| 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 | 78.5 | Confident | 90.5 | Very high | 241 Ų | 241 | 110.5 Ų | 110.5 | 100% | 1.187 | 60% | 0.595 | S | S | * | * | 0 | 132.7 | 0 | -173.8 | 157.3 | 64.6 | 0 | 0 | 107.8 | |||||
| 2 | V | 82.1 | Confident | 90.8 | Very high | 114 Ų | 114 | 103.9 Ų | 103.9 | 69% | 0.691 | 57% | 0.573 | S | S | * | * | trans | -135.9 | 134.8 | -171.4 | -178.4 | 0 | 0 | 0 | 0 | 109.7 | N4 | V2-N4 PolarHBondContact O-N 3Š| ||
| 3 | P | 85.6 | Confident | 91 | Very high | 56 Ų | 56 | 100.7 Ų | 100.7 | 36% | 0.364 | 56% | 0.563 | S | S | . | * | trans | -76.1 | 119.8 | 177.8 | 28.8 | -33 | 0 | 0 | 0 | 111.9 | G8 K9 | P3-G8 VanDerWaalsContact CG-O 3.29Å; P3-G8 WeakPolarHBondContact CG-O 3.4Å; P3-K9 VanDerWaalsContact O-CE 3.31Å; P3-K9 WeakPolarHBondContact O-CE 3.41Å; P3-K9 WeakPolarHBondContact O-CG 3.39Å | ||
| 4 | N | 92.1 | Very high | 91.4 | Very high | 138 Ų | 138 | 99.8 Ų | 99.8 | 74% | 0.738 | 56% | 0.555 | S | S | * | * | trans | -82.4 | -28.4 | 177.1 | -70.1 | -25.6 | 0 | 0 | 0 | 113.1 | V2 K9 | V2-N4 PolarHBondContact O-N 3Å; N4-K9 WeakPolarHBondContact O-CE 3.23Å; N4-K9 PolarHBondContact O-NZ 2.84Å | ||
| 5 | T | 94.6 | Very high | 91.4 | Very high | 95 Ų | 95 | 99.1 Ų | 99.1 | 58% | 0.583 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -71.9 | 149.4 | -178.5 | 61 | 0 | 0 | 0 | 0 | 112.3 | A7 G8 K9 | T5-A7 PolarHBondContact O-N 2.97Å; T5-G8 PolarHBondContact O-N 3.02Å; T5-G8 PolarHBondContact OG1-N 2.9Å; T5-K9 WeakPolarHBondContact O-CG 3.32Å; T5-K9 PolarHBondContact O-N 3.37Å |
| 6 | I | 93.5 | Very high | 91.6 | Very high | 139 Ų | 139 | 97.6 Ų | 97.6 | 71% | 0.713 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -59.9 | -47.7 | -179.7 | -60.1 | 173.8 | 0 | 0 | 0 | 110.7 | G8 K9 I10 | I6-G8 PolarHBondContact O-N 3.27Å; I6-K9 PolarHBondContact O-N 3.2Å; I6-I10 HydrophobicContact CG2-CD1 4.31Å; I6-I10 WeakPolarHBondContact O-CG1 3.32Å; I6-I10 PolarHBondContact O-N 3.03Å; I6-I10 VanDerWaalsContact O-N 3.17Å |
| 7 | A | 92.5 | Very high | 91.7 | Very high | 54 Ų | 54 | 98.6 Ų | 98.6 | 45% | 0.446 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59.3 | -43.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | T5 K9 I10 F11 | T5-A7 PolarHBondContact O-N 2.97Å; A7-K9 VanDerWaalsContact C-N 3.29Å; A7-K9 PolarHBondContact O-N 2.89Å; A7-I10 PolarHBondContact O-N 2.82Å; A7-I10 VanDerWaalsContact O-N 3.13Å; A7-F11 WeakPolarHBondContact O-CD2 3.43Å; A7-F11 PolarHBondContact O-N 3.08Å |
| 8 | G | 93 | Very high | 91.7 | Very high | 18 Ų | 18 | 96.7 Ų | 96.7 | 19% | 0.186 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -63.5 | -32.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | P3 T5 I6 G12 | P3-G8 VanDerWaalsContact CG-O 3.29Å; P3-G8 WeakPolarHBondContact CG-O 3.4Å; T5-G8 PolarHBondContact O-N 3.02Å; T5-G8 PolarHBondContact OG1-N 2.9Å; I6-G8 PolarHBondContact O-N 3.27Å; G8-G12 WeakPolarHBondContact O-CA 3.46Å; G8-G12 PolarHBondContact O-N 3.39Å |
| 9 | K | 94 | Very high | 91.8 | Very high | 119 Ų | 119 | 93.3 Ų | 93.3 | 52% | 0.517 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69 | -35.6 | 173.1 | -70.6 | 171.7 | -179.2 | 172.2 | 0 | 112.4 | P3 N4 T5 I6 A7 S13 | P3-K9 VanDerWaalsContact O-CE 3.31Å; P3-K9 WeakPolarHBondContact O-CE 3.41Å; P3-K9 WeakPolarHBondContact O-CG 3.39Å; N4-K9 WeakPolarHBondContact O-CE 3.23Å; N4-K9 PolarHBondContact O-NZ 2.84Å; T5-K9 WeakPolarHBondContact O-CG 3.32Å; T5-K9 PolarHBondContact O-N 3.37Å; I6-K9 PolarHBondContact O-N 3.2Å; A7-K9 VanDerWaalsContact C-N 3.29Å; A7-K9 PolarHBondContact O-N 2.89Å; K9-S13 PolarHBondContact O-N 2.83Å; K9-S13 PolarHBondContact O-OG 3.27Å |
| 10 | I | 95.6 | Very high | 91.8 | Very high | 91 Ų | 91 | 93.3 Ų | 93.3 | 47% | 0.467 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.8 | -51.3 | 175.7 | -64.4 | 164.5 | 0 | 0 | 0 | 110.7 | I6 A7 G12 S13 I14 | I6-I10 HydrophobicContact CG2-CD1 4.31Å; I6-I10 WeakPolarHBondContact O-CG1 3.32Å; I6-I10 PolarHBondContact O-N 3.03Å; I6-I10 VanDerWaalsContact O-N 3.17Å; A7-I10 PolarHBondContact O-N 2.82Å; A7-I10 VanDerWaalsContact O-N 3.13Å; I10-G12 VanDerWaalsContact C-N 3.26Å; I10-G12 PolarHBondContact O-N 3.03Å; I10-S13 PolarHBondContact O-N 2.67Å; I10-S13 PolarHBondContact O-OG 2.82Å; I10-I14 HydrophobicContact CG2-CD1 3.96Å; I10-I14 WeakPolarHBondContact O-CG1 3.47Å; I10-I14 PolarHBondContact O-N 2.95Å; I10-I14 VanDerWaalsContact O-N 3.1Å |
| 11 | F | 94.1 | Very high | 91.6 | Very high | 150 Ų | 150 | 94 Ų | 94 | 66% | 0.658 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64 | -34.1 | 175.9 | -69.1 | -65.7 | 0 | 0 | 0 | 112.1 | A7 C15 | A7-F11 WeakPolarHBondContact O-CD2 3.43Å; A7-F11 PolarHBondContact O-N 3.08Å; F11-C15 WeakPolarHBondContact O-CB 3.34Å; F11-C15 PolarHBondContact O-N 3.41Å |
| 12 | G | 94.3 | Very high | 92.1 | Very high | 32 Ų | 32 | 87.8 Ų | 87.8 | 33% | 0.33 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.9 | -41.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | G8 I10 S16 | G8-G12 WeakPolarHBondContact O-CA 3.46Å; G8-G12 PolarHBondContact O-N 3.39Å; I10-G12 VanDerWaalsContact C-N 3.26Å; I10-G12 PolarHBondContact O-N 3.03Å; G12-S16 VanDerWaalsContact O-CB 3.3Å; G12-S16 WeakPolarHBondContact O-CB 3.3Å; G12-S16 PolarHBondContact O-N 3.3Å |
| 13 | S | 93.6 | Very high | 92.4 | Very high | 62 Ų | 62 | 88.8 Ų | 88.8 | 43% | 0.434 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -70.1 | -42.3 | 177.3 | 68.2 | 0 | 0 | 0 | 0 | 111.8 | K9 I10 S16 L17 | K9-S13 PolarHBondContact O-N 2.83Å; K9-S13 PolarHBondContact O-OG 3.27Å; I10-S13 PolarHBondContact O-N 2.67Å; I10-S13 PolarHBondContact O-OG 2.82Å; S13-S16 PolarHBondContact O-N 3.44Å; S13-L17 WeakPolarHBondContact O-CB 3.34Å; S13-L17 VanDerWaalsContact O-CG 3.29Å; S13-L17 WeakPolarHBondContact O-CG 3.39Å; S13-L17 PolarHBondContact O-N 3.37Å |
| 14 | I | 95.6 | Very high | 92.3 | Very high | 88 Ų | 88 | 88.7 Ų | 88.7 | 45% | 0.451 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -58.9 | -49.9 | 174.3 | -64.4 | 165.4 | 0 | 0 | 0 | 110.1 | I10 S16 L17 S18 | I10-I14 HydrophobicContact CG2-CD1 3.96Å; I10-I14 WeakPolarHBondContact O-CG1 3.47Å; I10-I14 PolarHBondContact O-N 2.95Å; I10-I14 VanDerWaalsContact O-N 3.1Å; I14-S16 PolarHBondContact O-N 3.05Å; I14-L17 PolarHBondContact O-N 2.92Å; I14-S18 PolarHBondContact O-N 2.95Å; I14-S18 PolarHBondContact O-OG 3.42Å; I14-S18 VanDerWaalsContact O-OG 3.08Å |
| 15 | C | 92.1 | Very high | 91.3 | Very high | 90 Ų | 90 | 87 Ų | 87 | 61% | 0.608 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.4 | -43.1 | 177.9 | -175.5 | 0 | 0 | 0 | 0 | 112.6 | F11 S18 G19 | F11-C15 WeakPolarHBondContact O-CB 3.34Å; F11-C15 PolarHBondContact O-N 3.41Å; C15-S18 PolarHBondContact O-N 3.32Å; C15-G19 PolarHBondContact O-N 3.48Å |
| 16 | S | 94.2 | Very high | 90.4 | Very high | 75 Ų | 75 | 85.4 Ų | 85.4 | 52% | 0.524 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.9 | -48.4 | 176.6 | -173.8 | 0 | 0 | 0 | 0 | 111.9 | G12 S13 I14 S18 G19 V20 | G12-S16 VanDerWaalsContact O-CB 3.3Å; G12-S16 WeakPolarHBondContact O-CB 3.3Å; G12-S16 PolarHBondContact O-N 3.3Å; S13-S16 PolarHBondContact O-N 3.44Å; I14-S16 PolarHBondContact O-N 3.05Å; S16-S18 PolarHBondContact O-N 2.95Å; S16-G19 PolarHBondContact O-N 2.92Å; S16-V20 WeakPolarHBondContact O-CG2 3.49Å; S16-V20 PolarHBondContact O-N 2.99Å |
| 17 | L | 93.1 | Very high | 89 | Confident | 115 Ų | 115 | 83.5 Ų | 83.5 | 60% | 0.602 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.5 | -44.5 | 176.9 | -69.5 | 168.2 | 0 | 0 | 0 | 111.7 | S13 I14 V20 L21 | S13-L17 WeakPolarHBondContact O-CB 3.34Å; S13-L17 VanDerWaalsContact O-CG 3.29Å; S13-L17 WeakPolarHBondContact O-CG 3.39Å; S13-L17 PolarHBondContact O-N 3.37Å; I14-L17 PolarHBondContact O-N 2.92Å; L17-V20 PolarHBondContact O-N 3.1Å; L17-L21 WeakPolarHBondContact O-CB 3.21Å; L17-L21 VanDerWaalsContact O-CG 3.29Å; L17-L21 WeakPolarHBondContact O-CG 3.38Å; L17-L21 PolarHBondContact O-N 2.93Å |
| 18 | S | 92.8 | Very high | 87.6 | Confident | 63 Ų | 63 | 84.3 Ų | 84.3 | 44% | 0.441 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 175.1 | -61.2 | 0 | 0 | 0 | 0 | 112.2 | I14 C15 S16 L21 V22 | I14-S18 PolarHBondContact O-N 2.95Å; I14-S18 PolarHBondContact O-OG 3.42Å; I14-S18 VanDerWaalsContact O-OG 3.08Å; C15-S18 PolarHBondContact O-N 3.32Å; S16-S18 PolarHBondContact O-N 2.95Å; S18-L21 PolarHBondContact O-N 3.38Å; S18-V22 VanDerWaalsContact O-CG2 3.31Å; S18-V22 WeakPolarHBondContact O-CG2 3.39Å; S18-V22 PolarHBondContact O-N 3.2Å |
| 19 | G | 93 | Very high | 86 | Confident | 33 Ų | 33 | 88 Ų | 88 | 34% | 0.34 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63 | -44 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | C15 S16 V22 I23 | C15-G19 PolarHBondContact O-N 3.48Å; S16-G19 PolarHBondContact O-N 2.92Å; G19-V22 PolarHBondContact O-N 2.78Å; G19-I23 WeakPolarHBondContact O-CG1 3.45Å; G19-I23 PolarHBondContact O-N 3.47Å |
| 20 | V | 92.8 | Very high | 84.6 | Confident | 92 Ų | 92 | 86.8 Ų | 86.8 | 56% | 0.558 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.6 | -43.7 | 175.8 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | S16 L17 I23 A24 | S16-V20 WeakPolarHBondContact O-CG2 3.49Å; S16-V20 PolarHBondContact O-N 2.99Å; L17-V20 PolarHBondContact O-N 3.1Å; V20-I23 PolarHBondContact O-N 3.02Å; V20-A24 WeakPolarHBondContact O-CB 3.43Å; V20-A24 PolarHBondContact O-N 3.36Å |
| 21 | L | 86.6 | Confident | 83 | Confident | 108 Ų | 108 | 86.8 Ų | 86.8 | 57% | 0.565 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.8 | -41.5 | 177.1 | -70.6 | 170.1 | 0 | 0 | 0 | 112.4 | L17 S18 I23 A24 L25 | L17-L21 WeakPolarHBondContact O-CB 3.21Å; L17-L21 VanDerWaalsContact O-CG 3.29Å; L17-L21 WeakPolarHBondContact O-CG 3.38Å; L17-L21 PolarHBondContact O-N 2.93Å; S18-L21 PolarHBondContact O-N 3.38Å; L21-I23 VanDerWaalsContact C-N 3.31Å; L21-I23 PolarHBondContact O-N 3.15Å; L21-A24 PolarHBondContact O-N 2.77Å; L21-L25 VanDerWaalsContact O-CG 3.27Å; L21-L25 WeakPolarHBondContact O-CG 3.22Å; L21-L25 PolarHBondContact O-N 2.89Å; L21-L25 VanDerWaalsContact O-N 3.14Å |
| 22 | V | 89.3 | Confident | 81.4 | Confident | 111 Ų | 111 | 82.8 Ų | 82.8 | 67% | 0.673 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.9 | -37.4 | 175.9 | 167.1 | 0 | 0 | 0 | 0 | 112 | S18 G19 P26 | S18-V22 VanDerWaalsContact O-CG2 3.31Å; S18-V22 WeakPolarHBondContact O-CG2 3.39Å; S18-V22 PolarHBondContact O-N 3.2Å; G19-V22 PolarHBondContact O-N 2.78Å; V22-P26 WeakPolarHBondContact O-CD 3.27Å |
| 23 | I | 88.8 | Confident | 80 | Confident | 135 Ų | 135 | 85.6 Ų | 85.6 | 69% | 0.692 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -83.4 | -24.3 | 179 | -65.3 | 171.7 | 0 | 0 | 0 | 112.3 | G19 V20 L21 P26 | G19-I23 WeakPolarHBondContact O-CG1 3.45Å; G19-I23 PolarHBondContact O-N 3.47Å; V20-I23 PolarHBondContact O-N 3.02Å; L21-I23 VanDerWaalsContact C-N 3.31Å; L21-I23 PolarHBondContact O-N 3.15Å; I23-P26 VanDerWaalsContact O-CD 3.23Å; I23-P26 WeakPolarHBondContact O-CD 3.28Å |
| 24 | A | 81.9 | Confident | 78.4 | Confident | 54 Ų | 54 | 89 Ų | 89 | 45% | 0.446 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -81 | -26.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | V20 L21 P28 | V20-A24 WeakPolarHBondContact O-CB 3.43Å; V20-A24 PolarHBondContact O-N 3.36Å; L21-A24 PolarHBondContact O-N 2.77Å; A24-P28 WeakPolarHBondContact O-CD 3.48Å; A24-P28 VanDerWaalsContact O-CG 3.28Å; A24-P28 WeakPolarHBondContact O-CG 3.31Å |
| 25 | L | 71.5 | Confident | 76.7 | Confident | 103 Ų | 103 | 88 Ų | 88 | 54% | 0.539 | 53% | 0.527 | S | S | . | . | S | Bend | trans | -80.5 | -23.8 | -176.2 | -71.8 | 170.6 | 0 | 0 | 0 | 118.6 | L21 P28 V29 | L21-L25 VanDerWaalsContact O-CG 3.27Å; L21-L25 WeakPolarHBondContact O-CG 3.22Å; L21-L25 PolarHBondContact O-N 2.89Å; L21-L25 VanDerWaalsContact O-N 3.14Å; L25-P28 WeakPolarHBondContact O-CD 3.45Å; L25-V29 WeakPolarHBondContact O-CB 3.44Å; L25-V29 WeakPolarHBondContact O-CG2 3.45Å; L25-V29 PolarHBondContact O-N 3.17Å |
| 26 | P | 76.3 | Confident | 75.3 | Confident | 62 Ų | 62 | 92.3 Ų | 92.3 | 40% | 0.403 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -68.3 | -41.5 | -176.6 | 26.1 | -32.4 | 0 | 0 | 0 | 112.1 | V22 I23 V29 I30 | V22-P26 WeakPolarHBondContact O-CD 3.27Å; I23-P26 VanDerWaalsContact O-CD 3.23Å; I23-P26 WeakPolarHBondContact O-CD 3.28Å; P26-V29 PolarHBondContact O-N 2.95Å; P26-I30 WeakPolarHBondContact O-CB 3.47Å; P26-I30 WeakPolarHBondContact O-CD1 3.5Å; P26-I30 WeakPolarHBondContact O-CG1 3.48Å; P26-I30 PolarHBondContact O-N 3.22Å |
| 27 | V | 64.8 | Low | 73.7 | Confident | 98 Ų | 98 | 92.1 Ų | 92.1 | 59% | 0.594 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.6 | -48.2 | -177.9 | -174 | 0 | 0 | 0 | 0 | 112 | V29 I30 V31 | V27-V29 PolarHBondContact O-N 2.86Å; V27-I30 PolarHBondContact O-N 3.37Å; V27-V31 HydrophobicContact CG1-CG2 4.3Å; V27-V31 WeakPolarHBondContact O-CG2 3.29Å; V27-V31 PolarHBondContact O-N 3.26Å |
| 28 | P | 61.7 | Low | 72.2 | Confident | 72 Ų | 72 | 94.9 Ų | 94.9 | 47% | 0.468 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63 | -37.4 | 175.6 | -24.3 | 35.7 | 0 | 0 | 0 | 113.7 | A24 L25 S32 | A24-P28 WeakPolarHBondContact O-CD 3.48Å; A24-P28 VanDerWaalsContact O-CG 3.28Å; A24-P28 WeakPolarHBondContact O-CG 3.31Å; L25-P28 WeakPolarHBondContact O-CD 3.45Å; P28-S32 WeakPolarHBondContact O-CB 3.31Å; P28-S32 PolarHBondContact O-N 3.29Å |
| 29 | V | 61.2 | Low | 70.7 | Confident | 95 Ų | 95 | 97.7 Ų | 97.7 | 58% | 0.576 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.3 | -44 | 176.8 | 168.8 | 0 | 0 | 0 | 0 | 110.7 | L25 P26 V27 N33 | L25-V29 WeakPolarHBondContact O-CB 3.44Å; L25-V29 WeakPolarHBondContact O-CG2 3.45Å; L25-V29 PolarHBondContact O-N 3.17Å; P26-V29 PolarHBondContact O-N 2.95Å; V27-V29 PolarHBondContact O-N 2.86Å; V29-N33 VanDerWaalsContact O-CB 3.3Å; V29-N33 WeakPolarHBondContact O-CB 3.32Å; V29-N33 PolarHBondContact O-N 3.44Å; V29-N33 VanDerWaalsContact O-N 3.12Å |
| 30 | I | 63.4 | Low | 69.2 | Low | 93 Ų | 93 | 102.7 Ų | 102.7 | 48% | 0.477 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.3 | -48.5 | 177.2 | -70.3 | 166.5 | 0 | 0 | 0 | 111.1 | P26 V27 N33 F34 | P26-I30 WeakPolarHBondContact O-CB 3.47Å; P26-I30 WeakPolarHBondContact O-CD1 3.5Å; P26-I30 WeakPolarHBondContact O-CG1 3.48Å; P26-I30 PolarHBondContact O-N 3.22Å; V27-I30 PolarHBondContact O-N 3.37Å; I30-N33 WeakPolarHBondContact O-CB 3.28Å; I30-N33 PolarHBondContact O-N 3.48Å; I30-F34 HydrophobicContact CG2-CD2 3.85Å; I30-F34 HydrophobicContact CG2-CE2 3.41Å; I30-F34 VanDerWaalsContact CG2-CE2 3.41Å; I30-F34 HydrophobicContact CG2-CZ 4.36Å; I30-F34 VanDerWaalsContact O-CD2 3.25Å; I30-F34 WeakPolarHBondContact O-CD2 3.36Å; I30-F34 PolarHBondContact O-N 2.93Å; I30-F34 VanDerWaalsContact O-N 3.13Å |
| 31 | V | 62.5 | Low | 67.6 | Low | 92 Ų | 92 | 102.1 Ų | 102.1 | 56% | 0.558 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.1 | -40.6 | -178.4 | 173.9 | 0 | 0 | 0 | 0 | 112.3 | V27 N33 F34 S35 | V27-V31 HydrophobicContact CG1-CG2 4.3Å; V27-V31 WeakPolarHBondContact O-CG2 3.29Å; V27-V31 PolarHBondContact O-N 3.26Å; V31-N33 VanDerWaalsContact C-N 3.28Å; V31-N33 PolarHBondContact O-N 3.21Å; V31-F34 PolarHBondContact O-N 3.34Å; V31-S35 PolarHBondContact O-N 3.09Å; V31-S35 VanDerWaalsContact O-N 3.09Å |
| 32 | S | 60 | Low | 66.4 | Low | 65 Ų | 65 | 102.1 Ų | 102.1 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.7 | -33.1 | 176.4 | -167.5 | 0 | 0 | 0 | 0 | 112.2 | P28 | P28-S32 WeakPolarHBondContact O-CB 3.31Å; P28-S32 PolarHBondContact O-N 3.29Å |
| 33 | N | 64.3 | Low | 64.9 | Low | 91 Ų | 91 | 106.4 Ų | 106.4 | 49% | 0.487 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.9 | -50.2 | 174.1 | -165.8 | -69.9 | 0 | 0 | 0 | 111.3 | V29 I30 V31 S35 R36 I37 | V29-N33 VanDerWaalsContact O-CB 3.3Å; V29-N33 WeakPolarHBondContact O-CB 3.32Å; V29-N33 PolarHBondContact O-N 3.44Å; V29-N33 VanDerWaalsContact O-N 3.12Å; I30-N33 WeakPolarHBondContact O-CB 3.28Å; I30-N33 PolarHBondContact O-N 3.48Å; V31-N33 VanDerWaalsContact C-N 3.28Å; V31-N33 PolarHBondContact O-N 3.21Å; N33-S35 VanDerWaalsContact C-N 3.31Å; N33-S35 PolarHBondContact O-N 3.07Å; N33-R36 PolarHBondContact O-N 3.1Å; N33-I37 PolarHBondContact O-N 3.39Å; N33-I37 VanDerWaalsContact O-N 3.15Å; N33-I37 WeakPolarHBondContact OD1-CD1 3.4Å |
| 34 | F | 61.5 | Low | 63.5 | Low | 133 Ų | 133 | 101.6 Ų | 101.6 | 58% | 0.583 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -58.9 | -38.1 | 177.9 | -72.9 | -51.1 | 0 | 0 | 0 | 113.4 | I30 V31 R36 I37 Y38 | I30-F34 HydrophobicContact CG2-CD2 3.85Å; I30-F34 HydrophobicContact CG2-CE2 3.41Å; I30-F34 VanDerWaalsContact CG2-CE2 3.41Å; I30-F34 HydrophobicContact CG2-CZ 4.36Å; I30-F34 VanDerWaalsContact O-CD2 3.25Å; I30-F34 WeakPolarHBondContact O-CD2 3.36Å; I30-F34 PolarHBondContact O-N 2.93Å; I30-F34 VanDerWaalsContact O-N 3.13Å; V31-F34 PolarHBondContact O-N 3.34Å; F34-R36 VanDerWaalsContact C-N 3.34Å; F34-R36 PolarHBondContact O-N 3.39Å; F34-I37 PolarHBondContact O-N 3.06Å; F34-Y38 WeakPolarHBondContact O-CB 3.34Å; F34-Y38 PolarHBondContact O-N 2.84Å |
| 35 | S | 60.2 | Low | 62.5 | Low | 69 Ų | 69 | 102.9 Ų | 102.9 | 48% | 0.483 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -56.1 | -44.6 | 176.1 | 178 | 0 | 0 | 0 | 0 | 112.7 | V31 N33 H39 | V31-S35 PolarHBondContact O-N 3.09Å; V31-S35 VanDerWaalsContact O-N 3.09Å; N33-S35 VanDerWaalsContact C-N 3.31Å; N33-S35 PolarHBondContact O-N 3.07Å; S35-H39 PolarHBondContact O-N 3.14Å |
| 36 | R | 60.7 | Low | 62.1 | Low | 179 Ų | 179 | 104.8 Ų | 104.8 | 68% | 0.675 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -68.2 | -43.7 | 177 | -62.4 | -175.4 | -168.9 | -129.6 | 2 | 111.8 | N33 F34 Y38 Q40 | N33-R36 PolarHBondContact O-N 3.1Å; F34-R36 VanDerWaalsContact C-N 3.34Å; F34-R36 PolarHBondContact O-N 3.39Å; R36-Y38 VanDerWaalsContact C-N 3.34Å; R36-Y38 PolarHBondContact O-N 2.92Å; R36-Q40 WeakPolarHBondContact O-CB 3.44Å; R36-Q40 WeakPolarHBondContact O-CG 3.45Å; R36-Q40 PolarHBondContact O-N 3.47Å |
| 37 | I | 61.5 | Low | 61.5 | Low | 71 Ų | 71 | 107.9 Ų | 107.9 | 36% | 0.364 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 180 | -70.2 | -179.5 | 0 | 0 | 0 | 111.3 | N33 F34 Q40 N41 | N33-I37 PolarHBondContact O-N 3.39Å; N33-I37 VanDerWaalsContact O-N 3.15Å; N33-I37 WeakPolarHBondContact OD1-CD1 3.4Å; F34-I37 PolarHBondContact O-N 3.06Å; I37-Q40 PolarHBondContact O-N 3.36Å; I37-N41 WeakPolarHBondContact CG2-ND2 3.39Å; I37-N41 WeakPolarHBondContact O-CB 3.22Å; I37-N41 PolarHBondContact O-N 3.4Å; I37-N41 PolarHBondContact O-ND2 3.25Å |
| 38 | Y | 61.9 | Low | 61.4 | Low | 173 Ų | 173 | 109.5 Ų | 109.5 | 68% | 0.678 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.9 | -47.9 | -178.9 | -156.2 | -92.2 | 0 | 0 | 0 | 111.8 | F34 R36 Q42 | F34-Y38 WeakPolarHBondContact O-CB 3.34Å; F34-Y38 PolarHBondContact O-N 2.84Å; R36-Y38 VanDerWaalsContact C-N 3.34Å; R36-Y38 PolarHBondContact O-N 2.92Å; Y38-Q42 PolarHBondContact O-N 2.99Å; Y38-Q42 VanDerWaalsContact O-N 3.12Å |
| 39 | H | 61.9 | Low | 61.5 | Low | 123 Ų | 123 | 108.7 Ų | 108.7 | 57% | 0.569 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -68 | -33 | 176.2 | -81.6 | -68.8 | 0 | 0 | 0 | 113.7 | S35 R43 | S35-H39 PolarHBondContact O-N 3.14Å; H39-R43 PolarHBondContact O-N 3.33Å |
| 40 | Q | 60 | Low | 61.6 | Low | 137 Ų | 137 | 110.6 Ų | 110.6 | 64% | 0.64 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -70.8 | -44.8 | 176 | -76.6 | -177 | -21 | 0 | 0 | 112.3 | R36 I37 Q42 R43 A44 | R36-Q40 WeakPolarHBondContact O-CB 3.44Å; R36-Q40 WeakPolarHBondContact O-CG 3.45Å; R36-Q40 PolarHBondContact O-N 3.47Å; I37-Q40 PolarHBondContact O-N 3.36Å; Q40-Q42 VanDerWaalsContact C-N 3.34Å; Q40-Q42 PolarHBondContact O-N 2.93Å; Q40-R43 PolarHBondContact O-N 3.22Å; Q40-A44 PolarHBondContact O-N 3.19Å |
| 41 | N | 60.2 | Low | 62.1 | Low | 80 Ų | 80 | 112.7 Ų | 112.7 | 43% | 0.428 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.4 | -41.9 | 176.2 | -78.3 | -28.9 | 0 | 0 | 0 | 111.7 | I37 R43 A44 D45 | I37-N41 WeakPolarHBondContact CG2-ND2 3.39Å; I37-N41 WeakPolarHBondContact O-CB 3.22Å; I37-N41 PolarHBondContact O-N 3.4Å; I37-N41 PolarHBondContact O-ND2 3.25Å; N41-R43 VanDerWaalsContact C-N 3.26Å; N41-R43 PolarHBondContact O-N 3.26Å; N41-A44 WeakPolarHBondContact O-CB 3.25Å; N41-A44 PolarHBondContact O-N 3.12Å; N41-D45 PolarHBondContact O-N 3.23Å |
| 42 | Q | 60.6 | Low | 62.7 | Low | 108 Ų | 108 | 115.8 Ų | 115.8 | 51% | 0.505 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.3 | -31.7 | 177.5 | -163.5 | -174.1 | 76.6 | 0 | 0 | 113.2 | Y38 Q40 | Y38-Q42 PolarHBondContact O-N 2.99Å; Y38-Q42 VanDerWaalsContact O-N 3.12Å; Q40-Q42 VanDerWaalsContact C-N 3.34Å; Q40-Q42 PolarHBondContact O-N 2.93Å |
| 43 | R | 58.6 | Low | 63.4 | Low | 201 Ų | 201 | 116.8 Ų | 116.8 | 76% | 0.758 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -74.5 | -43.2 | 169.1 | -74.5 | -169.5 | 175.9 | -135.7 | 1.1 | 111.9 | H39 Q40 N41 D45 K46 M47 | H39-R43 PolarHBondContact O-N 3.33Å; Q40-R43 PolarHBondContact O-N 3.22Å; N41-R43 VanDerWaalsContact C-N 3.26Å; N41-R43 PolarHBondContact O-N 3.26Å; R43-D45 VanDerWaalsContact C-N 3.33Å; R43-D45 PolarHBondContact O-N 3.07Å; R43-K46 PolarHBondContact O-N 3.13Å; R43-M47 VanDerWaalsContact O-CG 3.28Å; R43-M47 WeakPolarHBondContact O-CG 3.2Å; R43-M47 PolarHBondContact O-N 2.91Å; R43-M47 VanDerWaalsContact O-N 3.08Å |
| 44 | A | 59.1 | Low | 63.9 | Low | 34 Ų | 34 | 121.7 Ų | 121.7 | 28% | 0.281 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.1 | -41.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q40 N41 M47 R48 | Q40-A44 PolarHBondContact O-N 3.19Å; N41-A44 WeakPolarHBondContact O-CB 3.25Å; N41-A44 PolarHBondContact O-N 3.12Å; A44-M47 PolarHBondContact O-N 3.02Å; A44-R48 WeakPolarHBondContact O-CB 3.35Å; A44-R48 WeakPolarHBondContact O-CD 3.24Å; A44-R48 VanDerWaalsContact O-CG 3.24Å; A44-R48 WeakPolarHBondContact O-CG 3.47Å; A44-R48 PolarHBondContact O-N 2.85Å |
| 45 | D | 60.9 | Low | 64.8 | Low | 81 Ų | 81 | 119.1 Ų | 119.1 | 43% | 0.433 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -76.4 | -34.1 | -176.8 | -68.1 | -36.2 | 0 | 0 | 0 | 113.2 | N41 R43 M47 R48 A49 | N41-D45 PolarHBondContact O-N 3.23Å; R43-D45 VanDerWaalsContact C-N 3.33Å; R43-D45 PolarHBondContact O-N 3.07Å; D45-M47 VanDerWaalsContact C-N 3.33Å; D45-M47 PolarHBondContact O-N 3.31Å; D45-R48 PolarHBondContact O-N 3.27Å; D45-R48 WeakPolarHBondContact OD1-CD 3.27Å; D45-R48 IonicContact OD1-CZ 3.1Å; D45-R48 IonicContact OD1-NE 3.39Å; D45-R48 IonicContact OD1-NH1 3.98Å; D45-R48 PolarHBondContact OD1-NH1 3.43Å; D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 3.43Å |
| 46 | K | 62.6 | Low | 65.7 | Low | 144 Ų | 144 | 118.1 Ų | 118.1 | 63% | 0.626 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -59.3 | -43.6 | 166.6 | -78.1 | -176.1 | 174.5 | -179.8 | 0 | 111.5 | R43 A49 Q50 | R43-K46 PolarHBondContact O-N 3.13Å; K46-A49 PolarHBondContact O-N 3.11Å; K46-Q50 WeakPolarHBondContact O-CG 3.28Å; K46-Q50 PolarHBondContact O-N 3.05Å; K46-Q50 VanDerWaalsContact O-N 3.15Å |
| 47 | M | 63.7 | Low | 66.5 | Low | 126 Ų | 126 | 118.8 Ų | 118.8 | 62% | 0.621 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -67.1 | -41.9 | 177 | -66 | -67.4 | -86.6 | 0 | 0 | 112.1 | R43 A44 D45 A49 Q50 Q51 | R43-M47 VanDerWaalsContact O-CG 3.28Å; R43-M47 WeakPolarHBondContact O-CG 3.2Å; R43-M47 PolarHBondContact O-N 2.91Å; R43-M47 VanDerWaalsContact O-N 3.08Å; A44-M47 PolarHBondContact O-N 3.02Å; D45-M47 VanDerWaalsContact C-N 3.33Å; D45-M47 PolarHBondContact O-N 3.31Å; M47-A49 VanDerWaalsContact C-N 3.34Å; M47-A49 PolarHBondContact O-N 3.12Å; M47-Q50 PolarHBondContact O-N 3.09Å; M47-Q51 VanDerWaalsContact O-CB 3.25Å; M47-Q51 WeakPolarHBondContact O-CB 3.45Å; M47-Q51 PolarHBondContact O-N 3.49Å |
| 48 | R | 62.3 | Low | 67.3 | Low | 133 Ų | 133 | 120 Ų | 120 | 50% | 0.502 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -61.2 | -39.6 | 175.5 | -75.1 | 160.6 | 171 | 170.2 | -1.5 | 112.2 | A44 D45 K52 | A44-R48 WeakPolarHBondContact O-CB 3.35Å; A44-R48 WeakPolarHBondContact O-CD 3.24Å; A44-R48 VanDerWaalsContact O-CG 3.24Å; A44-R48 WeakPolarHBondContact O-CG 3.47Å; A44-R48 PolarHBondContact O-N 2.85Å; D45-R48 PolarHBondContact O-N 3.27Å; D45-R48 WeakPolarHBondContact OD1-CD 3.27Å; D45-R48 IonicContact OD1-CZ 3.1Å; D45-R48 IonicContact OD1-NE 3.39Å; D45-R48 IonicContact OD1-NH1 3.98Å; D45-R48 PolarHBondContact OD1-NH1 3.43Å; R48-K52 VanDerWaalsContact O-CG 3.27Å; R48-K52 WeakPolarHBondContact O-CG 3.38Å; R48-K52 PolarHBondContact O-N 2.84Å |
| 49 | A | 64.2 | Low | 68 | Low | 54 Ų | 54 | 119.5 Ų | 119.5 | 45% | 0.446 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.1 | -50.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | D45 K46 M47 Q51 K52 V53 | D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 3.43Å; K46-A49 PolarHBondContact O-N 3.11Å; M47-A49 VanDerWaalsContact C-N 3.34Å; M47-A49 PolarHBondContact O-N 3.12Å; A49-Q51 PolarHBondContact O-N 2.87Å; A49-K52 PolarHBondContact O-N 3.15Å; A49-V53 PolarHBondContact O-N 2.79Å; A49-V53 VanDerWaalsContact O-N 3.15Å |
| 50 | Q | 64.3 | Low | 68.3 | Low | 135 Ų | 135 | 120.3 Ų | 120.3 | 63% | 0.631 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -63.7 | -38.4 | 178.1 | -69.1 | -177.8 | -3.6 | 0 | 0 | 112.6 | K46 M47 V53 R54 | K46-Q50 WeakPolarHBondContact O-CG 3.28Å; K46-Q50 PolarHBondContact O-N 3.05Å; K46-Q50 VanDerWaalsContact O-N 3.15Å; M47-Q50 PolarHBondContact O-N 3.09Å; Q50-V53 PolarHBondContact O-N 3.17Å; Q50-R54 WeakPolarHBondContact O-CB 3.45Å; Q50-R54 PolarHBondContact O-N 2.98Å |
| 51 | Q | 73.3 | Confident | 69 | Low | 138 Ų | 138 | 117.1 Ų | 117.1 | 65% | 0.645 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.3 | -38.7 | 177 | -168.8 | 178.3 | 15.2 | 0 | 0 | 111.9 | M47 A49 R54 L55 | M47-Q51 VanDerWaalsContact O-CB 3.25Å; M47-Q51 WeakPolarHBondContact O-CB 3.45Å; M47-Q51 PolarHBondContact O-N 3.49Å; A49-Q51 PolarHBondContact O-N 2.87Å; Q51-R54 PolarHBondContact O-N 3.5Å; Q51-L55 VanDerWaalsContact O-CB 3.22Å; Q51-L55 WeakPolarHBondContact O-CB 3.47Å; Q51-L55 PolarHBondContact O-N 3.18Å |
| 52 | K | 74.1 | Confident | 69.7 | Low | 157 Ų | 157 | 121.3 Ų | 121.3 | 68% | 0.683 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -60.5 | -46.6 | 172.1 | -74.8 | 170.5 | -178.4 | -178.9 | 0 | 111.4 | R48 A49 L55 A56 | R48-K52 VanDerWaalsContact O-CG 3.27Å; R48-K52 WeakPolarHBondContact O-CG 3.38Å; R48-K52 PolarHBondContact O-N 2.84Å; A49-K52 PolarHBondContact O-N 3.15Å; K52-L55 PolarHBondContact O-N 3.47Å; K52-A56 WeakPolarHBondContact O-CB 3.49Å; K52-A56 PolarHBondContact O-N 2.81Å |
| 53 | V | 75.4 | Confident | 69.6 | Low | 86 Ų | 86 | 122.5 Ų | 122.5 | 52% | 0.521 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64 | -44.9 | 177.9 | 175.4 | 0 | 0 | 0 | 0 | 111.8 | A49 Q50 A56 R57 | A49-V53 PolarHBondContact O-N 2.79Å; A49-V53 VanDerWaalsContact O-N 3.15Å; Q50-V53 PolarHBondContact O-N 3.17Å; V53-A56 PolarHBondContact O-N 3.31Å; V53-R57 PolarHBondContact O-N 2.81Å |
| 54 | R | 75.8 | Confident | 69.7 | Low | 193 Ų | 193 | 114.9 Ų | 114.9 | 73% | 0.728 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -64.6 | -40.8 | 178.1 | -169.1 | 170 | -178.3 | 148.7 | -0 | 111.8 | Q50 Q51 R57 I58 | Q50-R54 WeakPolarHBondContact O-CB 3.45Å; Q50-R54 PolarHBondContact O-N 2.98Å; Q51-R54 PolarHBondContact O-N 3.5Å; R54-R57 PolarHBondContact O-N 3.33Å; R54-I58 HydrophobicContact CG-CD1 4.28Å; R54-I58 VanDerWaalsContact O-CG1 3.32Å; R54-I58 WeakPolarHBondContact O-CG1 3.12Å; R54-I58 PolarHBondContact O-N 3.15Å |
| 55 | L | 80.3 | Confident | 69.8 | Low | 79 Ų | 79 | 118.5 Ų | 118.5 | 41% | 0.414 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -68.3 | -35.5 | 175.1 | -176.1 | 61 | 0 | 0 | 0 | 112.2 | Q51 K52 I58 R59 | Q51-L55 VanDerWaalsContact O-CB 3.22Å; Q51-L55 WeakPolarHBondContact O-CB 3.47Å; Q51-L55 PolarHBondContact O-N 3.18Å; K52-L55 PolarHBondContact O-N 3.47Å; L55-I58 PolarHBondContact O-N 2.94Å; L55-R59 WeakPolarHBondContact O-CB 3.39Å; L55-R59 VanDerWaalsContact O-CG 3.28Å; L55-R59 WeakPolarHBondContact O-CG 3.4Å; L55-R59 PolarHBondContact O-N 3.4Å |
| 56 | A | 78.8 | Confident | 69.8 | Low | 49 Ų | 49 | 117 Ų | 117 | 41% | 0.405 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -62.9 | -47.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | K52 V53 I58 R59 M60 | K52-A56 WeakPolarHBondContact O-CB 3.49Å; K52-A56 PolarHBondContact O-N 2.81Å; V53-A56 PolarHBondContact O-N 3.31Å; A56-I58 PolarHBondContact O-N 2.95Å; A56-R59 PolarHBondContact O-N 3.48Å; A56-R59 VanDerWaalsContact O-N 3.16Å; A56-M60 WeakPolarHBondContact O-CG 3.42Å; A56-M60 PolarHBondContact O-N 3.23Å |
| 57 | R | 76.2 | Confident | 69.7 | Low | 192 Ų | 192 | 114.2 Ų | 114.2 | 73% | 0.725 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -58 | -45 | 174.1 | -74.8 | -175.3 | 173.1 | -176.2 | -2.5 | 112.3 | V53 R54 R59 M60 A61 | V53-R57 PolarHBondContact O-N 2.81Å; R54-R57 PolarHBondContact O-N 3.33Å; R57-R59 VanDerWaalsContact C-N 3.35Å; R57-R59 PolarHBondContact O-N 2.95Å; R57-M60 PolarHBondContact O-N 3.27Å; R57-A61 PolarHBondContact O-N 3.34Å |
| 58 | I | 78.4 | Confident | 69.6 | Low | 96 Ų | 96 | 111 Ų | 111 | 49% | 0.492 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62.5 | -40.4 | 175.9 | -68.3 | 164.9 | 0 | 0 | 0 | 111.5 | R54 L55 A56 K62 | R54-I58 HydrophobicContact CG-CD1 4.28Å; R54-I58 VanDerWaalsContact O-CG1 3.32Å; R54-I58 WeakPolarHBondContact O-CG1 3.12Å; R54-I58 PolarHBondContact O-N 3.15Å; L55-I58 PolarHBondContact O-N 2.94Å; A56-I58 PolarHBondContact O-N 2.95Å; I58-K62 VanDerWaalsContact O-CB 3.29Å; I58-K62 WeakPolarHBondContact O-CB 3.45Å; I58-K62 PolarHBondContact O-N 3.37Å |
| 59 | R | 76.8 | Confident | 69.5 | Low | 163 Ų | 163 | 111.2 Ų | 111.2 | 62% | 0.615 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -66.1 | -39.7 | 176.1 | -77 | 173.6 | 174.8 | -174.5 | -1.4 | 112.3 | L55 A56 R57 K63 | L55-R59 WeakPolarHBondContact O-CB 3.39Å; L55-R59 VanDerWaalsContact O-CG 3.28Å; L55-R59 WeakPolarHBondContact O-CG 3.4Å; L55-R59 PolarHBondContact O-N 3.4Å; A56-R59 PolarHBondContact O-N 3.48Å; A56-R59 VanDerWaalsContact O-N 3.16Å; R57-R59 VanDerWaalsContact C-N 3.35Å; R57-R59 PolarHBondContact O-N 2.95Å; R59-K63 WeakPolarHBondContact O-CB 3.44Å; R59-K63 WeakPolarHBondContact O-CG 3.21Å; R59-K63 PolarHBondContact O-N 3.05Å |
| 60 | M | 69.9 | Low | 69.5 | Low | 140 Ų | 140 | 113.1 Ų | 113.1 | 69% | 0.69 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -66.3 | -48.4 | 175.3 | -67.2 | -51.3 | -159.9 | 0 | 0 | 111.3 | A56 R57 K62 K63 G64 | A56-M60 WeakPolarHBondContact O-CG 3.42Å; A56-M60 PolarHBondContact O-N 3.23Å; R57-M60 PolarHBondContact O-N 3.27Å; M60-K62 VanDerWaalsContact C-N 3.3Å; M60-K62 PolarHBondContact O-N 3.44Å; M60-K63 PolarHBondContact O-N 3.43Å; M60-K63 VanDerWaalsContact O-N 3.15Å; M60-G64 PolarHBondContact O-N 2.9Å |
| 61 | A | 74.3 | Confident | 69.3 | Low | 71 Ų | 71 | 112.6 Ų | 112.6 | 59% | 0.587 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -59.2 | -39.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | R57 T65 | R57-A61 PolarHBondContact O-N 3.34Å; A61-T65 PolarHBondContact O-OG1 3.31Å |
| 62 | K | 73.3 | Confident | 68.5 | Low | 168 Ų | 168 | 111.4 Ų | 111.4 | 73% | 0.73 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -77 | -22.5 | 177.7 | -172.7 | 166.3 | -178.2 | 173.1 | 0 | 114.1 | I58 M60 | I58-K62 VanDerWaalsContact O-CB 3.29Å; I58-K62 WeakPolarHBondContact O-CB 3.45Å; I58-K62 PolarHBondContact O-N 3.37Å; M60-K62 VanDerWaalsContact C-N 3.3Å; M60-K62 PolarHBondContact O-N 3.44Å |
| 63 | K | 59.4 | Low | 67.5 | Low | 133 Ų | 133 | 109.8 Ų | 109.8 | 58% | 0.578 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -85 | -35.5 | 171.8 | -79.4 | -169 | 170.5 | -161.7 | 0 | 112.4 | R59 M60 T65 A66 N67 | R59-K63 WeakPolarHBondContact O-CB 3.44Å; R59-K63 WeakPolarHBondContact O-CG 3.21Å; R59-K63 PolarHBondContact O-N 3.05Å; M60-K63 PolarHBondContact O-N 3.43Å; M60-K63 VanDerWaalsContact O-N 3.15Å; K63-T65 PolarHBondContact O-N 3.45Å; K63-A66 PolarHBondContact O-N 2.87Å; K63-N67 VanDerWaalsContact O-CB 3.31Å; K63-N67 WeakPolarHBondContact O-CB 3.3Å; K63-N67 PolarHBondContact O-N 2.88Å; K63-N67 PolarHBondContact O-OD1 3.44Å |
| 64 | G | 60.7 | Low | 66.5 | Low | 41 Ų | 41 | 111.2 Ų | 111.2 | 42% | 0.423 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -57.5 | -45.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | M60 A66 N67 A68 | M60-G64 PolarHBondContact O-N 2.9Å; G64-A66 PolarHBondContact O-N 3.46Å; G64-N67 PolarHBondContact O-N 2.99Å; G64-A68 VanDerWaalsContact O-CB 3.28Å; G64-A68 WeakPolarHBondContact O-CB 3.25Å; G64-A68 PolarHBondContact O-N 2.89Å |
| 65 | T | 60.5 | Low | 65.2 | Low | 109 Ų | 109 | 107.3 Ų | 107.3 | 67% | 0.669 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.4 | -35 | 177 | 41.4 | 0 | 0 | 0 | 0 | 113.8 | A61 K63 | A61-T65 PolarHBondContact O-OG1 3.31Å; K63-T65 PolarHBondContact O-N 3.45Å |
| 66 | A | 61.5 | Low | 63.8 | Low | 49 Ų | 49 | 109.2 Ų | 109.2 | 41% | 0.405 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -77.1 | -40.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | K63 G64 F69 L70 | K63-A66 PolarHBondContact O-N 2.87Å; G64-A66 PolarHBondContact O-N 3.46Å; A66-F69 PolarHBondContact O-N 3.16Å; A66-L70 WeakPolarHBondContact O-CG 3.5Å; A66-L70 PolarHBondContact O-N 2.86Å; A66-L70 VanDerWaalsContact O-N 3.09Å |
| 67 | N | 60.8 | Low | 62.3 | Low | 87 Ų | 87 | 111.2 Ų | 111.2 | 47% | 0.465 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -72.7 | -38.1 | -177.9 | -75.4 | 25.2 | 0 | 0 | 0 | 112.1 | K63 G64 F69 L70 Q71 | K63-N67 VanDerWaalsContact O-CB 3.31Å; K63-N67 WeakPolarHBondContact O-CB 3.3Å; K63-N67 PolarHBondContact O-N 2.88Å; K63-N67 PolarHBondContact O-OD1 3.44Å; G64-N67 PolarHBondContact O-N 2.99Å; N67-F69 VanDerWaalsContact C-N 3.29Å; N67-F69 PolarHBondContact O-N 3.29Å; N67-L70 PolarHBondContact O-N 3.04Å; N67-L70 VanDerWaalsContact O-N 3.17Å; N67-Q71 PolarHBondContact O-N 2.87Å |
| 68 | A | 60.9 | Low | 61 | Low | 58 Ų | 58 | 107.7 Ų | 107.7 | 48% | 0.479 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.5 | -37.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | G64 Y72 | G64-A68 VanDerWaalsContact O-CB 3.28Å; G64-A68 WeakPolarHBondContact O-CB 3.25Å; G64-A68 PolarHBondContact O-N 2.89Å; A68-Y72 PolarHBondContact O-N 2.83Å; A68-Y72 VanDerWaalsContact O-N 3.11Å |
| 69 | F | 61.8 | Low | 59.3 | Low | 138 Ų | 138 | 105.9 Ų | 105.9 | 61% | 0.605 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68 | -36.4 | 173.5 | -178 | -98.1 | 0 | 0 | 0 | 112.5 | A66 N67 K73 | A66-F69 PolarHBondContact O-N 3.16Å; N67-F69 VanDerWaalsContact C-N 3.29Å; N67-F69 PolarHBondContact O-N 3.29Å; F69-K73 PolarHBondContact O-N 3.3Å |
| 70 | L | 63 | Low | 57.7 | Low | 94 Ų | 94 | 103.9 Ų | 103.9 | 49% | 0.492 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -69.7 | -43.7 | 175.4 | -73.8 | 173.7 | 0 | 0 | 0 | 112.4 | A66 N67 Y72 K73 E74 | A66-L70 WeakPolarHBondContact O-CG 3.5Å; A66-L70 PolarHBondContact O-N 2.86Å; A66-L70 VanDerWaalsContact O-N 3.09Å; N67-L70 PolarHBondContact O-N 3.04Å; N67-L70 VanDerWaalsContact O-N 3.17Å; L70-Y72 PolarHBondContact O-N 3.28Å; L70-K73 CarbonylContact O-C 3.58Å; L70-K73 PolarHBondContact O-N 3.34Å; L70-K73 VanDerWaalsContact O-N 3.07Å; L70-E74 WeakPolarHBondContact O-CB 3.12Å; L70-E74 PolarHBondContact O-N 3.49Å |
| 71 | Q | 59.5 | Low | 56.4 | Low | 123 Ų | 123 | 101.5 Ų | 101.5 | 58% | 0.575 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -58.5 | -48.9 | 174.7 | -75.5 | -175.9 | -64 | 0 | 0 | 111.4 | N67 K73 E74 D75 | N67-Q71 PolarHBondContact O-N 2.87Å; Q71-K73 PolarHBondContact O-N 3.15Å; Q71-K73 VanDerWaalsContact O-N 3.12Å; Q71-E74 PolarHBondContact O-N 3.28Å; Q71-D75 WeakPolarHBondContact O-CB 3.27Å; Q71-D75 PolarHBondContact O-N 3.43Å |
| 72 | Y | 57.6 | Low | 54.5 | Low | 114 Ų | 114 | 107 Ų | 107 | 45% | 0.447 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -54.2 | -34.7 | 174.7 | 171.6 | -112.7 | 0 | 0 | 0 | 112.9 | A68 L70 H76 | A68-Y72 PolarHBondContact O-N 2.83Å; A68-Y72 VanDerWaalsContact O-N 3.11Å; L70-Y72 PolarHBondContact O-N 3.28Å; Y72-H76 VanDerWaalsContact O-CB 3.27Å; Y72-H76 WeakPolarHBondContact O-CB 3.23Å |
| 73 | K | 52.3 | Low | 53.2 | Low | 122 Ų | 122 | 107.4 Ų | 107.4 | 53% | 0.53 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -81.7 | -30.6 | 177.5 | -150.7 | -157 | 69.2 | 161 | 0 | 113.4 | F69 L70 Q71 T77 | F69-K73 PolarHBondContact O-N 3.3Å; L70-K73 CarbonylContact O-C 3.58Å; L70-K73 PolarHBondContact O-N 3.34Å; L70-K73 VanDerWaalsContact O-N 3.07Å; Q71-K73 PolarHBondContact O-N 3.15Å; Q71-K73 VanDerWaalsContact O-N 3.12Å; K73-T77 WeakPolarHBondContact O-CG2 3.36Å; K73-T77 PolarHBondContact O-N 3.01Å; K73-T77 PolarHBondContact O-OG1 3.15Å; K73-T77 VanDerWaalsContact O-OG1 3.13Å |
| 74 | E | 54.7 | Low | 52.4 | Low | 116 Ų | 116 | 107.4 Ų | 107.4 | 54% | 0.542 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -75.1 | -48.9 | -178.5 | -169.7 | 164.2 | -170.8 | 0 | 0 | 110.9 | L70 Q71 H76 T77 L78 | L70-E74 WeakPolarHBondContact O-CB 3.12Å; L70-E74 PolarHBondContact O-N 3.49Å; Q71-E74 PolarHBondContact O-N 3.28Å; E74-H76 VanDerWaalsContact C-N 3.26Å; E74-H76 PolarHBondContact O-N 2.91Å; E74-T77 WeakPolarHBondContact CA-OG1 3.38Å; E74-T77 PolarHBondContact O-N 2.83Å; E74-T77 PolarHBondContact O-OG1 3.32Å; E74-L78 PolarHBondContact O-N 3.44Å; E74-L78 VanDerWaalsContact O-N 3.15Å |
| 75 | D | 49 | Very low | 51.7 | Low | 111 Ų | 111 | 116 Ų | 116 | 59% | 0.594 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -55 | -43.2 | 172.2 | -66 | -29.7 | 0 | 0 | 0 | 110.8 | Q71 T77 L78 G79 | Q71-D75 WeakPolarHBondContact O-CB 3.27Å; Q71-D75 PolarHBondContact O-N 3.43Å; D75-T77 VanDerWaalsContact C-N 3.26Å; D75-T77 PolarHBondContact O-N 3.37Å; D75-L78 PolarHBondContact O-N 3.43Å; D75-G79 PolarHBondContact O-N 3.08Å |
| 76 | H | 51 | Low | 50.7 | Low | 119 Ų | 119 | 117.2 Ų | 117.2 | 55% | 0.551 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -73.9 | -12.3 | 179.7 | -151.2 | -49 | 0 | 0 | 0 | 114 | Y72 E74 | Y72-H76 VanDerWaalsContact O-CB 3.27Å; Y72-H76 WeakPolarHBondContact O-CB 3.23Å; E74-H76 VanDerWaalsContact C-N 3.26Å; E74-H76 PolarHBondContact O-N 2.91Å |
| 77 | T | 47.4 | Very low | 50.1 | Low | 91 Ų | 91 | 119 Ų | 119 | 56% | 0.558 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -93.3 | -19.3 | 170.4 | 45.3 | 0 | 0 | 0 | 0 | 114.2 | K73 E74 D75 | K73-T77 WeakPolarHBondContact O-CG2 3.36Å; K73-T77 PolarHBondContact O-N 3.01Å; K73-T77 PolarHBondContact O-OG1 3.15Å; K73-T77 VanDerWaalsContact O-OG1 3.13Å; E74-T77 WeakPolarHBondContact CA-OG1 3.38Å; E74-T77 PolarHBondContact O-N 2.83Å; E74-T77 PolarHBondContact O-OG1 3.32Å; D75-T77 VanDerWaalsContact C-N 3.26Å; D75-T77 PolarHBondContact O-N 3.37Å |
| 78 | L | 47.6 | Very low | 49.5 | Very low | 119 Ų | 119 | 120.9 Ų | 120.9 | 62% | 0.623 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -95.4 | -30.8 | 173.7 | -67 | 173.7 | 0 | 0 | 0 | 112.3 | E74 D75 V80 S81 | E74-L78 PolarHBondContact O-N 3.44Å; E74-L78 VanDerWaalsContact O-N 3.15Å; D75-L78 PolarHBondContact O-N 3.43Å; L78-V80 PolarHBondContact O-N 3.48Å; L78-V80 VanDerWaalsContact O-N 3.12Å; L78-S81 PolarHBondContact O-N 3.4Å; L78-S81 PolarHBondContact O-OG 2.87Å; L78-S81 VanDerWaalsContact O-OG 3.05Å |
| 79 | G | 42.5 | Very low | 48.8 | Very low | 57 Ų | 57 | 122.8 Ų | 122.8 | 59% | 0.588 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | -1.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | D75 S81 | D75-G79 PolarHBondContact O-N 3.08Å; G79-S81 VanDerWaalsContact C-N 3.33Å |
| 80 | V | 45 | Very low | 48.2 | Very low | 122 Ų | 122 | 120.5 Ų | 120.5 | 74% | 0.739 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -6.3 | 173.5 | -177.1 | 0 | 0 | 0 | 0 | 111.6 | L78 | L78-V80 PolarHBondContact O-N 3.48Å; L78-V80 VanDerWaalsContact O-N 3.12Å |
| 81 | S | 41.3 | Very low | 47.6 | Very low | 90 Ų | 90 | 118.6 Ų | 118.6 | 63% | 0.629 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -128.6 | 20.5 | -171.1 | 48 | 0 | 0 | 0 | 0 | 116.5 | L78 G79 | L78-S81 PolarHBondContact O-N 3.4Å; L78-S81 PolarHBondContact O-OG 2.87Å; L78-S81 VanDerWaalsContact O-OG 3.05Å; G79-S81 VanDerWaalsContact C-N 3.33Å |
| 82 | F | 35.4 | Very low | 47.1 | Very low | 187 Ų | 187 | 118.1 Ų | 118.1 | 82% | 0.82 | 63% | 0.632 | S | S | * | * | trans | -152.8 | 138.1 | 147.6 | -148.9 | -105.4 | 0 | 0 | 0 | 111.5 | ||||
| 83 | Q | 46.1 | Very low | 46.7 | Very low | 175 Ų | 175 | 117.1 Ų | 117.1 | 82% | 0.818 | 64% | 0.64 | S | S | * | * | trans | -101.1 | 150.1 | 172.6 | -178.3 | 167.8 | 12.3 | 0 | 0 | 110 | ||||
| 84 | D | 41.3 | Very low | 46.7 | Very low | 133 Ų | 133 | 115.9 Ų | 115.9 | 71% | 0.711 | 64% | 0.643 | S | S | * | * | trans | 107.3 | 141.2 | 164 | -159.7 | 28.5 | 0 | 0 | 0 | 116.7 | ||||
| 85 | R | 46.3 | Very low | 46.5 | Very low | 222 Ų | 222 | 117.7 Ų | 117.7 | 84% | 0.838 | 65% | 0.649 | S | S | * | * | trans | 55.9 | 103.3 | 172.9 | -28.6 | -165.1 | 79 | -179.2 | 2.3 | 115.5 | ||||
| 86 | D | 38.8 | Very low | 46.5 | Very low | 134 Ų | 134 | 118 Ų | 118 | 72% | 0.717 | 65% | 0.65 | S | S | * | * | -170.2 | 143.6 | 58.5 | -173.1 | 23.6 | 0 | 0 | 0 | 110.6 | |||||
| 87 | S | 50.5 | Low | 46.5 | Very low | 88 Ų | 88 | 117.7 Ų | 117.7 | 62% | 0.615 | 64% | 0.644 | S | S | * | * | trans | -93 | -27.4 | -154.7 | -64.6 | 0 | 0 | 0 | 0 | 116.8 | T90 | S87-T90 PolarHBondContact O-OG1 2.94Š| ||
| 88 | D | 48.1 | Very low | 47 | Very low | 126 Ų | 126 | 115.9 Ų | 115.9 | 67% | 0.674 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -89 | -30.3 | -160.8 | -69.1 | -19.6 | 0 | 0 | 0 | 114.3 | ||
| 89 | S | 45.2 | Very low | 47.5 | Very low | 98 Ų | 98 | 113 Ų | 113 | 69% | 0.685 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73 | -40.2 | 179.9 | -172 | 0 | 0 | 0 | 0 | 112.4 | ||
| 90 | T | 50.3 | Low | 48.2 | Very low | 89 Ų | 89 | 117.3 Ų | 117.3 | 55% | 0.546 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -67.5 | -38.8 | 177.9 | 51.4 | 0 | 0 | 0 | 0 | 111.8 | S87 L92 C93 V94 | S87-T90 PolarHBondContact O-OG1 2.94Å; T90-L92 PolarHBondContact O-N 3.47Å; T90-C93 WeakPolarHBondContact O-CB 3.2Å; T90-C93 PolarHBondContact O-N 3.45Å; T90-V94 WeakPolarHBondContact O-CG2 3.4Å; T90-V94 PolarHBondContact O-N 3.29Å |
| 91 | A | 48.9 | Very low | 49 | Very low | 54 Ų | 54 | 115.4 Ų | 115.4 | 45% | 0.446 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -59.4 | -41.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | V94 K95 | A91-V94 PolarHBondContact O-N 3.22Å; A91-K95 VanDerWaalsContact O-CB 3.22Å; A91-K95 WeakPolarHBondContact O-CB 3.49Å; A91-K95 PolarHBondContact O-N 2.73Å |
| 92 | L | 50.2 | Low | 50 | Low | 114 Ų | 114 | 118 Ų | 118 | 60% | 0.597 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -68.9 | -35.1 | 178.5 | -74.1 | 170.8 | 0 | 0 | 0 | 112.9 | T90 N96 | T90-L92 PolarHBondContact O-N 3.47Å; L92-N96 PolarHBondContact O-N 3.03Å; L92-N96 VanDerWaalsContact O-N 3.14Å; L92-N96 PolarHBondContact O-ND2 2.9Å |
| 93 | C | 49.7 | Very low | 51.2 | Low | 93 Ų | 93 | 115.8 Ų | 115.8 | 63% | 0.628 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -62.8 | -51.5 | 173 | -177.8 | 0 | 0 | 0 | 0 | 111 | T90 K95 N96 R97 | T90-C93 WeakPolarHBondContact O-CB 3.2Å; T90-C93 PolarHBondContact O-N 3.45Å; C93-K95 VanDerWaalsContact C-N 3.33Å; C93-K95 PolarHBondContact O-N 3.46Å; C93-N96 PolarHBondContact O-N 3.38Å; C93-R97 PolarHBondContact O-N 3.44Å; C93-R97 VanDerWaalsContact O-N 3.09Å |
| 94 | V | 50.8 | Low | 52.4 | Low | 95 Ų | 95 | 112 Ų | 112 | 58% | 0.576 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.7 | -37.9 | 179.4 | 174.3 | 0 | 0 | 0 | 0 | 111.9 | T90 A91 R97 S98 | T90-V94 WeakPolarHBondContact O-CG2 3.4Å; T90-V94 PolarHBondContact O-N 3.29Å; A91-V94 PolarHBondContact O-N 3.22Å; V94-R97 WeakPolarHBondContact O-CB 2.92Å; V94-R97 PolarHBondContact O-N 3.2Å; V94-S98 PolarHBondContact O-N 3.24Å; V94-S98 PolarHBondContact O-OG 3.45Å |
| 95 | K | 50 | Low | 53.8 | Low | 154 Ų | 154 | 110.2 Ų | 110.2 | 67% | 0.67 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -71.3 | -32.8 | 179.9 | -169.8 | 172.3 | -177.7 | 176.9 | 0 | 113.9 | A91 C93 S98 A99 | A91-K95 VanDerWaalsContact O-CB 3.22Å; A91-K95 WeakPolarHBondContact O-CB 3.49Å; A91-K95 PolarHBondContact O-N 2.73Å; C93-K95 VanDerWaalsContact C-N 3.33Å; C93-K95 PolarHBondContact O-N 3.46Å; K95-S98 PolarHBondContact O-OG 3.12Å; K95-A99 PolarHBondContact O-N 3.43Å |
| 96 | N | 49.3 | Very low | 55.4 | Low | 117 Ų | 117 | 105.7 Ų | 105.7 | 63% | 0.626 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -71.6 | -37.9 | 171.4 | -82 | -83.5 | 0 | 0 | 0 | 111.3 | L92 C93 F100 | L92-N96 PolarHBondContact O-N 3.03Å; L92-N96 VanDerWaalsContact O-N 3.14Å; L92-N96 PolarHBondContact O-ND2 2.9Å; C93-N96 PolarHBondContact O-N 3.38Å; N96-F100 PolarHBondContact O-N 3.31Å |
| 97 | R | 52.1 | Low | 57.3 | Low | 113 Ų | 113 | 104.1 Ų | 104.1 | 43% | 0.426 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.4 | -51.3 | 174.1 | 180 | 174.9 | 174.4 | 158.2 | 2.1 | 111.4 | C93 V94 A99 F100 E101 | C93-R97 PolarHBondContact O-N 3.44Å; C93-R97 VanDerWaalsContact O-N 3.09Å; V94-R97 WeakPolarHBondContact O-CB 2.92Å; V94-R97 PolarHBondContact O-N 3.2Å; R97-A99 VanDerWaalsContact C-N 3.29Å; R97-A99 PolarHBondContact O-N 3.18Å; R97-F100 PolarHBondContact O-N 3.15Å; R97-E101 VanDerWaalsContact CG-OE2 3.31Å; R97-E101 WeakPolarHBondContact CG-OE2 3.36Å; R97-E101 IonicContact CZ-OE1 3.68Å; R97-E101 IonicContact NE-OE1 3.86Å; R97-E101 IonicContact NE-OE2 3.61Å; R97-E101 PolarHBondContact NE-OE2 3.33Å; R97-E101 VanDerWaalsContact NE-OE2 3.1Å; R97-E101 IonicContact NH2-OE1 2.73Å; R97-E101 PolarHBondContact NH2-OE1 3.45Å; R97-E101 WeakPolarHBondContact O-CB 3.28Å; R97-E101 PolarHBondContact O-N 3.24Å |
| 98 | S | 57.8 | Low | 58.4 | Low | 54 Ų | 54 | 103.9 Ų | 103.9 | 38% | 0.378 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.4 | -30 | -176.4 | 66.1 | 0 | 0 | 0 | 0 | 114.2 | V94 K95 H102 | V94-S98 PolarHBondContact O-N 3.24Å; V94-S98 PolarHBondContact O-OG 3.45Å; K95-S98 PolarHBondContact O-OG 3.12Å; S98-H102 WeakPolarHBondContact O-CB 3.31Å; S98-H102 PolarHBondContact O-N 2.89Å; S98-H102 PolarHBondContact O-ND1 3.09Å; S98-H102 VanDerWaalsContact O-ND1 3.15Å |
| 99 | A | 58.6 | Low | 59.7 | Low | 57 Ų | 57 | 103.1 Ų | 103.1 | 47% | 0.471 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.7 | -47.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | K95 R97 Q103 | K95-A99 PolarHBondContact O-N 3.43Å; R97-A99 VanDerWaalsContact C-N 3.29Å; R97-A99 PolarHBondContact O-N 3.18Å; A99-Q103 PolarHBondContact O-N 3.47Å |
| 100 | F | 55.7 | Low | 61.4 | Low | 149 Ų | 149 | 101 Ų | 101 | 65% | 0.654 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -68.9 | -37.7 | 176.8 | -171.3 | -97.1 | 0 | 0 | 0 | 111.8 | N96 R97 Q103 H104 | N96-F100 PolarHBondContact O-N 3.31Å; R97-F100 PolarHBondContact O-N 3.15Å; F100-Q103 PolarHBondContact O-N 3.22Å; F100-H104 WeakPolarHBondContact O-CB 3.33Å; F100-H104 PolarHBondContact O-N 3.44Å |
| 101 | E | 62.8 | Low | 62.3 | Low | 82 Ų | 82 | 101.2 Ų | 101.2 | 38% | 0.383 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.6 | -32.6 | 179 | -154 | 153.6 | -143.2 | 0 | 0 | 111 | R97 N105 | R97-E101 VanDerWaalsContact CG-OE2 3.31Å; R97-E101 WeakPolarHBondContact CG-OE2 3.36Å; R97-E101 IonicContact CZ-OE1 3.68Å; R97-E101 IonicContact NE-OE1 3.86Å; R97-E101 IonicContact NE-OE2 3.61Å; R97-E101 PolarHBondContact NE-OE2 3.33Å; R97-E101 VanDerWaalsContact NE-OE2 3.1Å; R97-E101 IonicContact NH2-OE1 2.73Å; R97-E101 PolarHBondContact NH2-OE1 3.45Å; R97-E101 WeakPolarHBondContact O-CB 3.28Å; R97-E101 PolarHBondContact O-N 3.24Å; E101-N105 PolarHBondContact O-N 3.34Å; E101-N105 PolarHBondContact O-ND2 3.4Å |
| 102 | H | 62.4 | Low | 63.3 | Low | 144 Ų | 144 | 104 Ų | 104 | 67% | 0.667 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.3 | -46.7 | 167.4 | -95.3 | 71.4 | 0 | 0 | 0 | 112.9 | S98 H104 N105 H106 | S98-H102 WeakPolarHBondContact O-CB 3.31Å; S98-H102 PolarHBondContact O-N 2.89Å; S98-H102 PolarHBondContact O-ND1 3.09Å; S98-H102 VanDerWaalsContact O-ND1 3.15Å; H102-H104 VanDerWaalsContact C-N 3.26Å; H102-H104 PolarHBondContact O-N 3.38Å; H102-N105 PolarHBondContact O-N 3.33Å; H102-H106 WeakPolarHBondContact O-CB 3.29Å; H102-H106 PolarHBondContact O-N 3.33Å |
| 103 | Q | 61.3 | Low | 64.2 | Low | 141 Ų | 141 | 106.2 Ų | 106.2 | 66% | 0.659 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.7 | -36.5 | 176.9 | -72.6 | -179.5 | -27 | 0 | 0 | 111.7 | A99 F100 L107 | A99-Q103 PolarHBondContact O-N 3.47Å; F100-Q103 PolarHBondContact O-N 3.22Å; Q103-L107 WeakPolarHBondContact O-CB 3.41Å; Q103-L107 PolarHBondContact O-N 2.94Å |
| 104 | H | 69.9 | Low | 64.7 | Low | 94 Ų | 94 | 107.1 Ų | 107.1 | 44% | 0.435 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66 | -49.4 | 175.5 | -171.5 | 58.6 | 0 | 0 | 0 | 112.4 | F100 H102 H106 L107 L108 | F100-H104 WeakPolarHBondContact O-CB 3.33Å; F100-H104 PolarHBondContact O-N 3.44Å; H102-H104 VanDerWaalsContact C-N 3.26Å; H102-H104 PolarHBondContact O-N 3.38Å; H104-H106 PolarHBondContact O-N 3.02Å; H104-L107 PolarHBondContact O-N 3.13Å; H104-L108 WeakPolarHBondContact O-CG 3.29Å; H104-L108 PolarHBondContact O-N 3.14Å |
| 105 | N | 72.2 | Confident | 65.5 | Low | 97 Ų | 97 | 107.2 Ų | 107.2 | 52% | 0.519 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.5 | -40.5 | 177.8 | -77.6 | -67.8 | 0 | 0 | 0 | 112.2 | E101 H102 L107 L108 H109 | E101-N105 PolarHBondContact O-N 3.34Å; E101-N105 PolarHBondContact O-ND2 3.4Å; H102-N105 PolarHBondContact O-N 3.33Å; N105-L107 VanDerWaalsContact C-N 3.34Å; N105-L107 PolarHBondContact O-N 3.12Å; N105-L108 PolarHBondContact O-N 3.32Å; N105-H109 WeakPolarHBondContact O-CB 3.5Å; N105-H109 PolarHBondContact O-N 3.42Å |
| 106 | H | 79.4 | Confident | 65.6 | Low | 127 Ų | 127 | 106.7 Ų | 106.7 | 59% | 0.588 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62.2 | -40.7 | 173.7 | -174.2 | -71.8 | 0 | 0 | 0 | 111.9 | H102 H104 C110 | H102-H106 WeakPolarHBondContact O-CB 3.29Å; H102-H106 PolarHBondContact O-N 3.33Å; H104-H106 PolarHBondContact O-N 3.02Å; H106-C110 PolarHBondContact CE1-SG 3.4Å; H106-C110 WeakPolarHBondContact O-CB 3.16Å; H106-C110 PolarHBondContact O-N 3.08Å; H106-C110 PolarHBondContact O-SG 2.86Å |
| 107 | L | 78.4 | Confident | 65.6 | Low | 101 Ų | 101 | 108 Ų | 108 | 53% | 0.529 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 176.2 | -173.3 | 70.4 | 0 | 0 | 0 | 111.8 | Q103 H104 N105 C110 L111 | Q103-L107 WeakPolarHBondContact O-CB 3.41Å; Q103-L107 PolarHBondContact O-N 2.94Å; H104-L107 PolarHBondContact O-N 3.13Å; N105-L107 VanDerWaalsContact C-N 3.34Å; N105-L107 PolarHBondContact O-N 3.12Å; L107-C110 PolarHBondContact O-N 2.91Å; L107-L111 HydrophobicContact CG-CD1 4.24Å; L107-L111 WeakPolarHBondContact O-CB 3.2Å; L107-L111 VanDerWaalsContact O-CG 3.3Å; L107-L111 WeakPolarHBondContact O-CG 3.3Å; L107-L111 PolarHBondContact O-N 3Å |
| 108 | L | 72.6 | Confident | 65.4 | Low | 83 Ų | 83 | 110.8 Ų | 110.8 | 44% | 0.435 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.1 | -48.7 | 176.4 | -70.7 | 176.6 | 0 | 0 | 0 | 111.7 | H104 N105 C110 L111 E112 | H104-L108 WeakPolarHBondContact O-CG 3.29Å; H104-L108 PolarHBondContact O-N 3.14Å; N105-L108 PolarHBondContact O-N 3.32Å; L108-C110 VanDerWaalsContact C-N 3.32Å; L108-C110 PolarHBondContact O-N 3.49Å; L108-L111 WeakPolarHBondContact O-CB 3.49Å; L108-L111 PolarHBondContact O-N 3.45Å; L108-L111 VanDerWaalsContact O-N 3.1Å; L108-E112 VanDerWaalsContact O-CB 3.32Å; L108-E112 WeakPolarHBondContact O-CB 3.47Å; L108-E112 PolarHBondContact O-N 3.42Å |
| 109 | H | 75.8 | Confident | 64.5 | Low | 110 Ų | 110 | 116 Ų | 116 | 51% | 0.509 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -62.8 | -36.4 | 177.1 | 176.6 | -108.8 | 0 | 0 | 0 | 112.4 | N105 K113 | N105-H109 WeakPolarHBondContact O-CB 3.5Å; N105-H109 PolarHBondContact O-N 3.42Å; H109-K113 VanDerWaalsContact O-CB 3.23Å; H109-K113 WeakPolarHBondContact O-CB 3.19Å; H109-K113 PolarHBondContact O-N 3.37Å |
| 110 | C | 80.5 | Confident | 63.6 | Low | 52 Ų | 52 | 118.8 Ų | 118.8 | 35% | 0.351 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.8 | -41.5 | 170.8 | -81 | 0 | 0 | 0 | 0 | 112.6 | H106 L107 L108 T114 | H106-C110 PolarHBondContact CE1-SG 3.4Å; H106-C110 WeakPolarHBondContact O-CB 3.16Å; H106-C110 PolarHBondContact O-N 3.08Å; H106-C110 PolarHBondContact O-SG 2.86Å; L107-C110 PolarHBondContact O-N 2.91Å; L108-C110 VanDerWaalsContact C-N 3.32Å; L108-C110 PolarHBondContact O-N 3.49Å; C110-T114 WeakPolarHBondContact O-CB 3.29Å; C110-T114 PolarHBondContact O-N 3.37Å; C110-T114 PolarHBondContact O-OG1 3.05Å |
| 111 | L | 69.7 | Low | 63.3 | Low | 94 Ų | 94 | 116.6 Ų | 116.6 | 49% | 0.492 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64.9 | -51.5 | 176.5 | -75.3 | 166.4 | 0 | 0 | 0 | 110.9 | L107 L108 K113 T114 T115 | L107-L111 HydrophobicContact CG-CD1 4.24Å; L107-L111 WeakPolarHBondContact O-CB 3.2Å; L107-L111 VanDerWaalsContact O-CG 3.3Å; L107-L111 WeakPolarHBondContact O-CG 3.3Å; L107-L111 PolarHBondContact O-N 3Å; L108-L111 WeakPolarHBondContact O-CB 3.49Å; L108-L111 PolarHBondContact O-N 3.45Å; L108-L111 VanDerWaalsContact O-N 3.1Å; L111-K113 PolarHBondContact O-N 2.96Å; L111-T114 CarbonylContact O-C 3.52Å; L111-T114 WeakPolarHBondContact O-CA 3.38Å; L111-T114 WeakPolarHBondContact O-CB 3.43Å; L111-T114 PolarHBondContact O-N 2.96Å; L111-T115 WeakPolarHBondContact O-CG2 3.31Å; L111-T115 PolarHBondContact O-N 3.29Å; L111-T115 PolarHBondContact O-OG1 2.82Å |
| 112 | E | 71.1 | Confident | 62.3 | Low | 113 Ų | 113 | 119.1 Ų | 119.1 | 53% | 0.528 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -49.1 | -53.9 | 175.8 | 178.4 | 174.7 | -141.3 | 0 | 0 | 111.7 | L108 T114 T115 N116 | L108-E112 VanDerWaalsContact O-CB 3.32Å; L108-E112 WeakPolarHBondContact O-CB 3.47Å; L108-E112 PolarHBondContact O-N 3.42Å; E112-T114 VanDerWaalsContact C-N 3.26Å; E112-T114 PolarHBondContact O-N 3.3Å; E112-T115 VanDerWaalsContact CA-OG1 3.32Å; E112-T115 WeakPolarHBondContact CA-OG1 3.39Å; E112-T115 PolarHBondContact O-N 2.9Å; E112-T115 VanDerWaalsContact O-N 3.08Å; E112-T115 PolarHBondContact O-OG1 3.3Å; E112-N116 PolarHBondContact O-N 2.95Å |
| 113 | K | 68.8 | Low | 61.4 | Low | 160 Ų | 160 | 119.7 Ų | 119.7 | 70% | 0.696 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.4 | -27.2 | 176.5 | -173 | 170.4 | -176.9 | 172.6 | 0 | 113.8 | H109 L111 | H109-K113 VanDerWaalsContact O-CB 3.23Å; H109-K113 WeakPolarHBondContact O-CB 3.19Å; H109-K113 PolarHBondContact O-N 3.37Å; L111-K113 PolarHBondContact O-N 2.96Å |
| 114 | T | 60.4 | Low | 60.7 | Low | 112 Ų | 112 | 117.9 Ų | 117.9 | 69% | 0.687 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -79.6 | -32.9 | 173.9 | -54.4 | 0 | 0 | 0 | 0 | 111.4 | C110 L111 E112 | C110-T114 WeakPolarHBondContact O-CB 3.29Å; C110-T114 PolarHBondContact O-N 3.37Å; C110-T114 PolarHBondContact O-OG1 3.05Å; L111-T114 CarbonylContact O-C 3.52Å; L111-T114 WeakPolarHBondContact O-CA 3.38Å; L111-T114 WeakPolarHBondContact O-CB 3.43Å; L111-T114 PolarHBondContact O-N 2.96Å; E112-T114 VanDerWaalsContact C-N 3.26Å; E112-T114 PolarHBondContact O-N 3.3Å |
| 115 | T | 66.9 | Low | 59.1 | Low | 98 Ų | 98 | 121.7 Ų | 121.7 | 60% | 0.601 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -80.8 | -8.6 | -177.5 | 48.6 | 0 | 0 | 0 | 0 | 115.4 | L111 E112 H117 | L111-T115 WeakPolarHBondContact O-CG2 3.31Å; L111-T115 PolarHBondContact O-N 3.29Å; L111-T115 PolarHBondContact O-OG1 2.82Å; E112-T115 VanDerWaalsContact CA-OG1 3.32Å; E112-T115 WeakPolarHBondContact CA-OG1 3.39Å; E112-T115 PolarHBondContact O-N 2.9Å; E112-T115 VanDerWaalsContact O-N 3.08Å; E112-T115 PolarHBondContact O-OG1 3.3Å; T115-H117 VanDerWaalsContact C-N 3.34Å; T115-H117 PolarHBondContact O-N 2.99Å |
| 116 | N | 52.1 | Low | 57.8 | Low | 142 Ų | 142 | 121.8 Ų | 121.8 | 76% | 0.759 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 49.9 | 49.6 | -179.4 | -88.9 | -91.2 | 0 | 0 | 0 | 113.2 | E112 E118 | E112-N116 PolarHBondContact O-N 2.95Å; N116-E118 VanDerWaalsContact C-N 3.28Å; N116-E118 PolarHBondContact O-N 3.13Å |
| 117 | H | 49.3 | Very low | 56 | Low | 144 Ų | 144 | 124.3 Ų | 124.3 | 67% | 0.667 | 63% | 0.633 | S | S | * | * | trans | -78.6 | 80.6 | 173.1 | -163.8 | -65.7 | 0 | 0 | 0 | 110.1 | T115 F119 | T115-H117 VanDerWaalsContact C-N 3.34Å; T115-H117 PolarHBondContact O-N 2.99Å; H117-F119 PolarHBondContact O-N 3.17Å | ||
| 118 | E | 47.1 | Very low | 54.4 | Low | 172 Ų | 172 | 125.7 Ų | 125.7 | 80% | 0.804 | 64% | 0.64 | S | S | * | * | trans | -55.2 | 121.9 | 170.4 | -169.7 | 176.9 | 145.8 | 0 | 0 | 109.4 | N116 T120 | N116-E118 VanDerWaalsContact C-N 3.28Å; N116-E118 PolarHBondContact O-N 3.13Å; E118-T120 PolarHBondContact O-N 3.36Å | ||
| 119 | F | 40 | Very low | 52.9 | Low | 163 Ų | 163 | 127.1 Ų | 127.1 | 72% | 0.715 | 66% | 0.655 | S | S | * | * | trans | -89 | 93.6 | -173.3 | -154.4 | -80.6 | 0 | 0 | 0 | 108.6 | H117 D121 | H117-F119 PolarHBondContact O-N 3.17Å; F119-D121 VanDerWaalsContact C-N 3.34Å; F119-D121 PolarHBondContact O-N 3.43Å | ||
| 120 | T | 39.7 | Very low | 51.4 | Low | 117 Ų | 117 | 129.9 Ų | 129.9 | 72% | 0.718 | 67% | 0.671 | S | S | * | * | trans | -65.4 | 95.8 | 170 | -51.1 | 0 | 0 | 0 | 0 | 109 | E118 E122 | E118-T120 PolarHBondContact O-N 3.36Å; T120-E122 PolarHBondContact O-N 3.2Å | ||
| 121 | D | 48.3 | Very low | 49.5 | Very low | 102 Ų | 102 | 133.4 Ų | 133.4 | 55% | 0.545 | 69% | 0.691 | S | S | . | * | trans | -72.3 | 91.3 | 178.4 | -173.3 | 44.7 | 0 | 0 | 0 | 110.5 | F119 M123 | F119-D121 VanDerWaalsContact C-N 3.34Å; F119-D121 PolarHBondContact O-N 3.43Å; D121-M123 PolarHBondContact O-N 2.94Å | ||
| 122 | E | 42.7 | Very low | 47.5 | Very low | 136 Ų | 136 | 137.5 Ų | 137.5 | 64% | 0.636 | 71% | 0.707 | S | S | * | * | trans | -75.4 | 44.1 | 177.7 | -110.7 | -76.4 | 128.6 | 0 | 0 | 112.1 | T120 T124 | T120-E122 PolarHBondContact O-N 3.2Å; E122-T124 PolarHBondContact O-N 3.1Å | ||
| 123 | M | 43 | Very low | 45.9 | Very low | 155 Ų | 155 | 136.7 Ų | 136.7 | 76% | 0.764 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | 46.6 | 174.4 | -159.5 | -166.5 | -57.1 | 0 | 0 | 111.9 | D121 | D121-M123 PolarHBondContact O-N 2.94Š|
| 124 | T | 47.1 | Very low | 44.3 | Very low | 104 Ų | 104 | 136.1 Ų | 136.1 | 64% | 0.638 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.5 | -31.5 | -178.3 | -53.7 | 0 | 0 | 0 | 0 | 113.1 | E122 S126 | E122-T124 PolarHBondContact O-N 3.1Å; T124-S126 PolarHBondContact O-N 3.29Å |
| 125 | Y | 36.8 | Very low | 42.9 | Very low | 173 Ų | 173 | 134.5 Ų | 134.5 | 68% | 0.678 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 31.3 | -174.4 | -139.9 | -90.2 | 0 | 0 | 0 | 115.8 | L128 | Y125-L128 HydrophobicContact CE1-CB 4.45Š|
| 126 | S | 44.8 | Very low | 41.3 | Very low | 99 Ų | 99 | 139.7 Ų | 139.7 | 69% | 0.692 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | -14.6 | 178.5 | -157.2 | 0 | 0 | 0 | 0 | 113.7 | T124 | T124-S126 PolarHBondContact O-N 3.29Š|
| 127 | E | 40.7 | Very low | 40.5 | Very low | 180 Ų | 180 | 143.7 Ų | 143.7 | 84% | 0.841 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -96.6 | -11.1 | -163.3 | -160.5 | 163.4 | -172.8 | 0 | 0 | 115.1 | ||
| 128 | L | 45.1 | Very low | 39.6 | Very low | 131 Ų | 131 | 142.5 Ų | 142.5 | 69% | 0.686 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -108.7 | 10.5 | -171.7 | -137.8 | 78.1 | 0 | 0 | 0 | 116 | Y125 | Y125-L128 HydrophobicContact CE1-CB 4.45Š|
| 129 | C | 40.1 | Very low | 39.1 | Very low | 112 Ų | 112 | 139.7 Ų | 139.7 | 76% | 0.757 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -136.8 | 28.4 | -176 | -158.6 | 0 | 0 | 0 | 0 | 114.2 | ||
| 130 | M | 45.4 | Very low | 38.8 | Very low | 169 Ų | 169 | 143.9 Ų | 143.9 | 83% | 0.833 | 76% | 0.762 | S | S | * | * | trans | -108.4 | 2.5 | 175.5 | -73.6 | -67.1 | 176.6 | 0 | 0 | 113.8 | ||||
| 131 | T | 40 | Very low | 38.8 | Very low | 125 Ų | 125 | 144 Ų | 144 | 77% | 0.767 | 77% | 0.767 | S | S | * | * | trans | -89.9 | 122.5 | 178.2 | 30.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 132 | E | 28.9 | Very low | 38.1 | Very low | 181 Ų | 181 | 146 Ų | 146 | 85% | 0.846 | 78% | 0.783 | S | S | * | * | trans | 73.9 | 64.6 | 152.9 | -134.7 | 166.6 | 172.6 | 0 | 0 | 119.8 | ||||
| 133 | S | 36.3 | Very low | 37.7 | Very low | 96 Ų | 96 | 145 Ų | 145 | 67% | 0.671 | 79% | 0.792 | S | S | * | * | 33.9 | 144.2 | 119.3 | 64.1 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 134 | V | 35.2 | Very low | 37.1 | Very low | 148 Ų | 148 | 146.3 Ų | 146.3 | 90% | 0.897 | 80% | 0.801 | S | S | * | * | trans | 66.1 | 115.4 | 155.9 | -64.6 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 135 | G | 31.3 | Very low | 36.4 | Very low | 78 Ų | 78 | 146.9 Ų | 146.9 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | 169.4 | 106.1 | 161.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 136 | F | 32.8 | Very low | 36.3 | Very low | 207 Ų | 207 | 144.2 Ų | 144.2 | 91% | 0.908 | 82% | 0.815 | S | S | * | * | trans | -75 | 129.3 | 166 | -86.8 | -105.8 | 0 | 0 | 0 | 110.7 | ||||
| 137 | R | 36.1 | Very low | 35.8 | Very low | 226 Ų | 226 | 147.5 Ų | 147.5 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | 173.9 | 127.9 | 121.6 | -95.4 | 168 | -145.4 | -85.8 | 2.6 | 115 | |||||
| 138 | T | 31.3 | Very low | 35.4 | Very low | 118 Ų | 118 | 148.1 Ų | 148.1 | 72% | 0.724 | 82% | 0.823 | S | S | * | * | trans | 28.1 | 111.1 | 140.2 | 61.1 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 139 | S | 36 | Very low | 34.6 | Very low | 113 Ų | 113 | 145.6 Ų | 145.6 | 79% | 0.79 | 83% | 0.828 | S | S | * | * | 41.1 | 108.1 | 127.4 | -51.8 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 140 | R | 32.8 | Very low | 34.3 | Very low | 251 Ų | 251 | 144.4 Ų | 144.4 | 95% | 0.947 | 83% | 0.826 | S | S | * | * | -163.7 | 145.7 | 123.9 | -109.8 | 161.6 | -174.6 | 179.6 | 1.7 | 112 | |||||
| 141 | S | 40.3 | Very low | 33.8 | Very low | 119 Ų | 119 | 145 Ų | 145 | 83% | 0.832 | 83% | 0.827 | S | S | * | * | trans | -96.7 | 134.1 | 176.4 | 37 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 142 | T | 33.2 | Very low | 33.6 | Very low | 145 Ų | 145 | 145.1 Ų | 145.1 | 89% | 0.89 | 82% | 0.823 | S | S | * | * | trans | -136 | 150.3 | 160.4 | 46.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 143 | S | 34.6 | Very low | 34 | Very low | 115 Ų | 115 | 143.7 Ų | 143.7 | 80% | 0.804 | 82% | 0.822 | S | S | * | * | trans | -139.6 | 132.9 | 171.9 | 49.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 144 | L | 31.2 | Very low | 34.1 | Very low | 183 Ų | 183 | 144.1 Ų | 144.1 | 96% | 0.958 | 82% | 0.824 | S | S | * | * | trans | -135.6 | 160 | 172 | -76.2 | 179 | 0 | 0 | 0 | 109.5 | ||||
| 145 | S | 32.3 | Very low | 34.4 | Very low | 115 Ų | 115 | 144 Ų | 144 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | trans | -124.5 | 150.1 | -171.3 | 171.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 146 | S | 34.6 | Very low | 34.8 | Very low | 117 Ų | 117 | 144 Ų | 144 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | trans | -133.7 | 155.9 | 159.8 | 56.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 147 | Q | 34.7 | Very low | 35.1 | Very low | 169 Ų | 169 | 140.3 Ų | 140.3 | 79% | 0.79 | 82% | 0.823 | S | S | * | * | trans | -111.4 | 148.6 | 177.4 | -60.3 | 173.6 | -5.5 | 0 | 0 | 108.9 | ||||
| 148 | Q | 32.2 | Very low | 35.4 | Very low | 192 Ų | 192 | 135.2 Ų | 135.2 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | -171.6 | 166.9 | 101.6 | -95.3 | 168.2 | 17 | 0 | 0 | 110.2 | |||||
| 149 | G | 28.4 | Very low | 36.2 | Very low | 78 Ų | 78 | 136.1 Ų | 136.1 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -100.3 | -170.5 | -167 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 150 | A | 33.3 | Very low | 36.5 | Very low | 87 Ų | 87 | 142 Ų | 142 | 72% | 0.719 | 83% | 0.833 | S | S | * | * | trans | 169.9 | 39.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 151 | Q | 34.1 | Very low | 36.8 | Very low | 182 Ų | 182 | 141.8 Ų | 141.8 | 85% | 0.85 | 83% | 0.832 | S | S | * | * | trans | 60.3 | -174.5 | 155.3 | -60.8 | -160.7 | 26.2 | 0 | 0 | 120.2 | ||||
| 152 | N | 36.5 | Very low | 36.5 | Very low | 128 Ų | 128 | 140.5 Ų | 140.5 | 68% | 0.684 | 83% | 0.829 | S | S | * | * | trans | 56.8 | 91.9 | 170.7 | 43.3 | -89.2 | 0 | 0 | 0 | 121.5 | ||||
| 153 | N | 36.1 | Very low | 36.9 | Very low | 151 Ų | 151 | 144.3 Ų | 144.3 | 81% | 0.807 | 83% | 0.827 | S | S | * | * | 107.7 | 124.4 | 120.3 | -68 | 0.4 | 0 | 0 | 0 | 121.9 | |||||
| 154 | S | 39 | Very low | 37 | Very low | 104 Ų | 104 | 150.3 Ų | 150.3 | 73% | 0.727 | 83% | 0.832 | S | S | * | * | trans | 67 | 125.2 | 144.9 | 51.7 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 155 | T | 42.7 | Very low | 37.2 | Very low | 145 Ų | 145 | 152.8 Ų | 152.8 | 89% | 0.89 | 83% | 0.828 | S | S | * | * | trans | 56 | 105.4 | 149.3 | 42.8 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 156 | G | 38.2 | Very low | 37.4 | Very low | 78 Ų | 78 | 152.4 Ų | 152.4 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | trans | -174.7 | 129.3 | 162.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 157 | C | 40.6 | Very low | 37.5 | Very low | 131 Ų | 131 | 151.2 Ų | 151.2 | 89% | 0.885 | 83% | 0.829 | S | S | * | * | trans | -91.9 | 116.7 | -173.4 | -69.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 158 | C | 41.3 | Very low | 37.6 | Very low | 119 Ų | 119 | 150.7 Ų | 150.7 | 80% | 0.804 | 83% | 0.829 | S | S | * | * | trans | 47 | 87.7 | 149.1 | -65.5 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 159 | P | 48.4 | Very low | 37.8 | Very low | 136 Ų | 136 | 154 Ų | 154 | 88% | 0.883 | 83% | 0.833 | S | S | * | * | trans | -78.5 | 132.6 | 155.6 | 32.1 | -31.8 | 0 | 0 | 0 | 111.6 | ||||
| 160 | R | 41.5 | Very low | 38 | Very low | 237 Ų | 237 | 157.7 Ų | 157.7 | 89% | 0.894 | 83% | 0.834 | S | S | * | * | trans | -95 | 130.3 | 171.2 | -67.4 | 174.2 | 171.5 | 179 | -1.7 | 111 | ||||
| 161 | R | 40 | Very low | 38 | Very low | 246 Ų | 246 | 157.3 Ų | 157.3 | 93% | 0.928 | 83% | 0.831 | S | S | * | * | trans | -170.6 | 149 | 130.2 | -118.4 | 177.2 | 169.1 | 161.6 | -2.9 | 118.6 | ||||
| 162 | A | 34.5 | Very low | 38 | Very low | 92 Ų | 92 | 156.1 Ų | 156.1 | 76% | 0.76 | 83% | 0.83 | S | S | * | * | trans | 66.5 | 120.4 | 139.4 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 163 | R | 39.9 | Very low | 38 | Very low | 225 Ų | 225 | 155.1 Ų | 155.1 | 85% | 0.849 | 83% | 0.833 | S | S | * | * | trans | -76 | 145.5 | 159 | -59.3 | 169.8 | 169.5 | -179.8 | -5.4 | 111.7 | ||||
| 164 | R | 36.8 | Very low | 38.2 | Very low | 242 Ų | 242 | 154.6 Ų | 154.6 | 91% | 0.913 | 84% | 0.836 | S | S | * | * | -147.5 | 119.5 | 121.7 | -64.1 | -163.4 | -177.2 | -166.5 | 1.4 | 106.7 | |||||
| 165 | R | 37.1 | Very low | 38.2 | Very low | 234 Ų | 234 | 155.8 Ų | 155.8 | 88% | 0.883 | 84% | 0.838 | S | S | * | * | 52.2 | 91.1 | 83.4 | -80 | -170.7 | 173.4 | 172.9 | -2.8 | 113.7 | |||||
| 166 | A | 35.8 | Very low | 37.7 | Very low | 107 Ų | 107 | 153.7 Ų | 153.7 | 88% | 0.884 | 83% | 0.829 | S | S | * | * | trans | -103.9 | 164.3 | 145.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 167 | A | 36.4 | Very low | 37.6 | Very low | 92 Ų | 92 | 157 Ų | 157 | 76% | 0.76 | 83% | 0.834 | S | S | * | * | trans | -150.8 | 159.8 | -171.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 168 | M | 37.4 | Very low | 37.2 | Very low | 159 Ų | 159 | 156.2 Ų | 156.2 | 78% | 0.783 | 83% | 0.83 | S | S | * | * | trans | 62.7 | 104 | 159.2 | -66.4 | -79.5 | -82 | 0 | 0 | 118.4 | ||||
| 169 | R | 35.5 | Very low | 37.1 | Very low | 260 Ų | 260 | 162.4 Ų | 162.4 | 98% | 0.981 | 84% | 0.836 | S | S | * | * | -137.1 | 165.5 | 110.1 | -77.1 | -147.4 | 167.6 | -172.8 | -3.5 | 110.1 | |||||
| 170 | L | 33.3 | Very low | 36.2 | Very low | 156 Ų | 156 | 159.7 Ų | 159.7 | 82% | 0.817 | 83% | 0.833 | S | S | * | * | trans | -143.8 | 131.1 | -156.1 | 170.9 | 68.4 | 0 | 0 | 0 | 111.2 | ||||
| 171 | A | 32.8 | Very low | 35.9 | Very low | 79 Ų | 79 | 153.1 Ų | 153.1 | 65% | 0.653 | 82% | 0.823 | S | S | * | * | trans | 162.6 | 138.4 | 160.5 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 172 | N | 34.5 | Very low | 36 | Very low | 157 Ų | 157 | 148.4 Ų | 148.4 | 84% | 0.84 | 82% | 0.822 | S | S | * | * | cis | -143.8 | 174.2 | -0.7 | -98.7 | -18.5 | 0 | 0 | 0 | 111.2 | ||||
| 173 | S | 35.9 | Very low | 36 | Very low | 108 Ų | 108 | 151.1 Ų | 151.1 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | trans | -32.1 | 153.1 | 170.4 | -48.6 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 174 | T | 40.7 | Very low | 36 | Very low | 139 Ų | 139 | 147.8 Ų | 147.8 | 85% | 0.853 | 81% | 0.812 | S | S | * | * | cis | -144.6 | 159.6 | 45.8 | 50.4 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 175 | V | 39.1 | Very low | 36 | Very low | 130 Ų | 130 | 144.3 Ų | 144.3 | 79% | 0.788 | 81% | 0.811 | S | S | * | * | trans | -33.9 | 117.8 | 176.1 | 178.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 176 | S | 33 | Very low | 35.8 | Very low | 100 Ų | 100 | 140.4 Ų | 140.4 | 70% | 0.699 | 81% | 0.808 | S | S | * | * | 31.9 | 126.9 | 123.8 | -39.6 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 177 | V | 35.4 | Very low | 35.9 | Very low | 148 Ų | 148 | 141.7 Ų | 141.7 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | -147.8 | 138.7 | 111.3 | 171.2 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 178 | S | 32.7 | Very low | 36 | Very low | 114 Ų | 114 | 144 Ų | 144 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | -95.7 | 128.3 | -179.3 | -57.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 179 | R | 37.7 | Very low | 35.9 | Very low | 250 Ų | 250 | 145.6 Ų | 145.6 | 94% | 0.943 | 81% | 0.809 | S | S | * | * | trans | -155.9 | 117.9 | 144.2 | -119.5 | 170.7 | -179.9 | 138 | 1.5 | 110.5 | ||||
| 180 | G | 31.1 | Very low | 35.7 | Very low | 79 Ų | 79 | 142 Ų | 142 | 81% | 0.814 | 80% | 0.801 | S | S | * | * | trans | -77.5 | 128.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 181 | S | 34.4 | Very low | 35.5 | Very low | 98 Ų | 98 | 143.6 Ų | 143.6 | 69% | 0.685 | 80% | 0.801 | S | S | * | * | trans | -71.6 | 141.8 | 162.9 | -176.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 182 | V | 40.9 | Very low | 35.5 | Very low | 148 Ų | 148 | 146.3 Ų | 146.3 | 90% | 0.897 | 81% | 0.81 | S | S | * | * | trans | -124 | 91.9 | 157.5 | -78.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 183 | Q | 36.1 | Very low | 35.4 | Very low | 149 Ų | 149 | 144.4 Ų | 144.4 | 70% | 0.696 | 80% | 0.804 | S | S | * | * | trans | -85.7 | 128.9 | -177.1 | -168.6 | 162.4 | 2.6 | 0 | 0 | 110.4 | ||||
| 184 | E | 39.2 | Very low | 35.3 | Very low | 154 Ų | 154 | 144.1 Ų | 144.1 | 72% | 0.72 | 80% | 0.802 | S | S | * | * | trans | 24.8 | 133.3 | 148.6 | -57.1 | 168.9 | 127.4 | 0 | 0 | 120.1 | ||||
| 185 | L | 36 | Very low | 35.2 | Very low | 169 Ų | 169 | 145 Ų | 145 | 89% | 0.885 | 80% | 0.8 | S | S | * | * | trans | -148.9 | 154.8 | 136.3 | -136.6 | 73.2 | 0 | 0 | 0 | 109.8 | ||||
| 186 | D | 34.8 | Very low | 35.6 | Very low | 152 Ų | 152 | 144.2 Ų | 144.2 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | trans | -62.8 | 153.6 | -159.3 | -66.4 | -83.8 | 0 | 0 | 0 | 117.6 | ||||
| 187 | T | 36.8 | Very low | 35.9 | Very low | 134 Ų | 134 | 145.6 Ų | 145.6 | 82% | 0.822 | 80% | 0.804 | S | S | * | * | trans | -120.3 | 110.4 | 162.9 | -61 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 188 | L | 39.4 | Very low | 36.1 | Very low | 141 Ų | 141 | 146.7 Ų | 146.7 | 74% | 0.738 | 80% | 0.799 | S | S | * | * | trans | -62.5 | 137.4 | 178.3 | -71.1 | 166.5 | 0 | 0 | 0 | 111.8 | F190 | L188-F190 HydrophobicContact CB-CE2 4.33Å; L188-F190 PolarHBondContact O-N 2.93Å | ||
| 189 | Q | 35.4 | Very low | 36.3 | Very low | 192 Ų | 192 | 148.1 Ų | 148.1 | 90% | 0.897 | 80% | 0.804 | S | S | * | * | trans | -77.4 | 103.4 | -179 | -64.5 | -177.6 | 2.8 | 0 | 0 | 111.8 | K191 | Q189-K191 PolarHBondContact O-N 3.36Š| ||
| 190 | F | 30.5 | Very low | 36.3 | Very low | 186 Ų | 186 | 145.9 Ų | 145.9 | 82% | 0.816 | 80% | 0.795 | S | S | * | * | trans | -85.5 | 92.8 | 169.9 | -78.9 | -82.7 | 0 | 0 | 0 | 111.5 | L188 T192 | L188-F190 HydrophobicContact CB-CE2 4.33Å; L188-F190 PolarHBondContact O-N 2.93Å; F190-T192 PolarHBondContact O-N 2.95Å | ||
| 191 | K | 30 | Very low | 36.6 | Very low | 189 Ų | 189 | 148.2 Ų | 148.2 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | trans | -78.2 | 102.2 | 167.8 | -178.9 | -179.2 | 177.6 | -178.1 | 0 | 109.4 | Q189 T193 | Q189-K191 PolarHBondContact O-N 3.36Å; K191-T193 PolarHBondContact O-N 2.87Å | ||
| 192 | T | 31.8 | Very low | 36.9 | Very low | 136 Ų | 136 | 147.5 Ų | 147.5 | 83% | 0.834 | 79% | 0.794 | S | S | * | * | trans | -58.5 | 129.8 | 177.3 | -48.2 | 0 | 0 | 0 | 0 | 111.2 | F190 | F190-T192 PolarHBondContact O-N 2.95Š| ||
| 193 | T | 31.7 | Very low | 37 | Very low | 117 Ų | 117 | 148.9 Ų | 148.9 | 72% | 0.718 | 80% | 0.795 | S | S | * | * | trans | -143.1 | 149.6 | 167.3 | -63.2 | 0 | 0 | 0 | 0 | 107.4 | K191 | K191-T193 PolarHBondContact O-N 2.87Š| ||
| 194 | S | 34.8 | Very low | 37.2 | Very low | 102 Ų | 102 | 149.3 Ų | 149.3 | 71% | 0.713 | 80% | 0.803 | S | S | * | * | trans | -92.2 | 178.5 | -161.6 | 47.2 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 195 | I | 38.8 | Very low | 37.2 | Very low | 158 Ų | 158 | 146.5 Ų | 146.5 | 81% | 0.81 | 81% | 0.805 | S | S | * | * | trans | 94.6 | 129.3 | 169.8 | -54.9 | 172.8 | 0 | 0 | 0 | 114.5 | ||||
| 196 | P | 46.2 | Very low | 37.5 | Very low | 112 Ų | 112 | 145.9 Ų | 145.9 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -92.7 | 175 | -177.6 | 39.2 | -37.9 | 0 | 0 | 0 | 113.3 | ||||
| 197 | P | 39.8 | Very low | 37.9 | Very low | 130 Ų | 130 | 144.1 Ų | 144.1 | 84% | 0.844 | 80% | 0.795 | S | S | * | * | -137 | -179.2 | 110.2 | 39.2 | -29.3 | 0 | 0 | 0 | 114.5 | |||||
| 198 | Q | 40.9 | Very low | 38.1 | Very low | 170 Ų | 170 | 143.7 Ų | 143.7 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | trans | -84.1 | 148 | -177.6 | -56 | 175.7 | 2.9 | 0 | 0 | 113.2 | ||||
| 199 | T | 35.2 | Very low | 38.2 | Very low | 145 Ų | 145 | 144.6 Ų | 144.6 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -138.1 | 136 | 146.7 | -45.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 200 | R | 39.3 | Very low | 38.5 | Very low | 203 Ų | 203 | 143.2 Ų | 143.2 | 77% | 0.766 | 79% | 0.791 | S | S | * | * | trans | -106.1 | 145.2 | -175.5 | -64.2 | 168 | 65.9 | -171.6 | 1.5 | 111.2 | ||||
| 201 | S | 36.7 | Very low | 38.8 | Very low | 127 Ų | 127 | 143 Ų | 143 | 89% | 0.888 | 79% | 0.79 | S | S | * | * | trans | -141 | 106.7 | 154.4 | 52 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 202 | S | 41.4 | Very low | 39.3 | Very low | 83 Ų | 83 | 142.1 Ų | 142.1 | 58% | 0.58 | 79% | 0.793 | S | S | * | * | trans | -105.3 | 139.7 | -177.8 | 48.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 203 | L | 41.9 | Very low | 39.8 | Very low | 177 Ų | 177 | 142.2 Ų | 142.2 | 93% | 0.927 | 79% | 0.789 | S | S | * | * | trans | -123.3 | 140.8 | 158.2 | -89.2 | 168.9 | 0 | 0 | 0 | 108.7 | ||||
| 204 | N | 40.3 | Very low | 40 | Very low | 159 Ų | 159 | 142.8 Ų | 142.8 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | trans | -79.5 | 136.9 | -169.7 | -64.3 | -18.4 | 0 | 0 | 0 | 111.4 | ||||
| 205 | A | 38.9 | Very low | 40 | Very low | 94 Ų | 94 | 141.2 Ų | 141.2 | 78% | 0.777 | 80% | 0.796 | S | S | * | * | trans | -120.3 | 123.8 | 151.4 | 0 | 0 | 0 | 0 | 0 | 106.6 | P207 | A205-P207 WeakPolarHBondContact O-CD 3.35Š| ||
| 206 | Q | 42.9 | Very low | 40.3 | Very low | 156 Ų | 156 | 141 Ų | 141 | 73% | 0.729 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 118.2 | 176.4 | 171.6 | 179 | -22.6 | 0 | 0 | 108.5 | D208 | Q206-D208 PolarHBondContact NE2-OD1 3.01Š|
| 207 | P | 43.2 | Very low | 40.2 | Very low | 116 Ų | 116 | 144 Ų | 144 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 117.4 | 163.3 | 33 | -26.6 | 0 | 0 | 0 | 108.8 | A205 | A205-P207 WeakPolarHBondContact O-CD 3.35Š|
| 208 | D | 41.4 | Very low | 40.1 | Very low | 124 Ų | 124 | 144.3 Ų | 144.3 | 66% | 0.663 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 143.3 | 169.4 | -64.4 | -51.8 | 0 | 0 | 0 | 110.5 | Q206 L210 | Q206-D208 PolarHBondContact NE2-OD1 3.01Å; D208-L210 PolarHBondContact O-N 3.32Å |
| 209 | D | 42 | Very low | 40.2 | Very low | 161 Ų | 161 | 146.9 Ų | 146.9 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | trans | -67.4 | 102.6 | -170.3 | -91.5 | -54.5 | 0 | 0 | 0 | 113.6 | ||||
| 210 | L | 41.8 | Very low | 40.6 | Very low | 163 Ų | 163 | 146.1 Ų | 146.1 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | -105.5 | 78.7 | 160.8 | -74.2 | 177.8 | 0 | 0 | 0 | 110.7 | D208 L212 | D208-L210 PolarHBondContact O-N 3.32Å; L210-L212 PolarHBondContact O-N 3.44Å | ||
| 211 | K | 35.3 | Very low | 40.8 | Very low | 180 Ų | 180 | 140.4 Ų | 140.4 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -63.1 | 88 | 176.7 | -178.2 | -175.7 | 175.5 | 178.2 | 0 | 112.2 | ||||
| 212 | L | 41.5 | Very low | 41.1 | Very low | 171 Ų | 171 | 138.9 Ų | 138.9 | 90% | 0.895 | 79% | 0.791 | S | S | * | * | trans | -82.9 | 123.8 | 163.6 | -68.8 | 178.8 | 0 | 0 | 0 | 109.8 | L210 | L210-L212 PolarHBondContact O-N 3.44Š| ||
| 213 | N | 42.5 | Very low | 41.3 | Very low | 139 Ų | 139 | 142.2 Ų | 142.2 | 74% | 0.743 | 80% | 0.801 | S | S | * | * | trans | -112.4 | 97 | -169.3 | -176.4 | 27 | 0 | 0 | 0 | 110.9 | ||||
| 214 | C | 36.1 | Very low | 41.2 | Very low | 128 Ų | 128 | 141 Ų | 141 | 87% | 0.865 | 79% | 0.793 | S | S | * | * | trans | -134.1 | 134.6 | 167.5 | -70.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 215 | G | 34.2 | Very low | 41.2 | Very low | 69 Ų | 69 | 138.3 Ų | 138.3 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | -85.7 | -174.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 216 | D | 44.7 | Very low | 41.6 | Very low | 153 Ų | 153 | 140.8 Ų | 140.8 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -61.7 | 130 | -171.9 | -50.5 | -96 | 0 | 0 | 0 | 114.6 | ||||
| 217 | Q | 43.3 | Very low | 41.5 | Very low | 177 Ų | 177 | 139 Ų | 139 | 83% | 0.827 | 79% | 0.788 | S | S | * | * | trans | -171.1 | 132.5 | 135.3 | -105.9 | 143.9 | 96.7 | 0 | 0 | 113.3 | ||||
| 218 | D | 38 | Very low | 41.6 | Very low | 136 Ų | 136 | 139.7 Ų | 139.7 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | 41.3 | 94.5 | 147.4 | -54.6 | -22 | 0 | 0 | 0 | 120.8 | T220 | D218-T220 VanDerWaalsContact C-N 3.27Å; D218-T220 PolarHBondContact O-N 3.2Å | ||
| 219 | F | 44.2 | Very low | 41.6 | Very low | 224 Ų | 224 | 139.2 Ų | 139.2 | 98% | 0.982 | 79% | 0.794 | S | S | * | * | trans | -70.2 | 75 | 163.2 | -74.8 | -75.2 | 0 | 0 | 0 | 112.8 | A221 | F219-A221 PolarHBondContact O-N 3.46Š| ||
| 220 | T | 42.5 | Very low | 41.8 | Very low | 128 Ų | 128 | 137.6 Ų | 137.6 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | -73.4 | 110.3 | 169.9 | -63.2 | 0 | 0 | 0 | 0 | 110.7 | D218 A222 | D218-T220 VanDerWaalsContact C-N 3.27Å; D218-T220 PolarHBondContact O-N 3.2Å; T220-A222 PolarHBondContact O-N 2.97Å | ||
| 221 | A | 44.3 | Very low | 41.6 | Very low | 84 Ų | 84 | 134.6 Ų | 134.6 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | -76.4 | 117.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | F219 I223 | F219-A221 PolarHBondContact O-N 3.46Å; A221-I223 PolarHBondContact O-N 3.19Å | ||
| 222 | A | 41.8 | Very low | 41.6 | Very low | 95 Ų | 95 | 133.8 Ų | 133.8 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | trans | -71.7 | 109.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | T220 | T220-A222 PolarHBondContact O-N 2.97Š| ||
| 223 | I | 46.5 | Very low | 41.8 | Very low | 153 Ų | 153 | 132 Ų | 132 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | -85.5 | 111.1 | 175.6 | -58.9 | 176.8 | 0 | 0 | 0 | 109.4 | A221 S225 | A221-I223 PolarHBondContact O-N 3.19Å; I223-S225 PolarHBondContact O-N 3.44Å | ||
| 224 | I | 40.1 | Very low | 41.9 | Very low | 150 Ų | 150 | 131.1 Ų | 131.1 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -85.9 | 95.7 | 176.5 | -58.3 | 173.2 | 0 | 0 | 0 | 109.3 | I226 | I224-I226 PolarHBondContact O-N 3.38Š| ||
| 225 | S | 39.3 | Very low | 41.7 | Very low | 103 Ų | 103 | 133 Ų | 133 | 72% | 0.72 | 79% | 0.794 | S | S | * | * | trans | -75.8 | 114 | 172.8 | -65.8 | 0 | 0 | 0 | 0 | 111 | I223 | I223-S225 PolarHBondContact O-N 3.44Š| ||
| 226 | I | 48.6 | Very low | 41.8 | Very low | 147 Ų | 147 | 137.1 Ų | 137.1 | 75% | 0.754 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 125.4 | 176.6 | -57.3 | 174.9 | 0 | 0 | 0 | 109.3 | I224 | I224-I226 PolarHBondContact O-N 3.38Š|
| 227 | P | 39.3 | Very low | 41.2 | Very low | 118 Ų | 118 | 135.7 Ų | 135.7 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -66 | 135.1 | 175.5 | -20.7 | 33.1 | 0 | 0 | 0 | 112.5 | ||
| 228 | T | 46.6 | Very low | 41 | Very low | 131 Ų | 131 | 134.1 Ų | 134.1 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 135.6 | 170.1 | 46.6 | 0 | 0 | 0 | 0 | 111.1 | ||
| 229 | P | 41.6 | Very low | 41.5 | Very low | 114 Ų | 114 | 133 Ų | 133 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 155.1 | 177 | 30.3 | -35.4 | 0 | 0 | 0 | 112.3 | ||
| 230 | P | 45.1 | Very low | 41.7 | Very low | 127 Ų | 127 | 128 Ų | 128 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 154.1 | -179.5 | 30.3 | -35.9 | 0 | 0 | 0 | 112.8 | ||
| 231 | A | 37.6 | Very low | 41.4 | Very low | 99 Ų | 99 | 126.9 Ų | 126.9 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 143.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 232 | N | 36.3 | Very low | 41.5 | Very low | 164 Ų | 164 | 128.8 Ų | 128.8 | 88% | 0.877 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 144.4 | 170.2 | -75.9 | -37 | 0 | 0 | 0 | 111.1 | ||
| 233 | T | 45.8 | Very low | 41.3 | Very low | 132 Ų | 132 | 130.2 Ų | 130.2 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 167.6 | 169 | 49.1 | 0 | 0 | 0 | 0 | 111.7 | ||
| 234 | P | 43.3 | Very low | 41.3 | Very low | 122 Ų | 122 | 128.3 Ų | 128.3 | 79% | 0.792 | 78% | 0.783 | S | S | * | * | -139.8 | 122.3 | 127.5 | 34.8 | -21.5 | 0 | 0 | 0 | 114.7 | |||||
| 235 | D | 32.1 | Very low | 41.3 | Very low | 166 Ų | 166 | 127.4 Ų | 127.4 | 89% | 0.888 | 78% | 0.784 | S | S | * | * | trans | 57.9 | 167.1 | 138.3 | -131.5 | -15.6 | 0 | 0 | 0 | 122.8 | ||||
| 236 | E | 36.3 | Very low | 41.5 | Very low | 156 Ų | 156 | 128.3 Ų | 128.3 | 73% | 0.729 | 79% | 0.788 | S | S | * | * | trans | -118.6 | 141.2 | -155.2 | 178 | 163.6 | 66.4 | 0 | 0 | 114.9 | ||||
| 237 | S | 33.8 | Very low | 40.7 | Very low | 123 Ų | 123 | 124.8 Ų | 124.8 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | -161.2 | 110.2 | 152.8 | 37.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 238 | L | 38.4 | Very low | 40.6 | Very low | 144 Ų | 144 | 127.4 Ų | 127.4 | 75% | 0.754 | 79% | 0.794 | S | S | * | * | trans | -92.3 | -178.2 | 166.9 | -86.5 | 165.8 | 0 | 0 | 0 | 109.7 | ||||
| 239 | P | 48.3 | Very low | 40.2 | Very low | 112 Ų | 112 | 128.9 Ų | 128.9 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | cis | -143.5 | -156.5 | 18.6 | 44 | -22.7 | 0 | 0 | 0 | 114.4 | ||||
| 240 | P | 48 | Very low | 40 | Very low | 121 Ų | 121 | 135.4 Ų | 135.4 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | cis | -119.5 | -166 | -44.2 | 23.8 | -1.5 | 0 | 0 | 0 | 112.9 | ||||
| 241 | S | 36.9 | Very low | 39.4 | Very low | 103 Ų | 103 | 135.9 Ų | 135.9 | 72% | 0.72 | 80% | 0.801 | S | S | * | * | trans | -92.8 | -177.3 | -173.7 | 61 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 242 | P | 45.5 | Very low | 39.2 | Very low | 125 Ų | 125 | 137.8 Ų | 137.8 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | -140 | 165.1 | 82.5 | 36.9 | -20.3 | 0 | 0 | 0 | 117.2 | |||||
| 243 | T | 38.3 | Very low | 39.1 | Very low | 124 Ų | 124 | 141 Ų | 141 | 76% | 0.761 | 80% | 0.803 | S | S | * | * | trans | -94.2 | -172.4 | 171.8 | 48.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 244 | P | 45.8 | Very low | 38.5 | Very low | 113 Ų | 113 | 139.3 Ų | 139.3 | 73% | 0.734 | 80% | 0.802 | S | S | * | * | cis | -125.9 | -152.9 | 7.8 | 37.9 | -13.9 | 0 | 0 | 0 | 112.5 | ||||
| 245 | V | 41.5 | Very low | 38.2 | Very low | 131 Ų | 131 | 140.5 Ų | 140.5 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | cis | -148.4 | 165.2 | 12 | -118.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 246 | P | 42.4 | Very low | 38.3 | Very low | 122 Ų | 122 | 137.1 Ų | 137.1 | 79% | 0.792 | 80% | 0.803 | S | S | * | * | trans | -111 | 152.2 | -170.5 | 39.8 | -32 | 0 | 0 | 0 | 117.4 | ||||
| 247 | G | 33 | Very low | 38.1 | Very low | 74 Ų | 74 | 140.1 Ų | 140.1 | 76% | 0.763 | 81% | 0.809 | S | S | * | * | trans | 89.7 | 135.2 | 138.4 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 248 | I | 36.4 | Very low | 38.2 | Very low | 173 Ų | 173 | 140.9 Ų | 140.9 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | trans | -166.8 | 148.8 | 147.8 | -105 | 157.6 | 0 | 0 | 0 | 109 | ||||
| 249 | L | 39 | Very low | 38.1 | Very low | 162 Ų | 162 | 141.5 Ų | 141.5 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -83.2 | 145.5 | 179.4 | -62.6 | 87 | 0 | 0 | 0 | 112.2 | ||||
| 250 | R | 37 | Very low | 37.5 | Very low | 250 Ų | 250 | 143.4 Ų | 143.4 | 94% | 0.943 | 81% | 0.806 | S | S | * | * | -158.5 | 134.7 | 121.3 | -118.2 | 170.3 | -179.8 | 152.9 | 0.8 | 115.4 | |||||
| 251 | N | 32 | Very low | 37.1 | Very low | 137 Ų | 137 | 144.3 Ų | 144.3 | 73% | 0.733 | 81% | 0.81 | S | S | * | * | trans | -70.9 | 135.4 | 170 | 150 | 49.3 | 0 | 0 | 0 | 111.6 | ||||
| 252 | T | 32.4 | Very low | 37.1 | Very low | 140 Ų | 140 | 145.3 Ų | 145.3 | 86% | 0.859 | 81% | 0.811 | S | S | * | * | trans | -140.6 | 130.8 | 145.7 | -42.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 253 | R | 34.9 | Very low | 36.9 | Very low | 231 Ų | 231 | 149 Ų | 149 | 87% | 0.872 | 82% | 0.815 | S | S | * | * | trans | -110.3 | 122.6 | 177.3 | 170.1 | -161.5 | -167.7 | 173.8 | 5.7 | 109.4 | ||||
| 254 | A | 34.3 | Very low | 37.2 | Very low | 96 Ų | 96 | 150.5 Ų | 150.5 | 79% | 0.793 | 82% | 0.816 | S | S | * | * | trans | -174.8 | 127.1 | 148.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 255 | T | 36.2 | Very low | 37 | Very low | 147 Ų | 147 | 150.8 Ų | 150.8 | 90% | 0.902 | 82% | 0.821 | S | S | * | * | trans | -101.1 | 125 | 157.4 | 47.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 256 | A | 33.7 | Very low | 37.2 | Very low | 95 Ų | 95 | 149.1 Ų | 149.1 | 79% | 0.785 | 82% | 0.815 | S | S | * | * | trans | -153.2 | 146.9 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 257 | Y | 32.7 | Very low | 37.1 | Very low | 220 Ų | 220 | 154.9 Ų | 154.9 | 86% | 0.863 | 84% | 0.838 | S | S | * | * | trans | -60.3 | 158.2 | 166.3 | -72.3 | -102.8 | 0 | 0 | 0 | 109.9 | ||||
| 258 | T | 34.4 | Very low | 37.3 | Very low | 138 Ų | 138 | 159 Ų | 159 | 85% | 0.847 | 84% | 0.842 | S | S | * | * | -150.2 | 167.5 | 57.6 | 46.1 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 259 | H | 37.4 | Very low | 37.4 | Very low | 157 Ų | 157 | 158.2 Ų | 158.2 | 73% | 0.727 | 84% | 0.84 | S | S | * | * | trans | -83.7 | -171 | 166.4 | -168.7 | -110.1 | 0 | 0 | 0 | 111.1 | ||||
| 260 | E | 35.1 | Very low | 37.3 | Very low | 152 Ų | 152 | 158 Ų | 158 | 71% | 0.71 | 84% | 0.839 | S | S | * | * | trans | 81.2 | 103.3 | 168.5 | -52.8 | -81.9 | 110.5 | 0 | 0 | 116.8 | ||||
| 261 | T | 39.9 | Very low | 37.3 | Very low | 141 Ų | 141 | 152.6 Ų | 152.6 | 87% | 0.865 | 83% | 0.833 | S | S | * | * | trans | -80.4 | 127.7 | 161.2 | 50.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 262 | V | 37.3 | Very low | 37.7 | Very low | 123 Ų | 123 | 153.6 Ų | 153.6 | 75% | 0.745 | 84% | 0.839 | S | S | * | * | trans | -129.1 | 125.9 | 159 | -178.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 263 | K | 41.3 | Very low | 38 | Very low | 203 Ų | 203 | 154.5 Ų | 154.5 | 88% | 0.883 | 84% | 0.838 | S | S | * | * | trans | -82.2 | 126.9 | 170.6 | -68.3 | 178.8 | 178.6 | 178.9 | 0 | 109.6 | ||||
| 264 | I | 43.9 | Very low | 38.2 | Very low | 155 Ų | 155 | 149 Ų | 149 | 80% | 0.795 | 84% | 0.835 | S | S | * | * | trans | -135 | 130.8 | 148.5 | -58.9 | -177.1 | 0 | 0 | 0 | 107.5 | ||||
| 265 | S | 42.8 | Very low | 38.5 | Very low | 119 Ų | 119 | 153.1 Ų | 153.1 | 83% | 0.832 | 84% | 0.839 | S | S | * | * | trans | -109.7 | 131.8 | 168.7 | -59.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 266 | S | 45.9 | Very low | 38.7 | Very low | 96 Ų | 96 | 153.6 Ų | 153.6 | 67% | 0.671 | 83% | 0.833 | S | S | * | * | trans | -166.9 | 125.7 | 160.8 | 178.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 267 | L | 40.1 | Very low | 39.2 | Very low | 244 Ų | 244 | 158.9 Ų | 158.9 | 100% | 1.277 | 84% | 0.838 | S | S | * | * | trans | 52.9 | 0 | 160.6 | -60.2 | 169.4 | 0 | 0 | 0 | 116.2 |
Retrieved 267 of 267 residues in 443.3 ms
(Link to these results)