| 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 | 36.3 | Very low | 47 | Very low | 247 Ų | 247 | 132.1 Ų | 132.1 | 100% | 1.217 | 68% | 0.676 | S | S | * | * | 0 | 85.6 | 0 | -64.4 | 163 | 73.6 | 0 | 0 | 109.4 | |||||
| 2 | K | 46.6 | Very low | 47.5 | Very low | 218 Ų | 218 | 127.3 Ų | 127.3 | 95% | 0.948 | 65% | 0.652 | S | S | * | * | trans | -122.3 | 114.9 | -176.7 | -79.2 | 173 | 174.8 | 173.2 | 0 | 106.7 | ||||
| 3 | G | 40.3 | Very low | 47.8 | Very low | 55 Ų | 55 | 121 Ų | 121 | 57% | 0.567 | 62% | 0.62 | S | S | * | * | trans | 170.2 | -18.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | K5 | G3-K5 PolarHBondContact O-N 3.05Š| ||
| 4 | M | 44.3 | Very low | 47.7 | Very low | 155 Ų | 155 | 121.1 Ų | 121.1 | 76% | 0.764 | 61% | 0.614 | S | S | * | * | trans | -89.8 | -2.2 | -167.6 | -132.5 | 152.5 | 72.9 | 0 | 0 | 115.9 | L8 | M4-L8 PolarHBondContact O-N 3.41Š| ||
| 5 | K | 54.5 | Low | 47.9 | Very low | 176 Ų | 176 | 115.4 Ų | 115.4 | 77% | 0.765 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -78.3 | -43.4 | -172.4 | -62.6 | -178.7 | -179.2 | 179.7 | 0 | 115.2 | G3 I9 | G3-K5 PolarHBondContact O-N 3.05Å; K5-I9 WeakPolarHBondContact O-CG1 3.31Å; K5-I9 PolarHBondContact O-N 3.29Å |
| 6 | P | 49.6 | Very low | 48.1 | Very low | 86 Ų | 86 | 111.4 Ų | 111.4 | 56% | 0.558 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -75 | -31.7 | -179.6 | 29.3 | -33.1 | 0 | 0 | 0 | 111.9 | L8 I9 L10 | P6-L8 VanDerWaalsContact C-N 3.33Å; P6-L8 PolarHBondContact O-N 3.14Å; P6-I9 PolarHBondContact O-N 2.95Å; P6-L10 WeakPolarHBondContact O-CB 3.44Å; P6-L10 PolarHBondContact O-N 3.32Å |
| 7 | H | 41.9 | Very low | 47.9 | Very low | 129 Ų | 129 | 110.4 Ų | 110.4 | 60% | 0.597 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -65.1 | -36.1 | 175.6 | -76.3 | -66.8 | 0 | 0 | 0 | 112.4 | L10 L11 | H7-L10 PolarHBondContact O-N 3.42Å; H7-L11 WeakPolarHBondContact O-CB 3.42Å; H7-L11 PolarHBondContact O-N 3.27Å |
| 8 | L | 50.8 | Low | 47.8 | Very low | 71 Ų | 71 | 110.2 Ų | 110.2 | 37% | 0.372 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.2 | -38.9 | 177.3 | -150.6 | 100.2 | 0 | 0 | 0 | 111.9 | M4 P6 L11 L12 F50 | M4-L8 PolarHBondContact O-N 3.41Å; P6-L8 VanDerWaalsContact C-N 3.33Å; P6-L8 PolarHBondContact O-N 3.14Å; L8-L11 PolarHBondContact O-N 3.14Å; L8-L12 VanDerWaalsContact O-CB 3.3Å; L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 PolarHBondContact O-N 3.13Å; L8-F50 HydrophobicContact CD2-CE1 4.5Å; L8-F50 HydrophobicContact CD2-CE2 4.4Å; L8-F50 HydrophobicContact CD2-CZ 3.74Å |
| 9 | I | 53.3 | Low | 47.7 | Very low | 106 Ų | 106 | 106.1 Ų | 106.1 | 54% | 0.544 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -68.9 | -41.7 | 176.7 | -63.7 | 165.8 | 0 | 0 | 0 | 110.2 | K5 P6 L11 L12 L13 | K5-I9 WeakPolarHBondContact O-CG1 3.31Å; K5-I9 PolarHBondContact O-N 3.29Å; P6-I9 PolarHBondContact O-N 2.95Å; I9-L11 VanDerWaalsContact C-N 3.35Å; I9-L12 PolarHBondContact O-N 2.88Å; I9-L13 HydrophobicContact CG2-CD1 3.98Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CD1 3.41Å; I9-L13 WeakPolarHBondContact O-CG 3.3Å; I9-L13 PolarHBondContact O-N 3.04Å |
| 10 | L | 48.2 | Very low | 47.2 | Very low | 93 Ų | 93 | 103.8 Ų | 103.8 | 49% | 0.487 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.3 | -41.1 | 174.9 | -168.5 | 78.5 | 0 | 0 | 0 | 111.5 | P6 H7 L13 F14 | P6-L10 WeakPolarHBondContact O-CB 3.44Å; P6-L10 PolarHBondContact O-N 3.32Å; H7-L10 PolarHBondContact O-N 3.42Å; L10-L13 WeakPolarHBondContact O-CB 3.36Å; L10-L13 PolarHBondContact O-N 3.16Å; L10-F14 HydrophobicContact CG-CD2 4.19Å; L10-F14 HydrophobicContact CG-CE2 4.41Å; L10-F14 WeakPolarHBondContact O-CB 3.49Å; L10-F14 WeakPolarHBondContact O-CD2 3.38Å; L10-F14 PolarHBondContact O-N 2.9Å |
| 11 | L | 51.5 | Low | 46.8 | Very low | 117 Ų | 117 | 104.5 Ų | 104.5 | 61% | 0.613 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -69.3 | -38.9 | 178.3 | -159.7 | 112.9 | 0 | 0 | 0 | 111.5 | H7 L8 I9 L13 F14 A15 | H7-L11 WeakPolarHBondContact O-CB 3.42Å; H7-L11 PolarHBondContact O-N 3.27Å; L8-L11 PolarHBondContact O-N 3.14Å; I9-L11 VanDerWaalsContact C-N 3.35Å; L11-L13 VanDerWaalsContact C-N 3.32Å; L11-F14 PolarHBondContact O-N 3.15Å; L11-A15 WeakPolarHBondContact O-CB 3.38Å; L11-A15 PolarHBondContact O-N 2.69Å |
| 12 | L | 52.6 | Low | 46.7 | Very low | 75 Ų | 75 | 97.3 Ų | 97.3 | 39% | 0.393 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.2 | -39 | 172.9 | -162.9 | 98.2 | 0 | 0 | 0 | 111.6 | L8 I9 S16 F50 | L8-L12 VanDerWaalsContact O-CB 3.3Å; L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 PolarHBondContact O-N 3.13Å; I9-L12 PolarHBondContact O-N 2.88Å; L12-S16 WeakPolarHBondContact O-CB 3.46Å; L12-S16 PolarHBondContact O-N 3.43Å; L12-S16 VanDerWaalsContact O-N 3.08Å; L12-S16 PolarHBondContact O-OG 3.19Å; L12-F50 HydrophobicContact CD1-CD2 4.09Å; L12-F50 HydrophobicContact CD1-CE2 3.27Å; L12-F50 HydrophobicContact CD1-CZ 3.55Å |
| 13 | L | 51.5 | Low | 46.1 | Very low | 45 Ų | 45 | 90.5 Ų | 90.5 | 24% | 0.236 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -67.3 | -43.4 | 175.2 | -84.5 | 161.2 | 0 | 0 | 0 | 111.9 | I9 L10 L11 S16 L17 F146 L149 | I9-L13 HydrophobicContact CG2-CD1 3.98Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CD1 3.41Å; I9-L13 WeakPolarHBondContact O-CG 3.3Å; I9-L13 PolarHBondContact O-N 3.04Å; L10-L13 WeakPolarHBondContact O-CB 3.36Å; L10-L13 PolarHBondContact O-N 3.16Å; L11-L13 VanDerWaalsContact C-N 3.32Å; L13-S16 PolarHBondContact O-N 2.85Å; L13-L17 PolarHBondContact O-N 3.32Å; L13-F146 HydrophobicContact CD2-CD1 3.56Å; L13-F146 HydrophobicContact CD2-CE1 3.33Å; L13-F146 HydrophobicContact CD2-CG 4.33Å; L13-F146 HydrophobicContact CD2-CZ 3.87Å; L13-L149 HydrophobicContact CD2-CD2 4.48Å |
| 14 | F | 46.7 | Very low | 46 | Very low | 123 Ų | 123 | 96.9 Ų | 96.9 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.1 | -41 | 176.5 | -100.5 | -84.3 | 0 | 0 | 0 | 112.8 | L10 L11 S16 L17 L18 | L10-F14 HydrophobicContact CG-CD2 4.19Å; L10-F14 HydrophobicContact CG-CE2 4.41Å; L10-F14 WeakPolarHBondContact O-CB 3.49Å; L10-F14 WeakPolarHBondContact O-CD2 3.38Å; L10-F14 PolarHBondContact O-N 2.9Å; L11-F14 PolarHBondContact O-N 3.15Å; F14-S16 VanDerWaalsContact C-N 3.31Å; F14-S16 PolarHBondContact O-N 2.89Å; F14-L17 WeakPolarHBondContact O-CB 3.41Å; F14-L17 PolarHBondContact O-N 3.09Å; F14-L18 PolarHBondContact O-N 2.84Å |
| 15 | A | 51.1 | Low | 45.4 | Very low | 35 Ų | 35 | 94.8 Ų | 94.8 | 29% | 0.289 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.2 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L11 L17 L18 C19 | L11-A15 WeakPolarHBondContact O-CB 3.38Å; L11-A15 PolarHBondContact O-N 2.69Å; A15-L17 VanDerWaalsContact C-N 3.34Å; A15-L18 PolarHBondContact O-N 3.07Å; A15-C19 PolarHBondContact O-N 2.93Å |
| 16 | S | 50.1 | Low | 44.5 | Very low | 52 Ų | 52 | 97.2 Ų | 97.2 | 36% | 0.364 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.3 | -32.8 | 175.1 | -58.2 | 0 | 0 | 0 | 0 | 112.5 | L12 L13 F14 C19 A20 | L12-S16 WeakPolarHBondContact O-CB 3.46Å; L12-S16 PolarHBondContact O-N 3.43Å; L12-S16 VanDerWaalsContact O-N 3.08Å; L12-S16 PolarHBondContact O-OG 3.19Å; L13-S16 PolarHBondContact O-N 2.85Å; F14-S16 VanDerWaalsContact C-N 3.31Å; F14-S16 PolarHBondContact O-N 2.89Å; S16-C19 PolarHBondContact O-N 3.42Å; S16-A20 WeakPolarHBondContact O-CB 3.35Å; S16-A20 PolarHBondContact O-N 3.48Å |
| 17 | L | 45.9 | Very low | 43.9 | Very low | 93 Ų | 93 | 102.4 Ų | 102.4 | 49% | 0.487 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.4 | -43.8 | 175.3 | -152 | 83.7 | 0 | 0 | 0 | 111.3 | L13 F14 A15 A20 E21 | L13-L17 PolarHBondContact O-N 3.32Å; F14-L17 WeakPolarHBondContact O-CB 3.41Å; F14-L17 PolarHBondContact O-N 3.09Å; A15-L17 VanDerWaalsContact C-N 3.34Å; L17-A20 PolarHBondContact O-N 3.43Å; L17-E21 PolarHBondContact O-N 3.43Å |
| 18 | L | 46.1 | Very low | 43.4 | Very low | 107 Ų | 107 | 103.7 Ų | 103.7 | 56% | 0.56 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.6 | -37.5 | 176.1 | -74.6 | 161.4 | 0 | 0 | 0 | 112.1 | F14 A15 E21 T22 | F14-L18 PolarHBondContact O-N 2.84Å; A15-L18 PolarHBondContact O-N 3.07Å; L18-E21 PolarHBondContact O-N 2.8Å; L18-T22 WeakPolarHBondContact O-CG2 3.5Å; L18-T22 PolarHBondContact O-N 2.9Å; L18-T22 PolarHBondContact O-OG1 3.01Å |
| 19 | C | 45.1 | Very low | 42.7 | Very low | 33 Ų | 33 | 105.2 Ų | 105.2 | 22% | 0.223 | 56% | 0.559 | C | S | . | * | H | α-helix | trans | -66.5 | -36.6 | 172.3 | -79.2 | 0 | 0 | 0 | 0 | 113.1 | A15 S16 T22 A23 | A15-C19 PolarHBondContact O-N 2.93Å; S16-C19 PolarHBondContact O-N 3.42Å; C19-T22 WeakPolarHBondContact CA-OG1 3.39Å; C19-T22 PolarHBondContact O-OG1 3.46Å; C19-T22 VanDerWaalsContact O-OG1 3.1Å; C19-A23 WeakPolarHBondContact O-CB 3.36Å; C19-A23 PolarHBondContact O-N 3.17Å; C19-A23 VanDerWaalsContact O-N 3.08Å |
| 20 | A | 37.8 | Very low | 41.9 | Very low | 60 Ų | 60 | 105.4 Ų | 105.4 | 50% | 0.496 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -70.1 | -34.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S16 L17 R24 | S16-A20 WeakPolarHBondContact O-CB 3.35Å; S16-A20 PolarHBondContact O-N 3.48Å; L17-A20 PolarHBondContact O-N 3.43Å; A20-R24 PolarHBondContact O-N 3.31Å |
| 21 | E | 39.1 | Very low | 41.3 | Very low | 118 Ų | 118 | 106.2 Ų | 106.2 | 55% | 0.551 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -72.9 | -38.3 | 175.4 | -74.6 | -166.4 | 156.2 | 0 | 0 | 112.7 | L17 L18 R24 | L17-E21 PolarHBondContact O-N 3.43Å; L18-E21 PolarHBondContact O-N 2.8Å; E21-R24 WeakPolarHBondContact O-CB 3.31Å; E21-R24 PolarHBondContact O-N 3.46Å; E21-R24 VanDerWaalsContact O-N 3.09Å |
| 22 | T | 33.6 | Very low | 40.6 | Very low | 97 Ų | 97 | 108.9 Ų | 108.9 | 60% | 0.595 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -70.7 | -31.5 | 176.2 | 46.3 | 0 | 0 | 0 | 0 | 113.1 | L18 C19 R24 S25 | L18-T22 WeakPolarHBondContact O-CG2 3.5Å; L18-T22 PolarHBondContact O-N 2.9Å; L18-T22 PolarHBondContact O-OG1 3.01Å; C19-T22 WeakPolarHBondContact CA-OG1 3.39Å; C19-T22 PolarHBondContact O-OG1 3.46Å; C19-T22 VanDerWaalsContact O-OG1 3.1Å; T22-R24 PolarHBondContact O-N 3.3Å; T22-S25 PolarHBondContact O-N 2.89Å |
| 23 | A | 33.8 | Very low | 39.7 | Very low | 74 Ų | 74 | 110.9 Ų | 110.9 | 61% | 0.612 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -67.5 | -22.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | C19 S25 | C19-A23 WeakPolarHBondContact O-CB 3.36Å; C19-A23 PolarHBondContact O-N 3.17Å; C19-A23 VanDerWaalsContact O-N 3.08Å; A23-S25 VanDerWaalsContact C-N 3.34Å |
| 24 | R | 37.5 | Very low | 39.3 | Very low | 189 Ų | 189 | 112.2 Ų | 112.2 | 71% | 0.713 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -76.1 | -20.3 | 179.9 | -141.2 | 173.4 | -175.3 | 170.6 | 0.2 | 113.2 | A20 E21 T22 | A20-R24 PolarHBondContact O-N 3.31Å; E21-R24 WeakPolarHBondContact O-CB 3.31Å; E21-R24 PolarHBondContact O-N 3.46Å; E21-R24 VanDerWaalsContact O-N 3.09Å; T22-R24 PolarHBondContact O-N 3.3Å |
| 25 | S | 31.7 | Very low | 38.9 | Very low | 111 Ų | 111 | 114.3 Ų | 114.3 | 78% | 0.776 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.2 | -7.5 | -179.5 | -169.7 | 0 | 0 | 0 | 0 | 114.3 | T22 A23 | T22-S25 PolarHBondContact O-N 2.89Å; A23-S25 VanDerWaalsContact C-N 3.34Å |
| 26 | R | 37.6 | Very low | 38.4 | Very low | 228 Ų | 228 | 121.9 Ų | 121.9 | 86% | 0.86 | 63% | 0.634 | S | S | * | * | trans | -126.2 | 60.7 | -175.3 | -150.4 | 176.7 | -161.8 | 174 | 5.6 | 111.2 | D28 | R26-D28 PolarHBondContact O-N 3.08Š| ||
| 27 | K | 36.6 | Very low | 38.2 | Very low | 194 Ų | 194 | 129.6 Ų | 129.6 | 84% | 0.843 | 66% | 0.655 | S | S | * | * | trans | -88.4 | 85.1 | 169 | -169.9 | -177.4 | -177.2 | -174.8 | 0 | 108.4 | ||||
| 28 | D | 30.1 | Very low | 38 | Very low | 156 Ų | 156 | 128 Ų | 128 | 83% | 0.834 | 66% | 0.656 | S | S | * | * | trans | -145.1 | 141.5 | 152.9 | -89.2 | -39.3 | 0 | 0 | 0 | 110.9 | R26 | R26-D28 PolarHBondContact O-N 3.08Š| ||
| 29 | S | 36.8 | Very low | 37.7 | Very low | 104 Ų | 104 | 124.5 Ų | 124.5 | 73% | 0.727 | 64% | 0.642 | S | S | * | * | trans | -49.3 | 149.4 | -168.3 | 54.6 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 30 | T | 35.8 | Very low | 37.8 | Very low | 110 Ų | 110 | 127.6 Ų | 127.6 | 68% | 0.675 | 66% | 0.656 | S | S | * | * | trans | 123.9 | 128.1 | 135.1 | -60 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 31 | N | 35.4 | Very low | 38.4 | Very low | 110 Ų | 110 | 126.2 Ų | 126.2 | 59% | 0.588 | 65% | 0.648 | S | S | * | * | trans | 81.9 | 131.4 | 158.2 | -92.7 | -23.4 | 0 | 0 | 0 | 121.1 | N33 S34 | N31-N33 PolarHBondContact O-N 3.47Å; N31-S34 WeakPolarHBondContact O-CB 3.41Å; N31-S34 PolarHBondContact O-N 3.17Å; N31-S34 PolarHBondContact O-OG 2.97Å | ||
| 32 | Q | 37.4 | Very low | 38.7 | Very low | 172 Ų | 172 | 126 Ų | 126 | 80% | 0.804 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -46.7 | -17.1 | 171 | -75.2 | 171.1 | -45.4 | 0 | 0 | 114.8 | S34 F35 | Q32-S34 VanDerWaalsContact C-N 3.29Å; Q32-S34 PolarHBondContact O-N 2.96Å; Q32-F35 PolarHBondContact O-N 3.48Å |
| 33 | N | 35 | Very low | 39.3 | Very low | 117 Ų | 117 | 129.7 Ų | 129.7 | 63% | 0.626 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -72.3 | -19 | 175 | -69.9 | -15 | 0 | 0 | 0 | 113.8 | N31 R37 | N31-N33 PolarHBondContact O-N 3.47Å; N33-R37 PolarHBondContact O-N 3.03Å |
| 34 | S | 42.2 | Very low | 40.2 | Very low | 73 Ų | 73 | 132.5 Ų | 132.5 | 51% | 0.51 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -71.5 | -31.4 | 174.4 | 59.5 | 0 | 0 | 0 | 0 | 112.5 | N31 Q32 R37 A38 | N31-S34 WeakPolarHBondContact O-CB 3.41Å; N31-S34 PolarHBondContact O-N 3.17Å; N31-S34 PolarHBondContact O-OG 2.97Å; Q32-S34 VanDerWaalsContact C-N 3.29Å; Q32-S34 PolarHBondContact O-N 2.96Å; S34-R37 PolarHBondContact O-N 2.73Å; S34-A38 WeakPolarHBondContact O-CA 3.34Å; S34-A38 WeakPolarHBondContact O-CB 3.23Å; S34-A38 PolarHBondContact O-N 3.47Å |
| 35 | F | 37.8 | Very low | 40.8 | Very low | 167 Ų | 167 | 127.4 Ų | 127.4 | 73% | 0.732 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -71.4 | -38.9 | -179.6 | -154.7 | -92.2 | 0 | 0 | 0 | 111.9 | Q32 A39 | Q32-F35 PolarHBondContact O-N 3.48Å; F35-A39 WeakPolarHBondContact O-CB 3.4Å; F35-A39 PolarHBondContact O-N 3.44Å |
| 36 | R | 40.2 | Very low | 41.4 | Very low | 194 Ų | 194 | 125 Ų | 125 | 73% | 0.732 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -68.4 | -37.6 | 172.7 | -77.5 | 175.8 | 67.8 | 165.1 | 0.3 | 112.2 | N40 | R36-N40 VanDerWaalsContact O-CB 3.27Å; R36-N40 WeakPolarHBondContact O-CB 3.28Å; R36-N40 VanDerWaalsContact O-CG 3.24Å; R36-N40 PolarHBondContact O-N 2.99Å |
| 37 | R | 46.2 | Very low | 41.8 | Very low | 214 Ų | 214 | 117.1 Ų | 117.1 | 81% | 0.808 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -71.3 | -38.6 | 175.1 | -104.5 | 179.6 | 176.6 | 158.7 | -0.5 | 112.8 | N33 S34 G41 | N33-R37 PolarHBondContact O-N 3.03Å; S34-R37 PolarHBondContact O-N 2.73Å; R37-G41 PolarHBondContact O-N 3.32Å |
| 38 | A | 43.3 | Very low | 42.6 | Very low | 61 Ų | 61 | 114.8 Ų | 114.8 | 50% | 0.504 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -71 | -41 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | S34 G41 F42 | S34-A38 WeakPolarHBondContact O-CA 3.34Å; S34-A38 WeakPolarHBondContact O-CB 3.23Å; S34-A38 PolarHBondContact O-N 3.47Å; A38-G41 CarbonylContact O-C 3.6Å; A38-G41 PolarHBondContact O-N 3.47Å; A38-F42 VanDerWaalsContact O-CB 3.31Å; A38-F42 WeakPolarHBondContact O-CB 3.4Å; A38-F42 PolarHBondContact O-N 3.44Å |
| 39 | A | 39.1 | Very low | 43.6 | Very low | 32 Ų | 32 | 112.1 Ų | 112.1 | 26% | 0.264 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.5 | -49.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | F35 G41 F42 Y43 | F35-A39 WeakPolarHBondContact O-CB 3.4Å; F35-A39 PolarHBondContact O-N 3.44Å; A39-G41 VanDerWaalsContact C-N 3.3Å; A39-G41 PolarHBondContact O-N 2.95Å; A39-F42 CarbonylContact O-C 3.59Å; A39-F42 WeakPolarHBondContact O-CB 3.1Å; A39-F42 PolarHBondContact O-N 3.23Å; A39-F42 VanDerWaalsContact O-N 3.12Å; A39-Y43 WeakPolarHBondContact O-CB 3.22Å; A39-Y43 WeakPolarHBondContact O-CD2 3.24Å; A39-Y43 PolarHBondContact O-N 3.24Å |
| 40 | N | 47.5 | Very low | 44.4 | Very low | 99 Ų | 99 | 108.6 Ų | 108.6 | 53% | 0.529 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.4 | -36.7 | 176.2 | -76.3 | 2.5 | 0 | 0 | 0 | 112.4 | R36 Y43 Q44 | R36-N40 VanDerWaalsContact O-CB 3.27Å; R36-N40 WeakPolarHBondContact O-CB 3.28Å; R36-N40 VanDerWaalsContact O-CG 3.24Å; R36-N40 PolarHBondContact O-N 2.99Å; N40-Y43 PolarHBondContact O-N 2.83Å; N40-Q44 WeakPolarHBondContact O-CB 3.27Å; N40-Q44 VanDerWaalsContact O-CG 3.3Å; N40-Q44 WeakPolarHBondContact O-CG 3.23Å; N40-Q44 PolarHBondContact O-N 3.44Å |
| 41 | G | 49.9 | Very low | 45.2 | Very low | 31 Ų | 31 | 105.1 Ų | 105.1 | 32% | 0.32 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.3 | -36.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | R37 A38 A39 M45 | R37-G41 PolarHBondContact O-N 3.32Å; A38-G41 CarbonylContact O-C 3.6Å; A38-G41 PolarHBondContact O-N 3.47Å; A39-G41 VanDerWaalsContact C-N 3.3Å; A39-G41 PolarHBondContact O-N 2.95Å; G41-M45 WeakPolarHBondContact O-CB 3.32Å; G41-M45 PolarHBondContact O-N 2.85Å |
| 42 | F | 46.3 | Very low | 46.2 | Very low | 114 Ų | 114 | 107.2 Ų | 107.2 | 50% | 0.5 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -70.3 | -40.2 | 175.1 | -140.4 | -98.7 | 0 | 0 | 0 | 111.2 | A38 A39 M45 L46 | A38-F42 VanDerWaalsContact O-CB 3.31Å; A38-F42 WeakPolarHBondContact O-CB 3.4Å; A38-F42 PolarHBondContact O-N 3.44Å; A39-F42 CarbonylContact O-C 3.59Å; A39-F42 WeakPolarHBondContact O-CB 3.1Å; A39-F42 PolarHBondContact O-N 3.23Å; A39-F42 VanDerWaalsContact O-N 3.12Å; F42-M45 PolarHBondContact O-N 3.2Å; F42-L46 HydrophobicContact CD1-CD1 3.43Å; F42-L46 VanDerWaalsContact CD1-CD1 3.43Å; F42-L46 HydrophobicContact CE1-CD1 3.5Å; F42-L46 VanDerWaalsContact CE1-CD1 3.5Å; F42-L46 HydrophobicContact CG-CD1 4.4Å; F42-L46 VanDerWaalsContact O-CB 3.29Å; F42-L46 WeakPolarHBondContact O-CB 3.48Å; F42-L46 WeakPolarHBondContact O-CD1 3.36Å; F42-L46 PolarHBondContact O-N 2.91Å |
| 43 | Y | 45.7 | Very low | 47 | Very low | 173 Ų | 173 | 105.9 Ų | 105.9 | 68% | 0.678 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.4 | -41.2 | 173.4 | -83.8 | -70.9 | 0 | 0 | 0 | 111.8 | A39 N40 S47 | A39-Y43 WeakPolarHBondContact O-CB 3.22Å; A39-Y43 WeakPolarHBondContact O-CD2 3.24Å; A39-Y43 PolarHBondContact O-N 3.24Å; N40-Y43 PolarHBondContact O-N 2.83Å; Y43-S47 WeakPolarHBondContact O-CB 3.46Å; Y43-S47 PolarHBondContact O-N 3.35Å |
| 44 | Q | 52.3 | Low | 47.9 | Very low | 133 Ų | 133 | 103.7 Ų | 103.7 | 62% | 0.621 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -69.7 | -36.9 | 175.6 | -78 | 173.5 | -17.6 | 0 | 0 | 112.1 | N40 S47 N48 | N40-Q44 WeakPolarHBondContact O-CB 3.27Å; N40-Q44 VanDerWaalsContact O-CG 3.3Å; N40-Q44 WeakPolarHBondContact O-CG 3.23Å; N40-Q44 PolarHBondContact O-N 3.44Å; Q44-S47 PolarHBondContact O-N 3.47Å; Q44-N48 VanDerWaalsContact O-CB 3.28Å; Q44-N48 WeakPolarHBondContact O-CB 3.5Å; Q44-N48 PolarHBondContact O-N 2.9Å |
| 45 | M | 49.7 | Very low | 48.3 | Very low | 83 Ų | 83 | 103 Ų | 103 | 41% | 0.409 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -72.7 | -39.9 | 176.5 | -170.3 | 171.7 | -176.1 | 0 | 0 | 111.9 | G41 F42 I49 | G41-M45 WeakPolarHBondContact O-CB 3.32Å; G41-M45 PolarHBondContact O-N 2.85Å; F42-M45 PolarHBondContact O-N 3.2Å; M45-I49 HydrophobicContact CE-CD1 3.81Å; M45-I49 HydrophobicContact CG-CD1 3.6Å; M45-I49 HydrophobicContact CG-CG1 4.46Å; M45-I49 WeakPolarHBondContact O-CB 3.47Å; M45-I49 VanDerWaalsContact O-CG1 3.24Å; M45-I49 WeakPolarHBondContact O-CG1 3.21Å; M45-I49 PolarHBondContact O-N 3.36Å |
| 46 | L | 45.1 | Very low | 49.1 | Very low | 60 Ų | 60 | 104 Ų | 104 | 31% | 0.314 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 169.5 | -106.4 | 88.8 | 0 | 0 | 0 | 111.5 | F42 F50 | F42-L46 HydrophobicContact CD1-CD1 3.43Å; F42-L46 VanDerWaalsContact CD1-CD1 3.43Å; F42-L46 HydrophobicContact CE1-CD1 3.5Å; F42-L46 VanDerWaalsContact CE1-CD1 3.5Å; F42-L46 HydrophobicContact CG-CD1 4.4Å; F42-L46 VanDerWaalsContact O-CB 3.29Å; F42-L46 WeakPolarHBondContact O-CB 3.48Å; F42-L46 WeakPolarHBondContact O-CD1 3.36Å; F42-L46 PolarHBondContact O-N 2.91Å; L46-F50 WeakPolarHBondContact O-CA 3.3Å; L46-F50 WeakPolarHBondContact O-CB 3.44Å; L46-F50 PolarHBondContact O-N 3.48Å |
| 47 | S | 46.7 | Very low | 49.7 | Very low | 63 Ų | 63 | 95.9 Ų | 95.9 | 44% | 0.441 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.7 | -47.9 | 179 | 178.5 | 0 | 0 | 0 | 0 | 111.4 | Y43 Q44 G51 | Y43-S47 WeakPolarHBondContact O-CB 3.46Å; Y43-S47 PolarHBondContact O-N 3.35Å; Q44-S47 PolarHBondContact O-N 3.47Å; S47-G51 PolarHBondContact O-N 3.32Å |
| 48 | N | 51.6 | Low | 49.8 | Very low | 145 Ų | 145 | 88.5 Ų | 88.5 | 78% | 0.775 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -71.1 | -32.5 | -179.8 | -87 | -3.9 | 0 | 0 | 0 | 114.1 | Q44 | Q44-N48 VanDerWaalsContact O-CB 3.28Å; Q44-N48 WeakPolarHBondContact O-CB 3.5Å; Q44-N48 PolarHBondContact O-N 2.9Å |
| 49 | I | 51 | Low | 50.2 | Low | 99 Ų | 99 | 93 Ų | 93 | 51% | 0.508 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -92.9 | -31.2 | -176.1 | -65 | 175 | 0 | 0 | 0 | 111.8 | M45 | M45-I49 HydrophobicContact CE-CD1 3.81Å; M45-I49 HydrophobicContact CG-CD1 3.6Å; M45-I49 HydrophobicContact CG-CG1 4.46Å; M45-I49 WeakPolarHBondContact O-CB 3.47Å; M45-I49 VanDerWaalsContact O-CG1 3.24Å; M45-I49 WeakPolarHBondContact O-CG1 3.21Å; M45-I49 PolarHBondContact O-N 3.36Å |
| 50 | F | 54.7 | Low | 51 | Low | 31 Ų | 31 | 98.8 Ų | 98.8 | 14% | 0.136 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -106 | -17.4 | -166.5 | -129.6 | -109.8 | 0 | 0 | 0 | 114.2 | L8 L12 L46 N54 I55 L58 | L8-F50 HydrophobicContact CD2-CE1 4.5Å; L8-F50 HydrophobicContact CD2-CE2 4.4Å; L8-F50 HydrophobicContact CD2-CZ 3.74Å; L12-F50 HydrophobicContact CD1-CD2 4.09Å; L12-F50 HydrophobicContact CD1-CE2 3.27Å; L12-F50 HydrophobicContact CD1-CZ 3.55Å; L46-F50 WeakPolarHBondContact O-CA 3.3Å; L46-F50 WeakPolarHBondContact O-CB 3.44Å; L46-F50 PolarHBondContact O-N 3.48Å; F50-N54 HydrophobicContact CD1-CB 3.67Å; F50-N54 HydrophobicContact CE1-CB 4Å; F50-N54 WeakPolarHBondContact CE1-ND2 3.44Å; F50-N54 WeakPolarHBondContact O-CB 3.21Å; F50-I55 HydrophobicContact CB-CG1 4.34Å; F50-L58 HydrophobicContact CD1-CD1 4.45Å; F50-L58 HydrophobicContact CE1-CD1 3.63Å; F50-L58 HydrophobicContact CZ-CD1 4.19Å |
| 51 | G | 51.4 | Low | 51.3 | Low | 36 Ų | 36 | 101.3 Ų | 101.3 | 37% | 0.371 | 50% | 0.497 | S | S | . | . | trans | 68.9 | 140 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S47 D53 N54 I55 | S47-G51 PolarHBondContact O-N 3.32Å; G51-D53 PolarHBondContact O-N 2.86Å; G51-D53 VanDerWaalsContact O-N 3.13Å; G51-N54 PolarHBondContact O-N 3.35Å; G51-I55 PolarHBondContact O-N 2.95Å | ||
| 52 | E | 56.4 | Low | 51.6 | Low | 154 Ų | 154 | 103.9 Ų | 103.9 | 72% | 0.72 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -57 | -32.9 | -171.4 | -160.5 | 166.9 | -176.2 | 0 | 0 | 113.4 | R56 | E52-R56 PolarHBondContact O-N 2.85Å |
| 53 | D | 54.7 | Low | 51.9 | Low | 145 Ų | 145 | 101 Ų | 101 | 78% | 0.775 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -68.6 | -34.3 | 178.2 | -63.8 | -43.6 | 0 | 0 | 0 | 113.4 | G51 G57 | G51-D53 PolarHBondContact O-N 2.86Å; G51-D53 VanDerWaalsContact O-N 3.13Å; D53-G57 PolarHBondContact O-N 2.79Å |
| 54 | N | 53.6 | Low | 52.3 | Low | 70 Ų | 70 | 98 Ų | 98 | 37% | 0.374 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -84.7 | -27.3 | -176.5 | -136 | 30.4 | 0 | 0 | 0 | 111.2 | F50 G51 G57 L58 | F50-N54 HydrophobicContact CD1-CB 3.67Å; F50-N54 HydrophobicContact CE1-CB 4Å; F50-N54 WeakPolarHBondContact CE1-ND2 3.44Å; F50-N54 WeakPolarHBondContact O-CB 3.21Å; G51-N54 PolarHBondContact O-N 3.35Å; N54-G57 CarbonylContact O-C 3.59Å; N54-G57 PolarHBondContact O-N 3.33Å; N54-L58 WeakPolarHBondContact O-CB 3.38Å; N54-L58 PolarHBondContact O-N 2.86Å |
| 55 | I | 52.4 | Low | 52.3 | Low | 60 Ų | 60 | 95.5 Ų | 95.5 | 31% | 0.308 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.4 | -42.2 | 168.8 | -66.1 | 169.9 | 0 | 0 | 0 | 110.2 | F50 G51 G57 L58 Y59 | F50-I55 HydrophobicContact CB-CG1 4.34Å; G51-I55 PolarHBondContact O-N 2.95Å; I55-G57 VanDerWaalsContact C-N 3.32Å; I55-G57 PolarHBondContact O-N 3.18Å; I55-L58 PolarHBondContact O-N 3.45Å; I55-Y59 WeakPolarHBondContact O-CB 3.35Å; I55-Y59 PolarHBondContact O-N 2.93Å |
| 56 | R | 52.6 | Low | 52.4 | Low | 187 Ų | 187 | 92.3 Ų | 92.3 | 71% | 0.706 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -64.4 | -38.7 | 173.8 | -167.3 | 176.1 | -71.3 | -137.9 | -0.1 | 111.5 | E52 K60 | E52-R56 PolarHBondContact O-N 2.85Å; R56-K60 WeakPolarHBondContact O-CB 3.34Å; R56-K60 PolarHBondContact O-N 3.4Å |
| 57 | G | 53 | Low | 52.9 | Low | 23 Ų | 23 | 94.9 Ų | 94.9 | 24% | 0.237 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -60 | -49.5 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | D53 N54 I55 Y59 K60 F61 | D53-G57 PolarHBondContact O-N 2.79Å; N54-G57 CarbonylContact O-C 3.59Å; N54-G57 PolarHBondContact O-N 3.33Å; I55-G57 VanDerWaalsContact C-N 3.32Å; I55-G57 PolarHBondContact O-N 3.18Å; G57-Y59 PolarHBondContact O-N 3.5Å; G57-K60 CarbonylContact O-C 3.59Å; G57-K60 PolarHBondContact O-N 3.47Å; G57-F61 WeakPolarHBondContact O-CD2 3.39Å; G57-F61 PolarHBondContact O-N 2.9Å |
| 58 | L | 50 | Low | 53.5 | Low | 59 Ų | 59 | 100 Ų | 100 | 31% | 0.309 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60 | -46.9 | 179.2 | -146.3 | 101 | 0 | 0 | 0 | 111 | F50 N54 I55 K60 F61 F62 | F50-L58 HydrophobicContact CD1-CD1 4.45Å; F50-L58 HydrophobicContact CE1-CD1 3.63Å; F50-L58 HydrophobicContact CZ-CD1 4.19Å; N54-L58 WeakPolarHBondContact O-CB 3.38Å; N54-L58 PolarHBondContact O-N 2.86Å; I55-L58 PolarHBondContact O-N 3.45Å; L58-K60 VanDerWaalsContact C-N 3.31Å; L58-K60 PolarHBondContact O-N 3.41Å; L58-F61 PolarHBondContact O-N 3.45Å; L58-F62 HydrophobicContact CD2-CD2 3.94Å; L58-F62 HydrophobicContact CD2-CE2 3.55Å; L58-F62 HydrophobicContact CG-CD2 4Å; L58-F62 HydrophobicContact CG-CE2 3.84Å; L58-F62 WeakPolarHBondContact O-CB 3.25Å; L58-F62 VanDerWaalsContact O-CD2 3.23Å; L58-F62 WeakPolarHBondContact O-CD2 3.45Å; L58-F62 PolarHBondContact O-N 2.82Å |
| 59 | Y | 51.7 | Low | 53.8 | Low | 157 Ų | 157 | 97 Ų | 97 | 62% | 0.616 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -59.2 | -42.5 | 176 | -175.1 | -96.6 | 0 | 0 | 0 | 111.6 | I55 G57 F62 S63 | I55-Y59 WeakPolarHBondContact O-CB 3.35Å; I55-Y59 PolarHBondContact O-N 2.93Å; G57-Y59 PolarHBondContact O-N 3.5Å; Y59-F62 PolarHBondContact O-N 2.87Å; Y59-S63 WeakPolarHBondContact O-CB 3.16Å; Y59-S63 PolarHBondContact O-N 2.88Å; Y59-S63 PolarHBondContact O-OG 2.88Å |
| 60 | K | 54 | Low | 54.1 | Low | 153 Ų | 153 | 93.9 Ų | 93.9 | 67% | 0.665 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -69.5 | -31.6 | 177.1 | -164.4 | 172 | -174 | 173.9 | 0 | 113 | R56 G57 L58 S63 K64 | R56-K60 WeakPolarHBondContact O-CB 3.34Å; R56-K60 PolarHBondContact O-N 3.4Å; G57-K60 CarbonylContact O-C 3.59Å; G57-K60 PolarHBondContact O-N 3.47Å; L58-K60 VanDerWaalsContact C-N 3.31Å; L58-K60 PolarHBondContact O-N 3.41Å; K60-S63 WeakPolarHBondContact CA-OG 3.34Å; K60-S63 PolarHBondContact O-OG 3.34Å; K60-S63 VanDerWaalsContact O-OG 3.12Å; K60-K64 WeakPolarHBondContact O-CB 3.39Å; K60-K64 PolarHBondContact O-N 3.47Å |
| 61 | F | 54.1 | Low | 54.5 | Low | 151 Ų | 151 | 97.8 Ų | 97.8 | 66% | 0.662 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -72.1 | -43.4 | 172.5 | -88.8 | -72.5 | 0 | 0 | 0 | 111.7 | G57 L58 T65 | G57-F61 WeakPolarHBondContact O-CD2 3.39Å; G57-F61 PolarHBondContact O-N 2.9Å; L58-F61 PolarHBondContact O-N 3.45Å; F61-T65 VanDerWaalsContact O-CB 3.29Å; F61-T65 WeakPolarHBondContact O-CB 3.34Å; F61-T65 PolarHBondContact O-N 2.93Å; F61-T65 PolarHBondContact O-OG1 2.83Å |
| 62 | F | 56.5 | Low | 55.1 | Low | 86 Ų | 86 | 98.1 Ų | 98.1 | 38% | 0.377 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.9 | -51.8 | 174.9 | -88.2 | -70.4 | 0 | 0 | 0 | 110.3 | L58 Y59 K64 T65 T66 T153 L157 | L58-F62 HydrophobicContact CD2-CD2 3.94Å; L58-F62 HydrophobicContact CD2-CE2 3.55Å; L58-F62 HydrophobicContact CG-CD2 4Å; L58-F62 HydrophobicContact CG-CE2 3.84Å; L58-F62 WeakPolarHBondContact O-CB 3.25Å; L58-F62 VanDerWaalsContact O-CD2 3.23Å; L58-F62 WeakPolarHBondContact O-CD2 3.45Å; L58-F62 PolarHBondContact O-N 2.82Å; Y59-F62 PolarHBondContact O-N 2.87Å; F62-K64 VanDerWaalsContact C-N 3.33Å; F62-K64 PolarHBondContact O-N 3.37Å; F62-T65 PolarHBondContact O-N 3.41Å; F62-T65 VanDerWaalsContact O-N 3.1Å; F62-T66 WeakPolarHBondContact O-CB 3.49Å; F62-T66 PolarHBondContact O-N 3.13Å; F62-T66 PolarHBondContact O-OG1 3.45Å; F62-T153 HydrophobicContact CE1-CG2 3.95Å; F62-T153 HydrophobicContact CZ-CG2 4.2Å; F62-L157 HydrophobicContact CD1-CD2 4.24Å |
| 63 | S | 53.4 | Low | 55.3 | Low | 54 Ų | 54 | 93.5 Ų | 93.5 | 38% | 0.378 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -57.5 | -44.6 | 179.5 | 68.6 | 0 | 0 | 0 | 0 | 112.5 | Y59 K60 T65 T66 E67 | Y59-S63 WeakPolarHBondContact O-CB 3.16Å; Y59-S63 PolarHBondContact O-N 2.88Å; Y59-S63 PolarHBondContact O-OG 2.88Å; K60-S63 WeakPolarHBondContact CA-OG 3.34Å; K60-S63 PolarHBondContact O-OG 3.34Å; K60-S63 VanDerWaalsContact O-OG 3.12Å; S63-T65 VanDerWaalsContact C-N 3.34Å; S63-T65 PolarHBondContact O-N 2.88Å; S63-T66 PolarHBondContact O-N 2.82Å; S63-E67 WeakPolarHBondContact O-CB 3.41Å; S63-E67 PolarHBondContact O-N 3.19Å |
| 64 | K | 54.3 | Low | 55.7 | Low | 109 Ų | 109 | 91.1 Ų | 91.1 | 47% | 0.474 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -68.5 | -30.8 | 178.4 | -168 | 170.9 | -172.4 | 168.1 | 0 | 113.5 | K60 F62 R68 | K60-K64 WeakPolarHBondContact O-CB 3.39Å; K60-K64 PolarHBondContact O-N 3.47Å; F62-K64 VanDerWaalsContact C-N 3.33Å; F62-K64 PolarHBondContact O-N 3.37Å; K64-R68 WeakPolarHBondContact O-CG 3.33Å; K64-R68 PolarHBondContact O-N 3.34Å |
| 65 | T | 51.3 | Low | 56.2 | Low | 81 Ų | 81 | 91.2 Ų | 91.2 | 50% | 0.497 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -75 | -40.6 | 175.4 | -56.7 | 0 | 0 | 0 | 0 | 110.5 | F61 F62 S63 R68 F69 | F61-T65 VanDerWaalsContact O-CB 3.29Å; F61-T65 WeakPolarHBondContact O-CB 3.34Å; F61-T65 PolarHBondContact O-N 2.93Å; F61-T65 PolarHBondContact O-OG1 2.83Å; F62-T65 PolarHBondContact O-N 3.41Å; F62-T65 VanDerWaalsContact O-N 3.1Å; S63-T65 VanDerWaalsContact C-N 3.34Å; S63-T65 PolarHBondContact O-N 2.88Å; T65-R68 PolarHBondContact O-N 3.16Å; T65-F69 VanDerWaalsContact O-CB 3.29Å; T65-F69 WeakPolarHBondContact O-CB 3.41Å; T65-F69 PolarHBondContact O-N 3.01Å |
| 66 | T | 51.5 | Low | 56.9 | Low | 15 Ų | 15 | 91.6 Ų | 91.6 | 9% | 0.092 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -61.5 | -46.2 | 173.8 | -50.6 | 0 | 0 | 0 | 0 | 111.3 | F62 S63 R68 F69 V70 L157 | F62-T66 WeakPolarHBondContact O-CB 3.49Å; F62-T66 PolarHBondContact O-N 3.13Å; F62-T66 PolarHBondContact O-OG1 3.45Å; S63-T66 PolarHBondContact O-N 2.82Å; T66-R68 VanDerWaalsContact C-N 3.34Å; T66-R68 PolarHBondContact O-N 2.92Å; T66-F69 PolarHBondContact O-N 3.19Å; T66-V70 HydrophobicContact CG2-CG2 4.19Å; T66-V70 WeakPolarHBondContact O-CB 3.22Å; T66-V70 WeakPolarHBondContact O-CG2 3.38Å; T66-V70 PolarHBondContact O-N 3.42Å; T66-L157 HydrophobicContact CG2-CD2 4.24Å; T66-L157 WeakPolarHBondContact OG1-CD2 3.38Å |
| 67 | E | 57 | Low | 57.5 | Low | 114 Ų | 114 | 87.3 Ų | 87.3 | 53% | 0.533 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58 | -46.7 | 178.7 | -174.6 | -178.5 | -172.6 | 0 | 0 | 111.2 | S63 V70 H71 | S63-E67 WeakPolarHBondContact O-CB 3.41Å; S63-E67 PolarHBondContact O-N 3.19Å; E67-V70 PolarHBondContact O-N 3.45Å; E67-H71 WeakPolarHBondContact O-CB 3.3Å; E67-H71 PolarHBondContact O-CD2 3.05Å; E67-H71 PolarHBondContact O-N 3.06Å |
| 68 | R | 58.1 | Low | 58.5 | Low | 172 Ų | 172 | 89.7 Ų | 89.7 | 65% | 0.649 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -67.4 | -37.2 | 176.3 | -71.5 | 174.8 | 178.6 | -178.5 | -5.9 | 113.1 | K64 T65 T66 G72 | K64-R68 WeakPolarHBondContact O-CG 3.33Å; K64-R68 PolarHBondContact O-N 3.34Å; T65-R68 PolarHBondContact O-N 3.16Å; T66-R68 VanDerWaalsContact C-N 3.34Å; T66-R68 PolarHBondContact O-N 2.92Å; R68-G72 PolarHBondContact O-N 3.21Å |
| 69 | F | 58.4 | Low | 59.5 | Low | 82 Ų | 82 | 90.8 Ų | 90.8 | 36% | 0.36 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.9 | -44.9 | 175.9 | 178.8 | -99.8 | 0 | 0 | 0 | 110.9 | T65 T66 G72 V73 F135 L154 | T65-F69 VanDerWaalsContact O-CB 3.29Å; T65-F69 WeakPolarHBondContact O-CB 3.41Å; T65-F69 PolarHBondContact O-N 3.01Å; T66-F69 PolarHBondContact O-N 3.19Å; F69-G72 CarbonylContact O-C 3.59Å; F69-G72 PolarHBondContact O-N 2.98Å; F69-G72 VanDerWaalsContact O-N 3.17Å; F69-V73 HydrophobicContact CD1-CG2 4.11Å; F69-V73 HydrophobicContact CD2-CG2 4.47Å; F69-V73 HydrophobicContact CE1-CG2 3.67Å; F69-V73 HydrophobicContact CE2-CG2 4.07Å; F69-V73 HydrophobicContact CG-CG2 4.49Å; F69-V73 HydrophobicContact CZ-CG2 3.65Å; F69-V73 WeakPolarHBondContact O-CG2 3.16Å; F69-V73 PolarHBondContact O-N 3.1Å; F69-F135 HydrophobicContact CE2-CZ 4.41Å; F69-L154 HydrophobicContact CE2-CD2 4.42Å; F69-L154 HydrophobicContact CZ-CD2 4.15Å |
| 70 | V | 57.8 | Low | 60.2 | Low | 32 Ų | 32 | 85.7 Ų | 85.7 | 19% | 0.194 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -60.4 | -48.4 | 176 | 168.8 | 0 | 0 | 0 | 0 | 110.2 | T66 E67 G72 V73 D74 Y161 | T66-V70 HydrophobicContact CG2-CG2 4.19Å; T66-V70 WeakPolarHBondContact O-CB 3.22Å; T66-V70 WeakPolarHBondContact O-CG2 3.38Å; T66-V70 PolarHBondContact O-N 3.42Å; E67-V70 PolarHBondContact O-N 3.45Å; V70-G72 VanDerWaalsContact C-N 3.28Å; V70-G72 PolarHBondContact O-N 3.49Å; V70-V73 PolarHBondContact O-N 3.24Å; V70-D74 VanDerWaalsContact O-CB 3.26Å; V70-D74 WeakPolarHBondContact O-CB 3.34Å; V70-D74 PolarHBondContact O-N 3.03Å; V70-Y161 HydrophobicContact CB-CE2 4.31Å; V70-Y161 HydrophobicContact CG1-CD2 4.45Å; V70-Y161 HydrophobicContact CG1-CE2 3.7Å; V70-Y161 HydrophobicContact CG2-CD2 3.5Å; V70-Y161 VanDerWaalsContact CG2-CD2 3.5Å; V70-Y161 HydrophobicContact CG2-CE2 3.56Å; V70-Y161 HydrophobicContact CG2-CG 4.49Å |
| 71 | H | 62.2 | Low | 61 | Low | 114 Ų | 114 | 86.5 Ų | 86.5 | 53% | 0.528 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.5 | -37.1 | 175.1 | -77.6 | -56.8 | 0 | 0 | 0 | 112.8 | E67 S75 | E67-H71 WeakPolarHBondContact O-CB 3.3Å; E67-H71 PolarHBondContact O-CD2 3.05Å; E67-H71 PolarHBondContact O-N 3.06Å; H71-S75 VanDerWaalsContact O-CB 3.31Å; H71-S75 WeakPolarHBondContact O-CB 3.24Å; H71-S75 PolarHBondContact O-N 3.43Å |
| 72 | G | 63.9 | Low | 61.9 | Low | 42 Ų | 42 | 84.3 Ų | 84.3 | 43% | 0.433 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | R68 F69 V70 F76 | R68-G72 PolarHBondContact O-N 3.21Å; F69-G72 CarbonylContact O-C 3.59Å; F69-G72 PolarHBondContact O-N 2.98Å; F69-G72 VanDerWaalsContact O-N 3.17Å; V70-G72 VanDerWaalsContact C-N 3.28Å; V70-G72 PolarHBondContact O-N 3.49Å; G72-F76 WeakPolarHBondContact O-CB 3.21Å; G72-F76 PolarHBondContact O-N 2.82Å |
| 73 | V | 60.7 | Low | 62.6 | Low | 57 Ų | 57 | 85 Ų | 85 | 35% | 0.345 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -67.4 | -41.5 | 177 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | F69 V70 F76 L77 | F69-V73 HydrophobicContact CD1-CG2 4.11Å; F69-V73 HydrophobicContact CD2-CG2 4.47Å; F69-V73 HydrophobicContact CE1-CG2 3.67Å; F69-V73 HydrophobicContact CE2-CG2 4.07Å; F69-V73 HydrophobicContact CG-CG2 4.49Å; F69-V73 HydrophobicContact CZ-CG2 3.65Å; F69-V73 WeakPolarHBondContact O-CG2 3.16Å; F69-V73 PolarHBondContact O-N 3.1Å; V70-V73 PolarHBondContact O-N 3.24Å; V73-F76 PolarHBondContact O-N 3.48Å; V73-L77 HydrophobicContact CG1-CD1 3.99Å; V73-L77 HydrophobicContact CG1-CG 4.28Å; V73-L77 WeakPolarHBondContact O-CB 3.35Å; V73-L77 VanDerWaalsContact O-CG 3.31Å; V73-L77 WeakPolarHBondContact O-CG 3.32Å; V73-L77 PolarHBondContact O-N 3.36Å |
| 74 | D | 63.7 | Low | 63.2 | Low | 95 Ų | 95 | 85.4 Ų | 85.4 | 51% | 0.508 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.2 | -47.2 | 179.2 | -162.5 | 48.8 | 0 | 0 | 0 | 111.1 | V70 F76 L77 D78 | V70-D74 VanDerWaalsContact O-CB 3.26Å; V70-D74 WeakPolarHBondContact O-CB 3.34Å; V70-D74 PolarHBondContact O-N 3.03Å; D74-F76 VanDerWaalsContact C-N 3.3Å; D74-F76 PolarHBondContact O-N 2.99Å; D74-L77 PolarHBondContact O-N 3.38Å; D74-D78 WeakPolarHBondContact O-CB 3.39Å; D74-D78 PolarHBondContact O-N 3.44Å |
| 75 | S | 64.3 | Low | 63.8 | Low | 72 Ų | 72 | 82.1 Ų | 82.1 | 50% | 0.503 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.3 | -40 | 173.1 | -178.6 | 0 | 0 | 0 | 0 | 111.7 | H71 D78 T79 | H71-S75 VanDerWaalsContact O-CB 3.31Å; H71-S75 WeakPolarHBondContact O-CB 3.24Å; H71-S75 PolarHBondContact O-N 3.43Å; S75-D78 PolarHBondContact O-N 3.19Å; S75-T79 PolarHBondContact O-N 3.46Å; S75-T79 PolarHBondContact O-OG1 2.9Å |
| 76 | F | 65.5 | Low | 64.7 | Low | 69 Ų | 69 | 83 Ų | 83 | 30% | 0.303 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -67.2 | -42.8 | 179.2 | -178 | -104 | 0 | 0 | 0 | 112.3 | G72 V73 D74 T79 I80 F131 | G72-F76 WeakPolarHBondContact O-CB 3.21Å; G72-F76 PolarHBondContact O-N 2.82Å; V73-F76 PolarHBondContact O-N 3.48Å; D74-F76 VanDerWaalsContact C-N 3.3Å; D74-F76 PolarHBondContact O-N 2.99Å; F76-T79 PolarHBondContact O-N 3.23Å; F76-I80 HydrophobicContact CD1-CD1 3.73Å; F76-I80 HydrophobicContact CD1-CG1 4.44Å; F76-I80 HydrophobicContact CE1-CD1 3.05Å; F76-I80 HydrophobicContact CE1-CG1 3.96Å; F76-I80 HydrophobicContact CE2-CD1 4.33Å; F76-I80 HydrophobicContact CE2-CG1 4.45Å; F76-I80 HydrophobicContact CZ-CD1 3.38Å; F76-I80 HydrophobicContact CZ-CG1 3.91Å; F76-I80 PolarHBondContact O-N 3.25Å; F76-F131 AromaticContact CD1-CE1 3.94Å; F76-F131 HydrophobicContact CD1-CE1 3.94Å; F76-F131 HydrophobicContact CD1-CZ 4.05Å; F76-F131 HydrophobicContact CD2-CE2 4.4Å; F76-F131 HydrophobicContact CD2-CZ 4.11Å; F76-F131 AromaticContact CE1-CD1 3.51Å; F76-F131 HydrophobicContact CE1-CD1 3.51Å; F76-F131 HydrophobicContact CE1-CD2 4.28Å; F76-F131 AromaticContact CE1-CE1 3.08Å; F76-F131 HydrophobicContact CE1-CE1 3.08Å; F76-F131 AromaticContact CE1-CE2 3.92Å; F76-F131 HydrophobicContact CE1-CE2 3.92Å; F76-F131 HydrophobicContact CE1-CG 4.11Å; F76-F131 AromaticContact CE1-CZ 3.31Å; F76-F131 HydrophobicContact CE1-CZ 3.31Å; F76-F131 HydrophobicContact CE2-CD2 4.06Å; F76-F131 HydrophobicContact CE2-CE1 4.12Å; F76-F131 AromaticContact CE2-CE2 3.39Å; F76-F131 HydrophobicContact CE2-CE2 3.39Å; F76-F131 AromaticContact CE2-CZ 3.43Å; F76-F131 HydrophobicContact CE2-CZ 3.43Å; F76-F131 VanDerWaalsContact CE2-CZ 3.43Å; F76-F131 HydrophobicContact CG-CZ 4.39Å; F76-F131 AromaticContact CZ-CD1 3.54Å; F76-F131 HydrophobicContact CZ-CD1 3.54Å; F76-F131 AromaticContact CZ-CD2 3.44Å; F76-F131 HydrophobicContact CZ-CD2 3.44Å; F76-F131 VanDerWaalsContact CZ-CD2 3.44Å; F76-F131 AromaticContact CZ-CE1 3.23Å; F76-F131 HydrophobicContact CZ-CE1 3.23Å; F76-F131 AromaticContact CZ-CE2 3.11Å; F76-F131 HydrophobicContact CZ-CE2 3.11Å; F76-F131 AromaticContact CZ-CG 3.65Å; F76-F131 HydrophobicContact CZ-CG 3.65Å; F76-F131 AromaticContact CZ-CZ 3Å; F76-F131 HydrophobicContact CZ-CZ 3Å |
| 77 | L | 66.3 | Low | 65.4 | Low | 97 Ų | 97 | 85.8 Ų | 85.8 | 51% | 0.508 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63 | -41.1 | 174.1 | -74.5 | 175.2 | 0 | 0 | 0 | 111.5 | V73 D74 T79 I80 W81 | V73-L77 HydrophobicContact CG1-CD1 3.99Å; V73-L77 HydrophobicContact CG1-CG 4.28Å; V73-L77 WeakPolarHBondContact O-CB 3.35Å; V73-L77 VanDerWaalsContact O-CG 3.31Å; V73-L77 WeakPolarHBondContact O-CG 3.32Å; V73-L77 PolarHBondContact O-N 3.36Å; D74-L77 PolarHBondContact O-N 3.38Å; L77-T79 VanDerWaalsContact C-N 3.29Å; L77-T79 PolarHBondContact O-N 3.26Å; L77-I80 PolarHBondContact O-N 3.41Å; L77-W81 VanDerWaalsContact O-CB 3.25Å; L77-W81 WeakPolarHBondContact O-CB 3.25Å; L77-W81 PolarHBondContact O-N 3.09Å |
| 78 | D | 72.9 | Confident | 65.7 | Low | 73 Ų | 73 | 81 Ų | 81 | 39% | 0.39 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.7 | -37.9 | 174.2 | -174.3 | 46.2 | 0 | 0 | 0 | 111.5 | D74 S75 W81 K82 | D74-D78 WeakPolarHBondContact O-CB 3.39Å; D74-D78 PolarHBondContact O-N 3.44Å; S75-D78 PolarHBondContact O-N 3.19Å; D78-W81 PolarHBondContact O-N 3.41Å; D78-K82 WeakPolarHBondContact O-CB 3.46Å; D78-K82 WeakPolarHBondContact O-CG 3.49Å; D78-K82 PolarHBondContact O-N 2.77Å; D78-K82 IonicContact OD1-NZ 3.76Å; D78-K82 IonicContact OD2-NZ 2.72Å; D78-K82 PolarHBondContact OD2-NZ 2.81Å |
| 79 | T | 71.1 | Confident | 66.1 | Low | 81 Ų | 81 | 78 Ų | 78 | 50% | 0.497 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -68.3 | -42.6 | 176.3 | -36.9 | 0 | 0 | 0 | 0 | 111.7 | S75 F76 L77 W81 K82 M83 | S75-T79 PolarHBondContact O-N 3.46Å; S75-T79 PolarHBondContact O-OG1 2.9Å; F76-T79 PolarHBondContact O-N 3.23Å; L77-T79 VanDerWaalsContact C-N 3.29Å; L77-T79 PolarHBondContact O-N 3.26Å; T79-W81 VanDerWaalsContact C-N 3.34Å; T79-K82 PolarHBondContact O-N 2.8Å; T79-M83 WeakPolarHBondContact O-CB 3.37Å; T79-M83 PolarHBondContact O-N 3.45Å |
| 80 | I | 67.9 | Low | 66.3 | Low | 51 Ų | 51 | 80.3 Ų | 80.3 | 26% | 0.262 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.4 | -44.3 | 173.3 | -74.5 | 175.9 | 0 | 0 | 0 | 110.5 | F76 L77 K82 M83 W84 | F76-I80 HydrophobicContact CD1-CD1 3.73Å; F76-I80 HydrophobicContact CD1-CG1 4.44Å; F76-I80 HydrophobicContact CE1-CD1 3.05Å; F76-I80 HydrophobicContact CE1-CG1 3.96Å; F76-I80 HydrophobicContact CE2-CD1 4.33Å; F76-I80 HydrophobicContact CE2-CG1 4.45Å; F76-I80 HydrophobicContact CZ-CD1 3.38Å; F76-I80 HydrophobicContact CZ-CG1 3.91Å; F76-I80 PolarHBondContact O-N 3.25Å; L77-I80 PolarHBondContact O-N 3.41Å; I80-K82 VanDerWaalsContact C-N 3.34Å; I80-K82 PolarHBondContact O-N 3.08Å; I80-M83 HydrophobicContact CG1-CE 4.19Å; I80-M83 PolarHBondContact O-N 2.85Å; I80-W84 VanDerWaalsContact O-CB 3.29Å; I80-W84 WeakPolarHBondContact O-CB 3.39Å; I80-W84 PolarHBondContact O-N 2.83Å |
| 81 | W | 70.4 | Confident | 66.3 | Low | 169 Ų | 169 | 81.6 Ų | 81.6 | 64% | 0.64 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -61.4 | -45.3 | -179.5 | -176.1 | -98.3 | 0 | 0 | 0 | 110.8 | L77 D78 T79 W84 T85 | L77-W81 VanDerWaalsContact O-CB 3.25Å; L77-W81 WeakPolarHBondContact O-CB 3.25Å; L77-W81 PolarHBondContact O-N 3.09Å; D78-W81 PolarHBondContact O-N 3.41Å; T79-W81 VanDerWaalsContact C-N 3.34Å; W81-W84 WeakPolarHBondContact O-CB 3.49Å; W81-W84 PolarHBondContact O-N 3.41Å; W81-T85 WeakPolarHBondContact O-CG2 3.02Å; W81-T85 PolarHBondContact O-N 3.48Å; W81-T85 PolarHBondContact O-OG1 3.04Å |
| 82 | K | 72.4 | Confident | 65.9 | Low | 106 Ų | 106 | 79.3 Ų | 79.3 | 46% | 0.461 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.2 | -47.9 | 173.4 | -78.5 | 169 | 176.8 | 152 | 0 | 112.6 | D78 T79 I80 W84 T85 D86 | D78-K82 WeakPolarHBondContact O-CB 3.46Å; D78-K82 WeakPolarHBondContact O-CG 3.49Å; D78-K82 PolarHBondContact O-N 2.77Å; D78-K82 IonicContact OD1-NZ 3.76Å; D78-K82 IonicContact OD2-NZ 2.72Å; D78-K82 PolarHBondContact OD2-NZ 2.81Å; T79-K82 PolarHBondContact O-N 2.8Å; I80-K82 VanDerWaalsContact C-N 3.34Å; I80-K82 PolarHBondContact O-N 3.08Å; K82-W84 PolarHBondContact O-N 3.46Å; K82-T85 WeakPolarHBondContact CA-OG1 3.17Å; K82-T85 PolarHBondContact O-N 3.42Å; K82-T85 PolarHBondContact O-OG1 3.13Å; K82-D86 WeakPolarHBondContact O-CB 3.13Å; K82-D86 PolarHBondContact O-N 3.08Å |
| 83 | M | 71.3 | Confident | 65.6 | Low | 101 Ų | 101 | 79.2 Ų | 79.2 | 50% | 0.498 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -59.6 | -34.9 | 176.1 | 178.4 | 174.8 | 47.3 | 0 | 0 | 111.7 | T79 I80 L87 | T79-M83 WeakPolarHBondContact O-CB 3.37Å; T79-M83 PolarHBondContact O-N 3.45Å; I80-M83 HydrophobicContact CG1-CE 4.19Å; I80-M83 PolarHBondContact O-N 2.85Å; M83-L87 VanDerWaalsContact O-CB 3.27Å; M83-L87 WeakPolarHBondContact O-CB 3.38Å; M83-L87 PolarHBondContact O-N 2.78Å |
| 84 | W | 66.6 | Low | 65.1 | Low | 62 Ų | 62 | 81.2 Ų | 81.2 | 24% | 0.235 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -72.6 | -44.3 | 176.4 | -177.1 | -110.5 | 0 | 0 | 0 | 112.5 | I80 W81 K82 D86 L87 L88 A120 A124 | I80-W84 VanDerWaalsContact O-CB 3.29Å; I80-W84 WeakPolarHBondContact O-CB 3.39Å; I80-W84 PolarHBondContact O-N 2.83Å; W81-W84 WeakPolarHBondContact O-CB 3.49Å; W81-W84 PolarHBondContact O-N 3.41Å; K82-W84 PolarHBondContact O-N 3.46Å; W84-D86 VanDerWaalsContact C-N 3.32Å; W84-D86 PolarHBondContact O-N 3.17Å; W84-L87 HydrophobicContact CE3-CD2 4.12Å; W84-L87 HydrophobicContact CZ3-CD2 3.93Å; W84-L87 PolarHBondContact O-N 3.26Å; W84-L88 HydrophobicContact CG-CD1 4.42Å; W84-L88 HydrophobicContact CZ2-CD1 4.5Å; W84-L88 HydrophobicContact CZ2-CD2 4.28Å; W84-L88 HydrophobicContact CZ2-CG 4.48Å; W84-L88 WeakPolarHBondContact O-CB 3.38Å; W84-L88 VanDerWaalsContact O-CG 3.28Å; W84-L88 WeakPolarHBondContact O-CG 3.26Å; W84-L88 PolarHBondContact O-N 2.86Å; W84-A120 HydrophobicContact CH2-CB 3.67Å; W84-A120 WeakPolarHBondContact CH2-O 3.33Å; W84-A120 HydrophobicContact CZ2-CB 4.46Å; W84-A120 HydrophobicContact CZ3-CB 4.3Å; W84-A120 WeakPolarHBondContact CZ3-O 3.18Å; W84-A124 HydrophobicContact CE3-CB 4.01Å; W84-A124 HydrophobicContact CH2-CB 3.73Å; W84-A124 HydrophobicContact CZ2-CB 4.49Å; W84-A124 HydrophobicContact CZ3-CB 3.48Å; W84-A124 VanDerWaalsContact CZ3-CB 3.48Å |
| 85 | T | 65.6 | Low | 64.4 | Low | 40 Ų | 40 | 79.1 Ų | 79.1 | 25% | 0.245 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64 | -39.2 | 175.8 | 52.9 | 0 | 0 | 0 | 0 | 111.5 | W81 K82 L88 D89 | W81-T85 WeakPolarHBondContact O-CG2 3.02Å; W81-T85 PolarHBondContact O-N 3.48Å; W81-T85 PolarHBondContact O-OG1 3.04Å; K82-T85 WeakPolarHBondContact CA-OG1 3.17Å; K82-T85 PolarHBondContact O-N 3.42Å; K82-T85 PolarHBondContact O-OG1 3.13Å; T85-L88 PolarHBondContact O-N 3.18Å; T85-D89 WeakPolarHBondContact O-CB 3.29Å; T85-D89 PolarHBondContact O-N 2.92Å |
| 86 | D | 71.1 | Confident | 63.7 | Low | 100 Ų | 100 | 79.8 Ų | 79.8 | 54% | 0.535 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -68.1 | -39.3 | 176.7 | -69.5 | -3.2 | 0 | 0 | 0 | 111.3 | K82 W84 L88 D89 V90 | K82-D86 WeakPolarHBondContact O-CB 3.13Å; K82-D86 PolarHBondContact O-N 3.08Å; W84-D86 VanDerWaalsContact C-N 3.32Å; W84-D86 PolarHBondContact O-N 3.17Å; D86-L88 VanDerWaalsContact C-N 3.34Å; D86-D89 PolarHBondContact O-N 2.93Å; D86-V90 WeakPolarHBondContact O-CB 3.29Å; D86-V90 VanDerWaalsContact O-CG2 3.27Å; D86-V90 WeakPolarHBondContact O-CG2 3.28Å; D86-V90 PolarHBondContact O-N 3.32Å |
| 87 | L | 65.5 | Low | 62.9 | Low | 73 Ų | 73 | 80.1 Ų | 80.1 | 38% | 0.382 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.8 | -39.6 | 174.9 | -165.7 | 89.2 | 0 | 0 | 0 | 111.6 | M83 W84 M91 | M83-L87 VanDerWaalsContact O-CB 3.27Å; M83-L87 WeakPolarHBondContact O-CB 3.38Å; M83-L87 PolarHBondContact O-N 2.78Å; W84-L87 HydrophobicContact CE3-CD2 4.12Å; W84-L87 HydrophobicContact CZ3-CD2 3.93Å; W84-L87 PolarHBondContact O-N 3.26Å; L87-M91 HydrophobicContact CD2-CE 4.04Å; L87-M91 HydrophobicContact CG-CE 4.13Å; L87-M91 WeakPolarHBondContact O-CB 3.01Å; L87-M91 PolarHBondContact O-N 3.31Å |
| 88 | L | 63.7 | Low | 62.1 | Low | 14 Ų | 14 | 78.9 Ų | 78.9 | 7% | 0.073 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -66 | -40.7 | 175.4 | -74.4 | 173.6 | 0 | 0 | 0 | 111.8 | W84 T85 D86 M91 G92 I93 | W84-L88 HydrophobicContact CG-CD1 4.42Å; W84-L88 HydrophobicContact CZ2-CD1 4.5Å; W84-L88 HydrophobicContact CZ2-CD2 4.28Å; W84-L88 HydrophobicContact CZ2-CG 4.48Å; W84-L88 WeakPolarHBondContact O-CB 3.38Å; W84-L88 VanDerWaalsContact O-CG 3.28Å; W84-L88 WeakPolarHBondContact O-CG 3.26Å; W84-L88 PolarHBondContact O-N 2.86Å; T85-L88 PolarHBondContact O-N 3.18Å; D86-L88 VanDerWaalsContact C-N 3.34Å; L88-M91 HydrophobicContact CD2-CE 4.28Å; L88-M91 PolarHBondContact O-N 2.85Å; L88-G92 PolarHBondContact O-N 3.45Å; L88-I93 PolarHBondContact O-N 2.99Å |
| 89 | D | 66.8 | Low | 61.1 | Low | 109 Ų | 109 | 80.9 Ų | 80.9 | 58% | 0.583 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -66.3 | -43.8 | 177.7 | -164.7 | 29.7 | 0 | 0 | 0 | 111.5 | T85 D86 M91 G92 | T85-D89 WeakPolarHBondContact O-CB 3.29Å; T85-D89 PolarHBondContact O-N 2.92Å; D86-D89 PolarHBondContact O-N 2.93Å; D89-M91 VanDerWaalsContact C-N 3.27Å; D89-M91 PolarHBondContact O-N 2.81Å; D89-G92 WeakPolarHBondContact O-CA 3.01Å; D89-G92 PolarHBondContact O-N 3.47Å |
| 90 | V | 62.9 | Low | 59.9 | Low | 130 Ų | 130 | 84 Ų | 84 | 79% | 0.788 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -64.4 | -29.6 | 174.1 | 171.2 | 0 | 0 | 0 | 0 | 112.5 | D86 G92 | D86-V90 WeakPolarHBondContact O-CB 3.29Å; D86-V90 VanDerWaalsContact O-CG2 3.27Å; D86-V90 WeakPolarHBondContact O-CG2 3.28Å; D86-V90 PolarHBondContact O-N 3.32Å; V90-G92 PolarHBondContact O-N 2.88Å |
| 91 | M | 57.6 | Low | 59 | Low | 59 Ų | 59 | 88 Ų | 88 | 29% | 0.291 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.4 | -2.3 | 171 | -86.9 | -171.5 | -65.1 | 0 | 0 | 113.8 | L87 L88 D89 I93 A120 | L87-M91 HydrophobicContact CD2-CE 4.04Å; L87-M91 HydrophobicContact CG-CE 4.13Å; L87-M91 WeakPolarHBondContact O-CB 3.01Å; L87-M91 PolarHBondContact O-N 3.31Å; L88-M91 HydrophobicContact CD2-CE 4.28Å; L88-M91 PolarHBondContact O-N 2.85Å; D89-M91 VanDerWaalsContact C-N 3.27Å; D89-M91 PolarHBondContact O-N 2.81Å; M91-I93 VanDerWaalsContact C-N 3.35Å; M91-A120 HydrophobicContact CE-CB 3.57Å; M91-A120 HydrophobicContact SD-CB 4.3Å |
| 92 | G | 54.9 | Low | 58 | Low | 66 Ų | 66 | 88 Ų | 88 | 68% | 0.68 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.8 | 21.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114 | L88 D89 V90 | L88-G92 PolarHBondContact O-N 3.45Å; D89-G92 WeakPolarHBondContact O-CA 3.01Å; D89-G92 PolarHBondContact O-N 3.47Å; V90-G92 PolarHBondContact O-N 2.88Å |
| 93 | I | 55.7 | Low | 56.6 | Low | 40 Ų | 40 | 84.9 Ų | 84.9 | 21% | 0.205 | 47% | 0.471 | C | S | . | . | trans | -101.9 | 98.2 | 176.7 | -60.5 | 178.2 | 0 | 0 | 0 | 108.3 | L88 M91 A95 L117 | L88-I93 PolarHBondContact O-N 2.99Å; M91-I93 VanDerWaalsContact C-N 3.35Å; I93-A95 PolarHBondContact O-N 3.43Å; I93-A95 VanDerWaalsContact O-N 3.17Å; I93-L117 HydrophobicContact CD1-CD2 4.09Å; I93-L117 HydrophobicContact CD1-CG 4.12Å | ||
| 94 | D | 51 | Low | 55.6 | Low | 99 Ų | 99 | 85.4 Ų | 85.4 | 53% | 0.529 | 48% | 0.482 | S | S | . | . | trans | -69.5 | 107.4 | -179 | -148.4 | -34.6 | 0 | 0 | 0 | 110.5 | S96 N97 | D94-S96 PolarHBondContact O-N 3.34Å; D94-S96 PolarHBondContact OD1-OG 2.86Å; D94-N97 PolarHBondContact O-N 3.32Å | ||
| 95 | A | 48.2 | Very low | 54.8 | Low | 51 Ų | 51 | 87.2 Ų | 87.2 | 42% | 0.421 | 50% | 0.5 | S | S | . | . | G | 310 helix | trans | -60.7 | -18.3 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | I93 N97 L98 | I93-A95 PolarHBondContact O-N 3.43Å; I93-A95 VanDerWaalsContact O-N 3.17Å; A95-N97 PolarHBondContact O-N 2.86Å; A95-L98 HydrophobicContact CB-CD1 4.28Å |
| 96 | S | 50.6 | Low | 53.8 | Low | 85 Ų | 85 | 87.6 Ų | 87.6 | 59% | 0.594 | 50% | 0.504 | S | S | * | . | G | 310 helix | trans | -65.4 | -18.1 | 177.4 | 59.1 | 0 | 0 | 0 | 0 | 114.4 | D94 | D94-S96 PolarHBondContact O-N 3.34Å; D94-S96 PolarHBondContact OD1-OG 2.86Å |
| 97 | N | 47.9 | Very low | 52.6 | Low | 77 Ų | 77 | 87.5 Ų | 87.5 | 41% | 0.412 | 50% | 0.503 | S | S | . | . | G | 310 helix | trans | -116.6 | 9.2 | -175.7 | -77.6 | -83 | 0 | 0 | 0 | 114.4 | D94 A95 S99 H100 Y101 | D94-N97 PolarHBondContact O-N 3.32Å; A95-N97 PolarHBondContact O-N 2.86Å; N97-S99 PolarHBondContact O-N 2.85Å; N97-S99 VanDerWaalsContact O-N 3.07Å; N97-H100 PolarHBondContact O-N 2.9Å; N97-Y101 HydrophobicContact CB-CD2 3.87Å; N97-Y101 HydrophobicContact CB-CE2 3.63Å; N97-Y101 VanDerWaalsContact O-CD2 3.26Å; N97-Y101 WeakPolarHBondContact O-CD2 3.39Å; N97-Y101 PolarHBondContact O-N 2.91Å |
| 98 | L | 51 | Low | 51.7 | Low | 71 Ų | 71 | 89.3 Ų | 89.3 | 37% | 0.372 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -51.6 | -35.2 | -177.2 | -92 | 160.7 | 0 | 0 | 0 | 113.7 | A95 H100 Y101 F102 | A95-L98 HydrophobicContact CB-CD1 4.28Å; L98-H100 VanDerWaalsContact C-N 3.27Å; L98-H100 PolarHBondContact O-N 2.87Å; L98-Y101 PolarHBondContact O-N 2.93Å; L98-F102 HydrophobicContact CD2-CE2 4.22Å; L98-F102 WeakPolarHBondContact O-CD2 3.37Å; L98-F102 PolarHBondContact O-N 3.02Å |
| 99 | S | 51.4 | Low | 51.1 | Low | 115 Ų | 115 | 95.7 Ų | 95.7 | 80% | 0.804 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.9 | -23.2 | 177.6 | 56.1 | 0 | 0 | 0 | 0 | 114.1 | N97 | N97-S99 PolarHBondContact O-N 2.85Å; N97-S99 VanDerWaalsContact O-N 3.07Å |
| 100 | H | 46.3 | Very low | 50.5 | Low | 145 Ų | 145 | 91.9 Ų | 91.9 | 67% | 0.671 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -94.6 | -15.7 | 179.1 | -153.6 | -73.5 | 0 | 0 | 0 | 113 | N97 L98 | N97-H100 PolarHBondContact O-N 2.9Å; L98-H100 VanDerWaalsContact C-N 3.27Å; L98-H100 PolarHBondContact O-N 2.87Å |
| 101 | Y | 48 | Very low | 50.2 | Low | 136 Ų | 136 | 90.2 Ų | 90.2 | 53% | 0.533 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -92.3 | -11.6 | 178.2 | -77.4 | -75.2 | 0 | 0 | 0 | 114.4 | N97 L98 S103 | N97-Y101 HydrophobicContact CB-CD2 3.87Å; N97-Y101 HydrophobicContact CB-CE2 3.63Å; N97-Y101 VanDerWaalsContact O-CD2 3.26Å; N97-Y101 WeakPolarHBondContact O-CD2 3.39Å; N97-Y101 PolarHBondContact O-N 2.91Å; L98-Y101 PolarHBondContact O-N 2.93Å; Y101-S103 PolarHBondContact O-N 3.16Å |
| 102 | F | 49.7 | Very low | 50.2 | Low | 168 Ų | 168 | 90.5 Ų | 90.5 | 74% | 0.737 | 54% | 0.537 | S | S | * | . | trans | -80.6 | 9.5 | 173.2 | -94.3 | -75.5 | 0 | 0 | 0 | 114.3 | L98 | L98-F102 HydrophobicContact CD2-CE2 4.22Å; L98-F102 WeakPolarHBondContact O-CD2 3.37Å; L98-F102 PolarHBondContact O-N 3.02Å | ||
| 103 | S | 43.9 | Very low | 50.2 | Low | 42 Ų | 42 | 94.8 Ų | 94.8 | 29% | 0.294 | 53% | 0.533 | S | S | . | . | S | Bend | trans | -80.2 | 130.8 | 173 | 71.1 | 0 | 0 | 0 | 0 | 110.7 | Y101 T105 S106 | Y101-S103 PolarHBondContact O-N 3.16Å; S103-T105 PolarHBondContact O-N 3.38Å; S103-T105 PolarHBondContact OG-OG1 2.89Å; S103-S106 PolarHBondContact O-N 3.38Å; S103-S106 VanDerWaalsContact O-N 3.14Å |
| 104 | P | 50.3 | Low | 50.4 | Low | 112 Ų | 112 | 94.4 Ų | 94.4 | 73% | 0.727 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -7.3 | -171.7 | 22.2 | -32.8 | 0 | 0 | 0 | 114.9 | ||
| 105 | T | 49.1 | Very low | 51 | Low | 100 Ų | 100 | 95.4 Ų | 95.4 | 61% | 0.613 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -17 | 179.5 | 49.9 | 0 | 0 | 0 | 0 | 114 | S103 T108 | S103-T105 PolarHBondContact O-N 3.38Å; S103-T105 PolarHBondContact OG-OG1 2.89Å; T105-T108 PolarHBondContact O-OG1 3.31Å |
| 106 | S | 44.2 | Very low | 51.9 | Low | 48 Ų | 48 | 96.8 Ų | 96.8 | 34% | 0.336 | 54% | 0.54 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.5 | -20.1 | -177.4 | -57.5 | 0 | 0 | 0 | 0 | 113.6 | S103 T108 | S103-S106 PolarHBondContact O-N 3.38Å; S103-S106 VanDerWaalsContact O-N 3.14Å; S106-T108 VanDerWaalsContact C-N 3.33Å |
| 107 | L | 45.9 | Very low | 52.6 | Low | 98 Ų | 98 | 96.3 Ų | 96.3 | 51% | 0.513 | 53% | 0.53 | S | S | . | . | S | Bend | trans | -71.8 | -25.6 | 176 | -88.2 | 81 | 0 | 0 | 0 | 112.9 | ||
| 108 | T | 48 | Very low | 53.6 | Low | 110 Ų | 110 | 97.1 Ų | 97.1 | 68% | 0.675 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -80.9 | -23.8 | -177.7 | 38.7 | 0 | 0 | 0 | 0 | 113.9 | T105 S106 | T105-T108 PolarHBondContact O-OG1 3.31Å; S106-T108 VanDerWaalsContact C-N 3.33Å |
| 109 | N | 50.7 | Low | 54.5 | Low | 148 Ų | 148 | 96 Ų | 96 | 79% | 0.791 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -90.6 | -9.5 | -174 | -94.9 | -2.8 | 0 | 0 | 0 | 115.3 | ||
| 110 | S | 53.8 | Low | 55.3 | Low | 29 Ų | 29 | 90.6 Ų | 90.6 | 20% | 0.203 | 50% | 0.501 | C | S | . | . | trans | -145 | 84.7 | 178.9 | 58.5 | 0 | 0 | 0 | 0 | 112.6 | A112 R113 A114 | S110-A112 PolarHBondContact O-N 3.45Å; S110-A112 VanDerWaalsContact O-N 3.1Å; S110-R113 PolarHBondContact O-N 2.78Å; S110-R113 WeakPolarHBondContact OG-CD 3.02Å; S110-A114 PolarHBondContact O-N 2.84Å | ||
| 111 | P | 57.3 | Low | 56.5 | Low | 95 Ų | 95 | 88 Ų | 88 | 62% | 0.617 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.4 | -29.3 | -176.3 | 22.1 | -32.8 | 0 | 0 | 0 | 113 | R113 L115 | P111-R113 VanDerWaalsContact C-N 3.34Å; P111-R113 PolarHBondContact O-N 3.44Å; P111-L115 WeakPolarHBondContact O-CB 3.32Å; P111-L115 WeakPolarHBondContact O-CG 3.29Å; P111-L115 PolarHBondContact O-N 2.87Å; P111-L115 VanDerWaalsContact O-N 3.07Å |
| 112 | A | 57.2 | Low | 57.7 | Low | 66 Ų | 66 | 86.6 Ų | 86.6 | 55% | 0.545 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62 | -36.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | S110 L116 | S110-A112 PolarHBondContact O-N 3.45Å; S110-A112 VanDerWaalsContact O-N 3.1Å; A112-L116 VanDerWaalsContact O-CG 3.31Å; A112-L116 WeakPolarHBondContact O-CG 3.28Å; A112-L116 PolarHBondContact O-N 2.89Å |
| 113 | R | 54.6 | Low | 58.7 | Low | 156 Ų | 156 | 81.6 Ų | 81.6 | 59% | 0.589 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -79.3 | -35.4 | -177.7 | -64.4 | -174.6 | -176.6 | 158.7 | -2.7 | 112.6 | S110 P111 L115 L116 L117 | S110-R113 PolarHBondContact O-N 2.78Å; S110-R113 WeakPolarHBondContact OG-CD 3.02Å; P111-R113 VanDerWaalsContact C-N 3.34Å; P111-R113 PolarHBondContact O-N 3.44Å; R113-L115 VanDerWaalsContact C-N 3.33Å; R113-L116 PolarHBondContact O-N 2.77Å; R113-L117 PolarHBondContact O-N 3Å |
| 114 | A | 59.5 | Low | 59.9 | Low | 31 Ų | 31 | 81.2 Ų | 81.2 | 26% | 0.256 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111 | S110 L116 L117 V118 | S110-A114 PolarHBondContact O-N 2.84Å; A114-L116 PolarHBondContact O-N 3.41Å; A114-L117 PolarHBondContact O-N 3.09Å; A114-V118 WeakPolarHBondContact O-CB 3.42Å; A114-V118 VanDerWaalsContact O-CG2 3.26Å; A114-V118 WeakPolarHBondContact O-CG2 3.4Å; A114-V118 PolarHBondContact O-N 2.64Å |
| 115 | L | 63.4 | Low | 60.8 | Low | 121 Ų | 121 | 81.9 Ų | 81.9 | 63% | 0.634 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63.1 | -39.1 | 174 | -75.1 | 172.3 | 0 | 0 | 0 | 112.5 | P111 R113 V118 A119 | P111-L115 WeakPolarHBondContact O-CB 3.32Å; P111-L115 WeakPolarHBondContact O-CG 3.29Å; P111-L115 PolarHBondContact O-N 2.87Å; P111-L115 VanDerWaalsContact O-N 3.07Å; R113-L115 VanDerWaalsContact C-N 3.33Å; L115-V118 PolarHBondContact O-N 2.57Å; L115-A119 WeakPolarHBondContact O-CB 3.13Å; L115-A119 PolarHBondContact O-N 3.12Å |
| 116 | L | 66.8 | Low | 62.1 | Low | 80 Ų | 80 | 85 Ų | 85 | 42% | 0.419 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66 | -41.2 | 175.1 | -73 | 172.4 | 0 | 0 | 0 | 112.5 | A112 R113 A114 A119 A120 | A112-L116 VanDerWaalsContact O-CG 3.31Å; A112-L116 WeakPolarHBondContact O-CG 3.28Å; A112-L116 PolarHBondContact O-N 2.89Å; R113-L116 PolarHBondContact O-N 2.77Å; A114-L116 PolarHBondContact O-N 3.41Å; L116-A119 PolarHBondContact O-N 3.31Å; L116-A120 VanDerWaalsContact O-CB 3.27Å; L116-A120 WeakPolarHBondContact O-CB 3.26Å; L116-A120 PolarHBondContact O-N 3.12Å |
| 117 | L | 65.1 | Low | 63.2 | Low | 75 Ų | 75 | 88.7 Ų | 88.7 | 39% | 0.393 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.4 | -43.9 | 174.1 | -87.6 | 172.7 | 0 | 0 | 0 | 112.1 | I93 R113 A114 A119 A120 V121 | I93-L117 HydrophobicContact CD1-CD2 4.09Å; I93-L117 HydrophobicContact CD1-CG 4.12Å; R113-L117 PolarHBondContact O-N 3Å; A114-L117 PolarHBondContact O-N 3.09Å; L117-A119 VanDerWaalsContact C-N 3.34Å; L117-A120 PolarHBondContact O-N 2.84Å; L117-V121 WeakPolarHBondContact O-CB 3.31Å; L117-V121 VanDerWaalsContact O-CG2 3.28Å; L117-V121 WeakPolarHBondContact O-CG2 3.41Å; L117-V121 PolarHBondContact O-N 3.48Å |
| 118 | V | 68.9 | Low | 64.2 | Low | 94 Ų | 94 | 88 Ų | 88 | 57% | 0.57 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.8 | -43.6 | 175.9 | 171.4 | 0 | 0 | 0 | 0 | 110.3 | A114 L115 V121 L122 | A114-V118 WeakPolarHBondContact O-CB 3.42Å; A114-V118 VanDerWaalsContact O-CG2 3.26Å; A114-V118 WeakPolarHBondContact O-CG2 3.4Å; A114-V118 PolarHBondContact O-N 2.64Å; L115-V118 PolarHBondContact O-N 2.57Å; V118-V121 PolarHBondContact O-N 3.05Å; V118-L122 WeakPolarHBondContact O-CB 3.5Å; V118-L122 PolarHBondContact O-N 3.44Å |
| 119 | A | 70.1 | Confident | 64.9 | Low | 46 Ų | 46 | 85.4 Ų | 85.4 | 38% | 0.38 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.5 | -43.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L115 L116 L117 L122 V123 | L115-A119 WeakPolarHBondContact O-CB 3.13Å; L115-A119 PolarHBondContact O-N 3.12Å; L116-A119 PolarHBondContact O-N 3.31Å; L117-A119 VanDerWaalsContact C-N 3.34Å; A119-L122 PolarHBondContact O-N 3.17Å; A119-V123 WeakPolarHBondContact O-CB 3.39Å; A119-V123 WeakPolarHBondContact O-CG2 3.36Å; A119-V123 PolarHBondContact O-N 3.5Å |
| 120 | A | 68.8 | Low | 65.8 | Low | 3 Ų | 3 | 83.1 Ų | 83.1 | 3% | 0.025 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -58.4 | -52.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | W84 M91 L116 L117 L122 V123 A124 | W84-A120 HydrophobicContact CH2-CB 3.67Å; W84-A120 WeakPolarHBondContact CH2-O 3.33Å; W84-A120 HydrophobicContact CZ2-CB 4.46Å; W84-A120 HydrophobicContact CZ3-CB 4.3Å; W84-A120 WeakPolarHBondContact CZ3-O 3.18Å; M91-A120 HydrophobicContact CE-CB 3.57Å; M91-A120 HydrophobicContact SD-CB 4.3Å; L116-A120 VanDerWaalsContact O-CB 3.27Å; L116-A120 WeakPolarHBondContact O-CB 3.26Å; L116-A120 PolarHBondContact O-N 3.12Å; L117-A120 PolarHBondContact O-N 2.84Å; A120-L122 VanDerWaalsContact C-N 3.26Å; A120-L122 PolarHBondContact O-N 3.17Å; A120-V123 PolarHBondContact O-N 3.18Å; A120-V123 VanDerWaalsContact O-N 3.15Å; A120-A124 PolarHBondContact O-N 3.03Å |
| 121 | V | 70.6 | Confident | 66.5 | Low | 90 Ų | 90 | 85.9 Ų | 85.9 | 55% | 0.545 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.8 | -38.8 | 179.9 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | L117 V118 A124 Y125 | L117-V121 WeakPolarHBondContact O-CB 3.31Å; L117-V121 VanDerWaalsContact O-CG2 3.28Å; L117-V121 WeakPolarHBondContact O-CG2 3.41Å; L117-V121 PolarHBondContact O-N 3.48Å; V118-V121 PolarHBondContact O-N 3.05Å; V121-A124 PolarHBondContact O-N 3.13Å; V121-Y125 WeakPolarHBondContact O-CB 3.21Å; V121-Y125 PolarHBondContact O-N 3.18Å |
| 122 | L | 73.2 | Confident | 66.9 | Low | 106 Ų | 106 | 83.1 Ų | 83.1 | 56% | 0.555 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.3 | -40.2 | 176.7 | -167 | 69.9 | 0 | 0 | 0 | 111.9 | V118 A119 A120 Y125 W126 | V118-L122 WeakPolarHBondContact O-CB 3.5Å; V118-L122 PolarHBondContact O-N 3.44Å; A119-L122 PolarHBondContact O-N 3.17Å; A120-L122 VanDerWaalsContact C-N 3.26Å; A120-L122 PolarHBondContact O-N 3.17Å; L122-Y125 PolarHBondContact O-N 2.87Å; L122-W126 WeakPolarHBondContact O-CB 3.32Å; L122-W126 PolarHBondContact O-N 2.89Å |
| 123 | V | 72.4 | Confident | 67 | Low | 64 Ų | 64 | 81.9 Ų | 81.9 | 39% | 0.388 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.7 | -44.8 | 174.8 | 169.4 | 0 | 0 | 0 | 0 | 110.7 | A119 A120 Y125 W126 F127 | A119-V123 WeakPolarHBondContact O-CB 3.39Å; A119-V123 WeakPolarHBondContact O-CG2 3.36Å; A119-V123 PolarHBondContact O-N 3.5Å; A120-V123 PolarHBondContact O-N 3.18Å; A120-V123 VanDerWaalsContact O-N 3.15Å; V123-Y125 VanDerWaalsContact C-N 3.32Å; V123-Y125 PolarHBondContact O-N 3.31Å; V123-W126 WeakPolarHBondContact O-CB 3.28Å; V123-W126 PolarHBondContact O-N 3.02Å; V123-F127 HydrophobicContact CG1-CD2 3.76Å; V123-F127 HydrophobicContact CG1-CE2 3.99Å; V123-F127 WeakPolarHBondContact O-CD2 3.47Å; V123-F127 PolarHBondContact O-N 2.83Å |
| 124 | A | 69 | Low | 67.4 | Low | 34 Ų | 34 | 76.2 Ų | 76.2 | 28% | 0.281 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -57.7 | -45.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | W84 A120 V121 W126 F127 L128 | W84-A124 HydrophobicContact CE3-CB 4.01Å; W84-A124 HydrophobicContact CH2-CB 3.73Å; W84-A124 HydrophobicContact CZ2-CB 4.49Å; W84-A124 HydrophobicContact CZ3-CB 3.48Å; W84-A124 VanDerWaalsContact CZ3-CB 3.48Å; A120-A124 PolarHBondContact O-N 3.03Å; V121-A124 PolarHBondContact O-N 3.13Å; A124-W126 VanDerWaalsContact C-N 3.33Å; A124-W126 PolarHBondContact O-N 2.93Å; A124-F127 PolarHBondContact O-N 2.7Å; A124-L128 VanDerWaalsContact O-CB 3.27Å; A124-L128 WeakPolarHBondContact O-CB 3.17Å; A124-L128 PolarHBondContact O-N 3.44Å |
| 125 | Y | 67.5 | Low | 67.7 | Low | 125 Ų | 125 | 78.4 Ų | 78.4 | 49% | 0.49 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.3 | -44 | 175.9 | 173.6 | -97.9 | 0 | 0 | 0 | 111.7 | V121 L122 V123 L128 S129 M186 | V121-Y125 WeakPolarHBondContact O-CB 3.21Å; V121-Y125 PolarHBondContact O-N 3.18Å; L122-Y125 PolarHBondContact O-N 2.87Å; V123-Y125 VanDerWaalsContact C-N 3.32Å; V123-Y125 PolarHBondContact O-N 3.31Å; Y125-L128 PolarHBondContact O-N 3.1Å; Y125-S129 VanDerWaalsContact O-CB 3.26Å; Y125-S129 WeakPolarHBondContact O-CB 3.29Å; Y125-S129 PolarHBondContact O-N 2.95Å; Y125-M186 HydrophobicContact CE2-CE 4.37Å |
| 126 | W | 77.1 | Confident | 67.7 | Low | 165 Ų | 165 | 75 Ų | 75 | 63% | 0.625 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -62.2 | -46.6 | 177.8 | -121.2 | 75.9 | 0 | 0 | 0 | 112.1 | L122 V123 A124 S129 L130 | L122-W126 WeakPolarHBondContact O-CB 3.32Å; L122-W126 PolarHBondContact O-N 2.89Å; V123-W126 WeakPolarHBondContact O-CB 3.28Å; V123-W126 PolarHBondContact O-N 3.02Å; A124-W126 VanDerWaalsContact C-N 3.33Å; A124-W126 PolarHBondContact O-N 2.93Å; W126-S129 PolarHBondContact O-N 3.34Å; W126-L130 HydrophobicContact CE3-CD1 3.52Å; W126-L130 HydrophobicContact CE3-CG 4.05Å; W126-L130 HydrophobicContact CZ3-CD1 3.73Å; W126-L130 HydrophobicContact CZ3-CD2 4.43Å; W126-L130 HydrophobicContact CZ3-CG 4.28Å; W126-L130 WeakPolarHBondContact O-CB 3.29Å; W126-L130 WeakPolarHBondContact O-CG 3.49Å; W126-L130 PolarHBondContact O-N 3.4Å |
| 127 | F | 67.9 | Low | 67.4 | Low | 126 Ų | 126 | 78.3 Ų | 78.3 | 55% | 0.553 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -61.9 | -45 | 176.1 | -97.6 | -82.1 | 0 | 0 | 0 | 112 | V123 A124 S129 L130 F131 | V123-F127 HydrophobicContact CG1-CD2 3.76Å; V123-F127 HydrophobicContact CG1-CE2 3.99Å; V123-F127 WeakPolarHBondContact O-CD2 3.47Å; V123-F127 PolarHBondContact O-N 2.83Å; A124-F127 PolarHBondContact O-N 2.7Å; F127-S129 VanDerWaalsContact C-N 3.32Å; F127-S129 PolarHBondContact O-N 2.8Å; F127-L130 PolarHBondContact O-N 2.8Å; F127-F131 VanDerWaalsContact O-CB 3.26Å; F127-F131 WeakPolarHBondContact O-CB 3.47Å; F127-F131 PolarHBondContact O-N 3.4Å |
| 128 | L | 66 | Low | 67.2 | Low | 84 Ų | 84 | 79.9 Ų | 79.9 | 44% | 0.44 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.2 | -43.2 | 177.8 | -170.3 | 73.7 | 0 | 0 | 0 | 111 | A124 Y125 F131 L132 | A124-L128 VanDerWaalsContact O-CB 3.27Å; A124-L128 WeakPolarHBondContact O-CB 3.17Å; A124-L128 PolarHBondContact O-N 3.44Å; Y125-L128 PolarHBondContact O-N 3.1Å; L128-F131 PolarHBondContact O-N 2.86Å; L128-L132 HydrophobicContact CD1-CD1 4.1Å; L128-L132 HydrophobicContact CG-CD1 4.26Å; L128-L132 WeakPolarHBondContact O-CB 3.23Å; L128-L132 WeakPolarHBondContact O-CD1 3.18Å; L128-L132 PolarHBondContact O-N 3.27Å |
| 129 | S | 63.7 | Low | 66.9 | Low | 55 Ų | 55 | 76.7 Ų | 76.7 | 39% | 0.385 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65.4 | -45.5 | 178.5 | -167.9 | 0 | 0 | 0 | 0 | 112.1 | Y125 W126 F127 G133 | Y125-S129 VanDerWaalsContact O-CB 3.26Å; Y125-S129 WeakPolarHBondContact O-CB 3.29Å; Y125-S129 PolarHBondContact O-N 2.95Å; W126-S129 PolarHBondContact O-N 3.34Å; F127-S129 VanDerWaalsContact C-N 3.32Å; F127-S129 PolarHBondContact O-N 2.8Å; S129-G133 PolarHBondContact O-N 2.86Å |
| 130 | L | 69.6 | Low | 66.4 | Low | 100 Ų | 100 | 79.1 Ų | 79.1 | 52% | 0.524 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 174.9 | -77.6 | 175.4 | 0 | 0 | 0 | 112.1 | W126 F127 G134 | W126-L130 HydrophobicContact CE3-CD1 3.52Å; W126-L130 HydrophobicContact CE3-CG 4.05Å; W126-L130 HydrophobicContact CZ3-CD1 3.73Å; W126-L130 HydrophobicContact CZ3-CD2 4.43Å; W126-L130 HydrophobicContact CZ3-CG 4.28Å; W126-L130 WeakPolarHBondContact O-CB 3.29Å; W126-L130 WeakPolarHBondContact O-CG 3.49Å; W126-L130 PolarHBondContact O-N 3.4Å; F127-L130 PolarHBondContact O-N 2.8Å; L130-G134 PolarHBondContact O-N 3.43Å |
| 131 | F | 67.9 | Low | 65.8 | Low | 88 Ų | 88 | 83.7 Ų | 83.7 | 39% | 0.386 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -66.7 | -48.1 | -179.9 | -178.2 | -96.3 | 0 | 0 | 0 | 111.6 | F76 F127 L128 G134 F135 | F76-F131 AromaticContact CD1-CE1 3.94Å; F76-F131 HydrophobicContact CD1-CE1 3.94Å; F76-F131 HydrophobicContact CD1-CZ 4.05Å; F76-F131 HydrophobicContact CD2-CE2 4.4Å; F76-F131 HydrophobicContact CD2-CZ 4.11Å; F76-F131 AromaticContact CE1-CD1 3.51Å; F76-F131 HydrophobicContact CE1-CD1 3.51Å; F76-F131 HydrophobicContact CE1-CD2 4.28Å; F76-F131 AromaticContact CE1-CE1 3.08Å; F76-F131 HydrophobicContact CE1-CE1 3.08Å; F76-F131 AromaticContact CE1-CE2 3.92Å; F76-F131 HydrophobicContact CE1-CE2 3.92Å; F76-F131 HydrophobicContact CE1-CG 4.11Å; F76-F131 AromaticContact CE1-CZ 3.31Å; F76-F131 HydrophobicContact CE1-CZ 3.31Å; F76-F131 HydrophobicContact CE2-CD2 4.06Å; F76-F131 HydrophobicContact CE2-CE1 4.12Å; F76-F131 AromaticContact CE2-CE2 3.39Å; F76-F131 HydrophobicContact CE2-CE2 3.39Å; F76-F131 AromaticContact CE2-CZ 3.43Å; F76-F131 HydrophobicContact CE2-CZ 3.43Å; F76-F131 VanDerWaalsContact CE2-CZ 3.43Å; F76-F131 HydrophobicContact CG-CZ 4.39Å; F76-F131 AromaticContact CZ-CD1 3.54Å; F76-F131 HydrophobicContact CZ-CD1 3.54Å; F76-F131 AromaticContact CZ-CD2 3.44Å; F76-F131 HydrophobicContact CZ-CD2 3.44Å; F76-F131 VanDerWaalsContact CZ-CD2 3.44Å; F76-F131 AromaticContact CZ-CE1 3.23Å; F76-F131 HydrophobicContact CZ-CE1 3.23Å; F76-F131 AromaticContact CZ-CE2 3.11Å; F76-F131 HydrophobicContact CZ-CE2 3.11Å; F76-F131 AromaticContact CZ-CG 3.65Å; F76-F131 HydrophobicContact CZ-CG 3.65Å; F76-F131 AromaticContact CZ-CZ 3Å; F76-F131 HydrophobicContact CZ-CZ 3Å; F127-F131 VanDerWaalsContact O-CB 3.26Å; F127-F131 WeakPolarHBondContact O-CB 3.47Å; F127-F131 PolarHBondContact O-N 3.4Å; L128-F131 PolarHBondContact O-N 2.86Å; F131-G134 PolarHBondContact O-N 3.47Å; F131-F135 VanDerWaalsContact O-CB 3.29Å; F131-F135 WeakPolarHBondContact O-CB 3.03Å; F131-F135 PolarHBondContact O-N 3.47Å |
| 132 | L | 64.8 | Low | 65.2 | Low | 37 Ų | 37 | 84.1 Ų | 84.1 | 19% | 0.194 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -60.2 | -48.2 | 174.9 | -99.7 | 67.6 | 0 | 0 | 0 | 110.7 | L128 G134 F135 F136 V183 | L128-L132 HydrophobicContact CD1-CD1 4.1Å; L128-L132 HydrophobicContact CG-CD1 4.26Å; L128-L132 WeakPolarHBondContact O-CB 3.23Å; L128-L132 WeakPolarHBondContact O-CD1 3.18Å; L128-L132 PolarHBondContact O-N 3.27Å; L132-G134 PolarHBondContact O-N 2.86Å; L132-F135 PolarHBondContact O-N 3.34Å; L132-F136 HydrophobicContact CB-CD2 4.43Å; L132-F136 HydrophobicContact CB-CE2 4.4Å; L132-F136 HydrophobicContact CG-CE2 4.35Å; L132-F136 WeakPolarHBondContact O-CB 3.47Å; L132-F136 WeakPolarHBondContact O-CD2 3.4Å; L132-F136 PolarHBondContact O-N 3.25Å; L132-V183 HydrophobicContact CD2-CG2 4.44Å |
| 133 | G | 60.7 | Low | 64.5 | Low | 39 Ų | 39 | 83.8 Ų | 83.8 | 40% | 0.402 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -59.4 | -45.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.5 | S129 F136 Y137 | S129-G133 PolarHBondContact O-N 2.86Å; G133-F136 PolarHBondContact O-N 3.39Å; G133-Y137 VanDerWaalsContact O-CB 3.25Å; G133-Y137 WeakPolarHBondContact O-CB 3.49Å; G133-Y137 PolarHBondContact O-N 3.18Å |
| 134 | G | 62.7 | Low | 63.9 | Low | 38 Ų | 38 | 82.2 Ų | 82.2 | 39% | 0.392 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.4 | -43.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L130 F131 L132 Y137 L138 | L130-G134 PolarHBondContact O-N 3.43Å; F131-G134 PolarHBondContact O-N 3.47Å; L132-G134 PolarHBondContact O-N 2.86Å; G134-Y137 PolarHBondContact O-N 2.87Å; G134-L138 WeakPolarHBondContact O-CB 3.31Å; G134-L138 PolarHBondContact O-N 3.39Å |
| 135 | F | 65.7 | Low | 63.1 | Low | 77 Ų | 77 | 92.1 Ų | 92.1 | 34% | 0.338 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.9 | -45.5 | 175.5 | -179.9 | -103.4 | 0 | 0 | 0 | 111.6 | F69 F131 L132 Y137 L138 L139 | F69-F135 HydrophobicContact CE2-CZ 4.41Å; F131-F135 VanDerWaalsContact O-CB 3.29Å; F131-F135 WeakPolarHBondContact O-CB 3.03Å; F131-F135 PolarHBondContact O-N 3.47Å; L132-F135 PolarHBondContact O-N 3.34Å; F135-Y137 VanDerWaalsContact C-N 3.34Å; F135-Y137 PolarHBondContact O-N 2.82Å; F135-L138 PolarHBondContact O-N 2.81Å; F135-L139 HydrophobicContact CD1-CD1 3.75Å; F135-L139 HydrophobicContact CD1-CG 4.44Å; F135-L139 HydrophobicContact CE1-CD1 3.3Å; F135-L139 HydrophobicContact CE1-CG 4.16Å; F135-L139 HydrophobicContact CE2-CD1 4.45Å; F135-L139 HydrophobicContact CZ-CD1 3.7Å; F135-L139 HydrophobicContact CZ-CD2 4.5Å; F135-L139 HydrophobicContact CZ-CG 4.19Å; F135-L139 WeakPolarHBondContact O-CB 3.21Å; F135-L139 VanDerWaalsContact O-CG 3.3Å; F135-L139 WeakPolarHBondContact O-CG 3.42Å; F135-L139 PolarHBondContact O-N 2.88Å |
| 136 | F | 62.6 | Low | 62.3 | Low | 48 Ų | 48 | 91 Ų | 91 | 21% | 0.211 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -64.9 | -36.9 | 175 | -77.4 | -62.6 | 0 | 0 | 0 | 112.5 | L132 G133 H140 F147 V183 T187 | L132-F136 HydrophobicContact CB-CD2 4.43Å; L132-F136 HydrophobicContact CB-CE2 4.4Å; L132-F136 HydrophobicContact CG-CE2 4.35Å; L132-F136 WeakPolarHBondContact O-CB 3.47Å; L132-F136 WeakPolarHBondContact O-CD2 3.4Å; L132-F136 PolarHBondContact O-N 3.25Å; G133-F136 PolarHBondContact O-N 3.39Å; F136-H140 VanDerWaalsContact O-CB 3.25Å; F136-H140 WeakPolarHBondContact O-CB 3.4Å; F136-H140 PolarHBondContact O-N 3.41Å; F136-F147 HydrophobicContact CD1-CE2 4.44Å; F136-F147 HydrophobicContact CD1-CZ 4.1Å; F136-V183 HydrophobicContact CZ-CG1 4.13Å; F136-T187 HydrophobicContact CE1-CG2 4.27Å; F136-T187 HydrophobicContact CE2-CG2 4.36Å; F136-T187 HydrophobicContact CZ-CG2 4.02Å |
| 137 | Y | 61.4 | Low | 61.2 | Low | 151 Ų | 151 | 85.1 Ų | 85.1 | 59% | 0.592 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -67.7 | -43.1 | 176 | -179.2 | -108.2 | 0 | 0 | 0 | 112.1 | G133 G134 F135 H140 I141 | G133-Y137 VanDerWaalsContact O-CB 3.25Å; G133-Y137 WeakPolarHBondContact O-CB 3.49Å; G133-Y137 PolarHBondContact O-N 3.18Å; G134-Y137 PolarHBondContact O-N 2.87Å; F135-Y137 VanDerWaalsContact C-N 3.34Å; F135-Y137 PolarHBondContact O-N 2.82Å; Y137-H140 CarbonylContact O-C 3.57Å; Y137-H140 WeakPolarHBondContact O-CA 3.27Å; Y137-H140 WeakPolarHBondContact O-CB 3.32Å; Y137-H140 PolarHBondContact O-N 3.46Å; Y137-H140 VanDerWaalsContact O-N 3.13Å; Y137-I141 HydrophobicContact CD1-CD1 3.69Å; Y137-I141 HydrophobicContact CE1-CD1 3.17Å; Y137-I141 HydrophobicContact CE1-CG1 4.21Å; Y137-I141 HydrophobicContact CE2-CD1 4.2Å; Y137-I141 HydrophobicContact CE2-CG1 4.46Å; Y137-I141 HydrophobicContact CG-CD1 4.4Å; Y137-I141 VanDerWaalsContact CZ-CD1 3.46Å; Y137-I141 WeakPolarHBondContact O-CG1 3.08Å; Y137-I141 PolarHBondContact O-N 2.87Å |
| 138 | L | 61.9 | Low | 60.8 | Low | 107 Ų | 107 | 87.7 Ų | 87.7 | 56% | 0.56 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -64.5 | -43.9 | 176 | -165.3 | 74 | 0 | 0 | 0 | 110.7 | G134 F135 H140 I141 V142 | G134-L138 WeakPolarHBondContact O-CB 3.31Å; G134-L138 PolarHBondContact O-N 3.39Å; F135-L138 PolarHBondContact O-N 2.81Å; L138-H140 VanDerWaalsContact C-N 3.28Å; L138-H140 PolarHBondContact O-N 3.02Å; L138-I141 PolarHBondContact O-N 3.27Å; L138-V142 WeakPolarHBondContact O-CB 3.48Å; L138-V142 WeakPolarHBondContact O-CG2 3.3Å; L138-V142 PolarHBondContact O-N 3.48Å |
| 139 | L | 60.9 | Low | 60.2 | Low | 27 Ų | 27 | 87.1 Ų | 87.1 | 14% | 0.141 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -59.1 | -40.9 | 170.9 | -76.4 | 177 | 0 | 0 | 0 | 111.6 | F135 V142 F143 F147 L154 | F135-L139 HydrophobicContact CD1-CD1 3.75Å; F135-L139 HydrophobicContact CD1-CG 4.44Å; F135-L139 HydrophobicContact CE1-CD1 3.3Å; F135-L139 HydrophobicContact CE1-CG 4.16Å; F135-L139 HydrophobicContact CE2-CD1 4.45Å; F135-L139 HydrophobicContact CZ-CD1 3.7Å; F135-L139 HydrophobicContact CZ-CD2 4.5Å; F135-L139 HydrophobicContact CZ-CG 4.19Å; F135-L139 WeakPolarHBondContact O-CB 3.21Å; F135-L139 VanDerWaalsContact O-CG 3.3Å; F135-L139 WeakPolarHBondContact O-CG 3.42Å; F135-L139 PolarHBondContact O-N 2.88Å; L139-V142 PolarHBondContact O-N 2.8Å; L139-F143 HydrophobicContact CB-CD2 4.46Å; L139-F143 HydrophobicContact CD2-CD2 3.82Å; L139-F143 HydrophobicContact CD2-CE2 3.55Å; L139-F143 WeakPolarHBondContact O-CB 3.47Å; L139-F143 WeakPolarHBondContact O-CD2 3.32Å; L139-F143 PolarHBondContact O-N 2.91Å; L139-F147 HydrophobicContact CB-CD2 4.47Å; L139-F147 HydrophobicContact CB-CE2 4.14Å; L139-L154 HydrophobicContact CD1-CD1 4.07Å |
| 140 | H | 60 | Low | 59.7 | Low | 97 Ų | 97 | 85 Ų | 85 | 45% | 0.449 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -65.3 | -39.8 | 177.4 | -177.3 | -87.9 | 0 | 0 | 0 | 112.1 | F136 Y137 L138 G144 F147 | F136-H140 VanDerWaalsContact O-CB 3.25Å; F136-H140 WeakPolarHBondContact O-CB 3.4Å; F136-H140 PolarHBondContact O-N 3.41Å; Y137-H140 CarbonylContact O-C 3.57Å; Y137-H140 WeakPolarHBondContact O-CA 3.27Å; Y137-H140 WeakPolarHBondContact O-CB 3.32Å; Y137-H140 PolarHBondContact O-N 3.46Å; Y137-H140 VanDerWaalsContact O-N 3.13Å; L138-H140 VanDerWaalsContact C-N 3.28Å; L138-H140 PolarHBondContact O-N 3.02Å; H140-G144 WeakPolarHBondContact O-CA 3.21Å; H140-G144 PolarHBondContact O-N 3.4Å; H140-F147 HydrophobicContact CB-CD2 3.98Å; H140-F147 HydrophobicContact CB-CE2 4.06Å |
| 141 | I | 56.1 | Low | 59.1 | Low | 99 Ų | 99 | 83.8 Ų | 83.8 | 51% | 0.508 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.2 | -46.9 | 174.8 | -71.7 | 170 | 0 | 0 | 0 | 110.8 | Y137 L138 | Y137-I141 HydrophobicContact CD1-CD1 3.69Å; Y137-I141 HydrophobicContact CE1-CD1 3.17Å; Y137-I141 HydrophobicContact CE1-CG1 4.21Å; Y137-I141 HydrophobicContact CE2-CD1 4.2Å; Y137-I141 HydrophobicContact CE2-CG1 4.46Å; Y137-I141 HydrophobicContact CG-CD1 4.4Å; Y137-I141 VanDerWaalsContact CZ-CD1 3.46Å; Y137-I141 WeakPolarHBondContact O-CG1 3.08Å; Y137-I141 PolarHBondContact O-N 2.87Å; L138-I141 PolarHBondContact O-N 3.27Å |
| 142 | V | 58 | Low | 58.5 | Low | 100 Ų | 100 | 82.8 Ų | 82.8 | 61% | 0.606 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -70.3 | -40 | -174.6 | 172 | 0 | 0 | 0 | 0 | 111.8 | L138 L139 | L138-V142 WeakPolarHBondContact O-CB 3.48Å; L138-V142 WeakPolarHBondContact O-CG2 3.3Å; L138-V142 PolarHBondContact O-N 3.48Å; L139-V142 PolarHBondContact O-N 2.8Å |
| 143 | F | 58.6 | Low | 58.1 | Low | 98 Ų | 98 | 83.2 Ų | 83.2 | 43% | 0.43 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -98.5 | -15.9 | -177 | -68.6 | -79.4 | 0 | 0 | 0 | 113.9 | L139 R145 F146 A150 | L139-F143 HydrophobicContact CB-CD2 4.46Å; L139-F143 HydrophobicContact CD2-CD2 3.82Å; L139-F143 HydrophobicContact CD2-CE2 3.55Å; L139-F143 WeakPolarHBondContact O-CB 3.47Å; L139-F143 WeakPolarHBondContact O-CD2 3.32Å; L139-F143 PolarHBondContact O-N 2.91Å; F143-R145 PolarHBondContact O-N 2.92Å; F143-F146 WeakPolarHBondContact O-CB 3.41Å; F143-F146 PolarHBondContact O-N 2.84Å; F143-A150 HydrophobicContact CD2-CB 4.34Å; F143-A150 HydrophobicContact CG-CB 4.29Å |
| 144 | G | 59.9 | Low | 58.1 | Low | 31 Ų | 31 | 83.4 Ų | 83.4 | 32% | 0.32 | 40% | 0.402 | S | S | . | . | G | 310 helix | trans | 50.6 | -121.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | H140 F146 F147 | H140-G144 WeakPolarHBondContact O-CA 3.21Å; H140-G144 PolarHBondContact O-N 3.4Å; G144-F146 PolarHBondContact O-N 2.76Å; G144-F146 VanDerWaalsContact O-N 3.16Å; G144-F147 WeakPolarHBondContact O-CB 3.45Å; G144-F147 PolarHBondContact O-N 2.79Å |
| 145 | R | 52.4 | Low | 57.8 | Low | 242 Ų | 242 | 87.7 Ų | 87.7 | 91% | 0.913 | 41% | 0.41 | S | S | * | . | G | 310 helix | trans | -60.5 | -21.5 | 178.6 | -142.5 | 94.1 | 153.5 | 165.7 | -3.8 | 113.5 | F143 F147 | F143-R145 PolarHBondContact O-N 2.92Å; R145-F147 VanDerWaalsContact C-N 3.32Å |
| 146 | F | 49.9 | Very low | 57.1 | Low | 102 Ų | 102 | 86.2 Ų | 86.2 | 45% | 0.447 | 41% | 0.411 | S | S | . | . | G | 310 helix | trans | -88.9 | 8.4 | -179.5 | -59.2 | -68.2 | 0 | 0 | 0 | 113.9 | L13 F143 G144 W148 L149 A150 | L13-F146 HydrophobicContact CD2-CD1 3.56Å; L13-F146 HydrophobicContact CD2-CE1 3.33Å; L13-F146 HydrophobicContact CD2-CG 4.33Å; L13-F146 HydrophobicContact CD2-CZ 3.87Å; F143-F146 WeakPolarHBondContact O-CB 3.41Å; F143-F146 PolarHBondContact O-N 2.84Å; G144-F146 PolarHBondContact O-N 2.76Å; G144-F146 VanDerWaalsContact O-N 3.16Å; F146-W148 PolarHBondContact O-N 2.78Å; F146-W148 VanDerWaalsContact O-N 3.13Å; F146-L149 WeakPolarHBondContact O-CB 3.18Å; F146-L149 PolarHBondContact O-N 3.37Å; F146-A150 PolarHBondContact O-N 2.85Å |
| 147 | F | 55.4 | Low | 56.6 | Low | 41 Ų | 41 | 84.9 Ų | 84.9 | 18% | 0.18 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -54.9 | -30.3 | 176.6 | -174.8 | -104.8 | 0 | 0 | 0 | 113.5 | F136 L139 H140 G144 R145 R151 | F136-F147 HydrophobicContact CD1-CE2 4.44Å; F136-F147 HydrophobicContact CD1-CZ 4.1Å; L139-F147 HydrophobicContact CB-CD2 4.47Å; L139-F147 HydrophobicContact CB-CE2 4.14Å; H140-F147 HydrophobicContact CB-CD2 3.98Å; H140-F147 HydrophobicContact CB-CE2 4.06Å; G144-F147 WeakPolarHBondContact O-CB 3.45Å; G144-F147 PolarHBondContact O-N 2.79Å; R145-F147 VanDerWaalsContact C-N 3.32Å; F147-R151 HydrophobicContact CE1-CG 4.17Å; F147-R151 HydrophobicContact CZ-CG 4.43Å; F147-R151 PolarHBondContact O-N 3.32Å |
| 148 | W | 59.3 | Low | 56.3 | Low | 181 Ų | 181 | 79.9 Ų | 79.9 | 69% | 0.686 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -63.8 | -41.3 | 173.6 | -176.7 | 79.6 | 0 | 0 | 0 | 112.4 | F146 R151 V152 | F146-W148 PolarHBondContact O-N 2.78Å; F146-W148 VanDerWaalsContact O-N 3.13Å; W148-R151 WeakPolarHBondContact O-CB 3.43Å; W148-R151 PolarHBondContact O-N 3.42Å; W148-V152 HydrophobicContact CD2-CG2 4.2Å; W148-V152 HydrophobicContact CE3-CG2 4.42Å; W148-V152 HydrophobicContact CH2-CG2 4.25Å; W148-V152 HydrophobicContact CZ2-CG2 4Å; W148-V152 HydrophobicContact CZ3-CG2 4.45Å; W148-V152 WeakPolarHBondContact O-CG2 3.29Å; W148-V152 PolarHBondContact O-N 2.73Å |
| 149 | L | 52.5 | Low | 55.7 | Low | 71 Ų | 71 | 77.8 Ų | 77.8 | 37% | 0.372 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -69.8 | -41.4 | 179.8 | -161 | 74.6 | 0 | 0 | 0 | 110.9 | L13 F146 R151 V152 T153 | L13-L149 HydrophobicContact CD2-CD2 4.48Å; F146-L149 WeakPolarHBondContact O-CB 3.18Å; F146-L149 PolarHBondContact O-N 3.37Å; L149-R151 VanDerWaalsContact C-N 3.29Å; L149-R151 PolarHBondContact O-N 2.74Å; L149-V152 PolarHBondContact O-N 3.4Å; L149-V152 VanDerWaalsContact O-N 3.16Å; L149-T153 PolarHBondContact O-N 3.31Å; L149-T153 PolarHBondContact O-OG1 2.95Å |
| 150 | A | 53.4 | Low | 55.2 | Low | 12 Ų | 12 | 80.8 Ų | 80.8 | 10% | 0.099 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -57.7 | -41.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | F143 F146 T153 L154 | F143-A150 HydrophobicContact CD2-CB 4.34Å; F143-A150 HydrophobicContact CG-CB 4.29Å; F146-A150 PolarHBondContact O-N 2.85Å; A150-T153 VanDerWaalsContact CA-OG1 3.29Å; A150-T153 WeakPolarHBondContact CA-OG1 3.21Å; A150-T153 PolarHBondContact O-N 2.91Å; A150-T153 PolarHBondContact O-OG1 3.45Å; A150-L154 WeakPolarHBondContact O-CB 3.08Å; A150-L154 VanDerWaalsContact O-CG 3.32Å; A150-L154 WeakPolarHBondContact O-CG 3.33Å; A150-L154 PolarHBondContact O-N 2.77Å |
| 151 | R | 56.3 | Low | 54.8 | Low | 74 Ų | 74 | 79.6 Ų | 79.6 | 28% | 0.279 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.3 | -44.2 | 173.6 | -85.4 | -140.4 | -79.9 | 175.4 | -10.1 | 113 | F147 W148 L149 T153 L154 F155 T187 | F147-R151 HydrophobicContact CE1-CG 4.17Å; F147-R151 HydrophobicContact CZ-CG 4.43Å; F147-R151 PolarHBondContact O-N 3.32Å; W148-R151 WeakPolarHBondContact O-CB 3.43Å; W148-R151 PolarHBondContact O-N 3.42Å; L149-R151 VanDerWaalsContact C-N 3.29Å; L149-R151 PolarHBondContact O-N 2.74Å; R151-T153 VanDerWaalsContact C-N 3.35Å; R151-L154 PolarHBondContact O-N 3.22Å; R151-F155 VanDerWaalsContact O-CB 3.28Å; R151-F155 WeakPolarHBondContact O-CB 3.27Å; R151-F155 PolarHBondContact O-N 3.45Å; R151-T187 PolarHBondContact NH1-O 2.92Å |
| 152 | V | 55.2 | Low | 54.5 | Low | 66 Ų | 66 | 77.2 Ų | 77.2 | 40% | 0.4 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.3 | -40.9 | 178 | 173.5 | 0 | 0 | 0 | 0 | 110.8 | W148 L149 F155 A156 | W148-V152 HydrophobicContact CD2-CG2 4.2Å; W148-V152 HydrophobicContact CE3-CG2 4.42Å; W148-V152 HydrophobicContact CH2-CG2 4.25Å; W148-V152 HydrophobicContact CZ2-CG2 4Å; W148-V152 HydrophobicContact CZ3-CG2 4.45Å; W148-V152 WeakPolarHBondContact O-CG2 3.29Å; W148-V152 PolarHBondContact O-N 2.73Å; L149-V152 PolarHBondContact O-N 3.4Å; L149-V152 VanDerWaalsContact O-N 3.16Å; V152-F155 PolarHBondContact O-N 3.1Å; V152-A156 VanDerWaalsContact O-CB 3.32Å; V152-A156 WeakPolarHBondContact O-CB 3.09Å; V152-A156 PolarHBondContact O-N 3.43Å |
| 153 | T | 58.3 | Low | 54.2 | Low | 47 Ų | 47 | 78 Ų | 78 | 29% | 0.288 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -67.1 | -43.4 | 174.6 | 39.3 | 0 | 0 | 0 | 0 | 112.3 | F62 L149 A150 R151 F155 A156 L157 | F62-T153 HydrophobicContact CE1-CG2 3.95Å; F62-T153 HydrophobicContact CZ-CG2 4.2Å; L149-T153 PolarHBondContact O-N 3.31Å; L149-T153 PolarHBondContact O-OG1 2.95Å; A150-T153 VanDerWaalsContact CA-OG1 3.29Å; A150-T153 WeakPolarHBondContact CA-OG1 3.21Å; A150-T153 PolarHBondContact O-N 2.91Å; A150-T153 PolarHBondContact O-OG1 3.45Å; R151-T153 VanDerWaalsContact C-N 3.35Å; T153-F155 VanDerWaalsContact C-N 3.3Å; T153-F155 PolarHBondContact O-N 3.41Å; T153-A156 PolarHBondContact O-N 2.78Å; T153-L157 VanDerWaalsContact O-CB 3.31Å; T153-L157 WeakPolarHBondContact O-CB 3.5Å; T153-L157 WeakPolarHBondContact O-CG 3.45Å; T153-L157 PolarHBondContact O-N 3.32Å |
| 154 | L | 59.1 | Low | 53.8 | Low | 43 Ų | 43 | 80.3 Ų | 80.3 | 23% | 0.225 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -61.8 | -41.1 | 176.1 | -76.2 | 171.6 | 0 | 0 | 0 | 111.2 | F69 L139 A150 R151 L157 S158 | F69-L154 HydrophobicContact CE2-CD2 4.42Å; F69-L154 HydrophobicContact CZ-CD2 4.15Å; L139-L154 HydrophobicContact CD1-CD1 4.07Å; A150-L154 WeakPolarHBondContact O-CB 3.08Å; A150-L154 VanDerWaalsContact O-CG 3.32Å; A150-L154 WeakPolarHBondContact O-CG 3.33Å; A150-L154 PolarHBondContact O-N 2.77Å; R151-L154 PolarHBondContact O-N 3.22Å; L154-L157 PolarHBondContact O-N 3.36Å; L154-S158 WeakPolarHBondContact O-CB 3.14Å; L154-S158 PolarHBondContact O-N 2.89Å; L154-S158 PolarHBondContact O-OG 2.96Å |
| 155 | F | 56.3 | Low | 53.1 | Low | 128 Ų | 128 | 84.3 Ų | 84.3 | 56% | 0.561 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -64.7 | -43 | 175.6 | -172.7 | -100.3 | 0 | 0 | 0 | 112.4 | R151 V152 T153 L157 S158 C159 | R151-F155 VanDerWaalsContact O-CB 3.28Å; R151-F155 WeakPolarHBondContact O-CB 3.27Å; R151-F155 PolarHBondContact O-N 3.45Å; V152-F155 PolarHBondContact O-N 3.1Å; T153-F155 VanDerWaalsContact C-N 3.3Å; T153-F155 PolarHBondContact O-N 3.41Å; F155-L157 VanDerWaalsContact C-N 3.34Å; F155-S158 PolarHBondContact O-N 2.96Å; F155-C159 WeakPolarHBondContact O-CB 3.46Å; F155-C159 PolarHBondContact O-N 2.88Å |
| 156 | A | 52 | Low | 52.8 | Low | 45 Ų | 45 | 75.3 Ų | 75.3 | 37% | 0.372 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -64.3 | -39.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | V152 T153 C159 L160 | V152-A156 VanDerWaalsContact O-CB 3.32Å; V152-A156 WeakPolarHBondContact O-CB 3.09Å; V152-A156 PolarHBondContact O-N 3.43Å; T153-A156 PolarHBondContact O-N 2.78Å; A156-C159 PolarHBondContact O-N 3.49Å; A156-L160 WeakPolarHBondContact O-CG 3.27Å; A156-L160 PolarHBondContact O-N 3.45Å |
| 157 | L | 52.4 | Low | 52.7 | Low | 21 Ų | 21 | 79.4 Ų | 79.4 | 11% | 0.11 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -70.1 | -38.7 | 176.4 | -70.4 | -176 | 0 | 0 | 0 | 112.3 | F62 T66 T153 L154 F155 L160 Y161 | F62-L157 HydrophobicContact CD1-CD2 4.24Å; T66-L157 HydrophobicContact CG2-CD2 4.24Å; T66-L157 WeakPolarHBondContact OG1-CD2 3.38Å; T153-L157 VanDerWaalsContact O-CB 3.31Å; T153-L157 WeakPolarHBondContact O-CB 3.5Å; T153-L157 WeakPolarHBondContact O-CG 3.45Å; T153-L157 PolarHBondContact O-N 3.32Å; L154-L157 PolarHBondContact O-N 3.36Å; F155-L157 VanDerWaalsContact C-N 3.34Å; L157-L160 PolarHBondContact O-N 2.91Å; L157-Y161 WeakPolarHBondContact O-CB 3.43Å; L157-Y161 PolarHBondContact O-N 3.3Å |
| 158 | S | 53.3 | Low | 52.1 | Low | 46 Ų | 46 | 80.3 Ų | 80.3 | 32% | 0.322 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.4 | -39.3 | 172.1 | -64.9 | 0 | 0 | 0 | 0 | 111.9 | L154 F155 Y161 I162 | L154-S158 WeakPolarHBondContact O-CB 3.14Å; L154-S158 PolarHBondContact O-N 2.89Å; L154-S158 PolarHBondContact O-OG 2.96Å; F155-S158 PolarHBondContact O-N 2.96Å; S158-Y161 PolarHBondContact O-N 2.95Å; S158-I162 WeakPolarHBondContact O-CD1 3.5Å; S158-I162 VanDerWaalsContact O-CG1 3.26Å; S158-I162 WeakPolarHBondContact O-CG1 3.31Å; S158-I162 PolarHBondContact O-N 3.33Å |
| 159 | C | 49.5 | Very low | 51.2 | Low | 63 Ų | 63 | 77.5 Ų | 77.5 | 43% | 0.426 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -63.4 | -48.2 | 175.2 | -170.1 | 0 | 0 | 0 | 0 | 111.3 | F155 A156 Y161 I162 L163 | F155-C159 WeakPolarHBondContact O-CB 3.46Å; F155-C159 PolarHBondContact O-N 2.88Å; A156-C159 PolarHBondContact O-N 3.49Å; C159-Y161 VanDerWaalsContact C-N 3.34Å; C159-Y161 PolarHBondContact O-N 2.62Å; C159-I162 PolarHBondContact O-N 2.78Å; C159-L163 WeakPolarHBondContact O-CD1 3.37Å; C159-L163 PolarHBondContact O-N 3.36Å |
| 160 | L | 50.7 | Low | 50.9 | Low | 89 Ų | 89 | 79 Ų | 79 | 47% | 0.466 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.5 | -35.2 | 176.9 | -73.4 | 172.7 | 0 | 0 | 0 | 113 | A156 L157 L163 Q164 | A156-L160 WeakPolarHBondContact O-CG 3.27Å; A156-L160 PolarHBondContact O-N 3.45Å; L157-L160 PolarHBondContact O-N 2.91Å; L160-L163 PolarHBondContact O-N 3.21Å; L160-Q164 WeakPolarHBondContact O-CB 3.25Å; L160-Q164 PolarHBondContact O-N 2.81Å |
| 161 | Y | 52 | Low | 50.5 | Low | 72 Ų | 72 | 86.6 Ų | 86.6 | 28% | 0.282 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | 175.2 | 178.5 | -104.7 | 0 | 0 | 0 | 112.1 | V70 L157 S158 C159 Q164 K165 | V70-Y161 HydrophobicContact CB-CE2 4.31Å; V70-Y161 HydrophobicContact CG1-CD2 4.45Å; V70-Y161 HydrophobicContact CG1-CE2 3.7Å; V70-Y161 HydrophobicContact CG2-CD2 3.5Å; V70-Y161 VanDerWaalsContact CG2-CD2 3.5Å; V70-Y161 HydrophobicContact CG2-CE2 3.56Å; V70-Y161 HydrophobicContact CG2-CG 4.49Å; L157-Y161 WeakPolarHBondContact O-CB 3.43Å; L157-Y161 PolarHBondContact O-N 3.3Å; S158-Y161 PolarHBondContact O-N 2.95Å; C159-Y161 VanDerWaalsContact C-N 3.34Å; C159-Y161 PolarHBondContact O-N 2.62Å; Y161-Q164 PolarHBondContact O-N 3.42Å; Y161-K165 HydrophobicContact CE1-CD 4.34Å; Y161-K165 HydrophobicContact CE2-CD 3.76Å; Y161-K165 VanDerWaalsContact O-CB 3.3Å; Y161-K165 WeakPolarHBondContact O-CB 3.36Å; Y161-K165 PolarHBondContact O-N 2.93Å; Y161-K165 WeakPolarHBondContact OH-CD 3.37Å; Y161-K165 PolarHBondContact OH-NZ 3.39Å |
| 162 | I | 49.6 | Very low | 50 | Low | 49 Ų | 49 | 92.8 Ų | 92.8 | 25% | 0.251 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.2 | -43 | 174.8 | -69.7 | 165.8 | 0 | 0 | 0 | 110.4 | S158 C159 F166 V180 | S158-I162 WeakPolarHBondContact O-CD1 3.5Å; S158-I162 VanDerWaalsContact O-CG1 3.26Å; S158-I162 WeakPolarHBondContact O-CG1 3.31Å; S158-I162 PolarHBondContact O-N 3.33Å; C159-I162 PolarHBondContact O-N 2.78Å; I162-F166 HydrophobicContact CG2-CD2 4.19Å; I162-F166 WeakPolarHBondContact O-CB 3.46Å; I162-F166 WeakPolarHBondContact O-CD2 3.31Å; I162-F166 PolarHBondContact O-N 3.25Å; I162-V180 HydrophobicContact CD1-CG2 4.06Å |
| 163 | L | 51.3 | Low | 49.6 | Very low | 118 Ų | 118 | 90.8 Ų | 90.8 | 62% | 0.618 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -65.1 | -36.4 | 177.3 | -91.9 | 137.3 | 0 | 0 | 0 | 113.4 | C159 L160 | C159-L163 WeakPolarHBondContact O-CD1 3.37Å; C159-L163 PolarHBondContact O-N 3.36Å; L160-L163 PolarHBondContact O-N 3.21Å |
| 164 | Q | 50.3 | Low | 48.9 | Very low | 145 Ų | 145 | 93.2 Ų | 93.2 | 68% | 0.678 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -81.9 | -27.2 | 179.9 | -82.7 | -174.1 | -32.4 | 0 | 0 | 114.4 | L160 Y161 | L160-Q164 WeakPolarHBondContact O-CB 3.25Å; L160-Q164 PolarHBondContact O-N 2.81Å; Y161-Q164 PolarHBondContact O-N 3.42Å |
| 165 | K | 45.2 | Very low | 48.3 | Very low | 116 Ų | 116 | 97.8 Ų | 97.8 | 50% | 0.504 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -100.8 | -12.6 | -173.2 | -160.5 | 158.3 | 180 | 172.6 | 0 | 114.1 | Y161 | Y161-K165 HydrophobicContact CE1-CD 4.34Å; Y161-K165 HydrophobicContact CE2-CD 3.76Å; Y161-K165 VanDerWaalsContact O-CB 3.3Å; Y161-K165 WeakPolarHBondContact O-CB 3.36Å; Y161-K165 PolarHBondContact O-N 2.93Å; Y161-K165 WeakPolarHBondContact OH-CD 3.37Å; Y161-K165 PolarHBondContact OH-NZ 3.39Å |
| 166 | F | 46 | Very low | 48 | Very low | 53 Ų | 53 | 93.1 Ų | 93.1 | 23% | 0.232 | 49% | 0.494 | C | S | . | . | trans | -115.9 | 27.2 | -176.3 | -71.2 | -73.7 | 0 | 0 | 0 | 115.6 | I162 G168 R172 A173 P176 | I162-F166 HydrophobicContact CG2-CD2 4.19Å; I162-F166 WeakPolarHBondContact O-CB 3.46Å; I162-F166 WeakPolarHBondContact O-CD2 3.31Å; I162-F166 PolarHBondContact O-N 3.25Å; F166-G168 PolarHBondContact O-N 2.8Å; F166-R172 HydrophobicContact CE1-CB 4.07Å; F166-R172 WeakPolarHBondContact CZ-O 3.42Å; F166-A173 HydrophobicContact CD1-CB 3.55Å; F166-A173 HydrophobicContact CD2-CB 4.41Å; F166-A173 HydrophobicContact CE1-CB 3.75Å; F166-A173 HydrophobicContact CG-CB 3.93Å; F166-A173 HydrophobicContact CZ-CB 4.26Å; F166-P176 HydrophobicContact CE2-CB 4.36Å; F166-P176 HydrophobicContact CE2-CG 3.4Å; F166-P176 VanDerWaalsContact CE2-CG 3.4Å; F166-P176 HydrophobicContact CZ-CG 3.4Å | ||
| 167 | E | 47.8 | Very low | 47.9 | Very low | 187 Ų | 187 | 96.3 Ų | 96.3 | 87% | 0.874 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -75.2 | -7.1 | 168.2 | -150.5 | 161.5 | -166.3 | 0 | 0 | 112.4 | ||
| 168 | G | 43.4 | Very low | 47.8 | Very low | 61 Ų | 61 | 98.9 Ų | 98.9 | 63% | 0.629 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -110.4 | -35.2 | -170 | 0 | 0 | 0 | 0 | 0 | 118.3 | F166 | F166-G168 PolarHBondContact O-N 2.8Š|
| 169 | D | 40.4 | Very low | 47.9 | Very low | 121 Ų | 121 | 102.2 Ų | 102.2 | 65% | 0.647 | 53% | 0.532 | S | S | * | . | trans | -154.5 | 120.4 | -176.8 | -84.1 | -51.1 | 0 | 0 | 0 | 112.9 | E171 | D169-E171 PolarHBondContact O-N 3.22Š| ||
| 170 | P | 46.5 | Very low | 48.3 | Very low | 102 Ų | 102 | 101.1 Ų | 101.1 | 66% | 0.662 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -14.1 | -169.8 | 29.2 | -34.6 | 0 | 0 | 0 | 114.9 | ||
| 171 | E | 45.1 | Very low | 48.3 | Very low | 173 Ų | 173 | 101.1 Ų | 101.1 | 81% | 0.808 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -26.4 | -168.8 | -52.5 | -170 | -168.8 | 0 | 0 | 113.1 | D169 | D169-E171 PolarHBondContact O-N 3.22Š|
| 172 | R | 44.8 | Very low | 48.2 | Very low | 203 Ų | 203 | 99.9 Ų | 99.9 | 77% | 0.766 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.4 | -4.9 | 176 | -65.8 | -168.9 | -179.4 | -160.3 | 1.8 | 113.6 | F166 V174 P176 | F166-R172 HydrophobicContact CE1-CB 4.07Å; F166-R172 WeakPolarHBondContact CZ-O 3.42Å; R172-V174 VanDerWaalsContact C-N 3.26Å; R172-V174 PolarHBondContact O-N 2.8Å; R172-P176 WeakPolarHBondContact O-CD 3.26Å |
| 173 | A | 47.4 | Very low | 48.5 | Very low | 25 Ų | 25 | 99.3 Ų | 99.3 | 21% | 0.207 | 53% | 0.525 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.4 | -20 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | F166 P176 L177 | F166-A173 HydrophobicContact CD1-CB 3.55Å; F166-A173 HydrophobicContact CD2-CB 4.41Å; F166-A173 HydrophobicContact CE1-CB 3.75Å; F166-A173 HydrophobicContact CG-CB 3.93Å; F166-A173 HydrophobicContact CZ-CB 4.26Å; A173-P176 VanDerWaalsContact O-CD 3.31Å; A173-P176 WeakPolarHBondContact O-CD 3.37Å; A173-P176 WeakPolarHBondContact O-CG 3.21Å; A173-L177 WeakPolarHBondContact O-CB 3.33Å; A173-L177 PolarHBondContact O-N 3.17Å |
| 174 | V | 43.2 | Very low | 48.7 | Very low | 98 Ų | 98 | 100.6 Ų | 100.6 | 59% | 0.594 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -67.9 | -36.3 | -177.7 | -178.9 | 0 | 0 | 0 | 0 | 112.1 | R172 L177 C178 | R172-V174 VanDerWaalsContact C-N 3.26Å; R172-V174 PolarHBondContact O-N 2.8Å; V174-L177 PolarHBondContact O-N 3.38Å; V174-C178 WeakPolarHBondContact O-CB 3.4Å; V174-C178 PolarHBondContact O-N 3.41Å |
| 175 | L | 46.7 | Very low | 48.6 | Very low | 138 Ų | 138 | 101.6 Ų | 101.6 | 72% | 0.723 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.6 | -48.8 | 178.8 | -92.6 | 156.5 | 0 | 0 | 0 | 113.7 | C178 F179 | L175-C178 PolarHBondContact O-N 2.77Å; L175-F179 WeakPolarHBondContact O-CB 3.49Å; L175-F179 PolarHBondContact O-N 2.83Å |
| 176 | P | 50.4 | Low | 48.4 | Very low | 31 Ų | 31 | 101.8 Ų | 101.8 | 20% | 0.201 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -70.8 | -30.8 | 173.6 | 19.9 | -24.6 | 0 | 0 | 0 | 112.5 | F166 R172 A173 C178 F179 V180 | F166-P176 HydrophobicContact CE2-CB 4.36Å; F166-P176 HydrophobicContact CE2-CG 3.4Å; F166-P176 VanDerWaalsContact CE2-CG 3.4Å; F166-P176 HydrophobicContact CZ-CG 3.4Å; R172-P176 WeakPolarHBondContact O-CD 3.26Å; A173-P176 VanDerWaalsContact O-CD 3.31Å; A173-P176 WeakPolarHBondContact O-CD 3.37Å; A173-P176 WeakPolarHBondContact O-CG 3.21Å; P176-C178 VanDerWaalsContact C-N 3.34Å; P176-F179 PolarHBondContact O-N 3.43Å; P176-V180 WeakPolarHBondContact O-CB 3.27Å; P176-V180 VanDerWaalsContact O-CG2 3.27Å; P176-V180 WeakPolarHBondContact O-CG2 3.21Å; P176-V180 PolarHBondContact O-N 3.34Å |
| 177 | L | 50.2 | Low | 48.5 | Very low | 111 Ų | 111 | 100.6 Ų | 100.6 | 58% | 0.581 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -67.1 | -37 | 172.3 | -161.5 | 121.1 | 0 | 0 | 0 | 111.4 | A173 V174 V180 M181 | A173-L177 WeakPolarHBondContact O-CB 3.33Å; A173-L177 PolarHBondContact O-N 3.17Å; V174-L177 PolarHBondContact O-N 3.38Å; L177-V180 PolarHBondContact O-N 3.01Å; L177-M181 WeakPolarHBondContact O-CB 2.96Å; L177-M181 PolarHBondContact O-N 2.92Å |
| 178 | C | 49.9 | Very low | 48.1 | Very low | 75 Ų | 75 | 92.9 Ų | 92.9 | 51% | 0.507 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.2 | -39.1 | 171.8 | -174.4 | 0 | 0 | 0 | 0 | 111.6 | V174 L175 P176 M181 A182 | V174-C178 WeakPolarHBondContact O-CB 3.4Å; V174-C178 PolarHBondContact O-N 3.41Å; L175-C178 PolarHBondContact O-N 2.77Å; P176-C178 VanDerWaalsContact C-N 3.34Å; C178-M181 PolarHBondContact O-N 2.87Å; C178-A182 WeakPolarHBondContact O-CB 3.39Å; C178-A182 PolarHBondContact O-N 3.27Å |
| 179 | F | 54.6 | Low | 48.1 | Very low | 117 Ų | 117 | 95.5 Ų | 95.5 | 51% | 0.513 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 173.8 | -172 | -99.4 | 0 | 0 | 0 | 111.7 | L175 P176 A182 V183 | L175-F179 WeakPolarHBondContact O-CB 3.49Å; L175-F179 PolarHBondContact O-N 2.83Å; P176-F179 PolarHBondContact O-N 3.43Å; F179-A182 PolarHBondContact O-N 3.06Å; F179-V183 HydrophobicContact CD1-CG2 4.09Å; F179-V183 HydrophobicContact CE1-CG2 3.83Å; F179-V183 HydrophobicContact CZ-CG2 4.07Å; F179-V183 VanDerWaalsContact O-CB 3.29Å; F179-V183 WeakPolarHBondContact O-CB 3.31Å; F179-V183 WeakPolarHBondContact O-CG2 3.34Å; F179-V183 PolarHBondContact O-N 2.85Å |
| 180 | V | 58.4 | Low | 48.4 | Very low | 39 Ų | 39 | 92.6 Ų | 92.6 | 24% | 0.236 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -66.7 | -39.7 | 173.8 | 170 | 0 | 0 | 0 | 0 | 111.1 | I162 P176 L177 Y184 | I162-V180 HydrophobicContact CD1-CG2 4.06Å; P176-V180 WeakPolarHBondContact O-CB 3.27Å; P176-V180 VanDerWaalsContact O-CG2 3.27Å; P176-V180 WeakPolarHBondContact O-CG2 3.21Å; P176-V180 PolarHBondContact O-N 3.34Å; L177-V180 PolarHBondContact O-N 3.01Å; V180-Y184 WeakPolarHBondContact O-CB 3.29Å; V180-Y184 PolarHBondContact O-N 2.82Å |
| 181 | M | 50.8 | Low | 48.2 | Very low | 89 Ų | 89 | 90.6 Ų | 90.6 | 44% | 0.438 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.9 | -42.2 | 173.3 | -113.7 | -59.6 | 113.8 | 0 | 0 | 111.9 | L177 C178 Y184 F185 | L177-M181 WeakPolarHBondContact O-CB 2.96Å; L177-M181 PolarHBondContact O-N 2.92Å; C178-M181 PolarHBondContact O-N 2.87Å; M181-Y184 HydrophobicContact CE-CD1 3.32Å; M181-Y184 HydrophobicContact CE-CE1 3.96Å; M181-Y184 HydrophobicContact CE-CG 3.77Å; M181-Y184 CarbonylContact O-C 3.54Å; M181-Y184 WeakPolarHBondContact O-CB 3.2Å; M181-Y184 PolarHBondContact O-N 2.85Å; M181-Y184 HydrophobicContact SD-CD1 4.21Å; M181-F185 WeakPolarHBondContact O-CB 3.5Å; M181-F185 PolarHBondContact O-N 3.44Å; M181-F185 HydrophobicContact SD-CD2 4.13Å |
| 182 | A | 49.6 | Very low | 47.8 | Very low | 47 Ų | 47 | 85.4 Ų | 85.4 | 39% | 0.388 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -68.1 | -39.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | C178 F179 F185 M186 | C178-A182 WeakPolarHBondContact O-CB 3.39Å; C178-A182 PolarHBondContact O-N 3.27Å; F179-A182 PolarHBondContact O-N 3.06Å; A182-F185 PolarHBondContact O-N 3.35Å; A182-M186 WeakPolarHBondContact O-CB 3.26Å; A182-M186 WeakPolarHBondContact O-CG 3.36Å; A182-M186 PolarHBondContact O-N 3.15Å |
| 183 | V | 57.3 | Low | 47.6 | Very low | 37 Ų | 37 | 84.1 Ų | 84.1 | 22% | 0.224 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -66 | -39.3 | 170.9 | 170.4 | 0 | 0 | 0 | 0 | 110.2 | L132 F136 F179 T187 | L132-V183 HydrophobicContact CD2-CG2 4.44Å; F136-V183 HydrophobicContact CZ-CG1 4.13Å; F179-V183 HydrophobicContact CD1-CG2 4.09Å; F179-V183 HydrophobicContact CE1-CG2 3.83Å; F179-V183 HydrophobicContact CZ-CG2 4.07Å; F179-V183 VanDerWaalsContact O-CB 3.29Å; F179-V183 WeakPolarHBondContact O-CB 3.31Å; F179-V183 WeakPolarHBondContact O-CG2 3.34Å; F179-V183 PolarHBondContact O-N 2.85Å; V183-T187 HydrophobicContact CG1-CG2 4.42Å; V183-T187 WeakPolarHBondContact O-CA 3.27Å; V183-T187 WeakPolarHBondContact O-CB 3.19Å; V183-T187 WeakPolarHBondContact O-CG2 3.48Å; V183-T187 PolarHBondContact O-N 3.45Å; V183-T187 PolarHBondContact O-OG1 3.42Å |
| 184 | Y | 54.2 | Low | 47.1 | Very low | 145 Ų | 145 | 92.7 Ų | 92.7 | 57% | 0.569 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -66.8 | -37.8 | 174.8 | -177.6 | -94 | 0 | 0 | 0 | 112.8 | V180 M181 T187 G188 | V180-Y184 WeakPolarHBondContact O-CB 3.29Å; V180-Y184 PolarHBondContact O-N 2.82Å; M181-Y184 HydrophobicContact CE-CD1 3.32Å; M181-Y184 HydrophobicContact CE-CE1 3.96Å; M181-Y184 HydrophobicContact CE-CG 3.77Å; M181-Y184 CarbonylContact O-C 3.54Å; M181-Y184 WeakPolarHBondContact O-CB 3.2Å; M181-Y184 PolarHBondContact O-N 2.85Å; M181-Y184 HydrophobicContact SD-CD1 4.21Å; Y184-T187 CarbonylContact O-C 3.13Å; Y184-G188 WeakPolarHBondContact O-CA 3.13Å; Y184-G188 PolarHBondContact O-N 3.01Å; Y184-G188 VanDerWaalsContact O-N 3.09Å |
| 185 | F | 47.7 | Very low | 47 | Very low | 166 Ų | 166 | 98.2 Ų | 98.2 | 73% | 0.728 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -74.5 | -41.7 | 177.4 | -122.5 | -91.1 | 0 | 0 | 0 | 112.1 | M181 A182 G188 | M181-F185 WeakPolarHBondContact O-CB 3.5Å; M181-F185 PolarHBondContact O-N 3.44Å; M181-F185 HydrophobicContact SD-CD2 4.13Å; A182-F185 PolarHBondContact O-N 3.35Å; F185-G188 VanDerWaalsContact O-CA 3.28Å; F185-G188 WeakPolarHBondContact O-CA 3.46Å; F185-G188 PolarHBondContact O-N 3.41Å |
| 186 | M | 42.8 | Very low | 46.5 | Very low | 119 Ų | 119 | 100.7 Ų | 100.7 | 59% | 0.586 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -71.7 | -31.5 | 174.9 | -74.3 | -68.4 | -149 | 0 | 0 | 111.7 | Y125 A182 G188 | Y125-M186 HydrophobicContact CE2-CE 4.37Å; A182-M186 WeakPolarHBondContact O-CB 3.26Å; A182-M186 WeakPolarHBondContact O-CG 3.36Å; A182-M186 PolarHBondContact O-N 3.15Å; M186-G188 PolarHBondContact O-N 2.97Å |
| 187 | T | 46.4 | Very low | 46 | Very low | 29 Ų | 29 | 102.8 Ų | 102.8 | 18% | 0.178 | 54% | 0.535 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.8 | 36 | 163.6 | 67.7 | 0 | 0 | 0 | 0 | 111.6 | F136 R151 V183 Y184 | F136-T187 HydrophobicContact CE1-CG2 4.27Å; F136-T187 HydrophobicContact CE2-CG2 4.36Å; F136-T187 HydrophobicContact CZ-CG2 4.02Å; R151-T187 PolarHBondContact NH1-O 2.92Å; V183-T187 HydrophobicContact CG1-CG2 4.42Å; V183-T187 WeakPolarHBondContact O-CA 3.27Å; V183-T187 WeakPolarHBondContact O-CB 3.19Å; V183-T187 WeakPolarHBondContact O-CG2 3.48Å; V183-T187 PolarHBondContact O-N 3.45Å; V183-T187 PolarHBondContact O-OG1 3.42Å; Y184-T187 CarbonylContact O-C 3.13Å |
| 188 | G | 40.2 | Very low | 45.5 | Very low | 25 Ų | 25 | 100.6 Ų | 100.6 | 26% | 0.258 | 54% | 0.539 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -45.2 | 162.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y184 F185 M186 V190 | Y184-G188 WeakPolarHBondContact O-CA 3.13Å; Y184-G188 PolarHBondContact O-N 3.01Å; Y184-G188 VanDerWaalsContact O-N 3.09Å; F185-G188 VanDerWaalsContact O-CA 3.28Å; F185-G188 WeakPolarHBondContact O-CA 3.46Å; F185-G188 PolarHBondContact O-N 3.41Å; M186-G188 PolarHBondContact O-N 2.97Å; G188-V190 VanDerWaalsContact C-N 3.33Å; G188-V190 WeakPolarHBondContact O-CG2 3.27Å; G188-V190 PolarHBondContact O-N 3.47Å |
| 189 | P | 43.9 | Very low | 45.3 | Very low | 116 Ų | 116 | 98.4 Ų | 98.4 | 75% | 0.753 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.8 | 89.8 | -160.3 | 19.9 | -32.8 | 0 | 0 | 0 | 113.4 | G191 A192 | P189-G191 PolarHBondContact O-N 2.81Å; P189-A192 PolarHBondContact O-N 3.42Å; P189-A192 VanDerWaalsContact O-N 3.17Å |
| 190 | V | 47.2 | Very low | 44.9 | Very low | 59 Ų | 59 | 96.6 Ų | 96.6 | 36% | 0.358 | 53% | 0.528 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | 21.7 | 175.8 | -156.1 | 0 | 0 | 0 | 0 | 110.2 | G188 A192 Y193 | G188-V190 VanDerWaalsContact C-N 3.33Å; G188-V190 WeakPolarHBondContact O-CG2 3.27Å; G188-V190 PolarHBondContact O-N 3.47Å; V190-A192 VanDerWaalsContact C-N 3.25Å; V190-Y193 HydrophobicContact CG1-CD2 4.24Å; V190-Y193 HydrophobicContact CG1-CG 4.42Å |
| 191 | G | 41.8 | Very low | 44.7 | Very low | 60 Ų | 60 | 97.6 Ų | 97.6 | 62% | 0.619 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.1 | -21.1 | 157.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | P189 | P189-G191 PolarHBondContact O-N 2.81Š|
| 192 | A | 37.1 | Very low | 44.8 | Very low | 64 Ų | 64 | 96.4 Ų | 96.4 | 53% | 0.529 | 54% | 0.541 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -38 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | P189 V190 R195 | P189-A192 PolarHBondContact O-N 3.42Å; P189-A192 VanDerWaalsContact O-N 3.17Å; V190-A192 VanDerWaalsContact C-N 3.25Å; A192-R195 VanDerWaalsContact O-CB 3.22Å; A192-R195 WeakPolarHBondContact O-CB 3.18Å; A192-R195 PolarHBondContact O-N 2.9Å |
| 193 | Y | 40.3 | Very low | 45.1 | Very low | 176 Ų | 176 | 99.4 Ų | 99.4 | 69% | 0.69 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | -26 | -179.4 | -67.8 | -83.2 | 0 | 0 | 0 | 113.2 | V190 R195 R196 | V190-Y193 HydrophobicContact CG1-CD2 4.24Å; V190-Y193 HydrophobicContact CG1-CG 4.42Å; Y193-R195 PolarHBondContact O-N 2.79Å; Y193-R196 PolarHBondContact O-N 3.33Å |
| 194 | W | 36.9 | Very low | 45.5 | Very low | 205 Ų | 205 | 103.5 Ų | 103.5 | 78% | 0.777 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -72.8 | -19.1 | 167.9 | -139.2 | 62.8 | 0 | 0 | 0 | 112.7 | R196 | W194-R196 PolarHBondContact O-N 3.3Š|
| 195 | R | 39.9 | Very low | 46.1 | Very low | 215 Ų | 215 | 103.1 Ų | 103.1 | 81% | 0.811 | 57% | 0.57 | S | S | * | * | G | 310 helix | trans | -72.4 | -13.4 | 169.7 | -140.6 | -172.3 | -146.5 | -100.2 | 6.1 | 113.1 | A192 Y193 | A192-R195 VanDerWaalsContact O-CB 3.22Å; A192-R195 WeakPolarHBondContact O-CB 3.18Å; A192-R195 PolarHBondContact O-N 2.9Å; Y193-R195 PolarHBondContact O-N 2.79Å |
| 196 | R | 37.4 | Very low | 47.2 | Very low | 189 Ų | 189 | 101.6 Ų | 101.6 | 71% | 0.713 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -98.9 | 2.4 | -177.4 | -151 | 162.3 | -172.1 | 166.7 | 0.7 | 114.4 | Y193 W194 | Y193-R196 PolarHBondContact O-N 3.33Å; W194-R196 PolarHBondContact O-N 3.3Å |
| 197 | G | 38.7 | Very low | 48.9 | Very low | 76 Ų | 76 | 100.9 Ų | 100.9 | 78% | 0.784 | 56% | 0.56 | S | S | * | * | S | Bend | trans | -98.2 | 11.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 198 | G | 40.8 | Very low | 50.3 | Low | 64 Ų | 64 | 103.7 Ų | 103.7 | 66% | 0.66 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -153.2 | 10.7 | -177.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 199 | G | 44.4 | Very low | 52.3 | Low | 30 Ų | 30 | 107.9 Ų | 107.9 | 31% | 0.309 | 59% | 0.587 | S | S | . | * | S | Bend | trans | -116.1 | -26.5 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115 | L203 | G199-L203 WeakPolarHBondContact O-CB 3.41Å; G199-L203 PolarHBondContact O-N 2.87Å |
| 200 | T | 47.5 | Very low | 54.3 | Low | 79 Ų | 79 | 107.2 Ų | 107.2 | 49% | 0.485 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -76 | -39.5 | -179.9 | 43.8 | 0 | 0 | 0 | 0 | 111.9 | S202 L203 E204 | T200-S202 VanDerWaalsContact C-N 3.34Å; T200-S202 PolarHBondContact O-N 3.39Å; T200-L203 PolarHBondContact O-N 3.39Å; T200-E204 WeakPolarHBondContact O-CB 3.44Å; T200-E204 PolarHBondContact O-N 2.84Å |
| 201 | A | 53 | Low | 56.1 | Low | 60 Ų | 60 | 109.3 Ų | 109.3 | 50% | 0.496 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -60.1 | -43 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | E205 | A201-E205 WeakPolarHBondContact O-CB 3.33Å; A201-E205 PolarHBondContact O-N 3.36Å |
| 202 | S | 54.5 | Low | 58.3 | Low | 64 Ų | 64 | 110 Ų | 110 | 45% | 0.448 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -71 | -35.1 | 178.9 | 173.2 | 0 | 0 | 0 | 0 | 113.8 | T200 K206 | T200-S202 VanDerWaalsContact C-N 3.34Å; T200-S202 PolarHBondContact O-N 3.39Å; S202-K206 VanDerWaalsContact O-CB 3.27Å; S202-K206 WeakPolarHBondContact O-CB 3.49Å; S202-K206 VanDerWaalsContact O-CG 3.24Å; S202-K206 WeakPolarHBondContact O-CG 3.46Å; S202-K206 PolarHBondContact O-N 2.82Å |
| 203 | L | 56.1 | Low | 60.8 | Low | 110 Ų | 110 | 111.9 Ų | 111.9 | 58% | 0.576 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -74.2 | -39.6 | 177.3 | -90.3 | 154.9 | 0 | 0 | 0 | 111.6 | G199 T200 K206 I207 | G199-L203 WeakPolarHBondContact O-CB 3.41Å; G199-L203 PolarHBondContact O-N 2.87Å; T200-L203 PolarHBondContact O-N 3.39Å; L203-K206 PolarHBondContact O-N 2.72Å; L203-I207 VanDerWaalsContact O-CB 3.32Å; L203-I207 WeakPolarHBondContact O-CB 3.42Å; L203-I207 VanDerWaalsContact O-CG1 3.23Å; L203-I207 WeakPolarHBondContact O-CG1 3.39Å; L203-I207 PolarHBondContact O-N 3.33Å |
| 204 | E | 65.5 | Low | 62.8 | Low | 123 Ų | 123 | 108.7 Ų | 108.7 | 58% | 0.575 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -66.8 | -41.3 | 174.7 | -164.3 | 160.8 | -167.7 | 0 | 0 | 110.7 | T200 K206 I207 N208 | T200-E204 WeakPolarHBondContact O-CB 3.44Å; T200-E204 PolarHBondContact O-N 2.84Å; E204-K206 PolarHBondContact O-N 2.89Å; E204-I207 PolarHBondContact O-N 3.34Å; E204-N208 WeakPolarHBondContact O-CB 3.45Å; E204-N208 PolarHBondContact O-N 2.72Å; E204-N208 PolarHBondContact O-ND2 3.49Å |
| 205 | E | 65.4 | Low | 65.3 | Low | 136 Ų | 136 | 107.5 Ų | 107.5 | 64% | 0.636 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -62.2 | -42.7 | 171.1 | -146.6 | 84 | -150.8 | 0 | 0 | 111.7 | A201 N208 H209 | A201-E205 WeakPolarHBondContact O-CB 3.33Å; A201-E205 PolarHBondContact O-N 3.36Å; E205-N208 PolarHBondContact O-N 2.83Å; E205-H209 VanDerWaalsContact O-CB 3.23Å; E205-H209 WeakPolarHBondContact O-CB 3.37Å; E205-H209 PolarHBondContact O-N 3.49Å |
| 206 | K | 72.2 | Confident | 67.5 | Low | 135 Ų | 135 | 101.5 Ų | 101.5 | 59% | 0.587 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -68.6 | -36 | 177.9 | -81.4 | -174.8 | 178.6 | -158.5 | 0 | 112.4 | S202 L203 E204 H209 L210 | S202-K206 VanDerWaalsContact O-CB 3.27Å; S202-K206 WeakPolarHBondContact O-CB 3.49Å; S202-K206 VanDerWaalsContact O-CG 3.24Å; S202-K206 WeakPolarHBondContact O-CG 3.46Å; S202-K206 PolarHBondContact O-N 2.82Å; L203-K206 PolarHBondContact O-N 2.72Å; E204-K206 PolarHBondContact O-N 2.89Å; K206-H209 PolarHBondContact O-N 2.85Å; K206-L210 WeakPolarHBondContact O-CB 3.35Å; K206-L210 VanDerWaalsContact O-CG 3.28Å; K206-L210 WeakPolarHBondContact O-CG 3.42Å; K206-L210 PolarHBondContact O-N 3.23Å |
| 207 | I | 77.9 | Confident | 69.8 | Low | 103 Ų | 103 | 98 Ų | 98 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.5 | -48.2 | 173.7 | -78.2 | 165.9 | 0 | 0 | 0 | 109.7 | L203 E204 H209 L210 D211 | L203-I207 VanDerWaalsContact O-CB 3.32Å; L203-I207 WeakPolarHBondContact O-CB 3.42Å; L203-I207 VanDerWaalsContact O-CG1 3.23Å; L203-I207 WeakPolarHBondContact O-CG1 3.39Å; L203-I207 PolarHBondContact O-N 3.33Å; E204-I207 PolarHBondContact O-N 3.34Å; I207-H209 VanDerWaalsContact C-N 3.26Å; I207-H209 PolarHBondContact O-N 2.9Å; I207-L210 PolarHBondContact O-N 3.26Å; I207-D211 WeakPolarHBondContact O-CB 3.45Å; I207-D211 PolarHBondContact O-N 2.82Å |
| 208 | N | 76.3 | Confident | 72.1 | Confident | 88 Ų | 88 | 99.2 Ų | 99.2 | 47% | 0.471 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.5 | -36.7 | 177.2 | -70.6 | -22.2 | 0 | 0 | 0 | 111.6 | E204 E205 T212 | E204-N208 WeakPolarHBondContact O-CB 3.45Å; E204-N208 PolarHBondContact O-N 2.72Å; E204-N208 PolarHBondContact O-ND2 3.49Å; E205-N208 PolarHBondContact O-N 2.83Å; N208-T212 WeakPolarHBondContact O-CB 3.34Å; N208-T212 PolarHBondContact O-N 3.19Å; N208-T212 PolarHBondContact O-OG1 3.4Å |
| 209 | H | 82.1 | Confident | 74.4 | Confident | 113 Ų | 113 | 99.4 Ų | 99.4 | 52% | 0.523 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.2 | -43.2 | 175.4 | -168.6 | 61.3 | 0 | 0 | 0 | 112.2 | E205 K206 I207 T212 Q213 | E205-H209 VanDerWaalsContact O-CB 3.23Å; E205-H209 WeakPolarHBondContact O-CB 3.37Å; E205-H209 PolarHBondContact O-N 3.49Å; K206-H209 PolarHBondContact O-N 2.85Å; I207-H209 VanDerWaalsContact C-N 3.26Å; I207-H209 PolarHBondContact O-N 2.9Å; H209-T212 PolarHBondContact O-N 2.92Å; H209-Q213 PolarHBondContact CD2-NE2 2.89Å; H209-Q213 PolarHBondContact NE2-NE2 3.23Å; H209-Q213 WeakPolarHBondContact O-CG 3.28Å; H209-Q213 PolarHBondContact O-N 3.35Å |
| 210 | L | 85 | Confident | 76.4 | Confident | 102 Ų | 102 | 106.3 Ų | 106.3 | 53% | 0.534 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.5 | -42.9 | 175.3 | -76.8 | 164.8 | 0 | 0 | 0 | 111.8 | K206 I207 T212 Q213 I214 | K206-L210 WeakPolarHBondContact O-CB 3.35Å; K206-L210 VanDerWaalsContact O-CG 3.28Å; K206-L210 WeakPolarHBondContact O-CG 3.42Å; K206-L210 PolarHBondContact O-N 3.23Å; I207-L210 PolarHBondContact O-N 3.26Å; L210-T212 VanDerWaalsContact C-N 3.35Å; L210-T212 PolarHBondContact O-N 3.5Å; L210-Q213 PolarHBondContact O-N 3.29Å; L210-I214 VanDerWaalsContact O-CG1 3.31Å; L210-I214 WeakPolarHBondContact O-CG1 3.1Å; L210-I214 PolarHBondContact O-N 2.98Å |
| 211 | D | 85.9 | Confident | 78.1 | Confident | 103 Ų | 103 | 107.3 Ų | 107.3 | 55% | 0.551 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63 | -42.1 | 177.5 | -169.4 | 59.2 | 0 | 0 | 0 | 111.7 | I207 Q213 I214 R215 | I207-D211 WeakPolarHBondContact O-CB 3.45Å; I207-D211 PolarHBondContact O-N 2.82Å; D211-Q213 PolarHBondContact O-N 3.28Å; D211-I214 PolarHBondContact O-N 2.94Å; D211-R215 PolarHBondContact O-N 3.04Å |
| 212 | T | 87.4 | Confident | 79.6 | Confident | 76 Ų | 76 | 106.9 Ų | 106.9 | 47% | 0.466 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.7 | -41.1 | 174.8 | -56.3 | 0 | 0 | 0 | 0 | 111.8 | N208 H209 L210 R215 L216 | N208-T212 WeakPolarHBondContact O-CB 3.34Å; N208-T212 PolarHBondContact O-N 3.19Å; N208-T212 PolarHBondContact O-OG1 3.4Å; H209-T212 PolarHBondContact O-N 2.92Å; L210-T212 VanDerWaalsContact C-N 3.35Å; L210-T212 PolarHBondContact O-N 3.5Å; T212-R215 PolarHBondContact O-N 3.47Å; T212-L216 HydrophobicContact CG2-CD1 4.31Å; T212-L216 WeakPolarHBondContact O-CG 3.47Å; T212-L216 PolarHBondContact O-N 3.39Å; T212-L216 VanDerWaalsContact O-N 3.08Å |
| 213 | Q | 88.9 | Confident | 81 | Confident | 102 Ų | 102 | 111.8 Ų | 111.8 | 48% | 0.477 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.3 | -41.5 | 176.9 | -74.9 | -169.3 | 27.4 | 0 | 0 | 112.4 | H209 L210 D211 R215 L216 L217 | H209-Q213 PolarHBondContact CD2-NE2 2.89Å; H209-Q213 PolarHBondContact NE2-NE2 3.23Å; H209-Q213 WeakPolarHBondContact O-CG 3.28Å; H209-Q213 PolarHBondContact O-N 3.35Å; L210-Q213 PolarHBondContact O-N 3.29Å; D211-Q213 PolarHBondContact O-N 3.28Å; Q213-R215 VanDerWaalsContact C-N 3.32Å; Q213-R215 PolarHBondContact O-N 3.45Å; Q213-L216 PolarHBondContact O-N 3.01Å; Q213-L217 WeakPolarHBondContact O-CB 3.3Å; Q213-L217 PolarHBondContact O-N 3.03Å |
| 214 | I | 82.8 | Confident | 82.5 | Confident | 109 Ų | 109 | 110.3 Ų | 110.3 | 56% | 0.559 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.7 | -42.8 | 176.5 | -69.4 | 165.7 | 0 | 0 | 0 | 110.2 | L210 D211 L216 L217 N218 | L210-I214 VanDerWaalsContact O-CG1 3.31Å; L210-I214 WeakPolarHBondContact O-CG1 3.1Å; L210-I214 PolarHBondContact O-N 2.98Å; D211-I214 PolarHBondContact O-N 2.94Å; I214-L216 PolarHBondContact O-N 3.31Å; I214-L217 PolarHBondContact O-N 2.97Å; I214-N218 WeakPolarHBondContact O-CB 3.44Å; I214-N218 PolarHBondContact O-N 3.02Å |
| 215 | R | 88.8 | Confident | 83.5 | Confident | 181 Ų | 181 | 108.7 Ų | 108.7 | 68% | 0.683 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.9 | -43.4 | 177.1 | -161.4 | 175.9 | 94.6 | 160.1 | 5.2 | 112.3 | D211 T212 Q213 N218 I219 | D211-R215 PolarHBondContact O-N 3.04Å; T212-R215 PolarHBondContact O-N 3.47Å; Q213-R215 VanDerWaalsContact C-N 3.32Å; Q213-R215 PolarHBondContact O-N 3.45Å; R215-N218 PolarHBondContact O-N 3.44Å; R215-I219 WeakPolarHBondContact O-CG1 3.28Å; R215-I219 PolarHBondContact O-N 2.92Å; R215-I219 VanDerWaalsContact O-N 3.17Å |
| 216 | L | 85.9 | Confident | 84.3 | Confident | 89 Ų | 89 | 105.5 Ų | 105.5 | 47% | 0.466 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.6 | -38.3 | 177.8 | -73 | 171.2 | 0 | 0 | 0 | 112.3 | T212 Q213 I214 I219 R220 | T212-L216 HydrophobicContact CG2-CD1 4.31Å; T212-L216 WeakPolarHBondContact O-CG 3.47Å; T212-L216 PolarHBondContact O-N 3.39Å; T212-L216 VanDerWaalsContact O-N 3.08Å; Q213-L216 PolarHBondContact O-N 3.01Å; I214-L216 PolarHBondContact O-N 3.31Å; L216-I219 PolarHBondContact O-N 3Å; L216-R220 WeakPolarHBondContact O-CG 3.31Å; L216-R220 PolarHBondContact O-N 3.43Å |
| 217 | L | 87.3 | Confident | 84.8 | Confident | 116 Ų | 116 | 102 Ų | 102 | 61% | 0.607 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.8 | -44.3 | 176 | -172.6 | 70.6 | 0 | 0 | 0 | 111 | Q213 I214 I219 R220 L221 | Q213-L217 WeakPolarHBondContact O-CB 3.3Å; Q213-L217 PolarHBondContact O-N 3.03Å; I214-L217 PolarHBondContact O-N 2.97Å; L217-I219 VanDerWaalsContact C-N 3.34Å; L217-I219 PolarHBondContact O-N 3.49Å; L217-R220 PolarHBondContact O-N 3.48Å; L217-L221 WeakPolarHBondContact O-CB 3.43Å; L217-L221 PolarHBondContact O-N 3.36Å |
| 218 | N | 87.3 | Confident | 85 | Confident | 100 Ų | 100 | 102.6 Ų | 102.6 | 54% | 0.535 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.9 | -41.5 | 178.5 | -167 | 6.4 | 0 | 0 | 0 | 112 | I214 R215 R220 L221 S222 | I214-N218 WeakPolarHBondContact O-CB 3.44Å; I214-N218 PolarHBondContact O-N 3.02Å; R215-N218 PolarHBondContact O-N 3.44Å; N218-R220 PolarHBondContact O-N 3.35Å; N218-L221 PolarHBondContact O-N 3.31Å; N218-S222 WeakPolarHBondContact O-CB 3.36Å; N218-S222 PolarHBondContact O-N 2.77Å; N218-S222 PolarHBondContact O-OG 3.05Å |
| 219 | I | 88.8 | Confident | 85.2 | Confident | 69 Ų | 69 | 104.3 Ų | 104.3 | 35% | 0.354 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 175 | -67.9 | 166.1 | 0 | 0 | 0 | 111.4 | R215 L216 L217 R223 | R215-I219 WeakPolarHBondContact O-CG1 3.28Å; R215-I219 PolarHBondContact O-N 2.92Å; R215-I219 VanDerWaalsContact O-N 3.17Å; L216-I219 PolarHBondContact O-N 3Å; L217-I219 VanDerWaalsContact C-N 3.34Å; L217-I219 PolarHBondContact O-N 3.49Å; I219-R223 VanDerWaalsContact CG2-NH2 3.27Å; I219-R223 PolarHBondContact O-N 3.1Å; I219-R223 VanDerWaalsContact O-N 3.09Å |
| 220 | R | 85.4 | Confident | 84.8 | Confident | 174 Ų | 174 | 106.9 Ų | 106.9 | 66% | 0.657 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.5 | -42.6 | 178.1 | -75.5 | -178.8 | -178.2 | -178.1 | 1.3 | 111.5 | L216 L217 N218 R223 V224 | L216-R220 WeakPolarHBondContact O-CG 3.31Å; L216-R220 PolarHBondContact O-N 3.43Å; L217-R220 PolarHBondContact O-N 3.48Å; N218-R220 PolarHBondContact O-N 3.35Å; R220-R223 PolarHBondContact O-N 3.07Å; R220-V224 VanDerWaalsContact O-CG2 3.3Å; R220-V224 WeakPolarHBondContact O-CG2 3.08Å; R220-V224 PolarHBondContact O-N 2.91Å |
| 221 | L | 83.9 | Confident | 84.2 | Confident | 100 Ų | 100 | 105.1 Ų | 105.1 | 52% | 0.524 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.8 | -44.8 | 178.2 | -162.1 | 86.8 | 0 | 0 | 0 | 111 | L217 N218 R223 V224 I225 | L217-L221 WeakPolarHBondContact O-CB 3.43Å; L217-L221 PolarHBondContact O-N 3.36Å; N218-L221 PolarHBondContact O-N 3.31Å; L221-R223 VanDerWaalsContact C-N 3.33Å; L221-R223 PolarHBondContact O-N 3.17Å; L221-V224 PolarHBondContact O-N 3.44Å; L221-V224 VanDerWaalsContact O-N 3.15Å; L221-I225 HydrophobicContact CD2-CD1 4.18Å; L221-I225 HydrophobicContact CG-CD1 4.12Å; L221-I225 WeakPolarHBondContact O-CB 3.19Å; L221-I225 WeakPolarHBondContact O-CG1 3.26Å; L221-I225 PolarHBondContact O-N 2.78Å |
| 222 | S | 85.2 | Confident | 83.4 | Confident | 51 Ų | 51 | 103.2 Ų | 103.2 | 36% | 0.357 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.3 | -44.5 | 175.4 | -62.4 | 0 | 0 | 0 | 0 | 111.1 | N218 V224 I225 D226 | N218-S222 WeakPolarHBondContact O-CB 3.36Å; N218-S222 PolarHBondContact O-N 2.77Å; N218-S222 PolarHBondContact O-OG 3.05Å; S222-V224 VanDerWaalsContact C-N 3.34Å; S222-V224 PolarHBondContact O-N 3.49Å; S222-I225 PolarHBondContact O-N 2.83Å; S222-D226 WeakPolarHBondContact O-CB 3.48Å; S222-D226 PolarHBondContact O-N 3.29Å |
| 223 | R | 82.7 | Confident | 82.3 | Confident | 168 Ų | 168 | 107.4 Ų | 107.4 | 63% | 0.634 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.8 | -35.5 | 175.4 | -81.6 | -169.3 | -106.1 | 170.4 | -11.7 | 113.8 | I219 R220 L221 S227 | I219-R223 VanDerWaalsContact CG2-NH2 3.27Å; I219-R223 PolarHBondContact O-N 3.1Å; I219-R223 VanDerWaalsContact O-N 3.09Å; R220-R223 PolarHBondContact O-N 3.07Å; L221-R223 VanDerWaalsContact C-N 3.33Å; L221-R223 PolarHBondContact O-N 3.17Å; R223-S227 WeakPolarHBondContact O-CB 3.5Å; R223-S227 PolarHBondContact O-N 3.38Å; R223-S227 PolarHBondContact O-OG 3.35Å |
| 224 | V | 87.6 | Confident | 80.4 | Confident | 78 Ų | 78 | 114.1 Ų | 114.1 | 47% | 0.473 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -69.5 | -41.6 | 176.5 | 168.7 | 0 | 0 | 0 | 0 | 110.4 | R220 L221 S222 S227 L228 | R220-V224 VanDerWaalsContact O-CG2 3.3Å; R220-V224 WeakPolarHBondContact O-CG2 3.08Å; R220-V224 PolarHBondContact O-N 2.91Å; L221-V224 PolarHBondContact O-N 3.44Å; L221-V224 VanDerWaalsContact O-N 3.15Å; S222-V224 VanDerWaalsContact C-N 3.34Å; S222-V224 PolarHBondContact O-N 3.49Å; V224-S227 WeakPolarHBondContact CA-OG 3.39Å; V224-S227 PolarHBondContact O-N 3.34Å; V224-S227 PolarHBondContact O-OG 2.89Å; V224-L228 HydrophobicContact CG1-CD1 3.95Å; V224-L228 PolarHBondContact O-N 3.19Å |
| 225 | I | 86.5 | Confident | 80.3 | Confident | 89 Ų | 89 | 114.4 Ų | 114.4 | 46% | 0.456 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -60 | -50.3 | 173.4 | -75 | 163.1 | 0 | 0 | 0 | 110.5 | L221 S222 S227 L228 E229 | L221-I225 HydrophobicContact CD2-CD1 4.18Å; L221-I225 HydrophobicContact CG-CD1 4.12Å; L221-I225 WeakPolarHBondContact O-CB 3.19Å; L221-I225 WeakPolarHBondContact O-CG1 3.26Å; L221-I225 PolarHBondContact O-N 2.78Å; S222-I225 PolarHBondContact O-N 2.83Å; I225-S227 PolarHBondContact O-N 3.44Å; I225-S227 VanDerWaalsContact O-N 3.16Å; I225-L228 PolarHBondContact O-N 3.19Å; I225-E229 WeakPolarHBondContact O-CB 3.45Å; I225-E229 PolarHBondContact O-N 3.07Å |
| 226 | D | 83.3 | Confident | 79.9 | Confident | 69 Ų | 69 | 110.8 Ų | 110.8 | 37% | 0.369 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.6 | -27.2 | 177 | -71.1 | -8.8 | 0 | 0 | 0 | 113 | S222 R230 | S222-D226 WeakPolarHBondContact O-CB 3.48Å; S222-D226 PolarHBondContact O-N 3.29Å; D226-R230 VanDerWaalsContact O-CG 3.31Å; D226-R230 WeakPolarHBondContact O-CG 3.26Å; D226-R230 PolarHBondContact O-N 3.05Å; D226-R230 PolarHBondContact O-NH1 3.17Å |
| 227 | S | 81.1 | Confident | 79.5 | Confident | 63 Ų | 63 | 112.1 Ų | 112.1 | 44% | 0.441 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -81.4 | -34.5 | 176.2 | 73.9 | 0 | 0 | 0 | 0 | 112.6 | R223 V224 I225 A231 | R223-S227 WeakPolarHBondContact O-CB 3.5Å; R223-S227 PolarHBondContact O-N 3.38Å; R223-S227 PolarHBondContact O-OG 3.35Å; V224-S227 WeakPolarHBondContact CA-OG 3.39Å; V224-S227 PolarHBondContact O-N 3.34Å; V224-S227 PolarHBondContact O-OG 2.89Å; I225-S227 PolarHBondContact O-N 3.44Å; I225-S227 VanDerWaalsContact O-N 3.16Å; S227-A231 WeakPolarHBondContact O-CB 3.37Å; S227-A231 PolarHBondContact O-N 2.89Å; S227-A231 VanDerWaalsContact O-N 3.13Å |
| 228 | L | 82.3 | Confident | 79.1 | Confident | 115 Ų | 115 | 111.8 Ų | 111.8 | 60% | 0.602 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -71.4 | -40.8 | 174.5 | -88.9 | 157.8 | 0 | 0 | 0 | 111.3 | V224 I225 A231 G232 | V224-L228 HydrophobicContact CG1-CD1 3.95Å; V224-L228 PolarHBondContact O-N 3.19Å; I225-L228 PolarHBondContact O-N 3.19Å; L228-A231 PolarHBondContact O-N 3.43Å; L228-A231 VanDerWaalsContact O-N 3.14Å; L228-G232 PolarHBondContact O-N 3.36Å |
| 229 | E | 80.1 | Confident | 78.6 | Confident | 123 Ų | 123 | 112.6 Ų | 112.6 | 58% | 0.575 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -61.7 | -46.9 | 176.3 | -169.8 | 170.5 | -164 | 0 | 0 | 110.9 | I225 A231 G232 E233 | I225-E229 WeakPolarHBondContact O-CB 3.45Å; I225-E229 PolarHBondContact O-N 3.07Å; E229-A231 PolarHBondContact O-N 3.38Å; E229-G232 PolarHBondContact O-N 3.37Å; E229-G232 VanDerWaalsContact O-N 3.14Å; E229-E233 PolarHBondContact O-N 3.14Å |
| 230 | R | 74.6 | Confident | 77.9 | Confident | 168 Ų | 168 | 115.5 Ų | 115.5 | 63% | 0.634 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65 | -24.3 | 173.6 | -73.1 | -175.5 | -172.1 | 97 | -0.5 | 114.4 | D226 | D226-R230 VanDerWaalsContact O-CG 3.31Å; D226-R230 WeakPolarHBondContact O-CG 3.26Å; D226-R230 PolarHBondContact O-N 3.05Å; D226-R230 PolarHBondContact O-NH1 3.17Å |
| 231 | A | 73.2 | Confident | 77.3 | Confident | 64 Ų | 64 | 111.3 Ų | 111.3 | 53% | 0.529 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -82.3 | -25.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | S227 L228 E229 | S227-A231 WeakPolarHBondContact O-CB 3.37Å; S227-A231 PolarHBondContact O-N 2.89Å; S227-A231 VanDerWaalsContact O-N 3.13Å; L228-A231 PolarHBondContact O-N 3.43Å; L228-A231 VanDerWaalsContact O-N 3.14Å; E229-A231 PolarHBondContact O-N 3.38Å |
| 232 | G | 67.2 | Low | 76.8 | Confident | 64 Ų | 64 | 112.2 Ų | 112.2 | 66% | 0.66 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -82.4 | -16.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | L228 E229 K234 | L228-G232 PolarHBondContact O-N 3.36Å; E229-G232 PolarHBondContact O-N 3.37Å; E229-G232 VanDerWaalsContact O-N 3.14Å; G232-K234 VanDerWaalsContact C-N 3.34Å |
| 233 | E | 65 | Low | 76.1 | Confident | 164 Ų | 164 | 117.3 Ų | 117.3 | 77% | 0.766 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | 5.2 | 175.6 | -71.2 | -169.3 | 143.8 | 0 | 0 | 114.4 | E229 | E229-E233 PolarHBondContact O-N 3.14Š|
| 234 | K | 50.2 | Low | 75.5 | Confident | 242 Ų | 242 | 112.6 Ų | 112.6 | 100% | 1.052 | 60% | 0.596 | S | S | * | * | trans | -110.5 | 0 | 172.2 | -80.5 | -175.2 | 176 | -178.6 | 0 | 111.1 | G232 | G232-K234 VanDerWaalsContact C-N 3.34Š|
Retrieved 234 of 234 residues in 58.8 ms
(Link to these results)