| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.3 | Very low | 51.4 | Low | 247 Ų | 247 | 136 Ų | 136 | 100% | 1.217 | 81% | 0.813 | S | S | * | * | 0 | 131.5 | 0 | -86.8 | 176.8 | -171.6 | 0 | 0 | 108.3 | |||||
| 2 | A | 42.9 | Very low | 53.2 | Low | 96 Ų | 96 | 133.9 Ų | 133.9 | 79% | 0.793 | 81% | 0.805 | S | S | * | * | trans | 55.5 | 94.1 | 161.9 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 3 | M | 37.6 | Very low | 55.1 | Low | 195 Ų | 195 | 127.1 Ų | 127.1 | 96% | 0.961 | 78% | 0.779 | S | S | * | * | trans | -76.7 | 119.7 | 145 | -76.6 | -173.1 | 118 | 0 | 0 | 107.3 | E5 | M3-E5 PolarHBondContact O-N 2.66Š| ||
| 4 | M | 47.3 | Very low | 57 | Low | 186 Ų | 186 | 125.9 Ų | 125.9 | 92% | 0.916 | 76% | 0.761 | S | S | * | * | trans | -72.6 | 116 | 168.7 | -74.8 | 173.3 | 128.6 | 0 | 0 | 108.3 | A6 | M4-A6 PolarHBondContact O-N 3.2Š| ||
| 5 | E | 42 | Very low | 58.7 | Low | 190 Ų | 190 | 121.3 Ų | 121.3 | 89% | 0.888 | 73% | 0.733 | S | S | * | * | trans | -70.7 | 116.1 | 165.2 | -78.4 | -177.3 | 147.3 | 0 | 0 | 109 | M3 Q7 | M3-E5 PolarHBondContact O-N 2.66Å; E5-Q7 PolarHBondContact O-N 3.04Å | ||
| 6 | A | 46.5 | Very low | 60.4 | Low | 99 Ų | 99 | 118.7 Ų | 118.7 | 82% | 0.818 | 72% | 0.721 | S | S | * | * | trans | -76.1 | 108.6 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | M4 G8 | M4-A6 PolarHBondContact O-N 3.2Å; A6-G8 PolarHBondContact O-N 3.02Å; A6-G8 VanDerWaalsContact O-N 3.14Å | ||
| 7 | Q | 48.4 | Very low | 62.1 | Low | 195 Ų | 195 | 116.6 Ų | 116.6 | 91% | 0.911 | 71% | 0.708 | S | S | * | * | trans | -60.7 | 113.6 | 170.8 | -87.3 | 169.6 | -35.3 | 0 | 0 | 109.6 | E5 G9 | E5-Q7 PolarHBondContact O-N 3.04Å; Q7-G9 PolarHBondContact O-N 2.84Å | ||
| 8 | G | 54.3 | Low | 63.6 | Low | 78 Ų | 78 | 116.2 Ų | 116.2 | 80% | 0.804 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -61 | 125.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111 | A6 | A6-G8 PolarHBondContact O-N 3.02Å; A6-G8 VanDerWaalsContact O-N 3.14Å |
| 9 | G | 65.4 | Low | 65 | Low | 64 Ų | 64 | 115.2 Ų | 115.2 | 66% | 0.66 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 156.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q7 | Q7-G9 PolarHBondContact O-N 2.84Š|
| 10 | P | 66.1 | Low | 66.3 | Low | 91 Ų | 91 | 115 Ų | 115 | 59% | 0.591 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 140 | -177.9 | 22.8 | -31.1 | 0 | 0 | 0 | 111.3 | Q14 | P10-Q14 HydrophobicContact CB-CB 4.43Š|
| 11 | S | 76.3 | Confident | 67.7 | Low | 55 Ų | 55 | 113.8 Ų | 113.8 | 39% | 0.385 | 67% | 0.674 | S | S | . | * | P | Polyproline II helix | trans | -62.3 | 151.2 | 179.8 | 65.6 | 0 | 0 | 0 | 0 | 111.1 | G13 Q14 T15 | S11-G13 PolarHBondContact O-N 2.73Å; S11-Q14 WeakPolarHBondContact O-CB 3.44Å; S11-Q14 PolarHBondContact O-N 2.86Å; S11-Q14 WeakPolarHBondContact OG-CG 3.38Å; S11-Q14 PolarHBondContact OG-OE1 3.1Å; S11-T15 PolarHBondContact O-N 2.71Å; S11-T15 VanDerWaalsContact O-N 3.14Å; S11-T15 PolarHBondContact O-OG1 2.68Å |
| 12 | P | 73.6 | Confident | 70.4 | Confident | 111 Ų | 111 | 108.5 Ų | 108.5 | 72% | 0.721 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -54.4 | -33.1 | -178.5 | -24.1 | 32 | 0 | 0 | 0 | 113.7 | C16 | P12-C16 PolarHBondContact O-N 2.91Å; P12-C16 VanDerWaalsContact O-N 3.09Å |
| 13 | G | 77.8 | Confident | 72.7 | Confident | 45 Ų | 45 | 106.6 Ų | 106.6 | 46% | 0.464 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -68.7 | -40.1 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | S11 T15 C16 V17 | S11-G13 PolarHBondContact O-N 2.73Å; G13-T15 VanDerWaalsContact C-N 3.33Å; G13-C16 PolarHBondContact O-N 2.78Å; G13-V17 WeakPolarHBondContact O-CG2 3.48Å; G13-V17 PolarHBondContact O-N 3.41Å |
| 14 | Q | 80.8 | Confident | 75.5 | Confident | 111 Ų | 111 | 101.6 Ų | 101.6 | 52% | 0.519 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -64.5 | -39.9 | 174.8 | -75.4 | 169 | -43.4 | 0 | 0 | 111.3 | P10 S11 V17 L18 | P10-Q14 HydrophobicContact CB-CB 4.43Å; S11-Q14 WeakPolarHBondContact O-CB 3.44Å; S11-Q14 PolarHBondContact O-N 2.86Å; S11-Q14 WeakPolarHBondContact OG-CG 3.38Å; S11-Q14 PolarHBondContact OG-OE1 3.1Å; Q14-V17 PolarHBondContact O-N 2.85Å; Q14-L18 WeakPolarHBondContact O-CB 3.45Å; Q14-L18 VanDerWaalsContact O-CG 3.27Å; Q14-L18 WeakPolarHBondContact O-CG 3.44Å; Q14-L18 PolarHBondContact O-N 2.97Å |
| 15 | T | 82.5 | Confident | 77.8 | Confident | 57 Ų | 57 | 98.1 Ų | 98.1 | 35% | 0.35 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -63.9 | -41.7 | 176.1 | -50.8 | 0 | 0 | 0 | 0 | 111.8 | S11 G13 L18 I19 | S11-T15 PolarHBondContact O-N 2.71Å; S11-T15 VanDerWaalsContact O-N 3.14Å; S11-T15 PolarHBondContact O-OG1 2.68Å; G13-T15 VanDerWaalsContact C-N 3.33Å; T15-L18 PolarHBondContact O-N 3.19Å; T15-I19 HydrophobicContact CG2-CD1 4.14Å; T15-I19 VanDerWaalsContact O-CG1 3.27Å; T15-I19 WeakPolarHBondContact O-CG1 3.09Å; T15-I19 PolarHBondContact O-N 2.75Å |
| 16 | C | 86.1 | Confident | 80.4 | Confident | 79 Ų | 79 | 93.2 Ų | 93.2 | 53% | 0.534 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.4 | -43.8 | 174.4 | -83.1 | 0 | 0 | 0 | 0 | 112.8 | P12 G13 L18 I19 L20 | P12-C16 PolarHBondContact O-N 2.91Å; P12-C16 VanDerWaalsContact O-N 3.09Å; G13-C16 PolarHBondContact O-N 2.78Å; C16-L18 VanDerWaalsContact C-N 3.33Å; C16-L18 PolarHBondContact O-N 2.77Å; C16-I19 PolarHBondContact O-N 3.23Å; C16-L20 WeakPolarHBondContact O-CG 3.36Å; C16-L20 PolarHBondContact O-N 2.73Å |
| 17 | V | 89.3 | Confident | 82.7 | Confident | 84 Ų | 84 | 95 Ų | 95 | 51% | 0.509 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.8 | -42.2 | 178.2 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | G13 Q14 I19 L20 I21 | G13-V17 WeakPolarHBondContact O-CG2 3.48Å; G13-V17 PolarHBondContact O-N 3.41Å; Q14-V17 PolarHBondContact O-N 2.85Å; V17-I19 PolarHBondContact O-N 2.8Å; V17-L20 PolarHBondContact O-N 3.07Å; V17-I21 HydrophobicContact CG1-CD1 3.81Å; V17-I21 HydrophobicContact CG1-CG1 4.49Å; V17-I21 VanDerWaalsContact O-CG1 3.29Å; V17-I21 WeakPolarHBondContact O-CG1 3.4Å; V17-I21 PolarHBondContact O-N 3.1Å |
| 18 | L | 89.4 | Confident | 84.9 | Confident | 108 Ų | 108 | 89.6 Ų | 89.6 | 57% | 0.565 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -63.8 | -40.1 | 176.7 | -71.9 | 170.4 | 0 | 0 | 0 | 112.4 | Q14 T15 C16 I21 F22 | Q14-L18 WeakPolarHBondContact O-CB 3.45Å; Q14-L18 VanDerWaalsContact O-CG 3.27Å; Q14-L18 WeakPolarHBondContact O-CG 3.44Å; Q14-L18 PolarHBondContact O-N 2.97Å; T15-L18 PolarHBondContact O-N 3.19Å; C16-L18 VanDerWaalsContact C-N 3.33Å; C16-L18 PolarHBondContact O-N 2.77Å; L18-I21 PolarHBondContact O-N 3.46Å; L18-F22 WeakPolarHBondContact O-CB 3.47Å; L18-F22 PolarHBondContact O-N 3.48Å |
| 19 | I | 90.8 | Very high | 87 | Confident | 97 Ų | 97 | 91.2 Ų | 91.2 | 50% | 0.497 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.2 | -45.9 | 175.2 | -69.1 | 165.3 | 0 | 0 | 0 | 110.4 | T15 C16 V17 I21 F22 T23 | T15-I19 HydrophobicContact CG2-CD1 4.14Å; T15-I19 VanDerWaalsContact O-CG1 3.27Å; T15-I19 WeakPolarHBondContact O-CG1 3.09Å; T15-I19 PolarHBondContact O-N 2.75Å; C16-I19 PolarHBondContact O-N 3.23Å; V17-I19 PolarHBondContact O-N 2.8Å; I19-I21 PolarHBondContact O-N 2.86Å; I19-F22 PolarHBondContact O-N 2.88Å; I19-T23 HydrophobicContact CG2-CG2 4.35Å; I19-T23 WeakPolarHBondContact O-CG2 3.39Å; I19-T23 PolarHBondContact O-N 3.44Å; I19-T23 PolarHBondContact O-OG1 3.18Å |
| 20 | L | 91.5 | Very high | 88.4 | Confident | 112 Ų | 112 | 91.4 Ų | 91.4 | 59% | 0.586 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.4 | -46.9 | 178.2 | -72.6 | 173.9 | 0 | 0 | 0 | 111.6 | C16 V17 F22 T23 V24 | C16-L20 WeakPolarHBondContact O-CG 3.36Å; C16-L20 PolarHBondContact O-N 2.73Å; V17-L20 PolarHBondContact O-N 3.07Å; L20-F22 VanDerWaalsContact C-N 3.31Å; L20-F22 PolarHBondContact O-N 3.08Å; L20-T23 WeakPolarHBondContact CA-OG1 3.19Å; L20-T23 PolarHBondContact O-N 3.49Å; L20-T23 PolarHBondContact O-OG1 2.87Å; L20-V24 WeakPolarHBondContact O-CG2 3.26Å; L20-V24 PolarHBondContact O-N 2.92Å |
| 21 | I | 93.9 | Very high | 89.9 | Confident | 89 Ų | 89 | 90 Ų | 90 | 46% | 0.456 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.2 | -46.1 | 176.3 | -68 | 166.5 | 0 | 0 | 0 | 110.5 | V17 L18 I19 T23 V24 L25 | V17-I21 HydrophobicContact CG1-CD1 3.81Å; V17-I21 HydrophobicContact CG1-CG1 4.49Å; V17-I21 VanDerWaalsContact O-CG1 3.29Å; V17-I21 WeakPolarHBondContact O-CG1 3.4Å; V17-I21 PolarHBondContact O-N 3.1Å; L18-I21 PolarHBondContact O-N 3.46Å; I19-I21 PolarHBondContact O-N 2.86Å; I21-T23 PolarHBondContact O-N 2.89Å; I21-V24 PolarHBondContact O-N 2.87Å; I21-L25 HydrophobicContact CG2-CD1 3.87Å; I21-L25 HydrophobicContact CG2-CG 4.38Å; I21-L25 WeakPolarHBondContact O-CB 3.45Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.27Å; I21-L25 PolarHBondContact O-N 2.93Å |
| 22 | F | 95.1 | Very high | 90.8 | Very high | 137 Ų | 137 | 89.9 Ų | 89.9 | 60% | 0.601 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.8 | -42.7 | 178.6 | -175 | -96.9 | 0 | 0 | 0 | 112.2 | L18 I19 L20 V24 L25 L26 | L18-F22 WeakPolarHBondContact O-CB 3.47Å; L18-F22 PolarHBondContact O-N 3.48Å; I19-F22 PolarHBondContact O-N 2.88Å; L20-F22 VanDerWaalsContact C-N 3.31Å; L20-F22 PolarHBondContact O-N 3.08Å; F22-V24 PolarHBondContact O-N 2.84Å; F22-L25 PolarHBondContact O-N 3.18Å; F22-L26 HydrophobicContact CE1-CD2 4.29Å; F22-L26 WeakPolarHBondContact O-CB 3.43Å; F22-L26 PolarHBondContact O-N 2.82Å |
| 23 | T | 92.5 | Very high | 91.9 | Very high | 55 Ų | 55 | 88.9 Ų | 88.9 | 34% | 0.337 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.2 | -40.6 | 178.1 | 57.5 | 0 | 0 | 0 | 0 | 112.5 | I19 L20 I21 L26 Q27 | I19-T23 HydrophobicContact CG2-CG2 4.35Å; I19-T23 WeakPolarHBondContact O-CG2 3.39Å; I19-T23 PolarHBondContact O-N 3.44Å; I19-T23 PolarHBondContact O-OG1 3.18Å; L20-T23 WeakPolarHBondContact CA-OG1 3.19Å; L20-T23 PolarHBondContact O-N 3.49Å; L20-T23 PolarHBondContact O-OG1 2.87Å; I21-T23 PolarHBondContact O-N 2.89Å; T23-L26 PolarHBondContact O-N 3.07Å; T23-Q27 WeakPolarHBondContact O-CB 3.28Å; T23-Q27 VanDerWaalsContact O-CG 3.28Å; T23-Q27 WeakPolarHBondContact O-CG 3.36Å; T23-Q27 PolarHBondContact O-N 2.92Å |
| 24 | V | 95.7 | Very high | 92.7 | Very high | 90 Ų | 90 | 90.9 Ų | 90.9 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.1 | -42.6 | 177.7 | 172.8 | 0 | 0 | 0 | 0 | 110.9 | L20 I21 F22 Q27 S28 | L20-V24 WeakPolarHBondContact O-CG2 3.26Å; L20-V24 PolarHBondContact O-N 2.92Å; I21-V24 PolarHBondContact O-N 2.87Å; F22-V24 PolarHBondContact O-N 2.84Å; V24-Q27 PolarHBondContact O-N 3.09Å; V24-S28 WeakPolarHBondContact O-CB 3.46Å; V24-S28 PolarHBondContact O-N 3.43Å |
| 25 | L | 95.8 | Very high | 93.5 | Very high | 114 Ų | 114 | 93.5 Ų | 93.5 | 60% | 0.597 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.7 | -43.1 | 176 | -71.7 | 173.7 | 0 | 0 | 0 | 111.6 | I21 F22 S28 L29 | I21-L25 HydrophobicContact CG2-CD1 3.87Å; I21-L25 HydrophobicContact CG2-CG 4.38Å; I21-L25 WeakPolarHBondContact O-CB 3.45Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.27Å; I21-L25 PolarHBondContact O-N 2.93Å; F22-L25 PolarHBondContact O-N 3.18Å; L25-S28 PolarHBondContact O-N 2.98Å; L25-L29 WeakPolarHBondContact O-CB 3.33Å; L25-L29 PolarHBondContact O-N 2.6Å |
| 26 | L | 95.8 | Very high | 94.1 | Very high | 86 Ų | 86 | 95.4 Ų | 95.4 | 45% | 0.45 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.9 | -43.7 | 177.7 | -173.9 | 63.5 | 0 | 0 | 0 | 111.6 | F22 T23 S28 L29 C30 | F22-L26 HydrophobicContact CE1-CD2 4.29Å; F22-L26 WeakPolarHBondContact O-CB 3.43Å; F22-L26 PolarHBondContact O-N 2.82Å; T23-L26 PolarHBondContact O-N 3.07Å; L26-S28 PolarHBondContact O-N 3.39Å; L26-L29 PolarHBondContact O-N 2.87Å; L26-C30 PolarHBondContact O-N 3.38Å; L26-C30 PolarHBondContact O-SG 2.7Å; L26-C30 VanDerWaalsContact O-SG 3.39Å |
| 27 | Q | 95.4 | Very high | 94.5 | Very high | 138 Ų | 138 | 98.5 Ų | 98.5 | 65% | 0.645 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.3 | -43.3 | 175.3 | -77.9 | 178.3 | -19.5 | 0 | 0 | 111.9 | T23 V24 L29 C30 A31 | T23-Q27 WeakPolarHBondContact O-CB 3.28Å; T23-Q27 VanDerWaalsContact O-CG 3.28Å; T23-Q27 WeakPolarHBondContact O-CG 3.36Å; T23-Q27 PolarHBondContact O-N 2.92Å; V24-Q27 PolarHBondContact O-N 3.09Å; Q27-L29 VanDerWaalsContact C-N 3.34Å; Q27-L29 PolarHBondContact O-N 3.12Å; Q27-C30 PolarHBondContact O-N 3.24Å; Q27-A31 WeakPolarHBondContact O-CB 3.27Å; Q27-A31 PolarHBondContact O-N 3.12Å |
| 28 | S | 95.7 | Very high | 94.7 | Very high | 80 Ų | 80 | 100.6 Ų | 100.6 | 56% | 0.559 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.5 | -41.3 | 176.8 | -173.9 | 0 | 0 | 0 | 0 | 111.9 | V24 L25 L26 A32 | V24-S28 WeakPolarHBondContact O-CB 3.46Å; V24-S28 PolarHBondContact O-N 3.43Å; L25-S28 PolarHBondContact O-N 2.98Å; L26-S28 PolarHBondContact O-N 3.39Å; S28-A32 WeakPolarHBondContact O-CB 3.37Å; S28-A32 PolarHBondContact O-N 2.84Å |
| 29 | L | 97 | Very high | 94.8 | Very high | 112 Ų | 112 | 98.3 Ų | 98.3 | 59% | 0.586 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.5 | -46.9 | 177.5 | -175.9 | 69.3 | 0 | 0 | 0 | 111.2 | L25 L26 Q27 A31 A32 V33 | L25-L29 WeakPolarHBondContact O-CB 3.33Å; L25-L29 PolarHBondContact O-N 2.6Å; L26-L29 PolarHBondContact O-N 2.87Å; Q27-L29 VanDerWaalsContact C-N 3.34Å; Q27-L29 PolarHBondContact O-N 3.12Å; L29-A31 VanDerWaalsContact C-N 3.35Å; L29-A31 PolarHBondContact O-N 3.15Å; L29-A32 PolarHBondContact O-N 2.7Å; L29-V33 WeakPolarHBondContact O-CG2 3.38Å; L29-V33 PolarHBondContact O-N 3.16Å |
| 30 | C | 96.3 | Very high | 94.8 | Very high | 69 Ų | 69 | 98.7 Ų | 98.7 | 47% | 0.466 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -58.3 | -46.9 | 176 | -73.7 | 0 | 0 | 0 | 0 | 111.4 | L26 Q27 A32 V33 T34 | L26-C30 PolarHBondContact O-N 3.38Å; L26-C30 PolarHBondContact O-SG 2.7Å; L26-C30 VanDerWaalsContact O-SG 3.39Å; Q27-C30 PolarHBondContact O-N 3.24Å; C30-A32 VanDerWaalsContact C-N 3.34Å; C30-A32 PolarHBondContact O-N 3.05Å; C30-V33 PolarHBondContact O-N 3Å; C30-T34 PolarHBondContact O-N 3.33Å; C30-T34 PolarHBondContact O-OG1 2.81Å |
| 31 | A | 95.9 | Very high | 94.8 | Very high | 61 Ų | 61 | 96.4 Ų | 96.4 | 50% | 0.504 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.9 | -42.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q27 L29 T34 Y35 | Q27-A31 WeakPolarHBondContact O-CB 3.27Å; Q27-A31 PolarHBondContact O-N 3.12Å; L29-A31 VanDerWaalsContact C-N 3.35Å; L29-A31 PolarHBondContact O-N 3.15Å; A31-T34 PolarHBondContact O-N 2.85Å; A31-Y35 VanDerWaalsContact O-CB 3.24Å; A31-Y35 WeakPolarHBondContact O-CB 3.34Å; A31-Y35 PolarHBondContact O-N 3.36Å |
| 32 | A | 96.4 | Very high | 94.2 | Very high | 52 Ų | 52 | 96.5 Ų | 96.5 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.6 | -44.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | S28 L29 C30 Y35 V36 | S28-A32 WeakPolarHBondContact O-CB 3.37Å; S28-A32 PolarHBondContact O-N 2.84Å; L29-A32 PolarHBondContact O-N 2.7Å; C30-A32 VanDerWaalsContact C-N 3.34Å; C30-A32 PolarHBondContact O-N 3.05Å; A32-Y35 PolarHBondContact O-N 2.79Å; A32-V36 WeakPolarHBondContact O-CG2 3.1Å; A32-V36 PolarHBondContact O-N 2.83Å |
| 33 | V | 96.8 | Very high | 93.5 | Very high | 90 Ų | 90 | 96.3 Ų | 96.3 | 55% | 0.545 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.4 | -46.8 | 177.3 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | L29 C30 Y35 V36 Y37 | L29-V33 WeakPolarHBondContact O-CG2 3.38Å; L29-V33 PolarHBondContact O-N 3.16Å; C30-V33 PolarHBondContact O-N 3Å; V33-Y35 VanDerWaalsContact C-N 3.34Å; V33-Y35 PolarHBondContact O-N 2.96Å; V33-V36 PolarHBondContact O-N 3.3Å; V33-Y37 WeakPolarHBondContact O-CB 3.02Å; V33-Y37 PolarHBondContact O-N 3.42Å |
| 34 | T | 94.9 | Very high | 93 | Very high | 87 Ų | 87 | 97.8 Ų | 97.8 | 53% | 0.534 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | 177.8 | -53.5 | 0 | 0 | 0 | 0 | 111.5 | C30 A31 Y37 F38 | C30-T34 PolarHBondContact O-N 3.33Å; C30-T34 PolarHBondContact O-OG1 2.81Å; A31-T34 PolarHBondContact O-N 2.85Å; T34-Y37 PolarHBondContact O-N 2.9Å; T34-F38 WeakPolarHBondContact O-CB 3.19Å; T34-F38 PolarHBondContact O-N 2.79Å |
| 35 | Y | 96.4 | Very high | 91.9 | Very high | 167 Ų | 167 | 98.3 Ų | 98.3 | 66% | 0.655 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.8 | -47.3 | 175.7 | 177.9 | -95.1 | 0 | 0 | 0 | 111.7 | A31 A32 V33 F38 T39 | A31-Y35 VanDerWaalsContact O-CB 3.24Å; A31-Y35 WeakPolarHBondContact O-CB 3.34Å; A31-Y35 PolarHBondContact O-N 3.36Å; A32-Y35 PolarHBondContact O-N 2.79Å; V33-Y35 VanDerWaalsContact C-N 3.34Å; V33-Y35 PolarHBondContact O-N 2.96Å; Y35-F38 PolarHBondContact O-N 2.63Å; Y35-T39 VanDerWaalsContact O-CB 3.28Å; Y35-T39 WeakPolarHBondContact O-CB 3.11Å; Y35-T39 PolarHBondContact O-N 2.96Å; Y35-T39 PolarHBondContact O-OG1 3.17Å |
| 36 | V | 95.4 | Very high | 90.6 | Very high | 97 Ų | 97 | 99.4 Ų | 99.4 | 59% | 0.588 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.8 | -45.9 | 177.6 | 171.4 | 0 | 0 | 0 | 0 | 111 | A32 V33 T39 N40 | A32-V36 WeakPolarHBondContact O-CG2 3.1Å; A32-V36 PolarHBondContact O-N 2.83Å; V33-V36 PolarHBondContact O-N 3.3Å; V36-T39 PolarHBondContact O-N 3.2Å; V36-N40 WeakPolarHBondContact O-CB 3.27Å; V36-N40 PolarHBondContact O-N 3.08Å |
| 37 | Y | 95.5 | Very high | 89.3 | Confident | 144 Ų | 144 | 99.5 Ų | 99.5 | 57% | 0.565 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -58.6 | -50.3 | 177.4 | 176.3 | -101.3 | 0 | 0 | 0 | 111.5 | V33 T34 T39 N40 E41 | V33-Y37 WeakPolarHBondContact O-CB 3.02Å; V33-Y37 PolarHBondContact O-N 3.42Å; T34-Y37 PolarHBondContact O-N 2.9Å; Y37-T39 PolarHBondContact O-N 2.64Å; Y37-N40 WeakPolarHBondContact O-CB 3.18Å; Y37-N40 PolarHBondContact O-N 2.64Å; Y37-E41 HydrophobicContact CD1-CG 4.47Å; Y37-E41 HydrophobicContact CE1-CG 3.97Å; Y37-E41 HydrophobicContact CE2-CG 4.09Å; Y37-E41 PolarHBondContact O-N 3.23Å |
| 38 | F | 93 | Very high | 88 | Confident | 127 Ų | 127 | 98.9 Ų | 98.9 | 56% | 0.557 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.1 | -40.3 | -179 | -167.3 | -104.6 | 0 | 0 | 0 | 112 | T34 Y35 N40 E41 L42 | T34-F38 WeakPolarHBondContact O-CB 3.19Å; T34-F38 PolarHBondContact O-N 2.79Å; Y35-F38 PolarHBondContact O-N 2.63Å; F38-N40 VanDerWaalsContact C-N 3.28Å; F38-N40 PolarHBondContact O-N 2.95Å; F38-E41 PolarHBondContact O-N 3.47Å; F38-L42 HydrophobicContact CD1-CD1 3.6Å; F38-L42 HydrophobicContact CD1-CG 4.01Å; F38-L42 HydrophobicContact CE1-CD1 3.39Å; F38-L42 HydrophobicContact CE1-CD2 4.23Å; F38-L42 HydrophobicContact CE1-CG 3.8Å; F38-L42 HydrophobicContact CZ-CD1 4.24Å; F38-L42 HydrophobicContact CZ-CD2 4.28Å; F38-L42 HydrophobicContact CZ-CG 4.23Å; F38-L42 WeakPolarHBondContact O-CB 3.4Å; F38-L42 WeakPolarHBondContact O-CG 3.49Å; F38-L42 PolarHBondContact O-N 2.91Å |
| 39 | T | 90.9 | Very high | 86.2 | Confident | 60 Ų | 60 | 103 Ų | 103 | 37% | 0.368 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.4 | -38.5 | 175.2 | -55.2 | 0 | 0 | 0 | 0 | 111.1 | Y35 V36 Y37 K43 | Y35-T39 VanDerWaalsContact O-CB 3.28Å; Y35-T39 WeakPolarHBondContact O-CB 3.11Å; Y35-T39 PolarHBondContact O-N 2.96Å; Y35-T39 PolarHBondContact O-OG1 3.17Å; V36-T39 PolarHBondContact O-N 3.2Å; Y37-T39 PolarHBondContact O-N 2.64Å; T39-K43 WeakPolarHBondContact O-CB 3.21Å; T39-K43 PolarHBondContact O-N 3.35Å |
| 40 | N | 91.3 | Very high | 84.3 | Confident | 105 Ų | 105 | 101.1 Ų | 101.1 | 56% | 0.561 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -69.3 | -42.6 | 178 | -163.2 | 34.7 | 0 | 0 | 0 | 112.2 | V36 Y37 F38 K43 Q44 | V36-N40 WeakPolarHBondContact O-CB 3.27Å; V36-N40 PolarHBondContact O-N 3.08Å; Y37-N40 WeakPolarHBondContact O-CB 3.18Å; Y37-N40 PolarHBondContact O-N 2.64Å; F38-N40 VanDerWaalsContact C-N 3.28Å; F38-N40 PolarHBondContact O-N 2.95Å; N40-K43 PolarHBondContact O-N 2.88Å; N40-Q44 PolarHBondContact O-N 3.11Å |
| 41 | E | 90.3 | Very high | 82.5 | Confident | 65 Ų | 65 | 106.2 Ų | 106.2 | 30% | 0.304 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.7 | -42.8 | 174.5 | -74.4 | -62.3 | 138.9 | 0 | 0 | 112.1 | Y37 F38 K43 Q44 M45 | Y37-E41 HydrophobicContact CD1-CG 4.47Å; Y37-E41 HydrophobicContact CE1-CG 3.97Å; Y37-E41 HydrophobicContact CE2-CG 4.09Å; Y37-E41 PolarHBondContact O-N 3.23Å; F38-E41 PolarHBondContact O-N 3.47Å; E41-K43 VanDerWaalsContact C-N 3.3Å; E41-K43 PolarHBondContact O-N 3.21Å; E41-Q44 WeakPolarHBondContact O-CB 3.46Å; E41-Q44 PolarHBondContact O-N 2.93Å; E41-M45 WeakPolarHBondContact O-CG 3.4Å; E41-M45 PolarHBondContact O-N 3.5Å |
| 42 | L | 82.7 | Confident | 80.8 | Confident | 91 Ų | 91 | 105.8 Ų | 105.8 | 48% | 0.476 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.5 | -42.4 | 173.6 | -78.9 | 179.1 | 0 | 0 | 0 | 111.6 | F38 Q44 M45 Q46 | F38-L42 HydrophobicContact CD1-CD1 3.6Å; F38-L42 HydrophobicContact CD1-CG 4.01Å; F38-L42 HydrophobicContact CE1-CD1 3.39Å; F38-L42 HydrophobicContact CE1-CD2 4.23Å; F38-L42 HydrophobicContact CE1-CG 3.8Å; F38-L42 HydrophobicContact CZ-CD1 4.24Å; F38-L42 HydrophobicContact CZ-CD2 4.28Å; F38-L42 HydrophobicContact CZ-CG 4.23Å; F38-L42 WeakPolarHBondContact O-CB 3.4Å; F38-L42 WeakPolarHBondContact O-CG 3.49Å; F38-L42 PolarHBondContact O-N 2.91Å; L42-Q44 VanDerWaalsContact C-N 3.35Å; L42-M45 PolarHBondContact O-N 3.07Å; L42-Q46 WeakPolarHBondContact O-CB 3.26Å; L42-Q46 PolarHBondContact O-N 2.76Å |
| 43 | K | 80.3 | Confident | 79 | Confident | 133 Ų | 133 | 105.3 Ų | 105.3 | 58% | 0.578 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.4 | -40.2 | 175.9 | -168.2 | 174.6 | -177.5 | 176.6 | 0 | 111.5 | T39 N40 E41 Q46 D47 | T39-K43 WeakPolarHBondContact O-CB 3.21Å; T39-K43 PolarHBondContact O-N 3.35Å; N40-K43 PolarHBondContact O-N 2.88Å; E41-K43 VanDerWaalsContact C-N 3.3Å; E41-K43 PolarHBondContact O-N 3.21Å; K43-Q46 PolarHBondContact O-N 2.82Å; K43-D47 WeakPolarHBondContact O-CB 3.37Å; K43-D47 PolarHBondContact O-N 3.08Å |
| 44 | Q | 80.6 | Confident | 77.4 | Confident | 86 Ų | 86 | 105.7 Ų | 105.7 | 40% | 0.402 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.7 | -40.9 | 175.5 | -164.8 | -163.3 | 89.1 | 0 | 0 | 112 | N40 E41 L42 D47 K48 | N40-Q44 PolarHBondContact O-N 3.11Å; E41-Q44 WeakPolarHBondContact O-CB 3.46Å; E41-Q44 PolarHBondContact O-N 2.93Å; L42-Q44 VanDerWaalsContact C-N 3.35Å; Q44-D47 PolarHBondContact O-N 2.62Å; Q44-K48 WeakPolarHBondContact O-CG 3.23Å; Q44-K48 PolarHBondContact O-N 2.82Å |
| 45 | M | 72.6 | Confident | 75.9 | Confident | 100 Ų | 100 | 103.3 Ų | 103.3 | 49% | 0.493 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.1 | -48.7 | 173.1 | -75.7 | -69.6 | -142.1 | 0 | 0 | 110.7 | E41 L42 D47 K48 Y49 | E41-M45 WeakPolarHBondContact O-CG 3.4Å; E41-M45 PolarHBondContact O-N 3.5Å; L42-M45 PolarHBondContact O-N 3.07Å; M45-D47 VanDerWaalsContact C-N 3.3Å; M45-D47 PolarHBondContact O-N 2.95Å; M45-K48 PolarHBondContact O-N 3.24Å; M45-K48 VanDerWaalsContact O-N 3.09Å; M45-Y49 HydrophobicContact CB-CD2 4.48Å; M45-Y49 WeakPolarHBondContact O-CD2 3.46Å; M45-Y49 PolarHBondContact O-N 3.5Å; M45-Y49 HydrophobicContact SD-CE2 4.45Å |
| 46 | Q | 69.7 | Low | 74.6 | Confident | 138 Ų | 138 | 96.1 Ų | 96.1 | 65% | 0.645 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -58.4 | -40.9 | 177.6 | -172.3 | 174.7 | 4.9 | 0 | 0 | 112 | L42 K43 Y49 S50 | L42-Q46 WeakPolarHBondContact O-CB 3.26Å; L42-Q46 PolarHBondContact O-N 2.76Å; K43-Q46 PolarHBondContact O-N 2.82Å; Q46-Y49 PolarHBondContact O-N 3.18Å; Q46-S50 VanDerWaalsContact O-CB 3.26Å; Q46-S50 WeakPolarHBondContact O-CB 3.43Å; Q46-S50 PolarHBondContact O-N 3.31Å; Q46-S50 PolarHBondContact O-OG 2.99Å |
| 47 | D | 67.3 | Low | 73.2 | Confident | 87 Ų | 87 | 96.2 Ų | 96.2 | 47% | 0.465 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.4 | -35.5 | 174.8 | -99.4 | 16.9 | 0 | 0 | 0 | 113 | K43 Q44 M45 S50 K51 | K43-D47 WeakPolarHBondContact O-CB 3.37Å; K43-D47 PolarHBondContact O-N 3.08Å; Q44-D47 PolarHBondContact O-N 2.62Å; M45-D47 VanDerWaalsContact C-N 3.3Å; M45-D47 PolarHBondContact O-N 2.95Å; D47-S50 WeakPolarHBondContact CA-OG 3.48Å; D47-S50 PolarHBondContact O-OG 2.82Å; D47-S50 VanDerWaalsContact O-OG 3.09Å; D47-K51 VanDerWaalsContact O-CB 3.27Å; D47-K51 WeakPolarHBondContact O-CB 3.42Å; D47-K51 WeakPolarHBondContact O-CG 3.35Å; D47-K51 PolarHBondContact O-N 3.24Å |
| 48 | K | 68.6 | Low | 71.6 | Confident | 126 Ų | 126 | 95.9 Ų | 95.9 | 55% | 0.548 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -70.7 | -39.6 | 174.4 | -76.7 | 172.2 | 176.6 | 167.6 | 0 | 111.8 | Q44 M45 S52 | Q44-K48 WeakPolarHBondContact O-CG 3.23Å; Q44-K48 PolarHBondContact O-N 2.82Å; M45-K48 PolarHBondContact O-N 3.24Å; M45-K48 VanDerWaalsContact O-N 3.09Å; K48-S52 PolarHBondContact O-N 3.22Å |
| 49 | Y | 58.9 | Low | 70.1 | Confident | 167 Ų | 167 | 96.5 Ų | 96.5 | 66% | 0.655 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -70 | -39 | 175.4 | -82.2 | -74.4 | 0 | 0 | 0 | 112 | M45 Q46 S52 | M45-Y49 HydrophobicContact CB-CD2 4.48Å; M45-Y49 WeakPolarHBondContact O-CD2 3.46Å; M45-Y49 PolarHBondContact O-N 3.5Å; M45-Y49 HydrophobicContact SD-CE2 4.45Å; Q46-Y49 PolarHBondContact O-N 3.18Å; Y49-S52 WeakPolarHBondContact O-CB 3.28Å; Y49-S52 PolarHBondContact O-N 2.95Å |
| 50 | S | 57.1 | Low | 68.3 | Low | 71 Ų | 71 | 102.7 Ų | 102.7 | 50% | 0.497 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -71.2 | -31.4 | 177.2 | 70.7 | 0 | 0 | 0 | 0 | 112.8 | Q46 D47 S52 | Q46-S50 VanDerWaalsContact O-CB 3.26Å; Q46-S50 WeakPolarHBondContact O-CB 3.43Å; Q46-S50 PolarHBondContact O-N 3.31Å; Q46-S50 PolarHBondContact O-OG 2.99Å; D47-S50 WeakPolarHBondContact CA-OG 3.48Å; D47-S50 PolarHBondContact O-OG 2.82Å; D47-S50 VanDerWaalsContact O-OG 3.09Å; S50-S52 VanDerWaalsContact C-N 3.33Å |
| 51 | K | 58.1 | Low | 66.6 | Low | 177 Ų | 177 | 101.3 Ų | 101.3 | 77% | 0.77 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -75.4 | -16.9 | 171.8 | -81.6 | 179.6 | 176.4 | 173.1 | 0 | 114.1 | D47 G53 | D47-K51 VanDerWaalsContact O-CB 3.27Å; D47-K51 WeakPolarHBondContact O-CB 3.42Å; D47-K51 WeakPolarHBondContact O-CG 3.35Å; D47-K51 PolarHBondContact O-N 3.24Å; K51-G53 PolarHBondContact O-N 3.16Å |
| 52 | S | 59.8 | Low | 64.7 | Low | 51 Ų | 51 | 106.7 Ų | 106.7 | 36% | 0.357 | 54% | 0.535 | S | S | . | . | S | Bend | trans | -75.3 | 119.4 | 170.9 | -173.3 | 0 | 0 | 0 | 0 | 108.5 | K48 Y49 S50 I54 A55 | K48-S52 PolarHBondContact O-N 3.22Å; Y49-S52 WeakPolarHBondContact O-CB 3.28Å; Y49-S52 PolarHBondContact O-N 2.95Å; S50-S52 VanDerWaalsContact C-N 3.33Å; S52-I54 PolarHBondContact O-N 3.35Å; S52-A55 PolarHBondContact O-N 3.49Å |
| 53 | G | 58 | Low | 63.4 | Low | 42 Ų | 42 | 106 Ų | 106 | 43% | 0.433 | 54% | 0.538 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | -6.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | K51 | K51-G53 PolarHBondContact O-N 3.16Š|
| 54 | I | 63.7 | Low | 62 | Low | 99 Ų | 99 | 104.6 Ų | 104.6 | 51% | 0.508 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73 | -27.3 | 175.2 | -49.8 | 173.9 | 0 | 0 | 0 | 112.3 | S52 C56 F57 L58 | S52-I54 PolarHBondContact O-N 3.35Å; I54-C56 PolarHBondContact O-N 3.17Å; I54-C56 VanDerWaalsContact O-N 3.14Å; I54-F57 PolarHBondContact O-N 2.76Å; I54-L58 HydrophobicContact CG2-CD1 3.91Å; I54-L58 HydrophobicContact CG2-CG 4.13Å; I54-L58 PolarHBondContact O-N 2.93Å |
| 55 | A | 64.6 | Low | 60.9 | Low | 37 Ų | 37 | 104.7 Ų | 104.7 | 31% | 0.306 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.3 | -30.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S52 F57 L58 K59 | S52-A55 PolarHBondContact O-N 3.49Å; A55-F57 VanDerWaalsContact C-N 3.26Å; A55-F57 PolarHBondContact O-N 2.72Å; A55-L58 PolarHBondContact O-N 2.97Å; A55-K59 PolarHBondContact O-N 3.09Å |
| 56 | C | 67.8 | Low | 60.3 | Low | 16 Ų | 16 | 103.2 Ų | 103.2 | 11% | 0.108 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -69.7 | -19.5 | 175.6 | -71.5 | 0 | 0 | 0 | 0 | 114.6 | I54 C77 K81 | I54-C56 PolarHBondContact O-N 3.17Å; I54-C56 VanDerWaalsContact O-N 3.14Å; C56-C77 WeakPolarHBondContact CA-SG 3.09Å; C56-C77 HydrophobicContact CB-CB 3.47Å; C56-C77 VanDerWaalsContact CB-CB 3.47Å; C56-C77 WeakPolarHBondContact CB-SG 3.4Å; C56-C77 WeakPolarHBondContact SG-CA 3.38Å; C56-C77 WeakPolarHBondContact SG-CB 3.29Å; C56-C77 CovalentContact SG-SG 2.04Å; C56-C77 PolarHBondContact SG-SG 3.02Å; C56-K81 WeakPolarHBondContact O-CE 3.32Å |
| 57 | F | 65.9 | Low | 59.7 | Low | 99 Ų | 99 | 98.7 Ų | 98.7 | 43% | 0.434 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -97.5 | -21.3 | 178.4 | -60.5 | -60.4 | 0 | 0 | 0 | 113.2 | I54 A55 V80 K81 L84 | I54-F57 PolarHBondContact O-N 2.76Å; A55-F57 VanDerWaalsContact C-N 3.26Å; A55-F57 PolarHBondContact O-N 2.72Å; F57-V80 HydrophobicContact CE1-CG1 4.26Å; F57-V80 HydrophobicContact CE2-CG1 3.84Å; F57-V80 HydrophobicContact CZ-CG1 3.48Å; F57-V80 VanDerWaalsContact CZ-CG1 3.48Å; F57-K81 HydrophobicContact CE1-CG 4.49Å; F57-L84 HydrophobicContact CD1-CD2 4.24Å; F57-L84 HydrophobicContact CE1-CB 4.45Å; F57-L84 HydrophobicContact CE1-CD2 3.43Å; F57-L84 VanDerWaalsContact CE1-CD2 3.43Å; F57-L84 HydrophobicContact CZ-CB 4.49Å; F57-L84 HydrophobicContact CZ-CD2 3.9Å |
| 58 | L | 62.5 | Low | 59.4 | Low | 137 Ų | 137 | 101.2 Ų | 101.2 | 72% | 0.717 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -91.4 | -12.5 | -178 | -65.7 | 173.4 | 0 | 0 | 0 | 113.6 | I54 A55 E60 | I54-L58 HydrophobicContact CG2-CD1 3.91Å; I54-L58 HydrophobicContact CG2-CG 4.13Å; I54-L58 PolarHBondContact O-N 2.93Å; A55-L58 PolarHBondContact O-N 2.97Å; L58-E60 PolarHBondContact O-N 3.24Å; L58-E60 VanDerWaalsContact O-N 3.17Å |
| 59 | K | 60.7 | Low | 59.4 | Low | 139 Ų | 139 | 98.6 Ų | 98.6 | 60% | 0.604 | 52% | 0.524 | S | S | * | . | trans | -77.7 | 101.5 | 175.2 | -161 | 176.9 | 178.6 | -173.4 | 0 | 108.9 | A55 D61 | A55-K59 PolarHBondContact O-N 3.09Å; K59-D61 VanDerWaalsContact C-N 3.29Å; K59-D61 PolarHBondContact O-N 2.91Å | ||
| 60 | E | 53.5 | Low | 59.5 | Low | 191 Ų | 191 | 97.5 Ų | 97.5 | 89% | 0.893 | 53% | 0.525 | S | S | * | . | trans | -63.9 | 88.6 | 168 | -75.2 | 173.6 | 161.7 | 0 | 0 | 108.6 | L58 | L58-E60 PolarHBondContact O-N 3.24Å; L58-E60 VanDerWaalsContact O-N 3.17Å | ||
| 61 | D | 55.4 | Low | 59.6 | Low | 75 Ų | 75 | 102.1 Ų | 102.1 | 40% | 0.401 | 54% | 0.539 | S | S | . | . | trans | -93 | 109.8 | 161.2 | -77.2 | -33.5 | 0 | 0 | 0 | 106.5 | K59 S63 | K59-D61 VanDerWaalsContact C-N 3.29Å; K59-D61 PolarHBondContact O-N 2.91Å; D61-S63 PolarHBondContact O-N 2.83Å | ||
| 62 | D | 50.7 | Low | 59.7 | Low | 178 Ų | 178 | 94.4 Ų | 94.4 | 95% | 0.952 | 51% | 0.507 | S | S | * | . | trans | -65.5 | 3.7 | 176.6 | -108.7 | -16.1 | 0 | 0 | 0 | 113.6 | ||||
| 63 | S | 55.6 | Low | 59.6 | Low | 76 Ų | 76 | 97.4 Ų | 97.4 | 53% | 0.531 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -79.7 | 129.5 | 177.6 | 56.9 | 0 | 0 | 0 | 0 | 110.5 | D61 W65 | D61-S63 PolarHBondContact O-N 2.83Å; S63-W65 PolarHBondContact O-N 2.97Å |
| 64 | S | 50.5 | Low | 59.7 | Low | 105 Ų | 105 | 102.9 Ų | 102.9 | 73% | 0.734 | 53% | 0.529 | S | S | * | . | trans | -57.4 | 109.5 | 171.9 | 63 | 0 | 0 | 0 | 0 | 108.8 | D66 | S64-D66 PolarHBondContact O-N 2.63Š| ||
| 65 | W | 57.7 | Low | 59.9 | Low | 88 Ų | 88 | 99.9 Ų | 99.9 | 33% | 0.333 | 52% | 0.516 | S | S | . | . | trans | -67.1 | 93.5 | -179.4 | -100.1 | 63.5 | 0 | 0 | 0 | 110.7 | S63 S72 W78 K81 | S63-W65 PolarHBondContact O-N 2.97Å; W65-S72 WeakPolarHBondContact CH2-OG 3.41Å; W65-S72 WeakPolarHBondContact CZ3-OG 3.37Å; W65-W78 HydrophobicContact CE3-CE3 4.31Å; W65-W78 HydrophobicContact CE3-CZ3 4.16Å; W65-W78 AromaticContact CH2-CE3 3.69Å; W65-W78 HydrophobicContact CH2-CE3 3.69Å; W65-W78 HydrophobicContact CH2-CZ3 4.34Å; W65-W78 HydrophobicContact CZ3-CD2 4.43Å; W65-W78 AromaticContact CZ3-CE3 3.35Å; W65-W78 HydrophobicContact CZ3-CE3 3.35Å; W65-W78 AromaticContact CZ3-CZ3 3.62Å; W65-W78 HydrophobicContact CZ3-CZ3 3.62Å; W65-K81 HydrophobicContact CD2-CD 4.04Å; W65-K81 VanDerWaalsContact CE2-NZ 3.25Å; W65-K81 HydrophobicContact CE3-CB 4.34Å; W65-K81 HydrophobicContact CE3-CD 4.04Å; W65-K81 HydrophobicContact CH2-CB 3.9Å; W65-K81 HydrophobicContact CH2-CD 3.2Å; W65-K81 HydrophobicContact CH2-CG 4.14Å; W65-K81 HydrophobicContact CZ2-CD 3.16Å; W65-K81 HydrophobicContact CZ2-CG 4.49Å; W65-K81 VanDerWaalsContact CZ2-NZ 3.31Å; W65-K81 HydrophobicContact CZ3-CB 3.66Å; W65-K81 HydrophobicContact CZ3-CD 3.62Å; W65-K81 HydrophobicContact CZ3-CG 4.28Å | ||
| 66 | D | 60.4 | Low | 60.1 | Low | 69 Ų | 69 | 104.3 Ų | 104.3 | 37% | 0.369 | 54% | 0.542 | S | S | . | . | trans | -84.8 | 127.6 | 166.6 | -162.8 | -38.6 | 0 | 0 | 0 | 109.4 | S64 N68 D69 | S64-D66 PolarHBondContact O-N 2.63Å; D66-N68 PolarHBondContact O-N 2.89Å; D66-N68 PolarHBondContact OD1-N 2.82Å; D66-D69 HydrophobicContact CB-CB 4.28Å; D66-D69 VanDerWaalsContact CB-CG 3.47Å; D66-D69 VanDerWaalsContact CB-OD2 3.25Å; D66-D69 WeakPolarHBondContact CB-OD2 3.5Å; D66-D69 PolarHBondContact O-N 2.96Å | ||
| 67 | P | 57.7 | Low | 60.4 | Low | 42 Ų | 42 | 104.8 Ų | 104.8 | 27% | 0.273 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -17.1 | 172.6 | 23.3 | -35.6 | 0 | 0 | 0 | 115.9 | W78 | P67-W78 HydrophobicContact CB-CH2 4.41Å; P67-W78 VanDerWaalsContact O-CH2 3.29Å; P67-W78 WeakPolarHBondContact O-CH2 3.46Å |
| 68 | N | 61.1 | Low | 60.9 | Low | 140 Ų | 140 | 102.2 Ų | 102.2 | 75% | 0.749 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.7 | 0.5 | -179 | -69 | -22.7 | 0 | 0 | 0 | 113.1 | D66 E70 | D66-N68 PolarHBondContact O-N 2.89Å; D66-N68 PolarHBondContact OD1-N 2.82Å; N68-E70 PolarHBondContact O-N 2.88Å |
| 69 | D | 67.9 | Low | 61.4 | Low | 71 Ų | 71 | 102 Ų | 102 | 38% | 0.38 | 53% | 0.528 | S | S | . | . | trans | -73.7 | 119.3 | 178.2 | -75.9 | -17.7 | 0 | 0 | 0 | 110.9 | D66 E71 S72 M73 | D66-D69 HydrophobicContact CB-CB 4.28Å; D66-D69 VanDerWaalsContact CB-CG 3.47Å; D66-D69 VanDerWaalsContact CB-OD2 3.25Å; D66-D69 WeakPolarHBondContact CB-OD2 3.5Å; D66-D69 PolarHBondContact O-N 2.96Å; D69-E71 PolarHBondContact O-N 2.9Å; D69-E71 VanDerWaalsContact O-N 3.15Å; D69-S72 WeakPolarHBondContact O-CB 3.37Å; D69-S72 PolarHBondContact O-N 3Å; D69-M73 PolarHBondContact O-N 2.92Å | ||
| 70 | E | 61.2 | Low | 62.3 | Low | 144 Ų | 144 | 97.7 Ų | 97.7 | 67% | 0.673 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | -24.7 | 178.9 | -135.4 | -171.7 | 177.3 | 0 | 0 | 112.7 | N68 K74 | N68-E70 PolarHBondContact O-N 2.88Å; E70-K74 WeakPolarHBondContact O-CG 3.26Å |
| 71 | E | 58.9 | Low | 63.3 | Low | 169 Ų | 169 | 90.7 Ų | 90.7 | 79% | 0.79 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -34.5 | 176.8 | -164.4 | 166.6 | -162.6 | 0 | 0 | 112 | D69 K74 | D69-E71 PolarHBondContact O-N 2.9Å; D69-E71 VanDerWaalsContact O-N 3.15Å; E71-K74 PolarHBondContact O-N 2.95Å |
| 72 | S | 59 | Low | 64.4 | Low | 15 Ų | 15 | 92.8 Ų | 92.8 | 11% | 0.105 | 48% | 0.482 | C | S | . | . | G | 310 helix | trans | -69.8 | -38.6 | 177.1 | -167.7 | 0 | 0 | 0 | 0 | 111.8 | W65 D69 K74 S75 W78 | W65-S72 WeakPolarHBondContact CH2-OG 3.41Å; W65-S72 WeakPolarHBondContact CZ3-OG 3.37Å; D69-S72 WeakPolarHBondContact O-CB 3.37Å; D69-S72 PolarHBondContact O-N 3Å; S72-K74 PolarHBondContact O-N 3.07Å; S72-S75 PolarHBondContact O-N 2.8Å; S72-S75 PolarHBondContact O-OG 2.95Å; S72-W78 VanDerWaalsContact OG-CZ3 3.3Å; S72-W78 WeakPolarHBondContact OG-CZ3 3.2Å |
| 73 | M | 58.3 | Low | 65.8 | Low | 113 Ų | 113 | 89.2 Ų | 89.2 | 56% | 0.557 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | -63.5 | -22.4 | 174.8 | -80.8 | 176.2 | 77.6 | 0 | 0 | 114 | D69 S75 W78 | D69-M73 PolarHBondContact O-N 2.92Å; M73-S75 VanDerWaalsContact C-N 3.34Å; M73-W78 HydrophobicContact CG-CD2 4.11Å; M73-W78 HydrophobicContact CG-CE3 4.47Å; M73-W78 HydrophobicContact CG-CH2 4.05Å; M73-W78 HydrophobicContact CG-CZ2 3.63Å; M73-W78 HydrophobicContact CG-CZ3 4.45Å |
| 74 | K | 60.9 | Low | 67 | Low | 158 Ų | 158 | 89.6 Ų | 89.6 | 69% | 0.687 | 46% | 0.455 | S | S | * | . | G | 310 helix | trans | -83.1 | -10.1 | 178.5 | -70.6 | 170.5 | -172.6 | 169.6 | 0 | 113.2 | E70 E71 S72 | E70-K74 WeakPolarHBondContact O-CG 3.26Å; E71-K74 PolarHBondContact O-N 2.95Å; S72-K74 PolarHBondContact O-N 3.07Å |
| 75 | S | 67.9 | Low | 68.4 | Low | 35 Ų | 35 | 89.3 Ų | 89.3 | 25% | 0.245 | 44% | 0.438 | C | S | . | . | S | Bend | trans | -75 | 135.9 | -178.9 | 73.8 | 0 | 0 | 0 | 0 | 111.5 | S72 M73 C77 W78 | S72-S75 PolarHBondContact O-N 2.8Å; S72-S75 PolarHBondContact O-OG 2.95Å; M73-S75 VanDerWaalsContact C-N 3.34Å; S75-C77 PolarHBondContact O-N 3.03Å; S75-W78 WeakPolarHBondContact O-CB 3.37Å; S75-W78 PolarHBondContact O-N 3.47Å; S75-W78 PolarHBondContact OG-N 2.85Å |
| 76 | P | 68.4 | Low | 69.4 | Low | 130 Ų | 130 | 88.2 Ų | 88.2 | 84% | 0.844 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | -18.2 | 172.6 | -25.1 | 33.9 | 0 | 0 | 0 | 113.9 | ||
| 77 | C | 74.2 | Confident | 70.5 | Confident | 27 Ų | 27 | 90.1 Ų | 90.1 | 18% | 0.182 | 45% | 0.446 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91 | -7.7 | 179.5 | -69.9 | 0 | 0 | 0 | 0 | 114.6 | C56 S75 Q79 V80 K81 | C56-C77 WeakPolarHBondContact CA-SG 3.09Å; C56-C77 HydrophobicContact CB-CB 3.47Å; C56-C77 VanDerWaalsContact CB-CB 3.47Å; C56-C77 WeakPolarHBondContact CB-SG 3.4Å; C56-C77 WeakPolarHBondContact SG-CA 3.38Å; C56-C77 WeakPolarHBondContact SG-CB 3.29Å; C56-C77 CovalentContact SG-SG 2.04Å; C56-C77 PolarHBondContact SG-SG 3.02Å; S75-C77 PolarHBondContact O-N 3.03Å; C77-Q79 VanDerWaalsContact C-N 3.35Å; C77-Q79 PolarHBondContact O-N 3.04Å; C77-V80 PolarHBondContact O-N 3.12Å; C77-K81 PolarHBondContact O-N 2.89Å |
| 78 | W | 75.4 | Confident | 71.6 | Confident | 44 Ų | 44 | 91 Ų | 91 | 17% | 0.167 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -52.8 | -50 | -178.7 | 172.6 | -108.1 | 0 | 0 | 0 | 112.7 | W65 P67 S72 M73 S75 V80 K81 W82 | W65-W78 HydrophobicContact CE3-CE3 4.31Å; W65-W78 HydrophobicContact CE3-CZ3 4.16Å; W65-W78 AromaticContact CH2-CE3 3.69Å; W65-W78 HydrophobicContact CH2-CE3 3.69Å; W65-W78 HydrophobicContact CH2-CZ3 4.34Å; W65-W78 HydrophobicContact CZ3-CD2 4.43Å; W65-W78 AromaticContact CZ3-CE3 3.35Å; W65-W78 HydrophobicContact CZ3-CE3 3.35Å; W65-W78 AromaticContact CZ3-CZ3 3.62Å; W65-W78 HydrophobicContact CZ3-CZ3 3.62Å; P67-W78 HydrophobicContact CB-CH2 4.41Å; P67-W78 VanDerWaalsContact O-CH2 3.29Å; P67-W78 WeakPolarHBondContact O-CH2 3.46Å; S72-W78 VanDerWaalsContact OG-CZ3 3.3Å; S72-W78 WeakPolarHBondContact OG-CZ3 3.2Å; M73-W78 HydrophobicContact CG-CD2 4.11Å; M73-W78 HydrophobicContact CG-CE3 4.47Å; M73-W78 HydrophobicContact CG-CH2 4.05Å; M73-W78 HydrophobicContact CG-CZ2 3.63Å; M73-W78 HydrophobicContact CG-CZ3 4.45Å; S75-W78 WeakPolarHBondContact O-CB 3.37Å; S75-W78 PolarHBondContact O-N 3.47Å; S75-W78 PolarHBondContact OG-N 2.85Å; W78-V80 VanDerWaalsContact C-N 3.34Å; W78-V80 PolarHBondContact O-N 2.82Å; W78-K81 PolarHBondContact O-N 2.9Å; W78-W82 AromaticContact CZ2-CD1 3.89Å; W78-W82 WeakPolarHBondContact O-CB 3.36Å; W78-W82 PolarHBondContact O-N 3.09Å |
| 79 | Q | 75.1 | Confident | 72.5 | Confident | 134 Ų | 134 | 89.7 Ų | 89.7 | 63% | 0.626 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -64.3 | -40.6 | -175 | -168.2 | 168.1 | 1.6 | 0 | 0 | 112.1 | C77 Q83 | C77-Q79 VanDerWaalsContact C-N 3.35Å; C77-Q79 PolarHBondContact O-N 3.04Å; Q79-Q83 WeakPolarHBondContact O-CB 3.42Å; Q79-Q83 VanDerWaalsContact O-CG 3.28Å; Q79-Q83 WeakPolarHBondContact O-CG 3.27Å; Q79-Q83 PolarHBondContact O-N 2.78Å |
| 80 | V | 77.6 | Confident | 73.1 | Confident | 48 Ų | 48 | 93.1 Ų | 93.1 | 29% | 0.291 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -67.3 | -47.5 | 178.6 | 178 | 0 | 0 | 0 | 0 | 110.8 | F57 C77 W78 W82 Q83 L84 | F57-V80 HydrophobicContact CE1-CG1 4.26Å; F57-V80 HydrophobicContact CE2-CG1 3.84Å; F57-V80 HydrophobicContact CZ-CG1 3.48Å; F57-V80 VanDerWaalsContact CZ-CG1 3.48Å; C77-V80 PolarHBondContact O-N 3.12Å; W78-V80 VanDerWaalsContact C-N 3.34Å; W78-V80 PolarHBondContact O-N 2.82Å; V80-W82 PolarHBondContact O-N 2.8Å; V80-Q83 PolarHBondContact O-N 2.88Å; V80-L84 PolarHBondContact O-N 2.92Å |
| 81 | K | 76.4 | Confident | 73.6 | Confident | 43 Ų | 43 | 92.8 Ų | 92.8 | 19% | 0.187 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -62.8 | -40.7 | 176.7 | -76.4 | 178.5 | 170.4 | -174.6 | 0 | 111.8 | C56 F57 W65 C77 W78 L84 R85 | C56-K81 WeakPolarHBondContact O-CE 3.32Å; F57-K81 HydrophobicContact CE1-CG 4.49Å; W65-K81 HydrophobicContact CD2-CD 4.04Å; W65-K81 VanDerWaalsContact CE2-NZ 3.25Å; W65-K81 HydrophobicContact CE3-CB 4.34Å; W65-K81 HydrophobicContact CE3-CD 4.04Å; W65-K81 HydrophobicContact CH2-CB 3.9Å; W65-K81 HydrophobicContact CH2-CD 3.2Å; W65-K81 HydrophobicContact CH2-CG 4.14Å; W65-K81 HydrophobicContact CZ2-CD 3.16Å; W65-K81 HydrophobicContact CZ2-CG 4.49Å; W65-K81 VanDerWaalsContact CZ2-NZ 3.31Å; W65-K81 HydrophobicContact CZ3-CB 3.66Å; W65-K81 HydrophobicContact CZ3-CD 3.62Å; W65-K81 HydrophobicContact CZ3-CG 4.28Å; C77-K81 PolarHBondContact O-N 2.89Å; W78-K81 PolarHBondContact O-N 2.9Å; K81-L84 PolarHBondContact O-N 3.29Å; K81-R85 PolarHBondContact O-N 3.11Å |
| 82 | W | 77.8 | Confident | 74.3 | Confident | 120 Ų | 120 | 86.6 Ų | 86.6 | 46% | 0.455 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -65.7 | -45.6 | 177.9 | -173.6 | 95.4 | 0 | 0 | 0 | 112.2 | W78 V80 L84 R85 Q86 | W78-W82 AromaticContact CZ2-CD1 3.89Å; W78-W82 WeakPolarHBondContact O-CB 3.36Å; W78-W82 PolarHBondContact O-N 3.09Å; V80-W82 PolarHBondContact O-N 2.8Å; W82-L84 VanDerWaalsContact C-N 3.34Å; W82-L84 PolarHBondContact O-N 2.67Å; W82-R85 PolarHBondContact O-N 2.99Å; W82-Q86 HydrophobicContact CD2-CG 3.86Å; W82-Q86 HydrophobicContact CE3-CG 3.75Å; W82-Q86 HydrophobicContact CH2-CG 3.63Å; W82-Q86 HydrophobicContact CZ2-CG 3.73Å; W82-Q86 HydrophobicContact CZ3-CG 3.64Å; W82-Q86 WeakPolarHBondContact O-CG 3.26Å; W82-Q86 PolarHBondContact O-N 3.28Å |
| 83 | Q | 79.7 | Confident | 75 | Confident | 103 Ų | 103 | 90.9 Ų | 90.9 | 48% | 0.481 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -61.2 | -42.3 | 176.7 | -77.7 | -179.2 | -34.9 | 0 | 0 | 111.9 | Q79 V80 R85 Q86 L87 | Q79-Q83 WeakPolarHBondContact O-CB 3.42Å; Q79-Q83 VanDerWaalsContact O-CG 3.28Å; Q79-Q83 WeakPolarHBondContact O-CG 3.27Å; Q79-Q83 PolarHBondContact O-N 2.78Å; V80-Q83 PolarHBondContact O-N 2.88Å; Q83-R85 VanDerWaalsContact C-N 3.35Å; Q83-R85 PolarHBondContact O-N 3.03Å; Q83-Q86 PolarHBondContact O-N 2.82Å; Q83-L87 WeakPolarHBondContact O-CG 3.47Å; Q83-L87 PolarHBondContact O-N 2.91Å |
| 84 | L | 80.9 | Confident | 75.4 | Confident | 83 Ų | 83 | 92.9 Ų | 92.9 | 44% | 0.435 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 174.4 | -178.3 | 65.3 | 0 | 0 | 0 | 111.2 | F57 V80 K81 W82 Q86 L87 V88 | F57-L84 HydrophobicContact CD1-CD2 4.24Å; F57-L84 HydrophobicContact CE1-CB 4.45Å; F57-L84 HydrophobicContact CE1-CD2 3.43Å; F57-L84 VanDerWaalsContact CE1-CD2 3.43Å; F57-L84 HydrophobicContact CZ-CB 4.49Å; F57-L84 HydrophobicContact CZ-CD2 3.9Å; V80-L84 PolarHBondContact O-N 2.92Å; K81-L84 PolarHBondContact O-N 3.29Å; W82-L84 VanDerWaalsContact C-N 3.34Å; W82-L84 PolarHBondContact O-N 2.67Å; L84-Q86 VanDerWaalsContact C-N 3.32Å; L84-Q86 PolarHBondContact O-N 2.63Å; L84-L87 WeakPolarHBondContact O-CB 3.33Å; L84-L87 PolarHBondContact O-N 3.19Å; L84-V88 WeakPolarHBondContact O-CG2 2.94Å; L84-V88 PolarHBondContact O-N 3.07Å |
| 85 | R | 79.4 | Confident | 75.2 | Confident | 99 Ų | 99 | 86.9 Ų | 86.9 | 37% | 0.374 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.3 | -40.5 | 177.5 | -169.8 | -178.9 | -174.1 | -169 | 6.5 | 112.3 | K81 W82 Q83 V88 R89 | K81-R85 PolarHBondContact O-N 3.11Å; W82-R85 PolarHBondContact O-N 2.99Å; Q83-R85 VanDerWaalsContact C-N 3.35Å; Q83-R85 PolarHBondContact O-N 3.03Å; R85-V88 PolarHBondContact O-N 3.41Å; R85-R89 WeakPolarHBondContact O-CB 3.41Å; R85-R89 WeakPolarHBondContact O-CG 3.47Å; R85-R89 PolarHBondContact O-N 2.92Å |
| 86 | Q | 80 | Confident | 74.7 | Confident | 66 Ų | 66 | 87.5 Ų | 87.5 | 31% | 0.308 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.6 | -39.6 | 176 | -71.3 | -63.5 | -20.4 | 0 | 0 | 112 | W82 Q83 L84 R89 K90 | W82-Q86 HydrophobicContact CD2-CG 3.86Å; W82-Q86 HydrophobicContact CE3-CG 3.75Å; W82-Q86 HydrophobicContact CH2-CG 3.63Å; W82-Q86 HydrophobicContact CZ2-CG 3.73Å; W82-Q86 HydrophobicContact CZ3-CG 3.64Å; W82-Q86 WeakPolarHBondContact O-CG 3.26Å; W82-Q86 PolarHBondContact O-N 3.28Å; Q83-Q86 PolarHBondContact O-N 2.82Å; L84-Q86 VanDerWaalsContact C-N 3.32Å; L84-Q86 PolarHBondContact O-N 2.63Å; Q86-R89 PolarHBondContact O-N 2.8Å; Q86-K90 WeakPolarHBondContact O-CB 3.47Å; Q86-K90 PolarHBondContact O-N 3.41Å |
| 87 | L | 82.3 | Confident | 74.3 | Confident | 108 Ų | 108 | 87.7 Ų | 87.7 | 57% | 0.565 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -63.4 | -45 | 174.5 | -76.2 | 165.8 | 0 | 0 | 0 | 111.6 | Q83 L84 K90 M91 | Q83-L87 WeakPolarHBondContact O-CG 3.47Å; Q83-L87 PolarHBondContact O-N 2.91Å; L84-L87 WeakPolarHBondContact O-CB 3.33Å; L84-L87 PolarHBondContact O-N 3.19Å; L87-K90 PolarHBondContact O-N 3.37Å; L87-M91 WeakPolarHBondContact O-CB 3.35Å; L87-M91 WeakPolarHBondContact O-CG 3.45Å; L87-M91 PolarHBondContact O-N 3.05Å |
| 88 | V | 80.7 | Confident | 73.4 | Confident | 62 Ų | 62 | 91.4 Ų | 91.4 | 38% | 0.376 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.7 | -49.8 | 175.1 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | L84 R85 K90 M91 I92 | L84-V88 WeakPolarHBondContact O-CG2 2.94Å; L84-V88 PolarHBondContact O-N 3.07Å; R85-V88 PolarHBondContact O-N 3.41Å; V88-K90 VanDerWaalsContact C-N 3.34Å; V88-K90 PolarHBondContact O-N 2.85Å; V88-M91 PolarHBondContact O-N 3.09Å; V88-I92 HydrophobicContact CG1-CD1 3.76Å; V88-I92 VanDerWaalsContact O-CG1 3.25Å; V88-I92 WeakPolarHBondContact O-CG1 3.3Å; V88-I92 PolarHBondContact O-N 2.84Å |
| 89 | R | 79.8 | Confident | 72.2 | Confident | 112 Ų | 112 | 91.1 Ų | 91.1 | 42% | 0.423 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58.4 | -44.4 | 175.5 | -80.4 | -179.2 | 172.5 | 168.5 | -5.2 | 112.4 | R85 Q86 I92 L93 | R85-R89 WeakPolarHBondContact O-CB 3.41Å; R85-R89 WeakPolarHBondContact O-CG 3.47Å; R85-R89 PolarHBondContact O-N 2.92Å; Q86-R89 PolarHBondContact O-N 2.8Å; R89-I92 PolarHBondContact O-N 2.85Å; R89-L93 WeakPolarHBondContact O-CB 3.28Å; R89-L93 WeakPolarHBondContact O-CG 3.49Å; R89-L93 PolarHBondContact O-N 2.87Å |
| 90 | K | 80.5 | Confident | 71.2 | Confident | 143 Ų | 143 | 89.9 Ų | 89.9 | 62% | 0.622 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -65.4 | -39.4 | -179.9 | -171.4 | 175.1 | -177.2 | 177.6 | 0 | 111.4 | Q86 L87 V88 R94 | Q86-K90 WeakPolarHBondContact O-CB 3.47Å; Q86-K90 PolarHBondContact O-N 3.41Å; L87-K90 PolarHBondContact O-N 3.37Å; V88-K90 VanDerWaalsContact C-N 3.34Å; V88-K90 PolarHBondContact O-N 2.85Å; K90-R94 WeakPolarHBondContact O-CB 3.42Å; K90-R94 PolarHBondContact O-N 2.98Å |
| 91 | M | 72 | Confident | 69.6 | Low | 137 Ų | 137 | 91.7 Ų | 91.7 | 68% | 0.675 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.1 | -44.9 | 173.9 | -70.7 | -135.2 | -67.6 | 0 | 0 | 111.6 | L87 V88 L93 R94 T95 | L87-M91 WeakPolarHBondContact O-CB 3.35Å; L87-M91 WeakPolarHBondContact O-CG 3.45Å; L87-M91 PolarHBondContact O-N 3.05Å; V88-M91 PolarHBondContact O-N 3.09Å; M91-L93 PolarHBondContact O-N 3.06Å; M91-R94 PolarHBondContact O-N 3.39Å; M91-T95 PolarHBondContact O-N 2.88Å; M91-T95 PolarHBondContact O-OG1 2.94Å |
| 92 | I | 74.9 | Confident | 68.2 | Low | 38 Ų | 38 | 95 Ų | 95 | 20% | 0.195 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -58.4 | -47.8 | 175.8 | -66.9 | 164.8 | 0 | 0 | 0 | 110.8 | V88 R89 S96 F181 | V88-I92 HydrophobicContact CG1-CD1 3.76Å; V88-I92 VanDerWaalsContact O-CG1 3.25Å; V88-I92 WeakPolarHBondContact O-CG1 3.3Å; V88-I92 PolarHBondContact O-N 2.84Å; R89-I92 PolarHBondContact O-N 2.85Å; I92-S96 PolarHBondContact O-N 3.09Å; I92-S96 VanDerWaalsContact O-N 3.11Å; I92-F181 HydrophobicContact CG1-CD2 4.31Å |
| 93 | L | 73.1 | Confident | 66.7 | Low | 106 Ų | 106 | 94 Ų | 94 | 56% | 0.555 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -67.6 | -42.6 | -178.5 | -73 | 169.8 | 0 | 0 | 0 | 113 | R89 M91 T95 S96 E97 | R89-L93 WeakPolarHBondContact O-CB 3.28Å; R89-L93 WeakPolarHBondContact O-CG 3.49Å; R89-L93 PolarHBondContact O-N 2.87Å; M91-L93 PolarHBondContact O-N 3.06Å; L93-T95 VanDerWaalsContact C-N 3.31Å; L93-T95 PolarHBondContact O-N 3.38Å; L93-S96 WeakPolarHBondContact CA-OG 3.28Å; L93-S96 WeakPolarHBondContact O-CB 3.31Å; L93-S96 PolarHBondContact O-N 2.93Å; L93-S96 VanDerWaalsContact O-N 3.07Å; L93-S96 PolarHBondContact O-OG 2.9Å; L93-E97 PolarHBondContact O-N 3.45Å |
| 94 | R | 66.4 | Low | 64.7 | Low | 154 Ų | 154 | 97.2 Ų | 97.2 | 58% | 0.581 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.6 | -39.5 | 179.9 | -133.6 | 177.3 | 84.1 | -177.2 | 7.6 | 111.9 | K90 M91 S96 E97 E98 | K90-R94 WeakPolarHBondContact O-CB 3.42Å; K90-R94 PolarHBondContact O-N 2.98Å; M91-R94 PolarHBondContact O-N 3.39Å; R94-S96 VanDerWaalsContact C-N 3.33Å; R94-E97 PolarHBondContact O-N 2.95Å; R94-E98 IonicContact NE-OE1 3.78Å; R94-E98 IonicContact NH2-OE1 3.99Å; R94-E98 WeakPolarHBondContact O-CG 3.27Å; R94-E98 PolarHBondContact O-N 2.88Å |
| 95 | T | 56.3 | Low | 62.8 | Low | 32 Ų | 32 | 102.5 Ų | 102.5 | 20% | 0.196 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -69.2 | -32 | 174.9 | -54.3 | 0 | 0 | 0 | 0 | 111.9 | M91 L93 T99 F181 | M91-T95 PolarHBondContact O-N 2.88Å; M91-T95 PolarHBondContact O-OG1 2.94Å; L93-T95 VanDerWaalsContact C-N 3.31Å; L93-T95 PolarHBondContact O-N 3.38Å; T95-T99 WeakPolarHBondContact O-CB 3.33Å; T95-T99 PolarHBondContact O-N 2.98Å; T95-T99 PolarHBondContact O-OG1 2.65Å; T95-F181 HydrophobicContact CG2-CE2 4.25Å; T95-F181 HydrophobicContact CG2-CZ 4.15Å |
| 96 | S | 58.8 | Low | 61.1 | Low | 48 Ų | 48 | 106.7 Ų | 106.7 | 34% | 0.336 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.8 | -42.4 | 173.4 | 77.7 | 0 | 0 | 0 | 0 | 112.3 | I92 L93 R94 T99 I100 | I92-S96 PolarHBondContact O-N 3.09Å; I92-S96 VanDerWaalsContact O-N 3.11Å; L93-S96 WeakPolarHBondContact CA-OG 3.28Å; L93-S96 WeakPolarHBondContact O-CB 3.31Å; L93-S96 PolarHBondContact O-N 2.93Å; L93-S96 VanDerWaalsContact O-N 3.07Å; L93-S96 PolarHBondContact O-OG 2.9Å; R94-S96 VanDerWaalsContact C-N 3.33Å; S96-T99 PolarHBondContact O-N 3.43Å; S96-I100 VanDerWaalsContact O-CG1 3.28Å; S96-I100 WeakPolarHBondContact O-CG1 3.39Å; S96-I100 PolarHBondContact O-N 2.91Å |
| 97 | E | 58.9 | Low | 59 | Low | 134 Ų | 134 | 112.7 Ų | 112.7 | 63% | 0.626 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.7 | -39.7 | 176.1 | -73.1 | 177.6 | 167.6 | 0 | 0 | 112.6 | L93 R94 T99 I100 S101 | L93-E97 PolarHBondContact O-N 3.45Å; R94-E97 PolarHBondContact O-N 2.95Å; E97-T99 PolarHBondContact O-N 3.03Å; E97-I100 PolarHBondContact O-N 2.88Å; E97-S101 PolarHBondContact O-N 2.87Å; E97-S101 VanDerWaalsContact O-N 3.16Å; E97-S101 PolarHBondContact O-OG 2.89Å |
| 98 | E | 56.4 | Low | 56.8 | Low | 105 Ų | 105 | 116.1 Ų | 116.1 | 49% | 0.491 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.9 | -28.2 | 172.2 | -73.2 | 171.8 | -171.5 | 0 | 0 | 112.2 | R94 S101 T102 | R94-E98 IonicContact NE-OE1 3.78Å; R94-E98 IonicContact NH2-OE1 3.99Å; R94-E98 WeakPolarHBondContact O-CG 3.27Å; R94-E98 PolarHBondContact O-N 2.88Å; E98-S101 PolarHBondContact O-OG 3.02Å; E98-T102 PolarHBondContact O-OG1 2.96Å |
| 99 | T | 48.8 | Very low | 54.6 | Low | 39 Ų | 39 | 119.8 Ų | 119.8 | 24% | 0.239 | 59% | 0.589 | C | S | . | * | H | α-helix | trans | -81.2 | -32.1 | 175.8 | -50.8 | 0 | 0 | 0 | 0 | 112.5 | T95 S96 E97 T102 V103 K179 | T95-T99 WeakPolarHBondContact O-CB 3.33Å; T95-T99 PolarHBondContact O-N 2.98Å; T95-T99 PolarHBondContact O-OG1 2.65Å; S96-T99 PolarHBondContact O-N 3.43Å; E97-T99 PolarHBondContact O-N 3.03Å; T99-T102 PolarHBondContact O-OG1 2.72Å; T99-T102 VanDerWaalsContact O-OG1 3.11Å; T99-V103 VanDerWaalsContact O-CG2 3.27Å; T99-V103 WeakPolarHBondContact O-CG2 3.21Å; T99-K179 HydrophobicContact CG2-CD 4.15Å; T99-K179 PolarHBondContact OG1-NZ 3.37Å |
| 100 | I | 54 | Low | 52.3 | Low | 108 Ų | 108 | 121.5 Ų | 121.5 | 55% | 0.554 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -74.1 | -38.9 | 179.7 | -68.3 | 162.2 | 0 | 0 | 0 | 111.3 | S96 E97 T102 V103 | S96-I100 VanDerWaalsContact O-CG1 3.28Å; S96-I100 WeakPolarHBondContact O-CG1 3.39Å; S96-I100 PolarHBondContact O-N 2.91Å; E97-I100 PolarHBondContact O-N 2.88Å; I100-T102 PolarHBondContact O-N 2.65Å; I100-V103 PolarHBondContact O-N 2.82Å |
| 101 | S | 44.8 | Very low | 50.1 | Low | 85 Ų | 85 | 120 Ų | 120 | 59% | 0.594 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -19.7 | 178.7 | 46.8 | 0 | 0 | 0 | 0 | 114.1 | E97 E98 | E97-S101 PolarHBondContact O-N 2.87Å; E97-S101 VanDerWaalsContact O-N 3.16Å; E97-S101 PolarHBondContact O-OG 2.89Å; E98-S101 PolarHBondContact O-OG 3.02Å |
| 102 | T | 45.9 | Very low | 48.7 | Very low | 114 Ų | 114 | 119.2 Ų | 119.2 | 70% | 0.699 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -8.7 | 176.6 | 45.9 | 0 | 0 | 0 | 0 | 114.1 | E98 T99 I100 | E98-T102 PolarHBondContact O-OG1 2.96Å; T99-T102 PolarHBondContact O-OG1 2.72Å; T99-T102 VanDerWaalsContact O-OG1 3.11Å; I100-T102 PolarHBondContact O-N 2.65Å |
| 103 | V | 47.4 | Very low | 47.2 | Very low | 97 Ų | 97 | 125.6 Ų | 125.6 | 59% | 0.588 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.1 | -13.8 | -176.6 | 175 | 0 | 0 | 0 | 0 | 112.8 | T99 I100 E105 K106 | T99-V103 VanDerWaalsContact O-CG2 3.27Å; T99-V103 WeakPolarHBondContact O-CG2 3.21Å; I100-V103 PolarHBondContact O-N 2.82Å; V103-E105 PolarHBondContact O-N 2.98Å; V103-K106 PolarHBondContact O-N 3.47Å |
| 104 | Q | 37.3 | Very low | 45.5 | Very low | 171 Ų | 171 | 127 Ų | 127 | 80% | 0.799 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -3 | -171.4 | -131.7 | 174.9 | 8.8 | 0 | 0 | 115.7 | ||
| 105 | E | 42.2 | Very low | 44.1 | Very low | 195 Ų | 195 | 130.5 Ų | 130.5 | 91% | 0.911 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.6 | -4.1 | 178.6 | -105.3 | -172.9 | 172.8 | 0 | 0 | 115.9 | V103 | V103-E105 PolarHBondContact O-N 2.98Š|
| 106 | K | 43.5 | Very low | 43.2 | Very low | 186 Ų | 186 | 138.5 Ų | 138.5 | 81% | 0.809 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -140.1 | 104.2 | 172.6 | -108.1 | 178.6 | 177.7 | 176.3 | 0 | 110.6 | V103 | V103-K106 PolarHBondContact O-N 3.47Š|
| 107 | Q | 35.6 | Very low | 42.6 | Very low | 193 Ų | 193 | 145.8 Ų | 145.8 | 90% | 0.902 | 74% | 0.74 | S | S | * | * | 156.6 | 102.5 | 112.8 | -161.4 | 152.5 | 9.3 | 0 | 0 | 110.3 | |||||
| 108 | Q | 36.8 | Very low | 42.3 | Very low | 179 Ų | 179 | 141.9 Ų | 141.9 | 84% | 0.836 | 74% | 0.736 | S | S | * | * | trans | -81.7 | 138.1 | 163.6 | -81.6 | 179.1 | -15.3 | 0 | 0 | 110.3 | ||||
| 109 | N | 32.7 | Very low | 42.5 | Very low | 139 Ų | 139 | 143 Ų | 143 | 74% | 0.743 | 75% | 0.752 | S | S | * | * | trans | 64.4 | 105.1 | 152.6 | -62.5 | -11.7 | 0 | 0 | 0 | 120 | ||||
| 110 | T | 33.1 | Very low | 43.8 | Very low | 149 Ų | 149 | 146.2 Ų | 146.2 | 91% | 0.914 | 76% | 0.764 | S | S | * | * | 175.2 | 134.5 | 99.3 | 21.6 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 111 | S | 33.1 | Very low | 45.6 | Very low | 110 Ų | 110 | 151 Ų | 151 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -102 | 153.2 | 166.3 | 50.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 112 | P | 42.8 | Very low | 48 | Very low | 122 Ų | 122 | 147.5 Ų | 147.5 | 79% | 0.792 | 75% | 0.75 | S | S | * | * | -143.5 | 148 | 95.4 | 32 | -13.5 | 0 | 0 | 0 | 116.1 | |||||
| 113 | L | 42.6 | Very low | 50.4 | Low | 171 Ų | 171 | 143 Ų | 143 | 90% | 0.895 | 73% | 0.725 | S | S | * | * | trans | 63.1 | 75.4 | 150.2 | -143.3 | 83.8 | 0 | 0 | 0 | 118.3 | ||||
| 114 | V | 37.4 | Very low | 52.8 | Low | 136 Ų | 136 | 138.4 Ų | 138.4 | 82% | 0.824 | 70% | 0.697 | S | S | * | * | trans | -88.8 | 108.5 | 162.8 | 178.5 | 0 | 0 | 0 | 0 | 108.8 | E116 | V114-E116 PolarHBondContact O-N 3.38Š| ||
| 115 | R | 37.3 | Very low | 55.7 | Low | 228 Ų | 228 | 132 Ų | 132 | 86% | 0.86 | 67% | 0.667 | S | S | * | * | trans | -49.2 | 117.6 | 162.6 | -161.2 | 177.3 | -163.2 | 178.8 | 4.1 | 107.6 | R117 | R115-R117 VanDerWaalsContact C-N 3.31Å; R115-R117 PolarHBondContact O-N 3.23Å | ||
| 116 | E | 39 | Very low | 58.3 | Low | 199 Ų | 199 | 122.8 Ų | 122.8 | 93% | 0.93 | 62% | 0.624 | S | S | * | * | trans | -52.1 | 94.1 | 178.3 | -76.1 | -173.8 | 155.5 | 0 | 0 | 109.9 | V114 | V114-E116 PolarHBondContact O-N 3.38Š| ||
| 117 | R | 46.2 | Very low | 60.8 | Low | 201 Ų | 201 | 114.1 Ų | 114.1 | 76% | 0.758 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 119 | 166.3 | -132.5 | 177.4 | -87.4 | -137 | 0.3 | 103.4 | R115 | R115-R117 VanDerWaalsContact C-N 3.31Å; R115-R117 PolarHBondContact O-N 3.23Å |
| 118 | G | 51.5 | Low | 63.5 | Low | 52 Ų | 52 | 105.1 Ų | 105.1 | 54% | 0.536 | 55% | 0.545 | S | S | . | . | P | Polyproline II helix | trans | -49.5 | 163.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q120 | G118-Q120 PolarHBondContact O-N 3.48Š|
| 119 | P | 59.8 | Low | 65.9 | Low | 128 Ų | 128 | 97.7 Ų | 97.7 | 83% | 0.831 | 51% | 0.512 | S | S | * | . | P | Polyproline II helix | trans | -46.3 | 116.5 | -168.7 | 16.7 | -30.5 | 0 | 0 | 0 | 111 | R121 | P119-R121 PolarHBondContact O-N 2.95Š|
| 120 | Q | 77.9 | Confident | 67.9 | Low | 108 Ų | 108 | 100.9 Ų | 100.9 | 51% | 0.505 | 51% | 0.514 | S | S | . | . | trans | -69.6 | 108.5 | -173.1 | -126.7 | 168.9 | -61.5 | 0 | 0 | 107.8 | G118 V122 N166 | G118-Q120 PolarHBondContact O-N 3.48Å; Q120-V122 WeakPolarHBondContact O-CG2 3.1Å; Q120-V122 PolarHBondContact O-N 3.46Å; Q120-N166 WeakPolarHBondContact CB-ND2 3.29Å; Q120-N166 WeakPolarHBondContact CG-ND2 3.42Å; Q120-N166 PolarHBondContact NE2-OD1 3.15Å | ||
| 121 | R | 90.5 | Very high | 69.2 | Low | 209 Ų | 209 | 97.6 Ų | 97.6 | 79% | 0.789 | 51% | 0.51 | S | S | * | . | trans | -67 | 123.7 | -177.6 | -65.3 | -177.9 | 178.3 | -171.4 | -1.6 | 109.5 | P119 S165 N166 | P119-R121 PolarHBondContact O-N 2.95Å; R121-S165 CarbonylContact O-C 3.54Å; R121-S165 WeakPolarHBondContact O-CB 3.49Å; R121-S165 PolarHBondContact O-OG 2.95Å; R121-N166 PolarHBondContact O-ND2 3.48Å; R121-N166 VanDerWaalsContact O-ND2 3.08Å | ||
| 122 | V | 96 | Very high | 70.3 | Confident | 11 Ų | 11 | 100.2 Ų | 100.2 | 7% | 0.067 | 50% | 0.503 | C | S | . | . | trans | -108.2 | 95 | 178.4 | -172.7 | 0 | 0 | 0 | 0 | 108.6 | Q120 S165 N166 L167 E178 Y182 F278 L279 | Q120-V122 WeakPolarHBondContact O-CG2 3.1Å; Q120-V122 PolarHBondContact O-N 3.46Å; V122-S165 WeakPolarHBondContact CA-O 3.42Å; V122-N166 HydrophobicContact CB-CB 4.36Å; V122-N166 HydrophobicContact CG1-CB 4.21Å; V122-N166 HydrophobicContact CG2-CB 3.97Å; V122-L167 HydrophobicContact CG1-CD1 3.57Å; V122-E178 VanDerWaalsContact CG2-CD 3.49Å; V122-E178 HydrophobicContact CG2-CG 4.44Å; V122-E178 WeakPolarHBondContact CG2-OE1 3.38Å; V122-E178 WeakPolarHBondContact CG2-OE2 3.41Å; V122-Y182 HydrophobicContact CG1-CE1 3.78Å; V122-Y182 WeakPolarHBondContact CG1-OH 3.32Å; V122-F278 WeakPolarHBondContact O-CA 3.49Å; V122-L279 HydrophobicContact CB-CB 3.72Å; V122-L279 HydrophobicContact CB-CD2 4.04Å; V122-L279 HydrophobicContact CG1-CB 4.04Å; V122-L279 HydrophobicContact CG1-CD2 4.5Å; V122-L279 HydrophobicContact CG2-CD2 3.95Å; V122-L279 PolarHBondContact O-N 3.37Å | ||
| 123 | A | 96.7 | Very high | 70.7 | Confident | 19 Ų | 19 | 100 Ų | 100 | 16% | 0.157 | 50% | 0.504 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.6 | 152.3 | -177 | 0 | 0 | 0 | 0 | 0 | 112.3 | F163 S165 A277 F278 | A123-F163 HydrophobicContact CB-CE2 3.92Å; A123-F163 HydrophobicContact CB-CZ 4.23Å; A123-F163 WeakPolarHBondContact O-CE2 3.47Å; A123-S165 PolarHBondContact N-O 2.94Å; A123-S165 WeakPolarHBondContact O-CA 3.27Å; A123-S165 WeakPolarHBondContact O-CB 3.37Å; A123-S165 PolarHBondContact O-N 3.07Å; A123-S165 VanDerWaalsContact O-O 3.12Å; A123-A277 CarbonylContact C-O 3.56Å; A123-A277 VanDerWaalsContact CA-O 3.28Å; A123-A277 WeakPolarHBondContact CA-O 3.37Å; A123-F278 HydrophobicContact CB-CB 3.7Å |
| 124 | A | 96.9 | Very high | 71.1 | Confident | 1 Ų | 1 | 94.9 Ų | 94.9 | 1% | 0.008 | 48% | 0.477 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.9 | 141.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | F163 L164 L167 L174 G276 A277 | A124-F163 WeakPolarHBondContact CA-O 3.45Å; A124-L164 HydrophobicContact CB-CD2 3.68Å; A124-L167 HydrophobicContact CB-CB 4.23Å; A124-L167 HydrophobicContact CB-CD1 4.43Å; A124-L167 HydrophobicContact CB-CD2 4.07Å; A124-L167 HydrophobicContact CB-CG 4.5Å; A124-L174 HydrophobicContact CB-CD1 4.05Å; A124-L174 HydrophobicContact CB-CD2 3.82Å; A124-G276 CarbonylContact O-C 3.53Å; A124-G276 WeakPolarHBondContact O-CA 3.27Å; A124-A277 PolarHBondContact N-O 3.15Å; A124-A277 PolarHBondContact O-N 3.37Å |
| 125 | H | 97.4 | Very high | 71.4 | Confident | 37 Ų | 37 | 90.5 Ų | 90.5 | 17% | 0.171 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.9 | 116.8 | 164.5 | -176 | 95.7 | 0 | 0 | 0 | 107.4 | T127 H161 S162 F163 Y185 F274 | H125-T127 WeakPolarHBondContact NE2-CG2 3.19Å; H125-H161 PolarHBondContact CD2-O 3.34Å; H125-S162 CarbonylContact O-C 3.59Å; H125-S162 WeakPolarHBondContact O-CA 3.48Å; H125-S162 WeakPolarHBondContact O-CB 3.47Å; H125-F163 HydrophobicContact CB-CD1 3.99Å; H125-F163 HydrophobicContact CB-CE1 3.62Å; H125-F163 HydrophobicContact CB-CZ 4.29Å; H125-F163 PolarHBondContact N-O 3.47Å; H125-F163 PolarHBondContact O-N 3.36Å; H125-Y185 AromaticContact ND1-CE2 3.75Å; H125-Y185 AromaticContact ND1-CZ 3.77Å; H125-Y185 PolarHBondContact ND1-OH 2.9Å; H125-F274 AromaticContact CE1-CD2 3.61Å; H125-F274 AromaticContact CE1-CG 3.68Å; H125-F274 AromaticContact NE2-CG 3.96Å |
| 126 | I | 96.9 | Very high | 71.7 | Confident | 0 Ų | 0 | 86.6 Ų | 86.6 | 0% | 0 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.2 | 141.5 | -179.4 | 61.4 | 178.2 | 0 | 0 | 0 | 108.9 | W154 E155 L164 L169 L174 F274 F275 | I126-W154 HydrophobicContact CB-CB 4.27Å; I126-W154 HydrophobicContact CD1-CB 3.54Å; I126-W154 HydrophobicContact CD1-CD2 4.36Å; I126-W154 HydrophobicContact CD1-CG 3.66Å; I126-W154 HydrophobicContact CG1-CB 4Å; I126-W154 HydrophobicContact CG1-CD2 4.44Å; I126-W154 HydrophobicContact CG1-CG 4.14Å; I126-E155 VanDerWaalsContact CB-O 3.23Å; I126-E155 WeakPolarHBondContact CB-O 3.26Å; I126-E155 WeakPolarHBondContact CG2-O 3.22Å; I126-L164 HydrophobicContact CG2-CD2 3.93Å; I126-L164 HydrophobicContact CG2-CG 4.32Å; I126-L169 HydrophobicContact CD1-CD1 3.51Å; I126-L169 HydrophobicContact CD1-CD2 4.19Å; I126-L169 HydrophobicContact CD1-CG 4.41Å; I126-L174 HydrophobicContact CD1-CD2 4.04Å; I126-L174 HydrophobicContact CD1-CG 4.12Å; I126-L174 HydrophobicContact CG2-CD2 4.45Å; I126-F274 CarbonylContact O-C 3.45Å; I126-F274 VanDerWaalsContact O-CA 3.28Å; I126-F274 WeakPolarHBondContact O-CA 3.33Å; I126-F274 WeakPolarHBondContact O-CB 3.39Å; I126-F275 HydrophobicContact CD1-CB 4.39Å; I126-F275 HydrophobicContact CD1-CD1 3.99Å; I126-F275 HydrophobicContact CG1-CB 3.95Å; I126-F275 HydrophobicContact CG1-CD1 4.38Å; I126-F275 VanDerWaalsContact CG1-O 3.26Å; I126-F275 WeakPolarHBondContact CG1-O 3.44Å; I126-F275 PolarHBondContact N-O 3.43Å; I126-F275 PolarHBondContact O-N 2.95Å |
| 127 | T | 96.1 | Very high | 71.8 | Confident | 5 Ų | 5 | 81.8 Ų | 81.8 | 3% | 0.031 | 44% | 0.435 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 164.8 | -170.8 | 57.9 | 0 | 0 | 0 | 0 | 110.9 | H125 W154 E155 H161 H270 F274 | H125-T127 WeakPolarHBondContact NE2-CG2 3.19Å; T127-W154 CarbonylContact O-C 3.45Å; T127-W154 WeakPolarHBondContact O-CA 3.36Å; T127-E155 PolarHBondContact O-N 3.4Å; T127-H161 HydrophobicContact CG2-CB 4.47Å; T127-H161 WeakPolarHBondContact CG2-O 3.35Å; T127-H270 WeakPolarHBondContact CB-O 3.44Å; T127-H270 HydrophobicContact CG2-CB 4.32Å; T127-H270 VanDerWaalsContact CG2-O 3.3Å; T127-H270 WeakPolarHBondContact CG2-O 3.33Å; T127-F274 HydrophobicContact CG2-CB 4.13Å |
| 128 | G | 92.9 | Very high | 71.7 | Confident | 3 Ų | 3 | 76.3 Ų | 76.3 | 3% | 0.031 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.9 | 155.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | M268 S273 | G128-M268 CarbonylContact C-O 3.52Å; G128-M268 VanDerWaalsContact CA-CE 3.46Å; G128-M268 WeakPolarHBondContact CA-O 3.43Å; G128-S273 PolarHBondContact N-O 2.96Å |
| 129 | T | 86.4 | Confident | 71.3 | Confident | 24 Ų | 24 | 79.3 Ų | 79.3 | 15% | 0.147 | 44% | 0.437 | C | S | . | . | trans | -107.4 | 113.3 | 175.3 | 48.2 | 0 | 0 | 0 | 0 | 111.2 | G131 S153 E155 M268 | T129-G131 PolarHBondContact O-N 2.89Å; T129-S153 PolarHBondContact OG1-O 3.28Å; T129-E155 HydrophobicContact CG2-CB 3.52Å; T129-E155 HydrophobicContact CG2-CG 4.14Å; T129-E155 WeakPolarHBondContact CG2-OE2 3.25Å; T129-M268 PolarHBondContact N-O 3.47Å | ||
| 130 | R | 74.4 | Confident | 70.7 | Confident | 205 Ų | 205 | 79 Ų | 79 | 77% | 0.774 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | 125.6 | 173.6 | -163.6 | 179.5 | -164.8 | -154.8 | -6.1 | 110.1 | D269 | R130-D269 WeakPolarHBondContact CD-OD1 3.39Å; R130-D269 WeakPolarHBondContact CG-OD1 3.41Å; R130-D269 IonicContact NE-OD1 3.93Å; R130-D269 PolarHBondContact NE-OD1 3.41Å; R130-D269 VanDerWaalsContact NE-OD1 3.15Å; R130-D269 IonicContact NE-OD2 2.82Å |
| 131 | G | 62.2 | Low | 69.2 | Low | 80 Ų | 80 | 77.4 Ų | 77.4 | 83% | 0.825 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 91.9 | -6.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | T129 S133 | T129-G131 PolarHBondContact O-N 2.89Å; G131-S133 PolarHBondContact O-N 3.33Å |
| 132 | R | 55.6 | Low | 67.2 | Low | 166 Ų | 166 | 77.2 Ų | 77.2 | 63% | 0.626 | 43% | 0.434 | S | S | * | . | trans | -95.3 | 80.1 | 166.6 | -118.6 | 177.9 | 163.5 | -162.4 | -7.8 | 108.5 | N134 T135 | R132-N134 PolarHBondContact O-N 2.92Å; R132-N134 VanDerWaalsContact O-N 3.1Å; R132-T135 HydrophobicContact CB-CG2 4.01Å; R132-T135 HydrophobicContact CG-CG2 3.39Å; R132-T135 VanDerWaalsContact CZ-CG2 3.49Å | ||
| 133 | S | 50.2 | Low | 65.1 | Low | 116 Ų | 116 | 83.4 Ų | 83.4 | 81% | 0.811 | 47% | 0.467 | S | S | * | . | trans | -49.6 | 121.6 | 166.7 | -175.4 | 0 | 0 | 0 | 0 | 108.2 | G131 T135 | G131-S133 PolarHBondContact O-N 3.33Å; S133-T135 PolarHBondContact O-N 3.3Å | ||
| 134 | N | 51 | Low | 63.6 | Low | 64 Ų | 64 | 85 Ų | 85 | 34% | 0.342 | 47% | 0.471 | S | S | . | . | trans | 6.6 | 84.9 | 179.8 | -76.8 | 0.5 | 0 | 0 | 0 | 114 | R132 L136 E263 | R132-N134 PolarHBondContact O-N 2.92Å; R132-N134 VanDerWaalsContact O-N 3.1Å; N134-L136 PolarHBondContact O-N 3.31Å; N134-E263 PolarHBondContact ND2-OE1 3.02Å; N134-E263 PolarHBondContact OD1-OE1 2.85Å | ||
| 135 | T | 44.8 | Very low | 63.2 | Low | 45 Ų | 45 | 91.6 Ų | 91.6 | 28% | 0.276 | 50% | 0.5 | S | S | . | . | S | Bend | trans | -59 | 103.9 | 175.4 | 45.1 | 0 | 0 | 0 | 0 | 109.3 | R132 S133 | R132-T135 HydrophobicContact CB-CG2 4.01Å; R132-T135 HydrophobicContact CG-CG2 3.39Å; R132-T135 VanDerWaalsContact CZ-CG2 3.49Å; S133-T135 PolarHBondContact O-N 3.3Å |
| 136 | L | 43.1 | Very low | 63 | Low | 145 Ų | 145 | 90.7 Ų | 90.7 | 76% | 0.759 | 50% | 0.499 | S | S | * | . | trans | 48.9 | 102.4 | -177.6 | -82 | 78.1 | 0 | 0 | 0 | 112 | N134 S138 | N134-L136 PolarHBondContact O-N 3.31Å; L136-S138 PolarHBondContact O-N 3.49Å | ||
| 137 | S | 41.8 | Very low | 62.9 | Low | 98 Ų | 98 | 95.3 Ų | 95.3 | 69% | 0.685 | 52% | 0.523 | S | S | * | . | trans | -56 | 81.6 | 144.6 | 13.8 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 138 | S | 44.2 | Very low | 62.9 | Low | 87 Ų | 87 | 97 Ų | 97 | 61% | 0.608 | 54% | 0.541 | S | S | * | . | trans | -53.5 | 124.7 | 161.7 | -166.7 | 0 | 0 | 0 | 0 | 104.4 | L136 N140 | L136-S138 PolarHBondContact O-N 3.49Å; S138-N140 PolarHBondContact O-N 3.26Å | ||
| 139 | P | 42.8 | Very low | 63 | Low | 114 Ų | 114 | 103.4 Ų | 103.4 | 74% | 0.74 | 56% | 0.564 | S | S | * | * | trans | -51.9 | 118 | -169.7 | 14.1 | -23.6 | 0 | 0 | 0 | 107.2 | S141 | P139-S141 PolarHBondContact O-N 3.36Š| ||
| 140 | N | 47.8 | Very low | 63.5 | Low | 122 Ų | 122 | 104.3 Ų | 104.3 | 65% | 0.652 | 57% | 0.566 | S | S | * | * | trans | -36.7 | 118.7 | 174.6 | -87.7 | -2.6 | 0 | 0 | 0 | 106.6 | S138 K142 | S138-N140 PolarHBondContact O-N 3.26Å; N140-K142 VanDerWaalsContact C-N 3.34Å; N140-K142 PolarHBondContact O-N 3.47Å | ||
| 141 | S | 46.7 | Very low | 64.5 | Low | 75 Ų | 75 | 94.8 Ų | 94.8 | 52% | 0.524 | 53% | 0.531 | S | S | . | . | trans | -55.9 | 114.6 | 165.2 | 83 | 0 | 0 | 0 | 0 | 103.7 | P139 N143 E144 | P139-S141 PolarHBondContact O-N 3.36Å; S141-N143 PolarHBondContact O-N 2.95Å; S141-E144 PolarHBondContact O-N 2.89Å | ||
| 142 | K | 47.3 | Very low | 66 | Low | 204 Ų | 204 | 93.3 Ų | 93.3 | 89% | 0.887 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | 9 | -167.1 | -70.3 | -179.4 | 175.2 | -179.8 | 0 | 113.4 | N140 | N140-K142 VanDerWaalsContact C-N 3.34Å; N140-K142 PolarHBondContact O-N 3.47Å |
| 143 | N | 51.6 | Low | 67.7 | Low | 141 Ų | 141 | 85.8 Ų | 85.8 | 75% | 0.754 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -126.9 | 8.9 | -172.1 | -61.9 | -17.7 | 0 | 0 | 0 | 113.4 | S141 K145 | S141-N143 PolarHBondContact O-N 2.95Å; N143-K145 PolarHBondContact O-N 3.3Å; N143-K145 VanDerWaalsContact O-N 3.12Å |
| 144 | E | 66.5 | Low | 69.8 | Low | 52 Ų | 52 | 80.9 Ų | 80.9 | 24% | 0.243 | 44% | 0.44 | C | S | . | . | trans | -72.9 | 104.9 | 179.8 | -164 | 163 | -164.7 | 0 | 0 | 110.1 | S141 A146 K150 | S141-E144 PolarHBondContact O-N 2.89Å; E144-A146 HydrophobicContact CG-CB 4.22Å; E144-A146 PolarHBondContact O-N 3.24Å; E144-A146 VanDerWaalsContact O-N 3.16Å; E144-K150 IonicContact OE1-NZ 3.66Å; E144-K150 PolarHBondContact OE1-NZ 3.41Å; E144-K150 VanDerWaalsContact OE1-NZ 3.07Å; E144-K150 IonicContact OE2-NZ 3.47Å | ||
| 145 | K | 87.7 | Confident | 71.7 | Confident | 141 Ų | 141 | 80 Ų | 80 | 61% | 0.613 | 43% | 0.434 | S | S | * | . | trans | -72.5 | 3.8 | -178.8 | -61.9 | -171.2 | -168.6 | 163.6 | 0 | 114.6 | N143 D218 | N143-K145 PolarHBondContact O-N 3.3Å; N143-K145 VanDerWaalsContact O-N 3.12Å; K145-D218 HydrophobicContact CD-CB 4.29Å; K145-D218 VanDerWaalsContact CD-OD1 3.27Å; K145-D218 WeakPolarHBondContact CD-OD1 3.38Å; K145-D218 WeakPolarHBondContact CE-OD1 3.29Å; K145-D218 IonicContact NZ-OD1 2.72Å; K145-D218 PolarHBondContact NZ-OD1 2.97Å; K145-D218 VanDerWaalsContact NZ-OD1 3.12Å; K145-D218 IonicContact NZ-OD2 2.76Å; K145-D218 PolarHBondContact NZ-OD2 3.41Å | ||
| 146 | A | 93.3 | Very high | 73.1 | Confident | 17 Ų | 17 | 80.3 Ų | 80.3 | 14% | 0.14 | 44% | 0.438 | C | S | . | . | trans | -70.3 | 142.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | E144 Y211 P219 F257 | E144-A146 HydrophobicContact CG-CB 4.22Å; E144-A146 PolarHBondContact O-N 3.24Å; E144-A146 VanDerWaalsContact O-N 3.16Å; A146-Y211 HydrophobicContact CB-CD1 4.39Å; A146-Y211 HydrophobicContact CB-CD2 4.18Å; A146-Y211 HydrophobicContact CB-CE1 4.13Å; A146-Y211 HydrophobicContact CB-CE2 3.89Å; A146-Y211 HydrophobicContact CB-CG 4.42Å; A146-P219 HydrophobicContact CB-CB 4.41Å; A146-P219 HydrophobicContact CB-CG 3.81Å; A146-F257 HydrophobicContact CB-CE2 4.26Å; A146-F257 HydrophobicContact CB-CZ 4.15Å | ||
| 147 | L | 95.7 | Very high | 74.7 | Confident | 97 Ų | 97 | 76.6 Ų | 76.6 | 51% | 0.508 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -77.5 | 148.4 | 173.9 | -62.8 | 174.7 | 0 | 0 | 0 | 110.2 | Y209 Y211 S259 | L147-Y209 HydrophobicContact CB-CD1 4.47Å; L147-Y209 HydrophobicContact CB-CD2 4.37Å; L147-Y209 HydrophobicContact CB-CE1 4.05Å; L147-Y209 HydrophobicContact CB-CE2 3.93Å; L147-Y209 HydrophobicContact CD1-CE1 3.91Å; L147-Y211 WeakPolarHBondContact CB-OH 3.3Å; L147-Y211 PolarHBondContact N-OH 3.46Å; L147-S259 WeakPolarHBondContact O-CB 3.2Å; L147-S259 PolarHBondContact O-OG 3.45Å |
| 148 | G | 94.6 | Very high | 75.9 | Confident | 40 Ų | 40 | 83.2 Ų | 83.2 | 41% | 0.412 | 43% | 0.434 | S | S | . | . | S | Bend | trans | 76 | -160.5 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | V260 | G148-V260 CarbonylContact C-O 3.49Å; G148-V260 WeakPolarHBondContact CA-O 3.38Å |
| 149 | R | 95.8 | Very high | 76.9 | Confident | 138 Ų | 138 | 81.5 Ų | 81.5 | 52% | 0.521 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 128.6 | 175.7 | -67 | 177 | 54.4 | 145.5 | -4.7 | 109.5 | I151 S259 V260 E263 | R149-I151 PolarHBondContact O-N 3.43Å; R149-S259 PolarHBondContact N-OG 2.95Å; R149-S259 VanDerWaalsContact N-OG 3.08Å; R149-S259 VanDerWaalsContact O-CA 3.32Å; R149-S259 WeakPolarHBondContact O-CA 3.48Å; R149-S259 PolarHBondContact O-OG 3.48Å; R149-V260 PolarHBondContact N-O 3.39Å; R149-V260 PolarHBondContact O-N 3.2Å; R149-E263 HydrophobicContact CB-CB 4.3Å; R149-E263 WeakPolarHBondContact CB-OE2 3.28Å; R149-E263 WeakPolarHBondContact CD-OE2 3.47Å; R149-E263 IonicContact CZ-OE2 3.28Å; R149-E263 VanDerWaalsContact CZ-OE2 3.28Å; R149-E263 IonicContact NE-OE2 3.07Å; R149-E263 PolarHBondContact NE-OE2 3.04Å; R149-E263 IonicContact NH2-OE2 3.18Å; R149-E263 PolarHBondContact NH2-OE2 2.92Å |
| 150 | K | 96.5 | Very high | 78.4 | Confident | 44 Ų | 44 | 80 Ų | 80 | 19% | 0.191 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.5 | 128.5 | 178.9 | 177.4 | 166.3 | 68.4 | -160.8 | 0 | 110.5 | E144 N152 E173 F257 V258 S259 | E144-K150 IonicContact OE1-NZ 3.66Å; E144-K150 PolarHBondContact OE1-NZ 3.41Å; E144-K150 VanDerWaalsContact OE1-NZ 3.07Å; E144-K150 IonicContact OE2-NZ 3.47Å; K150-N152 PolarHBondContact O-N 2.79Å; K150-E173 HydrophobicContact CD-CG 4.37Å; K150-E173 IonicContact NZ-OE1 3.21Å; K150-E173 PolarHBondContact NZ-OE1 3.44Å; K150-F257 HydrophobicContact CB-CD2 4.16Å; K150-F257 HydrophobicContact CB-CE2 4.33Å; K150-F257 HydrophobicContact CD-CB 3.99Å; K150-F257 HydrophobicContact CD-CD1 4.43Å; K150-F257 HydrophobicContact CD-CD2 3.43Å; K150-F257 VanDerWaalsContact CD-CD2 3.43Å; K150-F257 HydrophobicContact CD-CE2 3.92Å; K150-F257 HydrophobicContact CD-CG 3.71Å; K150-F257 HydrophobicContact CG-CB 4.35Å; K150-F257 HydrophobicContact CG-CD2 3.64Å; K150-F257 HydrophobicContact CG-CE2 4.24Å; K150-F257 HydrophobicContact CG-CG 4.25Å; K150-V258 WeakPolarHBondContact CA-O 3.28Å; K150-S259 PolarHBondContact N-OG 3.2Å |
| 151 | I | 95.5 | Very high | 80.1 | Confident | 4 Ų | 4 | 79.8 Ų | 79.8 | 2% | 0.021 | 42% | 0.423 | C | S | . | . | trans | -78.6 | 120.5 | 172.6 | -57.8 | 176.4 | 0 | 0 | 0 | 108.2 | R149 W154 T188 V258 V260 M268 | R149-I151 PolarHBondContact O-N 3.43Å; I151-W154 HydrophobicContact CB-CZ2 3.75Å; I151-W154 HydrophobicContact CD1-CH2 4.11Å; I151-W154 HydrophobicContact CD1-CZ2 3.82Å; I151-W154 HydrophobicContact CG1-CZ2 4.38Å; I151-W154 HydrophobicContact CG2-CD2 4.03Å; I151-W154 VanDerWaalsContact CG2-CE2 3.46Å; I151-W154 HydrophobicContact CG2-CH2 4.07Å; I151-W154 HydrophobicContact CG2-CZ2 3.5Å; I151-W154 VanDerWaalsContact CG2-CZ2 3.5Å; I151-W154 PolarHBondContact O-NE1 2.92Å; I151-T188 HydrophobicContact CD1-CG2 3.84Å; I151-V258 HydrophobicContact CD1-CG1 4.08Å; I151-V258 PolarHBondContact N-O 3.33Å; I151-V260 HydrophobicContact CD1-CG1 3.84Å; I151-V260 HydrophobicContact CD1-CG2 4.06Å; I151-V260 HydrophobicContact CG1-CG1 4.49Å; I151-V260 HydrophobicContact CG1-CG2 4.02Å; I151-M268 HydrophobicContact CG2-CE 3.68Å; I151-M268 HydrophobicContact CG2-SD 4.29Å | ||
| 152 | N | 93.8 | Very high | 82.3 | Confident | 49 Ų | 49 | 76.4 Ų | 76.4 | 26% | 0.262 | 40% | 0.399 | S | S | . | . | trans | -119 | -1.1 | -176.7 | 64 | 18.2 | 0 | 0 | 0 | 114.5 | K150 W154 | K150-N152 PolarHBondContact O-N 2.79Å; N152-W154 VanDerWaalsContact C-N 3.35Å; N152-W154 PolarHBondContact O-N 3.29Å | ||
| 153 | S | 92.1 | Very high | 84.5 | Confident | 8 Ų | 8 | 71 Ų | 71 | 6% | 0.056 | 38% | 0.376 | C | S | . | . | trans | -95.1 | 25.5 | -175.5 | 49.5 | 0 | 0 | 0 | 0 | 113.9 | T129 M268 | T129-S153 PolarHBondContact OG1-O 3.28Å; S153-M268 WeakPolarHBondContact OG-CE 3.45Å | ||
| 154 | W | 94.2 | Very high | 86.6 | Confident | 13 Ų | 13 | 66.8 Ų | 66.8 | 5% | 0.049 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.1 | 137.1 | 175.4 | -57 | 119.6 | 0 | 0 | 0 | 111.7 | I126 T127 I151 N152 L169 V258 M268 F275 | I126-W154 HydrophobicContact CB-CB 4.27Å; I126-W154 HydrophobicContact CD1-CB 3.54Å; I126-W154 HydrophobicContact CD1-CD2 4.36Å; I126-W154 HydrophobicContact CD1-CG 3.66Å; I126-W154 HydrophobicContact CG1-CB 4Å; I126-W154 HydrophobicContact CG1-CD2 4.44Å; I126-W154 HydrophobicContact CG1-CG 4.14Å; T127-W154 CarbonylContact O-C 3.45Å; T127-W154 WeakPolarHBondContact O-CA 3.36Å; I151-W154 HydrophobicContact CB-CZ2 3.75Å; I151-W154 HydrophobicContact CD1-CH2 4.11Å; I151-W154 HydrophobicContact CD1-CZ2 3.82Å; I151-W154 HydrophobicContact CG1-CZ2 4.38Å; I151-W154 HydrophobicContact CG2-CD2 4.03Å; I151-W154 VanDerWaalsContact CG2-CE2 3.46Å; I151-W154 HydrophobicContact CG2-CH2 4.07Å; I151-W154 HydrophobicContact CG2-CZ2 3.5Å; I151-W154 VanDerWaalsContact CG2-CZ2 3.5Å; I151-W154 PolarHBondContact O-NE1 2.92Å; N152-W154 VanDerWaalsContact C-N 3.35Å; N152-W154 PolarHBondContact O-N 3.29Å; W154-L169 HydrophobicContact CB-CD2 3.9Å; W154-L169 WeakPolarHBondContact O-CD2 2.94Å; W154-V258 HydrophobicContact CZ2-CB 4.08Å; W154-V258 HydrophobicContact CZ2-CG1 4.47Å; W154-V258 HydrophobicContact CZ2-CG2 4.21Å; W154-M268 HydrophobicContact CE3-CE 3.93Å; W154-M268 HydrophobicContact CH2-CE 4.39Å; W154-M268 HydrophobicContact CZ3-CE 3.85Å; W154-F275 HydrophobicContact CD2-CB 4.41Å; W154-F275 HydrophobicContact CH2-CB 4.31Å; W154-F275 HydrophobicContact CZ2-CB 4.04Å |
| 155 | E | 89.4 | Confident | 87.9 | Confident | 46 Ų | 46 | 66.2 Ų | 66.2 | 22% | 0.215 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 134.2 | 171.2 | -168.9 | 47 | -95 | 0 | 0 | 110.7 | I126 T127 T129 S157 | I126-E155 VanDerWaalsContact CB-O 3.23Å; I126-E155 WeakPolarHBondContact CB-O 3.26Å; I126-E155 WeakPolarHBondContact CG2-O 3.22Å; T127-E155 PolarHBondContact O-N 3.4Å; T129-E155 HydrophobicContact CG2-CB 3.52Å; T129-E155 HydrophobicContact CG2-CG 4.14Å; T129-E155 WeakPolarHBondContact CG2-OE2 3.25Å; E155-S157 WeakPolarHBondContact OE1-CA 3.45Å; E155-S157 WeakPolarHBondContact OE1-CB 3.47Å; E155-S157 PolarHBondContact OE1-N 3.16Å; E155-S157 PolarHBondContact OE1-OG 3.04Å |
| 156 | S | 75.8 | Confident | 88.2 | Confident | 51 Ų | 51 | 61.6 Ų | 61.6 | 36% | 0.357 | 34% | 0.337 | S | S | . | . | trans | -121.1 | -10.1 | 175.3 | 49.7 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 157 | S | 75 | Confident | 88.3 | Confident | 67 Ų | 67 | 61.3 Ų | 61.3 | 47% | 0.469 | 33% | 0.333 | S | S | . | . | S | Bend | trans | -56.9 | 145.6 | 170.5 | -54.1 | 0 | 0 | 0 | 0 | 108.7 | E155 S159 S162 | E155-S157 WeakPolarHBondContact OE1-CA 3.45Å; E155-S157 WeakPolarHBondContact OE1-CB 3.47Å; E155-S157 PolarHBondContact OE1-N 3.16Å; E155-S157 PolarHBondContact OE1-OG 3.04Å; S157-S159 PolarHBondContact O-N 2.91Å; S157-S159 PolarHBondContact O-OG 3.5Å; S157-S162 PolarHBondContact O-OG 3.27Å |
| 158 | R | 68.3 | Low | 88.3 | Confident | 237 Ų | 237 | 60.3 Ų | 60.3 | 89% | 0.894 | 33% | 0.325 | S | S | * | . | trans | -75.4 | 52.8 | 176.6 | -152.8 | -178.9 | -168.7 | -163.2 | 2.9 | 110.3 | ||||
| 159 | S | 65.2 | Low | 88.3 | Confident | 51 Ų | 51 | 60 Ų | 60 | 36% | 0.357 | 31% | 0.314 | S | S | . | . | trans | -69.5 | 141.6 | 161.8 | 33.4 | 0 | 0 | 0 | 0 | 107.6 | S157 H161 S162 | S157-S159 PolarHBondContact O-N 2.91Å; S157-S159 PolarHBondContact O-OG 3.5Å; S159-H161 PolarHBondContact O-N 3.28Å; S159-S162 PolarHBondContact O-N 2.94Å; S159-S162 PolarHBondContact O-OG 3.18Å; S159-S162 PolarHBondContact OG-OG 3.46Å | ||
| 160 | G | 72.9 | Confident | 88.2 | Confident | 84 Ų | 84 | 60.8 Ų | 60.8 | 87% | 0.866 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.4 | -7.9 | -166.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||
| 161 | H | 84.5 | Confident | 88 | Confident | 116 Ų | 116 | 64.3 Ų | 64.3 | 54% | 0.537 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.1 | -4.6 | 178.2 | -53.2 | -70.3 | 0 | 0 | 0 | 114 | H125 T127 S159 H270 | H125-H161 PolarHBondContact CD2-O 3.34Å; T127-H161 HydrophobicContact CG2-CB 4.47Å; T127-H161 WeakPolarHBondContact CG2-O 3.35Å; S159-H161 PolarHBondContact O-N 3.28Å; H161-H270 AromaticContact CD2-CD2 3.49Å; H161-H270 PolarHBondContact CD2-CD2 3.49Å; H161-H270 VanDerWaalsContact CD2-CD2 3.49Å; H161-H270 AromaticContact CD2-NE2 3.35Å; H161-H270 PolarHBondContact CD2-NE2 3.01Å; H161-H270 VanDerWaalsContact CD2-NE2 3.35Å; H161-H270 AromaticContact CG-CD2 3.47Å; H161-H270 VanDerWaalsContact CG-CD2 3.47Å; H161-H270 AromaticContact CG-NE2 3.71Å; H161-H270 AromaticContact NE2-NE2 3.66Å |
| 162 | S | 92.8 | Very high | 87.9 | Confident | 4 Ų | 4 | 64.2 Ų | 64.2 | 3% | 0.028 | 34% | 0.338 | C | S | . | . | trans | -135 | 141.9 | -178.6 | 52.9 | 0 | 0 | 0 | 0 | 112 | H125 S157 S159 | H125-S162 CarbonylContact O-C 3.59Å; H125-S162 WeakPolarHBondContact O-CA 3.48Å; H125-S162 WeakPolarHBondContact O-CB 3.47Å; S157-S162 PolarHBondContact O-OG 3.27Å; S159-S162 PolarHBondContact O-N 2.94Å; S159-S162 PolarHBondContact O-OG 3.18Å; S159-S162 PolarHBondContact OG-OG 3.46Å | ||
| 163 | F | 94 | Very high | 88.1 | Confident | 90 Ų | 90 | 62.2 Ų | 62.2 | 40% | 0.395 | 33% | 0.327 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.9 | 156 | 176.1 | 73.9 | -86.6 | 0 | 0 | 0 | 112.5 | A123 A124 H125 | A123-F163 HydrophobicContact CB-CE2 3.92Å; A123-F163 HydrophobicContact CB-CZ 4.23Å; A123-F163 WeakPolarHBondContact O-CE2 3.47Å; A124-F163 WeakPolarHBondContact CA-O 3.45Å; H125-F163 HydrophobicContact CB-CD1 3.99Å; H125-F163 HydrophobicContact CB-CE1 3.62Å; H125-F163 HydrophobicContact CB-CZ 4.29Å; H125-F163 PolarHBondContact N-O 3.47Å; H125-F163 PolarHBondContact O-N 3.36Å |
| 164 | L | 94.8 | Very high | 88.4 | Confident | 54 Ų | 54 | 61.8 Ų | 61.8 | 28% | 0.283 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 126.6 | 172.3 | -69.2 | 169 | 0 | 0 | 0 | 108.5 | A124 I126 L167 L169 L174 | A124-L164 HydrophobicContact CB-CD2 3.68Å; I126-L164 HydrophobicContact CG2-CD2 3.93Å; I126-L164 HydrophobicContact CG2-CG 4.32Å; L164-L167 HydrophobicContact CD2-CB 4.48Å; L164-L169 HydrophobicContact CD1-CB 4.08Å; L164-L174 HydrophobicContact CD2-CD2 3.58Å |
| 165 | S | 94.4 | Very high | 88.6 | Confident | 40 Ų | 40 | 61.6 Ų | 61.6 | 28% | 0.28 | 33% | 0.325 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.3 | 110.2 | 177.4 | -171.4 | 0 | 0 | 0 | 0 | 109.2 | R121 V122 A123 L167 | R121-S165 CarbonylContact O-C 3.54Å; R121-S165 WeakPolarHBondContact O-CB 3.49Å; R121-S165 PolarHBondContact O-OG 2.95Å; V122-S165 WeakPolarHBondContact CA-O 3.42Å; A123-S165 PolarHBondContact N-O 2.94Å; A123-S165 WeakPolarHBondContact O-CA 3.27Å; A123-S165 WeakPolarHBondContact O-CB 3.37Å; A123-S165 PolarHBondContact O-N 3.07Å; A123-S165 VanDerWaalsContact O-O 3.12Å; S165-L167 VanDerWaalsContact O-CD1 3.26Å; S165-L167 WeakPolarHBondContact O-CD1 3.39Å; S165-L167 PolarHBondContact O-N 3.45Å |
| 166 | N | 94.3 | Very high | 89 | Confident | 43 Ų | 43 | 59.4 Ų | 59.4 | 23% | 0.23 | 31% | 0.314 | C | S | . | . | S | Bend | trans | 54.5 | 24.8 | -172 | -57.9 | -38.6 | 0 | 0 | 0 | 114.7 | Q120 R121 V122 Q177 | Q120-N166 WeakPolarHBondContact CB-ND2 3.29Å; Q120-N166 WeakPolarHBondContact CG-ND2 3.42Å; Q120-N166 PolarHBondContact NE2-OD1 3.15Å; R121-N166 PolarHBondContact O-ND2 3.48Å; R121-N166 VanDerWaalsContact O-ND2 3.08Å; V122-N166 HydrophobicContact CB-CB 4.36Å; V122-N166 HydrophobicContact CG1-CB 4.21Å; V122-N166 HydrophobicContact CG2-CB 3.97Å; N166-Q177 VanDerWaalsContact O-CB 3.26Å; N166-Q177 WeakPolarHBondContact O-CB 3.39Å; N166-Q177 WeakPolarHBondContact O-CG 3.3Å |
| 167 | L | 95.1 | Very high | 90 | Very high | 11 Ų | 11 | 60.1 Ų | 60.1 | 6% | 0.058 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.8 | 159.9 | 163.7 | -69.2 | 86 | 0 | 0 | 0 | 107.3 | V122 A124 L164 S165 L174 I176 Y182 | V122-L167 HydrophobicContact CG1-CD1 3.57Å; A124-L167 HydrophobicContact CB-CB 4.23Å; A124-L167 HydrophobicContact CB-CD1 4.43Å; A124-L167 HydrophobicContact CB-CD2 4.07Å; A124-L167 HydrophobicContact CB-CG 4.5Å; L164-L167 HydrophobicContact CD2-CB 4.48Å; S165-L167 VanDerWaalsContact O-CD1 3.26Å; S165-L167 WeakPolarHBondContact O-CD1 3.39Å; S165-L167 PolarHBondContact O-N 3.45Å; L167-L174 HydrophobicContact CD2-CB 4.44Å; L167-I176 HydrophobicContact CD2-CD1 3.86Å; L167-Y182 HydrophobicContact CD2-CE1 4.49Å |
| 168 | H | 94.3 | Very high | 90.9 | Very high | 77 Ų | 77 | 60.3 Ų | 60.3 | 36% | 0.356 | 31% | 0.305 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.6 | 152.5 | 170.6 | 66.4 | -94.2 | 0 | 0 | 0 | 111.5 | V175 Q177 | H168-V175 VanDerWaalsContact CE1-CB 3.44Å; H168-V175 WeakPolarHBondContact CE1-CB 3.24Å; H168-V175 VanDerWaalsContact CE1-CG1 3.45Å; H168-V175 WeakPolarHBondContact CE1-CG1 3.38Å; H168-V175 PolarHBondContact N-O 3.22Å; H168-V175 WeakPolarHBondContact NE2-CB 3.49Å; H168-V175 WeakPolarHBondContact NE2-CG2 3.27Å; H168-V175 PolarHBondContact O-N 3.03Å; H168-Q177 PolarHBondContact CE1-NE2 3.28Å; H168-Q177 PolarHBondContact ND1-NE2 3.19Å |
| 169 | L | 95.3 | Very high | 92.3 | Very high | 33 Ų | 33 | 53.3 Ų | 53.3 | 17% | 0.173 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 130.4 | 176.7 | -175.8 | 65.4 | 0 | 0 | 0 | 109.8 | I126 W154 L164 E173 L174 | I126-L169 HydrophobicContact CD1-CD1 3.51Å; I126-L169 HydrophobicContact CD1-CD2 4.19Å; I126-L169 HydrophobicContact CD1-CG 4.41Å; W154-L169 HydrophobicContact CB-CD2 3.9Å; W154-L169 WeakPolarHBondContact O-CD2 2.94Å; L164-L169 HydrophobicContact CD1-CB 4.08Å; L169-E173 WeakPolarHBondContact CA-O 3.48Å; L169-L174 HydrophobicContact CD1-CD2 4.47Å |
| 170 | R | 94 | Very high | 93.7 | Very high | 155 Ų | 155 | 51.2 Ų | 51.2 | 59% | 0.585 | 27% | 0.268 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -139.4 | 118.7 | 174.1 | -175.9 | 179.5 | 179.7 | -174.6 | -0.2 | 109.8 | G172 E173 V175 | R170-G172 PolarHBondContact O-N 3.34Å; R170-E173 PolarHBondContact N-O 2.9Å; R170-E173 VanDerWaalsContact O-CB 3.27Å; R170-E173 WeakPolarHBondContact O-CB 3.36Å; R170-E173 PolarHBondContact O-N 3.17Å; R170-V175 HydrophobicContact CB-CG2 4.08Å |
| 171 | N | 91.4 | Very high | 94.8 | Very high | 118 Ų | 118 | 49 Ų | 49 | 63% | 0.631 | 23% | 0.234 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 53.1 | 36.1 | 177.8 | -56.8 | -22.7 | 0 | 0 | 0 | 114.1 | E173 | N171-E173 VanDerWaalsContact C-N 3.31Š|
| 172 | G | 93.9 | Very high | 95.5 | Very high | 2 Ų | 2 | 43.5 Ų | 43.5 | 2% | 0.021 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 82.6 | 1.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | R170 | R170-G172 PolarHBondContact O-N 3.34Š|
| 173 | E | 97.9 | Very high | 95.8 | Very high | 6 Ų | 6 | 46.5 Ų | 46.5 | 3% | 0.028 | 22% | 0.22 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 129.9 | -178.3 | -57.6 | 159.5 | -168.9 | 0 | 0 | 110.3 | K150 L169 R170 N171 R255 I256 F257 | K150-E173 HydrophobicContact CD-CG 4.37Å; K150-E173 IonicContact NZ-OE1 3.21Å; K150-E173 PolarHBondContact NZ-OE1 3.44Å; L169-E173 WeakPolarHBondContact CA-O 3.48Å; R170-E173 PolarHBondContact N-O 2.9Å; R170-E173 VanDerWaalsContact O-CB 3.27Å; R170-E173 WeakPolarHBondContact O-CB 3.36Å; R170-E173 PolarHBondContact O-N 3.17Å; N171-E173 VanDerWaalsContact C-N 3.31Å; E173-R255 HydrophobicContact CB-CB 4.18Å; E173-R255 IonicContact OE1-NH1 3.82Å; E173-R255 WeakPolarHBondContact OE2-CD 2.99Å; E173-R255 IonicContact OE2-CZ 2.64Å; E173-R255 IonicContact OE2-NE 3.35Å; E173-R255 IonicContact OE2-NH1 2.73Å; E173-R255 PolarHBondContact OE2-NH1 3.34Å; E173-I256 CarbonylContact C-O 3.54Å; E173-I256 VanDerWaalsContact CA-O 3.28Å; E173-I256 WeakPolarHBondContact CA-O 3.25Å; E173-F257 HydrophobicContact CB-CB 4.46Å; E173-F257 HydrophobicContact CG-CB 3.87Å; E173-F257 HydrophobicContact CG-CD1 4.27Å; E173-F257 HydrophobicContact CG-CG 4.35Å |
| 174 | L | 98.3 | Very high | 96 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 20% | 0.201 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 124.1 | 167.1 | -72.7 | 173.3 | 0 | 0 | 0 | 108.7 | A124 I126 L164 L167 L169 R255 I256 F275 A277 | A124-L174 HydrophobicContact CB-CD1 4.05Å; A124-L174 HydrophobicContact CB-CD2 3.82Å; I126-L174 HydrophobicContact CD1-CD2 4.04Å; I126-L174 HydrophobicContact CD1-CG 4.12Å; I126-L174 HydrophobicContact CG2-CD2 4.45Å; L164-L174 HydrophobicContact CD2-CD2 3.58Å; L167-L174 HydrophobicContact CD2-CB 4.44Å; L169-L174 HydrophobicContact CD1-CD2 4.47Å; L174-R255 WeakPolarHBondContact O-CA 3.46Å; L174-I256 HydrophobicContact CB-CD1 4.24Å; L174-I256 HydrophobicContact CB-CG1 3.74Å; L174-I256 HydrophobicContact CD1-CD1 4.38Å; L174-I256 PolarHBondContact N-O 2.04Å; L174-I256 PolarHBondContact O-N 3.37Å; L174-F275 HydrophobicContact CB-CE1 4.27Å; L174-F275 HydrophobicContact CD1-CD1 3.87Å; L174-F275 HydrophobicContact CD1-CE1 3.65Å; L174-F275 HydrophobicContact CD1-CG 4.48Å; L174-F275 HydrophobicContact CD1-CZ 4.09Å; L174-F275 HydrophobicContact CG-CD1 4.14Å; L174-F275 HydrophobicContact CG-CE1 3.86Å; L174-A277 HydrophobicContact CD1-CB 4.45Å |
| 175 | V | 98.2 | Very high | 96.2 | Very high | 9 Ų | 9 | 41.3 Ų | 41.3 | 6% | 0.055 | 20% | 0.195 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 122.8 | -178.4 | -172.8 | 0 | 0 | 0 | 0 | 110.1 | H168 R170 R255 | H168-V175 VanDerWaalsContact CE1-CB 3.44Å; H168-V175 WeakPolarHBondContact CE1-CB 3.24Å; H168-V175 VanDerWaalsContact CE1-CG1 3.45Å; H168-V175 WeakPolarHBondContact CE1-CG1 3.38Å; H168-V175 PolarHBondContact N-O 3.22Å; H168-V175 WeakPolarHBondContact NE2-CB 3.49Å; H168-V175 WeakPolarHBondContact NE2-CG2 3.27Å; H168-V175 PolarHBondContact O-N 3.03Å; R170-V175 HydrophobicContact CB-CG2 4.08Å; V175-R255 HydrophobicContact CG1-CG 4.33Å; V175-R255 HydrophobicContact CG2-CG 4.13Å |
| 176 | I | 98.1 | Very high | 96.4 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 18% | 0.181 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.8 | 128.7 | -174.2 | -57.3 | -55.3 | 0 | 0 | 0 | 111 | L167 E178 Y182 L250 K251 D253 D254 I256 | L167-I176 HydrophobicContact CD2-CD1 3.86Å; I176-E178 WeakPolarHBondContact CG2-O 3.32Å; I176-Y182 HydrophobicContact CD1-CD1 4.27Å; I176-Y182 HydrophobicContact CD1-CE1 4.08Å; I176-Y182 HydrophobicContact CD1-CE2 4.46Å; I176-Y182 HydrophobicContact CG2-CE2 3.75Å; I176-L250 HydrophobicContact CD1-CD1 3.5Å; I176-L250 VanDerWaalsContact CD1-CD1 3.5Å; I176-L250 HydrophobicContact CG1-CB 4.01Å; I176-L250 HydrophobicContact CG1-CD1 3.59Å; I176-L250 HydrophobicContact CG1-CG 4.42Å; I176-L250 HydrophobicContact CG2-CB 4.23Å; I176-K251 WeakPolarHBondContact CG2-O 3.25Å; I176-D253 PolarHBondContact O-N 2.82Å; I176-D254 HydrophobicContact CG1-CB 4.28Å; I176-D254 WeakPolarHBondContact CG1-O 3.4Å; I176-D254 PolarHBondContact N-O 3.39Å; I176-I256 HydrophobicContact CD1-CD1 4.47Å |
| 177 | Q | 96.5 | Very high | 96.6 | Very high | 66 Ų | 66 | 39.3 Ų | 39.3 | 31% | 0.308 | 18% | 0.179 | S | C | . | . | trans | -97.1 | -29.6 | 177.6 | -61.4 | -58.2 | -60.7 | 0 | 0 | 113.4 | N166 H168 K252 | N166-Q177 VanDerWaalsContact O-CB 3.26Å; N166-Q177 WeakPolarHBondContact O-CB 3.39Å; N166-Q177 WeakPolarHBondContact O-CG 3.3Å; H168-Q177 PolarHBondContact CE1-NE2 3.28Å; H168-Q177 PolarHBondContact ND1-NE2 3.19Å; Q177-K252 WeakPolarHBondContact O-CD 3.37Å; Q177-K252 WeakPolarHBondContact O-CG 3.39Å | ||
| 178 | E | 95.1 | Very high | 96.8 | Very high | 71 Ų | 71 | 38.8 Ų | 38.8 | 33% | 0.332 | 18% | 0.176 | S | C | . | . | S | Bend | trans | -122.2 | 131.6 | -175.4 | -64.6 | -177.6 | -149.4 | 0 | 0 | 109.7 | V122 I176 Y182 | V122-E178 VanDerWaalsContact CG2-CD 3.49Å; V122-E178 HydrophobicContact CG2-CG 4.44Å; V122-E178 WeakPolarHBondContact CG2-OE1 3.38Å; V122-E178 WeakPolarHBondContact CG2-OE2 3.41Å; I176-E178 WeakPolarHBondContact CG2-O 3.32Å; E178-Y182 VanDerWaalsContact O-CE2 3.29Å; E178-Y182 WeakPolarHBondContact O-CE2 3.36Å; E178-Y182 PolarHBondContact O-OH 3.25Å |
| 179 | K | 96.3 | Very high | 97 | Very high | 89 Ų | 89 | 37.1 Ų | 37.1 | 39% | 0.387 | 17% | 0.167 | S | C | . | . | trans | -65.5 | 138 | 173.8 | 178.8 | -167.8 | 172.7 | -173.9 | 0 | 108.8 | T99 E249 L250 | T99-K179 HydrophobicContact CG2-CD 4.15Å; T99-K179 PolarHBondContact OG1-NZ 3.37Å; K179-E249 WeakPolarHBondContact CE-OE1 3.32Å; K179-E249 IonicContact NZ-OE1 2.7Å; K179-E249 PolarHBondContact NZ-OE1 3.18Å; K179-L250 WeakPolarHBondContact CA-O 3.42Å | ||
| 180 | G | 95.3 | Very high | 97.1 | Very high | 7 Ų | 7 | 35.6 Ų | 35.6 | 7% | 0.072 | 16% | 0.159 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 165.9 | -167.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 113 | Y182 E249 L250 G281 | G180-Y182 WeakPolarHBondContact O-CD2 3.47Å; G180-E249 WeakPolarHBondContact O-CA 3.26Å; G180-L250 PolarHBondContact N-O 3Å; G180-L250 VanDerWaalsContact N-O 3.08Å; G180-L250 PolarHBondContact O-N 2.99Å; G180-G281 WeakPolarHBondContact CA-O 3.47Å |
| 181 | F | 97.3 | Very high | 97.2 | Very high | 38 Ų | 38 | 34.6 Ų | 34.6 | 17% | 0.167 | 16% | 0.155 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 118.5 | 175.8 | -68.8 | -78.2 | 0 | 0 | 0 | 110.5 | I92 T95 L247 F248 E249 V280 G281 | I92-F181 HydrophobicContact CG1-CD2 4.31Å; T95-F181 HydrophobicContact CG2-CE2 4.25Å; T95-F181 HydrophobicContact CG2-CZ 4.15Å; F181-L247 HydrophobicContact CB-CD1 3.95Å; F181-L247 HydrophobicContact CB-CD2 4.41Å; F181-L247 HydrophobicContact CB-CG 4.18Å; F181-L247 HydrophobicContact CD1-CD2 4.46Å; F181-L247 HydrophobicContact CD1-CG 4.43Å; F181-F248 WeakPolarHBondContact CA-O 3.27Å; F181-E249 HydrophobicContact CD1-CB 3.93Å; F181-E249 HydrophobicContact CD1-CG 4.48Å; F181-E249 HydrophobicContact CE1-CB 3.72Å; F181-E249 HydrophobicContact CE1-CG 4.22Å; F181-E249 HydrophobicContact CZ-CB 4.4Å; F181-E249 HydrophobicContact CZ-CG 4.46Å; F181-V280 PolarHBondContact O-N 3.44Å; F181-G281 PolarHBondContact N-O 3.32Å |
| 182 | Y | 98.4 | Very high | 97.4 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 13% | 0.129 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 129 | 178.8 | -73.1 | -100.5 | 0 | 0 | 0 | 110.4 | V122 L167 I176 E178 G180 I184 L247 F248 L250 A277 F278 L279 | V122-Y182 HydrophobicContact CG1-CE1 3.78Å; V122-Y182 WeakPolarHBondContact CG1-OH 3.32Å; L167-Y182 HydrophobicContact CD2-CE1 4.49Å; I176-Y182 HydrophobicContact CD1-CD1 4.27Å; I176-Y182 HydrophobicContact CD1-CE1 4.08Å; I176-Y182 HydrophobicContact CD1-CE2 4.46Å; I176-Y182 HydrophobicContact CG2-CE2 3.75Å; E178-Y182 VanDerWaalsContact O-CE2 3.29Å; E178-Y182 WeakPolarHBondContact O-CE2 3.36Å; E178-Y182 PolarHBondContact O-OH 3.25Å; G180-Y182 WeakPolarHBondContact O-CD2 3.47Å; Y182-I184 PolarHBondContact O-N 3.38Å; Y182-L247 WeakPolarHBondContact O-CA 3.45Å; Y182-F248 PolarHBondContact N-O 3.03Å; Y182-F248 PolarHBondContact O-N 3.5Å; Y182-L250 HydrophobicContact CD2-CB 3.83Å; Y182-L250 HydrophobicContact CD2-CD1 3.73Å; Y182-L250 HydrophobicContact CD2-CG 3.92Å; Y182-L250 HydrophobicContact CE2-CB 4.19Å; Y182-L250 HydrophobicContact CE2-CD1 4.5Å; Y182-L250 HydrophobicContact CG-CD1 3.78Å; Y182-L250 HydrophobicContact CG-CG 4.37Å; Y182-A277 HydrophobicContact CD1-CB 4.32Å; Y182-F278 VanDerWaalsContact CA-O 3.32Å; Y182-F278 WeakPolarHBondContact CA-O 3.38Å; Y182-L279 HydrophobicContact CD1-CB 4.47Å; Y182-L279 HydrophobicContact CD2-CD1 4.17Å; Y182-L279 HydrophobicContact CE1-CB 4.08Å; Y182-L279 HydrophobicContact CE1-CD1 4.39Å; Y182-L279 HydrophobicContact CE2-CD1 3.72Å |
| 183 | Y | 98.6 | Very high | 97.3 | Very high | 68 Ų | 68 | 37.7 Ų | 37.7 | 27% | 0.267 | 17% | 0.165 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 113.4 | 160.8 | -177.3 | -92.9 | 0 | 0 | 0 | 107.5 | Y185 Y243 G246 A277 F278 | Y183-Y185 AromaticContact CD1-CD1 3.87Å; Y183-Y185 HydrophobicContact CD1-CD1 3.87Å; Y183-Y185 AromaticContact CE1-CD1 3.86Å; Y183-Y185 HydrophobicContact CE1-CD1 3.86Å; Y183-Y185 HydrophobicContact CE1-CG 4.17Å; Y183-Y243 PolarHBondContact OH-OH 3.38Å; Y183-G246 WeakPolarHBondContact CA-O 3.16Å; Y183-A277 WeakPolarHBondContact O-CA 3.27Å; Y183-F278 HydrophobicContact CD1-CD1 4.24Å; Y183-F278 AromaticContact CD1-CE1 3.39Å; Y183-F278 HydrophobicContact CD1-CE1 3.39Å; Y183-F278 AromaticContact CD1-CZ 3.73Å; Y183-F278 HydrophobicContact CD1-CZ 3.73Å; Y183-F278 HydrophobicContact CE1-CE1 4.27Å; Y183-F278 AromaticContact CG-CE1 3.96Å; Y183-F278 HydrophobicContact CG-CE1 3.96Å; Y183-F278 AromaticContact CG-CZ 3.87Å; Y183-F278 HydrophobicContact CG-CZ 3.87Å; Y183-F278 PolarHBondContact N-O 3.34Å; Y183-F278 PolarHBondContact O-N 3.14Å; Y183-F278 VanDerWaalsContact O-N 3.07Å |
| 184 | I | 98.8 | Very high | 96.8 | Very high | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 17% | 0.17 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 135 | -178.6 | -53.1 | 168.1 | 0 | 0 | 0 | 107.6 | Y182 I210 L222 M223 G245 G246 F248 L250 I256 F275 A277 | Y182-I184 PolarHBondContact O-N 3.38Å; I184-I210 HydrophobicContact CG2-CG2 3.95Å; I184-L222 HydrophobicContact CD1-CD1 3.68Å; I184-M223 HydrophobicContact CB-CE 4.11Å; I184-M223 HydrophobicContact CG2-CE 4.31Å; I184-G245 CarbonylContact O-C 3.5Å; I184-G245 WeakPolarHBondContact O-CA 3.34Å; I184-G246 PolarHBondContact N-O 3.46Å; I184-G246 PolarHBondContact O-N 3.03Å; I184-F248 HydrophobicContact CD1-CB 4.16Å; I184-F248 HydrophobicContact CD1-CD2 3.97Å; I184-F248 HydrophobicContact CD1-CG 4.37Å; I184-L250 HydrophobicContact CD1-CD1 4.02Å; I184-L250 HydrophobicContact CD1-CD2 4.42Å; I184-I256 HydrophobicContact CD1-CD1 3.97Å; I184-I256 HydrophobicContact CD1-CG2 4.19Å; I184-I256 HydrophobicContact CG1-CD1 3.96Å; I184-I256 HydrophobicContact CG2-CD1 3.9Å; I184-F275 HydrophobicContact CG2-CE2 3.61Å; I184-F275 HydrophobicContact CG2-CZ 4.17Å; I184-A277 HydrophobicContact CG1-CB 4.3Å |
| 185 | Y | 98.9 | Very high | 95.8 | Very high | 35 Ų | 35 | 44.7 Ų | 44.7 | 14% | 0.137 | 20% | 0.198 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -144.1 | 152.2 | 178.3 | 64.5 | -85.5 | 0 | 0 | 0 | 112.2 | H125 Y183 Y243 Q244 F274 F275 G276 F278 | H125-Y185 AromaticContact ND1-CE2 3.75Å; H125-Y185 AromaticContact ND1-CZ 3.77Å; H125-Y185 PolarHBondContact ND1-OH 2.9Å; Y183-Y185 AromaticContact CD1-CD1 3.87Å; Y183-Y185 HydrophobicContact CD1-CD1 3.87Å; Y183-Y185 AromaticContact CE1-CD1 3.86Å; Y183-Y185 HydrophobicContact CE1-CD1 3.86Å; Y183-Y185 HydrophobicContact CE1-CG 4.17Å; Y185-Y243 WeakPolarHBondContact CB-OH 3.47Å; Y185-Y243 AromaticContact CD2-CE2 3.99Å; Y185-Y243 HydrophobicContact CD2-CE2 3.99Å; Y185-Y243 HydrophobicContact CG-CE2 4.41Å; Y185-Q244 VanDerWaalsContact CA-O 3.25Å; Y185-Q244 WeakPolarHBondContact CA-O 2.97Å; Y185-F274 HydrophobicContact CD2-CD2 4.35Å; Y185-F274 HydrophobicContact CD2-CE2 4.23Å; Y185-F274 HydrophobicContact CE2-CD2 4.09Å; Y185-F274 HydrophobicContact CE2-CE2 4.18Å; Y185-F275 WeakPolarHBondContact O-CD2 3.34Å; Y185-G276 PolarHBondContact N-O 3.39Å; Y185-G276 PolarHBondContact O-N 3Å; Y185-G276 VanDerWaalsContact O-O 3.12Å; Y185-F278 HydrophobicContact CE1-CD1 4.25Å; Y185-F278 HydrophobicContact CE1-CE1 4.46Å |
| 186 | S | 98.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -148.1 | 143 | 174.3 | -170.2 | 0 | 0 | 0 | 0 | 111.1 | Q208 Y243 Q244 V258 F274 | S186-Q208 PolarHBondContact O-NE2 3.34Å; S186-Q208 PolarHBondContact O-OE1 2.86Å; S186-Q208 PolarHBondContact OG-NE2 3.14Å; S186-Y243 WeakPolarHBondContact O-CA 3.17Å; S186-Q244 PolarHBondContact N-O 3.49Å; S186-Q244 PolarHBondContact O-N 2.91Å; S186-Q244 VanDerWaalsContact O-N 3.09Å; S186-V258 WeakPolarHBondContact OG-CG2 3.34Å; S186-F274 CarbonylContact C-O 3.59Å; S186-F274 WeakPolarHBondContact CA-O 3.3Å; S186-F274 PolarHBondContact OG-O 3.14Å |
| 187 | Q | 98.8 | Very high | 93 | Very high | 40 Ų | 40 | 56.5 Ų | 56.5 | 19% | 0.187 | 25% | 0.254 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 135.1 | 163.2 | -168.4 | 168.2 | -86.2 | 0 | 0 | 109.9 | I242 Y243 A272 S273 F274 | Q187-I242 CarbonylContact C-O 3.59Å; Q187-I242 VanDerWaalsContact CA-O 3.27Å; Q187-I242 WeakPolarHBondContact CA-O 3.06Å; Q187-Y243 HydrophobicContact CB-CD2 4.19Å; Q187-A272 WeakPolarHBondContact CG-O 3.49Å; Q187-A272 PolarHBondContact NE2-O 3.07Å; Q187-S273 CarbonylContact O-C 3.6Å; Q187-S273 VanDerWaalsContact O-CA 3.27Å; Q187-S273 WeakPolarHBondContact O-CA 3.29Å; Q187-F274 HydrophobicContact CB-CD1 4.13Å; Q187-F274 HydrophobicContact CB-CD2 3.95Å; Q187-F274 HydrophobicContact CB-CE1 3.69Å; Q187-F274 HydrophobicContact CB-CE2 3.5Å; Q187-F274 VanDerWaalsContact CB-CE2 3.5Å; Q187-F274 HydrophobicContact CB-CG 4.25Å; Q187-F274 HydrophobicContact CB-CZ 3.35Å; Q187-F274 HydrophobicContact CG-CE1 4.28Å; Q187-F274 HydrophobicContact CG-CZ 4.15Å; Q187-F274 PolarHBondContact N-O 2.98Å; Q187-F274 PolarHBondContact O-N 3.4Å; Q187-F274 VanDerWaalsContact O-O 3.09Å |
| 188 | T | 98.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 126.6 | 170.5 | 51.1 | 0 | 0 | 0 | 0 | 108.7 | I151 Q208 I242 V258 V260 | I151-T188 HydrophobicContact CD1-CG2 3.84Å; T188-Q208 HydrophobicContact CG2-CG 4.06Å; T188-Q208 VanDerWaalsContact CG2-NE2 3.27Å; T188-Q208 PolarHBondContact OG1-NE2 2.86Å; T188-I242 PolarHBondContact N-O 2.9Å; T188-I242 PolarHBondContact O-N 3.01Å; T188-V258 HydrophobicContact CG2-CG1 4.18Å; T188-V260 HydrophobicContact CG2-CG1 3.85Å |
| 189 | Y | 98.4 | Very high | 89.9 | Confident | 43 Ų | 43 | 66.3 Ų | 66.3 | 17% | 0.169 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.6 | 110.2 | 179.9 | -176.4 | -145.2 | 0 | 0 | 0 | 110.7 | R191 L239 S241 I266 D267 A272 S273 | Y189-R191 HydrophobicContact CD1-CB 4.26Å; Y189-R191 HydrophobicContact CE1-CB 3.92Å; Y189-R191 HydrophobicContact CE1-CG 4.4Å; Y189-R191 HydrophobicContact CE2-CB 4.49Å; Y189-L239 HydrophobicContact CE2-CB 4.05Å; Y189-L239 WeakPolarHBondContact OH-CD2 3.39Å; Y189-S241 VanDerWaalsContact CD2-OG 3.24Å; Y189-S241 WeakPolarHBondContact CD2-OG 3.38Å; Y189-I266 CarbonylContact O-C 3.55Å; Y189-I266 WeakPolarHBondContact O-CA 3.47Å; Y189-D267 HydrophobicContact CD1-CB 3.65Å; Y189-D267 HydrophobicContact CE1-CB 4.37Å; Y189-D267 HydrophobicContact CG-CB 4.35Å; Y189-D267 PolarHBondContact O-N 2.98Å; Y189-A272 HydrophobicContact CD1-CB 3.67Å; Y189-A272 HydrophobicContact CG-CB 4.14Å; Y189-S273 PolarHBondContact N-OG 3.09Å |
| 190 | F | 97.7 | Very high | 88.6 | Confident | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.9 | 115.3 | 171.1 | -66.5 | -99.3 | 0 | 0 | 0 | 108.6 | M206 Y240 I242 V260 T261 N262 L265 I266 | F190-M206 HydrophobicContact CB-CG 4.19Å; F190-M206 HydrophobicContact CB-SD 3.59Å; F190-M206 VanDerWaalsContact CB-SD 3.59Å; F190-M206 HydrophobicContact CD1-CB 3.89Å; F190-M206 HydrophobicContact CD1-CG 3.54Å; F190-M206 HydrophobicContact CD1-SD 4.1Å; F190-M206 HydrophobicContact CD2-CB 3.97Å; F190-M206 HydrophobicContact CD2-CG 4.3Å; F190-M206 HydrophobicContact CD2-SD 4.44Å; F190-M206 HydrophobicContact CE1-CB 3.84Å; F190-M206 HydrophobicContact CE1-CG 3.88Å; F190-M206 HydrophobicContact CE2-CB 3.95Å; F190-M206 HydrophobicContact CG-CB 3.95Å; F190-M206 HydrophobicContact CG-CG 3.76Å; F190-M206 HydrophobicContact CG-SD 3.81Å; F190-M206 HydrophobicContact CZ-CB 3.86Å; F190-M206 HydrophobicContact CZ-CG 4.41Å; F190-Y240 PolarHBondContact N-O 2.76Å; F190-Y240 PolarHBondContact O-N 3Å; F190-I242 HydrophobicContact CD2-CD1 4.07Å; F190-I242 HydrophobicContact CD2-CG1 4.32Å; F190-I242 HydrophobicContact CE2-CD1 3.77Å; F190-I242 HydrophobicContact CE2-CG1 4.32Å; F190-V260 HydrophobicContact CZ-CB 4.18Å; F190-V260 HydrophobicContact CZ-CG1 4.32Å; F190-T261 VanDerWaalsContact CE1-O 3.26Å; F190-T261 WeakPolarHBondContact CE1-O 3.4Å; F190-N262 HydrophobicContact CE1-CB 4.38Å; F190-L265 CarbonylContact C-O 3.55Å; F190-L265 WeakPolarHBondContact CA-O 3.37Å; F190-L265 HydrophobicContact CD1-CB 4.3Å; F190-I266 HydrophobicContact CD1-CD1 3.54Å; F190-I266 HydrophobicContact CD2-CD1 3.78Å; F190-I266 HydrophobicContact CE1-CD1 3.41Å; F190-I266 VanDerWaalsContact CE1-CD1 3.41Å; F190-I266 HydrophobicContact CE1-CG1 4.36Å; F190-I266 HydrophobicContact CE2-CD1 3.64Å; F190-I266 HydrophobicContact CG-CD1 3.74Å; F190-I266 HydrophobicContact CZ-CD1 3.47Å; F190-I266 VanDerWaalsContact CZ-CD1 3.47Å |
| 191 | R | 96.3 | Very high | 87.3 | Confident | 134 Ų | 134 | 74.8 Ų | 74.8 | 51% | 0.506 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 121.9 | 178.6 | -180 | 166.7 | 75.5 | 100.6 | 0.3 | 110 | Y189 G238 L239 L265 D267 | Y189-R191 HydrophobicContact CD1-CB 4.26Å; Y189-R191 HydrophobicContact CE1-CB 3.92Å; Y189-R191 HydrophobicContact CE1-CG 4.4Å; Y189-R191 HydrophobicContact CE2-CB 4.49Å; R191-G238 WeakPolarHBondContact CA-O 3.36Å; R191-L239 HydrophobicContact CB-CD2 4.32Å; R191-L239 HydrophobicContact CG-CD2 3.61Å; R191-L265 PolarHBondContact N-O 3.3Å; R191-D267 HydrophobicContact CB-CB 4.19Å; R191-D267 IonicContact CZ-OD2 2.65Å; R191-D267 IonicContact NE-OD2 2.72Å; R191-D267 PolarHBondContact NE-OD2 3.24Å; R191-D267 IonicContact NH2-OD2 2.9Å; R191-D267 PolarHBondContact NH2-OD2 2.96Å |
| 192 | F | 94.6 | Very high | 86.3 | Confident | 18 Ų | 18 | 75.6 Ų | 75.6 | 8% | 0.079 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.2 | 153 | 179.7 | 56.4 | -93.5 | 0 | 0 | 0 | 111.5 | E194 K204 M206 Y237 G238 Y240 L265 | F192-E194 HydrophobicContact CD2-CG 4.2Å; F192-E194 HydrophobicContact CE2-CG 3.9Å; F192-E194 WeakPolarHBondContact CE2-OE1 3.45Å; F192-K204 HydrophobicContact CD2-CD 4.36Å; F192-K204 HydrophobicContact CE1-CD 4.14Å; F192-K204 HydrophobicContact CE2-CD 3.97Å; F192-K204 HydrophobicContact CZ-CD 3.82Å; F192-M206 HydrophobicContact CE1-SD 3.88Å; F192-Y237 CarbonylContact O-C 3.6Å; F192-Y237 VanDerWaalsContact O-CA 3.29Å; F192-Y237 WeakPolarHBondContact O-CA 3.46Å; F192-Y237 VanDerWaalsContact O-CB 3.3Å; F192-Y237 WeakPolarHBondContact O-CB 3.42Å; F192-G238 PolarHBondContact N-O 3.23Å; F192-G238 VanDerWaalsContact N-O 3.09Å; F192-G238 PolarHBondContact O-N 3.42Å; F192-Y240 HydrophobicContact CE1-CD2 4.13Å; F192-Y240 HydrophobicContact CE1-CE2 4.25Å; F192-Y240 HydrophobicContact CZ-CD2 4.29Å; F192-Y240 AromaticContact CZ-CE2 3.94Å; F192-Y240 HydrophobicContact CZ-CE2 3.94Å; F192-L265 HydrophobicContact CB-CB 4.42Å; F192-L265 HydrophobicContact CB-CD2 3.75Å; F192-L265 HydrophobicContact CB-CG 4.45Å; F192-L265 HydrophobicContact CD1-CB 4.09Å; F192-L265 HydrophobicContact CD1-CD1 3.76Å; F192-L265 HydrophobicContact CD1-CD2 4.46Å; F192-L265 HydrophobicContact CD1-CG 4.32Å; F192-L265 HydrophobicContact CE1-CD1 4.22Å; F192-L265 HydrophobicContact CG-CD1 4.21Å; F192-L265 HydrophobicContact CG-CD2 4.27Å |
| 193 | Q | 93.1 | Very high | 85.8 | Confident | 167 Ų | 167 | 79.9 Ų | 79.9 | 78% | 0.78 | 38% | 0.377 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -91.4 | 137.1 | 164.6 | -166.5 | 169.9 | 7.5 | 0 | 0 | 108 | E236 | Q193-E236 WeakPolarHBondContact CG-O 3.35Å |
| 194 | E | 87.4 | Confident | 85.5 | Confident | 26 Ų | 26 | 78.3 Ų | 78.3 | 12% | 0.121 | 37% | 0.371 | C | S | . | . | P | Polyproline II helix | trans | -80.8 | 130 | 175.9 | -73.5 | -72 | -178.1 | 0 | 0 | 109.5 | F192 K204 A235 E236 | F192-E194 HydrophobicContact CD2-CG 4.2Å; F192-E194 HydrophobicContact CE2-CG 3.9Å; F192-E194 WeakPolarHBondContact CE2-OE1 3.45Å; E194-K204 IonicContact OE1-NZ 3.94Å; E194-K204 PolarHBondContact OE1-NZ 3.02Å; E194-K204 IonicContact OE2-NZ 3.15Å; E194-K204 PolarHBondContact OE2-NZ 2.99Å; E194-A235 WeakPolarHBondContact CB-O 3.39Å; E194-A235 WeakPolarHBondContact CG-O 3.28Å; E194-E236 PolarHBondContact N-O 2.9Å |
| 195 | E | 76.8 | Confident | 85.4 | Confident | 128 Ų | 128 | 84.6 Ų | 84.6 | 60% | 0.598 | 40% | 0.401 | S | S | * | . | P | Polyproline II helix | trans | -89.2 | 120.5 | 166.6 | -72 | -179.3 | 167.3 | 0 | 0 | 108.2 | K197 N202 | E195-K197 VanDerWaalsContact C-N 3.34Å; E195-K197 HydrophobicContact CB-CG 4.4Å; E195-K197 PolarHBondContact O-N 3.45Å; E195-K197 WeakPolarHBondContact OE2-CE 3.32Å; E195-K197 IonicContact OE2-NZ 3.12Å; E195-K197 PolarHBondContact OE2-NZ 3.41Å; E195-N202 PolarHBondContact O-ND2 3.35Å |
| 196 | I | 68.6 | Low | 85.3 | Confident | 143 Ų | 143 | 82.9 Ų | 82.9 | 73% | 0.733 | 39% | 0.394 | S | S | * | . | trans | -68.7 | 95.9 | 173.2 | -56.2 | 175 | 0 | 0 | 0 | 107.6 | ||||
| 197 | K | 68.3 | Low | 85.3 | Confident | 113 Ų | 113 | 83.4 Ų | 83.4 | 49% | 0.491 | 40% | 0.397 | S | S | . | . | trans | -95.9 | 111.8 | 172.5 | -68.5 | -177.2 | -178.4 | 170.1 | 0 | 108.2 | E195 N199 T200 | E195-K197 VanDerWaalsContact C-N 3.34Å; E195-K197 HydrophobicContact CB-CG 4.4Å; E195-K197 PolarHBondContact O-N 3.45Å; E195-K197 WeakPolarHBondContact OE2-CE 3.32Å; E195-K197 IonicContact OE2-NZ 3.12Å; E195-K197 PolarHBondContact OE2-NZ 3.41Å; K197-N199 PolarHBondContact O-N 3.14Å; K197-T200 PolarHBondContact O-N 2.81Å | ||
| 198 | E | 63.6 | Low | 85.3 | Confident | 175 Ų | 175 | 81.5 Ų | 81.5 | 82% | 0.818 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | 128.5 | 171.3 | -70.2 | -176 | 165 | 0 | 0 | 108.9 | ||
| 199 | N | 63.9 | Low | 85.3 | Confident | 169 Ų | 169 | 82.6 Ų | 82.6 | 90% | 0.904 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.7 | 16.4 | 176 | -58.4 | -34 | 0 | 0 | 0 | 119.4 | K197 | K197-N199 PolarHBondContact O-N 3.14Š|
| 200 | T | 67.9 | Low | 85.3 | Confident | 89 Ų | 89 | 80.6 Ų | 80.6 | 55% | 0.546 | 39% | 0.385 | S | S | . | . | trans | -119.9 | 138.4 | 173.1 | -34.2 | 0 | 0 | 0 | 0 | 112.2 | K197 N202 | K197-T200 PolarHBondContact O-N 2.81Å; T200-N202 PolarHBondContact O-N 2.85Å | ||
| 201 | K | 69.6 | Low | 85.4 | Confident | 185 Ų | 185 | 81.1 Ų | 81.1 | 80% | 0.804 | 39% | 0.387 | S | S | * | . | trans | -72.5 | 117.3 | 164.8 | -73.7 | -174.8 | 176.2 | -178.6 | 0 | 107.7 | D203 | K201-D203 VanDerWaalsContact C-N 3.27Å; K201-D203 WeakPolarHBondContact CB-OD1 3.5Å; K201-D203 PolarHBondContact O-N 3.09Å | ||
| 202 | N | 75.8 | Confident | 85.4 | Confident | 54 Ų | 54 | 76.2 Ų | 76.2 | 29% | 0.289 | 37% | 0.369 | S | S | . | . | trans | -93.4 | 27 | 179.8 | -74.8 | -12 | 0 | 0 | 0 | 112 | E195 T200 K204 | E195-N202 PolarHBondContact O-ND2 3.35Å; T200-N202 PolarHBondContact O-N 2.85Å; N202-K204 PolarHBondContact O-N 3.09Å; N202-K204 PolarHBondContact O-NZ 3.35Å | ||
| 203 | D | 86.6 | Confident | 85.6 | Confident | 90 Ų | 90 | 76.6 Ų | 76.6 | 48% | 0.481 | 37% | 0.37 | S | S | . | . | trans | -67.4 | 122.4 | -179.5 | 60.4 | -57.9 | 0 | 0 | 0 | 110.8 | K201 | K201-D203 VanDerWaalsContact C-N 3.27Å; K201-D203 WeakPolarHBondContact CB-OD1 3.5Å; K201-D203 PolarHBondContact O-N 3.09Å | ||
| 204 | K | 92.9 | Very high | 85.7 | Confident | 35 Ų | 35 | 70.4 Ų | 70.4 | 15% | 0.152 | 34% | 0.344 | C | S | . | . | trans | -112.6 | 121.7 | -178.9 | -65.1 | 169.6 | -169.6 | 68.6 | 0 | 108.9 | F192 E194 N202 N228 S229 L265 | F192-K204 HydrophobicContact CD2-CD 4.36Å; F192-K204 HydrophobicContact CE1-CD 4.14Å; F192-K204 HydrophobicContact CE2-CD 3.97Å; F192-K204 HydrophobicContact CZ-CD 3.82Å; E194-K204 IonicContact OE1-NZ 3.94Å; E194-K204 PolarHBondContact OE1-NZ 3.02Å; E194-K204 IonicContact OE2-NZ 3.15Å; E194-K204 PolarHBondContact OE2-NZ 2.99Å; N202-K204 PolarHBondContact O-N 3.09Å; N202-K204 PolarHBondContact O-NZ 3.35Å; K204-N228 WeakPolarHBondContact O-CA 3.22Å; K204-S229 PolarHBondContact N-OG 2.97Å; K204-S229 PolarHBondContact O-N 3.46Å; K204-L265 HydrophobicContact CD-CD1 3.74Å | ||
| 205 | Q | 96.1 | Very high | 86 | Confident | 132 Ų | 132 | 74.6 Ų | 74.6 | 62% | 0.617 | 38% | 0.376 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88.4 | 111.4 | 167.8 | -62.6 | -176 | 10.7 | 0 | 0 | 108.7 | V207 T261 N262 | Q205-V207 HydrophobicContact CB-CG2 4.48Å; Q205-T261 WeakPolarHBondContact O-CB 3.36Å; Q205-T261 PolarHBondContact O-OG1 2.9Å; Q205-N262 PolarHBondContact O-ND2 2.91Å |
| 206 | M | 97.6 | Very high | 86.7 | Confident | 0 Ų | 0 | 74.8 Ų | 74.8 | 0% | 0 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 110 | 177.7 | -64.3 | 164.3 | -71.7 | 0 | 0 | 107.4 | F190 F192 A226 R227 Y240 I242 | F190-M206 HydrophobicContact CB-CG 4.19Å; F190-M206 HydrophobicContact CB-SD 3.59Å; F190-M206 VanDerWaalsContact CB-SD 3.59Å; F190-M206 HydrophobicContact CD1-CB 3.89Å; F190-M206 HydrophobicContact CD1-CG 3.54Å; F190-M206 HydrophobicContact CD1-SD 4.1Å; F190-M206 HydrophobicContact CD2-CB 3.97Å; F190-M206 HydrophobicContact CD2-CG 4.3Å; F190-M206 HydrophobicContact CD2-SD 4.44Å; F190-M206 HydrophobicContact CE1-CB 3.84Å; F190-M206 HydrophobicContact CE1-CG 3.88Å; F190-M206 HydrophobicContact CE2-CB 3.95Å; F190-M206 HydrophobicContact CG-CB 3.95Å; F190-M206 HydrophobicContact CG-CG 3.76Å; F190-M206 HydrophobicContact CG-SD 3.81Å; F190-M206 HydrophobicContact CZ-CB 3.86Å; F190-M206 HydrophobicContact CZ-CG 4.41Å; F192-M206 HydrophobicContact CE1-SD 3.88Å; M206-A226 CarbonylContact O-C 3.54Å; M206-A226 VanDerWaalsContact O-CA 3.32Å; M206-A226 WeakPolarHBondContact O-CA 3.39Å; M206-R227 HydrophobicContact CE-CB 4.02Å; M206-R227 PolarHBondContact N-O 3.32Å; M206-R227 PolarHBondContact O-N 2.98Å; M206-Y240 HydrophobicContact CE-CD1 3.8Å; M206-Y240 HydrophobicContact CE-CD2 3.48Å; M206-Y240 VanDerWaalsContact CE-CD2 3.48Å; M206-Y240 HydrophobicContact CE-CE1 4.07Å; M206-Y240 HydrophobicContact CE-CE2 3.77Å; M206-Y240 HydrophobicContact CE-CG 3.5Å; M206-Y240 VanDerWaalsContact CE-CG 3.5Å; M206-Y240 HydrophobicContact SD-CD2 3.47Å; M206-Y240 WeakPolarHBondContact SD-CD2 3.42Å; M206-Y240 HydrophobicContact SD-CE2 4.19Å; M206-Y240 HydrophobicContact SD-CG 3.7Å; M206-I242 HydrophobicContact CB-CD1 4.05Å; M206-I242 WeakPolarHBondContact O-CD1 3.33Å |
| 207 | V | 98.4 | Very high | 87.7 | Confident | 10 Ų | 10 | 73 Ų | 73 | 6% | 0.061 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 127.6 | -175.6 | -166 | 0 | 0 | 0 | 0 | 108.8 | Q205 Y209 S225 A226 V260 T261 | Q205-V207 HydrophobicContact CB-CG2 4.48Å; V207-Y209 HydrophobicContact CB-CE2 3.78Å; V207-Y209 HydrophobicContact CG1-CD1 4.16Å; V207-Y209 HydrophobicContact CG1-CD2 4.25Å; V207-Y209 HydrophobicContact CG1-CE1 3.57Å; V207-Y209 HydrophobicContact CG1-CE2 3.67Å; V207-Y209 HydrophobicContact CG1-CG 4.47Å; V207-Y209 WeakPolarHBondContact CG1-OH 3.5Å; V207-S225 WeakPolarHBondContact CA-O 3.25Å; V207-A226 HydrophobicContact CB-CB 4.48Å; V207-A226 HydrophobicContact CG1-CB 4.14Å; V207-A226 HydrophobicContact CG2-CB 3.97Å; V207-V260 VanDerWaalsContact O-CA 3.25Å; V207-V260 WeakPolarHBondContact O-CA 3.24Å; V207-T261 HydrophobicContact CB-CG2 4.05Å; V207-T261 HydrophobicContact CG2-CG2 4.15Å; V207-T261 PolarHBondContact N-OG1 3.41Å; V207-T261 PolarHBondContact O-N 3.4Å |
| 208 | Q | 98.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 127.4 | 171 | -173.6 | -164.6 | 76.5 | 0 | 0 | 108.6 | S186 T188 K224 S225 I242 Q244 V258 V260 | S186-Q208 PolarHBondContact O-NE2 3.34Å; S186-Q208 PolarHBondContact O-OE1 2.86Å; S186-Q208 PolarHBondContact OG-NE2 3.14Å; T188-Q208 HydrophobicContact CG2-CG 4.06Å; T188-Q208 VanDerWaalsContact CG2-NE2 3.27Å; T188-Q208 PolarHBondContact OG1-NE2 2.86Å; Q208-K224 CarbonylContact O-C 3.59Å; Q208-K224 VanDerWaalsContact O-CA 3.27Å; Q208-K224 WeakPolarHBondContact O-CA 3.35Å; Q208-S225 PolarHBondContact N-O 3.37Å; Q208-S225 PolarHBondContact O-N 2.84Å; Q208-I242 HydrophobicContact CB-CG2 3.99Å; Q208-I242 PolarHBondContact NE2-O 2.91Å; Q208-Q244 PolarHBondContact O-NE2 3.42Å; Q208-Q244 VanDerWaalsContact OE1-CG 3.29Å; Q208-V258 HydrophobicContact CG-CG1 3.95Å; Q208-V260 HydrophobicContact CB-CG1 4.49Å; Q208-V260 HydrophobicContact CG-CG1 4.37Å |
| 209 | Y | 98.8 | Very high | 90.5 | Very high | 24 Ų | 24 | 61.9 Ų | 61.9 | 9% | 0.094 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 139.1 | 177.1 | -53.1 | -86.6 | 0 | 0 | 0 | 109.9 | L147 V207 Y211 L221 M223 K224 V258 S259 T261 | L147-Y209 HydrophobicContact CB-CD1 4.47Å; L147-Y209 HydrophobicContact CB-CD2 4.37Å; L147-Y209 HydrophobicContact CB-CE1 4.05Å; L147-Y209 HydrophobicContact CB-CE2 3.93Å; L147-Y209 HydrophobicContact CD1-CE1 3.91Å; V207-Y209 HydrophobicContact CB-CE2 3.78Å; V207-Y209 HydrophobicContact CG1-CD1 4.16Å; V207-Y209 HydrophobicContact CG1-CD2 4.25Å; V207-Y209 HydrophobicContact CG1-CE1 3.57Å; V207-Y209 HydrophobicContact CG1-CE2 3.67Å; V207-Y209 HydrophobicContact CG1-CG 4.47Å; V207-Y209 WeakPolarHBondContact CG1-OH 3.5Å; Y209-Y211 HydrophobicContact CD1-CE2 4.44Å; Y209-Y211 AromaticContact CG-CE2 3.98Å; Y209-Y211 HydrophobicContact CG-CE2 3.98Å; Y209-L221 HydrophobicContact CD1-CD1 3.86Å; Y209-L221 HydrophobicContact CG-CD1 4.35Å; Y209-M223 WeakPolarHBondContact CA-O 3.45Å; Y209-K224 HydrophobicContact CD1-CB 3.76Å; Y209-K224 HydrophobicContact CE1-CB 4.12Å; Y209-K224 HydrophobicContact CE1-CD 4.41Å; Y209-V258 CarbonylContact O-C 3.55Å; Y209-V258 WeakPolarHBondContact O-CA 3.38Å; Y209-S259 WeakPolarHBondContact CD2-O 3.49Å; Y209-S259 PolarHBondContact N-O 2.88Å; Y209-S259 PolarHBondContact O-N 3.22Å; Y209-T261 HydrophobicContact CE2-CG2 4.18Å |
| 210 | I | 98.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 120.9 | 170.1 | -62.6 | 173.9 | 0 | 0 | 0 | 107.5 | I184 L222 M223 Q244 F257 V258 | I184-I210 HydrophobicContact CG2-CG2 3.95Å; I210-L222 HydrophobicContact CG2-CD1 4.46Å; I210-L222 WeakPolarHBondContact O-CB 3.4Å; I210-L222 PolarHBondContact O-N 3.18Å; I210-M223 HydrophobicContact CB-CB 4.41Å; I210-M223 HydrophobicContact CB-CE 4.12Å; I210-M223 HydrophobicContact CD1-CE 3.51Å; I210-M223 HydrophobicContact CG1-CE 4.38Å; I210-M223 HydrophobicContact CG2-CE 4.04Å; I210-M223 PolarHBondContact N-O 2.85Å; I210-M223 PolarHBondContact O-N 2.91Å; I210-Q244 HydrophobicContact CD1-CG 3.76Å; I210-F257 WeakPolarHBondContact CA-O 3.48Å; I210-V258 HydrophobicContact CG1-CG2 4.47Å |
| 211 | Y | 98.6 | Very high | 93.5 | Very high | 11 Ų | 11 | 56.3 Ų | 56.3 | 4% | 0.043 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 160.3 | -175.9 | -80.6 | -86.4 | 0 | 0 | 0 | 111.7 | A146 L147 Y209 P219 I220 L221 I256 F257 | A146-Y211 HydrophobicContact CB-CD1 4.39Å; A146-Y211 HydrophobicContact CB-CD2 4.18Å; A146-Y211 HydrophobicContact CB-CE1 4.13Å; A146-Y211 HydrophobicContact CB-CE2 3.89Å; A146-Y211 HydrophobicContact CB-CG 4.42Å; L147-Y211 WeakPolarHBondContact CB-OH 3.3Å; L147-Y211 PolarHBondContact N-OH 3.46Å; Y209-Y211 HydrophobicContact CD1-CE2 4.44Å; Y209-Y211 AromaticContact CG-CE2 3.98Å; Y209-Y211 HydrophobicContact CG-CE2 3.98Å; Y211-P219 HydrophobicContact CD1-CB 3.85Å; Y211-P219 HydrophobicContact CD1-CG 4.49Å; Y211-P219 HydrophobicContact CG-CB 4.41Å; Y211-I220 CarbonylContact C-O 3.47Å; Y211-I220 WeakPolarHBondContact CA-O 3.17Å; Y211-L221 HydrophobicContact CD1-CB 4.11Å; Y211-L221 HydrophobicContact CD1-CD1 4.35Å; Y211-L221 HydrophobicContact CD2-CD1 4.24Å; Y211-L221 HydrophobicContact CE1-CB 3.68Å; Y211-L221 HydrophobicContact CE1-CD1 3.99Å; Y211-L221 HydrophobicContact CE1-CG 4.44Å; Y211-L221 HydrophobicContact CE2-CD1 3.88Å; Y211-L221 HydrophobicContact CG-CD1 4.46Å; Y211-I256 VanDerWaalsContact O-CA 3.27Å; Y211-I256 WeakPolarHBondContact O-CA 3.44Å; Y211-F257 VanDerWaalsContact CB-CE1 3.4Å; Y211-F257 AromaticContact CD2-CE2 3.92Å; Y211-F257 HydrophobicContact CD2-CE2 3.92Å; Y211-F257 HydrophobicContact CD2-CZ 4.15Å; Y211-F257 HydrophobicContact CG-CE1 4.36Å; Y211-F257 HydrophobicContact CG-CE2 4.02Å; Y211-F257 AromaticContact CG-CZ 3.78Å; Y211-F257 HydrophobicContact CG-CZ 3.78Å; Y211-F257 PolarHBondContact N-O 2.74Å; Y211-F257 PolarHBondContact O-N 3.49Å |
| 212 | K | 98.1 | Very high | 94.9 | Very high | 31 Ų | 31 | 48.9 Ų | 48.9 | 14% | 0.135 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.3 | 131.6 | 171.7 | -178.9 | 171 | 81.5 | 161.7 | 0 | 111.5 | I220 L222 E249 L250 D254 R255 I256 | K212-I220 PolarHBondContact N-O 3.48Å; K212-I220 PolarHBondContact O-N 3.18Å; K212-L222 HydrophobicContact CB-CD1 3.96Å; K212-L222 HydrophobicContact CB-CD2 3.95Å; K212-L222 HydrophobicContact CB-CG 3.94Å; K212-E249 PolarHBondContact NZ-O 2.91Å; K212-L250 HydrophobicContact CD-CD2 3.32Å; K212-L250 HydrophobicContact CG-CD2 4.36Å; K212-D254 HydrophobicContact CD-CB 4.31Å; K212-D254 WeakPolarHBondContact CD-OD2 3.37Å; K212-D254 HydrophobicContact CG-CB 4.45Å; K212-D254 IonicContact NZ-OD2 3.16Å; K212-D254 PolarHBondContact NZ-OD2 3.28Å; K212-R255 CarbonylContact C-O 3.01Å; K212-R255 WeakPolarHBondContact CA-O 3.47Å; K212-I256 HydrophobicContact CB-CG2 4.27Å; K212-I256 HydrophobicContact CG-CG2 4.28Å |
| 213 | Y | 97.4 | Very high | 96 | Very high | 27 Ų | 27 | 47.5 Ų | 47.5 | 11% | 0.106 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 135.9 | 156.5 | -82.7 | -66.8 | 0 | 0 | 0 | 110 | P219 D254 R255 F257 | Y213-P219 HydrophobicContact CD1-CB 4.33Å; Y213-P219 HydrophobicContact CE1-CB 3.87Å; Y213-P219 HydrophobicContact CE1-CG 4.24Å; Y213-P219 HydrophobicContact CE2-CB 4.14Å; Y213-D254 WeakPolarHBondContact O-CA 3.17Å; Y213-R255 VanDerWaalsContact CG-NH2 3.27Å; Y213-R255 PolarHBondContact N-O 3Å; Y213-R255 PolarHBondContact O-N 2.94Å; Y213-F257 HydrophobicContact CD2-CD1 4.12Å; Y213-F257 AromaticContact CD2-CE1 3.54Å; Y213-F257 HydrophobicContact CD2-CE1 3.54Å; Y213-F257 HydrophobicContact CD2-CZ 4.48Å; Y213-F257 HydrophobicContact CE2-CD1 4.37Å; Y213-F257 AromaticContact CE2-CE1 3.53Å; Y213-F257 HydrophobicContact CE2-CE1 3.53Å; Y213-F257 HydrophobicContact CE2-CZ 4.05Å |
| 214 | T | 96.2 | Very high | 96.6 | Very high | 36 Ų | 36 | 50.1 Ų | 50.1 | 22% | 0.221 | 26% | 0.256 | C | S | . | . | trans | -136.9 | -157.3 | 174.7 | -169.3 | 0 | 0 | 0 | 0 | 108.5 | Y216 I220 D254 | T214-Y216 PolarHBondContact O-N 2.68Å; T214-I220 HydrophobicContact CG2-CD1 3.86Å; T214-D254 WeakPolarHBondContact CA-OD1 3.27Å; T214-D254 WeakPolarHBondContact CB-OD1 3.34Å; T214-D254 PolarHBondContact OG1-OD1 3.4Å | ||
| 215 | S | 93.6 | Very high | 96.8 | Very high | 114 Ų | 114 | 50 Ų | 50 | 80% | 0.797 | 26% | 0.26 | S | S | * | . | S | Bend | trans | -65.6 | 13.2 | 173.1 | 66.2 | 0 | 0 | 0 | 0 | 114.8 | ||
| 216 | Y | 91.5 | Very high | 96.9 | Very high | 132 Ų | 132 | 46.8 Ų | 46.8 | 52% | 0.518 | 26% | 0.256 | S | S | . | . | S | Bend | trans | -108.2 | 141 | 178.4 | -169.4 | -104.6 | 0 | 0 | 0 | 110 | T214 D218 | T214-Y216 PolarHBondContact O-N 2.68Å; Y216-D218 HydrophobicContact CD1-CB 4.07Å; Y216-D218 WeakPolarHBondContact CD1-O 3.39Å; Y216-D218 HydrophobicContact CE1-CB 3.79Å; Y216-D218 PolarHBondContact O-N 2.88Å |
| 217 | P | 89.9 | Confident | 96.9 | Very high | 107 Ų | 107 | 54.2 Ų | 54.2 | 70% | 0.695 | 28% | 0.284 | S | S | * | . | S | Bend | trans | -62.6 | -37.1 | -173.6 | -25.2 | 35.1 | 0 | 0 | 0 | 114.8 | ||
| 218 | D | 93.6 | Very high | 96.7 | Very high | 37 Ų | 37 | 58.3 Ų | 58.3 | 20% | 0.198 | 31% | 0.305 | C | S | . | . | S | Bend | trans | -95 | 148.1 | -176.5 | -57.7 | -46.4 | 0 | 0 | 0 | 111.8 | K145 Y216 I220 | K145-D218 HydrophobicContact CD-CB 4.29Å; K145-D218 VanDerWaalsContact CD-OD1 3.27Å; K145-D218 WeakPolarHBondContact CD-OD1 3.38Å; K145-D218 WeakPolarHBondContact CE-OD1 3.29Å; K145-D218 IonicContact NZ-OD1 2.72Å; K145-D218 PolarHBondContact NZ-OD1 2.97Å; K145-D218 VanDerWaalsContact NZ-OD1 3.12Å; K145-D218 IonicContact NZ-OD2 2.76Å; K145-D218 PolarHBondContact NZ-OD2 3.41Å; Y216-D218 HydrophobicContact CD1-CB 4.07Å; Y216-D218 WeakPolarHBondContact CD1-O 3.39Å; Y216-D218 HydrophobicContact CE1-CB 3.79Å; Y216-D218 PolarHBondContact O-N 2.88Å; D218-I220 PolarHBondContact O-N 3.41Å |
| 219 | P | 96.3 | Very high | 96.5 | Very high | 16 Ų | 16 | 58.3 Ų | 58.3 | 10% | 0.104 | 31% | 0.305 | C | S | . | . | P | Polyproline II helix | trans | -66.7 | 134.6 | 173.1 | 28.4 | -33 | 0 | 0 | 0 | 110.9 | A146 Y211 Y213 F257 | A146-P219 HydrophobicContact CB-CB 4.41Å; A146-P219 HydrophobicContact CB-CG 3.81Å; Y211-P219 HydrophobicContact CD1-CB 3.85Å; Y211-P219 HydrophobicContact CD1-CG 4.49Å; Y211-P219 HydrophobicContact CG-CB 4.41Å; Y213-P219 HydrophobicContact CD1-CB 4.33Å; Y213-P219 HydrophobicContact CE1-CB 3.87Å; Y213-P219 HydrophobicContact CE1-CG 4.24Å; Y213-P219 HydrophobicContact CE2-CB 4.14Å; P219-F257 HydrophobicContact CB-CE1 4.15Å; P219-F257 HydrophobicContact CB-CZ 3.93Å |
| 220 | I | 97.4 | Very high | 96.2 | Very high | 71 Ų | 71 | 60.5 Ų | 60.5 | 36% | 0.364 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 122.7 | -179.5 | -56.7 | 173.3 | 0 | 0 | 0 | 108.8 | Y211 K212 T214 D218 L222 | Y211-I220 CarbonylContact C-O 3.47Å; Y211-I220 WeakPolarHBondContact CA-O 3.17Å; K212-I220 PolarHBondContact N-O 3.48Å; K212-I220 PolarHBondContact O-N 3.18Å; T214-I220 HydrophobicContact CG2-CD1 3.86Å; D218-I220 PolarHBondContact O-N 3.41Å; I220-L222 PolarHBondContact O-N 3.47Å |
| 221 | L | 98.4 | Very high | 95.8 | Very high | 70 Ų | 70 | 69.9 Ų | 69.9 | 37% | 0.366 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.8 | 124.1 | 176.2 | -178.4 | 66.5 | 0 | 0 | 0 | 110 | Y209 Y211 M223 K224 | Y209-L221 HydrophobicContact CD1-CD1 3.86Å; Y209-L221 HydrophobicContact CG-CD1 4.35Å; Y211-L221 HydrophobicContact CD1-CB 4.11Å; Y211-L221 HydrophobicContact CD1-CD1 4.35Å; Y211-L221 HydrophobicContact CD2-CD1 4.24Å; Y211-L221 HydrophobicContact CE1-CB 3.68Å; Y211-L221 HydrophobicContact CE1-CD1 3.99Å; Y211-L221 HydrophobicContact CE1-CG 4.44Å; Y211-L221 HydrophobicContact CE2-CD1 3.88Å; Y211-L221 HydrophobicContact CG-CD1 4.46Å; L221-M223 VanDerWaalsContact CD1-O 3.27Å; L221-M223 WeakPolarHBondContact CD1-O 3.08Å; L221-K224 HydrophobicContact CD2-CB 4.49Å; L221-K224 HydrophobicContact CD2-CD 4.45Å |
| 222 | L | 98.4 | Very high | 95.3 | Very high | 30 Ų | 30 | 72 Ų | 72 | 16% | 0.157 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | -48.2 | 174.2 | -59.8 | -173 | 0 | 0 | 0 | 111.4 | I184 I210 K212 I220 F248 I256 | I184-L222 HydrophobicContact CD1-CD1 3.68Å; I210-L222 HydrophobicContact CG2-CD1 4.46Å; I210-L222 WeakPolarHBondContact O-CB 3.4Å; I210-L222 PolarHBondContact O-N 3.18Å; K212-L222 HydrophobicContact CB-CD1 3.96Å; K212-L222 HydrophobicContact CB-CD2 3.95Å; K212-L222 HydrophobicContact CB-CG 3.94Å; I220-L222 PolarHBondContact O-N 3.47Å; L222-F248 HydrophobicContact CB-CD1 4.18Å; L222-F248 HydrophobicContact CB-CE1 3.8Å; L222-F248 HydrophobicContact CB-CE2 4.2Å; L222-F248 HydrophobicContact CB-CZ 3.83Å; L222-F248 HydrophobicContact CD1-CB 4.4Å; L222-F248 HydrophobicContact CD1-CD1 4.23Å; L222-F248 HydrophobicContact CD1-CD2 4.22Å; L222-F248 HydrophobicContact CD1-CG 4Å; L222-F248 HydrophobicContact CD2-CD1 3.8Å; L222-F248 HydrophobicContact CD2-CE1 4.07Å; L222-F248 HydrophobicContact CD2-CG 4.38Å; L222-F248 HydrophobicContact CG-CD1 4.3Å; L222-F248 HydrophobicContact CG-CE1 4.38Å; L222-F248 WeakPolarHBondContact O-CZ 3.49Å; L222-I256 HydrophobicContact CD1-CG2 4.41Å |
| 223 | M | 98.6 | Very high | 94.7 | Very high | 24 Ų | 24 | 79.6 Ų | 79.6 | 12% | 0.118 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.6 | 150.4 | -175.5 | -59.2 | 176.7 | -84.9 | 0 | 0 | 111.3 | I184 Y209 I210 L221 Q244 G245 G246 F248 | I184-M223 HydrophobicContact CB-CE 4.11Å; I184-M223 HydrophobicContact CG2-CE 4.31Å; Y209-M223 WeakPolarHBondContact CA-O 3.45Å; I210-M223 HydrophobicContact CB-CB 4.41Å; I210-M223 HydrophobicContact CB-CE 4.12Å; I210-M223 HydrophobicContact CD1-CE 3.51Å; I210-M223 HydrophobicContact CG1-CE 4.38Å; I210-M223 HydrophobicContact CG2-CE 4.04Å; I210-M223 PolarHBondContact N-O 2.85Å; I210-M223 PolarHBondContact O-N 2.91Å; L221-M223 VanDerWaalsContact CD1-O 3.27Å; L221-M223 WeakPolarHBondContact CD1-O 3.08Å; M223-Q244 VanDerWaalsContact CB-OE1 3.26Å; M223-G245 VanDerWaalsContact SD-C 3.51Å; M223-G246 PolarHBondContact SD-N 3.41Å; M223-G246 VanDerWaalsContact SD-N 3.43Å; M223-F248 HydrophobicContact CE-CD2 4.26Å; M223-F248 HydrophobicContact CE-CE2 3.57Å; M223-F248 HydrophobicContact CE-CZ 4.36Å; M223-F248 HydrophobicContact CG-CE2 3.63Å; M223-F248 HydrophobicContact CG-CZ 3.48Å; M223-F248 VanDerWaalsContact CG-CZ 3.48Å; M223-F248 HydrophobicContact SD-CE2 3.62Å; M223-F248 HydrophobicContact SD-CZ 4.08Å |
| 224 | K | 98.4 | Very high | 94.2 | Very high | 146 Ų | 146 | 85 Ų | 85 | 64% | 0.635 | 44% | 0.439 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -138.5 | 142.3 | 167.8 | 73 | 179.6 | -176.6 | -179 | 0 | 110.8 | Q208 Y209 L221 Q244 | Q208-K224 CarbonylContact O-C 3.59Å; Q208-K224 VanDerWaalsContact O-CA 3.27Å; Q208-K224 WeakPolarHBondContact O-CA 3.35Å; Y209-K224 HydrophobicContact CD1-CB 3.76Å; Y209-K224 HydrophobicContact CE1-CB 4.12Å; Y209-K224 HydrophobicContact CE1-CD 4.41Å; L221-K224 HydrophobicContact CD2-CB 4.49Å; L221-K224 HydrophobicContact CD2-CD 4.45Å; K224-Q244 PolarHBondContact O-OE1 3.28Å |
| 225 | S | 98.4 | Very high | 93.9 | Very high | 33 Ų | 33 | 84.3 Ų | 84.3 | 23% | 0.231 | 44% | 0.437 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 135.1 | 172.5 | -176.1 | 0 | 0 | 0 | 0 | 109.1 | V207 Q208 I242 | V207-S225 WeakPolarHBondContact CA-O 3.25Å; Q208-S225 PolarHBondContact N-O 3.37Å; Q208-S225 PolarHBondContact O-N 2.84Å; S225-I242 WeakPolarHBondContact OG-CG2 3.3Å |
| 226 | A | 97.9 | Very high | 93.8 | Very high | 64 Ų | 64 | 85.6 Ų | 85.6 | 53% | 0.529 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.3 | 143.9 | -169.7 | 0 | 0 | 0 | 0 | 0 | 112 | M206 V207 | M206-A226 CarbonylContact O-C 3.54Å; M206-A226 VanDerWaalsContact O-CA 3.32Å; M206-A226 WeakPolarHBondContact O-CA 3.39Å; V207-A226 HydrophobicContact CB-CB 4.48Å; V207-A226 HydrophobicContact CG1-CB 4.14Å; V207-A226 HydrophobicContact CG2-CB 3.97Å |
| 227 | R | 96.8 | Very high | 93.9 | Very high | 156 Ų | 156 | 86.2 Ų | 86.2 | 59% | 0.589 | 43% | 0.433 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 155.3 | 169.9 | -65.4 | -66.2 | -174.2 | 159.4 | 0.1 | 109.4 | M206 Y240 I242 | M206-R227 HydrophobicContact CE-CB 4.02Å; M206-R227 PolarHBondContact N-O 3.32Å; M206-R227 PolarHBondContact O-N 2.98Å; R227-Y240 HydrophobicContact CB-CD1 4.47Å; R227-I242 HydrophobicContact CB-CD1 4.11Å; R227-I242 HydrophobicContact CG-CD1 3.89Å; R227-I242 HydrophobicContact CG-CG1 3.97Å |
| 228 | N | 95.4 | Very high | 94.2 | Very high | 95 Ų | 95 | 81.3 Ų | 81.3 | 51% | 0.508 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 149 | 167 | 60.4 | 70.2 | 0 | 0 | 0 | 109.7 | K204 W231 | K204-N228 WeakPolarHBondContact O-CA 3.22Å; N228-W231 PolarHBondContact OD1-NE1 2.95Å |
| 229 | S | 94.4 | Very high | 94.4 | Very high | 1 Ų | 1 | 83.7 Ų | 83.7 | 1% | 0.007 | 41% | 0.414 | C | S | . | . | trans | -66.2 | 160.4 | 172.5 | 58 | 0 | 0 | 0 | 0 | 111 | K204 W231 Y240 | K204-S229 PolarHBondContact N-OG 2.97Å; K204-S229 PolarHBondContact O-N 3.46Å; S229-W231 PolarHBondContact O-NE1 2.85Å; S229-Y240 WeakPolarHBondContact CA-OH 2.99Å | ||
| 230 | C | 91.8 | Very high | 94.4 | Very high | 69 Ų | 69 | 85.4 Ų | 85.4 | 47% | 0.466 | 42% | 0.418 | S | S | . | . | trans | -59.4 | 140.2 | 171.1 | -172.6 | 0 | 0 | 0 | 0 | 110.2 | S232 A235 Y240 | C230-S232 VanDerWaalsContact C-N 3.34Å; C230-A235 HydrophobicContact CB-CB 4.25Å; C230-Y240 PolarHBondContact N-OH 2.91Å | ||
| 231 | W | 90.7 | Very high | 94.5 | Very high | 198 Ų | 198 | 85.1 Ų | 85.1 | 75% | 0.75 | 42% | 0.423 | S | S | * | . | trans | -91.5 | -5.2 | -175.5 | -61.9 | 36.7 | 0 | 0 | 0 | 111.6 | N228 S229 | N228-W231 PolarHBondContact OD1-NE1 2.95Å; S229-W231 PolarHBondContact O-NE1 2.85Å | ||
| 232 | S | 88.3 | Confident | 94.5 | Very high | 56 Ų | 56 | 81.9 Ų | 81.9 | 39% | 0.392 | 41% | 0.406 | S | S | . | . | trans | -66.4 | 137.4 | 178.1 | -173.1 | 0 | 0 | 0 | 0 | 110.4 | C230 D234 A235 | C230-S232 VanDerWaalsContact C-N 3.34Å; S232-D234 PolarHBondContact O-N 3.35Å; S232-D234 PolarHBondContact OG-N 3.38Å; S232-D234 VanDerWaalsContact OG-N 3.16Å; S232-A235 WeakPolarHBondContact O-CB 3.42Å; S232-A235 PolarHBondContact O-N 3.47Å | ||
| 233 | K | 85.6 | Confident | 94.5 | Very high | 190 Ų | 190 | 85.7 Ų | 85.7 | 83% | 0.826 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | -20.2 | 171.2 | -63.8 | -176.6 | 179.3 | -177.6 | 0 | 112.2 | A235 | K233-A235 PolarHBondContact O-N 3.01Š|
| 234 | D | 87.4 | Confident | 94.5 | Very high | 141 Ų | 141 | 85.5 Ų | 85.5 | 75% | 0.754 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | 3 | 178.4 | -48.8 | -39.4 | 0 | 0 | 0 | 112.1 | S232 E236 | S232-D234 PolarHBondContact O-N 3.35Å; S232-D234 PolarHBondContact OG-N 3.38Å; S232-D234 VanDerWaalsContact OG-N 3.16Å; D234-E236 PolarHBondContact O-N 3.42Å |
| 235 | A | 89.2 | Confident | 94.5 | Very high | 21 Ų | 21 | 80 Ų | 80 | 17% | 0.174 | 40% | 0.402 | C | S | . | . | trans | -72.1 | 112.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | E194 C230 S232 K233 | E194-A235 WeakPolarHBondContact CB-O 3.39Å; E194-A235 WeakPolarHBondContact CG-O 3.28Å; C230-A235 HydrophobicContact CB-CB 4.25Å; S232-A235 WeakPolarHBondContact O-CB 3.42Å; S232-A235 PolarHBondContact O-N 3.47Å; K233-A235 PolarHBondContact O-N 3.01Å | ||
| 236 | E | 91.6 | Very high | 94.5 | Very high | 141 Ų | 141 | 79.2 Ų | 79.2 | 66% | 0.659 | 40% | 0.399 | S | S | * | . | trans | -85.7 | -26.9 | 180 | -64.3 | 179.8 | -175.4 | 0 | 0 | 113.4 | Q193 E194 D234 | Q193-E236 WeakPolarHBondContact CG-O 3.35Å; E194-E236 PolarHBondContact N-O 2.9Å; D234-E236 PolarHBondContact O-N 3.42Å | ||
| 237 | Y | 94 | Very high | 94.5 | Very high | 145 Ų | 145 | 80 Ų | 80 | 57% | 0.569 | 40% | 0.395 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -157.3 | 166.2 | -178.9 | 63 | -92.7 | 0 | 0 | 0 | 111 | F192 L239 | F192-Y237 CarbonylContact O-C 3.6Å; F192-Y237 VanDerWaalsContact O-CA 3.29Å; F192-Y237 WeakPolarHBondContact O-CA 3.46Å; F192-Y237 VanDerWaalsContact O-CB 3.3Å; F192-Y237 WeakPolarHBondContact O-CB 3.42Å; Y237-L239 HydrophobicContact CD2-CD1 4.34Å; Y237-L239 HydrophobicContact CD2-CD2 4.08Å; Y237-L239 HydrophobicContact CD2-CG 3.84Å; Y237-L239 HydrophobicContact CE2-CD1 3.95Å; Y237-L239 HydrophobicContact CE2-CG 3.9Å |
| 238 | G | 95.2 | Very high | 94.6 | Very high | 3 Ų | 3 | 75.1 Ų | 75.1 | 3% | 0.031 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 129 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | R191 F192 | R191-G238 WeakPolarHBondContact CA-O 3.36Å; F192-G238 PolarHBondContact N-O 3.23Å; F192-G238 VanDerWaalsContact N-O 3.09Å; F192-G238 PolarHBondContact O-N 3.42Å |
| 239 | L | 97.5 | Very high | 94.7 | Very high | 88 Ų | 88 | 74.1 Ų | 74.1 | 46% | 0.461 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.9 | 109 | 176.3 | -52.1 | -175.4 | 0 | 0 | 0 | 108.8 | Y189 R191 Y237 | Y189-L239 HydrophobicContact CE2-CB 4.05Å; Y189-L239 WeakPolarHBondContact OH-CD2 3.39Å; R191-L239 HydrophobicContact CB-CD2 4.32Å; R191-L239 HydrophobicContact CG-CD2 3.61Å; Y237-L239 HydrophobicContact CD2-CD1 4.34Å; Y237-L239 HydrophobicContact CD2-CD2 4.08Å; Y237-L239 HydrophobicContact CD2-CG 3.84Å; Y237-L239 HydrophobicContact CE2-CD1 3.95Å; Y237-L239 HydrophobicContact CE2-CG 3.9Å |
| 240 | Y | 98.1 | Very high | 94.8 | Very high | 51 Ų | 51 | 74.1 Ų | 74.1 | 20% | 0.2 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 101.2 | -175.7 | -58.1 | -92.4 | 0 | 0 | 0 | 111 | F190 F192 M206 R227 S229 C230 | F190-Y240 PolarHBondContact N-O 2.76Å; F190-Y240 PolarHBondContact O-N 3Å; F192-Y240 HydrophobicContact CE1-CD2 4.13Å; F192-Y240 HydrophobicContact CE1-CE2 4.25Å; F192-Y240 HydrophobicContact CZ-CD2 4.29Å; F192-Y240 AromaticContact CZ-CE2 3.94Å; F192-Y240 HydrophobicContact CZ-CE2 3.94Å; M206-Y240 HydrophobicContact CE-CD1 3.8Å; M206-Y240 HydrophobicContact CE-CD2 3.48Å; M206-Y240 VanDerWaalsContact CE-CD2 3.48Å; M206-Y240 HydrophobicContact CE-CE1 4.07Å; M206-Y240 HydrophobicContact CE-CE2 3.77Å; M206-Y240 HydrophobicContact CE-CG 3.5Å; M206-Y240 VanDerWaalsContact CE-CG 3.5Å; M206-Y240 HydrophobicContact SD-CD2 3.47Å; M206-Y240 WeakPolarHBondContact SD-CD2 3.42Å; M206-Y240 HydrophobicContact SD-CE2 4.19Å; M206-Y240 HydrophobicContact SD-CG 3.7Å; R227-Y240 HydrophobicContact CB-CD1 4.47Å; S229-Y240 WeakPolarHBondContact CA-OH 2.99Å; C230-Y240 PolarHBondContact N-OH 2.91Å |
| 241 | S | 98.3 | Very high | 95.1 | Very high | 65 Ų | 65 | 76.3 Ų | 76.3 | 46% | 0.455 | 37% | 0.372 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.7 | 123.3 | 168.3 | -58.7 | 0 | 0 | 0 | 0 | 109.8 | Y189 | Y189-S241 VanDerWaalsContact CD2-OG 3.24Å; Y189-S241 WeakPolarHBondContact CD2-OG 3.38Å |
| 242 | I | 98.6 | Very high | 95.4 | Very high | 3 Ų | 3 | 72.9 Ų | 72.9 | 2% | 0.015 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.5 | 108.1 | 175.4 | -58 | -175.8 | 0 | 0 | 0 | 107.8 | Q187 T188 F190 M206 Q208 S225 R227 | Q187-I242 CarbonylContact C-O 3.59Å; Q187-I242 VanDerWaalsContact CA-O 3.27Å; Q187-I242 WeakPolarHBondContact CA-O 3.06Å; T188-I242 PolarHBondContact N-O 2.9Å; T188-I242 PolarHBondContact O-N 3.01Å; F190-I242 HydrophobicContact CD2-CD1 4.07Å; F190-I242 HydrophobicContact CD2-CG1 4.32Å; F190-I242 HydrophobicContact CE2-CD1 3.77Å; F190-I242 HydrophobicContact CE2-CG1 4.32Å; M206-I242 HydrophobicContact CB-CD1 4.05Å; M206-I242 WeakPolarHBondContact O-CD1 3.33Å; Q208-I242 HydrophobicContact CB-CG2 3.99Å; Q208-I242 PolarHBondContact NE2-O 2.91Å; S225-I242 WeakPolarHBondContact OG-CG2 3.3Å; R227-I242 HydrophobicContact CB-CD1 4.11Å; R227-I242 HydrophobicContact CG-CD1 3.89Å; R227-I242 HydrophobicContact CG-CG1 3.97Å |
| 243 | Y | 98.8 | Very high | 95.8 | Very high | 109 Ų | 109 | 75 Ų | 75 | 43% | 0.427 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.3 | 137 | 169.5 | 178.7 | -88.4 | 0 | 0 | 0 | 109.9 | Y183 Y185 S186 Q187 F274 | Y183-Y243 PolarHBondContact OH-OH 3.38Å; Y185-Y243 WeakPolarHBondContact CB-OH 3.47Å; Y185-Y243 AromaticContact CD2-CE2 3.99Å; Y185-Y243 HydrophobicContact CD2-CE2 3.99Å; Y185-Y243 HydrophobicContact CG-CE2 4.41Å; S186-Y243 WeakPolarHBondContact O-CA 3.17Å; Q187-Y243 HydrophobicContact CB-CD2 4.19Å; Y243-F274 HydrophobicContact CD2-CE2 4.34Å; Y243-F274 HydrophobicContact CE2-CE2 4.33Å |
| 244 | Q | 98.6 | Very high | 96.5 | Very high | 20 Ų | 20 | 66.1 Ų | 66.1 | 9% | 0.093 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.2 | 156.4 | 166.7 | 78.6 | -168.7 | -57.1 | 0 | 0 | 110.4 | Y185 S186 Q208 I210 M223 K224 | Y185-Q244 VanDerWaalsContact CA-O 3.25Å; Y185-Q244 WeakPolarHBondContact CA-O 2.97Å; S186-Q244 PolarHBondContact N-O 3.49Å; S186-Q244 PolarHBondContact O-N 2.91Å; S186-Q244 VanDerWaalsContact O-N 3.09Å; Q208-Q244 PolarHBondContact O-NE2 3.42Å; Q208-Q244 VanDerWaalsContact OE1-CG 3.29Å; I210-Q244 HydrophobicContact CD1-CG 3.76Å; M223-Q244 VanDerWaalsContact CB-OE1 3.26Å; K224-Q244 PolarHBondContact O-OE1 3.28Å |
| 245 | G | 98.4 | Very high | 97 | Very high | 30 Ų | 30 | 63.2 Ų | 63.2 | 31% | 0.309 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -162.8 | 159.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | I184 M223 | I184-G245 CarbonylContact O-C 3.5Å; I184-G245 WeakPolarHBondContact O-CA 3.34Å; M223-G245 VanDerWaalsContact SD-C 3.51Å |
| 246 | G | 97.7 | Very high | 97.4 | Very high | 17 Ų | 17 | 62.2 Ų | 62.2 | 18% | 0.175 | 30% | 0.3 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -169.5 | 164 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113 | Y183 I184 M223 | Y183-G246 WeakPolarHBondContact CA-O 3.16Å; I184-G246 PolarHBondContact N-O 3.46Å; I184-G246 PolarHBondContact O-N 3.03Å; M223-G246 PolarHBondContact SD-N 3.41Å; M223-G246 VanDerWaalsContact SD-N 3.43Å |
| 247 | L | 98 | Very high | 97.8 | Very high | 82 Ų | 82 | 55.5 Ų | 55.5 | 43% | 0.429 | 27% | 0.269 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 126.7 | -176.8 | -169.2 | 73.8 | 0 | 0 | 0 | 111 | F181 Y182 V280 | F181-L247 HydrophobicContact CB-CD1 3.95Å; F181-L247 HydrophobicContact CB-CD2 4.41Å; F181-L247 HydrophobicContact CB-CG 4.18Å; F181-L247 HydrophobicContact CD1-CD2 4.46Å; F181-L247 HydrophobicContact CD1-CG 4.43Å; Y182-L247 WeakPolarHBondContact O-CA 3.45Å; L247-V280 HydrophobicContact CD1-CB 3.97Å; L247-V280 HydrophobicContact CD1-CG1 4.41Å; L247-V280 HydrophobicContact CD1-CG2 3.72Å |
| 248 | F | 98.2 | Very high | 98 | Very high | 52 Ų | 52 | 48.6 Ų | 48.6 | 23% | 0.228 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -137.9 | 141 | 179.3 | -64.1 | -90.2 | 0 | 0 | 0 | 111.4 | F181 Y182 I184 L222 M223 L250 | F181-F248 WeakPolarHBondContact CA-O 3.27Å; Y182-F248 PolarHBondContact N-O 3.03Å; Y182-F248 PolarHBondContact O-N 3.5Å; I184-F248 HydrophobicContact CD1-CB 4.16Å; I184-F248 HydrophobicContact CD1-CD2 3.97Å; I184-F248 HydrophobicContact CD1-CG 4.37Å; L222-F248 HydrophobicContact CB-CD1 4.18Å; L222-F248 HydrophobicContact CB-CE1 3.8Å; L222-F248 HydrophobicContact CB-CE2 4.2Å; L222-F248 HydrophobicContact CB-CZ 3.83Å; L222-F248 HydrophobicContact CD1-CB 4.4Å; L222-F248 HydrophobicContact CD1-CD1 4.23Å; L222-F248 HydrophobicContact CD1-CD2 4.22Å; L222-F248 HydrophobicContact CD1-CG 4Å; L222-F248 HydrophobicContact CD2-CD1 3.8Å; L222-F248 HydrophobicContact CD2-CE1 4.07Å; L222-F248 HydrophobicContact CD2-CG 4.38Å; L222-F248 HydrophobicContact CG-CD1 4.3Å; L222-F248 HydrophobicContact CG-CE1 4.38Å; L222-F248 WeakPolarHBondContact O-CZ 3.49Å; M223-F248 HydrophobicContact CE-CD2 4.26Å; M223-F248 HydrophobicContact CE-CE2 3.57Å; M223-F248 HydrophobicContact CE-CZ 4.36Å; M223-F248 HydrophobicContact CG-CE2 3.63Å; M223-F248 HydrophobicContact CG-CZ 3.48Å; M223-F248 VanDerWaalsContact CG-CZ 3.48Å; M223-F248 HydrophobicContact SD-CE2 3.62Å; M223-F248 HydrophobicContact SD-CZ 4.08Å; F248-L250 HydrophobicContact CB-CD2 4.38Å |
| 249 | E | 97.6 | Very high | 98.1 | Very high | 75 Ų | 75 | 48.5 Ų | 48.5 | 35% | 0.35 | 24% | 0.241 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -75.3 | 124.8 | 168.2 | -165.3 | -175 | 176 | 0 | 0 | 109.7 | K179 G180 F181 K212 | K179-E249 WeakPolarHBondContact CE-OE1 3.32Å; K179-E249 IonicContact NZ-OE1 2.7Å; K179-E249 PolarHBondContact NZ-OE1 3.18Å; G180-E249 WeakPolarHBondContact O-CA 3.26Å; F181-E249 HydrophobicContact CD1-CB 3.93Å; F181-E249 HydrophobicContact CD1-CG 4.48Å; F181-E249 HydrophobicContact CE1-CB 3.72Å; F181-E249 HydrophobicContact CE1-CG 4.22Å; F181-E249 HydrophobicContact CZ-CB 4.4Å; F181-E249 HydrophobicContact CZ-CG 4.46Å; K212-E249 PolarHBondContact NZ-O 2.91Å |
| 250 | L | 97.9 | Very high | 98.2 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 140.3 | 177.2 | -54.2 | -179.7 | 0 | 0 | 0 | 109.8 | I176 K179 G180 Y182 I184 K212 F248 D254 I256 | I176-L250 HydrophobicContact CD1-CD1 3.5Å; I176-L250 VanDerWaalsContact CD1-CD1 3.5Å; I176-L250 HydrophobicContact CG1-CB 4.01Å; I176-L250 HydrophobicContact CG1-CD1 3.59Å; I176-L250 HydrophobicContact CG1-CG 4.42Å; I176-L250 HydrophobicContact CG2-CB 4.23Å; K179-L250 WeakPolarHBondContact CA-O 3.42Å; G180-L250 PolarHBondContact N-O 3Å; G180-L250 VanDerWaalsContact N-O 3.08Å; G180-L250 PolarHBondContact O-N 2.99Å; Y182-L250 HydrophobicContact CD2-CB 3.83Å; Y182-L250 HydrophobicContact CD2-CD1 3.73Å; Y182-L250 HydrophobicContact CD2-CG 3.92Å; Y182-L250 HydrophobicContact CE2-CB 4.19Å; Y182-L250 HydrophobicContact CE2-CD1 4.5Å; Y182-L250 HydrophobicContact CG-CD1 3.78Å; Y182-L250 HydrophobicContact CG-CG 4.37Å; I184-L250 HydrophobicContact CD1-CD1 4.02Å; I184-L250 HydrophobicContact CD1-CD2 4.42Å; K212-L250 HydrophobicContact CD-CD2 3.32Å; K212-L250 HydrophobicContact CG-CD2 4.36Å; F248-L250 HydrophobicContact CB-CD2 4.38Å; L250-D254 HydrophobicContact CB-CB 4.35Å; L250-I256 HydrophobicContact CD1-CD1 4.34Å; L250-I256 HydrophobicContact CD1-CG2 4.02Å; L250-I256 HydrophobicContact CD2-CG2 4.13Å |
| 251 | K | 97.8 | Very high | 98.1 | Very high | 116 Ų | 116 | 43.4 Ų | 43.4 | 50% | 0.504 | 22% | 0.219 | S | C | . | . | trans | -88 | 160.3 | 172.6 | -61.9 | 178.3 | -176.7 | 178.3 | 0 | 109.6 | I176 D253 D254 | I176-K251 WeakPolarHBondContact CG2-O 3.25Å; K251-D253 PolarHBondContact O-N 3.48Å; K251-D254 PolarHBondContact N-OD2 3.39Å; K251-D254 VanDerWaalsContact O-CB 3.26Å; K251-D254 WeakPolarHBondContact O-CB 3.36Å; K251-D254 PolarHBondContact O-N 2.98Å; K251-D254 VanDerWaalsContact O-N 3.09Å | ||
| 252 | K | 97 | Very high | 98 | Very high | 125 Ų | 125 | 42.9 Ų | 42.9 | 54% | 0.543 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | 138.8 | 165.6 | -178.6 | 174.8 | 179.1 | -179.7 | 0 | 109.5 | Q177 D254 | Q177-K252 WeakPolarHBondContact O-CD 3.37Å; Q177-K252 WeakPolarHBondContact O-CG 3.39Å; K252-D254 PolarHBondContact O-N 3.3Å |
| 253 | D | 97.5 | Very high | 97.8 | Very high | 101 Ų | 101 | 44 Ų | 44 | 54% | 0.54 | 22% | 0.216 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 67.5 | 3.8 | -176.6 | -51 | -48.1 | 0 | 0 | 0 | 115.4 | I176 K251 | I176-D253 PolarHBondContact O-N 2.82Å; K251-D253 PolarHBondContact O-N 3.48Å |
| 254 | D | 98.4 | Very high | 97.5 | Very high | 4 Ų | 4 | 46 Ų | 46 | 2% | 0.021 | 23% | 0.229 | C | C | . | . | trans | -60 | 146.4 | 162.7 | -78.8 | -5.1 | 0 | 0 | 0 | 109 | I176 K212 Y213 T214 L250 K251 K252 | I176-D254 HydrophobicContact CG1-CB 4.28Å; I176-D254 WeakPolarHBondContact CG1-O 3.4Å; I176-D254 PolarHBondContact N-O 3.39Å; K212-D254 HydrophobicContact CD-CB 4.31Å; K212-D254 WeakPolarHBondContact CD-OD2 3.37Å; K212-D254 HydrophobicContact CG-CB 4.45Å; K212-D254 IonicContact NZ-OD2 3.16Å; K212-D254 PolarHBondContact NZ-OD2 3.28Å; Y213-D254 WeakPolarHBondContact O-CA 3.17Å; T214-D254 WeakPolarHBondContact CA-OD1 3.27Å; T214-D254 WeakPolarHBondContact CB-OD1 3.34Å; T214-D254 PolarHBondContact OG1-OD1 3.4Å; L250-D254 HydrophobicContact CB-CB 4.35Å; K251-D254 PolarHBondContact N-OD2 3.39Å; K251-D254 VanDerWaalsContact O-CB 3.26Å; K251-D254 WeakPolarHBondContact O-CB 3.36Å; K251-D254 PolarHBondContact O-N 2.98Å; K251-D254 VanDerWaalsContact O-N 3.09Å; K252-D254 PolarHBondContact O-N 3.3Å | ||
| 255 | R | 98.4 | Very high | 97.4 | Very high | 79 Ų | 79 | 46 Ų | 46 | 30% | 0.298 | 23% | 0.229 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 128.8 | -178.7 | -50 | 174.6 | -71 | 153 | -5.4 | 109.1 | E173 L174 V175 K212 Y213 | E173-R255 HydrophobicContact CB-CB 4.18Å; E173-R255 IonicContact OE1-NH1 3.82Å; E173-R255 WeakPolarHBondContact OE2-CD 2.99Å; E173-R255 IonicContact OE2-CZ 2.64Å; E173-R255 IonicContact OE2-NE 3.35Å; E173-R255 IonicContact OE2-NH1 2.73Å; E173-R255 PolarHBondContact OE2-NH1 3.34Å; L174-R255 WeakPolarHBondContact O-CA 3.46Å; V175-R255 HydrophobicContact CG1-CG 4.33Å; V175-R255 HydrophobicContact CG2-CG 4.13Å; K212-R255 CarbonylContact C-O 3.01Å; K212-R255 WeakPolarHBondContact CA-O 3.47Å; Y213-R255 VanDerWaalsContact CG-NH2 3.27Å; Y213-R255 PolarHBondContact N-O 3Å; Y213-R255 PolarHBondContact O-N 2.94Å |
| 256 | I | 98.7 | Very high | 97.3 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 22% | 0.22 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 142.6 | 179.7 | 59.3 | 174.6 | 0 | 0 | 0 | 110.5 | E173 L174 I176 I184 Y211 K212 L222 L250 F275 A277 | E173-I256 CarbonylContact C-O 3.54Å; E173-I256 VanDerWaalsContact CA-O 3.28Å; E173-I256 WeakPolarHBondContact CA-O 3.25Å; L174-I256 HydrophobicContact CB-CD1 4.24Å; L174-I256 HydrophobicContact CB-CG1 3.74Å; L174-I256 HydrophobicContact CD1-CD1 4.38Å; L174-I256 PolarHBondContact N-O 2.04Å; L174-I256 PolarHBondContact O-N 3.37Å; I176-I256 HydrophobicContact CD1-CD1 4.47Å; I184-I256 HydrophobicContact CD1-CD1 3.97Å; I184-I256 HydrophobicContact CD1-CG2 4.19Å; I184-I256 HydrophobicContact CG1-CD1 3.96Å; I184-I256 HydrophobicContact CG2-CD1 3.9Å; Y211-I256 VanDerWaalsContact O-CA 3.27Å; Y211-I256 WeakPolarHBondContact O-CA 3.44Å; K212-I256 HydrophobicContact CB-CG2 4.27Å; K212-I256 HydrophobicContact CG-CG2 4.28Å; L222-I256 HydrophobicContact CD1-CG2 4.41Å; L250-I256 HydrophobicContact CD1-CD1 4.34Å; L250-I256 HydrophobicContact CD1-CG2 4.02Å; L250-I256 HydrophobicContact CD2-CG2 4.13Å; I256-F275 HydrophobicContact CB-CZ 4.19Å; I256-F275 HydrophobicContact CD1-CZ 3.79Å; I256-F275 HydrophobicContact CG1-CE1 4.21Å; I256-F275 HydrophobicContact CG1-CZ 3.73Å; I256-A277 HydrophobicContact CD1-CB 3.99Å |
| 257 | F | 98.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 22% | 0.217 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.3 | 163 | -178.4 | 65.7 | -86.6 | 0 | 0 | 0 | 112.5 | A146 K150 E173 I210 Y211 Y213 P219 | A146-F257 HydrophobicContact CB-CE2 4.26Å; A146-F257 HydrophobicContact CB-CZ 4.15Å; K150-F257 HydrophobicContact CB-CD2 4.16Å; K150-F257 HydrophobicContact CB-CE2 4.33Å; K150-F257 HydrophobicContact CD-CB 3.99Å; K150-F257 HydrophobicContact CD-CD1 4.43Å; K150-F257 HydrophobicContact CD-CD2 3.43Å; K150-F257 VanDerWaalsContact CD-CD2 3.43Å; K150-F257 HydrophobicContact CD-CE2 3.92Å; K150-F257 HydrophobicContact CD-CG 3.71Å; K150-F257 HydrophobicContact CG-CB 4.35Å; K150-F257 HydrophobicContact CG-CD2 3.64Å; K150-F257 HydrophobicContact CG-CE2 4.24Å; K150-F257 HydrophobicContact CG-CG 4.25Å; E173-F257 HydrophobicContact CB-CB 4.46Å; E173-F257 HydrophobicContact CG-CB 3.87Å; E173-F257 HydrophobicContact CG-CD1 4.27Å; E173-F257 HydrophobicContact CG-CG 4.35Å; I210-F257 WeakPolarHBondContact CA-O 3.48Å; Y211-F257 VanDerWaalsContact CB-CE1 3.4Å; Y211-F257 AromaticContact CD2-CE2 3.92Å; Y211-F257 HydrophobicContact CD2-CE2 3.92Å; Y211-F257 HydrophobicContact CD2-CZ 4.15Å; Y211-F257 HydrophobicContact CG-CE1 4.36Å; Y211-F257 HydrophobicContact CG-CE2 4.02Å; Y211-F257 AromaticContact CG-CZ 3.78Å; Y211-F257 HydrophobicContact CG-CZ 3.78Å; Y211-F257 PolarHBondContact N-O 2.74Å; Y211-F257 PolarHBondContact O-N 3.49Å; Y213-F257 HydrophobicContact CD2-CD1 4.12Å; Y213-F257 AromaticContact CD2-CE1 3.54Å; Y213-F257 HydrophobicContact CD2-CE1 3.54Å; Y213-F257 HydrophobicContact CD2-CZ 4.48Å; Y213-F257 HydrophobicContact CE2-CD1 4.37Å; Y213-F257 AromaticContact CE2-CE1 3.53Å; Y213-F257 HydrophobicContact CE2-CE1 3.53Å; Y213-F257 HydrophobicContact CE2-CZ 4.05Å; P219-F257 HydrophobicContact CB-CE1 4.15Å; P219-F257 HydrophobicContact CB-CZ 3.93Å |
| 258 | V | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 135.9 | 177.7 | -177 | 0 | 0 | 0 | 0 | 109.3 | K150 I151 W154 S186 T188 Q208 Y209 I210 V260 F275 | K150-V258 WeakPolarHBondContact CA-O 3.28Å; I151-V258 HydrophobicContact CD1-CG1 4.08Å; I151-V258 PolarHBondContact N-O 3.33Å; W154-V258 HydrophobicContact CZ2-CB 4.08Å; W154-V258 HydrophobicContact CZ2-CG1 4.47Å; W154-V258 HydrophobicContact CZ2-CG2 4.21Å; S186-V258 WeakPolarHBondContact OG-CG2 3.34Å; T188-V258 HydrophobicContact CG2-CG1 4.18Å; Q208-V258 HydrophobicContact CG-CG1 3.95Å; Y209-V258 CarbonylContact O-C 3.55Å; Y209-V258 WeakPolarHBondContact O-CA 3.38Å; I210-V258 HydrophobicContact CG1-CG2 4.47Å; V258-V260 HydrophobicContact CG1-CG1 4.37Å; V258-F275 HydrophobicContact CG2-CB 4.09Å; V258-F275 HydrophobicContact CG2-CD1 3.95Å; V258-F275 HydrophobicContact CG2-CD2 3.48Å; V258-F275 VanDerWaalsContact CG2-CD2 3.48Å; V258-F275 HydrophobicContact CG2-CE1 4.24Å; V258-F275 HydrophobicContact CG2-CE2 3.83Å; V258-F275 HydrophobicContact CG2-CG 3.58Å; V258-F275 HydrophobicContact CG2-CZ 4.19Å |
| 259 | S | 98.2 | Very high | 96.8 | Very high | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.007 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 147.3 | 171.7 | -176 | 0 | 0 | 0 | 0 | 109.8 | L147 R149 K150 Y209 | L147-S259 WeakPolarHBondContact O-CB 3.2Å; L147-S259 PolarHBondContact O-OG 3.45Å; R149-S259 PolarHBondContact N-OG 2.95Å; R149-S259 VanDerWaalsContact N-OG 3.08Å; R149-S259 VanDerWaalsContact O-CA 3.32Å; R149-S259 WeakPolarHBondContact O-CA 3.48Å; R149-S259 PolarHBondContact O-OG 3.48Å; K150-S259 PolarHBondContact N-OG 3.2Å; Y209-S259 WeakPolarHBondContact CD2-O 3.49Å; Y209-S259 PolarHBondContact N-O 2.88Å; Y209-S259 PolarHBondContact O-N 3.22Å |
| 260 | V | 98.2 | Very high | 96.6 | Very high | 1 Ų | 1 | 41.8 Ų | 41.8 | 1% | 0.006 | 20% | 0.198 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 149.7 | -176.8 | -65.9 | 0 | 0 | 0 | 0 | 112.6 | G148 R149 I151 T188 F190 V207 Q208 V258 E263 I266 | G148-V260 CarbonylContact C-O 3.49Å; G148-V260 WeakPolarHBondContact CA-O 3.38Å; R149-V260 PolarHBondContact N-O 3.39Å; R149-V260 PolarHBondContact O-N 3.2Å; I151-V260 HydrophobicContact CD1-CG1 3.84Å; I151-V260 HydrophobicContact CD1-CG2 4.06Å; I151-V260 HydrophobicContact CG1-CG1 4.49Å; I151-V260 HydrophobicContact CG1-CG2 4.02Å; T188-V260 HydrophobicContact CG2-CG1 3.85Å; F190-V260 HydrophobicContact CZ-CB 4.18Å; F190-V260 HydrophobicContact CZ-CG1 4.32Å; V207-V260 VanDerWaalsContact O-CA 3.25Å; V207-V260 WeakPolarHBondContact O-CA 3.24Å; Q208-V260 HydrophobicContact CB-CG1 4.49Å; Q208-V260 HydrophobicContact CG-CG1 4.37Å; V258-V260 HydrophobicContact CG1-CG1 4.37Å; V260-E263 HydrophobicContact CG2-CB 4.02Å; V260-E263 HydrophobicContact CG2-CG 4.25Å; V260-I266 HydrophobicContact CG1-CD1 4.47Å; V260-I266 HydrophobicContact CG2-CD1 4.43Å; V260-I266 HydrophobicContact CG2-CG1 4.02Å |
| 261 | T | 96.8 | Very high | 96.3 | Very high | 31 Ų | 31 | 47.6 Ų | 47.6 | 19% | 0.19 | 23% | 0.226 | C | C | . | . | S | Bend | trans | -72.8 | 162.1 | 157.9 | 57.4 | 0 | 0 | 0 | 0 | 109.7 | F190 Q205 V207 Y209 E263 | F190-T261 VanDerWaalsContact CE1-O 3.26Å; F190-T261 WeakPolarHBondContact CE1-O 3.4Å; Q205-T261 WeakPolarHBondContact O-CB 3.36Å; Q205-T261 PolarHBondContact O-OG1 2.9Å; V207-T261 HydrophobicContact CB-CG2 4.05Å; V207-T261 HydrophobicContact CG2-CG2 4.15Å; V207-T261 PolarHBondContact N-OG1 3.41Å; V207-T261 PolarHBondContact O-N 3.4Å; Y209-T261 HydrophobicContact CE2-CG2 4.18Å; T261-E263 VanDerWaalsContact C-N 3.27Å; T261-E263 PolarHBondContact O-N 3.4Å; T261-E263 VanDerWaalsContact O-N 3.09Å |
| 262 | N | 95.1 | Very high | 96.2 | Very high | 54 Ų | 54 | 42.9 Ų | 42.9 | 29% | 0.289 | 21% | 0.208 | S | C | . | . | S | Bend | trans | 47.3 | 44.8 | 172.8 | -60.5 | -58.6 | 0 | 0 | 0 | 114.7 | F190 Q205 H264 L265 | F190-N262 HydrophobicContact CE1-CB 4.38Å; Q205-N262 PolarHBondContact O-ND2 2.91Å; N262-H264 PolarHBondContact O-N 2.97Å; N262-L265 HydrophobicContact CB-CD1 3.71Å; N262-L265 HydrophobicContact CB-CG 4.05Å; N262-L265 WeakPolarHBondContact O-CB 3.38Å; N262-L265 PolarHBondContact O-N 3.35Å |
| 263 | E | 94.9 | Very high | 96.2 | Very high | 28 Ų | 28 | 37 Ų | 37 | 13% | 0.131 | 18% | 0.182 | C | C | . | . | G | 310 helix | trans | -49.7 | -34.2 | -177.6 | -172.8 | -163.6 | 152.9 | 0 | 0 | 113.3 | N134 R149 V260 T261 L265 I266 | N134-E263 PolarHBondContact ND2-OE1 3.02Å; N134-E263 PolarHBondContact OD1-OE1 2.85Å; R149-E263 HydrophobicContact CB-CB 4.3Å; R149-E263 WeakPolarHBondContact CB-OE2 3.28Å; R149-E263 WeakPolarHBondContact CD-OE2 3.47Å; R149-E263 IonicContact CZ-OE2 3.28Å; R149-E263 VanDerWaalsContact CZ-OE2 3.28Å; R149-E263 IonicContact NE-OE2 3.07Å; R149-E263 PolarHBondContact NE-OE2 3.04Å; R149-E263 IonicContact NH2-OE2 3.18Å; R149-E263 PolarHBondContact NH2-OE2 2.92Å; V260-E263 HydrophobicContact CG2-CB 4.02Å; V260-E263 HydrophobicContact CG2-CG 4.25Å; T261-E263 VanDerWaalsContact C-N 3.27Å; T261-E263 PolarHBondContact O-N 3.4Å; T261-E263 VanDerWaalsContact O-N 3.09Å; E263-L265 PolarHBondContact O-N 3.04Å; E263-L265 VanDerWaalsContact O-N 3.12Å; E263-I266 WeakPolarHBondContact O-CB 3.36Å; E263-I266 WeakPolarHBondContact O-CG1 3.41Å; E263-I266 PolarHBondContact O-N 3.48Å |
| 264 | H | 93.1 | Very high | 96.2 | Very high | 149 Ų | 149 | 33.7 Ų | 33.7 | 69% | 0.69 | 16% | 0.163 | S | C | * | . | G | 310 helix | trans | -64.3 | -13 | 178.5 | 63.9 | -80.2 | 0 | 0 | 0 | 114.5 | N262 | N262-H264 PolarHBondContact O-N 2.97Š|
| 265 | L | 95.3 | Very high | 96.2 | Very high | 20 Ų | 20 | 33.5 Ų | 33.5 | 11% | 0.105 | 16% | 0.162 | C | C | . | . | G | 310 helix | trans | -99 | 0.1 | 176.1 | -49.8 | 179.6 | 0 | 0 | 0 | 112.4 | F190 R191 F192 K204 N262 E263 | F190-L265 CarbonylContact C-O 3.55Å; F190-L265 WeakPolarHBondContact CA-O 3.37Å; F190-L265 HydrophobicContact CD1-CB 4.3Å; R191-L265 PolarHBondContact N-O 3.3Å; F192-L265 HydrophobicContact CB-CB 4.42Å; F192-L265 HydrophobicContact CB-CD2 3.75Å; F192-L265 HydrophobicContact CB-CG 4.45Å; F192-L265 HydrophobicContact CD1-CB 4.09Å; F192-L265 HydrophobicContact CD1-CD1 3.76Å; F192-L265 HydrophobicContact CD1-CD2 4.46Å; F192-L265 HydrophobicContact CD1-CG 4.32Å; F192-L265 HydrophobicContact CE1-CD1 4.22Å; F192-L265 HydrophobicContact CG-CD1 4.21Å; F192-L265 HydrophobicContact CG-CD2 4.27Å; K204-L265 HydrophobicContact CD-CD1 3.74Å; N262-L265 HydrophobicContact CB-CD1 3.71Å; N262-L265 HydrophobicContact CB-CG 4.05Å; N262-L265 WeakPolarHBondContact O-CB 3.38Å; N262-L265 PolarHBondContact O-N 3.35Å; E263-L265 PolarHBondContact O-N 3.04Å; E263-L265 VanDerWaalsContact O-N 3.12Å |
| 266 | I | 96.5 | Very high | 96.2 | Very high | 23 Ų | 23 | 29.7 Ų | 29.7 | 12% | 0.118 | 15% | 0.148 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 126.9 | 179.6 | -60.6 | -61 | 0 | 0 | 0 | 109.8 | Y189 F190 V260 E263 M268 | Y189-I266 CarbonylContact O-C 3.55Å; Y189-I266 WeakPolarHBondContact O-CA 3.47Å; F190-I266 HydrophobicContact CD1-CD1 3.54Å; F190-I266 HydrophobicContact CD2-CD1 3.78Å; F190-I266 HydrophobicContact CE1-CD1 3.41Å; F190-I266 VanDerWaalsContact CE1-CD1 3.41Å; F190-I266 HydrophobicContact CE1-CG1 4.36Å; F190-I266 HydrophobicContact CE2-CD1 3.64Å; F190-I266 HydrophobicContact CG-CD1 3.74Å; F190-I266 HydrophobicContact CZ-CD1 3.47Å; F190-I266 VanDerWaalsContact CZ-CD1 3.47Å; V260-I266 HydrophobicContact CG1-CD1 4.47Å; V260-I266 HydrophobicContact CG2-CD1 4.43Å; V260-I266 HydrophobicContact CG2-CG1 4.02Å; E263-I266 WeakPolarHBondContact O-CB 3.36Å; E263-I266 WeakPolarHBondContact O-CG1 3.41Å; E263-I266 PolarHBondContact O-N 3.48Å; I266-M268 HydrophobicContact CG2-CG 4.06Å; I266-M268 HydrophobicContact CG2-SD 3.59Å; I266-M268 VanDerWaalsContact CG2-SD 3.59Å |
| 267 | D | 96 | Very high | 96.2 | Very high | 18 Ų | 18 | 29.8 Ų | 29.8 | 10% | 0.096 | 15% | 0.149 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 120 | 165.2 | -162.4 | -38.2 | 0 | 0 | 0 | 109.6 | Y189 R191 D269 S273 | Y189-D267 HydrophobicContact CD1-CB 3.65Å; Y189-D267 HydrophobicContact CE1-CB 4.37Å; Y189-D267 HydrophobicContact CG-CB 4.35Å; Y189-D267 PolarHBondContact O-N 2.98Å; R191-D267 HydrophobicContact CB-CB 4.19Å; R191-D267 IonicContact CZ-OD2 2.65Å; R191-D267 IonicContact NE-OD2 2.72Å; R191-D267 PolarHBondContact NE-OD2 3.24Å; R191-D267 IonicContact NH2-OD2 2.9Å; R191-D267 PolarHBondContact NH2-OD2 2.96Å; D267-D269 WeakPolarHBondContact OD1-CB 3.38Å; D267-D269 VanDerWaalsContact OD1-CG 3.31Å; D267-D269 PolarHBondContact OD1-N 3.3Å; D267-S273 VanDerWaalsContact O-CB 3.31Å; D267-S273 WeakPolarHBondContact O-CB 3.46Å; D267-S273 PolarHBondContact O-OG 3.35Å |
| 268 | M | 94.9 | Very high | 96.2 | Very high | 32 Ų | 32 | 33.8 Ų | 33.8 | 16% | 0.158 | 17% | 0.166 | C | C | . | . | trans | -98.8 | 19 | -178.1 | -69 | -61.5 | -74.7 | 0 | 0 | 112.8 | G128 T129 I151 S153 W154 I266 | G128-M268 CarbonylContact C-O 3.52Å; G128-M268 VanDerWaalsContact CA-CE 3.46Å; G128-M268 WeakPolarHBondContact CA-O 3.43Å; T129-M268 PolarHBondContact N-O 3.47Å; I151-M268 HydrophobicContact CG2-CE 3.68Å; I151-M268 HydrophobicContact CG2-SD 4.29Å; S153-M268 WeakPolarHBondContact OG-CE 3.45Å; W154-M268 HydrophobicContact CE3-CE 3.93Å; W154-M268 HydrophobicContact CH2-CE 4.39Å; W154-M268 HydrophobicContact CZ3-CE 3.85Å; I266-M268 HydrophobicContact CG2-CG 4.06Å; I266-M268 HydrophobicContact CG2-SD 3.59Å; I266-M268 VanDerWaalsContact CG2-SD 3.59Å | ||
| 269 | D | 93.1 | Very high | 96.1 | Very high | 39 Ų | 39 | 36.2 Ų | 36.2 | 21% | 0.209 | 18% | 0.179 | C | C | . | . | trans | -57 | 139.2 | 164.7 | -76.4 | -7 | 0 | 0 | 0 | 110 | R130 D267 E271 A272 S273 | R130-D269 WeakPolarHBondContact CD-OD1 3.39Å; R130-D269 WeakPolarHBondContact CG-OD1 3.41Å; R130-D269 IonicContact NE-OD1 3.93Å; R130-D269 PolarHBondContact NE-OD1 3.41Å; R130-D269 VanDerWaalsContact NE-OD1 3.15Å; R130-D269 IonicContact NE-OD2 2.82Å; D267-D269 WeakPolarHBondContact OD1-CB 3.38Å; D267-D269 VanDerWaalsContact OD1-CG 3.31Å; D267-D269 PolarHBondContact OD1-N 3.3Å; D269-E271 VanDerWaalsContact C-N 3.28Å; D269-E271 PolarHBondContact O-N 3.48Å; D269-A272 HydrophobicContact CB-CB 4.2Å; D269-A272 WeakPolarHBondContact O-CB 3.49Å; D269-A272 PolarHBondContact O-N 2.98Å; D269-S273 PolarHBondContact O-N 3.32Å; D269-S273 VanDerWaalsContact O-N 3.09Å | ||
| 270 | H | 92.6 | Very high | 95.8 | Very high | 56 Ų | 56 | 39.5 Ų | 39.5 | 26% | 0.259 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -27.4 | -164.1 | 63.3 | -80.2 | 0 | 0 | 0 | 113.9 | T127 H161 | T127-H270 WeakPolarHBondContact CB-O 3.44Å; T127-H270 HydrophobicContact CG2-CB 4.32Å; T127-H270 VanDerWaalsContact CG2-O 3.3Å; T127-H270 WeakPolarHBondContact CG2-O 3.33Å; H161-H270 AromaticContact CD2-CD2 3.49Å; H161-H270 PolarHBondContact CD2-CD2 3.49Å; H161-H270 VanDerWaalsContact CD2-CD2 3.49Å; H161-H270 AromaticContact CD2-NE2 3.35Å; H161-H270 PolarHBondContact CD2-NE2 3.01Å; H161-H270 VanDerWaalsContact CD2-NE2 3.35Å; H161-H270 AromaticContact CG-CD2 3.47Å; H161-H270 VanDerWaalsContact CG-CD2 3.47Å; H161-H270 AromaticContact CG-NE2 3.71Å; H161-H270 AromaticContact NE2-NE2 3.66Å |
| 271 | E | 92.9 | Very high | 94.4 | Very high | 123 Ų | 123 | 42.3 Ų | 42.3 | 58% | 0.575 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | -20.9 | 175.1 | -48.4 | 92.4 | 146 | 0 | 0 | 112.3 | D269 | D269-E271 VanDerWaalsContact C-N 3.28Å; D269-E271 PolarHBondContact O-N 3.48Å |
| 272 | A | 95.1 | Very high | 94.3 | Very high | 17 Ų | 17 | 42.9 Ų | 42.9 | 14% | 0.14 | 23% | 0.23 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.1 | -46.7 | -172.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q187 Y189 D269 | Q187-A272 WeakPolarHBondContact CG-O 3.49Å; Q187-A272 PolarHBondContact NE2-O 3.07Å; Y189-A272 HydrophobicContact CD1-CB 3.67Å; Y189-A272 HydrophobicContact CG-CB 4.14Å; D269-A272 HydrophobicContact CB-CB 4.2Å; D269-A272 WeakPolarHBondContact O-CB 3.49Å; D269-A272 PolarHBondContact O-N 2.98Å |
| 273 | S | 97.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 23% | 0.227 | C | C | . | . | S | Bend | trans | -123.4 | 126 | -178.7 | -65.7 | 0 | 0 | 0 | 0 | 111.4 | G128 Q187 Y189 D267 D269 | G128-S273 PolarHBondContact N-O 2.96Å; Q187-S273 CarbonylContact O-C 3.6Å; Q187-S273 VanDerWaalsContact O-CA 3.27Å; Q187-S273 WeakPolarHBondContact O-CA 3.29Å; Y189-S273 PolarHBondContact N-OG 3.09Å; D267-S273 VanDerWaalsContact O-CB 3.31Å; D267-S273 WeakPolarHBondContact O-CB 3.46Å; D267-S273 PolarHBondContact O-OG 3.35Å; D269-S273 PolarHBondContact O-N 3.32Å; D269-S273 VanDerWaalsContact O-N 3.09Å |
| 274 | F | 97.8 | Very high | 94.2 | Very high | 32 Ų | 32 | 43.1 Ų | 43.1 | 14% | 0.14 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -154.1 | 162.3 | -176.7 | 51.7 | -101.4 | 0 | 0 | 0 | 112.4 | H125 I126 T127 Y185 S186 Q187 Y243 | H125-F274 AromaticContact CE1-CD2 3.61Å; H125-F274 AromaticContact CE1-CG 3.68Å; H125-F274 AromaticContact NE2-CG 3.96Å; I126-F274 CarbonylContact O-C 3.45Å; I126-F274 VanDerWaalsContact O-CA 3.28Å; I126-F274 WeakPolarHBondContact O-CA 3.33Å; I126-F274 WeakPolarHBondContact O-CB 3.39Å; T127-F274 HydrophobicContact CG2-CB 4.13Å; Y185-F274 HydrophobicContact CD2-CD2 4.35Å; Y185-F274 HydrophobicContact CD2-CE2 4.23Å; Y185-F274 HydrophobicContact CE2-CD2 4.09Å; Y185-F274 HydrophobicContact CE2-CE2 4.18Å; S186-F274 CarbonylContact C-O 3.59Å; S186-F274 WeakPolarHBondContact CA-O 3.3Å; S186-F274 PolarHBondContact OG-O 3.14Å; Q187-F274 HydrophobicContact CB-CD1 4.13Å; Q187-F274 HydrophobicContact CB-CD2 3.95Å; Q187-F274 HydrophobicContact CB-CE1 3.69Å; Q187-F274 HydrophobicContact CB-CE2 3.5Å; Q187-F274 VanDerWaalsContact CB-CE2 3.5Å; Q187-F274 HydrophobicContact CB-CG 4.25Å; Q187-F274 HydrophobicContact CB-CZ 3.35Å; Q187-F274 HydrophobicContact CG-CE1 4.28Å; Q187-F274 HydrophobicContact CG-CZ 4.15Å; Q187-F274 PolarHBondContact N-O 2.98Å; Q187-F274 PolarHBondContact O-N 3.4Å; Q187-F274 VanDerWaalsContact O-O 3.09Å; Y243-F274 HydrophobicContact CD2-CE2 4.34Å; Y243-F274 HydrophobicContact CE2-CE2 4.33Å |
| 275 | F | 98.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.5 | 140.2 | 179.6 | 179.7 | -140.9 | 0 | 0 | 0 | 109.8 | I126 W154 L174 I184 Y185 I256 V258 | I126-F275 HydrophobicContact CD1-CB 4.39Å; I126-F275 HydrophobicContact CD1-CD1 3.99Å; I126-F275 HydrophobicContact CG1-CB 3.95Å; I126-F275 HydrophobicContact CG1-CD1 4.38Å; I126-F275 VanDerWaalsContact CG1-O 3.26Å; I126-F275 WeakPolarHBondContact CG1-O 3.44Å; I126-F275 PolarHBondContact N-O 3.43Å; I126-F275 PolarHBondContact O-N 2.95Å; W154-F275 HydrophobicContact CD2-CB 4.41Å; W154-F275 HydrophobicContact CH2-CB 4.31Å; W154-F275 HydrophobicContact CZ2-CB 4.04Å; L174-F275 HydrophobicContact CB-CE1 4.27Å; L174-F275 HydrophobicContact CD1-CD1 3.87Å; L174-F275 HydrophobicContact CD1-CE1 3.65Å; L174-F275 HydrophobicContact CD1-CG 4.48Å; L174-F275 HydrophobicContact CD1-CZ 4.09Å; L174-F275 HydrophobicContact CG-CD1 4.14Å; L174-F275 HydrophobicContact CG-CE1 3.86Å; I184-F275 HydrophobicContact CG2-CE2 3.61Å; I184-F275 HydrophobicContact CG2-CZ 4.17Å; Y185-F275 WeakPolarHBondContact O-CD2 3.34Å; I256-F275 HydrophobicContact CB-CZ 4.19Å; I256-F275 HydrophobicContact CD1-CZ 3.79Å; I256-F275 HydrophobicContact CG1-CE1 4.21Å; I256-F275 HydrophobicContact CG1-CZ 3.73Å; V258-F275 HydrophobicContact CG2-CB 4.09Å; V258-F275 HydrophobicContact CG2-CD1 3.95Å; V258-F275 HydrophobicContact CG2-CD2 3.48Å; V258-F275 VanDerWaalsContact CG2-CD2 3.48Å; V258-F275 HydrophobicContact CG2-CE1 4.24Å; V258-F275 HydrophobicContact CG2-CE2 3.83Å; V258-F275 HydrophobicContact CG2-CG 3.58Å; V258-F275 HydrophobicContact CG2-CZ 4.19Å |
| 276 | G | 98.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 21% | 0.212 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -159.3 | 165.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | A124 Y185 | A124-G276 CarbonylContact O-C 3.53Å; A124-G276 WeakPolarHBondContact O-CA 3.27Å; Y185-G276 PolarHBondContact N-O 3.39Å; Y185-G276 PolarHBondContact O-N 3Å; Y185-G276 VanDerWaalsContact O-O 3.12Å |
| 277 | A | 98.6 | Very high | 94 | Very high | 1 Ų | 1 | 38.9 Ų | 38.9 | 1% | 0.008 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -154.3 | 149.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | A123 A124 L174 Y182 Y183 I184 I256 | A123-A277 CarbonylContact C-O 3.56Å; A123-A277 VanDerWaalsContact CA-O 3.28Å; A123-A277 WeakPolarHBondContact CA-O 3.37Å; A124-A277 PolarHBondContact N-O 3.15Å; A124-A277 PolarHBondContact O-N 3.37Å; L174-A277 HydrophobicContact CD1-CB 4.45Å; Y182-A277 HydrophobicContact CD1-CB 4.32Å; Y183-A277 WeakPolarHBondContact O-CA 3.27Å; I184-A277 HydrophobicContact CG1-CB 4.3Å; I256-A277 HydrophobicContact CD1-CB 3.99Å |
| 278 | F | 98 | Very high | 93.9 | Very high | 85 Ų | 85 | 40.4 Ų | 40.4 | 37% | 0.373 | 23% | 0.227 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -143.3 | 148.7 | 169.5 | 61.9 | -91 | 0 | 0 | 0 | 111.3 | V122 A123 Y182 Y183 Y185 V280 | V122-F278 WeakPolarHBondContact O-CA 3.49Å; A123-F278 HydrophobicContact CB-CB 3.7Å; Y182-F278 VanDerWaalsContact CA-O 3.32Å; Y182-F278 WeakPolarHBondContact CA-O 3.38Å; Y183-F278 HydrophobicContact CD1-CD1 4.24Å; Y183-F278 AromaticContact CD1-CE1 3.39Å; Y183-F278 HydrophobicContact CD1-CE1 3.39Å; Y183-F278 AromaticContact CD1-CZ 3.73Å; Y183-F278 HydrophobicContact CD1-CZ 3.73Å; Y183-F278 HydrophobicContact CE1-CE1 4.27Å; Y183-F278 AromaticContact CG-CE1 3.96Å; Y183-F278 HydrophobicContact CG-CE1 3.96Å; Y183-F278 AromaticContact CG-CZ 3.87Å; Y183-F278 HydrophobicContact CG-CZ 3.87Å; Y183-F278 PolarHBondContact N-O 3.34Å; Y183-F278 PolarHBondContact O-N 3.14Å; Y183-F278 VanDerWaalsContact O-N 3.07Å; Y185-F278 HydrophobicContact CE1-CD1 4.25Å; Y185-F278 HydrophobicContact CE1-CE1 4.46Å; F278-V280 HydrophobicContact CD2-CG2 4Å; F278-V280 HydrophobicContact CE2-CG2 3.71Å |
| 279 | L | 96.4 | Very high | 93.8 | Very high | 50 Ų | 50 | 41.1 Ų | 41.1 | 26% | 0.262 | 23% | 0.232 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -73.5 | 131.2 | 177.7 | -175.6 | 68 | 0 | 0 | 0 | 110.2 | V122 Y182 | V122-L279 HydrophobicContact CB-CB 3.72Å; V122-L279 HydrophobicContact CB-CD2 4.04Å; V122-L279 HydrophobicContact CG1-CB 4.04Å; V122-L279 HydrophobicContact CG1-CD2 4.5Å; V122-L279 HydrophobicContact CG2-CD2 3.95Å; V122-L279 PolarHBondContact O-N 3.37Å; Y182-L279 HydrophobicContact CD1-CB 4.47Å; Y182-L279 HydrophobicContact CD2-CD1 4.17Å; Y182-L279 HydrophobicContact CE1-CB 4.08Å; Y182-L279 HydrophobicContact CE1-CD1 4.39Å; Y182-L279 HydrophobicContact CE2-CD1 3.72Å |
| 280 | V | 91.9 | Very high | 93.9 | Very high | 70 Ų | 70 | 41.3 Ų | 41.3 | 42% | 0.424 | 23% | 0.234 | S | C | . | . | trans | -105.4 | -29.4 | 179.9 | -178.7 | 0 | 0 | 0 | 0 | 111.7 | F181 L247 F278 | F181-V280 PolarHBondContact O-N 3.44Å; L247-V280 HydrophobicContact CD1-CB 3.97Å; L247-V280 HydrophobicContact CD1-CG1 4.41Å; L247-V280 HydrophobicContact CD1-CG2 3.72Å; F278-V280 HydrophobicContact CD2-CG2 4Å; F278-V280 HydrophobicContact CE2-CG2 3.71Å | ||
| 281 | G | 69.3 | Low | 94 | Very high | 61 Ų | 61 | 39.9 Ų | 39.9 | 63% | 0.629 | 23% | 0.232 | S | C | * | . | trans | -176.8 | 0 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | G180 F181 | G180-G281 WeakPolarHBondContact CA-O 3.47Å; F181-G281 PolarHBondContact N-O 3.32Å |
Retrieved 281 of 281 residues in 58.1 ms
(Link to these results)