| 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 | 76.4 | Confident | 90.6 | Very high | 212 Ų | 212 | 124.6 Ų | 124.6 | 100% | 1.044 | 60% | 0.602 | S | S | * | * | 0 | -15.1 | 0 | -74.3 | -165.8 | -167.5 | 0 | 0 | 111.5 | E3 K4 | M1-E3 PolarHBondContact O-N 2.9Å; M1-K4 PolarHBondContact O-N 3.27Å | |||
| 2 | D | 90.7 | Very high | 90.8 | Very high | 131 Ų | 131 | 124.4 Ų | 124.4 | 70% | 0.701 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -68 | -32.5 | -169.6 | -47.6 | -70.4 | 0 | 0 | 0 | 114.2 | K4 L5 L6 | D2-K4 VanDerWaalsContact C-N 3.34Å; D2-K4 PolarHBondContact O-N 2.94Å; D2-L5 PolarHBondContact O-N 3.16Å; D2-L6 WeakPolarHBondContact O-CB 3.17Å; D2-L6 PolarHBondContact O-N 3.48Å |
| 3 | E | 92.2 | Very high | 91 | Very high | 171 Ų | 171 | 124 Ų | 124 | 80% | 0.799 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -62.5 | -39.2 | 178.5 | -165.8 | -170.4 | 132.3 | 0 | 0 | 112.5 | M1 A7 | M1-E3 PolarHBondContact O-N 2.9Å; E3-A7 WeakPolarHBondContact O-CB 3.39Å; E3-A7 PolarHBondContact O-N 3.25Å |
| 4 | K | 92.1 | Very high | 91.2 | Very high | 164 Ų | 164 | 128.6 Ų | 128.6 | 71% | 0.713 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -67.5 | -41.8 | 177.8 | -71 | -171.6 | 177.9 | -177.4 | 0 | 111.4 | M1 D2 A7 E8 | M1-K4 PolarHBondContact O-N 3.27Å; D2-K4 VanDerWaalsContact C-N 3.34Å; D2-K4 PolarHBondContact O-N 2.94Å; K4-A7 PolarHBondContact O-N 3.35Å; K4-E8 WeakPolarHBondContact O-CG 3.47Å; K4-E8 PolarHBondContact O-N 3.24Å |
| 5 | L | 93.2 | Very high | 91.4 | Very high | 100 Ų | 100 | 131.5 Ų | 131.5 | 52% | 0.524 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.2 | -44 | 177.8 | -174.5 | 67.1 | 0 | 0 | 0 | 111.2 | D2 A7 E8 Q9 | D2-L5 PolarHBondContact O-N 3.16Å; L5-A7 PolarHBondContact O-N 3.36Å; L5-E8 PolarHBondContact O-N 3.1Å; L5-Q9 WeakPolarHBondContact O-CG 3.27Å; L5-Q9 PolarHBondContact O-N 3.43Å |
| 6 | L | 93 | Very high | 91.7 | Very high | 92 Ų | 92 | 128.3 Ų | 128.3 | 48% | 0.482 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.1 | -42 | 176.6 | -170.1 | 74 | 0 | 0 | 0 | 111.5 | D2 E8 Q9 H10 | D2-L6 WeakPolarHBondContact O-CB 3.17Å; D2-L6 PolarHBondContact O-N 3.48Å; L6-E8 VanDerWaalsContact C-N 3.34Å; L6-E8 PolarHBondContact O-N 3.22Å; L6-Q9 PolarHBondContact O-N 3.18Å; L6-H10 PolarHBondContact O-CD2 3.4Å; L6-H10 PolarHBondContact O-N 3.22Å |
| 7 | A | 91.2 | Very high | 91.8 | Very high | 43 Ų | 43 | 124.3 Ų | 124.3 | 36% | 0.355 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.4 | -35.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E3 K4 L5 R11 | E3-A7 WeakPolarHBondContact O-CB 3.39Å; E3-A7 PolarHBondContact O-N 3.25Å; K4-A7 PolarHBondContact O-N 3.35Å; L5-A7 PolarHBondContact O-N 3.36Å; A7-R11 PolarHBondContact O-N 3.25Å; A7-R11 VanDerWaalsContact O-N 3.12Å |
| 8 | E | 91.8 | Very high | 92 | Very high | 116 Ų | 116 | 125.3 Ų | 125.3 | 54% | 0.542 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -69.5 | -43.8 | 172.4 | -76.4 | 178.2 | -175.9 | 0 | 0 | 111.9 | K4 L5 L6 H10 R11 H12 | K4-E8 WeakPolarHBondContact O-CG 3.47Å; K4-E8 PolarHBondContact O-N 3.24Å; L5-E8 PolarHBondContact O-N 3.1Å; L6-E8 VanDerWaalsContact C-N 3.34Å; L6-E8 PolarHBondContact O-N 3.22Å; E8-H10 VanDerWaalsContact C-N 3.35Å; E8-H10 PolarHBondContact O-N 3.21Å; E8-R11 PolarHBondContact O-N 3.27Å; E8-H12 PolarHBondContact O-N 3.35Å |
| 9 | Q | 92.2 | Very high | 92.2 | Very high | 109 Ų | 109 | 124.3 Ų | 124.3 | 51% | 0.509 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -59.3 | -43.7 | 174.2 | -76.1 | -176.7 | -54.9 | 0 | 0 | 111.7 | L5 L6 R11 H12 M13 | L5-Q9 WeakPolarHBondContact O-CG 3.27Å; L5-Q9 PolarHBondContact O-N 3.43Å; L6-Q9 PolarHBondContact O-N 3.18Å; Q9-R11 PolarHBondContact O-N 3.21Å; Q9-H12 PolarHBondContact O-N 2.99Å; Q9-M13 WeakPolarHBondContact O-CG 3.02Å; Q9-M13 PolarHBondContact O-N 3.12Å |
| 10 | H | 91.7 | Very high | 92.4 | Very high | 88 Ų | 88 | 120.4 Ų | 120.4 | 41% | 0.407 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -63.4 | -40 | 175.3 | -78.8 | -56.5 | 0 | 0 | 0 | 112.8 | L6 E8 M13 R14 | L6-H10 PolarHBondContact O-CD2 3.4Å; L6-H10 PolarHBondContact O-N 3.22Å; E8-H10 VanDerWaalsContact C-N 3.35Å; E8-H10 PolarHBondContact O-N 3.21Å; H10-M13 PolarHBondContact O-N 2.98Å; H10-R14 WeakPolarHBondContact O-CB 3.35Å; H10-R14 VanDerWaalsContact O-CG 3.32Å; H10-R14 WeakPolarHBondContact O-CG 3.24Å; H10-R14 PolarHBondContact O-N 3.2Å |
| 11 | R | 92.1 | Very high | 92.6 | Very high | 145 Ų | 145 | 119 Ų | 119 | 55% | 0.547 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64.5 | -40.6 | 174.4 | -86.9 | -173 | -80 | -178.2 | -2.4 | 111.8 | A7 E8 Q9 R14 R15 | A7-R11 PolarHBondContact O-N 3.25Å; A7-R11 VanDerWaalsContact O-N 3.12Å; E8-R11 PolarHBondContact O-N 3.27Å; Q9-R11 PolarHBondContact O-N 3.21Å; R11-R14 PolarHBondContact O-N 3.39Å; R11-R15 WeakPolarHBondContact O-CG 3.31Å; R11-R15 PolarHBondContact O-N 3.34Å |
| 12 | H | 93.1 | Very high | 93.6 | Very high | 122 Ų | 122 | 111.5 Ų | 111.5 | 57% | 0.565 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.1 | -48.4 | 175.6 | -171 | -89.3 | 0 | 0 | 0 | 111.3 | E8 Q9 R14 R15 V16 | E8-H12 PolarHBondContact O-N 3.35Å; Q9-H12 PolarHBondContact O-N 2.99Å; H12-R14 VanDerWaalsContact C-N 3.33Å; H12-R14 PolarHBondContact O-N 3.4Å; H12-R15 PolarHBondContact O-N 3.3Å; H12-R15 VanDerWaalsContact O-N 3.16Å; H12-V16 WeakPolarHBondContact O-CG2 3.36Å; H12-V16 PolarHBondContact O-N 3.32Å |
| 13 | M | 93.4 | Very high | 93.9 | Very high | 119 Ų | 119 | 110 Ų | 110 | 59% | 0.586 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.3 | -40.1 | 177.3 | -71 | -152.8 | -67.5 | 0 | 0 | 112.6 | Q9 H10 V16 A17 | Q9-M13 WeakPolarHBondContact O-CG 3.02Å; Q9-M13 PolarHBondContact O-N 3.12Å; H10-M13 PolarHBondContact O-N 2.98Å; M13-V16 PolarHBondContact O-N 3.38Å; M13-A17 WeakPolarHBondContact O-CB 3.45Å; M13-A17 PolarHBondContact O-N 3.31Å |
| 14 | R | 93.8 | Very high | 94.1 | Very high | 189 Ų | 189 | 105.2 Ų | 105.2 | 71% | 0.713 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.5 | -40.8 | 175.2 | -74.1 | 177.9 | -174.5 | -176.5 | 3.2 | 112.5 | H10 R11 H12 A17 F18 | H10-R14 WeakPolarHBondContact O-CB 3.35Å; H10-R14 VanDerWaalsContact O-CG 3.32Å; H10-R14 WeakPolarHBondContact O-CG 3.24Å; H10-R14 PolarHBondContact O-N 3.2Å; R11-R14 PolarHBondContact O-N 3.39Å; H12-R14 VanDerWaalsContact C-N 3.33Å; H12-R14 PolarHBondContact O-N 3.4Å; R14-A17 PolarHBondContact O-N 2.96Å; R14-F18 WeakPolarHBondContact O-CB 3.19Å; R14-F18 PolarHBondContact O-N 3.3Å |
| 15 | R | 94 | Very high | 94.3 | Very high | 171 Ų | 171 | 100.6 Ų | 100.6 | 65% | 0.645 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -45.7 | 176.5 | -73.4 | 174.9 | -178.7 | 177.9 | -0.3 | 111.4 | R11 H12 F18 L19 | R11-R15 WeakPolarHBondContact O-CG 3.31Å; R11-R15 PolarHBondContact O-N 3.34Å; H12-R15 PolarHBondContact O-N 3.3Å; H12-R15 VanDerWaalsContact O-N 3.16Å; R15-F18 PolarHBondContact O-N 3.46Å; R15-L19 WeakPolarHBondContact O-CB 3.14Å; R15-L19 VanDerWaalsContact O-CG 3.28Å; R15-L19 WeakPolarHBondContact O-CG 2.94Å; R15-L19 PolarHBondContact O-N 3.38Å |
| 16 | V | 95.6 | Very high | 94.4 | Very high | 80 Ų | 80 | 100 Ų | 100 | 49% | 0.485 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.4 | -44.3 | 177.5 | 174.8 | 0 | 0 | 0 | 0 | 111 | H12 M13 L19 G20 | H12-V16 WeakPolarHBondContact O-CG2 3.36Å; H12-V16 PolarHBondContact O-N 3.32Å; M13-V16 PolarHBondContact O-N 3.38Å; V16-L19 PolarHBondContact O-N 3.38Å; V16-G20 PolarHBondContact O-N 3.4Å |
| 17 | A | 94.5 | Very high | 94.6 | Very high | 61 Ų | 61 | 98.1 Ų | 98.1 | 50% | 0.504 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.8 | -44.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | M13 R14 G20 V21 | M13-A17 WeakPolarHBondContact O-CB 3.45Å; M13-A17 PolarHBondContact O-N 3.31Å; R14-A17 PolarHBondContact O-N 2.96Å; A17-G20 PolarHBondContact O-N 3.41Å; A17-V21 WeakPolarHBondContact O-CG2 3.23Å; A17-V21 PolarHBondContact O-N 3.28Å |
| 18 | F | 95.1 | Very high | 94.9 | Very high | 143 Ų | 143 | 100.1 Ų | 100.1 | 63% | 0.627 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.2 | -45.5 | 176.9 | -176.9 | -96.7 | 0 | 0 | 0 | 111.9 | R14 R15 G20 V21 V22 | R14-F18 WeakPolarHBondContact O-CB 3.19Å; R14-F18 PolarHBondContact O-N 3.3Å; R15-F18 PolarHBondContact O-N 3.46Å; F18-G20 VanDerWaalsContact C-N 3.31Å; F18-G20 PolarHBondContact O-N 3.48Å; F18-V21 PolarHBondContact O-N 3.24Å; F18-V22 HydrophobicContact CD1-CG2 3.99Å; F18-V22 HydrophobicContact CE1-CG2 3.59Å; F18-V22 HydrophobicContact CE2-CG2 4.37Å; F18-V22 HydrophobicContact CZ-CG2 3.81Å; F18-V22 WeakPolarHBondContact O-CG2 3.48Å; F18-V22 PolarHBondContact O-N 3.39Å |
| 19 | L | 96.1 | Very high | 95 | Very high | 106 Ų | 106 | 99.8 Ų | 99.8 | 56% | 0.555 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.9 | -40.9 | 175.9 | -71.2 | 172.8 | 0 | 0 | 0 | 111.7 | R15 V16 V21 V22 V23 | R15-L19 WeakPolarHBondContact O-CB 3.14Å; R15-L19 VanDerWaalsContact O-CG 3.28Å; R15-L19 WeakPolarHBondContact O-CG 2.94Å; R15-L19 PolarHBondContact O-N 3.38Å; V16-L19 PolarHBondContact O-N 3.38Å; L19-V21 PolarHBondContact O-N 3.47Å; L19-V22 PolarHBondContact O-N 2.84Å; L19-V23 WeakPolarHBondContact O-CB 3.25Å; L19-V23 VanDerWaalsContact O-CG2 3.29Å; L19-V23 WeakPolarHBondContact O-CG2 3.42Å; L19-V23 PolarHBondContact O-N 3.34Å |
| 20 | G | 96.5 | Very high | 95.1 | Very high | 45 Ų | 45 | 96.7 Ų | 96.7 | 46% | 0.464 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.4 | -43 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | V16 A17 F18 S24 | V16-G20 PolarHBondContact O-N 3.4Å; A17-G20 PolarHBondContact O-N 3.41Å; F18-G20 VanDerWaalsContact C-N 3.31Å; F18-G20 PolarHBondContact O-N 3.48Å; G20-S24 WeakPolarHBondContact O-CB 3.2Å; G20-S24 PolarHBondContact O-N 3.29Å |
| 21 | V | 96.5 | Very high | 95.3 | Very high | 91 Ų | 91 | 95.4 Ų | 95.4 | 55% | 0.552 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.3 | -45.6 | 175.3 | 174.7 | 0 | 0 | 0 | 0 | 110.8 | A17 F18 L19 V23 S24 T25 | A17-V21 WeakPolarHBondContact O-CG2 3.23Å; A17-V21 PolarHBondContact O-N 3.28Å; F18-V21 PolarHBondContact O-N 3.24Å; L19-V21 PolarHBondContact O-N 3.47Å; V21-V23 PolarHBondContact O-N 3.36Å; V21-S24 PolarHBondContact O-N 2.96Å; V21-T25 HydrophobicContact CG1-CG2 4.3Å; V21-T25 WeakPolarHBondContact O-CG2 3.41Å; V21-T25 PolarHBondContact O-N 2.97Å; V21-T25 PolarHBondContact O-OG1 3.48Å |
| 22 | V | 96.9 | Very high | 95.4 | Very high | 56 Ų | 56 | 93 Ų | 93 | 34% | 0.339 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 179.2 | 172.8 | 0 | 0 | 0 | 0 | 111.8 | F18 L19 S24 T25 V26 | F18-V22 HydrophobicContact CD1-CG2 3.99Å; F18-V22 HydrophobicContact CE1-CG2 3.59Å; F18-V22 HydrophobicContact CE2-CG2 4.37Å; F18-V22 HydrophobicContact CZ-CG2 3.81Å; F18-V22 WeakPolarHBondContact O-CG2 3.48Å; F18-V22 PolarHBondContact O-N 3.39Å; L19-V22 PolarHBondContact O-N 2.84Å; V22-S24 VanDerWaalsContact C-N 3.35Å; V22-T25 WeakPolarHBondContact CA-OG1 3.44Å; V22-T25 PolarHBondContact O-N 3.46Å; V22-T25 PolarHBondContact O-OG1 2.98Å; V22-V26 HydrophobicContact CG1-CG2 4.44Å; V22-V26 WeakPolarHBondContact O-CB 3.32Å; V22-V26 VanDerWaalsContact O-CG2 3.22Å; V22-V26 WeakPolarHBondContact O-CG2 3.36Å; V22-V26 PolarHBondContact O-N 3.37Å |
| 23 | V | 97 | Very high | 95.5 | Very high | 100 Ų | 100 | 91 Ų | 91 | 61% | 0.606 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.9 | -41.8 | 177.4 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | L19 V21 V26 A27 | L19-V23 WeakPolarHBondContact O-CB 3.25Å; L19-V23 VanDerWaalsContact O-CG2 3.29Å; L19-V23 WeakPolarHBondContact O-CG2 3.42Å; L19-V23 PolarHBondContact O-N 3.34Å; V21-V23 PolarHBondContact O-N 3.36Å; V23-V26 PolarHBondContact O-N 3.07Å; V23-A27 WeakPolarHBondContact O-CB 3.41Å; V23-A27 PolarHBondContact O-N 2.77Å |
| 24 | S | 96.5 | Very high | 95.5 | Very high | 69 Ų | 69 | 88.4 Ų | 88.4 | 48% | 0.483 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.5 | -45.5 | 177 | -175.8 | 0 | 0 | 0 | 0 | 112.1 | G20 V21 V22 V26 A27 V28 | G20-S24 WeakPolarHBondContact O-CB 3.2Å; G20-S24 PolarHBondContact O-N 3.29Å; V21-S24 PolarHBondContact O-N 2.96Å; V22-S24 VanDerWaalsContact C-N 3.35Å; S24-V26 PolarHBondContact O-N 3.47Å; S24-A27 PolarHBondContact O-N 2.91Å; S24-V28 WeakPolarHBondContact O-CG2 3.41Å; S24-V28 PolarHBondContact O-N 3.24Å |
| 25 | T | 96 | Very high | 95.6 | Very high | 68 Ų | 68 | 84.8 Ų | 84.8 | 42% | 0.417 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 178.3 | 55 | 0 | 0 | 0 | 0 | 111.7 | V21 V22 V28 I29 | V21-T25 HydrophobicContact CG1-CG2 4.3Å; V21-T25 WeakPolarHBondContact O-CG2 3.41Å; V21-T25 PolarHBondContact O-N 2.97Å; V21-T25 PolarHBondContact O-OG1 3.48Å; V22-T25 WeakPolarHBondContact CA-OG1 3.44Å; V22-T25 PolarHBondContact O-N 3.46Å; V22-T25 PolarHBondContact O-OG1 2.98Å; T25-V28 PolarHBondContact O-N 3.24Å; T25-I29 WeakPolarHBondContact O-CB 3.39Å; T25-I29 WeakPolarHBondContact O-CD1 3.25Å; T25-I29 WeakPolarHBondContact O-CG1 3.44Å; T25-I29 PolarHBondContact O-N 3.28Å |
| 26 | V | 96.3 | Very high | 95.6 | Very high | 88 Ų | 88 | 80.2 Ų | 80.2 | 53% | 0.533 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -42.8 | 175 | 172 | 0 | 0 | 0 | 0 | 111.1 | V22 V23 S24 I29 A30 | V22-V26 HydrophobicContact CG1-CG2 4.44Å; V22-V26 WeakPolarHBondContact O-CB 3.32Å; V22-V26 VanDerWaalsContact O-CG2 3.22Å; V22-V26 WeakPolarHBondContact O-CG2 3.36Å; V22-V26 PolarHBondContact O-N 3.37Å; V23-V26 PolarHBondContact O-N 3.07Å; S24-V26 PolarHBondContact O-N 3.47Å; V26-I29 PolarHBondContact O-N 3.48Å; V26-A30 VanDerWaalsContact O-CB 3.26Å; V26-A30 WeakPolarHBondContact O-CB 3.27Å; V26-A30 PolarHBondContact O-N 3.05Å |
| 27 | A | 96.1 | Very high | 95.6 | Very high | 51 Ų | 51 | 81.8 Ų | 81.8 | 42% | 0.421 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V23 S24 A30 S31 | V23-A27 WeakPolarHBondContact O-CB 3.41Å; V23-A27 PolarHBondContact O-N 2.77Å; S24-A27 PolarHBondContact O-N 2.91Å; A27-A30 PolarHBondContact O-N 3.36Å; A27-S31 PolarHBondContact O-N 3.47Å; A27-S31 PolarHBondContact O-OG 2.83Å; A27-S31 VanDerWaalsContact O-OG 3.1Å |
| 28 | V | 97 | Very high | 95.6 | Very high | 86 Ų | 86 | 83.1 Ų | 83.1 | 52% | 0.521 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.6 | -45.8 | 176.7 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | S24 T25 A30 S31 V32 | S24-V28 WeakPolarHBondContact O-CG2 3.41Å; S24-V28 PolarHBondContact O-N 3.24Å; T25-V28 PolarHBondContact O-N 3.24Å; V28-A30 VanDerWaalsContact C-N 3.34Å; V28-A30 PolarHBondContact O-N 3.35Å; V28-S31 PolarHBondContact O-N 3.09Å; V28-V32 HydrophobicContact CG1-CG2 4.27Å; V28-V32 WeakPolarHBondContact O-CB 3.43Å; V28-V32 VanDerWaalsContact O-CG2 3.25Å; V28-V32 WeakPolarHBondContact O-CG2 3.29Å; V28-V32 PolarHBondContact O-N 3.42Å |
| 29 | I | 94.7 | Very high | 95.7 | Very high | 108 Ų | 108 | 83.8 Ų | 83.8 | 55% | 0.554 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.2 | -45.4 | 177.2 | -68 | 164 | 0 | 0 | 0 | 110.3 | T25 V26 S31 V32 V33 | T25-I29 WeakPolarHBondContact O-CB 3.39Å; T25-I29 WeakPolarHBondContact O-CD1 3.25Å; T25-I29 WeakPolarHBondContact O-CG1 3.44Å; T25-I29 PolarHBondContact O-N 3.28Å; V26-I29 PolarHBondContact O-N 3.48Å; I29-S31 PolarHBondContact O-N 3.01Å; I29-V32 PolarHBondContact O-N 2.87Å; I29-V33 HydrophobicContact CG2-CG2 4.45Å; I29-V33 WeakPolarHBondContact O-CG2 3.33Å; I29-V33 PolarHBondContact O-N 2.96Å |
| 30 | A | 94.6 | Very high | 95.6 | Very high | 45 Ų | 45 | 82.1 Ų | 82.1 | 37% | 0.372 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.9 | -45.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111 | V26 A27 V28 V33 T34 | V26-A30 VanDerWaalsContact O-CB 3.26Å; V26-A30 WeakPolarHBondContact O-CB 3.27Å; V26-A30 PolarHBondContact O-N 3.05Å; A27-A30 PolarHBondContact O-N 3.36Å; V28-A30 VanDerWaalsContact C-N 3.34Å; V28-A30 PolarHBondContact O-N 3.35Å; A30-V33 PolarHBondContact O-N 3.34Å; A30-T34 WeakPolarHBondContact O-CB 3.29Å; A30-T34 WeakPolarHBondContact O-CG2 3.4Å; A30-T34 PolarHBondContact O-N 2.83Å; A30-T34 PolarHBondContact O-OG1 3.42Å |
| 31 | S | 94.7 | Very high | 95.6 | Very high | 60 Ų | 60 | 87.1 Ų | 87.1 | 42% | 0.42 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.7 | -42.9 | 176.3 | -62.2 | 0 | 0 | 0 | 0 | 112.7 | A27 V28 I29 V33 L35 | A27-S31 PolarHBondContact O-N 3.47Å; A27-S31 PolarHBondContact O-OG 2.83Å; A27-S31 VanDerWaalsContact O-OG 3.1Å; V28-S31 PolarHBondContact O-N 3.09Å; I29-S31 PolarHBondContact O-N 3.01Å; S31-V33 VanDerWaalsContact C-N 3.26Å; S31-V33 PolarHBondContact O-N 3.23Å; S31-L35 VanDerWaalsContact O-CB 3.28Å; S31-L35 WeakPolarHBondContact O-CB 3.43Å; S31-L35 WeakPolarHBondContact O-CG 3.47Å; S31-L35 PolarHBondContact O-N 3.01Å |
| 32 | V | 95.3 | Very high | 95.6 | Very high | 96 Ų | 96 | 86.7 Ų | 86.7 | 58% | 0.582 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.4 | -30.2 | 179.1 | 171 | 0 | 0 | 0 | 0 | 111.9 | V28 I29 P36 | V28-V32 HydrophobicContact CG1-CG2 4.27Å; V28-V32 WeakPolarHBondContact O-CB 3.43Å; V28-V32 VanDerWaalsContact O-CG2 3.25Å; V28-V32 WeakPolarHBondContact O-CG2 3.29Å; V28-V32 PolarHBondContact O-N 3.42Å; I29-V32 PolarHBondContact O-N 2.87Å; V32-P36 WeakPolarHBondContact O-CD 3.37Å; V32-P36 WeakPolarHBondContact O-CG 3.31Å |
| 33 | V | 94.5 | Very high | 95.5 | Very high | 79 Ų | 79 | 89.1 Ų | 89.1 | 48% | 0.479 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -87.4 | -44.7 | 177.1 | 175 | 0 | 0 | 0 | 0 | 111.8 | I29 A30 S31 P36 L37 | I29-V33 HydrophobicContact CG2-CG2 4.45Å; I29-V33 WeakPolarHBondContact O-CG2 3.33Å; I29-V33 PolarHBondContact O-N 2.96Å; A30-V33 PolarHBondContact O-N 3.34Å; S31-V33 VanDerWaalsContact C-N 3.26Å; S31-V33 PolarHBondContact O-N 3.23Å; V33-P36 WeakPolarHBondContact O-CD 3.41Å; V33-L37 HydrophobicContact CG1-CD1 3.75Å; V33-L37 WeakPolarHBondContact O-CB 3.43Å; V33-L37 WeakPolarHBondContact O-CD1 3.28Å; V33-L37 WeakPolarHBondContact O-CG 3.2Å; V33-L37 PolarHBondContact O-N 3.24Å |
| 34 | T | 94.5 | Very high | 95.4 | Very high | 65 Ų | 65 | 87.8 Ų | 87.8 | 40% | 0.399 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -70.9 | -38.9 | -175.3 | 54.6 | 0 | 0 | 0 | 0 | 112.5 | A30 L37 I38 | A30-T34 WeakPolarHBondContact O-CB 3.29Å; A30-T34 WeakPolarHBondContact O-CG2 3.4Å; A30-T34 PolarHBondContact O-N 2.83Å; A30-T34 PolarHBondContact O-OG1 3.42Å; T34-L37 PolarHBondContact O-N 2.95Å; T34-I38 WeakPolarHBondContact O-CB 3.39Å; T34-I38 WeakPolarHBondContact O-CD1 3.37Å; T34-I38 WeakPolarHBondContact O-CG1 3.31Å; T34-I38 PolarHBondContact O-N 3.48Å |
| 35 | L | 95.1 | Very high | 95.2 | Very high | 112 Ų | 112 | 88.7 Ų | 88.7 | 59% | 0.586 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.4 | -48.3 | -177.7 | -67.7 | 172.7 | 0 | 0 | 0 | 112.7 | S31 L37 I38 Y39 | S31-L35 VanDerWaalsContact O-CB 3.28Å; S31-L35 WeakPolarHBondContact O-CB 3.43Å; S31-L35 WeakPolarHBondContact O-CG 3.47Å; S31-L35 PolarHBondContact O-N 3.01Å; L35-L37 PolarHBondContact O-N 2.75Å; L35-I38 PolarHBondContact O-N 3.49Å; L35-Y39 WeakPolarHBondContact O-CB 3.38Å; L35-Y39 PolarHBondContact O-N 3Å |
| 36 | P | 95 | Very high | 95.1 | Very high | 75 Ų | 75 | 91 Ų | 91 | 49% | 0.487 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -36.9 | 175.2 | -23.3 | 35.8 | 0 | 0 | 0 | 113.1 | V32 V33 Y39 S40 | V32-P36 WeakPolarHBondContact O-CD 3.37Å; V32-P36 WeakPolarHBondContact O-CG 3.31Å; V33-P36 WeakPolarHBondContact O-CD 3.41Å; P36-Y39 PolarHBondContact O-N 3.14Å; P36-S40 VanDerWaalsContact O-CB 3.28Å; P36-S40 WeakPolarHBondContact O-CB 3.4Å; P36-S40 PolarHBondContact O-N 3.46Å |
| 37 | L | 94.8 | Very high | 94.9 | Very high | 113 Ų | 113 | 89.7 Ų | 89.7 | 59% | 0.592 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.1 | -46.2 | 176.1 | -74.2 | 176.4 | 0 | 0 | 0 | 111.5 | V33 T34 L35 Y39 S40 Y41 | V33-L37 HydrophobicContact CG1-CD1 3.75Å; V33-L37 WeakPolarHBondContact O-CB 3.43Å; V33-L37 WeakPolarHBondContact O-CD1 3.28Å; V33-L37 WeakPolarHBondContact O-CG 3.2Å; V33-L37 PolarHBondContact O-N 3.24Å; T34-L37 PolarHBondContact O-N 2.95Å; L35-L37 PolarHBondContact O-N 2.75Å; L37-Y39 VanDerWaalsContact C-N 3.34Å; L37-S40 PolarHBondContact O-N 3.26Å; L37-Y41 VanDerWaalsContact O-CB 3.28Å; L37-Y41 WeakPolarHBondContact O-CB 3.18Å; L37-Y41 PolarHBondContact O-N 2.8Å |
| 38 | I | 95.5 | Very high | 94.7 | Very high | 90 Ų | 90 | 92.8 Ų | 92.8 | 46% | 0.462 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 176 | -69.4 | 165.2 | 0 | 0 | 0 | 110.2 | T34 L35 Y41 I42 | T34-I38 WeakPolarHBondContact O-CB 3.39Å; T34-I38 WeakPolarHBondContact O-CD1 3.37Å; T34-I38 WeakPolarHBondContact O-CG1 3.31Å; T34-I38 PolarHBondContact O-N 3.48Å; L35-I38 PolarHBondContact O-N 3.49Å; I38-Y41 PolarHBondContact O-N 3.09Å; I38-I42 HydrophobicContact CG2-CD1 3.67Å; I38-I42 HydrophobicContact CG2-CG1 4.32Å; I38-I42 WeakPolarHBondContact O-CB 3.39Å; I38-I42 VanDerWaalsContact O-CG1 3.26Å; I38-I42 WeakPolarHBondContact O-CG1 3.48Å; I38-I42 PolarHBondContact O-N 2.8Å |
| 39 | Y | 96.1 | Very high | 94.5 | Very high | 157 Ų | 157 | 94.3 Ų | 94.3 | 62% | 0.616 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.5 | -48.2 | 177 | -178.1 | -96.5 | 0 | 0 | 0 | 111.9 | L35 P36 L37 Y41 I42 Q43 | L35-Y39 WeakPolarHBondContact O-CB 3.38Å; L35-Y39 PolarHBondContact O-N 3Å; P36-Y39 PolarHBondContact O-N 3.14Å; L37-Y39 VanDerWaalsContact C-N 3.34Å; Y39-Y41 VanDerWaalsContact C-N 3.31Å; Y39-Y41 PolarHBondContact O-N 2.84Å; Y39-I42 PolarHBondContact O-N 3.36Å; Y39-Q43 WeakPolarHBondContact O-CB 3.41Å; Y39-Q43 PolarHBondContact O-N 3.21Å |
| 40 | S | 94.9 | Very high | 94.4 | Very high | 71 Ų | 71 | 93.5 Ų | 93.5 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | 176.5 | 178.7 | 0 | 0 | 0 | 0 | 111.7 | P36 L37 Q43 S44 | P36-S40 VanDerWaalsContact O-CB 3.28Å; P36-S40 WeakPolarHBondContact O-CB 3.4Å; P36-S40 PolarHBondContact O-N 3.46Å; L37-S40 PolarHBondContact O-N 3.26Å; S40-Q43 PolarHBondContact O-N 2.91Å; S40-S44 WeakPolarHBondContact O-CB 3.49Å; S40-S44 PolarHBondContact O-N 3.36Å |
| 41 | Y | 95.7 | Very high | 94.1 | Very high | 150 Ų | 150 | 96.5 Ų | 96.5 | 59% | 0.588 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.5 | -47.8 | 176.2 | -179.6 | -107.2 | 0 | 0 | 0 | 112.2 | L37 I38 Y39 Q43 S44 L45 | L37-Y41 VanDerWaalsContact O-CB 3.28Å; L37-Y41 WeakPolarHBondContact O-CB 3.18Å; L37-Y41 PolarHBondContact O-N 2.8Å; I38-Y41 PolarHBondContact O-N 3.09Å; Y39-Y41 VanDerWaalsContact C-N 3.31Å; Y39-Y41 PolarHBondContact O-N 2.84Å; Y41-Q43 VanDerWaalsContact C-N 3.35Å; Y41-Q43 PolarHBondContact O-N 3.02Å; Y41-S44 PolarHBondContact O-N 3.49Å; Y41-L45 HydrophobicContact CD1-CD1 3.81Å; Y41-L45 HydrophobicContact CD1-CG 4.49Å; Y41-L45 HydrophobicContact CE1-CD1 3.27Å; Y41-L45 HydrophobicContact CE1-CG 4.15Å; Y41-L45 HydrophobicContact CE2-CD1 4.27Å; Y41-L45 HydrophobicContact CE2-CG 4.33Å; Y41-L45 WeakPolarHBondContact O-CG 3.21Å; Y41-L45 PolarHBondContact O-N 3.01Å |
| 42 | I | 96.4 | Very high | 94 | Very high | 81 Ų | 81 | 98.2 Ų | 98.2 | 42% | 0.415 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.2 | -44.5 | 176.7 | -68.8 | 167.6 | 0 | 0 | 0 | 110.5 | I38 Y39 S44 L45 Q46 | I38-I42 HydrophobicContact CG2-CD1 3.67Å; I38-I42 HydrophobicContact CG2-CG1 4.32Å; I38-I42 WeakPolarHBondContact O-CB 3.39Å; I38-I42 VanDerWaalsContact O-CG1 3.26Å; I38-I42 WeakPolarHBondContact O-CG1 3.48Å; I38-I42 PolarHBondContact O-N 2.8Å; Y39-I42 PolarHBondContact O-N 3.36Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 3.07Å; I42-L45 PolarHBondContact O-N 3.01Å; I42-Q46 HydrophobicContact CG2-CG 4.34Å; I42-Q46 WeakPolarHBondContact O-CB 3.25Å; I42-Q46 WeakPolarHBondContact O-CG 3.36Å; I42-Q46 PolarHBondContact O-N 2.72Å |
| 43 | Q | 95.1 | Very high | 93.9 | Very high | 107 Ų | 107 | 98.9 Ų | 98.9 | 50% | 0.5 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -41.4 | 178.5 | -173.3 | 179.8 | -1.3 | 0 | 0 | 111.8 | Y39 S40 Y41 Q46 S47 | Y39-Q43 WeakPolarHBondContact O-CB 3.41Å; Y39-Q43 PolarHBondContact O-N 3.21Å; S40-Q43 PolarHBondContact O-N 2.91Å; Y41-Q43 VanDerWaalsContact C-N 3.35Å; Y41-Q43 PolarHBondContact O-N 3.02Å; Q43-Q46 PolarHBondContact O-N 3.42Å; Q43-S47 PolarHBondContact O-N 3.32Å; Q43-S47 PolarHBondContact O-OG 3.04Å |
| 44 | S | 94.3 | Very high | 93.6 | Very high | 73 Ų | 73 | 98.9 Ų | 98.9 | 51% | 0.51 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.3 | -38.8 | 175.1 | -173.7 | 0 | 0 | 0 | 0 | 112.3 | S40 Y41 I42 S47 H48 | S40-S44 WeakPolarHBondContact O-CB 3.49Å; S40-S44 PolarHBondContact O-N 3.36Å; Y41-S44 PolarHBondContact O-N 3.49Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 3.07Å; S44-S47 PolarHBondContact O-OG 3.32Å; S44-H48 WeakPolarHBondContact O-CB 3.34Å; S44-H48 PolarHBondContact O-N 3.48Å; S44-H48 VanDerWaalsContact O-N 3.15Å |
| 45 | L | 93.6 | Very high | 93.4 | Very high | 88 Ų | 88 | 101.6 Ų | 101.6 | 46% | 0.461 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67 | -42.1 | 174.8 | -76.4 | 177.1 | 0 | 0 | 0 | 111.5 | Y41 I42 H48 L49 | Y41-L45 HydrophobicContact CD1-CD1 3.81Å; Y41-L45 HydrophobicContact CD1-CG 4.49Å; Y41-L45 HydrophobicContact CE1-CD1 3.27Å; Y41-L45 HydrophobicContact CE1-CG 4.15Å; Y41-L45 HydrophobicContact CE2-CD1 4.27Å; Y41-L45 HydrophobicContact CE2-CG 4.33Å; Y41-L45 WeakPolarHBondContact O-CG 3.21Å; Y41-L45 PolarHBondContact O-N 3.01Å; I42-L45 PolarHBondContact O-N 3.01Å; L45-H48 PolarHBondContact O-N 2.82Å; L45-L49 VanDerWaalsContact O-CB 3.28Å; L45-L49 WeakPolarHBondContact O-CB 3.45Å; L45-L49 PolarHBondContact O-N 2.99Å |
| 46 | Q | 93.4 | Very high | 93 | Very high | 117 Ų | 117 | 99.8 Ų | 99.8 | 55% | 0.547 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.3 | -45.8 | 177 | -77.4 | -177.8 | -32.8 | 0 | 0 | 111.5 | I42 Q43 H48 L49 I50 | I42-Q46 HydrophobicContact CG2-CG 4.34Å; I42-Q46 WeakPolarHBondContact O-CB 3.25Å; I42-Q46 WeakPolarHBondContact O-CG 3.36Å; I42-Q46 PolarHBondContact O-N 2.72Å; Q43-Q46 PolarHBondContact O-N 3.42Å; Q46-H48 PolarHBondContact O-N 3.33Å; Q46-L49 PolarHBondContact O-N 2.79Å; Q46-I50 WeakPolarHBondContact O-CB 3.45Å; Q46-I50 WeakPolarHBondContact O-CD1 3.28Å; Q46-I50 WeakPolarHBondContact O-CG1 3.28Å; Q46-I50 PolarHBondContact O-N 3.45Å |
| 47 | S | 92.4 | Very high | 92.8 | Very high | 59 Ų | 59 | 103.1 Ų | 103.1 | 41% | 0.413 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.3 | -42.8 | 178.9 | 65.8 | 0 | 0 | 0 | 0 | 111.8 | Q43 S44 N51 | Q43-S47 PolarHBondContact O-N 3.32Å; Q43-S47 PolarHBondContact O-OG 3.04Å; S44-S47 PolarHBondContact O-OG 3.32Å; S47-N51 WeakPolarHBondContact O-CB 3.48Å; S47-N51 PolarHBondContact O-N 2.94Å; S47-N51 PolarHBondContact O-ND2 2.92Å |
| 48 | H | 90.7 | Very high | 92.4 | Very high | 117 Ų | 117 | 101.3 Ų | 101.3 | 54% | 0.542 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.3 | -44.9 | 176 | -167.2 | -68 | 0 | 0 | 0 | 111.8 | S44 L45 Q46 N51 E52 | S44-H48 WeakPolarHBondContact O-CB 3.34Å; S44-H48 PolarHBondContact O-N 3.48Å; S44-H48 VanDerWaalsContact O-N 3.15Å; L45-H48 PolarHBondContact O-N 2.82Å; Q46-H48 PolarHBondContact O-N 3.33Å; H48-N51 PolarHBondContact O-N 3.4Å; H48-E52 IonicContact CE1-OE1 3.63Å; H48-E52 WeakPolarHBondContact O-CG 3.47Å; H48-E52 PolarHBondContact O-N 3.41Å |
| 49 | L | 93.2 | Very high | 92 | Very high | 118 Ų | 118 | 105.3 Ų | 105.3 | 62% | 0.618 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -67.5 | -38.4 | -178.9 | -168.2 | 136.9 | 0 | 0 | 0 | 112 | L45 Q46 L53 | L45-L49 VanDerWaalsContact O-CB 3.28Å; L45-L49 WeakPolarHBondContact O-CB 3.45Å; L45-L49 PolarHBondContact O-N 2.99Å; Q46-L49 PolarHBondContact O-N 2.79Å; L49-L53 VanDerWaalsContact O-CB 3.25Å; L49-L53 WeakPolarHBondContact O-CB 3.44Å; L49-L53 PolarHBondContact O-N 2.98Å |
| 50 | I | 92.1 | Very high | 91.6 | Very high | 91 Ų | 91 | 100.3 Ų | 100.3 | 47% | 0.467 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.2 | -47 | 174.2 | -70.4 | 163.8 | 0 | 0 | 0 | 110.4 | Q46 E52 L53 D54 | Q46-I50 WeakPolarHBondContact O-CB 3.45Å; Q46-I50 WeakPolarHBondContact O-CD1 3.28Å; Q46-I50 WeakPolarHBondContact O-CG1 3.28Å; Q46-I50 PolarHBondContact O-N 3.45Å; I50-E52 PolarHBondContact O-N 2.98Å; I50-L53 PolarHBondContact O-N 3.04Å; I50-D54 WeakPolarHBondContact O-CB 3.16Å; I50-D54 PolarHBondContact O-N 2.91Å |
| 51 | N | 89.7 | Confident | 91.1 | Very high | 107 Ų | 107 | 104.5 Ų | 104.5 | 57% | 0.572 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.5 | -44.3 | 179.9 | -70.7 | -20.3 | 0 | 0 | 0 | 112.3 | S47 H48 D54 F55 | S47-N51 WeakPolarHBondContact O-CB 3.48Å; S47-N51 PolarHBondContact O-N 2.94Å; S47-N51 PolarHBondContact O-ND2 2.92Å; H48-N51 PolarHBondContact O-N 3.4Å; N51-D54 PolarHBondContact O-N 3.03Å; N51-F55 WeakPolarHBondContact O-CB 3.33Å; N51-F55 PolarHBondContact O-N 2.79Å |
| 52 | E | 91.6 | Very high | 90.5 | Very high | 96 Ų | 96 | 100.4 Ų | 100.4 | 45% | 0.449 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.7 | -41.1 | 176.8 | -72.7 | -65.6 | 166.4 | 0 | 0 | 111.9 | H48 I50 F55 C56 | H48-E52 IonicContact CE1-OE1 3.63Å; H48-E52 WeakPolarHBondContact O-CG 3.47Å; H48-E52 PolarHBondContact O-N 3.41Å; I50-E52 PolarHBondContact O-N 2.98Å; E52-F55 PolarHBondContact O-N 3.41Å; E52-C56 WeakPolarHBondContact O-CB 3.33Å; E52-C56 PolarHBondContact O-N 2.95Å; E52-C56 PolarHBondContact O-SG 3.41Å |
| 53 | L | 92.7 | Very high | 89.7 | Confident | 110 Ų | 110 | 101.8 Ų | 101.8 | 58% | 0.576 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.9 | -43.8 | 177.4 | -159.6 | 93.7 | 0 | 0 | 0 | 111.2 | L49 I50 C56 K57 | L49-L53 VanDerWaalsContact O-CB 3.25Å; L49-L53 WeakPolarHBondContact O-CB 3.44Å; L49-L53 PolarHBondContact O-N 2.98Å; I50-L53 PolarHBondContact O-N 3.04Å; L53-C56 PolarHBondContact O-N 3.3Å; L53-K57 WeakPolarHBondContact O-CB 3.26Å; L53-K57 PolarHBondContact O-N 3.36Å |
| 54 | D | 89.6 | Confident | 89.1 | Confident | 80 Ų | 80 | 105 Ų | 105 | 43% | 0.428 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.2 | -37.9 | 177.9 | -81.1 | -21 | 0 | 0 | 0 | 112 | I50 N51 K57 T58 | I50-D54 WeakPolarHBondContact O-CB 3.16Å; I50-D54 PolarHBondContact O-N 2.91Å; N51-D54 PolarHBondContact O-N 3.03Å; D54-K57 PolarHBondContact O-N 2.96Å; D54-T58 VanDerWaalsContact O-CB 3.31Å; D54-T58 WeakPolarHBondContact O-CB 2.92Å; D54-T58 PolarHBondContact O-N 3.22Å; D54-T58 PolarHBondContact O-OG1 3.44Å |
| 55 | F | 88.7 | Confident | 88.4 | Confident | 122 Ų | 122 | 106.2 Ų | 106.2 | 54% | 0.535 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.6 | -47.9 | 173.1 | -177.3 | -101.5 | 0 | 0 | 0 | 111.3 | N51 E52 K57 T58 R59 | N51-F55 WeakPolarHBondContact O-CB 3.33Å; N51-F55 PolarHBondContact O-N 2.79Å; E52-F55 PolarHBondContact O-N 3.41Å; F55-K57 VanDerWaalsContact C-N 3.35Å; F55-K57 PolarHBondContact O-N 3.47Å; F55-T58 PolarHBondContact O-N 2.92Å; F55-R59 VanDerWaalsContact O-CB 3.29Å; F55-R59 WeakPolarHBondContact O-CB 3.11Å; F55-R59 PolarHBondContact O-N 2.95Å |
| 56 | C | 88.5 | Confident | 87.6 | Confident | 74 Ų | 74 | 106.9 Ų | 106.9 | 50% | 0.5 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.8 | -41.2 | 176.5 | -72.5 | 0 | 0 | 0 | 0 | 112.1 | E52 L53 S60 | E52-C56 WeakPolarHBondContact O-CB 3.33Å; E52-C56 PolarHBondContact O-N 2.95Å; E52-C56 PolarHBondContact O-SG 3.41Å; L53-C56 PolarHBondContact O-N 3.3Å; C56-S60 VanDerWaalsContact O-CB 3.31Å; C56-S60 WeakPolarHBondContact O-CB 3.44Å; C56-S60 PolarHBondContact O-N 3.38Å; C56-S60 PolarHBondContact O-OG 2.83Å |
| 57 | K | 90.7 | Very high | 86.8 | Confident | 144 Ų | 144 | 104.5 Ų | 104.5 | 63% | 0.626 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -66.6 | -42.8 | 177.7 | -172.5 | 176.6 | -178.7 | 178.7 | 0 | 111.9 | L53 D54 F55 S60 R61 | L53-K57 WeakPolarHBondContact O-CB 3.26Å; L53-K57 PolarHBondContact O-N 3.36Å; D54-K57 PolarHBondContact O-N 2.96Å; F55-K57 VanDerWaalsContact C-N 3.35Å; F55-K57 PolarHBondContact O-N 3.47Å; K57-S60 WeakPolarHBondContact CA-OG 3.28Å; K57-S60 PolarHBondContact O-OG 3.11Å; K57-R61 WeakPolarHBondContact O-CB 3.33Å; K57-R61 PolarHBondContact O-N 2.67Å |
| 58 | T | 86.8 | Confident | 86.1 | Confident | 75 Ų | 75 | 107.7 Ų | 107.7 | 46% | 0.46 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.1 | -45.4 | 177.7 | -57.7 | 0 | 0 | 0 | 0 | 110.9 | D54 F55 R61 D62 | D54-T58 VanDerWaalsContact O-CB 3.31Å; D54-T58 WeakPolarHBondContact O-CB 2.92Å; D54-T58 PolarHBondContact O-N 3.22Å; D54-T58 PolarHBondContact O-OG1 3.44Å; F55-T58 PolarHBondContact O-N 2.92Å; T58-R61 PolarHBondContact O-N 2.97Å; T58-D62 PolarHBondContact O-N 3.21Å |
| 59 | R | 85.5 | Confident | 85.3 | Confident | 174 Ų | 174 | 104.8 Ų | 104.8 | 66% | 0.657 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.3 | -41.3 | 179.4 | -170.8 | 178.5 | 177.6 | 121.3 | -0.7 | 112.4 | F55 M63 | F55-R59 VanDerWaalsContact O-CB 3.29Å; F55-R59 WeakPolarHBondContact O-CB 3.11Å; F55-R59 PolarHBondContact O-N 2.95Å; R59-M63 WeakPolarHBondContact O-CB 3.18Å; R59-M63 PolarHBondContact O-N 2.78Å |
| 60 | S | 87.7 | Confident | 84.1 | Confident | 52 Ų | 52 | 104.3 Ų | 104.3 | 36% | 0.364 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66 | -37.7 | 175.6 | 54.3 | 0 | 0 | 0 | 0 | 112 | C56 K57 W64 | C56-S60 VanDerWaalsContact O-CB 3.31Å; C56-S60 WeakPolarHBondContact O-CB 3.44Å; C56-S60 PolarHBondContact O-N 3.38Å; C56-S60 PolarHBondContact O-OG 2.83Å; K57-S60 WeakPolarHBondContact CA-OG 3.28Å; K57-S60 PolarHBondContact O-OG 3.11Å; S60-W64 WeakPolarHBondContact O-CB 3.43Å; S60-W64 PolarHBondContact O-N 3.04Å |
| 61 | R | 85.5 | Confident | 83.3 | Confident | 159 Ų | 159 | 107 Ų | 107 | 60% | 0.6 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.4 | -49.2 | 174.4 | -170 | -177.3 | 74.4 | 166.7 | 1.5 | 112.3 | K57 T58 M63 W64 L65 | K57-R61 WeakPolarHBondContact O-CB 3.33Å; K57-R61 PolarHBondContact O-N 2.67Å; T58-R61 PolarHBondContact O-N 2.97Å; R61-M63 VanDerWaalsContact C-N 3.31Å; R61-M63 PolarHBondContact O-N 2.88Å; R61-W64 PolarHBondContact O-N 3.48Å; R61-L65 HydrophobicContact CG-CD1 4.31Å; R61-L65 WeakPolarHBondContact O-CG 3.26Å; R61-L65 PolarHBondContact O-N 3.45Å |
| 62 | D | 81.7 | Confident | 82.5 | Confident | 64 Ų | 64 | 103.9 Ų | 103.9 | 34% | 0.342 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.6 | -41.6 | 179 | -94.1 | 22.8 | 0 | 0 | 0 | 111.1 | T58 W64 L65 E66 R81 | T58-D62 PolarHBondContact O-N 3.21Å; D62-W64 PolarHBondContact O-N 2.95Å; D62-L65 PolarHBondContact O-N 3.46Å; D62-E66 WeakPolarHBondContact O-CG 3.19Å; D62-E66 PolarHBondContact O-N 3.38Å; D62-R81 IonicContact OD2-NH1 3.68Å |
| 63 | M | 80.5 | Confident | 80.9 | Confident | 110 Ų | 110 | 110.6 Ų | 110.6 | 54% | 0.542 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 175 | -172.4 | -178.9 | 74.4 | 0 | 0 | 112.2 | R59 R61 E66 I67 | R59-M63 WeakPolarHBondContact O-CB 3.18Å; R59-M63 PolarHBondContact O-N 2.78Å; R61-M63 VanDerWaalsContact C-N 3.31Å; R61-M63 PolarHBondContact O-N 2.88Å; M63-E66 PolarHBondContact O-N 3.41Å; M63-I67 HydrophobicContact CG-CD1 4.05Å; M63-I67 VanDerWaalsContact O-CG1 3.29Å; M63-I67 WeakPolarHBondContact O-CG1 3.22Å; M63-I67 PolarHBondContact O-N 3.46Å |
| 64 | W | 82.3 | Confident | 79 | Confident | 176 Ų | 176 | 112.3 Ų | 112.3 | 67% | 0.667 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.7 | -38.8 | 177.7 | -99 | 95.1 | 0 | 0 | 0 | 113 | S60 R61 D62 I67 F68 | S60-W64 WeakPolarHBondContact O-CB 3.43Å; S60-W64 PolarHBondContact O-N 3.04Å; R61-W64 PolarHBondContact O-N 3.48Å; D62-W64 PolarHBondContact O-N 2.95Å; W64-I67 PolarHBondContact O-N 2.91Å; W64-F68 WeakPolarHBondContact O-CB 3.44Å; W64-F68 PolarHBondContact O-N 3.24Å |
| 65 | L | 79.9 | Confident | 77.5 | Confident | 98 Ų | 98 | 114 Ų | 114 | 51% | 0.513 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.7 | -43.9 | 175.3 | -71.5 | 172.3 | 0 | 0 | 0 | 111.1 | R61 D62 F68 T69 | R61-L65 HydrophobicContact CG-CD1 4.31Å; R61-L65 WeakPolarHBondContact O-CG 3.26Å; R61-L65 PolarHBondContact O-N 3.45Å; D62-L65 PolarHBondContact O-N 3.46Å; L65-F68 PolarHBondContact O-N 2.81Å; L65-T69 VanDerWaalsContact O-CG2 3.27Å; L65-T69 WeakPolarHBondContact O-CG2 3.25Å; L65-T69 PolarHBondContact O-N 3.05Å; L65-T69 PolarHBondContact O-OG1 2.87Å |
| 66 | E | 76 | Confident | 75.8 | Confident | 102 Ų | 102 | 111.3 Ų | 111.3 | 48% | 0.477 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60 | -47.8 | 174.4 | -74 | -72 | 158.9 | 0 | 0 | 111.5 | D62 M63 F68 T69 I70 | D62-E66 WeakPolarHBondContact O-CG 3.19Å; D62-E66 PolarHBondContact O-N 3.38Å; M63-E66 PolarHBondContact O-N 3.41Å; E66-F68 VanDerWaalsContact C-N 3.32Å; E66-F68 PolarHBondContact O-N 3.37Å; E66-T69 PolarHBondContact O-N 3.01Å; E66-T69 PolarHBondContact O-OG1 2.95Å; E66-I70 WeakPolarHBondContact O-CG1 3.22Å; E66-I70 PolarHBondContact O-N 2.8Å |
| 67 | I | 77.2 | Confident | 74.3 | Confident | 67 Ų | 67 | 113.1 Ų | 113.1 | 34% | 0.344 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.5 | -44.2 | 177.2 | -68.8 | 166.2 | 0 | 0 | 0 | 111.2 | M63 W64 I70 Q71 | M63-I67 HydrophobicContact CG-CD1 4.05Å; M63-I67 VanDerWaalsContact O-CG1 3.29Å; M63-I67 WeakPolarHBondContact O-CG1 3.22Å; M63-I67 PolarHBondContact O-N 3.46Å; W64-I67 PolarHBondContact O-N 2.91Å; I67-I70 PolarHBondContact O-N 2.87Å; I67-Q71 HydrophobicContact CG2-CG 4.45Å; I67-Q71 WeakPolarHBondContact O-CG 3.22Å; I67-Q71 PolarHBondContact O-N 2.96Å |
| 68 | F | 77.6 | Confident | 72.7 | Confident | 126 Ų | 126 | 117.6 Ų | 117.6 | 55% | 0.553 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.1 | -40.4 | 179.1 | -168.8 | -94.7 | 0 | 0 | 0 | 112 | W64 L65 E66 I70 Q71 S72 | W64-F68 WeakPolarHBondContact O-CB 3.44Å; W64-F68 PolarHBondContact O-N 3.24Å; L65-F68 PolarHBondContact O-N 2.81Å; E66-F68 VanDerWaalsContact C-N 3.32Å; E66-F68 PolarHBondContact O-N 3.37Å; F68-I70 PolarHBondContact O-N 2.88Å; F68-Q71 PolarHBondContact O-N 2.97Å; F68-S72 WeakPolarHBondContact O-CB 3.43Å; F68-S72 PolarHBondContact O-N 3.12Å; F68-S72 PolarHBondContact O-OG 2.89Å |
| 69 | T | 73.6 | Confident | 71.3 | Confident | 55 Ų | 55 | 120.2 Ų | 120.2 | 34% | 0.337 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.3 | -43.4 | 176.2 | 61.9 | 0 | 0 | 0 | 0 | 111.6 | L65 E66 S72 | L65-T69 VanDerWaalsContact O-CG2 3.27Å; L65-T69 WeakPolarHBondContact O-CG2 3.25Å; L65-T69 PolarHBondContact O-N 3.05Å; L65-T69 PolarHBondContact O-OG1 2.87Å; E66-T69 PolarHBondContact O-N 3.01Å; E66-T69 PolarHBondContact O-OG1 2.95Å; T69-S72 PolarHBondContact O-N 3.34Å; T69-S72 PolarHBondContact O-OG 3.37Å |
| 70 | I | 68.7 | Low | 70.1 | Confident | 109 Ų | 109 | 121.1 Ų | 121.1 | 56% | 0.559 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.1 | -45.7 | 177.3 | -64.3 | 165.2 | 0 | 0 | 0 | 111.2 | E66 I67 F68 S72 R73 V76 | E66-I70 WeakPolarHBondContact O-CG1 3.22Å; E66-I70 PolarHBondContact O-N 2.8Å; I67-I70 PolarHBondContact O-N 2.87Å; F68-I70 PolarHBondContact O-N 2.88Å; I70-S72 VanDerWaalsContact C-N 3.31Å; I70-S72 PolarHBondContact O-N 2.9Å; I70-R73 PolarHBondContact O-N 2.88Å; I70-V76 HydrophobicContact CG1-CG2 4.08Å |
| 71 | Q | 75.7 | Confident | 68.7 | Low | 146 Ų | 146 | 124.1 Ų | 124.1 | 68% | 0.682 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -65.6 | -33.6 | 179.7 | -76.1 | -173.2 | -12.2 | 0 | 0 | 113 | I67 F68 R73 | I67-Q71 HydrophobicContact CG2-CG 4.45Å; I67-Q71 WeakPolarHBondContact O-CG 3.22Å; I67-Q71 PolarHBondContact O-N 2.96Å; F68-Q71 PolarHBondContact O-N 2.97Å; Q71-R73 PolarHBondContact O-N 2.94Å; Q71-R73 VanDerWaalsContact O-N 3.07Å |
| 72 | S | 72 | Confident | 67.8 | Low | 43 Ų | 43 | 120.4 Ų | 120.4 | 30% | 0.301 | 56% | 0.558 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.1 | -1.1 | -179.6 | 71.9 | 0 | 0 | 0 | 0 | 114.4 | F68 T69 I70 K74 | F68-S72 WeakPolarHBondContact O-CB 3.43Å; F68-S72 PolarHBondContact O-N 3.12Å; F68-S72 PolarHBondContact O-OG 2.89Å; T69-S72 PolarHBondContact O-N 3.34Å; T69-S72 PolarHBondContact O-OG 3.37Å; I70-S72 VanDerWaalsContact C-N 3.31Å; I70-S72 PolarHBondContact O-N 2.9Å; S72-K74 PolarHBondContact O-N 3.27Å; S72-K74 WeakPolarHBondContact OG-CG 3.33Å |
| 73 | R | 58.1 | Low | 67.1 | Low | 236 Ų | 236 | 124.5 Ų | 124.5 | 89% | 0.891 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 51.3 | 14.6 | -173.1 | -65.7 | -173 | 179.7 | -174.4 | 0.5 | 114 | I70 Q71 | I70-R73 PolarHBondContact O-N 2.88Å; Q71-R73 PolarHBondContact O-N 2.94Å; Q71-R73 VanDerWaalsContact O-N 3.07Å |
| 74 | K | 53.9 | Low | 65.9 | Low | 146 Ų | 146 | 123.4 Ų | 123.4 | 64% | 0.635 | 57% | 0.565 | S | S | * | * | trans | -71.1 | 140.4 | 172.8 | -68 | 179.7 | -178 | 179.8 | 0 | 107.4 | S72 V76 | S72-K74 PolarHBondContact O-N 3.27Å; S72-K74 WeakPolarHBondContact OG-CG 3.33Å; K74-V76 PolarHBondContact O-N 2.94Å | ||
| 75 | P | 56.7 | Low | 65 | Low | 117 Ų | 117 | 125.2 Ų | 125.2 | 76% | 0.76 | 58% | 0.578 | S | S | * | * | trans | -57.2 | 113 | 178.2 | 23.5 | -32.4 | 0 | 0 | 0 | 108.7 | T77 | P75-T77 PolarHBondContact O-N 3.44Š| ||
| 76 | V | 53 | Low | 64.2 | Low | 64 Ų | 64 | 123 Ų | 123 | 39% | 0.388 | 58% | 0.579 | S | S | . | * | trans | -72.5 | 97.4 | 176.7 | 179.7 | 0 | 0 | 0 | 0 | 106.8 | I70 K74 R78 | I70-V76 HydrophobicContact CG1-CG2 4.08Å; K74-V76 PolarHBondContact O-N 2.94Å; V76-R78 PolarHBondContact O-N 3.24Å; V76-R78 VanDerWaalsContact O-N 3.09Å | ||
| 77 | T | 57.4 | Low | 63.4 | Low | 112 Ų | 112 | 124.7 Ų | 124.7 | 69% | 0.687 | 59% | 0.587 | S | S | * | * | trans | -73.1 | 100.3 | 170.4 | 49.8 | 0 | 0 | 0 | 0 | 107.4 | P75 Q79 | P75-T77 PolarHBondContact O-N 3.44Å; T77-Q79 VanDerWaalsContact C-N 3.28Å; T77-Q79 PolarHBondContact O-N 3.15Å | ||
| 78 | R | 56.5 | Low | 62.9 | Low | 238 Ų | 238 | 128.6 Ų | 128.6 | 90% | 0.898 | 60% | 0.597 | S | S | * | * | trans | -64.6 | 93.6 | 168.6 | -78.6 | -164.5 | 176.6 | -144.4 | 0.8 | 108.4 | V76 R80 | V76-R78 PolarHBondContact O-N 3.24Å; V76-R78 VanDerWaalsContact O-N 3.09Å; R78-R80 PolarHBondContact O-N 2.9Å | ||
| 79 | Q | 58.8 | Low | 62.7 | Low | 130 Ų | 130 | 125.1 Ų | 125.1 | 61% | 0.607 | 59% | 0.586 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 123 | 170.7 | -78.1 | -174.6 | -39.2 | 0 | 0 | 108.9 | T77 R81 | T77-Q79 VanDerWaalsContact C-N 3.28Å; T77-Q79 PolarHBondContact O-N 3.15Å; Q79-R81 PolarHBondContact O-N 3.46Å |
| 80 | R | 58.7 | Low | 62.6 | Low | 193 Ų | 193 | 126.9 Ų | 126.9 | 73% | 0.728 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 118.4 | 172.2 | -171.4 | -178.9 | -174.9 | -164.8 | -0.1 | 107.9 | R78 A91 | R78-R80 PolarHBondContact O-N 2.9Å; R80-A91 HydrophobicContact CB-CB 4.34Å; R80-A91 WeakPolarHBondContact O-CB 3.33Å; R80-A91 PolarHBondContact O-N 3.21Å |
| 81 | R | 59.9 | Low | 62.2 | Low | 115 Ų | 115 | 123.1 Ų | 123.1 | 43% | 0.434 | 58% | 0.579 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.4 | 142 | 172.4 | -64.7 | -175.7 | 177.8 | 174.4 | 4 | 109.2 | D62 Q79 W88 V89 N90 | D62-R81 IonicContact OD2-NH1 3.68Å; Q79-R81 PolarHBondContact O-N 3.46Å; R81-W88 HydrophobicContact CB-CB 4.39Å; R81-W88 HydrophobicContact CB-CE3 3.79Å; R81-V89 CarbonylContact C-O 3.51Å; R81-V89 VanDerWaalsContact CA-O 3.25Å; R81-V89 WeakPolarHBondContact CA-O 3.32Å; R81-N90 PolarHBondContact NE-OD1 3.3Å |
| 82 | E | 66.1 | Low | 61.1 | Low | 82 Ų | 82 | 121 Ų | 121 | 38% | 0.383 | 59% | 0.586 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -115 | 146 | 177.7 | -71.4 | 176.2 | 175.2 | 0 | 0 | 109.4 | V89 A91 | E82-V89 PolarHBondContact N-O 2.89Å; E82-V89 WeakPolarHBondContact O-CG2 3.48Å; E82-V89 PolarHBondContact O-N 2.91Å; E82-A91 HydrophobicContact CG-CB 4.07Å |
| 83 | W | 65.6 | Low | 59.8 | Low | 150 Ų | 150 | 124 Ų | 124 | 57% | 0.568 | 61% | 0.607 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -92.1 | 108.7 | -177.4 | -176.2 | -97.2 | 0 | 0 | 0 | 109.5 | G86 W88 | W83-G86 WeakPolarHBondContact CH2-O 3.36Å; W83-W88 HydrophobicContact CB-CE3 4.39Å; W83-W88 HydrophobicContact CB-CZ3 4.26Å; W83-W88 AromaticContact CE3-CD1 3.71Å; W83-W88 AromaticContact CE3-CD2 3.67Å; W83-W88 HydrophobicContact CE3-CD2 3.67Å; W83-W88 AromaticContact CE3-CE2 3.45Å; W83-W88 VanDerWaalsContact CE3-CE2 3.45Å; W83-W88 HydrophobicContact CE3-CE3 4.34Å; W83-W88 AromaticContact CE3-CG 3.83Å; W83-W88 HydrophobicContact CE3-CG 3.83Å; W83-W88 AromaticContact CE3-CZ2 3.95Å; W83-W88 HydrophobicContact CE3-CZ2 3.95Å; W83-W88 AromaticContact CE3-NE1 3.47Å; W83-W88 AromaticContact CZ3-CD1 3.49Å; W83-W88 VanDerWaalsContact CZ3-CD1 3.49Å; W83-W88 HydrophobicContact CZ3-CD2 4.25Å; W83-W88 AromaticContact CZ3-CE2 3.8Å; W83-W88 HydrophobicContact CZ3-CG 4.06Å; W83-W88 HydrophobicContact CZ3-CZ2 4.47Å; W83-W88 AromaticContact CZ3-NE1 3.29Å; W83-W88 VanDerWaalsContact CZ3-NE1 3.29Å |
| 84 | L | 55.3 | Low | 58.7 | Low | 86 Ų | 86 | 116.5 Ų | 116.5 | 45% | 0.45 | 60% | 0.604 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -132.9 | 132 | 179.8 | -70.2 | 172.5 | 0 | 0 | 0 | 109.6 | G86 Q87 V89 | L84-G86 PolarHBondContact O-N 2.98Å; L84-G86 VanDerWaalsContact O-N 3.14Å; L84-Q87 PolarHBondContact N-O 3.38Å; L84-Q87 PolarHBondContact O-N 3.49Å; L84-V89 HydrophobicContact CB-CG2 4.01Å; L84-V89 HydrophobicContact CD1-CG2 3.76Å; L84-V89 HydrophobicContact CG-CG2 4.14Å |
| 85 | F | 65.2 | Low | 57.6 | Low | 214 Ų | 214 | 115 Ų | 115 | 94% | 0.939 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 52.1 | 34.1 | 178.1 | -54.5 | -75.2 | 0 | 0 | 0 | 115.3 | Q87 | F85-Q87 VanDerWaalsContact C-N 3.33Š|
| 86 | G | 61.7 | Low | 56.3 | Low | 52 Ų | 52 | 116.4 Ų | 116.4 | 54% | 0.536 | 61% | 0.613 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 80.8 | 9.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | W83 L84 | W83-G86 WeakPolarHBondContact CH2-O 3.36Å; L84-G86 PolarHBondContact O-N 2.98Å; L84-G86 VanDerWaalsContact O-N 3.14Å |
| 87 | Q | 60.4 | Low | 55.1 | Low | 137 Ų | 137 | 116.6 Ų | 116.6 | 64% | 0.64 | 63% | 0.628 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -130.9 | 143.7 | 179.7 | -167.8 | 173.2 | -17 | 0 | 0 | 111.1 | L84 F85 V89 | L84-Q87 PolarHBondContact N-O 3.38Å; L84-Q87 PolarHBondContact O-N 3.49Å; F85-Q87 VanDerWaalsContact C-N 3.33Å; Q87-V89 PolarHBondContact O-N 3.42Å |
| 88 | W | 65.9 | Low | 54.2 | Low | 149 Ų | 149 | 117.5 Ų | 117.5 | 56% | 0.564 | 64% | 0.636 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -75.5 | 119.2 | 169.9 | -70.6 | 104.1 | 0 | 0 | 0 | 109.8 | R81 W83 | R81-W88 HydrophobicContact CB-CB 4.39Å; R81-W88 HydrophobicContact CB-CE3 3.79Å; W83-W88 HydrophobicContact CB-CE3 4.39Å; W83-W88 HydrophobicContact CB-CZ3 4.26Å; W83-W88 AromaticContact CE3-CD1 3.71Å; W83-W88 AromaticContact CE3-CD2 3.67Å; W83-W88 HydrophobicContact CE3-CD2 3.67Å; W83-W88 AromaticContact CE3-CE2 3.45Å; W83-W88 VanDerWaalsContact CE3-CE2 3.45Å; W83-W88 HydrophobicContact CE3-CE3 4.34Å; W83-W88 AromaticContact CE3-CG 3.83Å; W83-W88 HydrophobicContact CE3-CG 3.83Å; W83-W88 AromaticContact CE3-CZ2 3.95Å; W83-W88 HydrophobicContact CE3-CZ2 3.95Å; W83-W88 AromaticContact CE3-NE1 3.47Å; W83-W88 AromaticContact CZ3-CD1 3.49Å; W83-W88 VanDerWaalsContact CZ3-CD1 3.49Å; W83-W88 HydrophobicContact CZ3-CD2 4.25Å; W83-W88 AromaticContact CZ3-CE2 3.8Å; W83-W88 HydrophobicContact CZ3-CG 4.06Å; W83-W88 HydrophobicContact CZ3-CZ2 4.47Å; W83-W88 AromaticContact CZ3-NE1 3.29Å; W83-W88 VanDerWaalsContact CZ3-NE1 3.29Å |
| 89 | V | 73.6 | Confident | 52.8 | Low | 54 Ų | 54 | 115.6 Ų | 115.6 | 33% | 0.327 | 64% | 0.638 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -113.6 | 148.1 | 174.7 | -66.2 | 0 | 0 | 0 | 0 | 110.5 | R81 E82 L84 Q87 A91 | R81-V89 CarbonylContact C-O 3.51Å; R81-V89 VanDerWaalsContact CA-O 3.25Å; R81-V89 WeakPolarHBondContact CA-O 3.32Å; E82-V89 PolarHBondContact N-O 2.89Å; E82-V89 WeakPolarHBondContact O-CG2 3.48Å; E82-V89 PolarHBondContact O-N 2.91Å; L84-V89 HydrophobicContact CB-CG2 4.01Å; L84-V89 HydrophobicContact CD1-CG2 3.76Å; L84-V89 HydrophobicContact CG-CG2 4.14Å; Q87-V89 PolarHBondContact O-N 3.42Å; V89-A91 PolarHBondContact O-N 3.39Å |
| 90 | N | 70.6 | Confident | 51.2 | Low | 91 Ų | 91 | 112.9 Ų | 112.9 | 49% | 0.487 | 65% | 0.645 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -69 | 128 | 177 | -66.3 | -36 | 0 | 0 | 0 | 109.2 | R81 A92 | R81-N90 PolarHBondContact NE-OD1 3.3Å; N90-A92 PolarHBondContact O-N 3.15Å |
| 91 | A | 60.6 | Low | 49.6 | Very low | 31 Ų | 31 | 115.3 Ų | 115.3 | 26% | 0.256 | 66% | 0.655 | S | S | . | * | trans | -62.7 | 113.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | R80 E82 V89 S93 | R80-A91 HydrophobicContact CB-CB 4.34Å; R80-A91 WeakPolarHBondContact O-CB 3.33Å; R80-A91 PolarHBondContact O-N 3.21Å; E82-A91 HydrophobicContact CG-CB 4.07Å; V89-A91 PolarHBondContact O-N 3.39Å; A91-S93 PolarHBondContact O-N 3.37Å | ||
| 92 | A | 53.9 | Low | 48 | Very low | 101 Ų | 101 | 113 Ų | 113 | 84% | 0.835 | 67% | 0.668 | S | S | * | * | trans | -58.6 | 110.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | N90 G94 | N90-A92 PolarHBondContact O-N 3.15Å; A92-G94 PolarHBondContact O-N 3.48Å | ||
| 93 | S | 44.7 | Very low | 46.1 | Very low | 106 Ų | 106 | 116 Ų | 116 | 74% | 0.741 | 69% | 0.691 | S | S | * | * | trans | -61.9 | 104.8 | 176.7 | 51.8 | 0 | 0 | 0 | 0 | 108.6 | A91 T95 | A91-S93 PolarHBondContact O-N 3.37Å; S93-T95 PolarHBondContact O-N 3.33Å | ||
| 94 | G | 33.5 | Very low | 44.1 | Very low | 79 Ų | 79 | 112.8 Ų | 112.8 | 81% | 0.814 | 71% | 0.705 | S | S | * | * | trans | -64.6 | 96.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | A92 | A92-G94 PolarHBondContact O-N 3.48Š| ||
| 95 | T | 32.3 | Very low | 42.7 | Very low | 114 Ų | 114 | 112.3 Ų | 112.3 | 70% | 0.699 | 72% | 0.722 | S | S | * | * | trans | -141.6 | 92.3 | 163.1 | 50.3 | 0 | 0 | 0 | 0 | 109.1 | S93 | S93-T95 PolarHBondContact O-N 3.33Š| ||
| 96 | T | 28.3 | Very low | 40.8 | Very low | 146 Ų | 146 | 105.5 Ų | 105.5 | 90% | 0.896 | 71% | 0.711 | S | S | * | * | trans | 31.8 | 117.2 | 141.2 | 57.1 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 97 | G | 29 | Very low | 39 | Very low | 68 Ų | 68 | 108.6 Ų | 108.6 | 70% | 0.701 | 72% | 0.72 | S | S | * | * | trans | 153.8 | 109.5 | 151.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q99 | G97-Q99 PolarHBondContact O-N 2.88Š| ||
| 98 | P | 38.6 | Very low | 37.7 | Very low | 132 Ų | 132 | 107.2 Ų | 107.2 | 86% | 0.857 | 72% | 0.723 | S | S | * | * | trans | -91.3 | 82.9 | 179 | 35 | -28 | 0 | 0 | 0 | 109.6 | ||||
| 99 | Q | 25.9 | Very low | 35.8 | Very low | 198 Ų | 198 | 106.1 Ų | 106.1 | 93% | 0.925 | 73% | 0.733 | S | S | * | * | trans | -151.4 | 136.3 | 162 | -77 | -149.9 | -13 | 0 | 0 | 111.8 | G97 | G97-Q99 PolarHBondContact O-N 2.88Š| ||
| 100 | G | 26.4 | Very low | 33.8 | Very low | 73 Ų | 73 | 110 Ų | 110 | 75% | 0.753 | 75% | 0.751 | S | S | * | * | trans | 115.5 | 79.2 | 159.6 | 0 | 0 | 0 | 0 | 0 | 114 | G102 | G100-G102 PolarHBondContact O-N 3.34Š| ||
| 101 | Y | 24.6 | Very low | 31.7 | Very low | 243 Ų | 243 | 108.7 Ų | 108.7 | 95% | 0.953 | 75% | 0.748 | S | S | * | * | trans | -55.1 | 92.2 | 146.8 | -90.9 | -100.3 | 0 | 0 | 0 | 107.7 | ||||
| 102 | G | 26.1 | Very low | 30.8 | Very low | 68 Ų | 68 | 112.8 Ų | 112.8 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | -117.7 | 82.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | G100 G104 | G100-G102 PolarHBondContact O-N 3.34Å; G102-G104 PolarHBondContact O-N 3.42Å | ||
| 103 | T | 26.1 | Very low | 29.6 | Very low | 143 Ų | 143 | 117.5 Ų | 117.5 | 88% | 0.877 | 77% | 0.77 | S | S | * | * | trans | -49.6 | 128.4 | 160.1 | 45.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 104 | G | 24.5 | Very low | 28.8 | Very low | 83 Ų | 83 | 118.8 Ų | 118.8 | 86% | 0.856 | 77% | 0.768 | S | S | * | * | trans | 121.6 | 99.7 | 163.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | G102 | G102-G104 PolarHBondContact O-N 3.42Š| ||
| 105 | G | 24.6 | Very low | 28.7 | Very low | 77 Ų | 77 | 120 Ų | 120 | 79% | 0.794 | 76% | 0.764 | S | S | * | * | trans | 166.9 | 82.4 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 106 | G | 25 | Very low | 28.7 | Very low | 70 Ų | 70 | 121 Ų | 121 | 72% | 0.722 | 77% | 0.77 | S | S | * | * | trans | -47.6 | 136.7 | -168.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | P108 | G106-P108 WeakPolarHBondContact O-CD 3.29Š| ||
| 107 | T | 25.5 | Very low | 28.8 | Very low | 117 Ų | 117 | 118.4 Ų | 118.4 | 72% | 0.718 | 76% | 0.758 | S | S | * | * | trans | -44.6 | 120.3 | 149.3 | 46.2 | 0 | 0 | 0 | 0 | 107.8 | T109 | T107-T109 PolarHBondContact O-N 3.43Š| ||
| 108 | P | 32 | Very low | 29.1 | Very low | 109 Ų | 109 | 120.5 Ų | 120.5 | 71% | 0.708 | 76% | 0.759 | S | S | * | * | trans | -68.4 | 96.1 | 165.9 | 28.4 | -28.6 | 0 | 0 | 0 | 105 | G106 I110 | G106-P108 WeakPolarHBondContact O-CD 3.29Å; P108-I110 HydrophobicContact CB-CG1 4.13Å; P108-I110 PolarHBondContact O-N 3.46Å | ||
| 109 | T | 26.4 | Very low | 29 | Very low | 125 Ų | 125 | 119.9 Ų | 119.9 | 77% | 0.767 | 76% | 0.755 | S | S | * | * | trans | -61.3 | 84.2 | 159.3 | -54 | 0 | 0 | 0 | 0 | 105.1 | T107 S111 | T107-T109 PolarHBondContact O-N 3.43Å; T109-S111 PolarHBondContact O-N 3.41Å | ||
| 110 | I | 31.1 | Very low | 29.4 | Very low | 137 Ų | 137 | 116.7 Ų | 116.7 | 70% | 0.703 | 75% | 0.749 | S | S | * | * | trans | -70.6 | 93.1 | 171.5 | -61.2 | 174.6 | 0 | 0 | 0 | 104.5 | P108 | P108-I110 HydrophobicContact CB-CG1 4.13Å; P108-I110 PolarHBondContact O-N 3.46Å | ||
| 111 | S | 26.7 | Very low | 29.8 | Very low | 62 Ų | 62 | 119 Ų | 119 | 43% | 0.434 | 75% | 0.751 | S | S | . | * | trans | -56.4 | 130 | 164.3 | -176.3 | 0 | 0 | 0 | 0 | 107.4 | T109 Y113 D114 | T109-S111 PolarHBondContact O-N 3.41Å; S111-Y113 PolarHBondContact O-N 2.87Å; S111-D114 PolarHBondContact O-N 2.84Å | ||
| 112 | P | 41.1 | Very low | 29.9 | Very low | 117 Ų | 117 | 119.2 Ų | 119.2 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | 13.9 | -171.8 | 26.1 | -32.8 | 0 | 0 | 0 | 114.9 | ||
| 113 | Y | 29 | Very low | 30.1 | Very low | 200 Ų | 200 | 119.5 Ų | 119.5 | 78% | 0.784 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.9 | 1.8 | 179.1 | -69.9 | -73.6 | 0 | 0 | 0 | 115.3 | S111 S115 | S111-Y113 PolarHBondContact O-N 2.87Å; Y113-S115 VanDerWaalsContact C-N 3.28Å; Y113-S115 PolarHBondContact O-N 2.87Å |
| 114 | D | 27.8 | Very low | 30.1 | Very low | 134 Ų | 134 | 116.9 Ų | 116.9 | 72% | 0.717 | 76% | 0.755 | S | S | * | * | trans | -78.7 | 86.5 | 171.7 | -83.5 | -31 | 0 | 0 | 0 | 110.4 | S111 V116 | S111-D114 PolarHBondContact O-N 2.84Å; D114-V116 VanDerWaalsContact C-N 3.25Å; D114-V116 PolarHBondContact O-N 3.3Å | ||
| 115 | S | 32 | Very low | 30.4 | Very low | 103 Ų | 103 | 116.6 Ų | 116.6 | 72% | 0.72 | 75% | 0.752 | S | S | * | * | trans | -59.1 | 88.5 | 162 | 54.5 | 0 | 0 | 0 | 0 | 109 | Y113 S117 | Y113-S115 VanDerWaalsContact C-N 3.28Å; Y113-S115 PolarHBondContact O-N 2.87Å; S115-S117 PolarHBondContact O-N 3.4Å | ||
| 116 | V | 32 | Very low | 30.9 | Very low | 135 Ų | 135 | 117.7 Ų | 117.7 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | trans | -69.4 | 89.2 | 163.4 | -177.9 | 0 | 0 | 0 | 0 | 106.6 | D114 | D114-V116 VanDerWaalsContact C-N 3.25Å; D114-V116 PolarHBondContact O-N 3.3Å | ||
| 117 | S | 30.8 | Very low | 31.6 | Very low | 93 Ų | 93 | 120.4 Ų | 120.4 | 65% | 0.65 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 131.3 | 168.8 | -65.9 | 0 | 0 | 0 | 0 | 108.9 | S115 | S115-S117 PolarHBondContact O-N 3.4Š|
| 118 | P | 35.5 | Very low | 32 | Very low | 111 Ų | 111 | 119.6 Ų | 119.6 | 72% | 0.721 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 146 | 178.8 | 26.2 | -32.5 | 0 | 0 | 0 | 110.1 | V120 | P118-V120 PolarHBondContact O-N 2.83Å; P118-V120 VanDerWaalsContact O-N 3.15Å |
| 119 | P | 35 | Very low | 32.2 | Very low | 120 Ų | 120 | 119.9 Ų | 119.9 | 78% | 0.779 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 118.7 | -177.8 | 25.4 | -31.1 | 0 | 0 | 0 | 109.9 | ||
| 120 | V | 34.1 | Very low | 32.5 | Very low | 130 Ų | 130 | 118.7 Ų | 118.7 | 79% | 0.788 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 127.2 | 170.3 | -97.5 | 0 | 0 | 0 | 0 | 110.3 | P118 Y122 | P118-V120 PolarHBondContact O-N 2.83Å; P118-V120 VanDerWaalsContact O-N 3.15Å; V120-Y122 PolarHBondContact O-N 2.78Å |
| 121 | P | 35.4 | Very low | 32.5 | Very low | 122 Ų | 122 | 121.4 Ų | 121.4 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 128.4 | 175 | 27.2 | -29.9 | 0 | 0 | 0 | 109.3 | G123 | P121-G123 PolarHBondContact O-N 3.22Š|
| 122 | Y | 27.7 | Very low | 32.7 | Very low | 248 Ų | 248 | 122.2 Ų | 122.2 | 97% | 0.973 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -47.7 | 118.5 | 168.4 | -101.6 | -102.2 | 0 | 0 | 0 | 110.6 | V120 | V120-Y122 PolarHBondContact O-N 2.78Š|
| 123 | G | 30.7 | Very low | 32.2 | Very low | 74 Ų | 74 | 120 Ų | 120 | 76% | 0.763 | 79% | 0.79 | S | S | * | * | trans | -178.5 | 84.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | P121 | P121-G123 PolarHBondContact O-N 3.22Š| ||
| 124 | G | 26.2 | Very low | 32.1 | Very low | 87 Ų | 87 | 121.7 Ų | 121.7 | 90% | 0.897 | 80% | 0.796 | S | S | * | * | trans | -68.3 | 152.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 125 | G | 30 | Very low | 32.7 | Very low | 77 Ų | 77 | 121.6 Ų | 121.6 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | trans | 152.6 | 77.4 | 165.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 126 | A | 34.5 | Very low | 33 | Very low | 101 Ų | 101 | 121.2 Ų | 121.2 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | 53.5 | 153.3 | 140.4 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 127 | P | 41.2 | Very low | 33.6 | Very low | 126 Ų | 126 | 120.5 Ų | 120.5 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -100.9 | 142.7 | -143.6 | 37.1 | -31.3 | 0 | 0 | 0 | 114.5 | ||
| 128 | A | 32.7 | Very low | 33.7 | Very low | 100 Ų | 100 | 124.5 Ų | 124.5 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -90.9 | 135.5 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 129 | P | 36.9 | Very low | 34 | Very low | 115 Ų | 115 | 124.7 Ų | 124.7 | 75% | 0.747 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -90.9 | 142.5 | -174.9 | 36.8 | -33.4 | 0 | 0 | 0 | 112.8 | ||
| 130 | S | 31.6 | Very low | 34.1 | Very low | 101 Ų | 101 | 123.7 Ų | 123.7 | 71% | 0.706 | 80% | 0.799 | S | S | * | * | trans | 50.1 | 130.9 | 133.7 | 73.6 | 0 | 0 | 0 | 0 | 122 | ||||
| 131 | Q | 31.7 | Very low | 34.3 | Very low | 193 Ų | 193 | 127.8 Ų | 127.8 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | trans | 98.9 | 139.7 | 141.5 | -53.8 | -127.3 | 17.2 | 0 | 0 | 119.7 | ||||
| 132 | G | 31 | Very low | 34.4 | Very low | 80 Ų | 80 | 130 Ų | 130 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | 107.4 | 105.4 | 170 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 133 | G | 30.7 | Very low | 34.8 | Very low | 71 Ų | 71 | 124.7 Ų | 124.7 | 73% | 0.732 | 80% | 0.795 | S | S | * | * | cis | 118.8 | 93.2 | 35 | 0 | 0 | 0 | 0 | 0 | 106.6 | V135 | G133-V135 PolarHBondContact O-N 2.84Š| ||
| 134 | Y | 27.3 | Very low | 35.3 | Very low | 234 Ų | 234 | 127.4 Ų | 127.4 | 92% | 0.918 | 80% | 0.797 | S | S | * | * | trans | -60.7 | 123.9 | 178 | -121.2 | -101.5 | 0 | 0 | 0 | 109.9 | ||||
| 135 | V | 39.1 | Very low | 36 | Very low | 133 Ų | 133 | 128.4 Ų | 128.4 | 81% | 0.806 | 79% | 0.787 | S | S | * | * | trans | -123.2 | 112.7 | 166.2 | -178.3 | 0 | 0 | 0 | 0 | 108.2 | G133 | G133-V135 PolarHBondContact O-N 2.84Š| ||
| 136 | P | 40 | Very low | 36.3 | Very low | 94 Ų | 94 | 130.9 Ų | 130.9 | 61% | 0.61 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 164.8 | 179.1 | 31.4 | -32.6 | 0 | 0 | 0 | 112.3 | ||
| 137 | P | 43.7 | Very low | 36.8 | Very low | 120 Ų | 120 | 131.9 Ų | 131.9 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 144 | -145.5 | 33.3 | -33.4 | 0 | 0 | 0 | 113.6 | ||
| 138 | Q | 33.1 | Very low | 36.8 | Very low | 178 Ų | 178 | 132.3 Ų | 132.3 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -89.9 | 135.7 | 172.1 | -68.6 | -71 | -69.2 | 0 | 0 | 110.4 | ||
| 139 | P | 41.9 | Very low | 37 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 75% | 0.747 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -89.2 | 118 | 176.2 | 33.2 | -28 | 0 | 0 | 0 | 110.3 | ||
| 140 | S | 36.6 | Very low | 37.4 | Very low | 98 Ų | 98 | 134.5 Ų | 134.5 | 69% | 0.685 | 79% | 0.79 | S | S | * | * | trans | -119.7 | 104 | 166 | 53.9 | 0 | 0 | 0 | 0 | 108.6 | E142 | S140-E142 PolarHBondContact O-N 3.42Š| ||
| 141 | Y | 37.7 | Very low | 37.9 | Very low | 217 Ų | 217 | 134.9 Ų | 134.9 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | trans | -74.2 | 97.5 | 168 | 51.7 | -82 | 0 | 0 | 0 | 107.2 | ||||
| 142 | E | 38.6 | Very low | 38.3 | Very low | 167 Ų | 167 | 130.9 Ų | 130.9 | 78% | 0.78 | 79% | 0.79 | S | S | * | * | trans | -91.9 | 121.1 | 167.8 | -80.4 | -179.7 | 153.1 | 0 | 0 | 109.1 | S140 V144 | S140-E142 PolarHBondContact O-N 3.42Å; E142-V144 PolarHBondContact O-N 2.97Å; E142-V144 VanDerWaalsContact O-N 3.08Å | ||
| 143 | T | 35.7 | Very low | 38.9 | Very low | 137 Ų | 137 | 133.4 Ų | 133.4 | 84% | 0.84 | 79% | 0.789 | S | S | * | * | trans | -57.6 | 103.2 | 178.1 | -51.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 144 | V | 41.2 | Very low | 39.4 | Very low | 132 Ų | 132 | 135.8 Ų | 135.8 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 129.3 | 175 | -179.8 | 0 | 0 | 0 | 0 | 109.3 | E142 | E142-V144 PolarHBondContact O-N 2.97Å; E142-V144 VanDerWaalsContact O-N 3.08Å |
| 145 | P | 40.2 | Very low | 40.1 | Very low | 108 Ų | 108 | 131.4 Ų | 131.4 | 70% | 0.701 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 146.7 | -169.6 | 27.8 | -34 | 0 | 0 | 0 | 113.5 | ||
| 146 | T | 36.9 | Very low | 40.2 | Very low | 129 Ų | 129 | 131 Ų | 131 | 79% | 0.791 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 123.9 | -179.5 | -33.5 | 0 | 0 | 0 | 0 | 112.4 | T148 | T146-T148 PolarHBondContact O-N 3.36Š|
| 147 | P | 44.7 | Very low | 40.5 | Very low | 122 Ų | 122 | 134.2 Ų | 134.2 | 79% | 0.792 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 122.3 | 178.1 | 26.1 | -31.8 | 0 | 0 | 0 | 110.4 | ||
| 148 | T | 42.4 | Very low | 40.4 | Very low | 135 Ų | 135 | 137.4 Ų | 137.4 | 83% | 0.828 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 132.5 | 173.3 | -42.1 | 0 | 0 | 0 | 0 | 109.5 | T146 L150 | T146-T148 PolarHBondContact O-N 3.36Å; T148-L150 PolarHBondContact O-N 2.88Å |
| 149 | A | 37.2 | Very low | 40.8 | Very low | 98 Ų | 98 | 134.3 Ų | 134.3 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -58 | 127.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 150 | L | 44.3 | Very low | 41 | Very low | 163 Ų | 163 | 133.9 Ų | 133.9 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | trans | -104.7 | 150.9 | 164.8 | -73.6 | 176.7 | 0 | 0 | 0 | 109.8 | T148 | T148-L150 PolarHBondContact O-N 2.88Š| ||
| 151 | P | 42.4 | Very low | 41.7 | Very low | 109 Ų | 109 | 134.7 Ų | 134.7 | 71% | 0.708 | 79% | 0.792 | S | S | * | * | trans | -81.4 | 161.3 | -152.5 | 32.6 | -35.5 | 0 | 0 | 0 | 114.4 | V153 | P151-V153 PolarHBondContact O-N 3Š| ||
| 152 | A | 39.8 | Very low | 42.2 | Very low | 109 Ų | 109 | 129.2 Ų | 129.2 | 90% | 0.901 | 78% | 0.784 | S | S | * | * | trans | -51.1 | 113.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 153 | V | 43.2 | Very low | 42.8 | Very low | 133 Ų | 133 | 129 Ų | 129 | 81% | 0.806 | 78% | 0.783 | S | S | * | * | trans | -92.4 | 118.2 | 166.2 | -179.8 | 0 | 0 | 0 | 0 | 108 | P151 | P151-V153 PolarHBondContact O-N 3Š| ||
| 154 | T | 41.8 | Very low | 43.5 | Very low | 121 Ų | 121 | 127.4 Ų | 127.4 | 74% | 0.742 | 77% | 0.766 | S | S | * | * | trans | -38.2 | 135.5 | 174.8 | 32.9 | 0 | 0 | 0 | 0 | 114.3 | V156 | T154-V156 PolarHBondContact O-N 3.41Š| ||
| 155 | V | 41.3 | Very low | 43.9 | Very low | 141 Ų | 141 | 121.4 Ų | 121.4 | 86% | 0.855 | 73% | 0.731 | S | S | * | * | trans | -40.5 | 102.7 | 171.2 | 177.7 | 0 | 0 | 0 | 0 | 110.4 | Q157 | V155-Q157 PolarHBondContact O-N 3.39Š| ||
| 156 | V | 42.6 | Very low | 44.6 | Very low | 124 Ų | 124 | 120.8 Ų | 120.8 | 75% | 0.752 | 73% | 0.727 | S | S | * | * | trans | -74.8 | 89.2 | 164.4 | -176 | 0 | 0 | 0 | 0 | 105.2 | T154 E158 | T154-V156 PolarHBondContact O-N 3.41Å; V156-E158 PolarHBondContact O-N 2.83Å; V156-E158 VanDerWaalsContact O-N 3.12Å | ||
| 157 | Q | 45.3 | Very low | 45.6 | Very low | 162 Ų | 162 | 119.4 Ų | 119.4 | 76% | 0.757 | 72% | 0.72 | S | S | * | * | trans | -50.7 | 118.5 | 159.7 | -161.6 | 166.9 | 8.6 | 0 | 0 | 105.5 | V155 C159 | V155-Q157 PolarHBondContact O-N 3.39Å; Q157-C159 PolarHBondContact O-N 3.36Å | ||
| 158 | E | 41.5 | Very low | 46.2 | Very low | 187 Ų | 187 | 113.8 Ų | 113.8 | 87% | 0.874 | 68% | 0.684 | S | S | * | * | trans | -55.5 | 87.3 | -177.9 | -69.8 | 165.4 | 151.8 | 0 | 0 | 108.6 | V156 C160 | V156-E158 PolarHBondContact O-N 2.83Å; V156-E158 VanDerWaalsContact O-N 3.12Å; E158-C160 PolarHBondContact O-N 2.9Å | ||
| 159 | C | 41.1 | Very low | 47.1 | Very low | 114 Ų | 114 | 111.5 Ų | 111.5 | 77% | 0.77 | 67% | 0.672 | S | S | * | * | trans | -64.3 | 105.4 | 172.1 | -78.1 | 0 | 0 | 0 | 0 | 105.5 | Q157 T161 | Q157-C159 PolarHBondContact O-N 3.36Å; C159-T161 PolarHBondContact O-N 2.62Å; C159-T161 VanDerWaalsContact O-N 3.11Å | ||
| 160 | C | 45.8 | Very low | 48.4 | Very low | 105 Ų | 105 | 111.4 Ų | 111.4 | 71% | 0.709 | 66% | 0.663 | S | S | * | * | trans | -34.5 | 118.7 | 170.7 | -82.1 | 0 | 0 | 0 | 0 | 109.6 | E158 C162 | E158-C160 PolarHBondContact O-N 2.9Å; C160-C162 PolarHBondContact O-N 3.37Å | ||
| 161 | T | 52.1 | Low | 49 | Very low | 115 Ų | 115 | 104 Ų | 104 | 71% | 0.706 | 63% | 0.625 | S | S | * | * | trans | -69.3 | 77.4 | 164 | 54 | 0 | 0 | 0 | 0 | 106.8 | C159 H163 | C159-T161 PolarHBondContact O-N 2.62Å; C159-T161 VanDerWaalsContact O-N 3.11Å; T161-H163 PolarHBondContact O-N 2.87Å | ||
| 162 | C | 47.7 | Very low | 49.8 | Very low | 102 Ų | 102 | 102.6 Ų | 102.6 | 69% | 0.689 | 62% | 0.616 | S | S | * | * | trans | -58.1 | 99.8 | 156.7 | 43.1 | 0 | 0 | 0 | 0 | 104.8 | C160 Q164 | C160-C162 PolarHBondContact O-N 3.37Å; C162-Q164 VanDerWaalsContact C-N 3.33Å; C162-Q164 PolarHBondContact O-N 3.3Å | ||
| 163 | H | 51 | Low | 50.9 | Low | 163 Ų | 163 | 102.5 Ų | 102.5 | 76% | 0.755 | 61% | 0.606 | S | S | * | * | trans | -54 | 105.6 | 175.4 | -76.4 | -86.3 | 0 | 0 | 0 | 105.9 | T161 G165 | T161-H163 PolarHBondContact O-N 2.87Å; H163-G165 PolarHBondContact O-N 3.1Å | ||
| 164 | Q | 51.2 | Low | 51.5 | Low | 103 Ų | 103 | 96.6 Ų | 96.6 | 48% | 0.481 | 57% | 0.573 | S | S | . | * | P | Polyproline II helix | trans | -48.6 | 132.2 | 169.7 | -90.9 | 174.7 | -0.1 | 0 | 0 | 106.3 | C162 | C162-Q164 VanDerWaalsContact C-N 3.33Å; C162-Q164 PolarHBondContact O-N 3.3Å |
| 165 | G | 50.5 | Low | 52.1 | Low | 6 Ų | 6 | 98.6 Ų | 98.6 | 6% | 0.062 | 57% | 0.574 | C | S | . | * | P | Polyproline II helix | trans | -50 | 151.4 | 175 | 0 | 0 | 0 | 0 | 0 | 109.8 | H163 | H163-G165 PolarHBondContact O-N 3.1Š|
| 166 | P | 54.3 | Low | 52.7 | Low | 95 Ų | 95 | 97.7 Ų | 97.7 | 62% | 0.617 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 140.2 | -176.9 | 21.1 | -32.6 | 0 | 0 | 0 | 110 | G168 | P166-G168 PolarHBondContact O-N 3.46Š|
| 167 | P | 58.5 | Low | 53.1 | Low | 101 Ų | 101 | 92 Ų | 92 | 66% | 0.656 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -46.1 | 136.7 | 177.3 | -28 | 33.9 | 0 | 0 | 0 | 110.5 | ||
| 168 | G | 55.9 | Low | 53.3 | Low | 4 Ų | 4 | 88 Ų | 88 | 4% | 0.041 | 53% | 0.526 | C | S | . | . | P | Polyproline II helix | trans | -57.6 | 156.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | P166 G338 | P166-G168 PolarHBondContact O-N 3.46Å; G168-G338 VanDerWaalsContact CA-CA 3.47Å |
| 169 | P | 62.5 | Low | 53.7 | Low | 87 Ų | 87 | 84.8 Ų | 84.8 | 57% | 0.565 | 51% | 0.514 | S | S | * | . | P | Polyproline II helix | trans | -53.2 | 147.2 | 177.1 | 24 | -33.2 | 0 | 0 | 0 | 110.3 | G171 | P169-G171 PolarHBondContact O-N 3.27Š|
| 170 | P | 63.6 | Low | 54.1 | Low | 96 Ų | 96 | 79.8 Ų | 79.8 | 62% | 0.623 | 48% | 0.482 | S | S | * | . | P | Polyproline II helix | trans | -48.8 | 143.1 | 174.2 | -26.4 | 34.3 | 0 | 0 | 0 | 110.9 | ||
| 171 | G | 57.3 | Low | 54.2 | Low | 6 Ų | 6 | 85.4 Ų | 85.4 | 6% | 0.062 | 49% | 0.488 | C | S | . | . | P | Polyproline II helix | trans | -58.9 | 158.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | P169 | P169-G171 PolarHBondContact O-N 3.27Š|
| 172 | P | 59.5 | Low | 54 | Low | 80 Ų | 80 | 85 Ų | 85 | 52% | 0.519 | 48% | 0.482 | S | S | . | . | P | Polyproline II helix | trans | -54 | 146.6 | 174.6 | 24.8 | -32.9 | 0 | 0 | 0 | 109.9 | V333 | P172-V333 HydrophobicContact CG-CG2 4.37Š|
| 173 | P | 61.3 | Low | 54 | Low | 107 Ų | 107 | 81.6 Ų | 81.6 | 70% | 0.695 | 46% | 0.464 | S | S | * | . | P | Polyproline II helix | trans | -48.9 | 143.7 | 172.1 | -25.7 | 34.2 | 0 | 0 | 0 | 110.8 | ||
| 174 | G | 57.4 | Low | 53.8 | Low | 10 Ų | 10 | 83 Ų | 83 | 10% | 0.103 | 47% | 0.47 | C | S | . | . | P | Polyproline II helix | trans | -57.5 | 152.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.2 | G221 G332 | G174-G221 PolarHBondContact N-O 2.88Å; G174-G332 VanDerWaalsContact CA-CA 3.47Å |
| 175 | E | 54.4 | Low | 53.7 | Low | 163 Ų | 163 | 83.3 Ų | 83.3 | 76% | 0.762 | 48% | 0.482 | S | S | * | . | P | Polyproline II helix | trans | -55.2 | 144.6 | 173.8 | -63.9 | -177 | 160.2 | 0 | 0 | 110.1 | G177 | E175-G177 PolarHBondContact O-N 3.47Š|
| 176 | D | 53.9 | Low | 53.5 | Low | 121 Ų | 121 | 86.4 Ų | 86.4 | 65% | 0.647 | 51% | 0.514 | S | S | * | . | P | Polyproline II helix | trans | -53.5 | 136.7 | 179 | -70.3 | -31.2 | 0 | 0 | 0 | 109.7 | P224 | D176-P224 WeakPolarHBondContact OD1-CD 3.38Å; D176-P224 WeakPolarHBondContact OD1-CG 3.5Å |
| 177 | G | 49.6 | Very low | 52.9 | Low | 5 Ų | 5 | 87.7 Ų | 87.7 | 5% | 0.052 | 53% | 0.525 | C | S | . | . | P | Polyproline II helix | trans | -60 | 143.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | E175 D179 I327 G329 | E175-G177 PolarHBondContact O-N 3.47Å; G177-D179 PolarHBondContact O-N 3.37Å; G177-I327 WeakPolarHBondContact CA-O 3.4Å; G177-G329 VanDerWaalsContact CA-CA 3.4Å |
| 178 | A | 49.6 | Very low | 52.4 | Low | 79 Ų | 79 | 90.4 Ų | 90.4 | 65% | 0.653 | 53% | 0.534 | S | S | * | . | P | Polyproline II helix | trans | -51.7 | 133.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 179 | D | 50.5 | Low | 51.7 | Low | 118 Ų | 118 | 94 Ų | 94 | 63% | 0.631 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 143.3 | 178.9 | -68.6 | -40.8 | 0 | 0 | 0 | 110.7 | G177 R181 | G177-D179 PolarHBondContact O-N 3.37Å; D179-R181 PolarHBondContact O-N 3.27Å |
| 180 | G | 49 | Very low | 50.5 | Low | 9 Ų | 9 | 95.8 Ų | 95.8 | 9% | 0.093 | 59% | 0.585 | C | S | . | * | P | Polyproline II helix | trans | -55.1 | 131.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | D182 | G180-D182 PolarHBondContact O-N 2.95Š|
| 181 | R | 49.2 | Very low | 49.5 | Very low | 224 Ų | 224 | 97.2 Ų | 97.2 | 85% | 0.845 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 133.4 | 177.3 | -62 | -176.3 | -170.6 | -179.2 | 3.1 | 108.6 | D179 G183 | D179-R181 PolarHBondContact O-N 3.27Å; R181-G183 PolarHBondContact O-N 3.19Å |
| 182 | D | 46.9 | Very low | 48.4 | Very low | 106 Ų | 106 | 100.8 Ų | 100.8 | 57% | 0.567 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 135.5 | 169.5 | -65.1 | -32.8 | 0 | 0 | 0 | 108.9 | G180 E184 P230 | G180-D182 PolarHBondContact O-N 2.95Å; D182-E184 PolarHBondContact O-N 2.99Å; D182-P230 VanDerWaalsContact OD1-CD 3.27Å; D182-P230 WeakPolarHBondContact OD1-CD 3.46Å; D182-P230 WeakPolarHBondContact OD1-CG 3.43Å |
| 183 | G | 47.4 | Very low | 47.4 | Very low | 30 Ų | 30 | 108.3 Ų | 108.3 | 31% | 0.309 | 65% | 0.65 | S | S | . | * | P | Polyproline II helix | trans | -57.7 | 131.7 | 169.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | R181 P185 | R181-G183 PolarHBondContact O-N 3.19Å; G183-P185 WeakPolarHBondContact O-CD 3.35Å; G183-P185 VanDerWaalsContact O-N 3.07Å |
| 184 | E | 47.1 | Very low | 46.2 | Very low | 192 Ų | 192 | 111.3 Ų | 111.3 | 90% | 0.897 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -50 | 117.5 | -175.8 | -76.2 | 178 | 107.9 | 0 | 0 | 110.5 | D182 | D182-E184 PolarHBondContact O-N 2.99Š|
| 185 | P | 49.8 | Very low | 45 | Very low | 111 Ų | 111 | 114.8 Ų | 114.8 | 72% | 0.721 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 143.2 | 162.4 | -18.9 | 33.2 | 0 | 0 | 0 | 108.5 | G183 S187 | G183-P185 WeakPolarHBondContact O-CD 3.35Å; G183-P185 VanDerWaalsContact O-N 3.07Å; P185-S187 PolarHBondContact O-N 3.46Å |
| 186 | G | 46.2 | Very low | 44.1 | Very low | 71 Ų | 71 | 114.9 Ų | 114.9 | 73% | 0.732 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 137.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | D188 | G186-D188 PolarHBondContact O-N 3.49Š|
| 187 | S | 40.4 | Very low | 43.2 | Very low | 121 Ų | 121 | 116.3 Ų | 116.3 | 85% | 0.846 | 71% | 0.706 | S | S | * | * | trans | -68.1 | 112.5 | -165 | 52.7 | 0 | 0 | 0 | 0 | 113.3 | P185 | P185-S187 PolarHBondContact O-N 3.46Š| ||
| 188 | D | 49.4 | Very low | 42.5 | Very low | 159 Ų | 159 | 122.2 Ų | 122.2 | 85% | 0.85 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -95.3 | 137.4 | 158.3 | -70.9 | -29.8 | 0 | 0 | 0 | 110.1 | G186 | G186-D188 PolarHBondContact O-N 3.49Š|
| 189 | G | 40.6 | Very low | 42.6 | Very low | 79 Ų | 79 | 123.5 Ų | 123.5 | 81% | 0.814 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 145.8 | -168.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 190 | S | 37.1 | Very low | 42.3 | Very low | 124 Ų | 124 | 122.4 Ų | 122.4 | 87% | 0.867 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 139 | -167.8 | -32.7 | 0 | 0 | 0 | 0 | 114.8 | ||
| 191 | P | 42.2 | Very low | 41.6 | Very low | 126 Ų | 126 | 131 Ų | 131 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -132.9 | 134 | 146 | 9.3 | 13.2 | 0 | 0 | 0 | 115.4 | ||||
| 192 | G | 34.9 | Very low | 41.4 | Very low | 82 Ų | 82 | 123.9 Ų | 123.9 | 85% | 0.845 | 77% | 0.771 | S | S | * | * | trans | 81.5 | 116.7 | 140.9 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 193 | R | 38.5 | Very low | 41.3 | Very low | 237 Ų | 237 | 125 Ų | 125 | 89% | 0.894 | 78% | 0.784 | S | S | * | * | trans | -103.3 | 160.2 | 178.6 | -59.7 | 174.7 | 178.6 | -178.9 | -1.5 | 111.3 | ||||
| 194 | D | 35.4 | Very low | 41.1 | Very low | 171 Ų | 171 | 130.1 Ų | 130.1 | 91% | 0.914 | 81% | 0.809 | S | S | * | * | trans | 163.5 | 148.8 | 141.1 | -73.9 | -24 | 0 | 0 | 0 | 108.3 | ||||
| 195 | G | 33.8 | Very low | 40.9 | Very low | 82 Ų | 82 | 126.6 Ų | 126.6 | 85% | 0.845 | 80% | 0.803 | S | S | * | * | cis | -169.6 | 167.1 | 4.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 196 | K | 33.9 | Very low | 40.4 | Very low | 166 Ų | 166 | 130.6 Ų | 130.6 | 72% | 0.722 | 81% | 0.812 | S | S | * | * | trans | -96.6 | 151.3 | -157.6 | 175.9 | -176 | -175.4 | -169.7 | 0 | 114.5 | ||||
| 197 | V | 36.2 | Very low | 40.6 | Very low | 151 Ų | 151 | 132.4 Ų | 132.4 | 92% | 0.915 | 81% | 0.811 | S | S | * | * | trans | -142.8 | 144.3 | 155.3 | -175.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 198 | L | 34 | Very low | 40.4 | Very low | 128 Ų | 128 | 132.2 Ų | 132.2 | 67% | 0.67 | 81% | 0.808 | S | S | * | * | trans | -115.6 | 175.6 | -165.5 | -88.4 | 170 | 0 | 0 | 0 | 111.8 | ||||
| 199 | P | 51 | Low | 40.4 | Very low | 107 Ų | 107 | 133.7 Ų | 133.7 | 70% | 0.695 | 81% | 0.809 | S | S | * | * | trans | -104.7 | -145.4 | -153.8 | 47.5 | -38.3 | 0 | 0 | 0 | 111.4 | ||||
| 200 | P | 46.2 | Very low | 40.9 | Very low | 95 Ų | 95 | 137.7 Ų | 137.7 | 62% | 0.617 | 81% | 0.81 | S | S | * | * | cis | -134.9 | -162.5 | -29.7 | 36.4 | -15.5 | 0 | 0 | 0 | 112.8 | ||||
| 201 | E | 32.8 | Very low | 41.4 | Very low | 190 Ų | 190 | 134.5 Ų | 134.5 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | trans | 90.5 | 123 | 143 | -81.4 | 164.4 | 174.1 | 0 | 0 | 121.8 | ||||
| 202 | G | 46.5 | Very low | 41.9 | Very low | 73 Ų | 73 | 134.5 Ų | 134.5 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | trans | -154.7 | 152.1 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 203 | P | 43.7 | Very low | 42.8 | Very low | 130 Ų | 130 | 133.2 Ų | 133.2 | 84% | 0.844 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -103.1 | 155.4 | -142.6 | 29.9 | -17.1 | 0 | 0 | 0 | 115.4 | ||
| 204 | V | 43.5 | Very low | 43.5 | Very low | 138 Ų | 138 | 121.9 Ų | 121.9 | 84% | 0.836 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 134.8 | -170.4 | -146.8 | 0 | 0 | 0 | 0 | 111.7 | ||
| 205 | P | 42.5 | Very low | 44.6 | Very low | 118 Ų | 118 | 119.5 Ų | 119.5 | 77% | 0.766 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 137 | 177.9 | 31.6 | -31.3 | 0 | 0 | 0 | 112.7 | ||
| 206 | E | 39.9 | Very low | 46 | Very low | 195 Ų | 195 | 116.6 Ų | 116.6 | 91% | 0.911 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 125.7 | -173.9 | -63.6 | 172 | 152.4 | 0 | 0 | 113.4 | ||
| 207 | P | 49.6 | Very low | 47.3 | Very low | 109 Ų | 109 | 108.8 Ų | 108.8 | 71% | 0.708 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 148.7 | 177.4 | 33 | -25.9 | 0 | 0 | 0 | 114.5 | ||
| 208 | C | 36.7 | Very low | 48.5 | Very low | 116 Ų | 116 | 105.5 Ų | 105.5 | 78% | 0.784 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 137.5 | -171.9 | -52.3 | 0 | 0 | 0 | 0 | 114.8 | I210 | C208-I210 PolarHBondContact O-N 3.3Š|
| 209 | Q | 50.4 | Low | 49.9 | Very low | 190 Ų | 190 | 102.4 Ų | 102.4 | 89% | 0.888 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -82.9 | -3.3 | -164.7 | -92.5 | 175.1 | -35.3 | 0 | 0 | 118.3 | ||
| 210 | I | 50.8 | Low | 50.2 | Low | 163 Ų | 163 | 97.5 Ų | 97.5 | 84% | 0.836 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -105.1 | -28.9 | -167.4 | -63.2 | 163.4 | 0 | 0 | 0 | 113.9 | C208 | C208-I210 PolarHBondContact O-N 3.3Š|
| 211 | C | 46.2 | Very low | 50.7 | Low | 57 Ų | 57 | 95.7 Ų | 95.7 | 39% | 0.385 | 57% | 0.57 | S | S | . | * | S | Bend | trans | -115.1 | 97 | 174.8 | -56.7 | 0 | 0 | 0 | 0 | 107 | P213 P340 | C211-P213 WeakPolarHBondContact O-CD 3.37Å; C211-P340 HydrophobicContact CB-CB 4.06Å |
| 212 | L | 53.7 | Low | 52.2 | Low | 127 Ų | 127 | 89.5 Ų | 89.5 | 67% | 0.665 | 55% | 0.551 | S | S | * | * | P | Polyproline II helix | trans | -55 | 119.4 | 176.9 | -83.6 | 88.3 | 0 | 0 | 0 | 107.9 | ||
| 213 | P | 52.7 | Low | 52.4 | Low | 54 Ų | 54 | 86.2 Ų | 86.2 | 35% | 0.351 | 52% | 0.517 | S | S | . | . | P | Polyproline II helix | trans | -52.7 | 145.7 | 170.1 | -26.1 | 36.6 | 0 | 0 | 0 | 109.5 | C211 | C211-P213 WeakPolarHBondContact O-CD 3.37Š|
| 214 | G | 54.7 | Low | 52.9 | Low | 0 Ų | 0 | 84 Ų | 84 | 0% | 0 | 50% | 0.503 | C | S | . | . | B | Isolated β-bridge | trans | -53.2 | 147.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | A216 S337 G338 | G214-A216 PolarHBondContact O-N 2.88Å; G214-S337 WeakPolarHBondContact O-CA 3.41Å; G214-S337 WeakPolarHBondContact O-CB 3.4Å; G214-S337 PolarHBondContact O-OG 3.36Å; G214-S337 VanDerWaalsContact O-OG 3.05Å; G214-G338 PolarHBondContact N-O 3.17Å; G214-G338 PolarHBondContact O-N 2.98Å |
| 215 | M | 58.7 | Low | 53.5 | Low | 120 Ų | 120 | 83.3 Ų | 83.3 | 59% | 0.591 | 49% | 0.489 | S | S | * | . | P | Polyproline II helix | trans | -48 | 132.4 | 179.9 | -69.4 | -178.9 | 76 | 0 | 0 | 109.9 | G217 | M215-G217 PolarHBondContact O-N 2.91Š|
| 216 | A | 63.2 | Low | 53.9 | Low | 22 Ų | 22 | 78.1 Ų | 78.1 | 18% | 0.182 | 46% | 0.457 | C | S | . | . | P | Polyproline II helix | trans | -54.4 | 134.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | G214 R334 G335 | G214-A216 PolarHBondContact O-N 2.88Å; A216-R334 HydrophobicContact CB-CG 3.93Å; A216-R334 VanDerWaalsContact CB-CZ 3.4Å; A216-R334 VanDerWaalsContact O-CZ 3.24Å; A216-R334 PolarHBondContact O-NE 2.92Å; A216-R334 PolarHBondContact O-NH2 3.28Å; A216-G335 VanDerWaalsContact CB-O 3.31Å; A216-G335 WeakPolarHBondContact CB-O 3.35Å |
| 217 | G | 61 | Low | 54.4 | Low | 1 Ų | 1 | 72.9 Ų | 72.9 | 1% | 0.01 | 44% | 0.44 | C | S | . | . | P | Polyproline II helix | trans | -58.1 | 160.8 | -173.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | M215 R334 G335 | M215-G217 PolarHBondContact O-N 2.91Å; G217-R334 WeakPolarHBondContact O-CG 3.46Å; G217-G335 PolarHBondContact N-O 3.49Å |
| 218 | P | 61.8 | Low | 54.7 | Low | 82 Ų | 82 | 73 Ų | 73 | 53% | 0.532 | 44% | 0.441 | S | S | . | . | P | Polyproline II helix | trans | -56.8 | 150.2 | 177.8 | 24.5 | -33 | 0 | 0 | 0 | 111.1 | ||
| 219 | P | 61.7 | Low | 55.4 | Low | 63 Ų | 63 | 68.3 Ų | 68.3 | 41% | 0.409 | 41% | 0.411 | S | S | . | . | B | Isolated β-bridge | trans | -55.2 | 141 | 174.3 | -20.1 | 30.4 | 0 | 0 | 0 | 111.2 | Q331 G332 | P219-Q331 HydrophobicContact CB-CG 4.03Å; P219-G332 WeakPolarHBondContact CB-O 3.34Å |
| 220 | G | 57.2 | Low | 55.5 | Low | 5 Ų | 5 | 63.8 Ų | 63.8 | 5% | 0.052 | 40% | 0.399 | C | S | . | . | P | Polyproline II helix | trans | -57.4 | 152.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q331 G332 | G220-Q331 VanDerWaalsContact O-CG 3.23Å; G220-Q331 WeakPolarHBondContact O-CG 3.28Å; G220-G332 PolarHBondContact N-O 3.3Å; G220-G332 PolarHBondContact O-N 3.47Å |
| 221 | G | 58.1 | Low | 55.8 | Low | 56 Ų | 56 | 63.8 Ų | 63.8 | 58% | 0.577 | 39% | 0.393 | S | S | * | . | P | Polyproline II helix | trans | -56.5 | 155.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | G174 | G174-G221 PolarHBondContact N-O 2.88Š|
| 222 | A | 63.3 | Low | 56 | Low | 60 Ų | 60 | 63 Ų | 63 | 50% | 0.496 | 39% | 0.394 | S | S | . | . | B | Isolated β-bridge | trans | -58.4 | 139.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | I328 | A222-I328 HydrophobicContact CB-CG2 3.6Å |
| 223 | G | 51.5 | Low | 55.9 | Low | 4 Ų | 4 | 66.5 Ų | 66.5 | 4% | 0.041 | 40% | 0.404 | C | S | . | . | P | Polyproline II helix | trans | -58 | 152.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 224 | P | 53.9 | Low | 55.9 | Low | 85 Ų | 85 | 70 Ų | 70 | 55% | 0.552 | 43% | 0.426 | S | S | * | . | P | Polyproline II helix | trans | -57.8 | 152.4 | 177.6 | 27 | -33.7 | 0 | 0 | 0 | 110.9 | D176 G226 | D176-P224 WeakPolarHBondContact OD1-CD 3.38Å; D176-P224 WeakPolarHBondContact OD1-CG 3.5Å; P224-G226 PolarHBondContact O-N 3.49Å |
| 225 | K | 57.1 | Low | 55.8 | Low | 123 Ų | 123 | 72.5 Ų | 72.5 | 54% | 0.535 | 45% | 0.453 | S | S | . | . | P | Polyproline II helix | trans | -66.2 | 128.5 | 176.7 | -169.2 | -179.7 | -172.6 | 172.2 | 0 | 109.4 | G326 | K225-G326 WeakPolarHBondContact CE-O 3.32Å; K225-G326 VanDerWaalsContact CG-O 3.24Å; K225-G326 WeakPolarHBondContact CG-O 3.5Å |
| 226 | G | 49.7 | Very low | 55.5 | Low | 9 Ų | 9 | 71.3 Ų | 71.3 | 9% | 0.093 | 46% | 0.462 | C | S | . | . | P | Polyproline II helix | trans | -55.8 | 150.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | P224 | P224-G226 PolarHBondContact O-N 3.49Š|
| 227 | P | 50.3 | Low | 55.1 | Low | 85 Ų | 85 | 76.2 Ų | 76.2 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | P | Polyproline II helix | trans | -60.5 | 154.4 | -178.2 | 25.9 | -33.7 | 0 | 0 | 0 | 111.8 | G229 | P227-G229 PolarHBondContact O-N 3.48Š|
| 228 | P | 56.3 | Low | 54.6 | Low | 112 Ų | 112 | 79.1 Ų | 79.1 | 73% | 0.727 | 52% | 0.522 | S | S | * | . | P | Polyproline II helix | trans | -58.7 | 137.3 | 171.3 | -21.4 | 32.9 | 0 | 0 | 0 | 111 | ||
| 229 | G | 50.9 | Low | 53.9 | Low | 16 Ų | 16 | 83.4 Ų | 83.4 | 17% | 0.165 | 54% | 0.54 | C | S | . | . | P | Polyproline II helix | trans | -58.9 | 151.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | P227 | P227-G229 PolarHBondContact O-N 3.48Š|
| 230 | P | 53.4 | Low | 53.4 | Low | 96 Ų | 96 | 88.3 Ų | 88.3 | 62% | 0.623 | 56% | 0.562 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 149.6 | -179.4 | 25 | -34.4 | 0 | 0 | 0 | 112.6 | D182 | D182-P230 VanDerWaalsContact OD1-CD 3.27Å; D182-P230 WeakPolarHBondContact OD1-CD 3.46Å; D182-P230 WeakPolarHBondContact OD1-CG 3.43Å |
| 231 | K | 55.9 | Low | 53 | Low | 162 Ų | 162 | 91.1 Ų | 91.1 | 70% | 0.704 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 134.1 | 176.9 | -171.6 | 176.1 | -179.7 | 177 | 0 | 110.1 | ||
| 232 | G | 51.5 | Low | 52.4 | Low | 40 Ų | 40 | 98.7 Ų | 98.7 | 41% | 0.412 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -54 | 146.1 | 178 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 233 | K | 50.5 | Low | 51.7 | Low | 201 Ų | 201 | 107.3 Ų | 107.3 | 87% | 0.874 | 63% | 0.628 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 148.2 | -177.9 | -66.2 | -178.2 | -178.4 | 178.2 | 0 | 111.3 | ||
| 234 | P | 54.5 | Low | 51.6 | Low | 127 Ų | 127 | 110.5 Ų | 110.5 | 83% | 0.825 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 142.5 | 174 | -23.1 | 33.8 | 0 | 0 | 0 | 112.3 | ||
| 235 | G | 51.6 | Low | 51.1 | Low | 54 Ų | 54 | 115.8 Ų | 115.8 | 56% | 0.557 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 154.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 236 | A | 51.5 | Low | 50.7 | Low | 95 Ų | 95 | 121.5 Ų | 121.5 | 79% | 0.785 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 148.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 237 | P | 54.9 | Low | 50.6 | Low | 125 Ų | 125 | 124.2 Ų | 124.2 | 81% | 0.812 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 142.5 | 175.2 | -23.1 | 33.9 | 0 | 0 | 0 | 112.8 | ||
| 238 | G | 51.6 | Low | 50.4 | Low | 62 Ų | 62 | 129.4 Ų | 129.4 | 64% | 0.639 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 151.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 239 | L | 46.9 | Very low | 50.3 | Low | 172 Ų | 172 | 131 Ų | 131 | 90% | 0.901 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -74 | 141.3 | -178.8 | -65.5 | 173 | 0 | 0 | 0 | 112.1 | ||
| 240 | D | 50.4 | Low | 50.4 | Low | 165 Ų | 165 | 133.3 Ų | 133.3 | 88% | 0.882 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -60 | 137.9 | 179.9 | -76.8 | -36.9 | 0 | 0 | 0 | 112.9 | ||
| 241 | G | 48.8 | Very low | 50.2 | Low | 65 Ų | 65 | 133.8 Ų | 133.8 | 67% | 0.67 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -63 | 148.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 242 | K | 45.3 | Very low | 50.3 | Low | 215 Ų | 215 | 134.7 Ų | 134.7 | 94% | 0.935 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -66 | 143.7 | -178.6 | -69.2 | -170.7 | 176.5 | -177 | 0 | 112.4 | ||
| 243 | R | 50.4 | Low | 50.4 | Low | 241 Ų | 241 | 135.4 Ų | 135.4 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 131.8 | 179.1 | -169.7 | -176.4 | -48.9 | -160.7 | 3.8 | 111.1 | ||
| 244 | G | 48.4 | Very low | 50.5 | Low | 70 Ų | 70 | 131.8 Ų | 131.8 | 72% | 0.722 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 154.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 245 | E | 42.9 | Very low | 50.7 | Low | 197 Ų | 197 | 131.9 Ų | 131.9 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 156.5 | -177.5 | -68.2 | -176.2 | 155.9 | 0 | 0 | 113.4 | ||
| 246 | R | 48.7 | Very low | 50.8 | Low | 243 Ų | 243 | 132.6 Ų | 132.6 | 92% | 0.917 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 134.4 | -176 | -174.5 | -175.3 | -62.9 | 175.8 | 0.5 | 111 | ||
| 247 | G | 49 | Very low | 50.8 | Low | 65 Ų | 65 | 140 Ų | 140 | 67% | 0.67 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 153.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 248 | M | 44.1 | Very low | 50.8 | Low | 195 Ų | 195 | 140.7 Ų | 140.7 | 96% | 0.961 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 151 | -177.3 | -67.5 | 179 | 74.7 | 0 | 0 | 113.4 | ||
| 249 | V | 55.5 | Low | 50.8 | Low | 146 Ų | 146 | 140.8 Ų | 140.8 | 89% | 0.885 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 135.2 | -179.7 | -179.4 | 0 | 0 | 0 | 0 | 110.9 | ||
| 250 | G | 52.6 | Low | 51 | Low | 63 Ų | 63 | 140.3 Ų | 140.3 | 65% | 0.649 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 154.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 251 | A | 49.3 | Very low | 51.3 | Low | 106 Ų | 106 | 137.4 Ų | 137.4 | 88% | 0.876 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 153.9 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 252 | E | 57.2 | Low | 51.7 | Low | 181 Ų | 181 | 136.6 Ų | 136.6 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 140.8 | -179.7 | -169 | 175 | 175.9 | 0 | 0 | 112.6 | ||
| 253 | G | 54.2 | Low | 52 | Low | 56 Ų | 56 | 132.6 Ų | 132.6 | 58% | 0.577 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 155.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 254 | P | 53.3 | Low | 52.5 | Low | 124 Ų | 124 | 127.8 Ų | 127.8 | 81% | 0.805 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 154.5 | -174.6 | 28.5 | -34.5 | 0 | 0 | 0 | 114 | ||
| 255 | P | 57.5 | Low | 53 | Low | 130 Ų | 130 | 126.5 Ų | 126.5 | 84% | 0.844 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 146.5 | 178.5 | -22.2 | 33.3 | 0 | 0 | 0 | 114.5 | ||
| 256 | G | 54.5 | Low | 53.5 | Low | 69 Ų | 69 | 123.1 Ų | 123.1 | 71% | 0.711 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 154 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 257 | R | 50.7 | Low | 54.1 | Low | 251 Ų | 251 | 116.4 Ų | 116.4 | 95% | 0.947 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 150.1 | -178.2 | -71.8 | -176.7 | 170.4 | 175.7 | -3.2 | 112.7 | ||
| 258 | V | 54.9 | Low | 54.4 | Low | 139 Ų | 139 | 116.3 Ų | 116.3 | 84% | 0.842 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 136.8 | 178 | -177.5 | 0 | 0 | 0 | 0 | 110.1 | ||
| 259 | G | 51.7 | Low | 54.5 | Low | 63 Ų | 63 | 115.1 Ų | 115.1 | 65% | 0.649 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 151.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 260 | D | 51.4 | Low | 54.1 | Low | 162 Ų | 162 | 114.8 Ų | 114.8 | 87% | 0.866 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 154.5 | -175.8 | -65.4 | -44 | 0 | 0 | 0 | 113.6 | ||
| 261 | C | 57.9 | Low | 53.9 | Low | 104 Ų | 104 | 114.7 Ų | 114.7 | 70% | 0.703 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 138.8 | -178.3 | -167.3 | 0 | 0 | 0 | 0 | 112.2 | ||
| 262 | G | 55.4 | Low | 53.7 | Low | 49 Ų | 49 | 119.9 Ų | 119.9 | 51% | 0.505 | 74% | 0.738 | S | S | . | * | P | Polyproline II helix | trans | -69.3 | 154.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 263 | P | 53.5 | Low | 53.4 | Low | 131 Ų | 131 | 119.1 Ų | 119.1 | 85% | 0.851 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 150.4 | -177.3 | 26.9 | -33.6 | 0 | 0 | 0 | 113 | ||
| 264 | K | 59 | Low | 53.2 | Low | 139 Ų | 139 | 123.1 Ų | 123.1 | 60% | 0.604 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 137.1 | -179.5 | -171.2 | 176.3 | -179.7 | 178.3 | 0 | 111.2 | ||
| 265 | G | 59.1 | Low | 52.9 | Low | 43 Ų | 43 | 126.7 Ų | 126.7 | 44% | 0.443 | 75% | 0.752 | S | S | . | * | P | Polyproline II helix | trans | -63.9 | 155.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 266 | P | 54.4 | Low | 52.3 | Low | 127 Ų | 127 | 127.5 Ų | 127.5 | 83% | 0.825 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 153.9 | -178.8 | 27.1 | -33.6 | 0 | 0 | 0 | 112.5 | ||
| 267 | V | 61.2 | Low | 52.3 | Low | 102 Ų | 102 | 129.4 Ų | 129.4 | 62% | 0.618 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 134.7 | 177 | 178.2 | 0 | 0 | 0 | 0 | 109.1 | ||
| 268 | G | 56.2 | Low | 52.6 | Low | 62 Ų | 62 | 119.6 Ų | 119.6 | 64% | 0.639 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 145.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 269 | D | 45.6 | Very low | 52.5 | Low | 171 Ų | 171 | 118.7 Ų | 118.7 | 91% | 0.914 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 143.4 | -177.2 | -67.4 | -50.1 | 0 | 0 | 0 | 113.2 | ||
| 270 | D | 46.8 | Very low | 53.1 | Low | 138 Ų | 138 | 119.8 Ų | 119.8 | 74% | 0.738 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 132.4 | -171.5 | -69.5 | -40.7 | 0 | 0 | 0 | 114.1 | K272 | D270-K272 PolarHBondContact O-N 3.08Š|
| 271 | G | 49.2 | Very low | 53.7 | Low | 61 Ų | 61 | 113.8 Ų | 113.8 | 63% | 0.629 | 69% | 0.691 | S | S | * | * | trans | -75 | 106.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L273 | G271-L273 PolarHBondContact O-N 2.91Š| ||
| 272 | K | 43.7 | Very low | 53.5 | Low | 215 Ų | 215 | 114.4 Ų | 114.4 | 94% | 0.935 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | 87 | 174.9 | -162.6 | -177.9 | -164.6 | -174 | 0 | 111.4 | D270 | D270-K272 PolarHBondContact O-N 3.08Š|
| 273 | L | 52.4 | Low | 53.8 | Low | 165 Ų | 165 | 117.4 Ų | 117.4 | 86% | 0.864 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 178.3 | -13.3 | 136.4 | -163.2 | 53.4 | 0 | 0 | 0 | 111.8 | G271 | G271-L273 PolarHBondContact O-N 2.91Š|
| 274 | I | 48.1 | Very low | 54 | Low | 140 Ų | 140 | 113.2 Ų | 113.2 | 72% | 0.718 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -146.1 | 110.1 | 177.4 | -43.2 | 172.8 | 0 | 0 | 0 | 107.9 | I276 | I274-I276 PolarHBondContact O-N 3.37Š|
| 275 | E | 48.2 | Very low | 53.7 | Low | 200 Ų | 200 | 112.2 Ų | 112.2 | 94% | 0.935 | 69% | 0.693 | S | S | * | * | trans | -69.1 | 88.4 | -175.6 | -68.9 | 179.4 | 172.2 | 0 | 0 | 111.6 | ||||
| 276 | I | 45 | Very low | 53.7 | Low | 146 Ų | 146 | 115.7 Ų | 115.7 | 75% | 0.749 | 71% | 0.708 | S | S | * | * | trans | -123.1 | 108 | 159.8 | -60.2 | 176.4 | 0 | 0 | 0 | 106.7 | I274 G278 | I274-I276 PolarHBondContact O-N 3.37Å; I276-G278 PolarHBondContact O-N 2.94Å; I276-G278 VanDerWaalsContact O-N 3.16Å | ||
| 277 | T | 54.2 | Low | 53.8 | Low | 110 Ų | 110 | 112.4 Ų | 112.4 | 68% | 0.675 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 117.7 | 172.2 | -50.9 | 0 | 0 | 0 | 0 | 109.3 | ||
| 278 | G | 56.5 | Low | 53.2 | Low | 45 Ų | 45 | 114.2 Ų | 114.2 | 46% | 0.464 | 71% | 0.709 | S | S | . | * | P | Polyproline II helix | trans | -65.4 | 142.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | I276 | I276-G278 PolarHBondContact O-N 2.94Å; I276-G278 VanDerWaalsContact O-N 3.16Å |
| 279 | P | 53.5 | Low | 53.2 | Low | 120 Ų | 120 | 120.3 Ų | 120.3 | 78% | 0.779 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 149.4 | 178.3 | 24.8 | -33 | 0 | 0 | 0 | 111.4 | G281 | P279-G281 PolarHBondContact O-N 3.24Š|
| 280 | P | 63.6 | Low | 53.7 | Low | 85 Ų | 85 | 114.5 Ų | 114.5 | 55% | 0.552 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 136.6 | 178.9 | -24.9 | 32.7 | 0 | 0 | 0 | 112.2 | ||
| 281 | G | 63.9 | Low | 53.8 | Low | 37 Ų | 37 | 114.1 Ų | 114.1 | 38% | 0.381 | 71% | 0.706 | S | S | . | * | P | Polyproline II helix | trans | -57.2 | 150.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | P279 | P279-G281 PolarHBondContact O-N 3.24Š|
| 282 | P | 54.3 | Low | 54.3 | Low | 116 Ų | 116 | 120.5 Ų | 120.5 | 75% | 0.753 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 151.9 | -179.3 | 24.8 | -33.1 | 0 | 0 | 0 | 111.9 | ||
| 283 | P | 60.4 | Low | 55 | Low | 112 Ų | 112 | 112.4 Ų | 112.4 | 73% | 0.727 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 139.2 | 173.6 | -23.8 | 33.6 | 0 | 0 | 0 | 111.7 | ||
| 284 | G | 59.4 | Low | 55 | Low | 44 Ų | 44 | 110.2 Ų | 110.2 | 45% | 0.454 | 69% | 0.69 | S | S | . | * | P | Polyproline II helix | trans | -63.3 | 155.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 285 | P | 51.5 | Low | 55.7 | Low | 117 Ų | 117 | 109.6 Ų | 109.6 | 76% | 0.76 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 153.1 | 179.3 | 25.3 | -33.4 | 0 | 0 | 0 | 112.1 | G287 | P285-G287 PolarHBondContact O-N 3.43Š|
| 286 | P | 59.9 | Low | 56.2 | Low | 116 Ų | 116 | 102.9 Ų | 102.9 | 75% | 0.753 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 137.9 | 176.5 | -24.5 | 33.3 | 0 | 0 | 0 | 112 | ||
| 287 | G | 56.8 | Low | 56.4 | Low | 59 Ų | 59 | 101.7 Ų | 101.7 | 61% | 0.608 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 140.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | P285 | P285-G287 PolarHBondContact O-N 3.43Š|
| 288 | T | 47.5 | Very low | 56.8 | Low | 140 Ų | 140 | 102.4 Ų | 102.4 | 86% | 0.859 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 145.3 | 175.4 | 49.6 | 0 | 0 | 0 | 0 | 110.8 | G290 | T288-G290 PolarHBondContact O-N 3.03Š|
| 289 | Q | 57 | Low | 56.8 | Low | 190 Ų | 190 | 103.2 Ų | 103.2 | 89% | 0.888 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 122.7 | 175.7 | -176.3 | 174.2 | 29.1 | 0 | 0 | 110.4 | ||
| 290 | G | 56.6 | Low | 56.4 | Low | 49 Ų | 49 | 107.1 Ų | 107.1 | 51% | 0.505 | 70% | 0.7 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 149 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | T288 | T288-G290 PolarHBondContact O-N 3.03Š|
| 291 | P | 48.4 | Very low | 56.1 | Low | 129 Ų | 129 | 110.6 Ų | 110.6 | 84% | 0.838 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 149.6 | 179.7 | 24.5 | -33.3 | 0 | 0 | 0 | 111.5 | G293 | P291-G293 PolarHBondContact O-N 3.28Š|
| 292 | K | 60 | Low | 55.6 | Low | 196 Ų | 196 | 112 Ų | 112 | 85% | 0.852 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 125.6 | 175.5 | -174.3 | 177.7 | 179.3 | 178.4 | 0 | 109 | ||
| 293 | G | 57.8 | Low | 55.1 | Low | 44 Ų | 44 | 114.8 Ų | 114.8 | 45% | 0.454 | 73% | 0.734 | S | S | . | * | P | Polyproline II helix | trans | -55.8 | 147 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111 | P291 | P291-G293 PolarHBondContact O-N 3.28Š|
| 294 | P | 51.7 | Low | 54.9 | Low | 120 Ų | 120 | 115.2 Ų | 115.2 | 78% | 0.779 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 152.3 | 178.3 | 24.9 | -33.3 | 0 | 0 | 0 | 110.8 | G296 | P294-G296 PolarHBondContact O-N 2.87Š|
| 295 | P | 63.3 | Low | 54.5 | Low | 126 Ų | 126 | 116.5 Ų | 116.5 | 82% | 0.818 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 136.9 | 174.5 | -25.2 | 33.6 | 0 | 0 | 0 | 111 | ||
| 296 | G | 58.3 | Low | 54 | Low | 59 Ų | 59 | 119.1 Ų | 119.1 | 61% | 0.608 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 149.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | P294 | P294-G296 PolarHBondContact O-N 2.87Š|
| 297 | P | 50.1 | Low | 53.6 | Low | 121 Ų | 121 | 123 Ų | 123 | 79% | 0.786 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 147.7 | 177.5 | 24.4 | -33 | 0 | 0 | 0 | 110.3 | G299 | P297-G299 PolarHBondContact O-N 3.3Š|
| 298 | P | 62.4 | Low | 53.4 | Low | 125 Ų | 125 | 122.6 Ų | 122.6 | 81% | 0.812 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 135.4 | 175.4 | -26.2 | 33.6 | 0 | 0 | 0 | 110.7 | K300 | P298-K300 PolarHBondContact O-N 3.48Š|
| 299 | G | 57.1 | Low | 53.2 | Low | 62 Ų | 62 | 121.5 Ų | 121.5 | 64% | 0.639 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 130.1 | 173 | 0 | 0 | 0 | 0 | 0 | 109.2 | P297 D301 | P297-G299 PolarHBondContact O-N 3.3Å; G299-D301 PolarHBondContact O-N 3.01Å |
| 300 | K | 45.2 | Very low | 53.2 | Low | 202 Ų | 202 | 118 Ų | 118 | 88% | 0.878 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 133.1 | 173.8 | 41.3 | -179.1 | 167.5 | 178.1 | 0 | 109.7 | P298 G302 | P298-K300 PolarHBondContact O-N 3.48Å; K300-G302 PolarHBondContact O-N 2.9Å |
| 301 | D | 56.5 | Low | 53 | Low | 158 Ų | 158 | 118.6 Ų | 118.6 | 85% | 0.845 | 75% | 0.752 | S | S | * | * | trans | -45.7 | 128.7 | 178.1 | -71 | -37.4 | 0 | 0 | 0 | 109.4 | G299 M303 | G299-D301 PolarHBondContact O-N 3.01Å; D301-M303 PolarHBondContact O-N 3.42Å | ||
| 302 | G | 52.7 | Low | 52.6 | Low | 66 Ų | 66 | 120.1 Ų | 120.1 | 68% | 0.68 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -53 | 131.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | K300 | K300-G302 PolarHBondContact O-N 2.9Š|
| 303 | M | 44.9 | Very low | 52.3 | Low | 175 Ų | 175 | 119.5 Ų | 119.5 | 86% | 0.862 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 138 | 177.4 | -71.3 | -174.4 | 68.3 | 0 | 0 | 109 | D301 G305 | D301-M303 PolarHBondContact O-N 3.42Å; M303-G305 PolarHBondContact O-N 3.35Å; M303-G305 VanDerWaalsContact O-N 3.1Å |
| 304 | P | 56.2 | Low | 52 | Low | 121 Ų | 121 | 119.2 Ų | 119.2 | 79% | 0.786 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 125.1 | 173.9 | -25.8 | 32.9 | 0 | 0 | 0 | 108.8 | L306 | P304-L306 PolarHBondContact O-N 3.21Š|
| 305 | G | 50.8 | Low | 51.8 | Low | 72 Ų | 72 | 119.2 Ų | 119.2 | 74% | 0.742 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -50 | 131.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | M303 K307 | M303-G305 PolarHBondContact O-N 3.35Å; M303-G305 VanDerWaalsContact O-N 3.1Å; G305-K307 PolarHBondContact O-N 3.49Å |
| 306 | L | 41.4 | Very low | 51.4 | Low | 172 Ų | 172 | 118.8 Ų | 118.8 | 90% | 0.901 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 131.1 | 177.9 | -71.2 | 169.4 | 0 | 0 | 0 | 108 | P304 G308 | P304-L306 PolarHBondContact O-N 3.21Å; L306-G308 PolarHBondContact O-N 2.94Å |
| 307 | K | 51.6 | Low | 51 | Low | 197 Ų | 197 | 118.3 Ų | 118.3 | 86% | 0.857 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -49 | 118.8 | 172.3 | -176.1 | 179.3 | 178.3 | -179.4 | 0 | 106.1 | G305 | G305-K307 PolarHBondContact O-N 3.49Š|
| 308 | G | 51.2 | Low | 50.8 | Low | 51 Ų | 51 | 120.3 Ų | 120.3 | 53% | 0.526 | 75% | 0.747 | S | S | . | * | P | Polyproline II helix | trans | -50.7 | 145.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | L306 | L306-G308 PolarHBondContact O-N 2.94Š|
| 309 | P | 44 | Very low | 50.4 | Low | 117 Ų | 117 | 121.1 Ų | 121.1 | 76% | 0.76 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 145.9 | 176.1 | 22.9 | -32.5 | 0 | 0 | 0 | 109.1 | G311 | P309-G311 PolarHBondContact O-N 3.42Š|
| 310 | P | 58 | Low | 50.2 | Low | 117 Ų | 117 | 120 Ų | 120 | 76% | 0.76 | 73% | 0.73 | S | S | * | * | trans | -45.1 | 131.8 | 170.9 | -24.3 | 32.9 | 0 | 0 | 0 | 108.5 | D312 | P310-D312 PolarHBondContact O-N 2.91Š| ||
| 311 | G | 51.7 | Low | 50.4 | Low | 60 Ų | 60 | 115.4 Ų | 115.4 | 62% | 0.619 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 138 | 174.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | P309 Q313 | P309-G311 PolarHBondContact O-N 3.42Å; G311-Q313 PolarHBondContact O-N 2.97Å |
| 312 | D | 40.5 | Very low | 50.5 | Low | 162 Ų | 162 | 112.3 Ų | 112.3 | 87% | 0.866 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 134.5 | 177 | -70.8 | -36.9 | 0 | 0 | 0 | 108.6 | P310 G314 | P310-D312 PolarHBondContact O-N 2.91Å; D312-G314 PolarHBondContact O-N 3.16Å |
| 313 | Q | 52.1 | Low | 50.5 | Low | 182 Ų | 182 | 110 Ų | 110 | 85% | 0.85 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 118.8 | 175.8 | -177.5 | 176.9 | 6.5 | 0 | 0 | 107.2 | G311 | G311-Q313 PolarHBondContact O-N 2.97Š|
| 314 | G | 52.1 | Low | 51 | Low | 38 Ų | 38 | 105.9 Ų | 105.9 | 39% | 0.392 | 69% | 0.685 | S | S | . | * | P | Polyproline II helix | trans | -50 | 144.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | D312 | D312-G314 PolarHBondContact O-N 3.16Š|
| 315 | P | 47.1 | Very low | 51.1 | Low | 120 Ų | 120 | 104.2 Ų | 104.2 | 78% | 0.779 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 141.1 | -178.5 | 21.8 | -32.8 | 0 | 0 | 0 | 109.4 | G317 | P315-G317 PolarHBondContact O-N 3.06Å; P315-G317 VanDerWaalsContact O-N 3.12Å |
| 316 | P | 55.1 | Low | 51.2 | Low | 117 Ų | 117 | 101 Ų | 101 | 76% | 0.76 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -47.3 | 126.9 | 175.1 | -25.7 | 33 | 0 | 0 | 0 | 108.7 | D318 | P316-D318 PolarHBondContact O-N 3.46Š|
| 317 | G | 51.2 | Low | 52.2 | Low | 49 Ų | 49 | 99.1 Ų | 99.1 | 51% | 0.505 | 63% | 0.63 | S | S | . | * | P | Polyproline II helix | trans | -51 | 140.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | P315 M319 | P315-G317 PolarHBondContact O-N 3.06Å; P315-G317 VanDerWaalsContact O-N 3.12Å; G317-M319 PolarHBondContact O-N 3.12Å |
| 318 | D | 46.1 | Very low | 52.8 | Low | 163 Ų | 163 | 95.1 Ų | 95.1 | 87% | 0.872 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 136.4 | -177.6 | -71.9 | -38.8 | 0 | 0 | 0 | 110.1 | P316 G320 | P316-D318 PolarHBondContact O-N 3.46Å; D318-G320 PolarHBondContact O-N 2.97Å |
| 319 | M | 53.8 | Low | 52.9 | Low | 142 Ų | 142 | 92.9 Ų | 92.9 | 70% | 0.7 | 59% | 0.594 | S | S | * | * | trans | -56 | 115.6 | 176.9 | 174.7 | 165 | 162.9 | 0 | 0 | 107.9 | G317 S321 | G317-M319 PolarHBondContact O-N 3.12Å; M319-S321 PolarHBondContact O-N 3.27Å | ||
| 320 | G | 52.6 | Low | 53.7 | Low | 38 Ų | 38 | 91.6 Ų | 91.6 | 39% | 0.392 | 59% | 0.585 | S | S | . | * | P | Polyproline II helix | trans | -48.3 | 133.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | D318 A322 | D318-G320 PolarHBondContact O-N 2.97Å; G320-A322 PolarHBondContact O-N 3.37Å |
| 321 | S | 49.9 | Very low | 53.9 | Low | 106 Ų | 106 | 92.5 Ų | 92.5 | 74% | 0.741 | 58% | 0.58 | S | S | * | * | P | Polyproline II helix | trans | -53 | 137.4 | -179.2 | -44.4 | 0 | 0 | 0 | 0 | 109.4 | M319 G323 | M319-S321 PolarHBondContact O-N 3.27Å; S321-G323 PolarHBondContact O-N 2.88Å |
| 322 | A | 58.1 | Low | 54.2 | Low | 93 Ų | 93 | 89.8 Ų | 89.8 | 77% | 0.769 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 129.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | G320 S324 | G320-A322 PolarHBondContact O-N 3.37Å; A322-S324 PolarHBondContact O-N 3.48Å |
| 323 | G | 52.9 | Low | 55.4 | Low | 19 Ų | 19 | 87.2 Ų | 87.2 | 20% | 0.196 | 54% | 0.542 | C | S | . | . | P | Polyproline II helix | trans | -51.9 | 139.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | S321 | S321-G323 PolarHBondContact O-N 2.88Š|
| 324 | S | 54.1 | Low | 56 | Low | 87 Ų | 87 | 85.3 Ų | 85.3 | 61% | 0.608 | 53% | 0.527 | S | S | * | . | P | Polyproline II helix | trans | -57.6 | 138.2 | 177.3 | -61.9 | 0 | 0 | 0 | 0 | 108.8 | A322 G326 | A322-S324 PolarHBondContact O-N 3.48Å; S324-G326 PolarHBondContact O-N 3.19Å |
| 325 | P | 59.1 | Low | 56.3 | Low | 86 Ų | 86 | 83.6 Ų | 83.6 | 56% | 0.558 | 51% | 0.509 | S | S | * | . | P | Polyproline II helix | trans | -58.4 | 137.4 | 177.8 | -19.8 | 29.7 | 0 | 0 | 0 | 110.9 | ||
| 326 | G | 53.7 | Low | 57.1 | Low | 4 Ų | 4 | 82 Ų | 82 | 4% | 0.041 | 50% | 0.499 | C | S | . | . | P | Polyproline II helix | trans | -51.5 | 147.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | K225 S324 | K225-G326 WeakPolarHBondContact CE-O 3.32Å; K225-G326 VanDerWaalsContact CG-O 3.24Å; K225-G326 WeakPolarHBondContact CG-O 3.5Å; S324-G326 PolarHBondContact O-N 3.19Å |
| 327 | I | 60.7 | Low | 57.5 | Low | 133 Ų | 133 | 79.6 Ų | 79.6 | 68% | 0.682 | 49% | 0.485 | S | S | * | . | P | Polyproline II helix | trans | -73.7 | 143.9 | 179.1 | -56.2 | 175.2 | 0 | 0 | 0 | 107.7 | G177 G329 | G177-I327 WeakPolarHBondContact CA-O 3.4Å; I327-G329 PolarHBondContact O-N 3.47Å |
| 328 | I | 64.9 | Low | 57.7 | Low | 113 Ų | 113 | 77.3 Ų | 77.3 | 58% | 0.579 | 46% | 0.462 | S | S | * | . | P | Polyproline II helix | trans | -62.1 | 130.7 | 173.2 | -67.7 | 168.5 | 0 | 0 | 0 | 108.1 | A222 | A222-I328 HydrophobicContact CB-CG2 3.6Š|
| 329 | G | 54.2 | Low | 58.3 | Low | 4 Ų | 4 | 73.6 Ų | 73.6 | 4% | 0.041 | 45% | 0.446 | C | S | . | . | P | Polyproline II helix | trans | -58.5 | 152.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | G177 I327 | G177-G329 VanDerWaalsContact CA-CA 3.4Å; I327-G329 PolarHBondContact O-N 3.47Å |
| 330 | P | 60.8 | Low | 58.4 | Low | 90 Ų | 90 | 70.8 Ų | 70.8 | 58% | 0.584 | 44% | 0.438 | S | S | * | . | P | Polyproline II helix | trans | -56.3 | 151.1 | 177.9 | 25.5 | -33.2 | 0 | 0 | 0 | 110.8 | G332 | P330-G332 PolarHBondContact O-N 2.87Š|
| 331 | Q | 62.1 | Low | 58.5 | Low | 136 Ų | 136 | 70.1 Ų | 70.1 | 64% | 0.636 | 43% | 0.432 | S | S | * | . | B | Isolated β-bridge | trans | -57.4 | 133.3 | 175.4 | -171.7 | 173 | 12 | 0 | 0 | 109.7 | P219 G220 | P219-Q331 HydrophobicContact CB-CG 4.03Å; G220-Q331 VanDerWaalsContact O-CG 3.23Å; G220-Q331 WeakPolarHBondContact O-CG 3.28Å |
| 332 | G | 57.5 | Low | 58.7 | Low | 4 Ų | 4 | 69.6 Ų | 69.6 | 4% | 0.041 | 43% | 0.428 | C | S | . | . | P | Polyproline II helix | trans | -58.6 | 146.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | G174 P219 G220 P330 | G174-G332 VanDerWaalsContact CA-CA 3.47Å; P219-G332 WeakPolarHBondContact CB-O 3.34Å; G220-G332 PolarHBondContact N-O 3.3Å; G220-G332 PolarHBondContact O-N 3.47Å; P330-G332 PolarHBondContact O-N 2.87Å |
| 333 | V | 65.7 | Low | 58.3 | Low | 108 Ų | 108 | 67.1 Ų | 67.1 | 66% | 0.655 | 41% | 0.405 | S | S | * | . | P | Polyproline II helix | trans | -60.4 | 152.6 | 179.3 | -67.3 | 0 | 0 | 0 | 0 | 111.1 | P172 G335 | P172-V333 HydrophobicContact CG-CG2 4.37Å; V333-G335 PolarHBondContact O-N 2.98Å |
| 334 | R | 64.6 | Low | 58.6 | Low | 141 Ų | 141 | 72.2 Ų | 72.2 | 53% | 0.532 | 43% | 0.428 | S | S | . | . | B | Isolated β-bridge | trans | -55.1 | 131.6 | 177.2 | -163.8 | -178.2 | -179.5 | -175.6 | -6 | 110.1 | A216 G217 | A216-R334 HydrophobicContact CB-CG 3.93Å; A216-R334 VanDerWaalsContact CB-CZ 3.4Å; A216-R334 VanDerWaalsContact O-CZ 3.24Å; A216-R334 PolarHBondContact O-NE 2.92Å; A216-R334 PolarHBondContact O-NH2 3.28Å; G217-R334 WeakPolarHBondContact O-CG 3.46Å |
| 335 | G | 58.5 | Low | 58.6 | Low | 2 Ų | 2 | 76.7 Ų | 76.7 | 2% | 0.021 | 44% | 0.438 | C | S | . | . | P | Polyproline II helix | trans | -63.1 | 154.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A216 G217 V333 | A216-G335 VanDerWaalsContact CB-O 3.31Å; A216-G335 WeakPolarHBondContact CB-O 3.35Å; G217-G335 PolarHBondContact N-O 3.49Å; V333-G335 PolarHBondContact O-N 2.98Å |
| 336 | P | 63.6 | Low | 58.2 | Low | 88 Ų | 88 | 75 Ų | 75 | 57% | 0.571 | 43% | 0.429 | S | S | * | . | P | Polyproline II helix | trans | -57.7 | 151.1 | 178.6 | 25.6 | -33.4 | 0 | 0 | 0 | 110.9 | ||
| 337 | S | 63.1 | Low | 58.1 | Low | 65 Ų | 65 | 80.2 Ų | 80.2 | 46% | 0.455 | 46% | 0.462 | S | S | . | . | P | Polyproline II helix | trans | -55.7 | 142.2 | 174 | -82.5 | 0 | 0 | 0 | 0 | 111.8 | G214 | G214-S337 WeakPolarHBondContact O-CA 3.41Å; G214-S337 WeakPolarHBondContact O-CB 3.4Å; G214-S337 PolarHBondContact O-OG 3.36Å; G214-S337 VanDerWaalsContact O-OG 3.05Å |
| 338 | G | 55.2 | Low | 57.6 | Low | 2 Ų | 2 | 79.8 Ų | 79.8 | 2% | 0.021 | 47% | 0.465 | C | S | . | . | B | Isolated β-bridge | trans | -63.6 | 157 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | G168 G214 | G168-G338 VanDerWaalsContact CA-CA 3.47Å; G214-G338 PolarHBondContact N-O 3.17Å; G214-G338 PolarHBondContact O-N 2.98Å |
| 339 | P | 58.4 | Low | 57 | Low | 85 Ų | 85 | 79.9 Ų | 79.9 | 55% | 0.552 | 47% | 0.473 | S | S | * | . | P | Polyproline II helix | trans | -55.6 | 147.2 | 178 | 24.2 | -33 | 0 | 0 | 0 | 110.9 | G341 | P339-G341 PolarHBondContact O-N 2.89Š|
| 340 | P | 57.1 | Low | 57 | Low | 82 Ų | 82 | 87.2 Ų | 87.2 | 53% | 0.532 | 50% | 0.5 | S | S | . | . | P | Polyproline II helix | trans | -53.8 | 135.6 | 176.3 | -23.8 | 32.7 | 0 | 0 | 0 | 111.4 | C211 | C211-P340 HydrophobicContact CB-CB 4.06Š|
| 341 | G | 53.9 | Low | 56.6 | Low | 25 Ų | 25 | 87.6 Ų | 87.6 | 26% | 0.258 | 50% | 0.501 | S | S | . | . | P | Polyproline II helix | trans | -62.9 | 146.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | P339 | P339-G341 PolarHBondContact O-N 2.89Š|
| 342 | S | 53.6 | Low | 55.9 | Low | 94 Ų | 94 | 84.8 Ų | 84.8 | 66% | 0.657 | 50% | 0.501 | S | S | * | . | P | Polyproline II helix | trans | -78.3 | 131.7 | 178.3 | 69.8 | 0 | 0 | 0 | 0 | 111 | D344 | S342-D344 PolarHBondContact O-N 2.88Å; S342-D344 PolarHBondContact OG-OD2 3.33Å |
| 343 | C | 51.1 | Low | 55.4 | Low | 42 Ų | 42 | 91.3 Ų | 91.3 | 28% | 0.284 | 54% | 0.542 | S | S | . | . | trans | -86.6 | 28.2 | -179.8 | -58 | 0 | 0 | 0 | 0 | 113.1 | H345 C346 R350 | C343-H345 PolarHBondContact O-N 3.44Å; C343-C346 HydrophobicContact CB-CB 4.24Å; C343-C346 PolarHBondContact O-N 3.38Å; C343-R350 PolarHBondContact O-NH2 3.41Å | ||
| 344 | D | 59 | Low | 54.6 | Low | 126 Ų | 126 | 89.5 Ų | 89.5 | 67% | 0.674 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -14.8 | -176.2 | -70.7 | -35.8 | 0 | 0 | 0 | 113.6 | S342 | S342-D344 PolarHBondContact O-N 2.88Å; S342-D344 PolarHBondContact OG-OD2 3.33Å |
| 345 | H | 54 | Low | 53.4 | Low | 180 Ų | 180 | 95.8 Ų | 95.8 | 83% | 0.833 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.9 | 6.6 | 176.3 | -59.6 | -59.5 | 0 | 0 | 0 | 114.7 | C343 P347 | C343-H345 PolarHBondContact O-N 3.44Å; H345-P347 VanDerWaalsContact O-CD 3.25Å; H345-P347 WeakPolarHBondContact O-CD 3.47Å |
| 346 | C | 50.1 | Low | 53.1 | Low | 52 Ų | 52 | 100.5 Ų | 100.5 | 35% | 0.351 | 60% | 0.598 | S | S | . | * | trans | -86.4 | 112.6 | 174.2 | -76.9 | 0 | 0 | 0 | 0 | 110.7 | C343 T348 | C343-C346 HydrophobicContact CB-CB 4.24Å; C343-C346 PolarHBondContact O-N 3.38Å; C346-T348 PolarHBondContact O-N 3.39Å | ||
| 347 | P | 51.7 | Low | 52.6 | Low | 113 Ų | 113 | 101.1 Ų | 101.1 | 73% | 0.734 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 136.4 | 172.8 | 25.7 | -32 | 0 | 0 | 0 | 110.2 | H345 | H345-P347 VanDerWaalsContact O-CD 3.25Å; H345-P347 WeakPolarHBondContact O-CD 3.47Å |
| 348 | T | 51 | Low | 52 | Low | 124 Ų | 124 | 103.1 Ų | 103.1 | 76% | 0.761 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -58.3 | 140.4 | 173.6 | 46.9 | 0 | 0 | 0 | 0 | 110.8 | C346 | C346-T348 PolarHBondContact O-N 3.39Š|
| 349 | P | 52.4 | Low | 51.8 | Low | 115 Ų | 115 | 109.1 Ų | 109.1 | 75% | 0.747 | 64% | 0.642 | S | S | * | * | P | Polyproline II helix | cis | -101 | 141 | 16.5 | 11.2 | 9.1 | 0 | 0 | 0 | 113 | T351 | P349-T351 PolarHBondContact O-N 2.95Å; P349-T351 VanDerWaalsContact O-N 3.09Å |
| 350 | R | 52.8 | Low | 51.4 | Low | 157 Ų | 157 | 110.6 Ų | 110.6 | 59% | 0.592 | 65% | 0.648 | S | S | * | * | trans | -87.4 | 52.6 | -178.7 | -61 | -168.3 | -174.8 | 165.6 | 5.2 | 112.3 | C343 | C343-R350 PolarHBondContact O-NH2 3.41Š| ||
| 351 | T | 53.7 | Low | 51 | Low | 99 Ų | 99 | 112.5 Ų | 112.5 | 61% | 0.607 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -132.3 | 124.6 | 173.5 | -29.8 | 0 | 0 | 0 | 0 | 108.7 | P349 | P349-T351 PolarHBondContact O-N 2.95Å; P349-T351 VanDerWaalsContact O-N 3.09Å |
| 352 | A | 47.3 | Very low | 50.8 | Low | 77 Ų | 77 | 118.7 Ų | 118.7 | 64% | 0.636 | 68% | 0.684 | S | S | * | * | trans | -60.6 | 137.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | G354 | A352-G354 PolarHBondContact O-N 3.29Š| ||
| 353 | P | 46.2 | Very low | 50.6 | Low | 141 Ų | 141 | 120.6 Ų | 120.6 | 92% | 0.916 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | 111.4 | 179.6 | 24 | -30.2 | 0 | 0 | 0 | 109.6 | ||
| 354 | G | 48.4 | Very low | 50.6 | Low | 69 Ų | 69 | 127.2 Ų | 127.2 | 71% | 0.711 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 145.5 | -6.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | A352 | A352-G354 PolarHBondContact O-N 3.29Š|
| 355 | Y | 40 | Very low | 49.8 | Very low | 273 Ų | 273 | 127.3 Ų | 127.3 | 100% | 1.071 | 72% | 0.724 | S | S | * | * | trans | -135.2 | 0 | 167.6 | -71.3 | -86.5 | 0 | 0 | 0 | 109.7 |
Retrieved 355 of 355 residues in 372.2 ms
(Link to these results)