K158 | D150-A154 WeakPolarHBondContact O-CB 3.29Å; D150-A154 PolarHBondContact O-N 3.22Å; A154-K158 WeakPolarHBondContact O-CG 3.26Å; A154-K158 PolarHBondContact O-N 3.42Å; A154-K158 VanDerWaalsContact O-N 3.13Å |
| 155 | L | 55.6 | Low | 49.2 | Very low | 76 Ų | 76 | 94.7 Ų | 94.7 | 40% | 0.398 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -71.8 | -43.8 | 178.3 | -156.7 | 144.8 | 0 | 0 | 0 | 110.7 | L106 V110 D151 A157 K158 V159 | L106-L155 HydrophobicContact CD2-CD1 4.06Å; L106-L155 HydrophobicContact CD2-CD2 3.5Å; L106-L155 HydrophobicContact CD2-CG 4.34Å; V110-L155 HydrophobicContact CG2-CD2 4.45Å; D151-L155 VanDerWaalsContact O-CB 3.3Å; D151-L155 WeakPolarHBondContact O-CB 3.47Å; D151-L155 PolarHBondContact O-N 3.01Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.3Å; L155-K158 PolarHBondContact O-N 2.87Å; L155-K158 VanDerWaalsContact O-N 3.16Å; L155-V159 HydrophobicContact CD2-CG2 3.96Å; L155-V159 WeakPolarHBondContact O-CG2 3.28Å; L155-V159 PolarHBondContact O-N 3.46Å |
| 156 | L | 54.6 | Low | 49.5 | Very low | 10 Ų | 10 | 92 Ų | 92 | 5% | 0.052 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -59.4 | -39 | 172.4 | -76 | -179.5 | 0 | 0 | 0 | 113.1 | N126 V129 F152 K158 V159 D160 | N126-L156 HydrophobicContact CB-CD1 3.91Å; N126-L156 HydrophobicContact CB-CD2 4.28Å; N126-L156 WeakPolarHBondContact OD1-CB 3.45Å; N126-L156 VanDerWaalsContact OD1-CD2 3.29Å; N126-L156 WeakPolarHBondContact OD1-CD2 3.39Å; V129-L156 HydrophobicContact CB-CD2 4.35Å; V129-L156 HydrophobicContact CG1-CD2 4.48Å; V129-L156 HydrophobicContact CG2-CD2 4.22Å; F152-L156 HydrophobicContact CD1-CD1 3.55Å; F152-L156 HydrophobicContact CD1-CG 4.3Å; F152-L156 HydrophobicContact CE1-CD1 3.3Å; F152-L156 HydrophobicContact CE1-CG 4.18Å; F152-L156 HydrophobicContact CG-CD1 4.4Å; F152-L156 HydrophobicContact CZ-CD1 3.96Å; F152-L156 HydrophobicContact CZ-CG 4.47Å; F152-L156 VanDerWaalsContact O-CB 3.26Å; F152-L156 WeakPolarHBondContact O-CB 3.35Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 3.05Å; L156-K158 PolarHBondContact O-N 3.35Å; L156-V159 PolarHBondContact O-N 3.18Å; L156-D160 WeakPolarHBondContact O-CB 3.36Å; L156-D160 PolarHBondContact O-N 3.06Å |
| 157 | A | 55.3 | Low | 49.4 | Very low | 62 Ų | 62 | 92 Ų | 92 | 51% | 0.512 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.9 | -34.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | C153 L155 A161 | C153-A157 VanDerWaalsContact O-CB 3.28Å; C153-A157 WeakPolarHBondContact O-CB 3.37Å; C153-A157 PolarHBondContact O-N 2.57Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.3Å; A157-A161 PolarHBondContact O-N 3.17Å |
| 158 | K | 57.3 | Low | 49.8 | Very low | 155 Ų | 155 | 93.3 Ų | 93.3 | 67% | 0.674 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -69.3 | -38.4 | 172.2 | -73 | 173.9 | -177.6 | 173.1 | 0 | 111.8 | A154 L155 L156 A161 | A154-K158 WeakPolarHBondContact O-CG 3.26Å; A154-K158 PolarHBondContact O-N 3.42Å; A154-K158 VanDerWaalsContact O-N 3.13Å; L155-K158 PolarHBondContact O-N 2.87Å; L155-K158 VanDerWaalsContact O-N 3.16Å; L156-K158 PolarHBondContact O-N 3.35Å; K158-A161 PolarHBondContact O-N 3.03Å |
| 159 | V | 54.8 | Low | 50.1 | Low | 15 Ų | 15 | 99.7 Ų | 99.7 | 9% | 0.091 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -72.4 | -39 | 179.6 | -150.2 | 0 | 0 | 0 | 0 | 111.2 | V110 M125 L155 L156 A161 D162 | V110-V159 HydrophobicContact CG1-CG1 3.98Å; V110-V159 HydrophobicContact CG1-CG2 4.42Å; M125-V159 HydrophobicContact CE-CB 3.48Å; M125-V159 VanDerWaalsContact CE-CB 3.48Å; M125-V159 HydrophobicContact CE-CG1 3.13Å; M125-V159 WeakPolarHBondContact CE-O 3.43Å; M125-V159 HydrophobicContact SD-CB 4.28Å; M125-V159 HydrophobicContact SD-CG1 3.5Å; M125-V159 VanDerWaalsContact SD-CG1 3.5Å; L155-V159 HydrophobicContact CD2-CG2 3.96Å; L155-V159 WeakPolarHBondContact O-CG2 3.28Å; L155-V159 PolarHBondContact O-N 3.46Å; L156-V159 PolarHBondContact O-N 3.18Å; V159-A161 PolarHBondContact O-N 3Å; V159-D162 PolarHBondContact O-N 2.97Å |
| 160 | D | 50.5 | Low | 50 | Low | 51 Ų | 51 | 96.7 Ų | 96.7 | 27% | 0.273 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.9 | -26.3 | 176.6 | -83.8 | -25.3 | 0 | 0 | 0 | 112.6 | N126 L156 | N126-D160 VanDerWaalsContact CG-OD2 3.31Å; N126-D160 PolarHBondContact ND2-OD2 3.27Å; N126-D160 PolarHBondContact OD1-OD2 3.29Å; L156-D160 WeakPolarHBondContact O-CB 3.36Å; L156-D160 PolarHBondContact O-N 3.06Å |
| 161 | A | 52.9 | Low | 49.9 | Very low | 71 Ų | 71 | 97.3 Ų | 97.3 | 59% | 0.587 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -72.4 | -26.7 | 178 | 0 | 0 | 0 | 0 | 0 | 114 | A157 K158 V159 | A157-A161 PolarHBondContact O-N 3.17Å; K158-A161 PolarHBondContact O-N 3.03Å; V159-A161 PolarHBondContact O-N 3Å |
| 162 | D | 52.7 | Low | 49.5 | Very low | 141 Ų | 141 | 93.5 Ų | 93.5 | 75% | 0.754 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -90.6 | -9.1 | -175.2 | -75.7 | -20.9 | 0 | 0 | 0 | 113.8 | V159 | V159-D162 PolarHBondContact O-N 2.97Å |
| 163 | S | 45.3 | Very low | 49.3 | Very low | 61 Ų | 61 | 95.4 Ų | 95.4 | 43% | 0.427 | 53% | 0.529 | S | S | . | . | trans | -110.9 | 57.8 | -176.6 | 52.7 | 0 | 0 | 0 | 0 | 112.7 | M125 E165 | M125-S163 WeakPolarHBondContact CE-OG 3.45Å; S163-E165 PolarHBondContact O-N 3.31Å; S163-E165 VanDerWaalsContact O-N 3.08Å | ||
| 164 | N | 39.2 | Very low | 48.9 | Very low | 150 Ų | 150 | 94.6 Ų | 94.6 | 80% | 0.802 | 52% | 0.524 | S | S | * | . | trans | -81.3 | 57 | 171.9 | -116.4 | -4.9 | 0 | 0 | 0 | 111.3 | ||||
| 165 | E | 41.9 | Very low | 48.9 | Very low | 179 Ų | 179 | 98.9 Ų | 98.9 | 84% | 0.836 | 54% | 0.54 | S | S | * | . | trans | -136.2 | 85.4 | 166.7 | -75.4 | -169.9 | 168.8 | 0 | 0 | 108.7 | S163 T167 | S163-E165 PolarHBondContact O-N 3.31Å; S163-E165 VanDerWaalsContact O-N 3.08Å; E165-T167 PolarHBondContact O-N 3.38Å | ||
| 166 | V | 44.4 | Very low | 48.6 | Very low | 107 Ų | 107 | 101.2 Ų | 101.2 | 65% | 0.648 | 55% | 0.551 | S | S | * | * | trans | -68.7 | 98 | 173.8 | -179.6 | 0 | 0 | 0 | 0 | 107.8 | H170 | V166-H170 HydrophobicContact CG1-CB 3.83Š| ||
| 167 | T | 42.3 | Very low | 48.1 | Very low | 112 Ų | 112 | 105.6 Ų | 105.6 | 69% | 0.687 | 58% | 0.575 | S | S | * | * | trans | -59.8 | 134.9 | 174.7 | 51.1 | 0 | 0 | 0 | 0 | 110.9 | E165 F169 H170 | E165-T167 PolarHBondContact O-N 3.38Å; T167-F169 PolarHBondContact O-N 3.23Å; T167-H170 PolarHBondContact O-N 3.3Å | ||
| 168 | D | 48.7 | Very low | 47.4 | Very low | 131 Ų | 131 | 108.1 Ų | 108.1 | 70% | 0.701 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.4 | -6.4 | -164.4 | -62.8 | -54.7 | 0 | 0 | 0 | 118.4 | ||
| 169 | F | 41.4 | Very low | 46.6 | Very low | 170 Ų | 170 | 109.7 Ų | 109.7 | 75% | 0.746 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -71.7 | -28.5 | 174.7 | -109.2 | -93.7 | 0 | 0 | 0 | 113.6 | T167 A172 L173 | T167-F169 PolarHBondContact O-N 3.23Å; F169-A172 WeakPolarHBondContact O-CB 3.44Å; F169-A172 PolarHBondContact O-N 3.04Å; F169-L173 PolarHBondContact O-N 2.74Å |
| 170 | H | 45.9 | Very low | 45.9 | Very low | 96 Ų | 96 | 113 Ų | 113 | 44% | 0.444 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -77.3 | -26.1 | -176.1 | -135.7 | -64.4 | 0 | 0 | 0 | 113.1 | V166 T167 A172 S174 | V166-H170 HydrophobicContact CG1-CB 3.83Å; T167-H170 PolarHBondContact O-N 3.3Å; H170-A172 VanDerWaalsContact C-N 3.3Å; H170-S174 PolarHBondContact O-N 3.25Å; H170-S174 PolarHBondContact O-OG 3.3Å |
| 171 | K | 49.2 | Very low | 45.1 | Very low | 147 Ų | 147 | 119.4 Ų | 119.4 | 64% | 0.639 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -67.7 | -31 | 168.2 | -89.2 | 178 | 178.9 | 168.4 | 0 | 112.1 | S174 | K171-S174 PolarHBondContact O-OG 2.89Å; K171-S174 VanDerWaalsContact O-OG 3.04Å |
| 172 | A | 46.4 | Very low | 43.9 | Very low | 52 Ų | 52 | 125 Ų | 125 | 43% | 0.43 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -73.4 | -38.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | F169 H170 | F169-A172 WeakPolarHBondContact O-CB 3.44Å; F169-A172 PolarHBondContact O-N 3.04Å; H170-A172 VanDerWaalsContact C-N 3.3Å |
| 173 | L | 50 | Low | 42.8 | Very low | 91 Ų | 91 | 123.5 Ų | 123.5 | 48% | 0.476 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -72.4 | -37.3 | 175.4 | -98.1 | 97 | 0 | 0 | 0 | 113.2 | F169 L175 I176 D177 | F169-L173 PolarHBondContact O-N 2.74Å; L173-L175 PolarHBondContact O-N 3.32Å; L173-I176 PolarHBondContact O-N 3.32Å; L173-D177 PolarHBondContact O-N 3.23Å |
| 174 | S | 44.8 | Very low | 42 | Very low | 63 Ų | 63 | 127.1 Ų | 127.1 | 44% | 0.441 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -64.7 | -24.7 | 179.4 | 56.8 | 0 | 0 | 0 | 0 | 113.5 | H170 K171 I176 T178 | H170-S174 PolarHBondContact O-N 3.25Å; H170-S174 PolarHBondContact O-OG 3.3Å; K171-S174 PolarHBondContact O-OG 2.89Å; K171-S174 VanDerWaalsContact O-OG 3.04Å; S174-I176 VanDerWaalsContact C-N 3.29Å; S174-T178 PolarHBondContact O-OG1 3.04Å |
| 175 | L | 54 | Low | 41.4 | Very low | 136 Ų | 136 | 124.9 Ų | 124.9 | 71% | 0.712 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.1 | -16.4 | 175.4 | -76.2 | 164.3 | 0 | 0 | 0 | 113.1 | L173 | L173-L175 PolarHBondContact O-N 3.32Š|
| 176 | I | 49.8 | Very low | 41 | Very low | 125 Ų | 125 | 122.7 Ų | 122.7 | 64% | 0.641 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | -30.2 | -177.2 | -62.4 | 170.3 | 0 | 0 | 0 | 111.4 | L173 S174 T178 | L173-I176 PolarHBondContact O-N 3.32Å; S174-I176 VanDerWaalsContact C-N 3.29Å; I176-T178 VanDerWaalsContact C-N 3.29Å; I176-T178 PolarHBondContact O-N 3.06Å |
| 177 | D | 42.5 | Very low | 40.2 | Very low | 103 Ų | 103 | 124.1 Ų | 124.1 | 55% | 0.551 | 68% | 0.677 | S | S | * | * | G | 310 helix | trans | -75.9 | -11.3 | -179.7 | -73.7 | -27 | 0 | 0 | 0 | 114.2 | L173 | L173-D177 PolarHBondContact O-N 3.23Š|
| 178 | T | 41.5 | Very low | 39.6 | Very low | 114 Ų | 114 | 124.4 Ų | 124.4 | 70% | 0.699 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -87 | -10.7 | -172.8 | -33.3 | 0 | 0 | 0 | 0 | 113.6 | S174 I176 | S174-T178 PolarHBondContact O-OG1 3.04Å; I176-T178 VanDerWaalsContact C-N 3.29Å; I176-T178 PolarHBondContact O-N 3.06Å |
| 179 | E | 39.7 | Very low | 38.6 | Very low | 188 Ų | 188 | 125.4 Ų | 125.4 | 88% | 0.879 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -98.2 | -0.2 | 179.6 | -69.1 | -173.6 | 165 | 0 | 0 | 113.9 | ||
| 180 | A | 40.7 | Very low | 37.9 | Very low | 85 Ų | 85 | 124 Ų | 124 | 70% | 0.702 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -108.1 | 10.6 | -171.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 181 | Q | 33.8 | Very low | 37 | Very low | 185 Ų | 185 | 123.1 Ų | 123.1 | 86% | 0.864 | 70% | 0.698 | S | S | * | * | trans | -116.6 | 92.2 | -179.6 | -64.4 | -165.8 | 6 | 0 | 0 | 112.9 | ||||
| 182 | F | 28.1 | Very low | 35.9 | Very low | 189 Ų | 189 | 121.2 Ų | 121.2 | 83% | 0.829 | 70% | 0.702 | S | S | * | * | trans | -137.8 | 126.1 | 152.9 | -164.7 | -109.6 | 0 | 0 | 0 | 109.3 | ||||
| 183 | T | 28.6 | Very low | 34.9 | Very low | 110 Ų | 110 | 124.2 Ų | 124.2 | 68% | 0.675 | 72% | 0.72 | S | S | * | * | S | Bend | trans | 76.6 | 124.4 | 178.1 | 81.7 | 0 | 0 | 0 | 0 | 114.4 | ||
| 184 | T | 30.4 | Very low | 33.9 | Very low | 136 Ų | 136 | 123.7 Ų | 123.7 | 83% | 0.834 | 74% | 0.737 | S | S | * | * | cis | -156.6 | 133.8 | 13.1 | 37.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 185 | S | 25.5 | Very low | 32.8 | Very low | 104 Ų | 104 | 127.6 Ų | 127.6 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | trans | -76.9 | 146.8 | 162.9 | 49.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 186 | V | 34.5 | Very low | 31.7 | Very low | 133 Ų | 133 | 128.8 Ų | 128.8 | 81% | 0.806 | 76% | 0.759 | S | S | * | * | -177.6 | 134.2 | 113.3 | 166.9 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 187 | D | 26.6 | Very low | 30.6 | Very low | 137 Ų | 137 | 128.5 Ų | 128.5 | 73% | 0.733 | 76% | 0.763 | S | S | * | * | trans | -61.5 | 170.1 | -178.6 | -43.6 | -69.7 | 0 | 0 | 0 | 112.4 | ||||
| 188 | N | 28.9 | Very low | 29.9 | Very low | 118 Ų | 118 | 129.3 Ų | 129.3 | 63% | 0.631 | 77% | 0.772 | S | S | * | * | cis | -175.1 | 149.2 | 42.5 | -152.2 | 21 | 0 | 0 | 0 | 110.6 | ||||
| 189 | E | 28.5 | Very low | 29.3 | Very low | 151 Ų | 151 | 132.5 Ų | 132.5 | 71% | 0.706 | 78% | 0.779 | S | S | * | * | trans | 34.1 | 136.3 | 140.3 | -67.7 | 167.9 | 174.7 | 0 | 0 | 120.6 | ||||
| 190 | T | 26.5 | Very low | 29.2 | Very low | 140 Ų | 140 | 128.8 Ų | 128.8 | 86% | 0.859 | 77% | 0.769 | S | S | * | * | -179.8 | 148.9 | 61.3 | -2.4 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 191 | G | 27.3 | Very low | 28.7 | Very low | 79 Ų | 79 | 132.1 Ų | 132.1 | 81% | 0.814 | 78% | 0.775 | S | S | * | * | trans | 82.7 | 147.5 | 148.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 192 | S | 24.9 | Very low | 28.7 | Very low | 106 Ų | 106 | 129.4 Ų | 129.4 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | cis | -179.3 | 139.9 | -22.2 | 171.3 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 193 | S | 26.2 | Very low | 28.9 | Very low | 115 Ų | 115 | 124.4 Ų | 124.4 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | 60.1 | 123.3 | 148.2 | 54.7 | 0 | 0 | 0 | 0 | 121 | ||||
| 194 | G | 28.3 | Very low | 28.9 | Very low | 80 Ų | 80 | 127 Ų | 127 | 83% | 0.825 | 77% | 0.77 | S | S | * | * | trans | 163.8 | 74.2 | 159.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 195 | D | 23.7 | Very low | 29 | Very low | 146 Ų | 146 | 124.8 Ų | 124.8 | 78% | 0.781 | 77% | 0.765 | S | S | * | * | trans | -53.2 | 131.1 | 169.2 | -176.5 | 20.4 | 0 | 0 | 0 | 112.8 | ||||
| 196 | L | 30.6 | Very low | 29.4 | Very low | 160 Ų | 160 | 128.7 Ų | 128.7 | 84% | 0.838 | 77% | 0.771 | S | S | * | * | trans | -170.2 | 99.3 | 157.3 | -106 | 142.3 | 0 | 0 | 0 | 110.7 | T198 | L196-T198 PolarHBondContact O-N 3.36Š| ||
| 197 | T | 25.3 | Very low | 29.4 | Very low | 119 Ų | 119 | 129.9 Ų | 129.9 | 73% | 0.73 | 77% | 0.768 | S | S | * | * | trans | -45.5 | 124.9 | 164 | 53.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 198 | T | 29.4 | Very low | 29.6 | Very low | 121 Ų | 121 | 130.5 Ų | 130.5 | 74% | 0.742 | 77% | 0.767 | S | S | * | * | trans | -154.2 | 96.4 | 152.6 | -12.1 | 0 | 0 | 0 | 0 | 109 | L196 V200 | L196-T198 PolarHBondContact O-N 3.36Å; T198-V200 PolarHBondContact O-N 3.03Å | ||
| 199 | E | 28.9 | Very low | 29.8 | Very low | 181 Ų | 181 | 134 Ų | 134 | 85% | 0.846 | 78% | 0.776 | S | S | * | * | trans | -61.7 | 122.9 | 165 | -61.5 | -159.6 | 132.8 | 0 | 0 | 108.8 | ||||
| 200 | V | 36.7 | Very low | 29.9 | Very low | 110 Ų | 110 | 129.8 Ų | 129.8 | 67% | 0.667 | 76% | 0.763 | S | S | * | * | trans | -130.2 | 104.7 | 166.3 | -156.4 | 0 | 0 | 0 | 0 | 107.1 | T198 L202 | T198-V200 PolarHBondContact O-N 3.03Å; V200-L202 HydrophobicContact CB-CD1 4.47Å; V200-L202 HydrophobicContact CG1-CD1 4.07Å; V200-L202 PolarHBondContact O-N 2.99Å | ||
| 201 | D | 29.3 | Very low | 30 | Very low | 155 Ų | 155 | 132.1 Ų | 132.1 | 83% | 0.829 | 77% | 0.765 | S | S | * | * | trans | -53.5 | 104 | 170 | -71.1 | -50.6 | 0 | 0 | 0 | 110.4 | ||||
| 202 | L | 34.9 | Very low | 30.2 | Very low | 127 Ų | 127 | 131.7 Ų | 131.7 | 67% | 0.665 | 75% | 0.753 | S | S | * | * | trans | -114 | 66 | 164.5 | -100.4 | 87 | 0 | 0 | 0 | 109.3 | V200 | V200-L202 HydrophobicContact CB-CD1 4.47Å; V200-L202 HydrophobicContact CG1-CD1 4.07Å; V200-L202 PolarHBondContact O-N 2.99Å | ||
| 203 | A | 31.1 | Very low | 30.6 | Very low | 85 Ų | 85 | 133.7 Ų | 133.7 | 70% | 0.702 | 76% | 0.756 | S | S | * | * | trans | -91.9 | 144.7 | 157.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 204 | D | 29.4 | Very low | 30.9 | Very low | 165 Ų | 165 | 136.8 Ų | 136.8 | 88% | 0.882 | 76% | 0.757 | S | S | * | * | trans | 75.7 | 85.6 | 170.4 | -69.3 | -21.7 | 0 | 0 | 0 | 119.1 | ||||
| 205 | A | 33.7 | Very low | 31.2 | Very low | 89 Ų | 89 | 140.6 Ų | 140.6 | 74% | 0.736 | 76% | 0.759 | S | S | * | * | trans | -137.4 | 82.6 | 142.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | E207 | A205-E207 PolarHBondContact O-N 3.27Š| ||
| 206 | Q | 32.7 | Very low | 31.8 | Very low | 185 Ų | 185 | 138.2 Ų | 138.2 | 86% | 0.864 | 75% | 0.754 | S | S | * | * | trans | 29 | 86.5 | 155.3 | -64.2 | -179.5 | -43.6 | 0 | 0 | 116.7 | E208 | Q206-E208 PolarHBondContact O-N 3Å; Q206-E208 VanDerWaalsContact O-N 3.14Å | ||
| 207 | E | 35.4 | Very low | 32.3 | Very low | 158 Ų | 158 | 136 Ų | 136 | 74% | 0.738 | 75% | 0.747 | S | S | * | * | trans | -66.6 | 100.9 | 149.5 | -84.4 | -178.9 | 167.3 | 0 | 0 | 107.9 | A205 K209 | A205-E207 PolarHBondContact O-N 3.27Å; E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 3.36Å | ||
| 208 | E | 31 | Very low | 33.3 | Very low | 151 Ų | 151 | 135 Ų | 135 | 71% | 0.706 | 75% | 0.75 | S | S | * | * | trans | -62.5 | 96.4 | 160.1 | -80.1 | -166.1 | 158.8 | 0 | 0 | 108.3 | Q206 S210 K256 | Q206-E208 PolarHBondContact O-N 3Å; Q206-E208 VanDerWaalsContact O-N 3.14Å; E208-S210 PolarHBondContact O-N 3.37Å; E208-K256 IonicContact OE2-NZ 2.7Å; E208-K256 PolarHBondContact OE2-NZ 3.13Å | ||
| 209 | K | 31.3 | Very low | 33.9 | Very low | 191 Ų | 191 | 133.9 Ų | 133.9 | 83% | 0.83 | 75% | 0.753 | S | S | * | * | trans | -59.3 | 96.5 | 164.7 | -81.5 | 178.9 | 174.3 | 175.8 | 0 | 109.1 | E207 | E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 3.36Å | ||
| 210 | S | 31.6 | Very low | 34.9 | Very low | 62 Ų | 62 | 128 Ų | 128 | 43% | 0.434 | 73% | 0.733 | S | S | . | * | trans | -79.7 | 113.5 | 157.3 | 55.1 | 0 | 0 | 0 | 0 | 108.4 | E208 A212 | E208-S210 PolarHBondContact O-N 3.37Å; S210-A212 PolarHBondContact O-N 3.47Å | ||
| 211 | E | 28.4 | Very low | 35.4 | Very low | 190 Ų | 190 | 126 Ų | 126 | 89% | 0.888 | 72% | 0.723 | S | S | * | * | trans | -54 | 113.5 | 171.3 | -61 | 171.9 | 154 | 0 | 0 | 110.5 | ||||
| 212 | A | 32.5 | Very low | 36.5 | Very low | 69 Ų | 69 | 125 Ų | 125 | 57% | 0.57 | 72% | 0.718 | S | S | * | * | trans | -153.8 | 118.2 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | S210 | S210-A212 PolarHBondContact O-N 3.47Š| ||
| 213 | D | 31.5 | Very low | 37.6 | Very low | 149 Ų | 149 | 121.5 Ų | 121.5 | 80% | 0.797 | 71% | 0.707 | S | S | * | * | trans | 64.1 | 96.4 | 156.2 | -60.5 | -22.6 | 0 | 0 | 0 | 120.5 | N215 | D213-N215 PolarHBondContact O-N 3.48Š| ||
| 214 | Q | 33.5 | Very low | 38.9 | Very low | 179 Ų | 179 | 120.6 Ų | 120.6 | 84% | 0.836 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -72.4 | 24 | 176.2 | -66.6 | 178.6 | -5.3 | 0 | 0 | 115.3 | ||
| 215 | N | 34.8 | Very low | 40.7 | Very low | 160 Ų | 160 | 116.3 Ų | 116.3 | 86% | 0.856 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -133.6 | 62.3 | -172.3 | -87.2 | -7.8 | 0 | 0 | 0 | 114 | D213 | D213-N215 PolarHBondContact O-N 3.48Š|
| 216 | S | 35.9 | Very low | 42.4 | Very low | 96 Ų | 96 | 118.4 Ų | 118.4 | 67% | 0.671 | 66% | 0.663 | S | S | * | * | trans | -160.6 | 24.2 | 161.9 | 60.2 | 0 | 0 | 0 | 0 | 114.5 | A218 | S216-A218 PolarHBondContact O-N 3.11Š| ||
| 217 | V | 41.7 | Very low | 44 | Very low | 115 Ų | 115 | 114.1 Ų | 114.1 | 70% | 0.697 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | 0.8 | -143.1 | -170.4 | 0 | 0 | 0 | 0 | 117.6 | ||
| 218 | A | 44.7 | Very low | 45.7 | Very low | 96 Ų | 96 | 113.3 Ų | 113.3 | 79% | 0.793 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | -28.2 | -170.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | S216 | S216-A218 PolarHBondContact O-N 3.11Š|
| 219 | A | 42.7 | Very low | 47.8 | Very low | 98 Ų | 98 | 111.8 Ų | 111.8 | 81% | 0.81 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -95.2 | -4.4 | -171.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 220 | S | 49.3 | Very low | 49.8 | Very low | 59 Ų | 59 | 108.1 Ų | 108.1 | 41% | 0.413 | 62% | 0.616 | S | S | . | * | S | Bend | trans | -103.3 | -12.5 | -174.1 | 55.5 | 0 | 0 | 0 | 0 | 114.7 | V224 | S220-V224 WeakPolarHBondContact O-CB 3.25Å; S220-V224 WeakPolarHBondContact O-CG2 3.48Å; S220-V224 PolarHBondContact O-N 3.11Å; S220-V224 VanDerWaalsContact O-N 3.11Å |
| 221 | S | 48.1 | Very low | 51.5 | Low | 66 Ų | 66 | 108.8 Ų | 108.8 | 46% | 0.462 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65.9 | -49 | -172.9 | -165.5 | 0 | 0 | 0 | 0 | 112.3 | A223 V224 D225 | S221-A223 VanDerWaalsContact C-N 3.35Å; S221-A223 PolarHBondContact O-N 3.31Å; S221-V224 PolarHBondContact O-N 3.43Å; S221-D225 PolarHBondContact O-N 3.14Å; S221-D225 VanDerWaalsContact O-N 3.13Å |
| 222 | D | 53.1 | Low | 53.6 | Low | 135 Ų | 135 | 109.4 Ų | 109.4 | 72% | 0.722 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.7 | -34.1 | -176.4 | -62.6 | -18.9 | 0 | 0 | 0 | 112.3 | D225 F226 | D222-D225 PolarHBondContact O-N 2.91Å; D222-F226 WeakPolarHBondContact O-CB 3.45Å; D222-F226 PolarHBondContact O-N 3.04Å |
| 223 | A | 58.2 | Low | 55.6 | Low | 54 Ų | 54 | 111.6 Ų | 111.6 | 45% | 0.446 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -68.6 | -40.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | S221 D225 F226 D227 | S221-A223 VanDerWaalsContact C-N 3.35Å; S221-A223 PolarHBondContact O-N 3.31Å; A223-D225 VanDerWaalsContact C-N 3.31Å; A223-D225 PolarHBondContact O-N 2.93Å; A223-F226 PolarHBondContact O-N 3.25Å; A223-D227 PolarHBondContact O-N 3.49Å |
| 224 | V | 57 | Low | 57.8 | Low | 66 Ų | 66 | 108 Ų | 108 | 40% | 0.4 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -64.7 | -37.7 | 176.8 | 170.5 | 0 | 0 | 0 | 0 | 111 | S220 S221 R228 | S220-V224 WeakPolarHBondContact O-CB 3.25Å; S220-V224 WeakPolarHBondContact O-CG2 3.48Å; S220-V224 PolarHBondContact O-N 3.11Å; S220-V224 VanDerWaalsContact O-N 3.11Å; S221-V224 PolarHBondContact O-N 3.43Å; V224-R228 VanDerWaalsContact O-CG 3.25Å; V224-R228 WeakPolarHBondContact O-CG 3.33Å; V224-R228 PolarHBondContact O-N 3.46Å; V224-R228 VanDerWaalsContact O-N 3.11Å |
| 225 | D | 67.5 | Low | 59.9 | Low | 74 Ų | 74 | 101.9 Ų | 101.9 | 40% | 0.396 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -72.3 | -37.6 | 176.9 | -71.7 | -31.3 | 0 | 0 | 0 | 112.3 | S221 D222 A223 R228 L229 | S221-D225 PolarHBondContact O-N 3.14Å; S221-D225 VanDerWaalsContact O-N 3.13Å; D222-D225 PolarHBondContact O-N 2.91Å; A223-D225 VanDerWaalsContact C-N 3.31Å; A223-D225 PolarHBondContact O-N 2.93Å; D225-R228 PolarHBondContact O-N 3.38Å; D225-L229 WeakPolarHBondContact O-CG 3.43Å; D225-L229 PolarHBondContact O-N 2.9Å |
| 226 | F | 68.7 | Low | 61.8 | Low | 134 Ų | 134 | 98.2 Ų | 98.2 | 59% | 0.588 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -61.9 | -45.8 | 172.8 | -177.2 | -98.6 | 0 | 0 | 0 | 112.3 | D222 A223 R228 L229 K230 | D222-F226 WeakPolarHBondContact O-CB 3.45Å; D222-F226 PolarHBondContact O-N 3.04Å; A223-F226 PolarHBondContact O-N 3.25Å; F226-R228 VanDerWaalsContact C-N 3.31Å; F226-R228 PolarHBondContact O-N 3.39Å; F226-L229 PolarHBondContact O-N 3.4Å; F226-K230 HydrophobicContact CE1-CD 4.47Å; F226-K230 WeakPolarHBondContact O-CB 3.14Å; F226-K230 PolarHBondContact O-N 3.4Å |
| 227 | D | 67.6 | Low | 64 | Low | 94 Ų | 94 | 99.3 Ų | 99.3 | 50% | 0.503 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.4 | -38.3 | 177.7 | -80.7 | -25.3 | 0 | 0 | 0 | 111.8 | A223 K230 M231 | A223-D227 PolarHBondContact O-N 3.49Å; D227-K230 PolarHBondContact O-N 3Å; D227-M231 WeakPolarHBondContact O-CB 3.41Å; D227-M231 VanDerWaalsContact O-CG 3.25Å; D227-M231 WeakPolarHBondContact O-CG 3.46Å; D227-M231 PolarHBondContact O-N 3.21Å |
| 228 | R | 70.8 | Confident | 65.7 | Low | 142 Ų | 142 | 97 Ų | 97 | 54% | 0.536 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63 | -45.2 | 174.5 | -76.9 | 171.4 | 172.4 | -163 | -5.3 | 112.2 | V224 D225 F226 M231 R232 | V224-R228 VanDerWaalsContact O-CG 3.25Å; V224-R228 WeakPolarHBondContact O-CG 3.33Å; V224-R228 PolarHBondContact O-N 3.46Å; V224-R228 VanDerWaalsContact O-N 3.11Å; D225-R228 PolarHBondContact O-N 3.38Å; F226-R228 VanDerWaalsContact C-N 3.31Å; F226-R228 PolarHBondContact O-N 3.39Å; R228-M231 PolarHBondContact O-N 2.97Å; R228-R232 PolarHBondContact O-N 3.01Å |
| 229 | L | 74.2 | Confident | 67.7 | Low | 118 Ų | 118 | 95 Ų | 95 | 62% | 0.618 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.6 | -45.2 | 176 | -81.1 | 158.7 | 0 | 0 | 0 | 111.5 | D225 F226 M231 R232 L233 | D225-L229 WeakPolarHBondContact O-CG 3.43Å; D225-L229 PolarHBondContact O-N 2.9Å; F226-L229 PolarHBondContact O-N 3.4Å; L229-M231 VanDerWaalsContact C-N 3.35Å; L229-M231 PolarHBondContact O-N 3.47Å; L229-R232 PolarHBondContact O-N 3.45Å; L229-L233 PolarHBondContact O-N 2.89Å |
| 230 | K | 74.4 | Confident | 69.6 | Low | 114 Ų | 114 | 99.5 Ų | 99.5 | 50% | 0.496 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.7 | -44.7 | 176.5 | -174.5 | 176.4 | -178.9 | 178.7 | 0 | 111.8 | F226 D227 R232 L233 L234 | F226-K230 HydrophobicContact CE1-CD 4.47Å; F226-K230 WeakPolarHBondContact O-CB 3.14Å; F226-K230 PolarHBondContact O-N 3.4Å; D227-K230 PolarHBondContact O-N 3Å; K230-R232 VanDerWaalsContact C-N 3.34Å; K230-R232 PolarHBondContact O-N 3.38Å; K230-L233 PolarHBondContact O-N 3.42Å; K230-L234 HydrophobicContact CG-CD1 4.23Å; K230-L234 WeakPolarHBondContact O-CG 3.25Å; K230-L234 PolarHBondContact O-N 3.48Å |
| 231 | M | 66.1 | Low | 70.9 | Confident | 77 Ų | 77 | 103.7 Ų | 103.7 | 38% | 0.379 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.1 | -37.4 | 177.2 | -71.9 | -52.9 | -60.5 | 0 | 0 | 112.3 | D227 R228 L229 L234 V235 Y246 | D227-M231 WeakPolarHBondContact O-CB 3.41Å; D227-M231 VanDerWaalsContact O-CG 3.25Å; D227-M231 WeakPolarHBondContact O-CG 3.46Å; D227-M231 PolarHBondContact O-N 3.21Å; R228-M231 PolarHBondContact O-N 2.97Å; L229-M231 VanDerWaalsContact C-N 3.35Å; L229-M231 PolarHBondContact O-N 3.47Å; M231-L234 PolarHBondContact O-N 2.96Å; M231-L234 HydrophobicContact SD-CD1 4.3Å; M231-V235 WeakPolarHBondContact O-CB 3.47Å; M231-V235 VanDerWaalsContact O-CG2 3.23Å; M231-V235 WeakPolarHBondContact O-CG2 2.96Å; M231-V235 PolarHBondContact O-N 2.57Å; M231-Y246 HydrophobicContact CE-CE2 3.79Å; M231-Y246 WeakPolarHBondContact CE-OH 3.45Å |
| 232 | R | 74 | Confident | 72.4 | Confident | 202 Ų | 202 | 104.3 Ų | 104.3 | 76% | 0.762 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.9 | -45.5 | 176.1 | -169.9 | 175.5 | -176.6 | 172.2 | 1 | 111.7 | R228 L229 K230 L234 V235 S236 | R228-R232 PolarHBondContact O-N 3.01Å; L229-R232 PolarHBondContact O-N 3.45Å; K230-R232 VanDerWaalsContact C-N 3.34Å; K230-R232 PolarHBondContact O-N 3.38Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.91Å; R232-V235 PolarHBondContact O-N 3.41Å; R232-S236 PolarHBondContact O-N 3.04Å; R232-S236 PolarHBondContact O-OG 3.41Å |
| 233 | L | 74.9 | Confident | 73.7 | Confident | 115 Ų | 115 | 100.5 Ų | 100.5 | 60% | 0.602 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.1 | -35.7 | 178.2 | -173.6 | 67.8 | 0 | 0 | 0 | 112.5 | L229 K230 S236 N237 | L229-L233 PolarHBondContact O-N 2.89Å; K230-L233 PolarHBondContact O-N 3.42Å; L233-S236 PolarHBondContact O-OG 3.28Å; L233-N237 PolarHBondContact O-N 2.82Å; L233-N237 PolarHBondContact O-ND2 3.44Å |
| 234 | L | 77.5 | Confident | 74.8 | Confident | 75 Ų | 75 | 100.8 Ų | 100.8 | 39% | 0.393 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69 | -46.5 | 175.9 | -73.7 | 169.7 | 0 | 0 | 0 | 111.3 | K230 M231 R232 S236 N237 F238 | K230-L234 HydrophobicContact CG-CD1 4.23Å; K230-L234 WeakPolarHBondContact O-CG 3.25Å; K230-L234 PolarHBondContact O-N 3.48Å; M231-L234 PolarHBondContact O-N 2.96Å; M231-L234 HydrophobicContact SD-CD1 4.3Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.91Å; L234-S236 VanDerWaalsContact C-N 3.28Å; L234-S236 PolarHBondContact O-N 3.44Å; L234-N237 PolarHBondContact O-N 3.13Å; L234-N237 VanDerWaalsContact O-N 3.13Å; L234-F238 HydrophobicContact CB-CE1 4.11Å; L234-F238 HydrophobicContact CB-CZ 4.29Å; L234-F238 WeakPolarHBondContact O-CD1 3.38Å; L234-F238 WeakPolarHBondContact O-CE1 3.23Å; L234-F238 WeakPolarHBondContact O-CG 2.96Å; L234-F238 PolarHBondContact O-N 3Å |
| 235 | V | 76.7 | Confident | 75.9 | Confident | 49 Ų | 49 | 105.2 Ų | 105.2 | 30% | 0.297 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.3 | -36.5 | 179.8 | 171.8 | 0 | 0 | 0 | 0 | 111.5 | M231 R232 N237 F238 L243 Y246 | M231-V235 WeakPolarHBondContact O-CB 3.47Å; M231-V235 VanDerWaalsContact O-CG2 3.23Å; M231-V235 WeakPolarHBondContact O-CG2 2.96Å; M231-V235 PolarHBondContact O-N 2.57Å; R232-V235 PolarHBondContact O-N 3.41Å; V235-N237 VanDerWaalsContact C-N 3.28Å; V235-N237 PolarHBondContact O-N 3.39Å; V235-F238 PolarHBondContact O-N 3.36Å; V235-L243 HydrophobicContact CG1-CD1 3.98Å; V235-Y246 HydrophobicContact CG2-CD1 4.2Å; V235-Y246 HydrophobicContact CG2-CE1 3.62Å |
| 236 | S | 75.4 | Confident | 76.4 | Confident | 84 Ų | 84 | 104 Ų | 104 | 59% | 0.587 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -68.8 | -24.8 | 177.4 | 64 | 0 | 0 | 0 | 0 | 113.8 | R232 L233 L234 | R232-S236 PolarHBondContact O-N 3.04Å; R232-S236 PolarHBondContact O-OG 3.41Å; L233-S236 PolarHBondContact O-OG 3.28Å; L234-S236 VanDerWaalsContact C-N 3.28Å; L234-S236 PolarHBondContact O-N 3.44Å |
| 237 | N | 82 | Confident | 76.9 | Confident | 119 Ų | 119 | 99.9 Ų | 99.9 | 64% | 0.636 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | 5.9 | -179.3 | -73.9 | -68.9 | 0 | 0 | 0 | 113.4 | L233 L234 V235 | L233-N237 PolarHBondContact O-N 2.82Å; L233-N237 PolarHBondContact O-ND2 3.44Å; L234-N237 PolarHBondContact O-N 3.13Å; L234-N237 VanDerWaalsContact O-N 3.13Å; V235-N237 VanDerWaalsContact C-N 3.28Å; V235-N237 PolarHBondContact O-N 3.39Å |
| 238 | F | 77.7 | Confident | 77.4 | Confident | 66 Ų | 66 | 100.7 Ų | 100.7 | 29% | 0.289 | 48% | 0.482 | S | S | . | . | trans | -77.2 | 138.7 | -179.6 | -81 | 2.3 | 0 | 0 | 0 | 112.3 | L234 V235 Q242 L243 Y246 | L234-F238 HydrophobicContact CB-CE1 4.11Å; L234-F238 HydrophobicContact CB-CZ 4.29Å; L234-F238 WeakPolarHBondContact O-CD1 3.38Å; L234-F238 WeakPolarHBondContact O-CE1 3.23Å; L234-F238 WeakPolarHBondContact O-CG 2.96Å; L234-F238 PolarHBondContact O-N 3Å; V235-F238 PolarHBondContact O-N 3.36Å; F238-Q242 HydrophobicContact CB-CB 3.95Å; F238-Q242 HydrophobicContact CD1-CB 4.49Å; F238-Q242 HydrophobicContact CD2-CB 4.23Å; F238-Q242 HydrophobicContact CG-CB 3.99Å; F238-L243 HydrophobicContact CB-CB 4.32Å; F238-Y246 HydrophobicContact CD2-CG 4.45Å; F238-Y246 HydrophobicContact CE2-CD1 4.32Å; F238-Y246 HydrophobicContact CE2-CD2 4.19Å; F238-Y246 AromaticContact CE2-CG 3.87Å; F238-Y246 HydrophobicContact CE2-CG 3.87Å | ||
| 239 | S | 85.1 | Confident | 77.9 | Confident | 55 Ų | 55 | 99.7 Ų | 99.7 | 39% | 0.385 | 48% | 0.48 | S | S | . | . | trans | -62.8 | 157.5 | 165.4 | 80.5 | 0 | 0 | 0 | 0 | 110.5 | E241 Q242 L243 | S239-E241 PolarHBondContact O-N 3.42Å; S239-E241 VanDerWaalsContact O-N 3.14Å; S239-Q242 WeakPolarHBondContact O-CB 3.38Å; S239-Q242 PolarHBondContact O-N 2.8Å; S239-Q242 WeakPolarHBondContact OG-CG 3.29Å; S239-Q242 PolarHBondContact OG-N 2.74Å; S239-Q242 PolarHBondContact OG-OE1 3.49Å; S239-L243 PolarHBondContact O-N 2.91Å | ||
| 240 | K | 82.6 | Confident | 78.2 | Confident | 192 Ų | 192 | 101 Ų | 101 | 84% | 0.835 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -54.1 | -36.9 | 178.7 | -66 | -176.7 | 179.6 | -179.8 | 0 | 112.7 | S244 | K240-S244 WeakPolarHBondContact O-CB 3.42Å; K240-S244 PolarHBondContact O-N 3.28Å |
| 241 | E | 76.7 | Confident | 78.4 | Confident | 146 Ų | 146 | 103 Ų | 103 | 68% | 0.682 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -71.7 | -37.6 | 176.7 | -64.4 | -175.3 | 173 | 0 | 0 | 112.9 | S239 R245 | S239-E241 PolarHBondContact O-N 3.42Å; S239-E241 VanDerWaalsContact O-N 3.14Å; E241-R245 WeakPolarHBondContact O-CG 3.5Å; E241-R245 PolarHBondContact O-N 3.48Å; E241-R245 VanDerWaalsContact O-N 3.08Å; E241-R245 PolarHBondContact O-NE 3.13Å |
| 242 | Q | 80.3 | Confident | 79.1 | Confident | 79 Ų | 79 | 102 Ų | 102 | 37% | 0.369 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.8 | -42.2 | 175.3 | -74.5 | 171.7 | -35.5 | 0 | 0 | 111.1 | F238 S239 R245 Y246 | F238-Q242 HydrophobicContact CB-CB 3.95Å; F238-Q242 HydrophobicContact CD1-CB 4.49Å; F238-Q242 HydrophobicContact CD2-CB 4.23Å; F238-Q242 HydrophobicContact CG-CB 3.99Å; S239-Q242 WeakPolarHBondContact O-CB 3.38Å; S239-Q242 PolarHBondContact O-N 2.8Å; S239-Q242 WeakPolarHBondContact OG-CG 3.29Å; S239-Q242 PolarHBondContact OG-N 2.74Å; S239-Q242 PolarHBondContact OG-OE1 3.49Å; Q242-R245 PolarHBondContact O-N 3.32Å; Q242-Y246 VanDerWaalsContact O-CB 3.32Å; Q242-Y246 WeakPolarHBondContact O-CB 3.4Å; Q242-Y246 PolarHBondContact O-N 3.21Å |
| 243 | L | 79.9 | Confident | 79.5 | Confident | 55 Ų | 55 | 97.7 Ų | 97.7 | 29% | 0.288 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61 | -48.5 | 176.1 | -174.7 | 64.8 | 0 | 0 | 0 | 110.8 | V235 F238 S239 R245 Y246 E247 | V235-L243 HydrophobicContact CG1-CD1 3.98Å; F238-L243 HydrophobicContact CB-CB 4.32Å; S239-L243 PolarHBondContact O-N 2.91Å; L243-R245 VanDerWaalsContact C-N 3.32Å; L243-R245 PolarHBondContact O-N 2.89Å; L243-Y246 PolarHBondContact O-N 3.34Å; L243-E247 HydrophobicContact CD1-CG 4.42Å; L243-E247 HydrophobicContact CG-CG 4.42Å; L243-E247 WeakPolarHBondContact O-CB 3.43Å; L243-E247 WeakPolarHBondContact O-CG 3.48Å; L243-E247 PolarHBondContact O-N 3.38Å |
| 244 | S | 81.3 | Confident | 80 | Confident | 60 Ų | 60 | 95.4 Ų | 95.4 | 42% | 0.42 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -58.1 | -42.7 | 176.2 | -178.2 | 0 | 0 | 0 | 0 | 112.2 | K240 M248 | K240-S244 WeakPolarHBondContact O-CB 3.42Å; K240-S244 PolarHBondContact O-N 3.28Å; S244-M248 WeakPolarHBondContact O-CB 3.36Å; S244-M248 WeakPolarHBondContact O-CG 3.48Å; S244-M248 PolarHBondContact O-N 3.03Å |
| 245 | R | 79.6 | Confident | 80.5 | Confident | 160 Ų | 160 | 95.4 Ų | 95.4 | 60% | 0.604 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -63.6 | -45.1 | 176.5 | -77.6 | -174.8 | -74.8 | 165.8 | -9.8 | 111.8 | E241 Q242 L243 M248 Y249 | E241-R245 WeakPolarHBondContact O-CG 3.5Å; E241-R245 PolarHBondContact O-N 3.48Å; E241-R245 VanDerWaalsContact O-N 3.08Å; E241-R245 PolarHBondContact O-NE 3.13Å; Q242-R245 PolarHBondContact O-N 3.32Å; L243-R245 VanDerWaalsContact C-N 3.32Å; L243-R245 PolarHBondContact O-N 2.89Å; R245-M248 PolarHBondContact O-N 3.31Å; R245-Y249 WeakPolarHBondContact O-CB 3.28Å; R245-Y249 PolarHBondContact O-N 2.98Å |
| 246 | Y | 79 | Confident | 81 | Confident | 49 Ų | 49 | 96.9 Ų | 96.9 | 19% | 0.192 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -64 | -43.8 | 179.2 | 176.2 | -108.5 | 0 | 0 | 0 | 112 | M231 V235 F238 Q242 L243 Y249 R250 | M231-Y246 HydrophobicContact CE-CE2 3.79Å; M231-Y246 WeakPolarHBondContact CE-OH 3.45Å; V235-Y246 HydrophobicContact CG2-CD1 4.2Å; V235-Y246 HydrophobicContact CG2-CE1 3.62Å; F238-Y246 HydrophobicContact CD2-CG 4.45Å; F238-Y246 HydrophobicContact CE2-CD1 4.32Å; F238-Y246 HydrophobicContact CE2-CD2 4.19Å; F238-Y246 AromaticContact CE2-CG 3.87Å; F238-Y246 HydrophobicContact CE2-CG 3.87Å; Q242-Y246 VanDerWaalsContact O-CB 3.32Å; Q242-Y246 WeakPolarHBondContact O-CB 3.4Å; Q242-Y246 PolarHBondContact O-N 3.21Å; L243-Y246 PolarHBondContact O-N 3.34Å; Y246-Y249 PolarHBondContact O-N 3.39Å; Y246-R250 VanDerWaalsContact CE1-CD 3.47Å; Y246-R250 HydrophobicContact CE1-CG 4.25Å; Y246-R250 HydrophobicContact CE2-CG 4.15Å; Y246-R250 WeakPolarHBondContact O-CG 3.35Å; Y246-R250 PolarHBondContact O-N 3.3Å; Y246-R250 WeakPolarHBondContact OH-CD 3.32Å |
| 247 | E | 79.2 | Confident | 81.6 | Confident | 47 Ų | 47 | 97.2 Ų | 97.2 | 22% | 0.22 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -62.6 | -44 | 175.6 | -73.3 | -171.9 | -176.3 | 0 | 0 | 112.1 | L243 Y249 R250 R251 | L243-E247 HydrophobicContact CD1-CG 4.42Å; L243-E247 HydrophobicContact CG-CG 4.42Å; L243-E247 WeakPolarHBondContact O-CB 3.43Å; L243-E247 WeakPolarHBondContact O-CG 3.48Å; L243-E247 PolarHBondContact O-N 3.38Å; E247-Y249 VanDerWaalsContact C-N 3.34Å; E247-Y249 PolarHBondContact O-N 3.04Å; E247-R250 PolarHBondContact O-N 3.34Å; E247-R251 WeakPolarHBondContact O-CB 3.48Å; E247-R251 VanDerWaalsContact O-CG 3.29Å; E247-R251 WeakPolarHBondContact O-CG 3.41Å; E247-R251 PolarHBondContact O-N 2.81Å; E247-R251 IonicContact OE2-CZ 3.92Å; E247-R251 VanDerWaalsContact OE2-CZ 3.28Å; E247-R251 IonicContact OE2-NH1 3.42Å; E247-R251 PolarHBondContact OE2-NH1 3.19Å; E247-R251 IonicContact OE2-NH2 3.92Å; E247-R251 PolarHBondContact OE2-NH2 3.38Å |
| 248 | M | 78.2 | Confident | 81.9 | Confident | 110 Ų | 110 | 97.4 Ų | 97.4 | 54% | 0.542 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.3 | -41 | 176.1 | -69.1 | -60 | 157.3 | 0 | 0 | 111.5 | S244 R245 R250 R251 S252 | S244-M248 WeakPolarHBondContact O-CB 3.36Å; S244-M248 WeakPolarHBondContact O-CG 3.48Å; S244-M248 PolarHBondContact O-N 3.03Å; R245-M248 PolarHBondContact O-N 3.31Å; M248-R250 PolarHBondContact O-N 2.89Å; M248-R251 PolarHBondContact O-N 2.76Å; M248-S252 WeakPolarHBondContact O-CB 3.5Å; M248-S252 PolarHBondContact O-N 2.94Å |
| 249 | Y | 81.1 | Confident | 82.5 | Confident | 121 Ų | 121 | 95 Ų | 95 | 48% | 0.475 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.6 | -45.2 | 174.3 | 176.3 | -99.1 | 0 | 0 | 0 | 111.5 | R245 Y246 E247 S252 K284 | R245-Y249 WeakPolarHBondContact O-CB 3.28Å; R245-Y249 PolarHBondContact O-N 2.98Å; Y246-Y249 PolarHBondContact O-N 3.39Å; E247-Y249 VanDerWaalsContact C-N 3.34Å; E247-Y249 PolarHBondContact O-N 3.04Å; Y249-S252 PolarHBondContact O-N 3.28Å; Y249-S252 PolarHBondContact O-OG 2.86Å; Y249-K284 HydrophobicContact CE2-CD 4.49Å; Y249-K284 HydrophobicContact CE2-CG 4.35Å; Y249-K284 WeakPolarHBondContact O-CE 3.49Å; Y249-K284 PolarHBondContact O-NZ 2.77Å |
| 250 | R | 81.1 | Confident | 82.6 | Confident | 147 Ų | 147 | 96.8 Ų | 96.8 | 56% | 0.555 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -65 | -40.8 | 177.4 | -76.8 | -168.9 | 69.5 | 179.6 | 0.2 | 113.1 | Y246 E247 M248 S252 | Y246-R250 VanDerWaalsContact CE1-CD 3.47Å; Y246-R250 HydrophobicContact CE1-CG 4.25Å; Y246-R250 HydrophobicContact CE2-CG 4.15Å; Y246-R250 WeakPolarHBondContact O-CG 3.35Å; Y246-R250 PolarHBondContact O-N 3.3Å; Y246-R250 WeakPolarHBondContact OH-CD 3.32Å; E247-R250 PolarHBondContact O-N 3.34Å; M248-R250 PolarHBondContact O-N 2.89Å; R250-S252 VanDerWaalsContact C-N 3.33Å |
| 251 | R | 78.6 | Confident | 83 | Confident | 155 Ų | 155 | 93.6 Ų | 93.6 | 59% | 0.585 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -70.5 | -28.2 | 178.3 | -71 | 179.8 | -173.7 | 117.2 | 7.8 | 112.8 | E247 M248 V253 | E247-R251 WeakPolarHBondContact O-CB 3.48Å; E247-R251 VanDerWaalsContact O-CG 3.29Å; E247-R251 WeakPolarHBondContact O-CG 3.41Å; E247-R251 PolarHBondContact O-N 2.81Å; E247-R251 IonicContact OE2-CZ 3.92Å; E247-R251 VanDerWaalsContact OE2-CZ 3.28Å; E247-R251 IonicContact OE2-NH1 3.42Å; E247-R251 PolarHBondContact OE2-NH1 3.19Å; E247-R251 IonicContact OE2-NH2 3.92Å; E247-R251 PolarHBondContact OE2-NH2 3.38Å; M248-R251 PolarHBondContact O-N 2.76Å; R251-V253 PolarHBondContact O-N 3.43Å |
| 252 | S | 79.4 | Confident | 83.7 | Confident | 56 Ų | 56 | 89.5 Ų | 89.5 | 39% | 0.392 | 43% | 0.426 | S | S | . | . | trans | -69 | 121.9 | 178.3 | 72.2 | 0 | 0 | 0 | 0 | 111.3 | M248 Y249 R250 K284 | M248-S252 WeakPolarHBondContact O-CB 3.5Å; M248-S252 PolarHBondContact O-N 2.94Å; Y249-S252 PolarHBondContact O-N 3.28Å; Y249-S252 PolarHBondContact O-OG 2.86Å; R250-S252 VanDerWaalsContact C-N 3.33Å; S252-K284 WeakPolarHBondContact O-CE 3.45Å; S252-K284 PolarHBondContact O-NZ 3.44Å; S252-K284 WeakPolarHBondContact OG-CE 3.5Å | ||
| 253 | V | 83.1 | Confident | 84.2 | Confident | 111 Ų | 111 | 86.6 Ų | 86.6 | 67% | 0.673 | 41% | 0.413 | S | S | * | . | trans | -141.5 | 135.5 | 177.4 | -179.1 | 0 | 0 | 0 | 0 | 108.4 | R251 P255 | R251-V253 PolarHBondContact O-N 3.43Å; V253-P255 WeakPolarHBondContact O-CD 3.35Å | ||
| 254 | F | 85.2 | Confident | 84.7 | Confident | 67 Ų | 67 | 88.7 Ų | 88.7 | 29% | 0.294 | 42% | 0.422 | S | S | . | . | trans | -74.2 | 127.4 | 170.2 | -72.2 | -62 | 0 | 0 | 0 | 110.1 | K256 I259 A283 K284 V287 | F254-K256 PolarHBondContact O-N 2.85Å; F254-I259 HydrophobicContact CB-CD1 3.88Å; F254-I259 HydrophobicContact CB-CG1 3.79Å; F254-I259 HydrophobicContact CG-CD1 4.18Å; F254-A283 HydrophobicContact CD2-CB 4.23Å; F254-A283 HydrophobicContact CE2-CB 4.09Å; F254-K284 HydrophobicContact CD2-CB 4.33Å; F254-K284 HydrophobicContact CE2-CB 4.15Å; F254-V287 HydrophobicContact CZ-CB 4.5Å; F254-V287 HydrophobicContact CZ-CG2 4.04Å | ||
| 255 | P | 88.4 | Confident | 85.2 | Confident | 76 Ų | 76 | 92.5 Ų | 92.5 | 49% | 0.494 | 43% | 0.433 | S | S | . | . | trans | -56.5 | 125 | 176.3 | -25.3 | 34.1 | 0 | 0 | 0 | 111 | V253 S257 F258 I259 | V253-P255 WeakPolarHBondContact O-CD 3.35Å; P255-S257 PolarHBondContact O-N 2.98Å; P255-S257 VanDerWaalsContact O-N 3.15Å; P255-F258 HydrophobicContact CB-CB 4.22Å; P255-F258 WeakPolarHBondContact O-CB 3.27Å; P255-F258 PolarHBondContact O-N 3.14Å; P255-I259 PolarHBondContact O-N 2.98Å | ||
| 256 | K | 86.3 | Confident | 85.7 | Confident | 80 Ų | 80 | 90.3 Ų | 90.3 | 35% | 0.348 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -56.5 | -34.3 | -178 | -62.3 | 178.8 | -173.4 | 171.9 | 0 | 112.2 | E208 F254 R260 V276 | E208-K256 IonicContact OE2-NZ 2.7Å; E208-K256 PolarHBondContact OE2-NZ 3.13Å; F254-K256 PolarHBondContact O-N 2.85Å; K256-R260 VanDerWaalsContact O-CB 3.27Å; K256-R260 WeakPolarHBondContact O-CB 3.22Å; K256-R260 PolarHBondContact O-N 3.15Å; K256-V276 HydrophobicContact CB-CG1 4.09Å; K256-V276 WeakPolarHBondContact O-CG1 3.48Å |
| 257 | S | 88 | Confident | 86.1 | Confident | 90 Ų | 90 | 92.6 Ų | 92.6 | 63% | 0.629 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -63.3 | -40.3 | 176.4 | 53.2 | 0 | 0 | 0 | 0 | 112.7 | P255 K261 | P255-S257 PolarHBondContact O-N 2.98Å; P255-S257 VanDerWaalsContact O-N 3.15Å; S257-K261 PolarHBondContact O-N 3.19Å; S257-K261 VanDerWaalsContact O-N 3.11Å |
| 258 | F | 89.1 | Confident | 86.5 | Confident | 124 Ų | 124 | 93.5 Ų | 93.5 | 54% | 0.544 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -69.4 | -48.2 | 179.1 | -175.3 | -98.9 | 0 | 0 | 0 | 111.2 | P255 R260 K261 V262 | P255-F258 HydrophobicContact CB-CB 4.22Å; P255-F258 WeakPolarHBondContact O-CB 3.27Å; P255-F258 PolarHBondContact O-N 3.14Å; F258-R260 VanDerWaalsContact C-N 3.33Å; F258-R260 PolarHBondContact O-N 3.02Å; F258-K261 WeakPolarHBondContact O-CB 3.29Å; F258-K261 PolarHBondContact O-N 3.19Å; F258-K261 VanDerWaalsContact O-N 3.11Å; F258-V262 HydrophobicContact CD1-CG2 4.28Å; F258-V262 HydrophobicContact CE1-CG2 3.9Å; F258-V262 HydrophobicContact CZ-CG2 4.13Å; F258-V262 WeakPolarHBondContact O-CG2 3.46Å; F258-V262 PolarHBondContact O-N 2.92Å |
| 259 | I | 89.6 | Confident | 86.8 | Confident | 14 Ų | 14 | 90.6 Ų | 90.6 | 7% | 0.072 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -59.8 | -44.5 | 177.8 | -62.7 | -62.1 | 0 | 0 | 0 | 111 | F254 P255 K261 V262 I263 V276 M279 A280 | F254-I259 HydrophobicContact CB-CD1 3.88Å; F254-I259 HydrophobicContact CB-CG1 3.79Å; F254-I259 HydrophobicContact CG-CD1 4.18Å; P255-I259 PolarHBondContact O-N 2.98Å; I259-K261 VanDerWaalsContact C-N 3.31Å; I259-K261 PolarHBondContact O-N 3.45Å; I259-V262 PolarHBondContact O-N 3.4Å; I259-I263 HydrophobicContact CG2-CD1 3.75Å; I259-I263 HydrophobicContact CG2-CG1 4.37Å; I259-I263 VanDerWaalsContact O-CG1 3.3Å; I259-I263 WeakPolarHBondContact O-CG1 3.39Å; I259-I263 PolarHBondContact O-N 2.98Å; I259-V276 HydrophobicContact CB-CG1 4.18Å; I259-V276 HydrophobicContact CG2-CG1 4.04Å; I259-M279 HydrophobicContact CG2-CB 4.08Å; I259-M279 HydrophobicContact CG2-CG 4.09Å; I259-A280 HydrophobicContact CG1-CB 4.21Å |
| 260 | R | 88.6 | Confident | 86.9 | Confident | 93 Ų | 93 | 89.3 Ų | 89.3 | 35% | 0.351 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -56.4 | -44.6 | 174.9 | -177.3 | -176.3 | -65.7 | -87.2 | -2 | 111.9 | K256 F258 I263 Q264 T271 V276 | K256-R260 VanDerWaalsContact O-CB 3.27Å; K256-R260 WeakPolarHBondContact O-CB 3.22Å; K256-R260 PolarHBondContact O-N 3.15Å; F258-R260 VanDerWaalsContact C-N 3.33Å; F258-R260 PolarHBondContact O-N 3.02Å; R260-I263 PolarHBondContact O-N 3.41Å; R260-Q264 WeakPolarHBondContact O-CB 3.37Å; R260-Q264 PolarHBondContact O-N 3.11Å; R260-T271 PolarHBondContact NH1-O 2.97Å; R260-V276 HydrophobicContact CB-CG2 4.1Å; R260-V276 HydrophobicContact CG-CG2 4.43Å |
| 261 | K | 90 | Very high | 87 | Confident | 126 Ų | 126 | 83.4 Ų | 83.4 | 55% | 0.548 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.4 | -44 | 178.5 | -171.6 | 177.8 | -179.4 | 179.3 | 0 | 111.8 | S257 F258 I259 Q264 Q265 | S257-K261 PolarHBondContact O-N 3.19Å; S257-K261 VanDerWaalsContact O-N 3.11Å; F258-K261 WeakPolarHBondContact O-CB 3.29Å; F258-K261 PolarHBondContact O-N 3.19Å; F258-K261 VanDerWaalsContact O-N 3.11Å; I259-K261 VanDerWaalsContact C-N 3.31Å; I259-K261 PolarHBondContact O-N 3.45Å; K261-Q264 PolarHBondContact O-N 2.9Å; K261-Q265 WeakPolarHBondContact O-CB 3.29Å; K261-Q265 VanDerWaalsContact O-CG 3.25Å; K261-Q265 WeakPolarHBondContact O-CG 3.42Å; K261-Q265 PolarHBondContact O-N 3.19Å |
| 262 | V | 91.4 | Very high | 87.5 | Confident | 60 Ų | 60 | 80.3 Ų | 80.3 | 36% | 0.364 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 178.5 | 174 | 0 | 0 | 0 | 0 | 111.7 | F258 I259 Q265 T266 | F258-V262 HydrophobicContact CD1-CG2 4.28Å; F258-V262 HydrophobicContact CE1-CG2 3.9Å; F258-V262 HydrophobicContact CZ-CG2 4.13Å; F258-V262 WeakPolarHBondContact O-CG2 3.46Å; F258-V262 PolarHBondContact O-N 2.92Å; I259-V262 PolarHBondContact O-N 3.4Å; V262-Q265 PolarHBondContact O-N 3.48Å; V262-T266 WeakPolarHBondContact O-CB 3.47Å; V262-T266 PolarHBondContact O-N 3.49Å; V262-T266 PolarHBondContact O-OG1 2.72Å |
| 263 | I | 90.2 | Very high | 87.8 | Confident | 18 Ų | 18 | 82 Ų | 82 | 9% | 0.092 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -62 | -46.8 | 177.1 | -63.6 | 165 | 0 | 0 | 0 | 109.9 | I259 R260 Q265 T266 T267 T271 V276 M279 | I259-I263 HydrophobicContact CG2-CD1 3.75Å; I259-I263 HydrophobicContact CG2-CG1 4.37Å; I259-I263 VanDerWaalsContact O-CG1 3.3Å; I259-I263 WeakPolarHBondContact O-CG1 3.39Å; I259-I263 PolarHBondContact O-N 2.98Å; R260-I263 PolarHBondContact O-N 3.41Å; I263-Q265 VanDerWaalsContact C-N 3.33Å; I263-Q265 PolarHBondContact O-N 2.87Å; I263-T266 PolarHBondContact O-N 2.92Å; I263-T267 WeakPolarHBondContact O-CB 3.32Å; I263-T267 PolarHBondContact O-N 3.08Å; I263-T267 PolarHBondContact O-OG1 3.28Å; I263-T271 HydrophobicContact CD1-CG2 4.4Å; I263-T271 HydrophobicContact CG2-CG2 3.76Å; I263-T271 VanDerWaalsContact CG2-OG1 3.29Å; I263-T271 WeakPolarHBondContact CG2-OG1 3.28Å; I263-V276 HydrophobicContact CD1-CG2 4.35Å; I263-M279 HydrophobicContact CD1-CB 3.92Å; I263-M279 HydrophobicContact CD1-CG 3.92Å; I263-M279 HydrophobicContact CG1-CG 4.2Å |
| 264 | Q | 90.5 | Very high | 88 | Confident | 99 Ų | 99 | 81.1 Ų | 81.1 | 46% | 0.463 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.6 | -37.1 | -179.8 | -169.6 | 172.6 | 12.4 | 0 | 0 | 112.4 | R260 K261 T266 G268 | R260-Q264 WeakPolarHBondContact O-CB 3.37Å; R260-Q264 PolarHBondContact O-N 3.11Å; K261-Q264 PolarHBondContact O-N 2.9Å; Q264-T266 VanDerWaalsContact C-N 3.32Å; Q264-T266 PolarHBondContact O-N 2.99Å; Q264-G268 WeakPolarHBondContact O-CA 3.22Å; Q264-G268 PolarHBondContact O-N 3.35Å |
| 265 | Q | 91.7 | Very high | 88.1 | Confident | 139 Ų | 139 | 81 Ų | 81 | 65% | 0.65 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -67 | -31.3 | 175.1 | -77.1 | 177.1 | -29.7 | 0 | 0 | 113 | K261 V262 I263 | K261-Q265 WeakPolarHBondContact O-CB 3.29Å; K261-Q265 VanDerWaalsContact O-CG 3.25Å; K261-Q265 WeakPolarHBondContact O-CG 3.42Å; K261-Q265 PolarHBondContact O-N 3.19Å; V262-Q265 PolarHBondContact O-N 3.48Å; I263-Q265 VanDerWaalsContact C-N 3.33Å; I263-Q265 PolarHBondContact O-N 2.87Å |
| 266 | T | 90.3 | Very high | 88.1 | Confident | 114 Ų | 114 | 77.4 Ų | 77.4 | 70% | 0.699 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -89.1 | -41.9 | -176 | -52.6 | 0 | 0 | 0 | 0 | 112.2 | V262 I263 Q264 | V262-T266 WeakPolarHBondContact O-CB 3.47Å; V262-T266 PolarHBondContact O-N 3.49Å; V262-T266 PolarHBondContact O-OG1 2.72Å; I263-T266 PolarHBondContact O-N 2.92Å; Q264-T266 VanDerWaalsContact C-N 3.32Å; Q264-T266 PolarHBondContact O-N 2.99Å |
| 267 | T | 88.7 | Confident | 88.1 | Confident | 97 Ų | 97 | 76.7 Ų | 76.7 | 60% | 0.595 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -96.5 | -21 | -174.9 | -49.4 | 0 | 0 | 0 | 0 | 112.6 | I263 A269 | I263-T267 WeakPolarHBondContact O-CB 3.32Å; I263-T267 PolarHBondContact O-N 3.08Å; I263-T267 PolarHBondContact O-OG1 3.28Å; T267-A269 HydrophobicContact CG2-CB 4.13Å; T267-A269 PolarHBondContact O-N 3.5Å |
| 268 | G | 86.9 | Confident | 88.1 | Confident | 67 Ų | 67 | 75 Ų | 75 | 69% | 0.691 | 43% | 0.431 | S | S | * | . | trans | 73.6 | -3.1 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | Q264 | Q264-G268 WeakPolarHBondContact O-CA 3.22Å; Q264-G268 PolarHBondContact O-N 3.35Å | ||
| 269 | A | 84.7 | Confident | 88 | Confident | 49 Ų | 49 | 73 Ų | 73 | 41% | 0.405 | 43% | 0.425 | S | S | . | . | S | Bend | trans | -107.2 | 147.6 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | T267 | T267-A269 HydrophobicContact CG2-CB 4.13Å; T267-A269 PolarHBondContact O-N 3.5Å |
| 270 | A | 83.6 | Confident | 87.9 | Confident | 93 Ų | 93 | 73.1 Ų | 73.1 | 77% | 0.769 | 43% | 0.427 | S | S | * | . | trans | -70.4 | 132.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 271 | T | 83.3 | Confident | 87.7 | Confident | 23 Ų | 23 | 70.4 Ų | 70.4 | 14% | 0.141 | 43% | 0.429 | C | S | . | . | trans | -104.6 | 142.4 | -173.9 | -10.9 | 0 | 0 | 0 | 0 | 112.6 | R260 I263 V275 | R260-T271 PolarHBondContact NH1-O 2.97Å; I263-T271 HydrophobicContact CD1-CG2 4.4Å; I263-T271 HydrophobicContact CG2-CG2 3.76Å; I263-T271 VanDerWaalsContact CG2-OG1 3.29Å; I263-T271 WeakPolarHBondContact CG2-OG1 3.28Å; T271-V275 HydrophobicContact CG2-CB 3.73Å; T271-V275 HydrophobicContact CG2-CG1 3.44Å; T271-V275 VanDerWaalsContact CG2-CG1 3.44Å; T271-V275 HydrophobicContact CG2-CG2 4.49Å | ||
| 272 | T | 88.1 | Confident | 87.6 | Confident | 91 Ų | 91 | 69.2 Ų | 69.2 | 56% | 0.558 | 43% | 0.428 | S | S | * | . | trans | -71.6 | 157.5 | 173.4 | 61.5 | 0 | 0 | 0 | 0 | 111.3 | N274 V275 V276 | T272-N274 VanDerWaalsContact C-N 3.33Å; T272-N274 PolarHBondContact O-N 3.44Å; T272-V275 PolarHBondContact O-N 3.24Å; T272-V275 VanDerWaalsContact OG1-CG2 3.28Å; T272-V275 WeakPolarHBondContact OG1-CG2 3.33Å; T272-V276 WeakPolarHBondContact O-CG2 3.36Å; T272-V276 PolarHBondContact O-N 2.88Å | ||
| 273 | M | 85.7 | Confident | 87.4 | Confident | 90 Ų | 90 | 67.6 Ų | 67.6 | 44% | 0.443 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.3 | -39.8 | -177.4 | -175 | 168.4 | 67.3 | 0 | 0 | 112.7 | V275 V276 I277 | M273-V275 VanDerWaalsContact C-N 3.31Å; M273-V275 PolarHBondContact O-N 3.48Å; M273-V276 WeakPolarHBondContact O-CB 3.37Å; M273-V276 PolarHBondContact O-N 2.97Å; M273-V276 VanDerWaalsContact O-N 3.13Å; M273-I277 HydrophobicContact CG-CD1 4.05Å; M273-I277 WeakPolarHBondContact O-CG1 3.48Å; M273-I277 PolarHBondContact O-N 3.25Å |
| 274 | N | 87.7 | Confident | 87.2 | Confident | 94 Ų | 94 | 68.8 Ų | 68.8 | 50% | 0.503 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.3 | -39.2 | -179.8 | -61.7 | -1.2 | 0 | 0 | 0 | 111.6 | T272 I277 A278 | T272-N274 VanDerWaalsContact C-N 3.33Å; T272-N274 PolarHBondContact O-N 3.44Å; N274-I277 PolarHBondContact O-N 3.43Å; N274-A278 WeakPolarHBondContact O-CB 3.48Å; N274-A278 PolarHBondContact O-N 3.11Å |
| 275 | V | 87.1 | Confident | 86.9 | Confident | 64 Ų | 64 | 67.7 Ų | 67.7 | 39% | 0.388 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -67.5 | -38.1 | 176.1 | 178 | 0 | 0 | 0 | 0 | 111.1 | T271 T272 M273 I277 A278 M279 | T271-V275 HydrophobicContact CG2-CB 3.73Å; T271-V275 HydrophobicContact CG2-CG1 3.44Å; T271-V275 VanDerWaalsContact CG2-CG1 3.44Å; T271-V275 HydrophobicContact CG2-CG2 4.49Å; T272-V275 PolarHBondContact O-N 3.24Å; T272-V275 VanDerWaalsContact OG1-CG2 3.28Å; T272-V275 WeakPolarHBondContact OG1-CG2 3.33Å; M273-V275 VanDerWaalsContact C-N 3.31Å; M273-V275 PolarHBondContact O-N 3.48Å; V275-I277 VanDerWaalsContact C-N 3.33Å; V275-I277 PolarHBondContact O-N 3.32Å; V275-A278 PolarHBondContact O-N 2.91Å; V275-M279 VanDerWaalsContact O-CB 3.28Å; V275-M279 WeakPolarHBondContact O-CB 3.25Å; V275-M279 PolarHBondContact O-N 3.37Å |
| 276 | V | 88.7 | Confident | 86.7 | Confident | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.006 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 175 | 175.3 | 0 | 0 | 0 | 0 | 111 | K256 I259 R260 I263 T272 M273 A280 | K256-V276 HydrophobicContact CB-CG1 4.09Å; K256-V276 WeakPolarHBondContact O-CG1 3.48Å; I259-V276 HydrophobicContact CB-CG1 4.18Å; I259-V276 HydrophobicContact CG2-CG1 4.04Å; R260-V276 HydrophobicContact CB-CG2 4.1Å; R260-V276 HydrophobicContact CG-CG2 4.43Å; I263-V276 HydrophobicContact CD1-CG2 4.35Å; T272-V276 WeakPolarHBondContact O-CG2 3.36Å; T272-V276 PolarHBondContact O-N 2.88Å; M273-V276 WeakPolarHBondContact O-CB 3.37Å; M273-V276 PolarHBondContact O-N 2.97Å; M273-V276 VanDerWaalsContact O-N 3.13Å; V276-A280 VanDerWaalsContact O-CB 3.29Å; V276-A280 WeakPolarHBondContact O-CB 3.21Å; V276-A280 PolarHBondContact O-N 3.39Å |
| 277 | I | 86.1 | Confident | 86.5 | Confident | 65 Ų | 65 | 61.5 Ų | 61.5 | 33% | 0.333 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.3 | -48.1 | 177.4 | -66.2 | 166.8 | 0 | 0 | 0 | 110.6 | M273 N274 V275 M279 A280 G281 | M273-I277 HydrophobicContact CG-CD1 4.05Å; M273-I277 WeakPolarHBondContact O-CG1 3.48Å; M273-I277 PolarHBondContact O-N 3.25Å; N274-I277 PolarHBondContact O-N 3.43Å; V275-I277 VanDerWaalsContact C-N 3.33Å; V275-I277 PolarHBondContact O-N 3.32Å; I277-M279 VanDerWaalsContact C-N 3.35Å; I277-M279 PolarHBondContact O-N 3.05Å; I277-A280 PolarHBondContact O-N 3.03Å; I277-G281 PolarHBondContact O-N 3.24Å |
| 278 | A | 87.9 | Confident | 86.3 | Confident | 53 Ų | 53 | 58.1 Ų | 58.1 | 44% | 0.438 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -59.4 | -45.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | N274 V275 A280 G281 I282 | N274-A278 WeakPolarHBondContact O-CB 3.48Å; N274-A278 PolarHBondContact O-N 3.11Å; V275-A278 PolarHBondContact O-N 2.91Å; A278-A280 PolarHBondContact O-N 3.37Å; A278-G281 PolarHBondContact O-N 2.92Å; A278-I282 WeakPolarHBondContact O-CG1 3.43Å; A278-I282 PolarHBondContact O-N 3.42Å |
| 279 | M | 87.7 | Confident | 86.2 | Confident | 83 Ų | 83 | 58 Ų | 58 | 41% | 0.409 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.4 | -38.9 | 178.6 | -168.9 | 61.9 | 65.9 | 0 | 0 | 112.2 | I259 I263 V275 I277 G281 I282 A283 | I259-M279 HydrophobicContact CG2-CB 4.08Å; I259-M279 HydrophobicContact CG2-CG 4.09Å; I263-M279 HydrophobicContact CD1-CB 3.92Å; I263-M279 HydrophobicContact CD1-CG 3.92Å; I263-M279 HydrophobicContact CG1-CG 4.2Å; V275-M279 VanDerWaalsContact O-CB 3.28Å; V275-M279 WeakPolarHBondContact O-CB 3.25Å; V275-M279 PolarHBondContact O-N 3.37Å; I277-M279 VanDerWaalsContact C-N 3.35Å; I277-M279 PolarHBondContact O-N 3.05Å; M279-G281 VanDerWaalsContact C-N 3.33Å; M279-G281 PolarHBondContact O-N 3.49Å; M279-I282 PolarHBondContact O-N 3.39Å; M279-A283 VanDerWaalsContact O-CB 3.22Å; M279-A283 WeakPolarHBondContact O-CB 3.39Å; M279-A283 PolarHBondContact O-N 2.99Å |
| 280 | A | 86.9 | Confident | 86.3 | Confident | 16 Ų | 16 | 57 Ų | 57 | 13% | 0.132 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.8 | -40.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I259 V276 I277 A278 K284 | I259-A280 HydrophobicContact CG1-CB 4.21Å; V276-A280 VanDerWaalsContact O-CB 3.29Å; V276-A280 WeakPolarHBondContact O-CB 3.21Å; V276-A280 PolarHBondContact O-N 3.39Å; I277-A280 PolarHBondContact O-N 3.03Å; A278-A280 PolarHBondContact O-N 3.37Å; A280-K284 WeakPolarHBondContact O-CB 3.3Å; A280-K284 PolarHBondContact O-N 2.84Å |
| 281 | G | 85.3 | Confident | 86.6 | Confident | 37 Ų | 37 | 55.6 Ų | 55.6 | 38% | 0.381 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.5 | -49.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | I277 A278 M279 A283 K284 V285 | I277-G281 PolarHBondContact O-N 3.24Å; A278-G281 PolarHBondContact O-N 2.92Å; M279-G281 VanDerWaalsContact C-N 3.33Å; M279-G281 PolarHBondContact O-N 3.49Å; G281-A283 PolarHBondContact O-N 3.17Å; G281-K284 WeakPolarHBondContact O-CB 3.43Å; G281-K284 PolarHBondContact O-N 3.06Å; G281-V285 WeakPolarHBondContact O-CG2 3.46Å; G281-V285 PolarHBondContact O-N 3.46Å |
| 282 | I | 86.5 | Confident | 86.6 | Confident | 101 Ų | 101 | 60.5 Ų | 60.5 | 52% | 0.518 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.1 | -45.3 | 178.3 | -64.9 | 164.4 | 0 | 0 | 0 | 110.9 | A278 M279 K284 V285 F286 | A278-I282 WeakPolarHBondContact O-CG1 3.43Å; A278-I282 PolarHBondContact O-N 3.42Å; M279-I282 PolarHBondContact O-N 3.39Å; I282-K284 VanDerWaalsContact C-N 3.26Å; I282-K284 PolarHBondContact O-N 3.22Å; I282-V285 PolarHBondContact O-N 2.96Å; I282-F286 WeakPolarHBondContact O-CB 3.35Å; I282-F286 PolarHBondContact O-N 2.91Å |
| 283 | A | 88.3 | Confident | 86.5 | Confident | 26 Ų | 26 | 57.1 Ų | 57.1 | 22% | 0.215 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -61.1 | -36.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | F254 M279 G281 F286 V287 | F254-A283 HydrophobicContact CD2-CB 4.23Å; F254-A283 HydrophobicContact CE2-CB 4.09Å; M279-A283 VanDerWaalsContact O-CB 3.22Å; M279-A283 WeakPolarHBondContact O-CB 3.39Å; M279-A283 PolarHBondContact O-N 2.99Å; G281-A283 PolarHBondContact O-N 3.17Å; A283-F286 PolarHBondContact O-N 3.34Å; A283-V287 WeakPolarHBondContact O-CG2 3.4Å; A283-V287 PolarHBondContact O-N 2.84Å |
| 284 | K | 85.8 | Confident | 86.6 | Confident | 43 Ų | 43 | 52.9 Ų | 52.9 | 19% | 0.187 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.1 | -45.2 | 177.4 | -174.7 | 174.5 | 178.7 | 175.5 | 0 | 112.2 | Y249 S252 F254 A280 G281 I282 F286 G288 | Y249-K284 HydrophobicContact CE2-CD 4.49Å; Y249-K284 HydrophobicContact CE2-CG 4.35Å; Y249-K284 WeakPolarHBondContact O-CE 3.49Å; Y249-K284 PolarHBondContact O-NZ 2.77Å; S252-K284 WeakPolarHBondContact O-CE 3.45Å; S252-K284 PolarHBondContact O-NZ 3.44Å; S252-K284 WeakPolarHBondContact OG-CE 3.5Å; F254-K284 HydrophobicContact CD2-CB 4.33Å; F254-K284 HydrophobicContact CE2-CB 4.15Å; A280-K284 WeakPolarHBondContact O-CB 3.3Å; A280-K284 PolarHBondContact O-N 2.84Å; G281-K284 WeakPolarHBondContact O-CB 3.43Å; G281-K284 PolarHBondContact O-N 3.06Å; I282-K284 VanDerWaalsContact C-N 3.26Å; I282-K284 PolarHBondContact O-N 3.22Å; K284-F286 VanDerWaalsContact C-N 3.34Å; K284-G288 PolarHBondContact O-N 3.1Å; K284-G288 VanDerWaalsContact O-N 3.1Å |
| 285 | V | 84.4 | Confident | 86.6 | Confident | 76 Ų | 76 | 51.3 Ų | 51.3 | 46% | 0.461 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.1 | -45.7 | 175.1 | 177.2 | 0 | 0 | 0 | 0 | 110.2 | G281 I282 V287 G288 E289 | G281-V285 WeakPolarHBondContact O-CG2 3.46Å; G281-V285 PolarHBondContact O-N 3.46Å; I282-V285 PolarHBondContact O-N 2.96Å; V285-V287 PolarHBondContact O-N 3.19Å; V285-G288 WeakPolarHBondContact O-CA 3.46Å; V285-G288 PolarHBondContact O-N 3.41Å; V285-G288 VanDerWaalsContact O-N 3.11Å; V285-E289 HydrophobicContact CG1-CG 4.46Å; V285-E289 PolarHBondContact O-N 3.42Å |
| 286 | F | 86.1 | Confident | 86.6 | Confident | 60 Ų | 60 | 52.1 Ų | 52.1 | 26% | 0.263 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.4 | -44.4 | 179.9 | 178.2 | -108.4 | 0 | 0 | 0 | 113.4 | I282 A283 K284 G288 E289 L290 Y317 V326 | I282-F286 WeakPolarHBondContact O-CB 3.35Å; I282-F286 PolarHBondContact O-N 2.91Å; A283-F286 PolarHBondContact O-N 3.34Å; K284-F286 VanDerWaalsContact C-N 3.34Å; F286-G288 VanDerWaalsContact C-N 3.29Å; F286-G288 PolarHBondContact O-N 3.11Å; F286-E289 PolarHBondContact O-N 2.94Å; F286-L290 HydrophobicContact CE1-CD2 4.43Å; F286-L290 VanDerWaalsContact O-CB 3.31Å; F286-L290 WeakPolarHBondContact O-CB 3.41Å; F286-L290 PolarHBondContact O-N 2.9Å; F286-Y317 HydrophobicContact CZ-CE2 4.48Å; F286-V326 HydrophobicContact CE2-CB 4.35Å; F286-V326 HydrophobicContact CE2-CG1 3.77Å; F286-V326 HydrophobicContact CE2-CG2 4.1Å; F286-V326 HydrophobicContact CZ-CG1 4.01Å |
| 287 | V | 87.5 | Confident | 86.5 | Confident | 62 Ų | 62 | 52.1 Ų | 52.1 | 38% | 0.376 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -65.7 | -35.9 | 176.7 | 171.8 | 0 | 0 | 0 | 0 | 111 | F254 A283 V285 L290 V291 | F254-V287 HydrophobicContact CZ-CB 4.5Å; F254-V287 HydrophobicContact CZ-CG2 4.04Å; A283-V287 WeakPolarHBondContact O-CG2 3.4Å; A283-V287 PolarHBondContact O-N 2.84Å; V285-V287 PolarHBondContact O-N 3.19Å; V287-L290 PolarHBondContact O-N 3.34Å; V287-V291 HydrophobicContact CG1-CG2 4.28Å; V287-V291 WeakPolarHBondContact O-CB 3.42Å; V287-V291 VanDerWaalsContact O-CG2 3.22Å; V287-V291 WeakPolarHBondContact O-CG2 3.31Å; V287-V291 PolarHBondContact O-N 2.96Å |
| 288 | G | 85 | Confident | 86.5 | Confident | 26 Ų | 26 | 51.3 Ų | 51.3 | 27% | 0.268 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -57.5 | -56.2 | 172 | 0 | 0 | 0 | 0 | 0 | 112 | K284 V285 F286 L290 V291 E292 | K284-G288 PolarHBondContact O-N 3.1Å; K284-G288 VanDerWaalsContact O-N 3.1Å; V285-G288 WeakPolarHBondContact O-CA 3.46Å; V285-G288 PolarHBondContact O-N 3.41Å; V285-G288 VanDerWaalsContact O-N 3.11Å; F286-G288 VanDerWaalsContact C-N 3.29Å; F286-G288 PolarHBondContact O-N 3.11Å; G288-L290 VanDerWaalsContact C-N 3.3Å; G288-L290 PolarHBondContact O-N 3.47Å; G288-V291 PolarHBondContact O-N 3.49Å; G288-E292 WeakPolarHBondContact O-CG 3.45Å; G288-E292 PolarHBondContact O-N 2.98Å |
| 289 | E | 84.1 | Confident | 86.4 | Confident | 66 Ų | 66 | 52.4 Ų | 52.4 | 31% | 0.308 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.8 | -39.3 | 179.2 | -66.4 | -176.2 | 146.6 | 0 | 0 | 112.6 | V285 F286 E292 E293 | V285-E289 HydrophobicContact CG1-CG 4.46Å; V285-E289 PolarHBondContact O-N 3.42Å; F286-E289 PolarHBondContact O-N 2.94Å; E289-E292 PolarHBondContact O-N 3.03Å; E289-E293 PolarHBondContact O-N 3.48Å |
| 290 | L | 87.3 | Confident | 86.4 | Confident | 27 Ų | 27 | 53.5 Ų | 53.5 | 14% | 0.141 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64.8 | -42.3 | 177.7 | -178.9 | 64.1 | 0 | 0 | 0 | 112.1 | F286 V287 G288 A294 I313 A316 L320 | F286-L290 HydrophobicContact CE1-CD2 4.43Å; F286-L290 VanDerWaalsContact O-CB 3.31Å; F286-L290 WeakPolarHBondContact O-CB 3.41Å; F286-L290 PolarHBondContact O-N 2.9Å; V287-L290 PolarHBondContact O-N 3.34Å; G288-L290 VanDerWaalsContact C-N 3.3Å; G288-L290 PolarHBondContact O-N 3.47Å; L290-A294 VanDerWaalsContact O-CB 3.25Å; L290-A294 WeakPolarHBondContact O-CB 3.22Å; L290-A294 PolarHBondContact O-N 3.24Å; L290-A294 VanDerWaalsContact O-N 3.08Å; L290-I313 HydrophobicContact CD1-CG2 4.39Å; L290-I313 HydrophobicContact CD2-CG2 4.08Å; L290-I313 HydrophobicContact CG-CG2 4.32Å; L290-A316 HydrophobicContact CD1-CB 3.88Å; L290-L320 HydrophobicContact CB-CD1 4.27Å; L290-L320 HydrophobicContact CD1-CD1 3.78Å |
| 291 | V | 88 | Confident | 86.5 | Confident | 63 Ų | 63 | 58.2 Ų | 58.2 | 38% | 0.382 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -70.1 | -40.6 | 178.3 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | V287 G288 A294 L295 | V287-V291 HydrophobicContact CG1-CG2 4.28Å; V287-V291 WeakPolarHBondContact O-CB 3.42Å; V287-V291 VanDerWaalsContact O-CG2 3.22Å; V287-V291 WeakPolarHBondContact O-CG2 3.31Å; V287-V291 PolarHBondContact O-N 2.96Å; G288-V291 PolarHBondContact O-N 3.49Å; V291-A294 PolarHBondContact O-N 3.08Å; V291-L295 HydrophobicContact CG1-CD1 4.1Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.31Å; V291-L295 PolarHBondContact O-N 2.93Å |
| 292 | E | 85.1 | Confident | 86.2 | Confident | 127 Ų | 127 | 65.6 Ų | 65.6 | 59% | 0.593 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -59.2 | -51.4 | 175.8 | -75.4 | 177.3 | -176.4 | 0 | 0 | 111.8 | G288 E289 A294 L295 D296 | G288-E292 WeakPolarHBondContact O-CG 3.45Å; G288-E292 PolarHBondContact O-N 2.98Å; E289-E292 PolarHBondContact O-N 3.03Å; E292-A294 VanDerWaalsContact C-N 3.25Å; E292-A294 PolarHBondContact O-N 3.07Å; E292-L295 WeakPolarHBondContact O-CB 3.25Å; E292-L295 PolarHBondContact O-N 3.22Å; E292-L295 VanDerWaalsContact O-N 3.11Å; E292-D296 PolarHBondContact O-N 2.95Å |
| 293 | E | 85.7 | Confident | 85.9 | Confident | 20 Ų | 20 | 62.9 Ų | 62.9 | 9% | 0.093 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -64.2 | -32 | 177.1 | -73.4 | -84.9 | -179.8 | 0 | 0 | 112.3 | E289 D296 I297 A316 L320 K323 | E289-E293 PolarHBondContact O-N 3.48Å; E293-D296 PolarHBondContact O-N 3.05Å; E293-I297 WeakPolarHBondContact O-CD1 3.37Å; E293-I297 VanDerWaalsContact O-CG1 3.27Å; E293-I297 WeakPolarHBondContact O-CG1 3.42Å; E293-I297 PolarHBondContact O-N 3.05Å; E293-A316 HydrophobicContact CB-CB 4.07Å; E293-L320 HydrophobicContact CB-CD1 4.47Å; E293-L320 HydrophobicContact CB-CG 4.48Å; E293-L320 HydrophobicContact CG-CD1 4.38Å; E293-L320 HydrophobicContact CG-CD2 3.92Å; E293-L320 HydrophobicContact CG-CG 4.07Å; E293-K323 IonicContact OE1-NZ 2.78Å; E293-K323 PolarHBondContact OE1-NZ 2.67Å; E293-K323 IonicContact OE2-NZ 3.19Å; E293-K323 PolarHBondContact OE2-NZ 2.78Å |
| 294 | A | 88.3 | Confident | 85.1 | Confident | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -70 | -34.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | L290 V291 E292 R298 L308 H312 I313 A316 | L290-A294 VanDerWaalsContact O-CB 3.25Å; L290-A294 WeakPolarHBondContact O-CB 3.22Å; L290-A294 PolarHBondContact O-N 3.24Å; L290-A294 VanDerWaalsContact O-N 3.08Å; V291-A294 PolarHBondContact O-N 3.08Å; E292-A294 VanDerWaalsContact C-N 3.25Å; E292-A294 PolarHBondContact O-N 3.07Å; A294-R298 WeakPolarHBondContact O-CB 3.47Å; A294-R298 PolarHBondContact O-N 2.9Å; A294-L308 HydrophobicContact CB-CD1 3.76Å; A294-L308 HydrophobicContact CB-CD2 4.07Å; A294-L308 HydrophobicContact CB-CG 4.38Å; A294-H312 HydrophobicContact CB-CB 4.36Å; A294-I313 HydrophobicContact CB-CG1 4.35Å; A294-A316 HydrophobicContact CB-CB 3.77Å |
| 295 | L | 86.5 | Confident | 84.4 | Confident | 61 Ų | 61 | 72.6 Ų | 72.6 | 32% | 0.319 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -67.8 | -43.2 | 171.6 | -70.7 | 169.4 | 0 | 0 | 0 | 111.1 | V291 E292 I297 R298 D299 L308 | V291-L295 HydrophobicContact CG1-CD1 4.1Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.31Å; V291-L295 PolarHBondContact O-N 2.93Å; E292-L295 WeakPolarHBondContact O-CB 3.25Å; E292-L295 PolarHBondContact O-N 3.22Å; E292-L295 VanDerWaalsContact O-N 3.11Å; L295-I297 VanDerWaalsContact C-N 3.31Å; L295-I297 PolarHBondContact O-N 2.93Å; L295-R298 WeakPolarHBondContact O-CB 3.43Å; L295-R298 PolarHBondContact O-N 3.37Å; L295-R298 VanDerWaalsContact O-N 3.14Å; L295-D299 VanDerWaalsContact O-CG 3.29Å; L295-D299 PolarHBondContact O-N 3.06Å; L295-L308 HydrophobicContact CD2-CD1 4.47Å |
| 296 | D | 86.9 | Confident | 84.1 | Confident | 82 Ų | 82 | 72.5 Ų | 72.5 | 44% | 0.439 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60.3 | -40.4 | 175.1 | -71.9 | -15.8 | 0 | 0 | 0 | 111.8 | E292 E293 D299 N300 | E292-D296 PolarHBondContact O-N 2.95Å; E293-D296 PolarHBondContact O-N 3.05Å; D296-D299 PolarHBondContact O-N 2.89Å; D296-N300 VanDerWaalsContact O-CB 3.3Å; D296-N300 WeakPolarHBondContact O-CB 3.37Å; D296-N300 PolarHBondContact O-N 3.37Å; D296-N300 PolarHBondContact O-ND2 3.14Å |
| 297 | I | 87.5 | Confident | 84.1 | Confident | 0 Ų | 0 | 74.5 Ų | 74.5 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 175.3 | -71.7 | 159.5 | 0 | 0 | 0 | 111.1 | E293 L295 D299 N300 W301 E315 A316 | E293-I297 WeakPolarHBondContact O-CD1 3.37Å; E293-I297 VanDerWaalsContact O-CG1 3.27Å; E293-I297 WeakPolarHBondContact O-CG1 3.42Å; E293-I297 PolarHBondContact O-N 3.05Å; L295-I297 VanDerWaalsContact C-N 3.31Å; L295-I297 PolarHBondContact O-N 2.93Å; I297-D299 VanDerWaalsContact C-N 3.31Å; I297-D299 PolarHBondContact O-N 3.47Å; I297-N300 PolarHBondContact O-N 3.49Å; I297-W301 HydrophobicContact CG2-CD2 4.02Å; I297-W301 HydrophobicContact CG2-CE3 4.38Å; I297-W301 HydrophobicContact CG2-CG 4.46Å; I297-W301 HydrophobicContact CG2-CH2 4.48Å; I297-W301 HydrophobicContact CG2-CZ2 4.13Å; I297-W301 WeakPolarHBondContact O-CB 3.47Å; I297-W301 PolarHBondContact O-N 3.35Å; I297-E315 HydrophobicContact CD1-CB 3.98Å; I297-E315 HydrophobicContact CD1-CG 3.84Å; I297-E315 HydrophobicContact CG1-CG 4.46Å; I297-E315 HydrophobicContact CG2-CB 4.49Å; I297-E315 HydrophobicContact CG2-CG 4.36Å; I297-A316 HydrophobicContact CD1-CB 3.76Å |
| 298 | R | 85.4 | Confident | 83.9 | Confident | 48 Ų | 48 | 74.4 Ų | 74.4 | 18% | 0.181 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -59.6 | -44.8 | 177.7 | 179.8 | -160 | 67.9 | 173.4 | -0.3 | 110.9 | A294 L295 W301 K302 E303 S304 E306 | A294-R298 WeakPolarHBondContact O-CB 3.47Å; A294-R298 PolarHBondContact O-N 2.9Å; L295-R298 WeakPolarHBondContact O-CB 3.43Å; L295-R298 PolarHBondContact O-N 3.37Å; L295-R298 VanDerWaalsContact O-N 3.14Å; R298-W301 PolarHBondContact O-N 3.11Å; R298-K302 PolarHBondContact O-N 3.29Å; R298-E303 WeakPolarHBondContact CD-O 3.39Å; R298-E303 HydrophobicContact CG-CB 4.06Å; R298-E303 VanDerWaalsContact CG-O 3.25Å; R298-E303 WeakPolarHBondContact CG-O 3.25Å; R298-E303 PolarHBondContact O-N 2.98Å; R298-S304 PolarHBondContact NH1-O 2.79Å; R298-E306 WeakPolarHBondContact CD-O 3.5Å |
| 299 | D | 86.5 | Confident | 84 | Confident | 77 Ų | 77 | 76.4 Ų | 76.4 | 41% | 0.412 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -69 | -39.8 | -178.8 | -67.3 | -3.5 | 0 | 0 | 0 | 110.8 | L295 D296 I297 W301 K302 | L295-D299 VanDerWaalsContact O-CG 3.29Å; L295-D299 PolarHBondContact O-N 3.06Å; D296-D299 PolarHBondContact O-N 2.89Å; I297-D299 VanDerWaalsContact C-N 3.31Å; I297-D299 PolarHBondContact O-N 3.47Å; D299-W301 VanDerWaalsContact C-N 3.29Å; D299-W301 PolarHBondContact O-N 3.31Å; D299-K302 PolarHBondContact O-N 3.46Å; D299-K302 VanDerWaalsContact O-N 3.08Å |
| 300 | N | 88.2 | Confident | 84.3 | Confident | 106 Ų | 106 | 77.5 Ų | 77.5 | 57% | 0.567 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -61.3 | -34.5 | 171.9 | -77.3 | -46.1 | 0 | 0 | 0 | 113.3 | D296 I297 K302 | D296-N300 VanDerWaalsContact O-CB 3.3Å; D296-N300 WeakPolarHBondContact O-CB 3.37Å; D296-N300 PolarHBondContact O-N 3.37Å; D296-N300 PolarHBondContact O-ND2 3.14Å; I297-N300 PolarHBondContact O-N 3.49Å; N300-K302 PolarHBondContact O-N 3.47Å |
| 301 | W | 87.3 | Confident | 84.4 | Confident | 114 Ų | 114 | 79.5 Ų | 79.5 | 43% | 0.432 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.8 | 5.9 | 177.6 | -70 | 4.4 | 0 | 0 | 0 | 113.2 | I297 R298 D299 E303 K311 H312 E315 | I297-W301 HydrophobicContact CG2-CD2 4.02Å; I297-W301 HydrophobicContact CG2-CE3 4.38Å; I297-W301 HydrophobicContact CG2-CG 4.46Å; I297-W301 HydrophobicContact CG2-CH2 4.48Å; I297-W301 HydrophobicContact CG2-CZ2 4.13Å; I297-W301 WeakPolarHBondContact O-CB 3.47Å; I297-W301 PolarHBondContact O-N 3.35Å; R298-W301 PolarHBondContact O-N 3.11Å; D299-W301 VanDerWaalsContact C-N 3.29Å; D299-W301 PolarHBondContact O-N 3.31Å; W301-E303 HydrophobicContact CB-CG 4.44Å; W301-E303 PolarHBondContact O-N 2.93Å; W301-K311 HydrophobicContact CZ3-CD 4.13Å; W301-K311 HydrophobicContact CZ3-CG 4.24Å; W301-H312 AromaticContact CE3-CD2 3.85Å; W301-E315 HydrophobicContact CZ2-CG 4.34Å |
| 302 | K | 79.9 | Confident | 84.5 | Confident | 193 Ų | 193 | 76.5 Ų | 76.5 | 84% | 0.839 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.9 | 23.9 | -178.4 | -54.8 | -179.6 | -179.9 | 179.8 | 0 | 113.5 | R298 D299 N300 S304 | R298-K302 PolarHBondContact O-N 3.29Å; D299-K302 PolarHBondContact O-N 3.46Å; D299-K302 VanDerWaalsContact O-N 3.08Å; N300-K302 PolarHBondContact O-N 3.47Å; K302-S304 VanDerWaalsContact C-N 3.31Å |
| 303 | E | 79.6 | Confident | 84.7 | Confident | 44 Ų | 44 | 73.7 Ų | 73.7 | 21% | 0.206 | 37% | 0.367 | C | S | . | . | trans | -97.3 | 28.1 | 176.5 | -66.2 | -177.7 | 169.3 | 0 | 0 | 111.2 | R298 W301 K305 E306 K311 H312 | R298-E303 WeakPolarHBondContact CD-O 3.39Å; R298-E303 HydrophobicContact CG-CB 4.06Å; R298-E303 VanDerWaalsContact CG-O 3.25Å; R298-E303 WeakPolarHBondContact CG-O 3.25Å; R298-E303 PolarHBondContact O-N 2.98Å; W301-E303 HydrophobicContact CB-CG 4.44Å; W301-E303 PolarHBondContact O-N 2.93Å; E303-K305 PolarHBondContact O-N 3.44Å; E303-E306 HydrophobicContact CB-CB 4.49Å; E303-E306 PolarHBondContact O-N 2.86Å; E303-K311 IonicContact OE1-NZ 3.9Å; E303-K311 PolarHBondContact OE1-NZ 3.01Å; E303-K311 WeakPolarHBondContact OE2-CE 3.07Å; E303-K311 IonicContact OE2-NZ 3.83Å; E303-K311 PolarHBondContact OE2-NZ 3.37Å; E303-H312 IonicContact OE2-CD2 3.09Å; E303-H312 IonicContact OE2-CE1 3.53Å; E303-H312 PolarHBondContact OE2-CE1 3.09Å; E303-H312 VanDerWaalsContact OE2-CE1 3.3Å; E303-H312 IonicContact OE2-NE2 3.95Å; E303-H312 PolarHBondContact OE2-NE2 2.92Å | ||
| 304 | S | 71.1 | Confident | 84.9 | Confident | 67 Ų | 67 | 81.2 Ų | 81.2 | 47% | 0.469 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -25.1 | -169 | 56 | 0 | 0 | 0 | 0 | 114.9 | R298 K302 | R298-S304 PolarHBondContact NH1-O 2.79Å; K302-S304 VanDerWaalsContact C-N 3.31Å |
| 305 | K | 72.8 | Confident | 84.8 | Confident | 206 Ų | 206 | 83 Ų | 83 | 90% | 0.896 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.7 | -13.8 | 176.7 | -76.3 | -174.9 | 176.7 | -179.4 | 0 | 114.4 | E303 | E303-K305 PolarHBondContact O-N 3.44Š|
| 306 | E | 78.2 | Confident | 84.8 | Confident | 73 Ų | 73 | 80 Ų | 80 | 34% | 0.341 | 39% | 0.387 | S | S | . | . | S | Bend | trans | -86.2 | 149.5 | -178 | -63.5 | -168.2 | 127.7 | 0 | 0 | 111.5 | R298 E303 K309 | R298-E306 WeakPolarHBondContact CD-O 3.5Å; E303-E306 HydrophobicContact CB-CB 4.49Å; E303-E306 PolarHBondContact O-N 2.86Å; E306-K309 IonicContact OE1-NZ 2.84Å; E306-K309 PolarHBondContact OE1-NZ 2.83Å; E306-K309 WeakPolarHBondContact OE2-CE 3.35Å; E306-K309 IonicContact OE2-NZ 2.63Å; E306-K309 PolarHBondContact OE2-NZ 3.25Å |
| 307 | P | 84.3 | Confident | 84.8 | Confident | 103 Ų | 103 | 81.6 Ų | 81.6 | 67% | 0.669 | 39% | 0.387 | S | S | * | . | trans | -62.7 | 156.1 | 172.2 | 28.2 | -35.2 | 0 | 0 | 0 | 110.6 | K309 | P307-K309 PolarHBondContact O-N 3.47Š| ||
| 308 | L | 84.3 | Confident | 84.7 | Confident | 59 Ų | 59 | 89 Ų | 89 | 31% | 0.309 | 42% | 0.416 | S | S | . | . | trans | -60.5 | 113.7 | 179.6 | -162.2 | 70.3 | 0 | 0 | 0 | 110.3 | A294 L295 H312 I313 | A294-L308 HydrophobicContact CB-CD1 3.76Å; A294-L308 HydrophobicContact CB-CD2 4.07Å; A294-L308 HydrophobicContact CB-CG 4.38Å; L295-L308 HydrophobicContact CD2-CD1 4.47Å; L308-H312 HydrophobicContact CD1-CB 3.88Å; L308-H312 HydrophobicContact CG-CB 4.48Å; L308-I313 HydrophobicContact CD2-CD1 3.94Å; L308-I313 HydrophobicContact CD2-CG1 3.77Å; L308-I313 HydrophobicContact CG-CD1 4.43Å; L308-I313 HydrophobicContact CG-CG1 4.12Å | ||
| 309 | K | 88 | Confident | 84.7 | Confident | 68 Ų | 68 | 90.2 Ų | 90.2 | 30% | 0.296 | 42% | 0.42 | S | S | . | . | trans | -89.4 | 150.8 | -179.5 | -72.2 | 170.6 | 178.9 | 171.2 | 0 | 109.6 | E306 P307 K311 H312 | E306-K309 IonicContact OE1-NZ 2.84Å; E306-K309 PolarHBondContact OE1-NZ 2.83Å; E306-K309 WeakPolarHBondContact OE2-CE 3.35Å; E306-K309 IonicContact OE2-NZ 2.63Å; E306-K309 PolarHBondContact OE2-NZ 3.25Å; P307-K309 PolarHBondContact O-N 3.47Å; K309-K311 HydrophobicContact CB-CD 4.34Å; K309-K311 HydrophobicContact CB-CG 3.81Å; K309-K311 HydrophobicContact CD-CD 4.41Å; K309-K311 PolarHBondContact O-N 3.14Å; K309-H312 PolarHBondContact N-ND1 2.85Å; K309-H312 WeakPolarHBondContact O-CB 3.44Å; K309-H312 PolarHBondContact O-N 3.24Å | ||
| 310 | P | 89.3 | Confident | 84.4 | Confident | 90 Ų | 90 | 86.6 Ų | 86.6 | 58% | 0.584 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -56.4 | -19.7 | 175.9 | -27.4 | 34.9 | 0 | 0 | 0 | 114.8 | R314 | P310-R314 WeakPolarHBondContact O-CG 3.3Å; P310-R314 PolarHBondContact O-N 2.62Å; P310-R314 PolarHBondContact O-NE 3.12Å |
| 311 | K | 90.1 | Very high | 83.8 | Confident | 68 Ų | 68 | 85 Ų | 85 | 30% | 0.296 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -66.1 | -39.1 | 172.2 | 67 | -176.2 | -173.1 | 172.8 | 0 | 112.5 | W301 E303 K309 E315 | W301-K311 HydrophobicContact CZ3-CD 4.13Å; W301-K311 HydrophobicContact CZ3-CG 4.24Å; E303-K311 IonicContact OE1-NZ 3.9Å; E303-K311 PolarHBondContact OE1-NZ 3.01Å; E303-K311 WeakPolarHBondContact OE2-CE 3.07Å; E303-K311 IonicContact OE2-NZ 3.83Å; E303-K311 PolarHBondContact OE2-NZ 3.37Å; K309-K311 HydrophobicContact CB-CD 4.34Å; K309-K311 HydrophobicContact CB-CG 3.81Å; K309-K311 HydrophobicContact CD-CD 4.41Å; K309-K311 PolarHBondContact O-N 3.14Å; K311-E315 PolarHBondContact O-N 3.44Å; K311-E315 VanDerWaalsContact O-N 3.13Å |
| 312 | H | 89.7 | Confident | 83.2 | Confident | 0 Ų | 0 | 84.6 Ų | 84.6 | 0% | 0 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -68.3 | -44 | -179.6 | -52.8 | 136.7 | 0 | 0 | 0 | 110.8 | A294 W301 E303 L308 K309 R314 E315 A316 | A294-H312 HydrophobicContact CB-CB 4.36Å; W301-H312 AromaticContact CE3-CD2 3.85Å; E303-H312 IonicContact OE2-CD2 3.09Å; E303-H312 IonicContact OE2-CE1 3.53Å; E303-H312 PolarHBondContact OE2-CE1 3.09Å; E303-H312 VanDerWaalsContact OE2-CE1 3.3Å; E303-H312 IonicContact OE2-NE2 3.95Å; E303-H312 PolarHBondContact OE2-NE2 2.92Å; L308-H312 HydrophobicContact CD1-CB 3.88Å; L308-H312 HydrophobicContact CG-CB 4.48Å; K309-H312 PolarHBondContact N-ND1 2.85Å; K309-H312 WeakPolarHBondContact O-CB 3.44Å; K309-H312 PolarHBondContact O-N 3.24Å; H312-R314 PolarHBondContact O-N 2.84Å; H312-E315 PolarHBondContact O-N 3.34Å; H312-A316 WeakPolarHBondContact O-CB 3.27Å; H312-A316 PolarHBondContact O-N 3.15Å |
| 313 | I | 89.1 | Confident | 82.8 | Confident | 69 Ų | 69 | 80.3 Ų | 80.3 | 35% | 0.354 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64.2 | -41.6 | 178.6 | -58.6 | 174.8 | 0 | 0 | 0 | 111.3 | L290 A294 L308 E315 A316 Y317 | L290-I313 HydrophobicContact CD1-CG2 4.39Å; L290-I313 HydrophobicContact CD2-CG2 4.08Å; L290-I313 HydrophobicContact CG-CG2 4.32Å; A294-I313 HydrophobicContact CB-CG1 4.35Å; L308-I313 HydrophobicContact CD2-CD1 3.94Å; L308-I313 HydrophobicContact CD2-CG1 3.77Å; L308-I313 HydrophobicContact CG-CD1 4.43Å; L308-I313 HydrophobicContact CG-CG1 4.12Å; I313-E315 VanDerWaalsContact C-N 3.34Å; I313-E315 PolarHBondContact O-N 3.31Å; I313-A316 WeakPolarHBondContact O-CB 3.35Å; I313-A316 PolarHBondContact O-N 3.26Å; I313-Y317 WeakPolarHBondContact O-CB 3.49Å; I313-Y317 PolarHBondContact O-N 3.22Å |
| 314 | R | 89.4 | Confident | 81.8 | Confident | 178 Ų | 178 | 86.8 Ų | 86.8 | 67% | 0.672 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -63.1 | -41.6 | 177.2 | -78 | -176.6 | -71 | -169.1 | 2.3 | 112 | P310 H312 R318 | P310-R314 WeakPolarHBondContact O-CG 3.3Å; P310-R314 PolarHBondContact O-N 2.62Å; P310-R314 PolarHBondContact O-NE 3.12Å; H312-R314 PolarHBondContact O-N 2.84Å; R314-R318 PolarHBondContact O-N 3.3Å |
| 315 | E | 86.2 | Confident | 81.3 | Confident | 36 Ų | 36 | 88.8 Ų | 88.8 | 17% | 0.168 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -70.6 | -36.9 | 175.9 | -174.8 | 59.5 | -163.9 | 0 | 0 | 111.7 | I297 W301 K311 H312 I313 Y317 R318 R319 | I297-E315 HydrophobicContact CD1-CB 3.98Å; I297-E315 HydrophobicContact CD1-CG 3.84Å; I297-E315 HydrophobicContact CG1-CG 4.46Å; I297-E315 HydrophobicContact CG2-CB 4.49Å; I297-E315 HydrophobicContact CG2-CG 4.36Å; W301-E315 HydrophobicContact CZ2-CG 4.34Å; K311-E315 PolarHBondContact O-N 3.44Å; K311-E315 VanDerWaalsContact O-N 3.13Å; H312-E315 PolarHBondContact O-N 3.34Å; I313-E315 VanDerWaalsContact C-N 3.34Å; I313-E315 PolarHBondContact O-N 3.31Å; E315-Y317 VanDerWaalsContact C-N 3.35Å; E315-Y317 PolarHBondContact O-N 3.48Å; E315-R318 WeakPolarHBondContact O-CB 3.39Å; E315-R318 PolarHBondContact O-N 3.19Å; E315-R318 VanDerWaalsContact O-N 3.14Å; E315-R318 IonicContact OE1-CZ 3.6Å; E315-R318 IonicContact OE1-NE 2.86Å; E315-R318 PolarHBondContact OE1-NE 3.01Å; E315-R318 IonicContact OE1-NH2 3.63Å; E315-R318 PolarHBondContact OE1-NH2 2.89Å; E315-R318 IonicContact OE2-CZ 2.91Å; E315-R318 IonicContact OE2-NE 3.28Å; E315-R318 PolarHBondContact OE2-NE 2.7Å; E315-R318 IonicContact OE2-NH2 2.57Å; E315-R319 WeakPolarHBondContact O-CG 3.39Å; E315-R319 PolarHBondContact O-N 3.25Å; E315-R319 IonicContact OE1-NE 3.66Å |
| 316 | A | 87 | Confident | 80.6 | Confident | 0 Ų | 0 | 80 Ų | 80 | 0% | 0 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59.6 | -46.7 | 174 | 0 | 0 | 0 | 0 | 0 | 111 | L290 E293 A294 I297 H312 I313 R318 R319 L320 | L290-A316 HydrophobicContact CD1-CB 3.88Å; E293-A316 HydrophobicContact CB-CB 4.07Å; A294-A316 HydrophobicContact CB-CB 3.77Å; I297-A316 HydrophobicContact CD1-CB 3.76Å; H312-A316 WeakPolarHBondContact O-CB 3.27Å; H312-A316 PolarHBondContact O-N 3.15Å; I313-A316 WeakPolarHBondContact O-CB 3.35Å; I313-A316 PolarHBondContact O-N 3.26Å; A316-R318 VanDerWaalsContact C-N 3.31Å; A316-R318 PolarHBondContact O-N 3.22Å; A316-R319 PolarHBondContact O-N 2.94Å; A316-L320 WeakPolarHBondContact O-CB 3.37Å; A316-L320 WeakPolarHBondContact O-CG 3.46Å; A316-L320 PolarHBondContact O-N 2.82Å |
| 317 | Y | 86.8 | Confident | 79.5 | Confident | 114 Ų | 114 | 84.9 Ų | 84.9 | 45% | 0.447 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.2 | -38.6 | 174.6 | -175.3 | -104.4 | 0 | 0 | 0 | 112.3 | F286 I313 E315 N321 V326 | F286-Y317 HydrophobicContact CZ-CE2 4.48Å; I313-Y317 WeakPolarHBondContact O-CB 3.49Å; I313-Y317 PolarHBondContact O-N 3.22Å; E315-Y317 VanDerWaalsContact C-N 3.35Å; E315-Y317 PolarHBondContact O-N 3.48Å; Y317-N321 WeakPolarHBondContact CD1-ND2 3.45Å; Y317-N321 WeakPolarHBondContact CE1-ND2 3.47Å; Y317-N321 WeakPolarHBondContact O-CB 3.34Å; Y317-N321 PolarHBondContact O-N 3.14Å; Y317-N321 PolarHBondContact O-ND2 3.42Å; Y317-V326 HydrophobicContact CE2-CG1 4.02Å |
| 318 | R | 85.9 | Confident | 78.1 | Confident | 157 Ų | 157 | 85 Ų | 85 | 59% | 0.592 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -63.2 | -47.8 | 174.7 | -166.3 | 179.5 | 79.1 | 117.6 | 5.4 | 111.4 | R314 E315 A316 N321 T322 | R314-R318 PolarHBondContact O-N 3.3Å; E315-R318 WeakPolarHBondContact O-CB 3.39Å; E315-R318 PolarHBondContact O-N 3.19Å; E315-R318 VanDerWaalsContact O-N 3.14Å; E315-R318 IonicContact OE1-CZ 3.6Å; E315-R318 IonicContact OE1-NE 2.86Å; E315-R318 PolarHBondContact OE1-NE 3.01Å; E315-R318 IonicContact OE1-NH2 3.63Å; E315-R318 PolarHBondContact OE1-NH2 2.89Å; E315-R318 IonicContact OE2-CZ 2.91Å; E315-R318 IonicContact OE2-NE 3.28Å; E315-R318 PolarHBondContact OE2-NE 2.7Å; E315-R318 IonicContact OE2-NH2 2.57Å; A316-R318 VanDerWaalsContact C-N 3.31Å; A316-R318 PolarHBondContact O-N 3.22Å; R318-N321 PolarHBondContact O-N 3.39Å; R318-T322 PolarHBondContact O-N 3.36Å; R318-T322 VanDerWaalsContact O-N 3.14Å; R318-T322 PolarHBondContact O-OG1 3.06Å |
| 319 | R | 84.3 | Confident | 76.1 | Confident | 73 Ų | 73 | 90.3 Ų | 90.3 | 28% | 0.275 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 177.8 | -71.6 | -169.2 | -174.6 | -175.9 | -3.6 | 112.2 | E315 A316 N321 T322 K323 | E315-R319 WeakPolarHBondContact O-CG 3.39Å; E315-R319 PolarHBondContact O-N 3.25Å; E315-R319 IonicContact OE1-NE 3.66Å; A316-R319 PolarHBondContact O-N 2.94Å; R319-N321 VanDerWaalsContact C-N 3.31Å; R319-N321 PolarHBondContact O-N 3.08Å; R319-T322 PolarHBondContact O-N 2.95Å; R319-T322 VanDerWaalsContact O-N 3.12Å; R319-K323 WeakPolarHBondContact O-CB 3.43Å; R319-K323 WeakPolarHBondContact O-CG 3.39Å; R319-K323 PolarHBondContact O-N 3.3Å |
| 320 | L | 81 | Confident | 74 | Confident | 1 Ų | 1 | 90.2 Ų | 90.2 | 1% | 0.005 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -63.1 | -37.7 | 177.9 | -77.3 | 168.4 | 0 | 0 | 0 | 111.8 | L290 E293 A316 T322 K323 W324 K325 V326 | L290-L320 HydrophobicContact CB-CD1 4.27Å; L290-L320 HydrophobicContact CD1-CD1 3.78Å; E293-L320 HydrophobicContact CB-CD1 4.47Å; E293-L320 HydrophobicContact CB-CG 4.48Å; E293-L320 HydrophobicContact CG-CD1 4.38Å; E293-L320 HydrophobicContact CG-CD2 3.92Å; E293-L320 HydrophobicContact CG-CG 4.07Å; A316-L320 WeakPolarHBondContact O-CB 3.37Å; A316-L320 WeakPolarHBondContact O-CG 3.46Å; A316-L320 PolarHBondContact O-N 2.82Å; L320-T322 VanDerWaalsContact C-N 3.32Å; L320-T322 PolarHBondContact O-N 3.37Å; L320-K323 PolarHBondContact O-N 3.31Å; L320-W324 PolarHBondContact O-N 3.13Å; L320-K325 HydrophobicContact CD2-CB 3.8Å; L320-K325 HydrophobicContact CD2-CD 4.1Å; L320-K325 PolarHBondContact O-N 3.04Å; L320-K325 VanDerWaalsContact O-N 3.15Å; L320-V326 HydrophobicContact CB-CG2 3.41Å; L320-V326 VanDerWaalsContact CB-CG2 3.41Å |
| 321 | N | 76.4 | Confident | 71.7 | Confident | 72 Ų | 72 | 90.7 Ų | 90.7 | 39% | 0.385 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.6 | -34.3 | 173.3 | -83.3 | -24 | 0 | 0 | 0 | 112.8 | Y317 R318 R319 V326 | Y317-N321 WeakPolarHBondContact CD1-ND2 3.45Å; Y317-N321 WeakPolarHBondContact CE1-ND2 3.47Å; Y317-N321 WeakPolarHBondContact O-CB 3.34Å; Y317-N321 PolarHBondContact O-N 3.14Å; Y317-N321 PolarHBondContact O-ND2 3.42Å; R318-N321 PolarHBondContact O-N 3.39Å; R319-N321 VanDerWaalsContact C-N 3.31Å; R319-N321 PolarHBondContact O-N 3.08Å; N321-V326 WeakPolarHBondContact OD1-CB 3.39Å; N321-V326 WeakPolarHBondContact OD1-CG2 3.04Å |
| 322 | T | 73.9 | Confident | 69.6 | Low | 105 Ų | 105 | 96.3 Ų | 96.3 | 64% | 0.644 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -76.4 | -34.8 | 175.1 | -53.5 | 0 | 0 | 0 | 0 | 112.1 | R318 R319 L320 W324 | R318-T322 PolarHBondContact O-N 3.36Å; R318-T322 VanDerWaalsContact O-N 3.14Å; R318-T322 PolarHBondContact O-OG1 3.06Å; R319-T322 PolarHBondContact O-N 2.95Å; R319-T322 VanDerWaalsContact O-N 3.12Å; L320-T322 VanDerWaalsContact C-N 3.32Å; L320-T322 PolarHBondContact O-N 3.37Å; T322-W324 VanDerWaalsContact O-CD1 3.25Å; T322-W324 PolarHBondContact O-N 2.86Å |
| 323 | K | 71.2 | Confident | 67.5 | Low | 104 Ų | 104 | 103.9 Ų | 103.9 | 45% | 0.452 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77 | 3.2 | 177.2 | -72.2 | 177.6 | 176.9 | 174.2 | 0 | 113.8 | E293 R319 L320 K325 | E293-K323 IonicContact OE1-NZ 2.78Å; E293-K323 PolarHBondContact OE1-NZ 2.67Å; E293-K323 IonicContact OE2-NZ 3.19Å; E293-K323 PolarHBondContact OE2-NZ 2.78Å; R319-K323 WeakPolarHBondContact O-CB 3.43Å; R319-K323 WeakPolarHBondContact O-CG 3.39Å; R319-K323 PolarHBondContact O-N 3.3Å; L320-K323 PolarHBondContact O-N 3.31Å; K323-K325 HydrophobicContact CB-CG 4.46Å; K323-K325 PolarHBondContact O-N 2.78Å |
| 324 | W | 58 | Low | 65.4 | Low | 180 Ų | 180 | 105.2 Ų | 105.2 | 68% | 0.682 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.6 | 20.1 | -178.7 | -57.2 | 83.2 | 0 | 0 | 0 | 115.3 | L320 T322 I334 | L320-W324 PolarHBondContact O-N 3.13Å; T322-W324 VanDerWaalsContact O-CD1 3.25Å; T322-W324 PolarHBondContact O-N 2.86Å; W324-I334 HydrophobicContact CH2-CG1 3.94Å; W324-I334 HydrophobicContact CZ3-CG1 4.01Å |
| 325 | K | 61 | Low | 63.2 | Low | 109 Ų | 109 | 101.3 Ų | 101.3 | 47% | 0.474 | 49% | 0.494 | S | S | . | . | trans | -91.1 | -7.7 | -177.9 | -72.6 | -170.2 | 175.1 | -171.5 | 0 | 114.4 | L320 K323 | L320-K325 HydrophobicContact CD2-CB 3.8Å; L320-K325 HydrophobicContact CD2-CD 4.1Å; L320-K325 PolarHBondContact O-N 3.04Å; L320-K325 VanDerWaalsContact O-N 3.15Å; K323-K325 HydrophobicContact CB-CG 4.46Å; K323-K325 PolarHBondContact O-N 2.78Å | ||
| 326 | V | 58.3 | Low | 61.2 | Low | 21 Ų | 21 | 110.3 Ų | 110.3 | 13% | 0.127 | 53% | 0.527 | C | S | . | . | S | Bend | trans | -97.8 | 117.6 | 178.3 | -167.7 | 0 | 0 | 0 | 0 | 109.7 | F286 Y317 L320 N321 | F286-V326 HydrophobicContact CE2-CB 4.35Å; F286-V326 HydrophobicContact CE2-CG1 3.77Å; F286-V326 HydrophobicContact CE2-CG2 4.1Å; F286-V326 HydrophobicContact CZ-CG1 4.01Å; Y317-V326 HydrophobicContact CE2-CG1 4.02Å; L320-V326 HydrophobicContact CB-CG2 3.41Å; L320-V326 VanDerWaalsContact CB-CG2 3.41Å; N321-V326 WeakPolarHBondContact OD1-CB 3.39Å; N321-V326 WeakPolarHBondContact OD1-CG2 3.04Å |
| 327 | F | 56 | Low | 59.3 | Low | 175 Ų | 175 | 114.7 Ų | 114.7 | 77% | 0.768 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -64.9 | 128.7 | 163.9 | -76.1 | -91.9 | 0 | 0 | 0 | 108.4 | ||
| 328 | P | 53.5 | Low | 57.1 | Low | 106 Ų | 106 | 118.8 Ų | 118.8 | 69% | 0.688 | 58% | 0.578 | S | S | * | * | cis | -116 | 151.3 | 35.6 | 36.7 | -26.6 | 0 | 0 | 0 | 115.2 | S330 | P328-S330 VanDerWaalsContact C-N 3.26Å; P328-S330 PolarHBondContact O-N 3.19Å | ||
| 329 | M | 44 | Very low | 54.8 | Low | 170 Ų | 170 | 118.6 Ų | 118.6 | 84% | 0.837 | 59% | 0.587 | S | S | * | * | trans | -58.8 | 84.5 | 162.5 | -80.1 | -172.6 | -86 | 0 | 0 | 110.3 | S331 | M329-S331 PolarHBondContact O-N 3.16Š| ||
| 330 | S | 42.1 | Very low | 52.6 | Low | 67 Ų | 67 | 127.6 Ų | 127.6 | 47% | 0.469 | 64% | 0.636 | S | S | . | * | trans | -74.2 | 100.2 | 164.7 | -169.5 | 0 | 0 | 0 | 0 | 108.1 | P328 K332 K333 | P328-S330 VanDerWaalsContact C-N 3.26Å; P328-S330 PolarHBondContact O-N 3.19Å; S330-K332 PolarHBondContact O-N 3.42Å; S330-K333 PolarHBondContact O-N 3.27Å; S330-K333 VanDerWaalsContact O-N 3.09Å | ||
| 331 | S | 42.5 | Very low | 51.2 | Low | 99 Ų | 99 | 134 Ų | 134 | 69% | 0.692 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -46.9 | -25.6 | 173.3 | 173.5 | 0 | 0 | 0 | 0 | 113 | M329 K333 | M329-S331 PolarHBondContact O-N 3.16Å; S331-K333 VanDerWaalsContact C-N 3.29Å; S331-K333 PolarHBondContact O-N 3.35Å |
| 332 | K | 46.3 | Very low | 49.9 | Very low | 186 Ų | 186 | 137.2 Ų | 137.2 | 81% | 0.809 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -71.1 | -12 | -178.4 | -66.1 | -175.1 | 178.7 | 179.7 | 0 | 115.3 | S330 | S330-K332 PolarHBondContact O-N 3.42Š|
| 333 | K | 45 | Very low | 48.6 | Very low | 160 Ų | 160 | 139 Ų | 139 | 70% | 0.696 | 69% | 0.685 | S | S | * | * | G | 310 helix | trans | -101.9 | -17.3 | 178.9 | -82.6 | -172.3 | 177.1 | -179.8 | 0 | 115.3 | S330 S331 S335 R336 | S330-K333 PolarHBondContact O-N 3.27Å; S330-K333 VanDerWaalsContact O-N 3.09Å; S331-K333 VanDerWaalsContact C-N 3.29Å; S331-K333 PolarHBondContact O-N 3.35Å; K333-S335 PolarHBondContact O-N 2.63Å; K333-R336 PolarHBondContact O-N 2.84Å |
| 334 | I | 44.6 | Very low | 47.2 | Very low | 96 Ų | 96 | 141.1 Ų | 141.1 | 49% | 0.492 | 70% | 0.698 | S | S | . | * | G | 310 helix | trans | -64.8 | -26.7 | 179.4 | -70.3 | 162.9 | 0 | 0 | 0 | 111.7 | W324 R336 | W324-I334 HydrophobicContact CH2-CG1 3.94Å; W324-I334 HydrophobicContact CZ3-CG1 4.01Å; I334-R336 VanDerWaalsContact C-N 3.34Å; I334-R336 PolarHBondContact O-N 2.86Å |
| 335 | S | 42.3 | Very low | 46.6 | Very low | 96 Ų | 96 | 138.6 Ų | 138.6 | 67% | 0.671 | 70% | 0.699 | S | S | * | * | G | 310 helix | trans | -77.6 | -8 | -176.7 | -175.5 | 0 | 0 | 0 | 0 | 115.4 | K333 | K333-S335 PolarHBondContact O-N 2.63Š|
| 336 | R | 45.9 | Very low | 45.6 | Very low | 226 Ų | 226 | 140.6 Ų | 140.6 | 85% | 0.853 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -109.3 | -7.1 | -170.7 | -73.5 | -167.5 | 176.1 | -168.5 | -1.3 | 115.9 | K333 I334 | K333-R336 PolarHBondContact O-N 2.84Å; I334-R336 VanDerWaalsContact C-N 3.34Å; I334-R336 PolarHBondContact O-N 2.86Å |
| 337 | S | 45.8 | Very low | 44.7 | Very low | 92 Ų | 92 | 149.1 Ų | 149.1 | 64% | 0.643 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -104.7 | 3.1 | -179.2 | 62 | 0 | 0 | 0 | 0 | 114.7 | ||
| 338 | F | 41.6 | Very low | 43.8 | Very low | 199 Ų | 199 | 147.2 Ų | 147.2 | 87% | 0.873 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -100.2 | 13.4 | 178.7 | -164.9 | -102.6 | 0 | 0 | 0 | 113.1 | ||
| 339 | L | 37.2 | Very low | 43 | Very low | 153 Ų | 153 | 150.6 Ų | 150.6 | 80% | 0.801 | 76% | 0.761 | S | S | * | * | trans | -132 | 24.6 | -169.7 | -113.1 | 159.7 | 0 | 0 | 0 | 114.7 | ||||
| 340 | M | 38.9 | Very low | 42.9 | Very low | 263 Ų | 263 | 148.8 Ų | 148.8 | 100% | 1.296 | 75% | 0.754 | S | S | * | * | trans | -134.1 | 0 | 165.1 | -96 | -173.5 | 168.5 | 0 | 0 | 110.8 |
Retrieved 340 of 340 residues in 1144.4 ms
(Link to these results)