| 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 | 52.2 | Low | 60.8 | Low | 236 Ų | 236 | 185.9 Ų | 185.9 | 100% | 1.163 | 88% | 0.878 | S | S | * | * | 0 | 105.1 | 0 | -85.6 | 168.5 | 153.6 | 0 | 0 | 108.3 | |||||
| 2 | M | 54.1 | Low | 60.9 | Low | 199 Ų | 199 | 183.4 Ų | 183.4 | 98% | 0.98 | 87% | 0.873 | S | S | * | * | trans | -87.7 | 112.3 | 174.3 | -77.2 | 172.8 | 165.8 | 0 | 0 | 108.5 | ||||
| 3 | M | 61.3 | Low | 61.2 | Low | 175 Ų | 175 | 174.9 Ų | 174.9 | 86% | 0.862 | 84% | 0.842 | S | S | * | * | trans | -99.5 | 109.4 | 169.4 | -74.5 | -174.2 | 172.2 | 0 | 0 | 108.7 | M5 | M3-M5 PolarHBondContact O-N 2.82Š| ||
| 4 | M | 67.8 | Low | 61.7 | Low | 189 Ų | 189 | 175 Ų | 175 | 93% | 0.931 | 84% | 0.841 | S | S | * | * | trans | -73.8 | 114.7 | 170.6 | -71.6 | -179.3 | 166.7 | 0 | 0 | 109.1 | ||||
| 5 | M | 64.8 | Low | 62.3 | Low | 179 Ų | 179 | 174.5 Ų | 174.5 | 88% | 0.882 | 84% | 0.837 | S | S | * | * | trans | -80.5 | 142.1 | 171.3 | -82.3 | -178.3 | 159.3 | 0 | 0 | 110.8 | M3 | M3-M5 PolarHBondContact O-N 2.82Š| ||
| 6 | P | 65 | Low | 62.8 | Low | 113 Ų | 113 | 168.5 Ų | 168.5 | 73% | 0.734 | 82% | 0.818 | S | S | * | * | trans | -75.1 | 137.4 | -170.2 | 30.3 | -33.9 | 0 | 0 | 0 | 112.1 | R8 | P6-R8 PolarHBondContact O-N 3.05Š| ||
| 7 | L | 61.6 | Low | 63.8 | Low | 172 Ų | 172 | 165.4 Ų | 165.4 | 90% | 0.901 | 81% | 0.805 | S | S | * | * | trans | -56.9 | 104.4 | 176.7 | -72.1 | 152.5 | 0 | 0 | 0 | 110.7 | L9 | L7-L9 PolarHBondContact O-N 3.41Å; L7-L9 VanDerWaalsContact O-N 3.12Å | ||
| 8 | R | 57.9 | Low | 64.9 | Low | 186 Ų | 186 | 162.8 Ų | 162.8 | 70% | 0.702 | 80% | 0.795 | S | S | * | * | trans | -74.5 | 98.3 | 171.3 | -69.3 | -162.6 | 175.9 | -171.4 | 1 | 109.7 | P6 R10 | P6-R8 PolarHBondContact O-N 3.05Å; R8-R10 HydrophobicContact CB-CB 4.47Å; R8-R10 HydrophobicContact CB-CG 4.38Å; R8-R10 PolarHBondContact O-N 3.28Å | ||
| 9 | L | 60.4 | Low | 66 | Low | 171 Ų | 171 | 158.2 Ų | 158.2 | 90% | 0.895 | 78% | 0.779 | S | S | * | * | trans | -67.1 | 57.4 | 161.9 | -76.8 | 158.7 | 0 | 0 | 0 | 111 | L7 | L7-L9 PolarHBondContact O-N 3.41Å; L7-L9 VanDerWaalsContact O-N 3.12Å | ||
| 10 | R | 63.9 | Low | 67 | Low | 191 Ų | 191 | 156.3 Ų | 156.3 | 72% | 0.721 | 77% | 0.771 | S | S | * | * | trans | -108.9 | 5.3 | 180 | -75.6 | -167.1 | 178.7 | -160.4 | -1.4 | 113.9 | R8 | R8-R10 HydrophobicContact CB-CB 4.47Å; R8-R10 HydrophobicContact CB-CG 4.38Å; R8-R10 PolarHBondContact O-N 3.28Å | ||
| 11 | W | 59.7 | Low | 68.1 | Low | 234 Ų | 234 | 153.5 Ų | 153.5 | 89% | 0.886 | 76% | 0.759 | S | S | * | * | trans | -121.1 | 45.3 | -172.3 | -69.1 | 101.7 | 0 | 0 | 0 | 112.8 | P13 | W11-P13 WeakPolarHBondContact O-CD 3.21Š| ||
| 12 | L | 62.3 | Low | 70 | Confident | 156 Ų | 156 | 145.8 Ų | 145.8 | 82% | 0.817 | 73% | 0.725 | S | S | * | * | trans | -79.1 | 110.5 | 159.8 | -98.8 | 149.7 | 0 | 0 | 0 | 107.1 | Q14 | L12-Q14 PolarHBondContact O-N 3.36Å; L12-Q14 VanDerWaalsContact O-N 3.14Å | ||
| 13 | P | 64.8 | Low | 71.8 | Confident | 73 Ų | 73 | 142.4 Ų | 142.4 | 47% | 0.474 | 71% | 0.71 | S | S | . | * | trans | -61.4 | 120.7 | 178.7 | 24.9 | -32.6 | 0 | 0 | 0 | 108.7 | W11 Q15 C16 | W11-P13 WeakPolarHBondContact O-CD 3.21Å; P13-Q15 PolarHBondContact O-N 2.93Å; P13-C16 HydrophobicContact CG-CB 4.48Å; P13-C16 PolarHBondContact O-N 2.97Å | ||
| 14 | Q | 67.4 | Low | 73.3 | Confident | 176 Ų | 176 | 140.2 Ų | 140.2 | 82% | 0.822 | 70% | 0.701 | S | S | * | * | G | 310 helix | trans | -54.8 | -23.4 | -178.9 | -165.8 | 174.3 | -14.8 | 0 | 0 | 112.6 | L12 C16 L17 | L12-Q14 PolarHBondContact O-N 3.36Å; L12-Q14 VanDerWaalsContact O-N 3.14Å; Q14-C16 VanDerWaalsContact C-N 3.28Å; Q14-C16 PolarHBondContact O-N 3.14Å; Q14-L17 PolarHBondContact O-N 3.12Å |
| 15 | Q | 71 | Confident | 74.6 | Confident | 168 Ų | 168 | 136 Ų | 136 | 79% | 0.785 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -64.4 | -24.2 | 175.6 | -63.8 | 175.8 | -9.3 | 0 | 0 | 113.9 | P13 P19 | P13-Q15 PolarHBondContact O-N 2.93Å; Q15-P19 WeakPolarHBondContact O-CD 3.44Å |
| 16 | C | 71.4 | Confident | 76 | Confident | 78 Ų | 78 | 132.9 Ų | 132.9 | 53% | 0.527 | 67% | 0.668 | S | S | . | * | G | 310 helix | trans | -79.9 | -23.6 | 177 | -71.2 | 0 | 0 | 0 | 0 | 113 | P13 Q14 P19 | P13-C16 HydrophobicContact CG-CB 4.48Å; P13-C16 PolarHBondContact O-N 2.97Å; Q14-C16 VanDerWaalsContact C-N 3.28Å; Q14-C16 PolarHBondContact O-N 3.14Å; C16-P19 WeakPolarHBondContact O-CD 3.39Å; C16-P19 WeakPolarHBondContact O-CG 2.93Å |
| 17 | L | 79.1 | Confident | 77.4 | Confident | 115 Ų | 115 | 130.9 Ų | 130.9 | 60% | 0.602 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -78.7 | -32.9 | -177.1 | -165.7 | 138.4 | 0 | 0 | 0 | 112 | Q14 L20 L21 | Q14-L17 PolarHBondContact O-N 3.12Å; L17-L20 PolarHBondContact O-N 2.96Å; L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 PolarHBondContact O-N 3.47Å |
| 18 | L | 84 | Confident | 79 | Confident | 120 Ų | 120 | 128.2 Ų | 128.2 | 63% | 0.628 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -61.9 | -51.9 | 179.2 | -161.8 | 151.9 | 0 | 0 | 0 | 113.5 | L20 L21 V22 | L18-L20 VanDerWaalsContact C-N 3.3Å; L18-L20 PolarHBondContact O-N 3.43Å; L18-L21 PolarHBondContact O-N 2.96Å; L18-V22 HydrophobicContact CD2-CG2 3.98Å; L18-V22 WeakPolarHBondContact O-CG2 3.27Å; L18-V22 PolarHBondContact O-N 3.43Å |
| 19 | P | 85.2 | Confident | 80.8 | Confident | 75 Ų | 75 | 124.4 Ų | 124.4 | 49% | 0.487 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -64.9 | -34.8 | 178.9 | 25.8 | -34.4 | 0 | 0 | 0 | 112.1 | Q15 C16 V22 L23 | Q15-P19 WeakPolarHBondContact O-CD 3.44Å; C16-P19 WeakPolarHBondContact O-CD 3.39Å; C16-P19 WeakPolarHBondContact O-CG 2.93Å; P19-V22 PolarHBondContact O-N 2.95Å; P19-L23 VanDerWaalsContact O-CB 3.27Å; P19-L23 WeakPolarHBondContact O-CB 3.44Å; P19-L23 PolarHBondContact O-N 3.08Å |
| 20 | L | 87.2 | Confident | 82.5 | Confident | 120 Ų | 120 | 122 Ų | 122 | 63% | 0.628 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -62.7 | -44.2 | 174.8 | -169.5 | 83.1 | 0 | 0 | 0 | 111.2 | L17 L18 L23 L24 | L17-L20 PolarHBondContact O-N 2.96Å; L18-L20 VanDerWaalsContact C-N 3.3Å; L18-L20 PolarHBondContact O-N 3.43Å; L20-L23 PolarHBondContact O-N 3.39Å; L20-L24 PolarHBondContact O-N 2.9Å; L20-L24 VanDerWaalsContact O-N 3.08Å |
| 21 | L | 89.7 | Confident | 84 | Confident | 97 Ų | 97 | 117.7 Ų | 117.7 | 51% | 0.508 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -65.9 | -42.1 | 178 | -171.9 | 145.2 | 0 | 0 | 0 | 111.6 | L17 L18 L24 L25 | L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 PolarHBondContact O-N 3.47Å; L18-L21 PolarHBondContact O-N 2.96Å; L21-L24 PolarHBondContact O-N 3.27Å; L21-L25 VanDerWaalsContact O-CB 3.26Å; L21-L25 WeakPolarHBondContact O-CB 3.35Å; L21-L25 PolarHBondContact O-N 3.33Å |
| 22 | V | 92.3 | Very high | 85.8 | Confident | 75 Ų | 75 | 112 Ų | 112 | 46% | 0.455 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -63.6 | -43.6 | 176.2 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | L18 P19 L24 L25 L26 | L18-V22 HydrophobicContact CD2-CG2 3.98Å; L18-V22 WeakPolarHBondContact O-CG2 3.27Å; L18-V22 PolarHBondContact O-N 3.43Å; P19-V22 PolarHBondContact O-N 2.95Å; V22-L24 PolarHBondContact O-N 2.84Å; V22-L25 PolarHBondContact O-N 3.28Å; V22-L26 WeakPolarHBondContact O-CB 3.26Å; V22-L26 PolarHBondContact O-N 3.22Å |
| 23 | L | 91.6 | Very high | 87.4 | Confident | 127 Ų | 127 | 108.8 Ų | 108.8 | 67% | 0.665 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -61.2 | -33.3 | 177.3 | -175.8 | 66.8 | 0 | 0 | 0 | 112.2 | P19 L20 P27 | P19-L23 VanDerWaalsContact O-CB 3.27Å; P19-L23 WeakPolarHBondContact O-CB 3.44Å; P19-L23 PolarHBondContact O-N 3.08Å; L20-L23 PolarHBondContact O-N 3.39Å; L23-P27 WeakPolarHBondContact O-CD 2.94Å; L23-P27 WeakPolarHBondContact O-CG 3.33Å |
| 24 | L | 92.5 | Very high | 88.8 | Confident | 130 Ų | 130 | 110.1 Ų | 110.1 | 68% | 0.681 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -79.5 | -39.5 | 175.4 | -176.2 | 67.2 | 0 | 0 | 0 | 112.7 | L20 L21 V22 P27 | L20-L24 PolarHBondContact O-N 2.9Å; L20-L24 VanDerWaalsContact O-N 3.08Å; L21-L24 PolarHBondContact O-N 3.27Å; V22-L24 PolarHBondContact O-N 2.84Å; L24-P27 WeakPolarHBondContact O-CD 3.49Å; L24-P27 WeakPolarHBondContact O-CG 3.48Å |
| 25 | L | 94.9 | Very high | 90.1 | Very high | 100 Ų | 100 | 106.2 Ų | 106.2 | 52% | 0.524 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -72.2 | -36.8 | -176 | -167.7 | 107.7 | 0 | 0 | 0 | 112.2 | L21 V22 L28 L29 | L21-L25 VanDerWaalsContact O-CB 3.26Å; L21-L25 WeakPolarHBondContact O-CB 3.35Å; L21-L25 PolarHBondContact O-N 3.33Å; V22-L25 PolarHBondContact O-N 3.28Å; L25-L28 WeakPolarHBondContact O-CB 3.32Å; L25-L28 PolarHBondContact O-N 2.97Å; L25-L29 WeakPolarHBondContact O-CB 3.39Å; L25-L29 PolarHBondContact O-N 3.4Å |
| 26 | L | 94.2 | Very high | 91.2 | Very high | 114 Ų | 114 | 102.7 Ų | 102.7 | 60% | 0.597 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -57.6 | -52.6 | -179 | -170.5 | 76.3 | 0 | 0 | 0 | 113.7 | V22 L28 L29 L30 | V22-L26 WeakPolarHBondContact O-CB 3.26Å; V22-L26 PolarHBondContact O-N 3.22Å; L26-L28 VanDerWaalsContact C-N 3.3Å; L26-L28 PolarHBondContact O-N 3.31Å; L26-L29 PolarHBondContact O-N 3.34Å; L26-L30 PolarHBondContact O-N 3.29Å |
| 27 | P | 94.9 | Very high | 92.3 | Very high | 71 Ų | 71 | 104 Ų | 104 | 46% | 0.461 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -67.2 | -31.5 | 177.9 | 26.9 | -35.3 | 0 | 0 | 0 | 112.2 | L23 L24 L30 L31 | L23-P27 WeakPolarHBondContact O-CD 2.94Å; L23-P27 WeakPolarHBondContact O-CG 3.33Å; L24-P27 WeakPolarHBondContact O-CD 3.49Å; L24-P27 WeakPolarHBondContact O-CG 3.48Å; P27-L30 PolarHBondContact O-N 3.42Å; P27-L31 WeakPolarHBondContact O-CB 3.47Å; P27-L31 PolarHBondContact O-N 2.96Å |
| 28 | L | 95.3 | Very high | 92.9 | Very high | 115 Ų | 115 | 103 Ų | 103 | 60% | 0.602 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64.5 | -43.8 | 175.5 | -171.9 | 72.1 | 0 | 0 | 0 | 111.3 | L25 L26 L31 L32 | L25-L28 WeakPolarHBondContact O-CB 3.32Å; L25-L28 PolarHBondContact O-N 2.97Å; L26-L28 VanDerWaalsContact C-N 3.3Å; L26-L28 PolarHBondContact O-N 3.31Å; L28-L31 PolarHBondContact O-N 3.03Å; L28-L32 PolarHBondContact O-N 3.5Å |
| 29 | L | 95.5 | Very high | 93.3 | Very high | 107 Ų | 107 | 102.7 Ų | 102.7 | 56% | 0.56 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.2 | -42.2 | 175.8 | -176 | 67.5 | 0 | 0 | 0 | 111.6 | L25 L26 L32 L33 | L25-L29 WeakPolarHBondContact O-CB 3.39Å; L25-L29 PolarHBondContact O-N 3.4Å; L26-L29 PolarHBondContact O-N 3.34Å; L29-L32 PolarHBondContact O-N 2.92Å; L29-L33 PolarHBondContact O-N 3.43Å |
| 30 | L | 95.8 | Very high | 93.5 | Very high | 121 Ų | 121 | 103.3 Ų | 103.3 | 63% | 0.634 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61.8 | -44 | 176.8 | -173.1 | 71.1 | 0 | 0 | 0 | 111.6 | L26 P27 L32 L33 L34 | L26-L30 PolarHBondContact O-N 3.29Å; P27-L30 PolarHBondContact O-N 3.42Å; L30-L32 VanDerWaalsContact C-N 3.35Å; L30-L32 PolarHBondContact O-N 3.33Å; L30-L33 PolarHBondContact O-N 3.49Å; L30-L34 WeakPolarHBondContact O-CB 3.49Å; L30-L34 PolarHBondContact O-N 3.33Å |
| 31 | L | 95.8 | Very high | 93.6 | Very high | 99 Ų | 99 | 103 Ų | 103 | 52% | 0.518 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 176.1 | -177.4 | 68.6 | 0 | 0 | 0 | 111.3 | P27 L28 L33 L34 L35 | P27-L31 WeakPolarHBondContact O-CB 3.47Å; P27-L31 PolarHBondContact O-N 2.96Å; L28-L31 PolarHBondContact O-N 3.03Å; L31-L33 PolarHBondContact O-N 3.02Å; L31-L34 PolarHBondContact O-N 3.37Å; L31-L35 HydrophobicContact CG-CD1 4.36Å; L31-L35 WeakPolarHBondContact O-CG 3.36Å; L31-L35 PolarHBondContact O-N 3.3Å |
| 32 | L | 96.2 | Very high | 93.4 | Very high | 114 Ų | 114 | 103 Ų | 103 | 60% | 0.597 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62 | -43.1 | 177.6 | -176.9 | 64.6 | 0 | 0 | 0 | 112 | L28 L29 L30 L34 L35 L36 | L28-L32 PolarHBondContact O-N 3.5Å; L29-L32 PolarHBondContact O-N 2.92Å; L30-L32 VanDerWaalsContact C-N 3.35Å; L30-L32 PolarHBondContact O-N 3.33Å; L32-L34 VanDerWaalsContact C-N 3.35Å; L32-L34 PolarHBondContact O-N 3.38Å; L32-L35 PolarHBondContact O-N 3.5Å; L32-L36 PolarHBondContact O-N 2.99Å |
| 33 | L | 96.1 | Very high | 93.1 | Very high | 89 Ų | 89 | 104.5 Ų | 104.5 | 47% | 0.466 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.7 | -42.2 | 177.3 | -176.5 | 65.8 | 0 | 0 | 0 | 111.7 | L29 L30 L31 L36 Q37 | L29-L33 PolarHBondContact O-N 3.43Å; L30-L33 PolarHBondContact O-N 3.49Å; L31-L33 PolarHBondContact O-N 3.02Å; L33-L36 PolarHBondContact O-N 3.01Å; L33-Q37 WeakPolarHBondContact O-CG 3.37Å; L33-Q37 PolarHBondContact O-N 2.92Å |
| 34 | L | 95.6 | Very high | 92.7 | Very high | 102 Ų | 102 | 103.6 Ų | 103.6 | 53% | 0.534 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64 | -42.5 | 177.9 | -173.5 | 144 | 0 | 0 | 0 | 111.7 | L30 L31 L32 L36 Q37 L38 | L30-L34 WeakPolarHBondContact O-CB 3.49Å; L30-L34 PolarHBondContact O-N 3.33Å; L31-L34 PolarHBondContact O-N 3.37Å; L32-L34 VanDerWaalsContact C-N 3.35Å; L32-L34 PolarHBondContact O-N 3.38Å; L34-L36 VanDerWaalsContact C-N 3.35Å; L34-L36 PolarHBondContact O-N 3.01Å; L34-Q37 PolarHBondContact O-N 3.06Å; L34-L38 PolarHBondContact O-N 2.82Å |
| 35 | L | 94.5 | Very high | 92 | Very high | 93 Ų | 93 | 103.1 Ų | 103.1 | 49% | 0.487 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.5 | -41.4 | 174.6 | -72.1 | 170.8 | 0 | 0 | 0 | 112 | L31 L32 L38 L39 | L31-L35 HydrophobicContact CG-CD1 4.36Å; L31-L35 WeakPolarHBondContact O-CG 3.36Å; L31-L35 PolarHBondContact O-N 3.3Å; L32-L35 PolarHBondContact O-N 3.5Å; L35-L38 PolarHBondContact O-N 3.41Å; L35-L39 WeakPolarHBondContact O-CB 3.38Å; L35-L39 PolarHBondContact O-N 3.41Å |
| 36 | L | 94.5 | Very high | 91 | Very high | 95 Ų | 95 | 101.2 Ų | 101.2 | 50% | 0.497 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.6 | -43.7 | 177 | -176.7 | 64.9 | 0 | 0 | 0 | 111.7 | L32 L33 L34 L39 L40 | L32-L36 PolarHBondContact O-N 2.99Å; L33-L36 PolarHBondContact O-N 3.01Å; L34-L36 VanDerWaalsContact C-N 3.35Å; L34-L36 PolarHBondContact O-N 3.01Å; L36-L39 PolarHBondContact O-N 3.38Å; L36-L40 HydrophobicContact CD1-CD1 4.48Å; L36-L40 HydrophobicContact CG-CD1 4.02Å; L36-L40 WeakPolarHBondContact O-CB 3.27Å; L36-L40 WeakPolarHBondContact O-CD1 3.44Å; L36-L40 WeakPolarHBondContact O-CG 3.37Å; L36-L40 PolarHBondContact O-N 2.84Å |
| 37 | Q | 93.1 | Very high | 90 | Very high | 106 Ų | 106 | 101 Ų | 101 | 50% | 0.495 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.6 | -44.3 | 175.3 | -73.3 | 174.1 | -0.2 | 0 | 0 | 111.6 | L33 L34 L40 L41 | L33-Q37 WeakPolarHBondContact O-CG 3.37Å; L33-Q37 PolarHBondContact O-N 2.92Å; L34-Q37 PolarHBondContact O-N 3.06Å; Q37-L40 PolarHBondContact O-N 3.34Å; Q37-L41 VanDerWaalsContact O-CG 3.32Å; Q37-L41 WeakPolarHBondContact O-CG 3.47Å; Q37-L41 PolarHBondContact O-N 3.33Å |
| 38 | L | 92.9 | Very high | 88.4 | Confident | 94 Ų | 94 | 100.3 Ų | 100.3 | 49% | 0.492 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 176.5 | -176.6 | 67.4 | 0 | 0 | 0 | 111.6 | L34 L35 L41 L42 | L34-L38 PolarHBondContact O-N 2.82Å; L35-L38 PolarHBondContact O-N 3.41Å; L38-L41 PolarHBondContact O-N 2.94Å; L38-L42 HydrophobicContact CG-CD1 4.36Å; L38-L42 WeakPolarHBondContact O-CG 3.22Å; L38-L42 PolarHBondContact O-N 3.5Å |
| 39 | L | 91.7 | Very high | 86.7 | Confident | 112 Ų | 112 | 97.4 Ų | 97.4 | 59% | 0.586 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.8 | -43 | 177.6 | -173.7 | 71.5 | 0 | 0 | 0 | 111.7 | L35 L36 L42 L43 | L35-L39 WeakPolarHBondContact O-CB 3.38Å; L35-L39 PolarHBondContact O-N 3.41Å; L36-L39 PolarHBondContact O-N 3.38Å; L39-L42 PolarHBondContact O-N 2.93Å; L39-L43 WeakPolarHBondContact O-CB 3.43Å; L39-L43 PolarHBondContact O-N 2.93Å |
| 40 | L | 90.3 | Very high | 84.8 | Confident | 88 Ų | 88 | 102.9 Ų | 102.9 | 46% | 0.461 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.6 | -43.5 | 175.1 | -79.4 | 159.5 | 0 | 0 | 0 | 111.6 | L36 Q37 L43 L44 | L36-L40 HydrophobicContact CD1-CD1 4.48Å; L36-L40 HydrophobicContact CG-CD1 4.02Å; L36-L40 WeakPolarHBondContact O-CB 3.27Å; L36-L40 WeakPolarHBondContact O-CD1 3.44Å; L36-L40 WeakPolarHBondContact O-CG 3.37Å; L36-L40 PolarHBondContact O-N 2.84Å; Q37-L40 PolarHBondContact O-N 3.34Å; L40-L43 PolarHBondContact O-N 3.35Å; L40-L44 WeakPolarHBondContact O-CB 3.36Å; L40-L44 VanDerWaalsContact O-CG 3.27Å; L40-L44 WeakPolarHBondContact O-CG 3.37Å; L40-L44 PolarHBondContact O-N 2.91Å |
| 41 | L | 87.7 | Confident | 82.8 | Confident | 114 Ų | 114 | 104 Ų | 104 | 60% | 0.597 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -61.7 | -43.8 | 175.5 | -73.8 | 169.5 | 0 | 0 | 0 | 111.8 | Q37 L38 L44 L45 | Q37-L41 VanDerWaalsContact O-CG 3.32Å; Q37-L41 WeakPolarHBondContact O-CG 3.47Å; Q37-L41 PolarHBondContact O-N 3.33Å; L38-L41 PolarHBondContact O-N 2.94Å; L41-L44 PolarHBondContact O-N 2.99Å; L41-L45 WeakPolarHBondContact O-CB 3.43Å; L41-L45 PolarHBondContact O-N 2.95Å |
| 42 | L | 85.6 | Confident | 80.4 | Confident | 97 Ų | 97 | 100.3 Ų | 100.3 | 51% | 0.508 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.1 | -40.5 | 176.3 | -72.2 | 171.7 | 0 | 0 | 0 | 112.1 | L38 L39 L45 A46 | L38-L42 HydrophobicContact CG-CD1 4.36Å; L38-L42 WeakPolarHBondContact O-CG 3.22Å; L38-L42 PolarHBondContact O-N 3.5Å; L39-L42 PolarHBondContact O-N 2.93Å; L42-L45 PolarHBondContact O-N 3.35Å; L42-A46 WeakPolarHBondContact O-CB 3.32Å; L42-A46 PolarHBondContact O-N 3.38Å |
| 43 | L | 86.1 | Confident | 77.9 | Confident | 107 Ų | 107 | 98.8 Ų | 98.8 | 56% | 0.56 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.3 | -44.2 | 176.2 | -175.6 | 68.3 | 0 | 0 | 0 | 111.1 | L39 L40 L45 A46 M47 | L39-L43 WeakPolarHBondContact O-CB 3.43Å; L39-L43 PolarHBondContact O-N 2.93Å; L40-L43 PolarHBondContact O-N 3.35Å; L43-L45 VanDerWaalsContact C-N 3.3Å; L43-L45 PolarHBondContact O-N 3.29Å; L43-A46 PolarHBondContact O-N 2.93Å; L43-M47 WeakPolarHBondContact O-CB 3.31Å; L43-M47 WeakPolarHBondContact O-CG 3.29Å; L43-M47 PolarHBondContact O-N 3.05Å |
| 44 | L | 83 | Confident | 75.7 | Confident | 108 Ų | 108 | 105.8 Ų | 105.8 | 57% | 0.565 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -59.5 | -43.1 | 173.8 | -76.7 | 167 | 0 | 0 | 0 | 110.9 | L40 L41 M47 T48 | L40-L44 WeakPolarHBondContact O-CB 3.36Å; L40-L44 VanDerWaalsContact O-CG 3.27Å; L40-L44 WeakPolarHBondContact O-CG 3.37Å; L40-L44 PolarHBondContact O-N 2.91Å; L41-L44 PolarHBondContact O-N 2.99Å; L44-M47 PolarHBondContact O-N 2.81Å; L44-T48 WeakPolarHBondContact O-CB 3.41Å; L44-T48 VanDerWaalsContact O-CG2 3.29Å; L44-T48 WeakPolarHBondContact O-CG2 3.35Å; L44-T48 PolarHBondContact O-N 3.32Å; L44-T48 PolarHBondContact O-OG1 2.88Å |
| 45 | L | 78.1 | Confident | 73.3 | Confident | 119 Ų | 119 | 106.1 Ų | 106.1 | 62% | 0.623 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64 | -39 | 176.2 | -172.6 | 64.6 | 0 | 0 | 0 | 112.2 | L41 L42 L43 T48 G49 | L41-L45 WeakPolarHBondContact O-CB 3.43Å; L41-L45 PolarHBondContact O-N 2.95Å; L42-L45 PolarHBondContact O-N 3.35Å; L43-L45 VanDerWaalsContact C-N 3.3Å; L43-L45 PolarHBondContact O-N 3.29Å; L45-T48 VanDerWaalsContact CA-OG1 3.31Å; L45-T48 WeakPolarHBondContact CA-OG1 3.39Å; L45-T48 PolarHBondContact O-OG1 3.23Å; L45-T48 VanDerWaalsContact O-OG1 3.1Å; L45-G49 PolarHBondContact O-N 2.85Å |
| 46 | A | 74.2 | Confident | 70.8 | Confident | 61 Ų | 61 | 106.9 Ų | 106.9 | 50% | 0.504 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.8 | -39.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L42 L43 G49 R50 | L42-A46 WeakPolarHBondContact O-CB 3.32Å; L42-A46 PolarHBondContact O-N 3.38Å; L43-A46 PolarHBondContact O-N 2.93Å; A46-G49 PolarHBondContact O-N 2.94Å; A46-R50 WeakPolarHBondContact O-CB 3.49Å; A46-R50 PolarHBondContact O-N 3.42Å |
| 47 | M | 72.4 | Confident | 68.3 | Low | 110 Ų | 110 | 107.7 Ų | 107.7 | 54% | 0.542 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -71 | -39.6 | 177.4 | -68.5 | -67.8 | -75.8 | 0 | 0 | 111.9 | L43 L44 R50 N51 | L43-M47 WeakPolarHBondContact O-CB 3.31Å; L43-M47 WeakPolarHBondContact O-CG 3.29Å; L43-M47 PolarHBondContact O-N 3.05Å; L44-M47 PolarHBondContact O-N 2.81Å; M47-R50 PolarHBondContact O-N 3.44Å; M47-N51 PolarHBondContact O-N 3.04Å |
| 48 | T | 63.1 | Low | 65.7 | Low | 55 Ų | 55 | 106.2 Ų | 106.2 | 34% | 0.337 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -72.2 | -32.1 | 174.2 | 55.3 | 0 | 0 | 0 | 0 | 111.7 | L44 L45 G52 L55 | L44-T48 WeakPolarHBondContact O-CB 3.41Å; L44-T48 VanDerWaalsContact O-CG2 3.29Å; L44-T48 WeakPolarHBondContact O-CG2 3.35Å; L44-T48 PolarHBondContact O-N 3.32Å; L44-T48 PolarHBondContact O-OG1 2.88Å; L45-T48 VanDerWaalsContact CA-OG1 3.31Å; L45-T48 WeakPolarHBondContact CA-OG1 3.39Å; L45-T48 PolarHBondContact O-OG1 3.23Å; L45-T48 VanDerWaalsContact O-OG1 3.1Å; T48-G52 CarbonylContact O-C 3.31Å; T48-G52 VanDerWaalsContact O-C 3.31Å; T48-G52 WeakPolarHBondContact O-CA 3.5Å; T48-G52 PolarHBondContact O-N 3.46Å; T48-L55 HydrophobicContact CG2-CD1 4.12Å |
| 49 | G | 58.2 | Low | 63.2 | Low | 55 Ų | 55 | 107.4 Ų | 107.4 | 57% | 0.567 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -67.2 | -36.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L45 A46 | L45-G49 PolarHBondContact O-N 2.85Å; A46-G49 PolarHBondContact O-N 2.94Å |
| 50 | R | 55.1 | Low | 60.8 | Low | 222 Ų | 222 | 108 Ų | 108 | 84% | 0.838 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -81.2 | -26.9 | -179.9 | -161.3 | 170.8 | 175.5 | 170.1 | -1.8 | 113.8 | A46 M47 | A46-R50 WeakPolarHBondContact O-CB 3.49Å; A46-R50 PolarHBondContact O-N 3.42Å; M47-R50 PolarHBondContact O-N 3.44Å |
| 51 | N | 55 | Low | 58.4 | Low | 144 Ų | 144 | 110.7 Ų | 110.7 | 77% | 0.77 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -107.9 | 4.7 | 176.6 | -71.9 | -18 | 0 | 0 | 0 | 114.1 | M47 | M47-N51 PolarHBondContact O-N 3.04Å |
| 52 | G | 44.3 | Very low | 56 | Low | 21 Ų | 21 | 111.1 Ų | 111.1 | 22% | 0.216 | 64% | 0.641 | C | S | . | * | trans | -158.8 | 67.2 | -163.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | T48 R54 L55 | T48-G52 CarbonylContact O-C 3.31Å; T48-G52 VanDerWaalsContact O-C 3.31Å; T48-G52 WeakPolarHBondContact O-CA 3.5Å; T48-G52 PolarHBondContact O-N 3.46Å; G52-R54 PolarHBondContact O-N 3.32Å; G52-L55 PolarHBondContact O-N 2.84Å | ||
| 53 | G | 43.8 | Very low | 54 | Low | 83 Ų | 83 | 112.3 Ų | 112.3 | 86% | 0.856 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | 24.1 | 152.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 54 | R | 50.3 | Low | 51.6 | Low | 236 Ų | 236 | 118.6 Ų | 118.6 | 89% | 0.891 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128 | 9.3 | -179.4 | -72 | -175.9 | 76 | -171.1 | 6.1 | 113.7 | G52 | G52-R54 PolarHBondContact O-N 3.32Š|
| 55 | L | 46.6 | Very low | 49.5 | Very low | 109 Ų | 109 | 119 Ų | 119 | 57% | 0.571 | 68% | 0.682 | S | S | * | * | trans | -104.5 | 14.3 | 168.6 | -68.4 | 172.4 | 0 | 0 | 0 | 113 | T48 G52 S57 A58 | T48-L55 HydrophobicContact CG2-CD1 4.12Å; G52-L55 PolarHBondContact O-N 2.84Å; L55-S57 PolarHBondContact O-N 3.3Å; L55-S57 VanDerWaalsContact O-N 3.14Å; L55-A58 HydrophobicContact CD2-CB 4.35Å | ||
| 56 | S | 41.6 | Very low | 47.7 | Very low | 109 Ų | 109 | 121 Ų | 121 | 76% | 0.762 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | 115.3 | 159.7 | -171.1 | 0 | 0 | 0 | 0 | 107.3 | ||
| 57 | S | 40.9 | Very low | 46.1 | Very low | 112 Ų | 112 | 126.1 Ų | 126.1 | 78% | 0.783 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 89.6 | 14.8 | 176.7 | 79.4 | 0 | 0 | 0 | 0 | 120.5 | L55 V59 | L55-S57 PolarHBondContact O-N 3.3Å; L55-S57 VanDerWaalsContact O-N 3.14Å; S57-V59 PolarHBondContact O-N 3.1Å |
| 58 | A | 39.8 | Very low | 44.6 | Very low | 75 Ų | 75 | 126.5 Ų | 126.5 | 62% | 0.62 | 71% | 0.708 | S | S | * | * | trans | -80.9 | 66.7 | 164.2 | 0 | 0 | 0 | 0 | 0 | 111 | L55 V60 | L55-A58 HydrophobicContact CD2-CB 4.35Å; A58-V60 PolarHBondContact O-N 2.9Å | ||
| 59 | V | 40.8 | Very low | 43.8 | Very low | 119 Ų | 119 | 128.6 Ų | 128.6 | 72% | 0.721 | 73% | 0.731 | S | S | * | * | trans | -63.1 | 124.4 | 164.4 | 171.2 | 0 | 0 | 0 | 0 | 107.6 | S57 I61 | S57-V59 PolarHBondContact O-N 3.1Å; V59-I61 PolarHBondContact O-N 2.88Å | ||
| 60 | V | 39.4 | Very low | 43.2 | Very low | 125 Ų | 125 | 130 Ų | 130 | 76% | 0.758 | 73% | 0.729 | S | S | * | * | trans | -57.6 | 97.1 | 175.2 | 178.1 | 0 | 0 | 0 | 0 | 109.5 | A58 V62 | A58-V60 PolarHBondContact O-N 2.9Å; V60-V62 HydrophobicContact CG1-CB 4.4Å; V60-V62 HydrophobicContact CG1-CG2 4.04Å | ||
| 61 | I | 40.3 | Very low | 42.8 | Very low | 143 Ų | 143 | 121.6 Ų | 121.6 | 73% | 0.733 | 70% | 0.7 | S | S | * | * | trans | -100.9 | 84.3 | 163.9 | -57.3 | 173.6 | 0 | 0 | 0 | 106.5 | V59 | V59-I61 PolarHBondContact O-N 2.88Š| ||
| 62 | V | 37.8 | Very low | 42.4 | Very low | 123 Ų | 123 | 121.9 Ų | 121.9 | 75% | 0.745 | 71% | 0.708 | S | S | * | * | trans | -114.1 | 80.3 | 165.8 | -178.1 | 0 | 0 | 0 | 0 | 106.8 | V60 | V60-V62 HydrophobicContact CG1-CB 4.4Å; V60-V62 HydrophobicContact CG1-CG2 4.04Å | ||
| 63 | T | 43.3 | Very low | 42.6 | Very low | 123 Ų | 123 | 124.6 Ų | 124.6 | 76% | 0.755 | 73% | 0.728 | S | S | * | * | trans | -131.9 | 112.7 | 158.8 | 39.7 | 0 | 0 | 0 | 0 | 107.8 | S65 | T63-S65 PolarHBondContact O-N 2.95Š| ||
| 64 | R | 35.2 | Very low | 42.7 | Very low | 239 Ų | 239 | 123.6 Ų | 123.6 | 90% | 0.902 | 71% | 0.705 | S | S | * | * | trans | -52.2 | 129.5 | 170.4 | -64.6 | 173.1 | 174.5 | -176.8 | -3 | 108.2 | ||||
| 65 | S | 39.5 | Very low | 42.3 | Very low | 117 Ų | 117 | 118.5 Ų | 118.5 | 82% | 0.818 | 71% | 0.706 | S | S | * | * | S | Bend | trans | 149.5 | -19 | 135.2 | -59 | 0 | 0 | 0 | 0 | 114.7 | T63 | T63-S65 PolarHBondContact O-N 2.95Š|
| 66 | E | 40.5 | Very low | 42.2 | Very low | 160 Ų | 160 | 117.5 Ų | 117.5 | 75% | 0.748 | 70% | 0.704 | S | S | * | * | trans | -140.1 | 104.7 | -176.7 | -67.7 | -175.6 | 164.6 | 0 | 0 | 110.9 | I68 | E66-I68 VanDerWaalsContact C-N 3.26Å; E66-I68 HydrophobicContact CB-CD1 4.42Å; E66-I68 HydrophobicContact CB-CG1 4.07Å; E66-I68 PolarHBondContact O-N 3.14Å | ||
| 67 | L | 40 | Very low | 42.3 | Very low | 169 Ų | 169 | 113.9 Ų | 113.9 | 89% | 0.885 | 68% | 0.684 | S | S | * | * | trans | -69.5 | 85.6 | 169 | -113.6 | 95.7 | 0 | 0 | 0 | 108.2 | ||||
| 68 | I | 42.1 | Very low | 42.7 | Very low | 117 Ų | 117 | 117.5 Ų | 117.5 | 60% | 0.6 | 68% | 0.681 | S | S | * | * | trans | -94 | 104.3 | 170.1 | -46.9 | -178.2 | 0 | 0 | 0 | 107.2 | E66 V70 | E66-I68 VanDerWaalsContact C-N 3.26Å; E66-I68 HydrophobicContact CB-CD1 4.42Å; E66-I68 HydrophobicContact CB-CG1 4.07Å; E66-I68 PolarHBondContact O-N 3.14Å; I68-V70 HydrophobicContact CB-CG2 4.02Å; I68-V70 HydrophobicContact CG2-CG2 3.35Å; I68-V70 PolarHBondContact O-N 3.02Å | ||
| 69 | A | 45.9 | Very low | 43.5 | Very low | 99 Ų | 99 | 119.9 Ų | 119.9 | 82% | 0.818 | 69% | 0.69 | S | S | * | * | trans | -67.3 | 96.8 | 165.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 70 | V | 45.3 | Very low | 44.3 | Very low | 86 Ų | 86 | 117.9 Ų | 117.9 | 52% | 0.521 | 68% | 0.675 | S | S | . | * | trans | -103 | 113.2 | 177.7 | -175.9 | 0 | 0 | 0 | 0 | 108.7 | I68 T72 | I68-V70 HydrophobicContact CB-CG2 4.02Å; I68-V70 HydrophobicContact CG2-CG2 3.35Å; I68-V70 PolarHBondContact O-N 3.02Å; V70-T72 PolarHBondContact O-N 2.91Å | ||
| 71 | D | 45.8 | Very low | 45.4 | Very low | 44 Ų | 44 | 115 Ų | 115 | 24% | 0.235 | 66% | 0.66 | C | S | . | * | trans | -53.7 | 112.3 | 175.1 | -169.3 | 9.1 | 0 | 0 | 0 | 111.2 | A73 T74 | D71-A73 VanDerWaalsContact C-N 3.31Å; D71-A73 PolarHBondContact OD1-N 3.19Å; D71-T74 PolarHBondContact OD2-OG1 2.95Å | ||
| 72 | T | 47.5 | Very low | 46.3 | Very low | 151 Ų | 151 | 116.2 Ų | 116.2 | 93% | 0.926 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -86.6 | -1 | 176.7 | 45.8 | 0 | 0 | 0 | 0 | 113 | V70 | V70-T72 PolarHBondContact O-N 2.91Š|
| 73 | A | 49.2 | Very low | 47.5 | Very low | 78 Ų | 78 | 112.9 Ų | 112.9 | 65% | 0.645 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -87.9 | -14.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | D71 | D71-A73 VanDerWaalsContact C-N 3.31Å; D71-A73 PolarHBondContact OD1-N 3.19Å |
| 74 | T | 44.4 | Very low | 48.3 | Very low | 61 Ų | 61 | 111.8 Ų | 111.8 | 37% | 0.374 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -146 | 119.3 | 178.7 | 5.9 | 0 | 0 | 0 | 0 | 107 | D71 T76 | D71-T74 PolarHBondContact OD2-OG1 2.95Å; T74-T76 PolarHBondContact O-N 3.42Å |
| 75 | S | 41.7 | Very low | 49.5 | Very low | 130 Ų | 130 | 106.4 Ų | 106.4 | 91% | 0.909 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | 34.2 | -175.5 | 68.9 | 0 | 0 | 0 | 0 | 114.9 | ||
| 76 | T | 45.6 | Very low | 50.5 | Low | 87 Ų | 87 | 110 Ų | 110 | 53% | 0.534 | 62% | 0.617 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -133.4 | -2.6 | -167.4 | 58.2 | 0 | 0 | 0 | 0 | 113.8 | T74 R78 | T74-T76 PolarHBondContact O-N 3.42Å; T76-R78 PolarHBondContact O-N 3.23Å |
| 77 | G | 43.2 | Very low | 51.6 | Low | 33 Ų | 33 | 104.4 Ų | 104.4 | 34% | 0.34 | 60% | 0.602 | S | S | . | * | trans | 56.6 | 29.2 | 168.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 78 | R | 50.4 | Low | 52.5 | Low | 189 Ų | 189 | 97.8 Ų | 97.8 | 71% | 0.713 | 57% | 0.567 | S | S | * | * | P | Polyproline II helix | trans | -95.7 | 136.1 | -178 | -79.2 | -177.1 | 169.9 | 171.5 | -2.3 | 111.3 | T76 L80 | T76-R78 PolarHBondContact O-N 3.23Å; R78-L80 PolarHBondContact O-N 3.28Å |
| 79 | P | 54.8 | Low | 53.5 | Low | 124 Ų | 124 | 96.7 Ų | 96.7 | 81% | 0.805 | 56% | 0.562 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 134.7 | 173.3 | 26.4 | -32.8 | 0 | 0 | 0 | 110.9 | ||
| 80 | L | 58.9 | Low | 54.4 | Low | 78 Ų | 78 | 98.5 Ų | 98.5 | 41% | 0.408 | 56% | 0.558 | S | S | . | * | P | Polyproline II helix | trans | -62.7 | 135.4 | 176 | -69.1 | 169.5 | 0 | 0 | 0 | 111.4 | R78 Q84 L88 | R78-L80 PolarHBondContact O-N 3.28Å; L80-Q84 HydrophobicContact CB-CB 4.48Å; L80-Q84 HydrophobicContact CD2-CB 4.21Å; L80-L88 HydrophobicContact CD1-CD1 4.4Å |
| 81 | S | 61.9 | Low | 55.3 | Low | 65 Ų | 65 | 97.1 Ų | 97.1 | 46% | 0.455 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -67.3 | 155.4 | 173.8 | 66.6 | 0 | 0 | 0 | 0 | 111.8 | G83 Q84 R85 | S81-G83 PolarHBondContact O-N 3.42Å; S81-G83 VanDerWaalsContact O-N 3.12Å; S81-Q84 PolarHBondContact O-N 3.31Å; S81-Q84 VanDerWaalsContact O-N 3.09Å; S81-Q84 PolarHBondContact OG-OE1 3.47Å; S81-R85 PolarHBondContact O-N 3.49Å |
| 82 | M | 59.6 | Low | 55.9 | Low | 168 Ų | 168 | 98.3 Ų | 98.3 | 83% | 0.828 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -54.4 | -32.3 | 176 | -83 | -161.6 | -165.7 | 0 | 0 | 113 | R85 R86 | M82-R85 PolarHBondContact O-N 3.27Å; M82-R86 PolarHBondContact O-N 2.73Å |
| 83 | G | 63.7 | Low | 56.4 | Low | 52 Ų | 52 | 91.9 Ų | 91.9 | 54% | 0.536 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.1 | -42.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S81 R85 R86 G87 | S81-G83 PolarHBondContact O-N 3.42Å; S81-G83 VanDerWaalsContact O-N 3.12Å; G83-R85 PolarHBondContact O-N 3.09Å; G83-R86 PolarHBondContact O-N 3.01Å; G83-G87 PolarHBondContact O-N 3.38Å; G83-G87 VanDerWaalsContact O-N 3.16Å |
| 84 | Q | 59.6 | Low | 56.6 | Low | 101 Ų | 101 | 91.3 Ų | 91.3 | 47% | 0.472 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.8 | -37.7 | 178.2 | -72.3 | 167.4 | -54.9 | 0 | 0 | 111.8 | L80 S81 R86 G87 L88 | L80-Q84 HydrophobicContact CB-CB 4.48Å; L80-Q84 HydrophobicContact CD2-CB 4.21Å; S81-Q84 PolarHBondContact O-N 3.31Å; S81-Q84 VanDerWaalsContact O-N 3.09Å; S81-Q84 PolarHBondContact OG-OE1 3.47Å; Q84-R86 VanDerWaalsContact C-N 3.34Å; Q84-R86 PolarHBondContact O-N 3.06Å; Q84-G87 PolarHBondContact O-N 2.82Å; Q84-L88 WeakPolarHBondContact O-CD1 3.32Å; Q84-L88 PolarHBondContact O-N 2.82Å; Q84-L88 VanDerWaalsContact O-N 3.15Å |
| 85 | R | 60.4 | Low | 57 | Low | 125 Ų | 125 | 90.3 Ų | 90.3 | 47% | 0.472 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58 | -44.2 | 173.8 | -74.4 | -177.2 | 176.2 | -117.6 | 5.7 | 112.3 | S81 M82 G83 L88 I89 | S81-R85 PolarHBondContact O-N 3.49Å; M82-R85 PolarHBondContact O-N 3.27Å; G83-R85 PolarHBondContact O-N 3.09Å; R85-L88 PolarHBondContact O-N 3.12Å; R85-I89 WeakPolarHBondContact O-CD1 2.99Å; R85-I89 WeakPolarHBondContact O-CG1 3.35Å; R85-I89 PolarHBondContact O-N 3.5Å |
| 86 | R | 60.8 | Low | 57.5 | Low | 192 Ų | 192 | 89.8 Ų | 89.8 | 73% | 0.725 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.2 | -37.1 | 177.6 | -77.6 | -176 | 172.4 | -174.4 | -1.6 | 112.5 | M82 G83 Q84 L88 I89 N90 | M82-R86 PolarHBondContact O-N 2.73Å; G83-R86 PolarHBondContact O-N 3.01Å; Q84-R86 VanDerWaalsContact C-N 3.34Å; Q84-R86 PolarHBondContact O-N 3.06Å; R86-L88 VanDerWaalsContact C-N 3.34Å; R86-L88 PolarHBondContact O-N 2.97Å; R86-I89 PolarHBondContact O-N 3.5Å; R86-N90 WeakPolarHBondContact O-CB 3.46Å; R86-N90 PolarHBondContact O-N 2.97Å |
| 87 | G | 61.9 | Low | 57.6 | Low | 43 Ų | 43 | 94.3 Ų | 94.3 | 44% | 0.443 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | G83 Q84 N90 S91 | G83-G87 PolarHBondContact O-N 3.38Å; G83-G87 VanDerWaalsContact O-N 3.16Å; Q84-G87 PolarHBondContact O-N 2.82Å; G87-N90 PolarHBondContact O-N 3.12Å; G87-S91 PolarHBondContact O-N 3.09Å; G87-S91 VanDerWaalsContact O-N 3.09Å |
| 88 | L | 60.6 | Low | 58.1 | Low | 30 Ų | 30 | 96 Ų | 96 | 16% | 0.157 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -70.1 | -36.3 | 178 | -76 | 151.2 | 0 | 0 | 0 | 112.9 | L80 Q84 R85 R86 S91 V104 | L80-L88 HydrophobicContact CD1-CD1 4.4Å; Q84-L88 WeakPolarHBondContact O-CD1 3.32Å; Q84-L88 PolarHBondContact O-N 2.82Å; Q84-L88 VanDerWaalsContact O-N 3.15Å; R85-L88 PolarHBondContact O-N 3.12Å; R86-L88 VanDerWaalsContact C-N 3.34Å; R86-L88 PolarHBondContact O-N 2.97Å; L88-S91 PolarHBondContact O-OG 2.81Å; L88-S91 VanDerWaalsContact O-OG 3.06Å; L88-V104 HydrophobicContact CB-CG1 4.18Å; L88-V104 HydrophobicContact CB-CG2 4.08Å; L88-V104 HydrophobicContact CD1-CG2 4.29Å; L88-V104 HydrophobicContact CD2-CB 3.88Å; L88-V104 HydrophobicContact CD2-CG1 3.42Å; L88-V104 VanDerWaalsContact CD2-CG1 3.42Å; L88-V104 HydrophobicContact CD2-CG2 4.32Å; L88-V104 HydrophobicContact CG-CG1 4.3Å; L88-V104 HydrophobicContact CG-CG2 4.45Å |
| 89 | I | 62.3 | Low | 58 | Low | 94 Ų | 94 | 95.2 Ų | 95.2 | 48% | 0.482 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.1 | -40.3 | 175 | -65.7 | 164.7 | 0 | 0 | 0 | 110.5 | R85 R86 | R85-I89 WeakPolarHBondContact O-CD1 2.99Å; R85-I89 WeakPolarHBondContact O-CG1 3.35Å; R85-I89 PolarHBondContact O-N 3.5Å; R86-I89 PolarHBondContact O-N 3.5Å |
| 90 | N | 64.2 | Low | 57.6 | Low | 138 Ų | 138 | 100 Ų | 100 | 74% | 0.738 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -77.8 | -16.5 | -178.9 | -71.8 | -9.7 | 0 | 0 | 0 | 114 | R86 G87 G92 | R86-N90 WeakPolarHBondContact O-CB 3.46Å; R86-N90 PolarHBondContact O-N 2.97Å; G87-N90 PolarHBondContact O-N 3.12Å; N90-G92 PolarHBondContact O-N 3.03Å |
| 91 | S | 64.3 | Low | 57.1 | Low | 56 Ų | 56 | 98 Ų | 98 | 39% | 0.392 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78 | 0.2 | 179.7 | 65.8 | 0 | 0 | 0 | 0 | 114 | G87 L88 A93 | G87-S91 PolarHBondContact O-N 3.09Å; G87-S91 VanDerWaalsContact O-N 3.09Å; L88-S91 PolarHBondContact O-OG 2.81Å; L88-S91 VanDerWaalsContact O-OG 3.06Å; S91-A93 PolarHBondContact O-N 3.45Å; S91-A93 VanDerWaalsContact O-N 3.12Å |
| 92 | G | 59.9 | Low | 56.4 | Low | 69 Ų | 69 | 97 Ų | 97 | 71% | 0.711 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.6 | 13.2 | -177 | 0 | 0 | 0 | 0 | 0 | 113.8 | N90 | N90-G92 PolarHBondContact O-N 3.03Š|
| 93 | A | 56.9 | Low | 56 | Low | 17 Ų | 17 | 91.9 Ų | 91.9 | 14% | 0.14 | 49% | 0.492 | C | S | . | . | trans | -69.3 | 140.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | S91 V95 V104 | S91-A93 PolarHBondContact O-N 3.45Å; S91-A93 VanDerWaalsContact O-N 3.12Å; A93-V95 WeakPolarHBondContact O-CG2 3.5Å; A93-V95 PolarHBondContact O-N 3.38Å; A93-V104 HydrophobicContact CB-CG1 4.09Å | ||
| 94 | P | 53.6 | Low | 55.4 | Low | 65 Ų | 65 | 91.4 Ų | 91.4 | 42% | 0.422 | 48% | 0.478 | S | S | . | . | trans | -60 | 111.5 | 178.1 | 23.7 | -31.5 | 0 | 0 | 0 | 109.7 | ||||
| 95 | V | 53.3 | Low | 55 | Low | 41 Ų | 41 | 90.5 Ų | 90.5 | 25% | 0.248 | 48% | 0.476 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 108.7 | 175.1 | 179.7 | 0 | 0 | 0 | 0 | 107.7 | A93 W97 Q102 V104 | A93-V95 WeakPolarHBondContact O-CG2 3.5Å; A93-V95 PolarHBondContact O-N 3.38Å; V95-W97 HydrophobicContact CG1-CZ2 4.28Å; V95-Q102 HydrophobicContact CG1-CG 3.39Å; V95-V104 HydrophobicContact CG2-CG2 4.28Å |
| 96 | H | 52.1 | Low | 54.4 | Low | 119 Ų | 119 | 90 Ų | 90 | 55% | 0.551 | 47% | 0.474 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -90.9 | 115.6 | 171.8 | -82.2 | -80 | 0 | 0 | 0 | 109.7 | V103 | H96-V103 PolarHBondContact N-O 3.47Å; H96-V103 PolarHBondContact O-N 3.3Å; H96-V103 VanDerWaalsContact O-O 3.1Å |
| 97 | W | 48.2 | Very low | 53.9 | Low | 181 Ų | 181 | 87.3 Ų | 87.3 | 69% | 0.686 | 47% | 0.474 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -84 | 121.8 | 170.2 | -62.3 | 88.7 | 0 | 0 | 0 | 108.6 | V95 Q102 | V95-W97 HydrophobicContact CG1-CZ2 4.28Å; W97-Q102 HydrophobicContact CD2-CG 4.4Å; W97-Q102 HydrophobicContact CE3-CB 3.97Å; W97-Q102 HydrophobicContact CE3-CG 4.28Å; W97-Q102 HydrophobicContact CH2-CB 4.17Å; W97-Q102 HydrophobicContact CH2-CG 4.07Å; W97-Q102 HydrophobicContact CZ2-CG 4.18Å; W97-Q102 HydrophobicContact CZ3-CB 3.78Å; W97-Q102 HydrophobicContact CZ3-CG 4.13Å |
| 98 | T | 52.9 | Low | 53.3 | Low | 68 Ų | 68 | 91.1 Ų | 91.1 | 42% | 0.417 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 160.4 | 168.5 | 67.1 | 0 | 0 | 0 | 0 | 108.8 | W100 G101 V103 | T98-W100 PolarHBondContact O-N 3.15Å; T98-W100 PolarHBondContact OG1-N 3.22Å; T98-G101 PolarHBondContact N-O 3.06Å; T98-G101 PolarHBondContact O-N 3.3Å; T98-G101 PolarHBondContact OG1-N 3.16Å; T98-G101 PolarHBondContact OG1-O 2.66Å; T98-V103 HydrophobicContact CG2-CG2 4.12Å |
| 99 | N | 47.2 | Very low | 52.6 | Low | 174 Ų | 174 | 93.7 Ų | 93.7 | 93% | 0.93 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | -3.9 | 170.8 | -92.7 | -22.4 | 0 | 0 | 0 | 113.9 | ||
| 100 | W | 46.8 | Very low | 51.6 | Low | 224 Ų | 224 | 91.6 Ų | 91.6 | 85% | 0.848 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117.9 | -1 | -173.3 | -56.2 | 65.1 | 0 | 0 | 0 | 112.4 | T98 | T98-W100 PolarHBondContact O-N 3.15Å; T98-W100 PolarHBondContact OG1-N 3.22Å |
| 101 | G | 49.7 | Very low | 50.4 | Low | 37 Ų | 37 | 89.6 Ų | 89.6 | 38% | 0.381 | 52% | 0.522 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 132.5 | 179.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | T98 | T98-G101 PolarHBondContact N-O 3.06Å; T98-G101 PolarHBondContact O-N 3.3Å; T98-G101 PolarHBondContact OG1-N 3.16Å; T98-G101 PolarHBondContact OG1-O 2.66Å |
| 102 | Q | 45.9 | Very low | 49.4 | Very low | 42 Ų | 42 | 93.9 Ų | 93.9 | 20% | 0.196 | 53% | 0.534 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 121.5 | -179.7 | -169.3 | -175.9 | -3.5 | 0 | 0 | 110 | V95 W97 V104 | V95-Q102 HydrophobicContact CG1-CG 3.39Å; W97-Q102 HydrophobicContact CD2-CG 4.4Å; W97-Q102 HydrophobicContact CE3-CB 3.97Å; W97-Q102 HydrophobicContact CE3-CG 4.28Å; W97-Q102 HydrophobicContact CH2-CB 4.17Å; W97-Q102 HydrophobicContact CH2-CG 4.07Å; W97-Q102 HydrophobicContact CZ2-CG 4.18Å; W97-Q102 HydrophobicContact CZ3-CB 3.78Å; W97-Q102 HydrophobicContact CZ3-CG 4.13Å; Q102-V104 HydrophobicContact CG-CG2 4.23Å |
| 103 | V | 51.5 | Low | 48.4 | Very low | 62 Ų | 62 | 102.1 Ų | 102.1 | 38% | 0.376 | 54% | 0.544 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 118.9 | 170.2 | -175.5 | 0 | 0 | 0 | 0 | 107.2 | H96 T98 I105 | H96-V103 PolarHBondContact N-O 3.47Å; H96-V103 PolarHBondContact O-N 3.3Å; H96-V103 VanDerWaalsContact O-O 3.1Å; T98-V103 HydrophobicContact CG2-CG2 4.12Å; V103-I105 HydrophobicContact CG1-CD1 4.31Å; V103-I105 HydrophobicContact CG1-CG1 3.85Å |
| 104 | V | 50.8 | Low | 47.9 | Very low | 42 Ų | 42 | 112.5 Ų | 112.5 | 26% | 0.255 | 60% | 0.597 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.3 | 114.2 | 172.4 | -169.1 | 0 | 0 | 0 | 0 | 107.8 | L88 A93 V95 Q102 | L88-V104 HydrophobicContact CB-CG1 4.18Å; L88-V104 HydrophobicContact CB-CG2 4.08Å; L88-V104 HydrophobicContact CD1-CG2 4.29Å; L88-V104 HydrophobicContact CD2-CB 3.88Å; L88-V104 HydrophobicContact CD2-CG1 3.42Å; L88-V104 VanDerWaalsContact CD2-CG1 3.42Å; L88-V104 HydrophobicContact CD2-CG2 4.32Å; L88-V104 HydrophobicContact CG-CG1 4.3Å; L88-V104 HydrophobicContact CG-CG2 4.45Å; A93-V104 HydrophobicContact CB-CG1 4.09Å; V95-V104 HydrophobicContact CG2-CG2 4.28Å; Q102-V104 HydrophobicContact CG-CG2 4.23Å |
| 105 | I | 52.2 | Low | 47.6 | Very low | 82 Ų | 82 | 114.9 Ų | 114.9 | 42% | 0.421 | 61% | 0.605 | S | S | . | * | trans | -103.4 | 117.8 | 176.3 | -54.9 | 177.6 | 0 | 0 | 0 | 106 | V103 | V103-I105 HydrophobicContact CG1-CD1 4.31Å; V103-I105 HydrophobicContact CG1-CG1 3.85Å | ||
| 106 | R | 46.9 | Very low | 47.3 | Very low | 113 Ų | 113 | 118.7 Ų | 118.7 | 43% | 0.426 | 62% | 0.624 | S | S | . | * | trans | -87.3 | 122 | 161.1 | -90.5 | -172 | -174.3 | 170.4 | -0.2 | 107.2 | D108 | R106-D108 PolarHBondContact O-N 3.24Š| ||
| 107 | D | 50.1 | Low | 47.1 | Very low | 137 Ų | 137 | 118.7 Ų | 118.7 | 73% | 0.733 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | 3 | 175.5 | -80.9 | -31.7 | 0 | 0 | 0 | 112.5 | ||
| 108 | D | 49.7 | Very low | 47 | Very low | 122 Ų | 122 | 115.1 Ų | 115.1 | 65% | 0.652 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | 0.8 | -161.3 | -33.6 | -22.5 | 0 | 0 | 0 | 114 | R106 G110 | R106-D108 PolarHBondContact O-N 3.24Å; D108-G110 PolarHBondContact O-N 2.91Å |
| 109 | G | 46 | Very low | 46.6 | Very low | 84 Ų | 84 | 118 Ų | 118 | 87% | 0.866 | 64% | 0.638 | S | S | * | * | trans | 58.7 | 13.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 110 | G | 42 | Very low | 46.6 | Very low | 51 Ų | 51 | 114.3 Ų | 114.3 | 53% | 0.526 | 62% | 0.618 | S | S | . | * | trans | -88.6 | 112 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113 | D108 F112 | D108-G110 PolarHBondContact O-N 2.91Å; G110-F112 PolarHBondContact O-N 3.47Å | ||
| 111 | A | 37.8 | Very low | 46.6 | Very low | 95 Ų | 95 | 106.4 Ų | 106.4 | 79% | 0.785 | 60% | 0.602 | S | S | * | * | trans | -59 | 128.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | R113 | A111-R113 PolarHBondContact O-N 3.23Š| ||
| 112 | F | 43.4 | Very low | 46.4 | Very low | 147 Ų | 147 | 111.8 Ų | 111.8 | 65% | 0.645 | 62% | 0.619 | S | S | * | * | trans | -67.8 | 113.4 | 162 | -77.4 | -89.1 | 0 | 0 | 0 | 108.2 | G110 | G110-F112 PolarHBondContact O-N 3.47Š| ||
| 113 | R | 39.9 | Very low | 46.4 | Very low | 241 Ų | 241 | 117.6 Ų | 117.6 | 91% | 0.909 | 65% | 0.654 | S | S | * | * | trans | -74.4 | 135.8 | 160.1 | -82.7 | -178.7 | 160 | -163.9 | -4.7 | 108 | A111 | A111-R113 PolarHBondContact O-N 3.23Š| ||
| 114 | N | 46.4 | Very low | 45.9 | Very low | 235 Ų | 235 | 122.6 Ų | 122.6 | 100% | 1.257 | 68% | 0.679 | S | S | * | * | trans | -42 | 0 | -178.9 | -79.2 | -19.2 | 0 | 0 | 0 | 114.8 |
Retrieved 114 of 114 residues in 105.4 ms
(Link to these results)