| 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 | 39.1 | Very low | 30.7 | Very low | 229 Ų | 229 | 130.3 Ų | 130.3 | 100% | 1.128 | 78% | 0.779 | S | S | * | * | 0 | 115.5 | 0 | -74.7 | -143.1 | -98.7 | 0 | 0 | 107.9 | |||||
| 2 | S | 33.6 | Very low | 30.4 | Very low | 98 Ų | 98 | 130.7 Ų | 130.7 | 69% | 0.685 | 77% | 0.774 | S | S | * | * | trans | 60.9 | 126 | 141.9 | -35.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 3 | H | 33.3 | Very low | 30.3 | Very low | 160 Ų | 160 | 132 Ų | 132 | 74% | 0.741 | 78% | 0.775 | S | S | * | * | cis | -161.8 | 134.4 | 21.3 | -92.5 | -68.5 | 0 | 0 | 0 | 107.8 | ||||
| 4 | L | 33.5 | Very low | 30 | Very low | 147 Ų | 147 | 135.1 Ų | 135.1 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | 63.1 | 115.2 | 117.9 | -83 | 107.9 | 0 | 0 | 0 | 117.7 | |||||
| 5 | A | 32.7 | Very low | 30 | Very low | 79 Ų | 79 | 140.5 Ų | 140.5 | 65% | 0.653 | 79% | 0.79 | S | S | * | * | 85.4 | 113.6 | 73.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 6 | A | 27.9 | Very low | 29.7 | Very low | 93 Ų | 93 | 137.3 Ų | 137.3 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | 60.1 | 114.5 | 78.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 7 | Q | 29.8 | Very low | 29.8 | Very low | 190 Ų | 190 | 138.7 Ų | 138.7 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | 168.2 | 109.5 | 149.8 | -95.7 | 169.5 | 6.3 | 0 | 0 | 107.9 | ||||
| 8 | S | 25.3 | Very low | 29.6 | Very low | 97 Ų | 97 | 137.8 Ų | 137.8 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | 83.9 | 121.9 | 62 | 74.9 | 0 | 0 | 0 | 0 | 115 | |||||
| 9 | C | 23.8 | Very low | 29.9 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 81% | 0.811 | 78% | 0.78 | S | S | * | * | trans | 59.7 | 119.8 | 137.8 | -64.2 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 10 | S | 29.1 | Very low | 29.8 | Very low | 110 Ų | 110 | 139.2 Ų | 139.2 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | trans | -174.4 | 103.4 | 133.3 | -92.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 11 | T | 29.4 | Very low | 29.9 | Very low | 110 Ų | 110 | 139.7 Ų | 139.7 | 68% | 0.675 | 78% | 0.781 | S | S | * | * | 76.5 | 124.8 | 86.3 | 57.4 | 0 | 0 | 0 | 0 | 116 | |||||
| 12 | N | 27.6 | Very low | 29.4 | Very low | 135 Ų | 135 | 133.1 Ų | 133.1 | 72% | 0.722 | 76% | 0.763 | S | S | * | * | trans | 76.4 | 112 | 144.5 | -58.9 | -16.8 | 0 | 0 | 0 | 119.3 | ||||
| 13 | N | 29.3 | Very low | 29.3 | Very low | 148 Ų | 148 | 132.5 Ų | 132.5 | 79% | 0.791 | 76% | 0.764 | S | S | * | * | -173.6 | 107.9 | 102.5 | -87.2 | -21.8 | 0 | 0 | 0 | 111.6 | |||||
| 14 | L | 26 | Very low | 29.2 | Very low | 175 Ų | 175 | 133.9 Ų | 133.9 | 92% | 0.916 | 77% | 0.768 | S | S | * | * | trans | -61.4 | 127.5 | 150.2 | -80.4 | 152.9 | 0 | 0 | 0 | 108 | ||||
| 15 | Y | 30 | Very low | 29 | Very low | 216 Ų | 216 | 138.7 Ų | 138.7 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | trans | -138 | 123.2 | 155.3 | -113.1 | -87 | 0 | 0 | 0 | 110.3 | ||||
| 16 | S | 25.3 | Very low | 28.8 | Very low | 89 Ų | 89 | 138.7 Ų | 138.7 | 62% | 0.622 | 78% | 0.783 | S | S | * | * | trans | -49.9 | 137.7 | 172.2 | -170.4 | 0 | 0 | 0 | 0 | 112.8 | T18 | S16-T18 PolarHBondContact OG-OG1 2.96Š| ||
| 17 | I | 31.3 | Very low | 28.7 | Very low | 162 Ų | 162 | 138.9 Ų | 138.9 | 83% | 0.831 | 79% | 0.785 | S | S | * | * | trans | -125.1 | 82.1 | 155.6 | -56.3 | 176.9 | 0 | 0 | 0 | 107.2 | M19 | I17-M19 HydrophobicContact CG2-CG 4.31Š| ||
| 18 | T | 26.3 | Very low | 28.5 | Very low | 122 Ų | 122 | 138.9 Ų | 138.9 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | trans | -85 | 120.2 | 150.7 | 20.9 | 0 | 0 | 0 | 0 | 107.3 | S16 | S16-T18 PolarHBondContact OG-OG1 2.96Š| ||
| 19 | M | 34 | Very low | 28.7 | Very low | 157 Ų | 157 | 139 Ų | 139 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | trans | -122.1 | 90.9 | 164.2 | -83.9 | -78.3 | -101 | 0 | 0 | 107.5 | I17 | I17-M19 HydrophobicContact CG2-CG 4.31Š| ||
| 20 | D | 28.1 | Very low | 28.9 | Very low | 146 Ų | 146 | 140.8 Ų | 140.8 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | -64.9 | 126.1 | 158.7 | -131.6 | -41.7 | 0 | 0 | 0 | 107.8 | ||||
| 21 | N | 32.1 | Very low | 29 | Very low | 151 Ų | 151 | 141.4 Ų | 141.4 | 81% | 0.807 | 79% | 0.794 | S | S | * | * | trans | -145.8 | 73.2 | 164.4 | -106.1 | -21.7 | 0 | 0 | 0 | 108.9 | ||||
| 22 | A | 28.1 | Very low | 28.9 | Very low | 91 Ų | 91 | 140.4 Ų | 140.4 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | trans | -82.1 | 109.7 | 156.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 23 | A | 32.1 | Very low | 28.8 | Very low | 85 Ų | 85 | 140.4 Ų | 140.4 | 70% | 0.702 | 79% | 0.792 | S | S | * | * | trans | -171.1 | 111.1 | 149.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 24 | K | 31.7 | Very low | 28.7 | Very low | 189 Ų | 189 | 142.8 Ų | 142.8 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | 73.6 | 118.9 | 132.3 | -71.9 | 174.6 | 177.2 | 172 | 0 | 120.5 | ||||
| 25 | R | 28.5 | Very low | 28.7 | Very low | 247 Ų | 247 | 137.6 Ų | 137.6 | 93% | 0.932 | 78% | 0.783 | S | S | * | * | trans | 87.7 | 124.3 | 140.2 | -69.7 | 176.6 | -180 | -170.5 | 0.2 | 118.3 | ||||
| 26 | G | 27.9 | Very low | 28.4 | Very low | 79 Ų | 79 | 134.6 Ų | 134.6 | 81% | 0.814 | 78% | 0.782 | S | S | * | * | trans | 146.2 | 65.6 | 151.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 27 | A | 25.7 | Very low | 28.6 | Very low | 97 Ų | 97 | 136.4 Ų | 136.4 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | -68.7 | 134.3 | 161.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 28 | Q | 26.7 | Very low | 28.4 | Very low | 191 Ų | 191 | 135.4 Ų | 135.4 | 89% | 0.893 | 79% | 0.791 | S | S | * | * | 159.6 | 143.8 | 121.7 | -85.2 | -172 | 4.9 | 0 | 0 | 113 | |||||
| 29 | A | 29.8 | Very low | 28.5 | Very low | 99 Ų | 99 | 136.3 Ų | 136.3 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | 88.9 | 90.6 | 153.7 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 30 | L | 28.6 | Very low | 28.1 | Very low | 158 Ų | 158 | 136.6 Ų | 136.6 | 83% | 0.827 | 80% | 0.795 | S | S | * | * | trans | -56.3 | 161.7 | 143.2 | -96.6 | 146.7 | 0 | 0 | 0 | 111.2 | ||||
| 31 | P | 30.1 | Very low | 28 | Very low | 122 Ų | 122 | 133.5 Ų | 133.5 | 79% | 0.792 | 80% | 0.797 | S | S | * | * | -138.3 | 144.4 | 92.3 | 27.3 | -7.8 | 0 | 0 | 0 | 115.9 | |||||
| 32 | S | 26.5 | Very low | 27.7 | Very low | 89 Ų | 89 | 135.7 Ų | 135.7 | 62% | 0.622 | 80% | 0.799 | S | S | * | * | trans | -42.4 | 141.2 | 159.8 | 43.9 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 33 | N | 26.5 | Very low | 27.8 | Very low | 136 Ų | 136 | 137 Ų | 137 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | -179.5 | 144.8 | 117.5 | -108.4 | -11.7 | 0 | 0 | 0 | 114.9 | |||||
| 34 | F | 27.9 | Very low | 27.9 | Very low | 198 Ų | 198 | 136.5 Ų | 136.5 | 87% | 0.868 | 80% | 0.799 | S | S | * | * | trans | 68.2 | 122.7 | 168.5 | -62.3 | -78.2 | 0 | 0 | 0 | 117.4 | ||||
| 35 | G | 24.5 | Very low | 27.9 | Very low | 65 Ų | 65 | 133 Ų | 133 | 67% | 0.67 | 80% | 0.798 | S | S | * | * | cis | 172.1 | 146.2 | 5.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 36 | D | 24 | Very low | 28.6 | Very low | 154 Ų | 154 | 123.9 Ų | 123.9 | 82% | 0.824 | 77% | 0.768 | S | S | * | * | trans | 49 | 97 | 160.9 | -61.1 | -45 | 0 | 0 | 0 | 119.8 | ||||
| 37 | S | 31.1 | Very low | 29.4 | Very low | 127 Ų | 127 | 122.9 Ų | 122.9 | 89% | 0.888 | 75% | 0.748 | S | S | * | * | trans | -163.2 | 85.6 | 135.1 | -80.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 38 | N | 25.2 | Very low | 30.3 | Very low | 141 Ų | 141 | 122.9 Ų | 122.9 | 75% | 0.754 | 74% | 0.74 | S | S | * | * | trans | -36.3 | 140.8 | 163.8 | -100.7 | -29.8 | 0 | 0 | 0 | 114.9 | ||||
| 39 | L | 29.6 | Very low | 31.3 | Very low | 140 Ų | 140 | 117.7 Ų | 117.7 | 73% | 0.733 | 72% | 0.721 | S | S | * | * | trans | 83.3 | 85.3 | 141.5 | -60.6 | 160.2 | 0 | 0 | 0 | 118.3 | ||||
| 40 | L | 25.2 | Very low | 32 | Very low | 164 Ų | 164 | 113.3 Ų | 113.3 | 86% | 0.859 | 69% | 0.685 | S | S | * | * | 37.5 | 117.4 | 111.2 | -74.5 | 149.8 | 0 | 0 | 0 | 117 | |||||
| 41 | G | 25.7 | Very low | 33 | Very low | 80 Ų | 80 | 110.5 Ų | 110.5 | 83% | 0.825 | 67% | 0.669 | S | S | * | * | 85.6 | 38.8 | 129.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | |||||
| 42 | K | 26.2 | Very low | 34.1 | Very low | 197 Ų | 197 | 111.1 Ų | 111.1 | 86% | 0.857 | 66% | 0.661 | S | S | * | * | trans | -122.7 | 86.6 | 162.4 | -69.8 | -179.1 | -178.6 | 175.7 | 0 | 110.2 | A44 | K42-A44 PolarHBondContact O-N 3.15Š| ||
| 43 | S | 30.9 | Very low | 35.4 | Very low | 119 Ų | 119 | 109.1 Ų | 109.1 | 83% | 0.832 | 64% | 0.644 | S | S | * | * | trans | -54.3 | 96.1 | 140.4 | 37.5 | 0 | 0 | 0 | 0 | 105.3 | S45 | S43-S45 PolarHBondContact O-N 3.25Š| ||
| 44 | A | 33.4 | Very low | 36.6 | Very low | 74 Ų | 74 | 103.2 Ų | 103.2 | 61% | 0.612 | 61% | 0.612 | S | S | * | * | trans | -47.6 | 115.9 | 169 | 0 | 0 | 0 | 0 | 0 | 105.2 | K42 L46 | K42-A44 PolarHBondContact O-N 3.15Å; A44-L46 VanDerWaalsContact C-N 3.28Å; A44-L46 PolarHBondContact O-N 2.9Å | ||
| 45 | S | 32.9 | Very low | 37.8 | Very low | 117 Ų | 117 | 97.5 Ų | 97.5 | 82% | 0.818 | 59% | 0.59 | S | S | * | * | trans | -58.8 | 93.7 | -169.4 | 43.3 | 0 | 0 | 0 | 0 | 108.7 | S43 S47 | S43-S45 PolarHBondContact O-N 3.25Å; S45-S47 PolarHBondContact O-N 3.03Å | ||
| 46 | L | 43 | Very low | 39.2 | Very low | 54 Ų | 54 | 95.2 Ų | 95.2 | 28% | 0.283 | 56% | 0.563 | S | S | . | * | trans | -53 | 126.1 | 168.3 | -73.3 | 169.9 | 0 | 0 | 0 | 105.4 | A44 A50 M51 L54 L83 L122 | A44-L46 VanDerWaalsContact C-N 3.28Å; A44-L46 PolarHBondContact O-N 2.9Å; L46-A50 HydrophobicContact CB-CB 4.43Å; L46-A50 HydrophobicContact CD2-CB 4.36Å; L46-M51 HydrophobicContact CB-CG 3.75Å; L46-M51 HydrophobicContact CB-SD 4.17Å; L46-M51 HydrophobicContact CD1-CG 4.22Å; L46-M51 HydrophobicContact CD1-SD 3.49Å; L46-M51 WeakPolarHBondContact CD1-SD 3.24Å; L46-M51 HydrophobicContact CG-SD 4.47Å; L46-L54 HydrophobicContact CD1-CD1 4.39Å; L46-L83 HydrophobicContact CD2-CD1 3.65Å; L46-L83 HydrophobicContact CD2-CD2 3.22Å; L46-L83 HydrophobicContact CD2-CG 4.06Å; L46-L122 HydrophobicContact CD1-CD1 4.43Å | ||
| 47 | S | 43.7 | Very low | 40.1 | Very low | 58 Ų | 58 | 90.7 Ų | 90.7 | 41% | 0.406 | 55% | 0.547 | S | S | . | . | trans | -55.1 | 144.3 | 176.6 | 88.8 | 0 | 0 | 0 | 0 | 107.7 | S45 T49 A50 M51 | S45-S47 PolarHBondContact O-N 3.03Å; S47-T49 PolarHBondContact O-N 3.3Å; S47-T49 WeakPolarHBondContact OG-CB 3.4Å; S47-T49 PolarHBondContact OG-N 3.34Å; S47-A50 WeakPolarHBondContact O-CA 3.23Å; S47-A50 WeakPolarHBondContact O-CB 3.42Å; S47-A50 PolarHBondContact O-N 3.5Å; S47-A50 PolarHBondContact OG-N 3.04Å; S47-M51 PolarHBondContact O-N 3.33Å | ||
| 48 | P | 45.3 | Very low | 40.8 | Very low | 97 Ų | 97 | 89.5 Ų | 89.5 | 63% | 0.63 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -51.7 | -29.8 | 177.5 | 9.3 | -20.8 | 0 | 0 | 0 | 111.9 | M51 Q52 | P48-M51 PolarHBondContact O-N 3.31Å; P48-Q52 WeakPolarHBondContact O-CB 3.45Å; P48-Q52 WeakPolarHBondContact O-CG 3.46Å; P48-Q52 PolarHBondContact O-N 3.39Å |
| 49 | T | 47.9 | Very low | 41.9 | Very low | 82 Ų | 82 | 84.4 Ų | 84.4 | 50% | 0.503 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.5 | -42.9 | 172 | -40.8 | 0 | 0 | 0 | 0 | 113.3 | S47 Q52 L53 | S47-T49 PolarHBondContact O-N 3.3Å; S47-T49 WeakPolarHBondContact OG-CB 3.4Å; S47-T49 PolarHBondContact OG-N 3.34Å; T49-Q52 PolarHBondContact O-N 3.25Å; T49-L53 HydrophobicContact CG2-CD1 4.46Å; T49-L53 WeakPolarHBondContact O-CB 3.29Å; T49-L53 WeakPolarHBondContact O-CG 3.47Å; T49-L53 PolarHBondContact O-N 3.07Å |
| 50 | A | 43.6 | Very low | 42.8 | Very low | 8 Ų | 8 | 84.6 Ų | 84.6 | 7% | 0.066 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -66.5 | -39 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | L46 S47 L53 L54 T79 | L46-A50 HydrophobicContact CB-CB 4.43Å; L46-A50 HydrophobicContact CD2-CB 4.36Å; S47-A50 WeakPolarHBondContact O-CA 3.23Å; S47-A50 WeakPolarHBondContact O-CB 3.42Å; S47-A50 PolarHBondContact O-N 3.5Å; S47-A50 PolarHBondContact OG-N 3.04Å; A50-L53 PolarHBondContact O-N 3.32Å; A50-L54 WeakPolarHBondContact O-CB 3.45Å; A50-L54 VanDerWaalsContact O-CG 3.22Å; A50-L54 WeakPolarHBondContact O-CG 3.06Å; A50-L54 PolarHBondContact O-N 3.49Å; A50-T79 HydrophobicContact CB-CG2 3.86Å |
| 51 | M | 49.9 | Very low | 43.8 | Very low | 99 Ų | 99 | 88 Ų | 88 | 49% | 0.488 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.5 | -39.7 | 173.5 | -76.8 | -64 | -71.9 | 0 | 0 | 112.2 | L46 S47 P48 L54 N55 | L46-M51 HydrophobicContact CB-CG 3.75Å; L46-M51 HydrophobicContact CB-SD 4.17Å; L46-M51 HydrophobicContact CD1-CG 4.22Å; L46-M51 HydrophobicContact CD1-SD 3.49Å; L46-M51 WeakPolarHBondContact CD1-SD 3.24Å; L46-M51 HydrophobicContact CG-SD 4.47Å; S47-M51 PolarHBondContact O-N 3.33Å; P48-M51 PolarHBondContact O-N 3.31Å; M51-L54 CarbonylContact O-C 3.56Å; M51-L54 PolarHBondContact O-N 3.44Å; M51-N55 WeakPolarHBondContact O-CB 3.37Å; M51-N55 PolarHBondContact O-N 3.44Å |
| 52 | Q | 53.6 | Low | 45 | Very low | 134 Ų | 134 | 91.3 Ų | 91.3 | 63% | 0.626 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65.1 | -40.4 | 174.9 | -76.8 | 169.1 | -10.6 | 0 | 0 | 112.1 | P48 T49 L54 N55 | P48-Q52 WeakPolarHBondContact O-CB 3.45Å; P48-Q52 WeakPolarHBondContact O-CG 3.46Å; P48-Q52 PolarHBondContact O-N 3.39Å; T49-Q52 PolarHBondContact O-N 3.25Å; Q52-L54 VanDerWaalsContact C-N 3.3Å; Q52-L54 PolarHBondContact O-N 2.82Å; Q52-N55 CarbonylContact O-C 3.19Å; Q52-N55 PolarHBondContact O-N 3.31Å; Q52-N55 VanDerWaalsContact O-N 3.1Å |
| 53 | L | 53 | Low | 46.2 | Very low | 48 Ų | 48 | 91.8 Ų | 91.8 | 25% | 0.251 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -71.7 | -22.4 | 174.7 | -72.5 | 175.7 | 0 | 0 | 0 | 113.4 | T49 A50 N55 L56 | T49-L53 HydrophobicContact CG2-CD1 4.46Å; T49-L53 WeakPolarHBondContact O-CB 3.29Å; T49-L53 WeakPolarHBondContact O-CG 3.47Å; T49-L53 PolarHBondContact O-N 3.07Å; A50-L53 PolarHBondContact O-N 3.32Å; L53-N55 VanDerWaalsContact C-N 3.32Å; L53-L56 HydrophobicContact CD2-CD2 4.34Å; L53-L56 WeakPolarHBondContact O-CD1 3.21Å; L53-L56 WeakPolarHBondContact O-CG 3.28Å |
| 54 | L | 52.7 | Low | 47.9 | Very low | 11 Ų | 11 | 87.2 Ų | 87.2 | 6% | 0.058 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -85.6 | -10.3 | 169.7 | -70.8 | 170.7 | 0 | 0 | 0 | 112.4 | L46 A50 M51 Q52 L76 L80 L83 L122 H125 T128 | L46-L54 HydrophobicContact CD1-CD1 4.39Å; A50-L54 WeakPolarHBondContact O-CB 3.45Å; A50-L54 VanDerWaalsContact O-CG 3.22Å; A50-L54 WeakPolarHBondContact O-CG 3.06Å; A50-L54 PolarHBondContact O-N 3.49Å; M51-L54 CarbonylContact O-C 3.56Å; M51-L54 PolarHBondContact O-N 3.44Å; Q52-L54 VanDerWaalsContact C-N 3.3Å; Q52-L54 PolarHBondContact O-N 2.82Å; L54-L76 HydrophobicContact CD2-CD1 4.14Å; L54-L80 HydrophobicContact CD2-CD2 4.28Å; L54-L83 HydrophobicContact CD1-CD1 4.47Å; L54-L122 HydrophobicContact CD1-CD1 4.21Å; L54-L122 HydrophobicContact CD1-CD2 4.36Å; L54-L122 HydrophobicContact CD2-CD2 4.33Å; L54-H125 WeakPolarHBondContact O-CB 3.01Å; L54-T128 VanDerWaalsContact C-OG1 3.31Å; L54-T128 PolarHBondContact O-OG1 3.2Å |
| 55 | N | 52.5 | Low | 49.8 | Very low | 78 Ų | 78 | 85.4 Ų | 85.4 | 42% | 0.417 | 46% | 0.458 | S | S | . | . | trans | -118.4 | 55.1 | -179.4 | -152.3 | 6.1 | 0 | 0 | 0 | 109.9 | M51 Q52 L53 A57 | M51-N55 WeakPolarHBondContact O-CB 3.37Å; M51-N55 PolarHBondContact O-N 3.44Å; Q52-N55 CarbonylContact O-C 3.19Å; Q52-N55 PolarHBondContact O-N 3.31Å; Q52-N55 VanDerWaalsContact O-N 3.1Å; L53-N55 VanDerWaalsContact C-N 3.32Å; N55-A57 PolarHBondContact O-N 3.43Å | ||
| 56 | L | 54 | Low | 51.8 | Low | 17 Ų | 17 | 83.4 Ų | 83.4 | 9% | 0.089 | 44% | 0.442 | C | S | . | . | trans | -69 | 28.7 | -178.5 | -64.2 | 165.4 | 0 | 0 | 0 | 113.7 | L53 S58 L59 L76 T128 F131 | L53-L56 HydrophobicContact CD2-CD2 4.34Å; L53-L56 WeakPolarHBondContact O-CD1 3.21Å; L53-L56 WeakPolarHBondContact O-CG 3.28Å; L56-S58 PolarHBondContact O-N 3.27Å; L56-L59 HydrophobicContact CB-CD1 4.1Å; L56-L59 HydrophobicContact CD2-CD1 3.88Å; L56-L59 HydrophobicContact CG-CD1 4.39Å; L56-L59 PolarHBondContact O-N 2.85Å; L56-L76 HydrophobicContact CD1-CD2 4.31Å; L56-T128 HydrophobicContact CD1-CG2 4.46Å; L56-F131 HydrophobicContact CD1-CB 4.13Å; L56-F131 HydrophobicContact CD1-CD1 3.35Å; L56-F131 HydrophobicContact CD1-CD2 4.41Å; L56-F131 HydrophobicContact CD1-CE1 3.79Å; L56-F131 HydrophobicContact CD1-CG 3.69Å; L56-F131 HydrophobicContact CD1-CZ 4.48Å | ||
| 57 | A | 43.8 | Very low | 53.4 | Low | 59 Ų | 59 | 84.3 Ų | 84.3 | 49% | 0.488 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -10.8 | 176 | 0 | 0 | 0 | 0 | 0 | 113.4 | N55 | N55-A57 PolarHBondContact O-N 3.43Š|
| 58 | S | 44.9 | Very low | 55 | Low | 102 Ų | 102 | 85.9 Ų | 85.9 | 71% | 0.713 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -7.9 | -179.6 | -46.6 | 0 | 0 | 0 | 0 | 114.7 | L56 | L56-S58 PolarHBondContact O-N 3.27Š|
| 59 | L | 48.2 | Very low | 56.5 | Low | 34 Ų | 34 | 82.5 Ų | 82.5 | 18% | 0.178 | 43% | 0.431 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | -4 | -171 | -98.7 | 147.7 | 0 | 0 | 0 | 115.4 | L56 R61 V64 K72 F131 | L56-L59 HydrophobicContact CB-CD1 4.1Å; L56-L59 HydrophobicContact CD2-CD1 3.88Å; L56-L59 HydrophobicContact CG-CD1 4.39Å; L56-L59 PolarHBondContact O-N 2.85Å; L59-R61 VanDerWaalsContact C-N 3.28Å; L59-R61 PolarHBondContact O-N 3.04Å; L59-V64 HydrophobicContact CD2-CB 4.43Å; L59-V64 HydrophobicContact CD2-CG1 4.37Å; L59-V64 HydrophobicContact CD2-CG2 3.9Å; L59-K72 HydrophobicContact CD1-CD 3.83Å; L59-K72 HydrophobicContact CD2-CD 4.02Å; L59-K72 HydrophobicContact CG-CD 4.29Å; L59-F131 HydrophobicContact CD1-CD2 3.62Å; L59-F131 HydrophobicContact CD1-CE2 3.52Å; L59-F131 HydrophobicContact CD1-CG 4.46Å; L59-F131 HydrophobicContact CD1-CZ 4.32Å; L59-F131 HydrophobicContact CD2-CE2 4.29Å; L59-F131 HydrophobicContact CG-CD2 4.49Å; L59-F131 HydrophobicContact CG-CE2 4.45Å |
| 60 | E | 47.9 | Very low | 58.1 | Low | 145 Ų | 145 | 79 Ų | 79 | 68% | 0.678 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.7 | -1.5 | -177.9 | -69.9 | -171.3 | 150.1 | 0 | 0 | 114.5 | Q130 | E60-Q130 PolarHBondContact OE1-OE1 2.86Š|
| 61 | R | 47.8 | Very low | 59.8 | Low | 234 Ų | 234 | 81.4 Ų | 81.4 | 88% | 0.883 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -135.5 | 2.8 | -167.7 | -67.1 | -168.2 | -169.7 | 170.3 | 4.3 | 118.5 | L59 | L59-R61 VanDerWaalsContact C-N 3.28Å; L59-R61 PolarHBondContact O-N 3.04Å |
| 62 | E | 50.1 | Low | 61.2 | Low | 150 Ų | 150 | 80.1 Ų | 80.1 | 70% | 0.701 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -119.3 | 142.1 | 178.1 | -75.2 | -179.2 | 155.4 | 0 | 0 | 111.2 | V64 | E62-V64 HydrophobicContact CB-CG2 4.1Å; E62-V64 WeakPolarHBondContact O-CG2 3.24Å; E62-V64 PolarHBondContact O-N 3.41Å |
| 63 | H | 51.8 | Low | 62.6 | Low | 208 Ų | 208 | 73.7 Ų | 73.7 | 96% | 0.963 | 38% | 0.383 | S | S | * | . | trans | -65.1 | 77.9 | 170.3 | -80.1 | -75.4 | 0 | 0 | 0 | 109.6 | ||||
| 64 | V | 65.3 | Low | 64 | Low | 23 Ų | 23 | 72.1 Ų | 72.1 | 14% | 0.139 | 37% | 0.374 | C | S | . | . | trans | -82.9 | 127.3 | 179.7 | -178.5 | 0 | 0 | 0 | 0 | 108.5 | L59 E62 E68 I69 | L59-V64 HydrophobicContact CD2-CB 4.43Å; L59-V64 HydrophobicContact CD2-CG1 4.37Å; L59-V64 HydrophobicContact CD2-CG2 3.9Å; E62-V64 HydrophobicContact CB-CG2 4.1Å; E62-V64 WeakPolarHBondContact O-CG2 3.24Å; E62-V64 PolarHBondContact O-N 3.41Å; V64-E68 HydrophobicContact CG1-CB 3.39Å; V64-E68 HydrophobicContact CG1-CG 4.47Å; V64-E68 WeakPolarHBondContact CG1-OE2 3.14Å; V64-I69 HydrophobicContact CB-CG1 4.13Å; V64-I69 HydrophobicContact CG1-CG1 3.62Å | ||
| 65 | S | 75.3 | Confident | 65.3 | Low | 35 Ų | 35 | 72.4 Ų | 72.4 | 25% | 0.245 | 38% | 0.379 | C | S | . | . | trans | -62.6 | 147.7 | 177.3 | 64.9 | 0 | 0 | 0 | 0 | 110.8 | S67 E68 I69 | S65-S67 PolarHBondContact O-N 3.06Å; S65-S67 VanDerWaalsContact O-N 3.1Å; S65-S67 PolarHBondContact OG-OG 3.42Å; S65-E68 WeakPolarHBondContact O-CB 3.26Å; S65-E68 PolarHBondContact O-N 3.34Å; S65-E68 WeakPolarHBondContact OG-CG 3.31Å; S65-E68 PolarHBondContact OG-N 3.43Å; S65-E68 PolarHBondContact OG-OE1 2.95Å; S65-I69 PolarHBondContact O-N 2.9Å; S65-I69 VanDerWaalsContact O-N 3.09Å | ||
| 66 | P | 74.4 | Confident | 66.6 | Low | 75 Ų | 75 | 68.7 Ų | 68.7 | 49% | 0.487 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -51.9 | -35.8 | 177.2 | -29.8 | 36.1 | 0 | 0 | 0 | 113.4 | I69 V70 Y138 | P66-I69 PolarHBondContact O-N 3.27Å; P66-V70 WeakPolarHBondContact O-CG2 3.41Å; P66-V70 PolarHBondContact O-N 2.95Å; P66-V70 VanDerWaalsContact O-N 3.11Å; P66-Y138 HydrophobicContact CB-CD1 3.77Å; P66-Y138 HydrophobicContact CB-CE1 3.91Å; P66-Y138 HydrophobicContact CG-CD1 4.46Å; P66-Y138 HydrophobicContact CG-CE1 4.12Å |
| 67 | S | 76.7 | Confident | 68.1 | Low | 74 Ų | 74 | 67.9 Ų | 67.9 | 52% | 0.517 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 174.3 | 42.4 | 0 | 0 | 0 | 0 | 113.1 | S65 V70 D71 | S65-S67 PolarHBondContact O-N 3.06Å; S65-S67 VanDerWaalsContact O-N 3.1Å; S65-S67 PolarHBondContact OG-OG 3.42Å; S67-V70 PolarHBondContact O-N 3.49Å; S67-D71 PolarHBondContact O-N 3.46Å |
| 68 | E | 77.1 | Confident | 69.8 | Low | 91 Ų | 91 | 65.1 Ų | 65.1 | 43% | 0.425 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -69.6 | -35.5 | 178.3 | -76.8 | 160.8 | -134.8 | 0 | 0 | 112.1 | V64 S65 V70 D71 K72 | V64-E68 HydrophobicContact CG1-CB 3.39Å; V64-E68 HydrophobicContact CG1-CG 4.47Å; V64-E68 WeakPolarHBondContact CG1-OE2 3.14Å; S65-E68 WeakPolarHBondContact O-CB 3.26Å; S65-E68 PolarHBondContact O-N 3.34Å; S65-E68 WeakPolarHBondContact OG-CG 3.31Å; S65-E68 PolarHBondContact OG-N 3.43Å; S65-E68 PolarHBondContact OG-OE1 2.95Å; E68-V70 VanDerWaalsContact C-N 3.31Å; E68-D71 PolarHBondContact O-N 3.48Å; E68-K72 WeakPolarHBondContact O-CB 3.28Å; E68-K72 VanDerWaalsContact O-CG 3.29Å; E68-K72 WeakPolarHBondContact O-CG 3.36Å; E68-K72 PolarHBondContact O-N 2.89Å |
| 69 | I | 76.3 | Confident | 71.4 | Confident | 26 Ų | 26 | 61.5 Ų | 61.5 | 13% | 0.133 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.2 | -46.3 | 173.1 | -63.2 | 177.3 | 0 | 0 | 0 | 109.6 | V64 S65 P66 K72 L73 F131 A135 Y138 | V64-I69 HydrophobicContact CB-CG1 4.13Å; V64-I69 HydrophobicContact CG1-CG1 3.62Å; S65-I69 PolarHBondContact O-N 2.9Å; S65-I69 VanDerWaalsContact O-N 3.09Å; P66-I69 PolarHBondContact O-N 3.27Å; I69-K72 PolarHBondContact O-N 3.25Å; I69-L73 WeakPolarHBondContact O-CB 3.45Å; I69-L73 PolarHBondContact O-N 2.92Å; I69-F131 HydrophobicContact CG2-CE2 4.13Å; I69-F131 HydrophobicContact CG2-CZ 4.42Å; I69-A135 HydrophobicContact CG2-CB 3.51Å; I69-Y138 HydrophobicContact CD1-CD2 4.4Å; I69-Y138 HydrophobicContact CD1-CE2 3.97Å; I69-Y138 HydrophobicContact CG2-CD2 4.04Å; I69-Y138 HydrophobicContact CG2-CE2 4.5Å |
| 70 | V | 81.5 | Confident | 72.8 | Confident | 7 Ų | 7 | 60 Ų | 60 | 4% | 0.042 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -68.5 | -39.2 | 179.7 | 178 | 0 | 0 | 0 | 0 | 111.9 | P66 S67 E68 K72 L73 K74 L139 E142 | P66-V70 WeakPolarHBondContact O-CG2 3.41Å; P66-V70 PolarHBondContact O-N 2.95Å; P66-V70 VanDerWaalsContact O-N 3.11Å; S67-V70 PolarHBondContact O-N 3.49Å; E68-V70 VanDerWaalsContact C-N 3.31Å; V70-K72 PolarHBondContact O-N 3.47Å; V70-L73 WeakPolarHBondContact O-CB 3.31Å; V70-L73 PolarHBondContact O-N 2.61Å; V70-K74 HydrophobicContact CG1-CD 4.01Å; V70-K74 VanDerWaalsContact CG1-CE 3.47Å; V70-K74 HydrophobicContact CG1-CG 4.23Å; V70-K74 VanDerWaalsContact O-CG 3.3Å; V70-K74 WeakPolarHBondContact O-CG 3.23Å; V70-K74 PolarHBondContact O-N 2.85Å; V70-L139 HydrophobicContact CG1-CB 4.36Å; V70-L139 HydrophobicContact CG1-CD1 3.83Å; V70-E142 WeakPolarHBondContact CG1-OE2 3.35Å |
| 71 | D | 80.3 | Confident | 74.3 | Confident | 60 Ų | 60 | 53.2 Ų | 53.2 | 32% | 0.321 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.2 | -43.2 | 173.7 | -85.6 | -33 | 0 | 0 | 0 | 112.1 | S67 E68 L73 K74 G75 Y158 | S67-D71 PolarHBondContact O-N 3.46Å; E68-D71 PolarHBondContact O-N 3.48Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 3.48Å; D71-K74 PolarHBondContact O-N 3.47Å; D71-G75 PolarHBondContact O-N 3.17Å; D71-Y158 VanDerWaalsContact CG-OH 3.27Å; D71-Y158 PolarHBondContact OD1-OH 2.88Å |
| 72 | K | 78.5 | Confident | 75.5 | Confident | 71 Ų | 71 | 42.7 Ų | 42.7 | 31% | 0.309 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -62.6 | -39.9 | 174.3 | -72.6 | 178.3 | -172.6 | 176.8 | 0 | 111.5 | L59 E68 I69 V70 G75 L76 F131 | L59-K72 HydrophobicContact CD1-CD 3.83Å; L59-K72 HydrophobicContact CD2-CD 4.02Å; L59-K72 HydrophobicContact CG-CD 4.29Å; E68-K72 WeakPolarHBondContact O-CB 3.28Å; E68-K72 VanDerWaalsContact O-CG 3.29Å; E68-K72 WeakPolarHBondContact O-CG 3.36Å; E68-K72 PolarHBondContact O-N 2.89Å; I69-K72 PolarHBondContact O-N 3.25Å; V70-K72 PolarHBondContact O-N 3.47Å; K72-G75 PolarHBondContact O-N 2.9Å; K72-L76 PolarHBondContact O-N 2.94Å; K72-F131 HydrophobicContact CB-CZ 3.9Å |
| 73 | L | 83.4 | Confident | 76.6 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65 | -46 | 176.2 | -178.4 | 63.2 | 0 | 0 | 0 | 112.1 | I69 V70 D71 G75 L76 F77 F131 L132 A135 L139 | I69-L73 WeakPolarHBondContact O-CB 3.45Å; I69-L73 PolarHBondContact O-N 2.92Å; V70-L73 WeakPolarHBondContact O-CB 3.31Å; V70-L73 PolarHBondContact O-N 2.61Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 3.48Å; L73-G75 VanDerWaalsContact C-N 3.29Å; L73-G75 PolarHBondContact O-N 2.86Å; L73-L76 WeakPolarHBondContact O-CB 3.44Å; L73-L76 PolarHBondContact O-N 3.5Å; L73-F77 HydrophobicContact CD1-CD1 4.07Å; L73-F77 HydrophobicContact CD1-CE1 3.49Å; L73-F77 VanDerWaalsContact CD1-CE1 3.49Å; L73-F77 HydrophobicContact CD1-CZ 3.8Å; L73-F77 HydrophobicContact CD2-CZ 4.33Å; L73-F77 HydrophobicContact CG-CD1 4.5Å; L73-F77 HydrophobicContact CG-CE1 4.09Å; L73-F77 HydrophobicContact CG-CE2 4.37Å; L73-F77 HydrophobicContact CG-CZ 4.03Å; L73-F77 WeakPolarHBondContact O-CG 3.31Å; L73-F77 PolarHBondContact O-N 3.19Å; L73-F131 HydrophobicContact CB-CE1 4.17Å; L73-F131 HydrophobicContact CB-CZ 4.27Å; L73-F131 HydrophobicContact CD1-CE1 4.07Å; L73-L132 HydrophobicContact CD1-CD2 3.61Å; L73-A135 HydrophobicContact CB-CB 4.17Å; L73-A135 HydrophobicContact CD1-CB 4.24Å; L73-A135 HydrophobicContact CD2-CB 3.9Å; L73-A135 HydrophobicContact CG-CB 4.34Å; L73-L139 HydrophobicContact CD2-CB 3.75Å; L73-L139 HydrophobicContact CD2-CD2 3.61Å; L73-L139 HydrophobicContact CD2-CG 4.32Å; L73-L139 HydrophobicContact CG-CD2 4.28Å |
| 74 | K | 81.3 | Confident | 77.7 | Confident | 14 Ų | 14 | 26.5 Ų | 26.5 | 6% | 0.061 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63.2 | -37.9 | 176.3 | -65.7 | 166.7 | 175.5 | 165.4 | 0 | 111.2 | V70 D71 F77 G78 L139 E142 I154 Y158 | V70-K74 HydrophobicContact CG1-CD 4.01Å; V70-K74 VanDerWaalsContact CG1-CE 3.47Å; V70-K74 HydrophobicContact CG1-CG 4.23Å; V70-K74 VanDerWaalsContact O-CG 3.3Å; V70-K74 WeakPolarHBondContact O-CG 3.23Å; V70-K74 PolarHBondContact O-N 2.85Å; D71-K74 PolarHBondContact O-N 3.47Å; K74-F77 PolarHBondContact O-N 3.07Å; K74-G78 PolarHBondContact O-N 2.77Å; K74-L139 HydrophobicContact CG-CD1 4.46Å; K74-E142 WeakPolarHBondContact CE-OE2 3.33Å; K74-E142 IonicContact NZ-OE1 3.81Å; K74-E142 PolarHBondContact NZ-OE1 3.11Å; K74-E142 IonicContact NZ-OE2 2.84Å; K74-E142 PolarHBondContact NZ-OE2 2.8Å; K74-I154 WeakPolarHBondContact CD-O 3.34Å; K74-I154 WeakPolarHBondContact CE-O 3.38Å; K74-Y158 HydrophobicContact CB-CD2 3.35Å; K74-Y158 HydrophobicContact CB-CE2 3.73Å; K74-Y158 HydrophobicContact CB-CG 4.31Å; K74-Y158 HydrophobicContact CD-CD2 4.19Å; K74-Y158 HydrophobicContact CD-CE2 3.96Å; K74-Y158 HydrophobicContact CG-CD2 4.38Å |
| 75 | G | 79.5 | Confident | 78 | Confident | 17 Ų | 17 | 27 Ų | 27 | 18% | 0.175 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.5 | -42.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | D71 K72 L73 G78 T79 | D71-G75 PolarHBondContact O-N 3.17Å; K72-G75 PolarHBondContact O-N 2.9Å; L73-G75 VanDerWaalsContact C-N 3.29Å; L73-G75 PolarHBondContact O-N 2.86Å; G75-G78 PolarHBondContact O-N 3.36Å; G75-T79 PolarHBondContact O-N 3.21Å; G75-T79 PolarHBondContact O-OG1 3.42Å |
| 76 | L | 81.4 | Confident | 77.9 | Confident | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.005 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.4 | -46.4 | 172.8 | 177.9 | 64.9 | 0 | 0 | 0 | 111.3 | L54 L56 K72 L73 G78 T79 L80 T128 F131 L132 | L54-L76 HydrophobicContact CD2-CD1 4.14Å; L56-L76 HydrophobicContact CD1-CD2 4.31Å; K72-L76 PolarHBondContact O-N 2.94Å; L73-L76 WeakPolarHBondContact O-CB 3.44Å; L73-L76 PolarHBondContact O-N 3.5Å; L76-G78 PolarHBondContact O-N 3.46Å; L76-T79 WeakPolarHBondContact O-CB 3.1Å; L76-T79 PolarHBondContact O-N 2.89Å; L76-L80 HydrophobicContact CD1-CG 4.4Å; L76-L80 HydrophobicContact CG-CD1 4.25Å; L76-L80 WeakPolarHBondContact O-CG 3.24Å; L76-L80 PolarHBondContact O-N 3.48Å; L76-T128 HydrophobicContact CD1-CG2 4.49Å; L76-T128 HydrophobicContact CD2-CG2 3.9Å; L76-F131 HydrophobicContact CD2-CD1 4.28Å; L76-F131 HydrophobicContact CD2-CE1 4.36Å; L76-L132 HydrophobicContact CD2-CD2 3.98Å; L76-L132 HydrophobicContact CD2-CG 4.46Å |
| 77 | F | 85.1 | Confident | 77.7 | Confident | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.7 | -41.4 | 177.8 | -75.2 | 6.3 | 0 | 0 | 0 | 112.6 | L73 K74 T79 L80 C81 L99 L102 V103 L132 L139 I155 | L73-F77 HydrophobicContact CD1-CD1 4.07Å; L73-F77 HydrophobicContact CD1-CE1 3.49Å; L73-F77 VanDerWaalsContact CD1-CE1 3.49Å; L73-F77 HydrophobicContact CD1-CZ 3.8Å; L73-F77 HydrophobicContact CD2-CZ 4.33Å; L73-F77 HydrophobicContact CG-CD1 4.5Å; L73-F77 HydrophobicContact CG-CE1 4.09Å; L73-F77 HydrophobicContact CG-CE2 4.37Å; L73-F77 HydrophobicContact CG-CZ 4.03Å; L73-F77 WeakPolarHBondContact O-CG 3.31Å; L73-F77 PolarHBondContact O-N 3.19Å; K74-F77 PolarHBondContact O-N 3.07Å; F77-T79 VanDerWaalsContact C-N 3.32Å; F77-T79 PolarHBondContact O-N 3Å; F77-L80 PolarHBondContact O-N 3.29Å; F77-C81 WeakPolarHBondContact O-CB 3.39Å; F77-C81 PolarHBondContact O-N 3.3Å; F77-C81 PolarHBondContact O-SG 3.1Å; F77-L99 HydrophobicContact CB-CD1 3.88Å; F77-L99 HydrophobicContact CD1-CD1 4.11Å; F77-L99 HydrophobicContact CD1-CD2 3.63Å; F77-L99 HydrophobicContact CD1-CG 4.4Å; F77-L99 HydrophobicContact CD2-CB 4.45Å; F77-L99 HydrophobicContact CD2-CD1 4.38Å; F77-L99 HydrophobicContact CE1-CD2 3.58Å; F77-L99 HydrophobicContact CE2-CB 4.45Å; F77-L99 HydrophobicContact CG-CD1 3.88Å; F77-L99 HydrophobicContact CG-CD2 4.14Å; F77-L99 HydrophobicContact CG-CG 4.45Å; F77-L99 HydrophobicContact CZ-CD2 4.05Å; F77-L102 HydrophobicContact CE1-CD2 4.31Å; F77-L102 HydrophobicContact CZ-CD2 4Å; F77-V103 HydrophobicContact CE2-CG2 3.64Å; F77-V103 HydrophobicContact CZ-CG2 4.13Å; F77-L132 HydrophobicContact CE1-CD2 3.96Å; F77-L139 HydrophobicContact CD2-CD2 4.36Å; F77-L139 HydrophobicContact CE2-CD2 3.67Å; F77-L139 HydrophobicContact CZ-CD2 4.38Å; F77-I155 HydrophobicContact CD2-CG2 3.64Å; F77-I155 HydrophobicContact CE2-CG2 4.02Å |
| 78 | G | 80.1 | Confident | 77.3 | Confident | 1 Ų | 1 | 29.5 Ų | 29.5 | 1% | 0.01 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -59.5 | -43.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | K74 G75 L76 C81 A82 | K74-G78 PolarHBondContact O-N 2.77Å; G75-G78 PolarHBondContact O-N 3.36Å; L76-G78 PolarHBondContact O-N 3.46Å; G78-C81 PolarHBondContact O-N 2.91Å; G78-A82 WeakPolarHBondContact O-CB 3.36Å; G78-A82 PolarHBondContact O-N 3.01Å |
| 79 | T | 76.9 | Confident | 77 | Confident | 25 Ų | 25 | 29.6 Ų | 29.6 | 15% | 0.153 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -63.4 | -49.2 | 176.8 | -56.4 | 0 | 0 | 0 | 0 | 111.3 | A50 G75 L76 F77 C81 A82 L83 | A50-T79 HydrophobicContact CB-CG2 3.86Å; G75-T79 PolarHBondContact O-N 3.21Å; G75-T79 PolarHBondContact O-OG1 3.42Å; L76-T79 WeakPolarHBondContact O-CB 3.1Å; L76-T79 PolarHBondContact O-N 2.89Å; F77-T79 VanDerWaalsContact C-N 3.32Å; F77-T79 PolarHBondContact O-N 3Å; T79-C81 VanDerWaalsContact C-N 3.33Å; T79-C81 PolarHBondContact O-N 3.43Å; T79-A82 PolarHBondContact O-N 2.72Å; T79-A82 VanDerWaalsContact O-N 3.14Å; T79-L83 HydrophobicContact CG2-CD1 4.26Å; T79-L83 HydrophobicContact CG2-CG 4.39Å; T79-L83 VanDerWaalsContact O-CG 3.31Å; T79-L83 WeakPolarHBondContact O-CG 3.41Å; T79-L83 PolarHBondContact O-N 2.92Å |
| 80 | L | 78.6 | Confident | 76.6 | Confident | 4 Ų | 4 | 32.7 Ų | 32.7 | 2% | 0.021 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.4 | -42.6 | 177.7 | -71.7 | 175 | 0 | 0 | 0 | 112.1 | L54 L76 F77 A82 L83 A84 M95 L99 L116 L122 | L54-L80 HydrophobicContact CD2-CD2 4.28Å; L76-L80 HydrophobicContact CD1-CG 4.4Å; L76-L80 HydrophobicContact CG-CD1 4.25Å; L76-L80 WeakPolarHBondContact O-CG 3.24Å; L76-L80 PolarHBondContact O-N 3.48Å; F77-L80 PolarHBondContact O-N 3.29Å; L80-A82 VanDerWaalsContact C-N 3.35Å; L80-L83 PolarHBondContact O-N 2.83Å; L80-A84 VanDerWaalsContact O-CB 3.32Å; L80-A84 WeakPolarHBondContact O-CB 3.37Å; L80-A84 PolarHBondContact O-N 3.42Å; L80-M95 HydrophobicContact CB-CE 3.83Å; L80-M95 HydrophobicContact CB-CG 4.27Å; L80-M95 HydrophobicContact CB-SD 3.73Å; L80-M95 HydrophobicContact CD1-SD 4.43Å; L80-M95 HydrophobicContact CD2-CE 4.34Å; L80-L99 HydrophobicContact CD1-CD2 4.16Å; L80-L116 HydrophobicContact CD1-CD1 4.43Å; L80-L122 HydrophobicContact CD2-CD2 3.62Å |
| 81 | C | 79.3 | Confident | 76.1 | Confident | 2 Ų | 2 | 35.7 Ų | 35.7 | 1% | 0.014 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.4 | -38.1 | 175.4 | -70.8 | 0 | 0 | 0 | 0 | 112.7 | F77 G78 T79 A85 S92 M95 A159 | F77-C81 WeakPolarHBondContact O-CB 3.39Å; F77-C81 PolarHBondContact O-N 3.3Å; F77-C81 PolarHBondContact O-SG 3.1Å; G78-C81 PolarHBondContact O-N 2.91Å; T79-C81 VanDerWaalsContact C-N 3.33Å; T79-C81 PolarHBondContact O-N 3.43Å; C81-A85 VanDerWaalsContact O-CB 3.31Å; C81-A85 WeakPolarHBondContact O-CB 3.28Å; C81-A85 PolarHBondContact O-N 2.85Å; C81-S92 PolarHBondContact O-OG 2.72Å; C81-M95 HydrophobicContact CB-CG 4.5Å; C81-A159 HydrophobicContact CB-CB 4.37Å |
| 82 | A | 72 | Confident | 75.7 | Confident | 12 Ų | 12 | 33.2 Ų | 33.2 | 10% | 0.099 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -68.4 | -42.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | G78 T79 L80 A84 A85 Q86 A162 | G78-A82 WeakPolarHBondContact O-CB 3.36Å; G78-A82 PolarHBondContact O-N 3.01Å; T79-A82 PolarHBondContact O-N 2.72Å; T79-A82 VanDerWaalsContact O-N 3.14Å; L80-A82 VanDerWaalsContact C-N 3.35Å; A82-A84 VanDerWaalsContact C-N 3.33Å; A82-A84 PolarHBondContact O-N 3.5Å; A82-A85 PolarHBondContact O-N 3.42Å; A82-Q86 WeakPolarHBondContact O-CG 3.5Å; A82-Q86 PolarHBondContact O-N 3.45Å; A82-A162 HydrophobicContact CB-CB 3.8Å |
| 83 | L | 73.8 | Confident | 75.3 | Confident | 18 Ų | 18 | 33.9 Ų | 33.9 | 9% | 0.094 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.3 | -43 | 174.2 | -68 | 180 | 0 | 0 | 0 | 111.7 | L46 L54 T79 L80 A85 Q86 Q87 L122 | L46-L83 HydrophobicContact CD2-CD1 3.65Å; L46-L83 HydrophobicContact CD2-CD2 3.22Å; L46-L83 HydrophobicContact CD2-CG 4.06Å; L54-L83 HydrophobicContact CD1-CD1 4.47Å; T79-L83 HydrophobicContact CG2-CD1 4.26Å; T79-L83 HydrophobicContact CG2-CG 4.39Å; T79-L83 VanDerWaalsContact O-CG 3.31Å; T79-L83 WeakPolarHBondContact O-CG 3.41Å; T79-L83 PolarHBondContact O-N 2.92Å; L80-L83 PolarHBondContact O-N 2.83Å; L83-A85 VanDerWaalsContact C-N 3.34Å; L83-Q86 PolarHBondContact O-N 2.81Å; L83-Q87 PolarHBondContact O-N 3.3Å; L83-L122 HydrophobicContact CD1-CD2 4.27Å |
| 84 | A | 74.3 | Confident | 74.9 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.4 | -41.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L80 A82 Q86 Q87 S88 K91 M95 I120 | L80-A84 VanDerWaalsContact O-CB 3.32Å; L80-A84 WeakPolarHBondContact O-CB 3.37Å; L80-A84 PolarHBondContact O-N 3.42Å; A82-A84 VanDerWaalsContact C-N 3.33Å; A82-A84 PolarHBondContact O-N 3.5Å; A84-Q86 VanDerWaalsContact C-N 3.34Å; A84-Q86 PolarHBondContact O-N 3.43Å; A84-Q87 PolarHBondContact O-N 2.9Å; A84-S88 PolarHBondContact O-N 3.26Å; A84-K91 HydrophobicContact CB-CB 4.36Å; A84-K91 WeakPolarHBondContact CB-O 3.33Å; A84-M95 HydrophobicContact CB-CB 3.6Å; A84-M95 HydrophobicContact CB-CE 4.28Å; A84-M95 HydrophobicContact CB-CG 4.06Å; A84-I120 HydrophobicContact CB-CD1 3.52Å |
| 85 | A | 73.2 | Confident | 74.8 | Confident | 33 Ų | 33 | 36.4 Ų | 36.4 | 27% | 0.273 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -64.4 | -34.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | C81 A82 L83 Q87 | C81-A85 VanDerWaalsContact O-CB 3.31Å; C81-A85 WeakPolarHBondContact O-CB 3.28Å; C81-A85 PolarHBondContact O-N 2.85Å; A82-A85 PolarHBondContact O-N 3.42Å; L83-A85 VanDerWaalsContact C-N 3.34Å; A85-Q87 VanDerWaalsContact C-N 3.25Å; A85-Q87 PolarHBondContact O-N 3.48Å |
| 86 | Q | 72 | Confident | 74.9 | Confident | 107 Ų | 107 | 38.7 Ų | 38.7 | 50% | 0.5 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -65 | -29.5 | 175 | -73.5 | 175.7 | 17.7 | 0 | 0 | 112.7 | A82 L83 A84 | A82-Q86 WeakPolarHBondContact O-CG 3.5Å; A82-Q86 PolarHBondContact O-N 3.45Å; L83-Q86 PolarHBondContact O-N 2.81Å; A84-Q86 VanDerWaalsContact C-N 3.34Å; A84-Q86 PolarHBondContact O-N 3.43Å |
| 87 | Q | 69.9 | Low | 74.8 | Confident | 95 Ų | 95 | 43.2 Ų | 43.2 | 44% | 0.444 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -81.4 | -51.1 | 176.8 | -65 | -170.1 | 1.9 | 0 | 0 | 111.5 | L83 A84 A85 K91 I120 | L83-Q87 PolarHBondContact O-N 3.3Å; A84-Q87 PolarHBondContact O-N 2.9Å; A85-Q87 VanDerWaalsContact C-N 3.25Å; A85-Q87 PolarHBondContact O-N 3.48Å; Q87-K91 HydrophobicContact CB-CD 3.69Å; Q87-K91 VanDerWaalsContact OE1-CD 3.27Å; Q87-I120 VanDerWaalsContact NE2-CG2 3.31Å; Q87-I120 PolarHBondContact NE2-O 3.45Å |
| 88 | S | 69 | Low | 74.6 | Confident | 36 Ų | 36 | 43.6 Ų | 43.6 | 25% | 0.252 | 23% | 0.23 | S | C | . | . | trans | -164.8 | 153.5 | 170.5 | 69 | 0 | 0 | 0 | 0 | 111.8 | A84 S90 K91 S92 | A84-S88 PolarHBondContact O-N 3.26Å; S88-S90 VanDerWaalsContact C-N 3.27Å; S88-S90 PolarHBondContact O-N 3.23Å; S88-K91 PolarHBondContact O-N 3.27Å; S88-K91 VanDerWaalsContact O-N 3.13Å; S88-K91 WeakPolarHBondContact OG-CB 3.32Å; S88-K91 VanDerWaalsContact OG-CG 3.28Å; S88-K91 WeakPolarHBondContact OG-CG 3.16Å; S88-K91 PolarHBondContact OG-N 2.94Å; S88-K91 VanDerWaalsContact OG-N 3.12Å; S88-S92 PolarHBondContact O-N 3.08Å; S88-S92 VanDerWaalsContact O-N 3.12Å | ||
| 89 | P | 69.9 | Low | 74.8 | Confident | 92 Ų | 92 | 43.5 Ų | 43.5 | 60% | 0.597 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -54.6 | -44.4 | 172.6 | -25.8 | 34.5 | 0 | 0 | 0 | 112 | K91 S92 F93 | P89-K91 VanDerWaalsContact C-N 3.29Å; P89-K91 PolarHBondContact O-N 2.86Å; P89-S92 WeakPolarHBondContact O-CA 3.43Å; P89-S92 VanDerWaalsContact O-CB 3.27Å; P89-S92 WeakPolarHBondContact O-CB 3.22Å; P89-S92 PolarHBondContact O-N 2.8Å; P89-F93 HydrophobicContact CB-CE2 4.38Å; P89-F93 WeakPolarHBondContact O-CD2 3.49Å; P89-F93 PolarHBondContact O-N 3.38Å |
| 90 | S | 68.7 | Low | 75 | Confident | 92 Ų | 92 | 43.7 Ų | 43.7 | 64% | 0.643 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -58.1 | -38.3 | 177.9 | -46.8 | 0 | 0 | 0 | 0 | 112.8 | S88 F93 L94 | S88-S90 VanDerWaalsContact C-N 3.27Å; S88-S90 PolarHBondContact O-N 3.23Å; S90-F93 PolarHBondContact O-N 3.44Å; S90-L94 PolarHBondContact O-N 3.26Å |
| 91 | K | 71.4 | Confident | 75.1 | Confident | 70 Ų | 70 | 47.9 Ų | 47.9 | 30% | 0.304 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -68.8 | -35.6 | 174.5 | -78.6 | 177.9 | 171.7 | -171.2 | 0 | 112.1 | A84 Q87 S88 P89 F93 L94 M95 C119 | A84-K91 HydrophobicContact CB-CB 4.36Å; A84-K91 WeakPolarHBondContact CB-O 3.33Å; Q87-K91 HydrophobicContact CB-CD 3.69Å; Q87-K91 VanDerWaalsContact OE1-CD 3.27Å; S88-K91 PolarHBondContact O-N 3.27Å; S88-K91 VanDerWaalsContact O-N 3.13Å; S88-K91 WeakPolarHBondContact OG-CB 3.32Å; S88-K91 VanDerWaalsContact OG-CG 3.28Å; S88-K91 WeakPolarHBondContact OG-CG 3.16Å; S88-K91 PolarHBondContact OG-N 2.94Å; S88-K91 VanDerWaalsContact OG-N 3.12Å; P89-K91 VanDerWaalsContact C-N 3.29Å; P89-K91 PolarHBondContact O-N 2.86Å; K91-F93 VanDerWaalsContact C-N 3.34Å; K91-L94 PolarHBondContact O-N 2.93Å; K91-M95 WeakPolarHBondContact O-CB 3.4Å; K91-M95 PolarHBondContact O-N 3.12Å; K91-C119 WeakPolarHBondContact CE-O 3.27Å; K91-C119 PolarHBondContact NZ-O 3.38Å |
| 92 | S | 71.6 | Confident | 75.3 | Confident | 7 Ų | 7 | 47.9 Ų | 47.9 | 5% | 0.049 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.4 | -42.8 | 172.8 | -161.4 | 0 | 0 | 0 | 0 | 112.2 | C81 S88 P89 M95 R96 | C81-S92 PolarHBondContact O-OG 2.72Å; S88-S92 PolarHBondContact O-N 3.08Å; S88-S92 VanDerWaalsContact O-N 3.12Å; P89-S92 WeakPolarHBondContact O-CA 3.43Å; P89-S92 VanDerWaalsContact O-CB 3.27Å; P89-S92 WeakPolarHBondContact O-CB 3.22Å; P89-S92 PolarHBondContact O-N 2.8Å; S92-M95 PolarHBondContact O-N 3.31Å; S92-R96 WeakPolarHBondContact O-CG 3.32Å; S92-R96 PolarHBondContact O-N 3.37Å |
| 93 | F | 69.2 | Low | 75.8 | Confident | 85 Ų | 85 | 47.4 Ų | 47.4 | 37% | 0.373 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -62.2 | -46.7 | 174.9 | -72.5 | -70.1 | 0 | 0 | 0 | 112.1 | P89 S90 K91 M95 R96 R97 M275 | P89-F93 HydrophobicContact CB-CE2 4.38Å; P89-F93 WeakPolarHBondContact O-CD2 3.49Å; P89-F93 PolarHBondContact O-N 3.38Å; S90-F93 PolarHBondContact O-N 3.44Å; K91-F93 VanDerWaalsContact C-N 3.34Å; F93-M95 VanDerWaalsContact C-N 3.34Å; F93-M95 PolarHBondContact O-N 3.31Å; F93-R96 PolarHBondContact O-N 3.3Å; F93-R97 PolarHBondContact O-N 3.2Å; F93-M275 HydrophobicContact CE1-CE 3.34Å; F93-M275 HydrophobicContact CE1-SD 3.72Å; F93-M275 HydrophobicContact CZ-CE 3.57Å; F93-M275 HydrophobicContact CZ-SD 3.55Å; F93-M275 VanDerWaalsContact CZ-SD 3.55Å |
| 94 | L | 76 | Confident | 75.9 | Confident | 65 Ų | 65 | 50.6 Ų | 50.6 | 34% | 0.34 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -58.9 | -47.6 | 176.3 | -174.8 | 57.7 | 0 | 0 | 0 | 110.9 | S90 K91 R96 R97 L98 C119 | S90-L94 PolarHBondContact O-N 3.26Å; K91-L94 PolarHBondContact O-N 2.93Å; L94-R96 PolarHBondContact O-N 3.49Å; L94-R97 WeakPolarHBondContact O-CB 3.36Å; L94-R97 PolarHBondContact O-N 3.42Å; L94-R97 VanDerWaalsContact O-N 3.12Å; L94-L98 HydrophobicContact CD1-CG 4.48Å; L94-L98 HydrophobicContact CG-CG 4.48Å; L94-L98 VanDerWaalsContact O-CG 3.31Å; L94-L98 WeakPolarHBondContact O-CG 3.41Å; L94-L98 PolarHBondContact O-N 2.86Å; L94-C119 HydrophobicContact CD2-CB 3.98Å; L94-C119 WeakPolarHBondContact CD2-SG 3.29Å |
| 95 | M | 79.7 | Confident | 75.8 | Confident | 2 Ų | 2 | 56.6 Ų | 56.6 | 1% | 0.01 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -55.4 | -49.4 | 175.8 | 174.9 | 61.5 | 72.6 | 0 | 0 | 112.1 | L80 C81 A84 K91 S92 F93 R97 L98 L99 L116 I120 | L80-M95 HydrophobicContact CB-CE 3.83Å; L80-M95 HydrophobicContact CB-CG 4.27Å; L80-M95 HydrophobicContact CB-SD 3.73Å; L80-M95 HydrophobicContact CD1-SD 4.43Å; L80-M95 HydrophobicContact CD2-CE 4.34Å; C81-M95 HydrophobicContact CB-CG 4.5Å; A84-M95 HydrophobicContact CB-CB 3.6Å; A84-M95 HydrophobicContact CB-CE 4.28Å; A84-M95 HydrophobicContact CB-CG 4.06Å; K91-M95 WeakPolarHBondContact O-CB 3.4Å; K91-M95 PolarHBondContact O-N 3.12Å; S92-M95 PolarHBondContact O-N 3.31Å; F93-M95 VanDerWaalsContact C-N 3.34Å; F93-M95 PolarHBondContact O-N 3.31Å; M95-R97 VanDerWaalsContact C-N 3.29Å; M95-R97 PolarHBondContact O-N 2.85Å; M95-L98 PolarHBondContact O-N 3.29Å; M95-L98 VanDerWaalsContact O-N 3.17Å; M95-L99 HydrophobicContact CG-CD1 3.97Å; M95-L99 HydrophobicContact CG-CG 4.41Å; M95-L99 VanDerWaalsContact O-CG 3.3Å; M95-L99 WeakPolarHBondContact O-CG 3.44Å; M95-L99 PolarHBondContact O-N 3.46Å; M95-L99 HydrophobicContact SD-CD1 3.88Å; M95-L99 HydrophobicContact SD-CD2 4.31Å; M95-L99 HydrophobicContact SD-CG 3.89Å; M95-L116 HydrophobicContact CE-CD2 3.09Å; M95-L116 HydrophobicContact CE-CG 4.49Å; M95-L116 HydrophobicContact SD-CD2 3.58Å; M95-L116 VanDerWaalsContact SD-CD2 3.58Å; M95-I120 HydrophobicContact CE-CD1 3.18Å; M95-I120 HydrophobicContact CE-CG1 4.45Å |
| 96 | R | 80.7 | Confident | 75.5 | Confident | 65 Ų | 65 | 60.4 Ų | 60.4 | 25% | 0.245 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.1 | -43 | 177.1 | -73 | -179.9 | -177.3 | -172.2 | 1.5 | 111.5 | S92 F93 L94 L99 L100 F156 | S92-R96 WeakPolarHBondContact O-CG 3.32Å; S92-R96 PolarHBondContact O-N 3.37Å; F93-R96 PolarHBondContact O-N 3.3Å; L94-R96 PolarHBondContact O-N 3.49Å; R96-L99 PolarHBondContact O-N 3.43Å; R96-L100 WeakPolarHBondContact O-CB 3.38Å; R96-L100 VanDerWaalsContact O-CG 3.3Å; R96-L100 WeakPolarHBondContact O-CG 3.43Å; R96-L100 PolarHBondContact O-N 3.02Å; R96-F156 HydrophobicContact CB-CE1 4.35Å; R96-F156 HydrophobicContact CB-CE2 4.25Å; R96-F156 HydrophobicContact CB-CZ 3.83Å; R96-F156 HydrophobicContact CG-CD1 4.44Å; R96-F156 HydrophobicContact CG-CE1 3.95Å; R96-F156 HydrophobicContact CG-CE2 4.31Å; R96-F156 HydrophobicContact CG-CZ 3.88Å |
| 97 | R | 78.6 | Confident | 75.8 | Confident | 97 Ų | 97 | 56 Ų | 56 | 37% | 0.366 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 175.9 | -176.6 | -177.9 | 177.7 | 155.9 | 8 | 112 | F93 L94 M95 L100 R101 D267 | F93-R97 PolarHBondContact O-N 3.2Å; L94-R97 WeakPolarHBondContact O-CB 3.36Å; L94-R97 PolarHBondContact O-N 3.42Å; L94-R97 VanDerWaalsContact O-N 3.12Å; M95-R97 VanDerWaalsContact C-N 3.29Å; M95-R97 PolarHBondContact O-N 2.85Å; R97-L100 PolarHBondContact O-N 3.39Å; R97-R101 WeakPolarHBondContact O-CG 3.32Å; R97-R101 PolarHBondContact O-N 3.46Å; R97-D267 IonicContact CZ-OD2 2.87Å; R97-D267 IonicContact NH1-OD2 2.61Å; R97-D267 PolarHBondContact NH1-OD2 3.12Å; R97-D267 IonicContact NH2-OD2 3.73Å; R97-D267 PolarHBondContact NH2-OD2 2.95Å |
| 98 | L | 81.7 | Confident | 76.3 | Confident | 7 Ų | 7 | 54.8 Ų | 54.8 | 4% | 0.037 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 178.3 | -66.3 | -172.4 | 0 | 0 | 0 | 111.8 | L94 M95 R101 L102 L112 E115 L116 | L94-L98 HydrophobicContact CD1-CG 4.48Å; L94-L98 HydrophobicContact CG-CG 4.48Å; L94-L98 VanDerWaalsContact O-CG 3.31Å; L94-L98 WeakPolarHBondContact O-CG 3.41Å; L94-L98 PolarHBondContact O-N 2.86Å; M95-L98 PolarHBondContact O-N 3.29Å; M95-L98 VanDerWaalsContact O-N 3.17Å; L98-R101 PolarHBondContact O-N 2.96Å; L98-L102 PolarHBondContact O-N 2.93Å; L98-L112 HydrophobicContact CB-CD1 3.66Å; L98-L112 HydrophobicContact CD1-CD1 4.42Å; L98-E115 HydrophobicContact CD1-CB 3.83Å; L98-E115 HydrophobicContact CD2-CB 4.27Å; L98-E115 WeakPolarHBondContact CD2-OE2 3.44Å; L98-L116 HydrophobicContact CD1-CD2 4.17Å |
| 99 | L | 84.7 | Confident | 76.9 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.9 | -39.4 | 177.2 | -65.3 | 176.3 | 0 | 0 | 0 | 112.1 | F77 L80 M95 R96 L102 V103 L112 F156 | F77-L99 HydrophobicContact CB-CD1 3.88Å; F77-L99 HydrophobicContact CD1-CD1 4.11Å; F77-L99 HydrophobicContact CD1-CD2 3.63Å; F77-L99 HydrophobicContact CD1-CG 4.4Å; F77-L99 HydrophobicContact CD2-CB 4.45Å; F77-L99 HydrophobicContact CD2-CD1 4.38Å; F77-L99 HydrophobicContact CE1-CD2 3.58Å; F77-L99 HydrophobicContact CE2-CB 4.45Å; F77-L99 HydrophobicContact CG-CD1 3.88Å; F77-L99 HydrophobicContact CG-CD2 4.14Å; F77-L99 HydrophobicContact CG-CG 4.45Å; F77-L99 HydrophobicContact CZ-CD2 4.05Å; L80-L99 HydrophobicContact CD1-CD2 4.16Å; M95-L99 HydrophobicContact CG-CD1 3.97Å; M95-L99 HydrophobicContact CG-CG 4.41Å; M95-L99 VanDerWaalsContact O-CG 3.3Å; M95-L99 WeakPolarHBondContact O-CG 3.44Å; M95-L99 PolarHBondContact O-N 3.46Å; M95-L99 HydrophobicContact SD-CD1 3.88Å; M95-L99 HydrophobicContact SD-CD2 4.31Å; M95-L99 HydrophobicContact SD-CG 3.89Å; R96-L99 PolarHBondContact O-N 3.43Å; L99-L102 WeakPolarHBondContact O-CB 3.22Å; L99-L102 PolarHBondContact O-N 3.49Å; L99-V103 WeakPolarHBondContact O-CG2 3.41Å; L99-V103 PolarHBondContact O-N 3.04Å; L99-L112 HydrophobicContact CD2-CD1 4.46Å; L99-L112 HydrophobicContact CD2-CD2 4.08Å; L99-F156 HydrophobicContact CB-CE1 4.27Å; L99-F156 HydrophobicContact CB-CZ 4.19Å; L99-F156 HydrophobicContact CD1-CE1 3.94Å |
| 100 | L | 81.3 | Confident | 77.5 | Confident | 28 Ų | 28 | 52.9 Ų | 52.9 | 15% | 0.147 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.5 | -41.9 | 172.9 | -72.5 | 168.4 | 0 | 0 | 0 | 111.5 | R96 R97 L102 V103 Y104 E152 I155 F156 | R96-L100 WeakPolarHBondContact O-CB 3.38Å; R96-L100 VanDerWaalsContact O-CG 3.3Å; R96-L100 WeakPolarHBondContact O-CG 3.43Å; R96-L100 PolarHBondContact O-N 3.02Å; R97-L100 PolarHBondContact O-N 3.39Å; L100-L102 VanDerWaalsContact C-N 3.28Å; L100-L102 PolarHBondContact O-N 3.47Å; L100-V103 PolarHBondContact O-N 2.94Å; L100-Y104 HydrophobicContact CB-CD2 4.45Å; L100-Y104 HydrophobicContact CD2-CD2 4.48Å; L100-Y104 HydrophobicContact CD2-CE2 3.98Å; L100-Y104 VanDerWaalsContact O-CD2 3.26Å; L100-Y104 WeakPolarHBondContact O-CD2 3.19Å; L100-Y104 PolarHBondContact O-N 2.85Å; L100-E152 HydrophobicContact CD1-CG 4.27Å; L100-E152 HydrophobicContact CD2-CG 3.91Å; L100-I155 HydrophobicContact CD2-CD1 3.77Å; L100-F156 HydrophobicContact CD1-CE2 4.13Å; L100-F156 HydrophobicContact CD2-CE2 3.91Å; L100-F156 HydrophobicContact CD2-CZ 4.45Å; L100-F156 HydrophobicContact CG-CE2 3.84Å; L100-F156 HydrophobicContact CG-CZ 4.09Å |
| 101 | R | 79.8 | Confident | 78.2 | Confident | 92 Ų | 92 | 49.5 Ų | 49.5 | 35% | 0.347 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.4 | -40.1 | 174.9 | -74.5 | 178.1 | 71 | -161.9 | -0.1 | 112.1 | R97 L98 N105 N106 S107 E115 | R97-R101 WeakPolarHBondContact O-CG 3.32Å; R97-R101 PolarHBondContact O-N 3.46Å; L98-R101 PolarHBondContact O-N 2.96Å; R101-N105 PolarHBondContact O-N 3.45Å; R101-N106 HydrophobicContact CB-CB 4.34Å; R101-N106 CarbonylContact O-C 3.58Å; R101-N106 WeakPolarHBondContact O-CA 3.26Å; R101-N106 PolarHBondContact O-N 3.07Å; R101-S107 PolarHBondContact O-N 3.18Å; R101-E115 IonicContact CZ-OE1 2.76Å; R101-E115 IonicContact NH1-OE1 3.13Å; R101-E115 PolarHBondContact NH1-OE1 3.28Å; R101-E115 IonicContact NH1-OE2 2.74Å |
| 102 | L | 83 | Confident | 78.7 | Confident | 2 Ų | 2 | 46.2 Ų | 46.2 | 1% | 0.01 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.3 | -47.8 | 175.5 | -174.9 | 73.1 | 0 | 0 | 0 | 111.4 | F77 L98 L99 L100 N105 P109 L112 L132 I136 | F77-L102 HydrophobicContact CE1-CD2 4.31Å; F77-L102 HydrophobicContact CZ-CD2 4Å; L98-L102 PolarHBondContact O-N 2.93Å; L99-L102 WeakPolarHBondContact O-CB 3.22Å; L99-L102 PolarHBondContact O-N 3.49Å; L100-L102 VanDerWaalsContact C-N 3.28Å; L100-L102 PolarHBondContact O-N 3.47Å; L102-N105 PolarHBondContact O-N 3.38Å; L102-P109 HydrophobicContact CD1-CB 4.45Å; L102-P109 HydrophobicContact CD1-CG 4.09Å; L102-L112 HydrophobicContact CB-CD2 4.36Å; L102-L112 HydrophobicContact CD1-CB 4.2Å; L102-L112 HydrophobicContact CD1-CD2 4.19Å; L102-L112 HydrophobicContact CD2-CD2 3.4Å; L102-L112 HydrophobicContact CG-CD2 4.17Å; L102-L132 HydrophobicContact CD2-CD2 4.23Å; L102-I136 HydrophobicContact CD1-CD1 3.6Å; L102-I136 HydrophobicContact CD2-CD1 3.39Å; L102-I136 HydrophobicContact CD2-CG1 3.88Å; L102-I136 HydrophobicContact CG-CD1 3.48Å; L102-I136 VanDerWaalsContact CG-CD1 3.48Å; L102-I136 HydrophobicContact CG-CG1 4.14Å |
| 103 | V | 82.4 | Confident | 79.2 | Confident | 2 Ų | 2 | 48.1 Ų | 48.1 | 1% | 0.012 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -68 | -40.7 | -177.2 | 175.8 | 0 | 0 | 0 | 0 | 111.7 | F77 L99 L100 N105 L139 Q140 I143 I155 | F77-V103 HydrophobicContact CE2-CG2 3.64Å; F77-V103 HydrophobicContact CZ-CG2 4.13Å; L99-V103 WeakPolarHBondContact O-CG2 3.41Å; L99-V103 PolarHBondContact O-N 3.04Å; L100-V103 PolarHBondContact O-N 2.94Å; V103-N105 PolarHBondContact O-N 3.28Å; V103-N105 VanDerWaalsContact O-N 3.15Å; V103-L139 HydrophobicContact CG1-CD2 4.43Å; V103-L139 HydrophobicContact CG1-CG 4.41Å; V103-L139 HydrophobicContact CG2-CD2 3.66Å; V103-L139 HydrophobicContact CG2-CG 4.47Å; V103-Q140 WeakPolarHBondContact O-CG 3.28Å; V103-Q140 PolarHBondContact O-NE2 2.8Å; V103-I143 HydrophobicContact CG1-CD1 3.31Å; V103-I143 HydrophobicContact CG1-CG1 4.06Å; V103-I155 HydrophobicContact CB-CD1 4.21Å; V103-I155 HydrophobicContact CG1-CD1 3.81Å; V103-I155 HydrophobicContact CG1-CG1 4.43Å; V103-I155 HydrophobicContact CG2-CD1 4.28Å |
| 104 | Y | 77.2 | Confident | 79.7 | Confident | 85 Ų | 85 | 51.4 Ų | 51.4 | 33% | 0.333 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.6 | 16.8 | 177.3 | -72.6 | -74.3 | 0 | 0 | 0 | 114.2 | L100 N106 I143 L148 A151 | L100-Y104 HydrophobicContact CB-CD2 4.45Å; L100-Y104 HydrophobicContact CD2-CD2 4.48Å; L100-Y104 HydrophobicContact CD2-CE2 3.98Å; L100-Y104 VanDerWaalsContact O-CD2 3.26Å; L100-Y104 WeakPolarHBondContact O-CD2 3.19Å; L100-Y104 PolarHBondContact O-N 2.85Å; Y104-N106 PolarHBondContact O-N 3.12Å; Y104-N106 VanDerWaalsContact O-N 3.16Å; Y104-I143 HydrophobicContact CD1-CD1 4.39Å; Y104-I143 HydrophobicContact CE1-CD1 3.95Å; Y104-L148 HydrophobicContact CE2-CD1 3.76Å; Y104-L148 WeakPolarHBondContact OH-CD1 3.49Å; Y104-A151 WeakPolarHBondContact OH-CB 3.19Å |
| 105 | N | 71.3 | Confident | 79.9 | Confident | 127 Ų | 127 | 50.4 Ų | 50.4 | 68% | 0.679 | 24% | 0.236 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 58.8 | 24.9 | 177.6 | -156.3 | 33.6 | 0 | 0 | 0 | 114.7 | R101 L102 V103 | R101-N105 PolarHBondContact O-N 3.45Å; L102-N105 PolarHBondContact O-N 3.38Å; V103-N105 PolarHBondContact O-N 3.28Å; V103-N105 VanDerWaalsContact O-N 3.15Å |
| 106 | N | 67.6 | Low | 79.8 | Confident | 112 Ų | 112 | 50.3 Ų | 50.3 | 60% | 0.599 | 24% | 0.235 | S | C | * | . | S | Bend | trans | -94.5 | 4.8 | 177.3 | -69.2 | -38.7 | 0 | 0 | 0 | 112.5 | R101 Y104 | R101-N106 HydrophobicContact CB-CB 4.34Å; R101-N106 CarbonylContact O-C 3.58Å; R101-N106 WeakPolarHBondContact O-CA 3.26Å; R101-N106 PolarHBondContact O-N 3.07Å; Y104-N106 PolarHBondContact O-N 3.12Å; Y104-N106 VanDerWaalsContact O-N 3.16Å |
| 107 | S | 78 | Confident | 79.6 | Confident | 14 Ų | 14 | 52.1 Ų | 52.1 | 10% | 0.098 | 25% | 0.246 | C | C | . | . | S | Bend | trans | -157.2 | 146.7 | 178.3 | -170.1 | 0 | 0 | 0 | 0 | 109.6 | R101 A111 | R101-S107 PolarHBondContact O-N 3.18Å; S107-A111 VanDerWaalsContact OG-CB 3.28Å; S107-A111 WeakPolarHBondContact OG-CB 3.26Å |
| 108 | T | 81.6 | Confident | 79.5 | Confident | 71 Ų | 71 | 54.8 Ų | 54.8 | 44% | 0.436 | 26% | 0.263 | S | S | . | . | trans | -87.2 | 157.9 | 172.5 | 74.3 | 0 | 0 | 0 | 0 | 110.6 | E110 A111 L112 | T108-E110 VanDerWaalsContact CB-OE2 3.23Å; T108-E110 WeakPolarHBondContact CB-OE2 3.39Å; T108-E110 PolarHBondContact O-N 3.36Å; T108-E110 VanDerWaalsContact O-N 3.17Å; T108-E110 PolarHBondContact OG1-OE2 3.49Å; T108-A111 WeakPolarHBondContact O-CB 3.45Å; T108-A111 PolarHBondContact O-N 3.28Å; T108-A111 PolarHBondContact OG1-N 2.9Å; T108-A111 VanDerWaalsContact OG1-N 3.17Å; T108-L112 PolarHBondContact O-N 2.84Å | ||
| 109 | P | 80.8 | Confident | 78.9 | Confident | 20 Ų | 20 | 56.1 Ų | 56.1 | 13% | 0.13 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -54.2 | -32.8 | 173.4 | -27.9 | 37.2 | 0 | 0 | 0 | 113.4 | L102 H113 L129 L132 K133 I136 | L102-P109 HydrophobicContact CD1-CB 4.45Å; L102-P109 HydrophobicContact CD1-CG 4.09Å; P109-H113 WeakPolarHBondContact O-CB 3.31Å; P109-H113 PolarHBondContact O-N 3Å; P109-L129 VanDerWaalsContact C-CD1 3.48Å; P109-L129 HydrophobicContact CB-CD1 3.72Å; P109-L129 VanDerWaalsContact O-CD1 3.28Å; P109-L129 WeakPolarHBondContact O-CD1 3.25Å; P109-L132 HydrophobicContact CB-CB 4.27Å; P109-K133 HydrophobicContact CB-CG 4.06Å; P109-K133 HydrophobicContact CG-CG 3.78Å; P109-I136 HydrophobicContact CG-CD1 3.71Å |
| 110 | E | 83.2 | Confident | 78.1 | Confident | 68 Ų | 68 | 56.6 Ų | 56.6 | 32% | 0.318 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -70.6 | -38.1 | 174.9 | -59.5 | 83.1 | 176.3 | 0 | 0 | 112.6 | T108 H113 R114 L129 K133 | T108-E110 VanDerWaalsContact CB-OE2 3.23Å; T108-E110 WeakPolarHBondContact CB-OE2 3.39Å; T108-E110 PolarHBondContact O-N 3.36Å; T108-E110 VanDerWaalsContact O-N 3.17Å; T108-E110 PolarHBondContact OG1-OE2 3.49Å; E110-H113 PolarHBondContact O-N 2.82Å; E110-R114 WeakPolarHBondContact O-CG 3.37Å; E110-R114 PolarHBondContact O-N 2.85Å; E110-L129 HydrophobicContact CG-CD2 4.46Å; E110-K133 WeakPolarHBondContact OE1-CE 3.26Å; E110-K133 IonicContact OE1-NZ 2.73Å; E110-K133 PolarHBondContact OE1-NZ 3.45Å |
| 111 | A | 81.9 | Confident | 77.6 | Confident | 21 Ų | 21 | 61.8 Ų | 61.8 | 17% | 0.174 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65.9 | -44.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | S107 T108 H113 R114 E115 | S107-A111 VanDerWaalsContact OG-CB 3.28Å; S107-A111 WeakPolarHBondContact OG-CB 3.26Å; T108-A111 WeakPolarHBondContact O-CB 3.45Å; T108-A111 PolarHBondContact O-N 3.28Å; T108-A111 PolarHBondContact OG1-N 2.9Å; T108-A111 VanDerWaalsContact OG1-N 3.17Å; A111-H113 VanDerWaalsContact C-N 3.34Å; A111-H113 PolarHBondContact O-N 3.14Å; A111-R114 PolarHBondContact O-N 3.43Å; A111-E115 WeakPolarHBondContact O-CG 3.12Å; A111-E115 PolarHBondContact O-N 2.93Å |
| 112 | L | 83.2 | Confident | 77 | Confident | 0 Ų | 0 | 58.2 Ų | 58.2 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -57.6 | -45.7 | 171.9 | 177.9 | 68.5 | 0 | 0 | 0 | 111.4 | L98 L99 L102 T108 R114 E115 L116 L132 | L98-L112 HydrophobicContact CB-CD1 3.66Å; L98-L112 HydrophobicContact CD1-CD1 4.42Å; L99-L112 HydrophobicContact CD2-CD1 4.46Å; L99-L112 HydrophobicContact CD2-CD2 4.08Å; L102-L112 HydrophobicContact CB-CD2 4.36Å; L102-L112 HydrophobicContact CD1-CB 4.2Å; L102-L112 HydrophobicContact CD1-CD2 4.19Å; L102-L112 HydrophobicContact CD2-CD2 3.4Å; L102-L112 HydrophobicContact CG-CD2 4.17Å; T108-L112 PolarHBondContact O-N 2.84Å; L112-R114 VanDerWaalsContact C-N 3.34Å; L112-R114 PolarHBondContact O-N 3.24Å; L112-E115 PolarHBondContact O-N 2.84Å; L112-L116 HydrophobicContact CD1-CD1 3.85Å; L112-L116 HydrophobicContact CD1-CD2 4.35Å; L112-L116 HydrophobicContact CD1-CG 3.84Å; L112-L116 HydrophobicContact CD2-CD1 4.14Å; L112-L116 HydrophobicContact CG-CD1 3.65Å; L112-L116 HydrophobicContact CG-CG 4.03Å; L112-L116 VanDerWaalsContact O-CB 3.28Å; L112-L116 WeakPolarHBondContact O-CB 3.45Å; L112-L116 WeakPolarHBondContact O-CG 3.4Å; L112-L116 PolarHBondContact O-N 2.76Å; L112-L132 HydrophobicContact CD2-CD1 4.23Å |
| 113 | H | 81.4 | Confident | 76.2 | Confident | 47 Ų | 47 | 63 Ų | 63 | 22% | 0.218 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -57.3 | -45.9 | 178.2 | -179.1 | 86.8 | 0 | 0 | 0 | 112.2 | P109 E110 A111 L116 Q117 I124 L129 | P109-H113 WeakPolarHBondContact O-CB 3.31Å; P109-H113 PolarHBondContact O-N 3Å; E110-H113 PolarHBondContact O-N 2.82Å; A111-H113 VanDerWaalsContact C-N 3.34Å; A111-H113 PolarHBondContact O-N 3.14Å; H113-L116 PolarHBondContact O-N 3.21Å; H113-Q117 WeakPolarHBondContact O-CB 3.48Å; H113-Q117 PolarHBondContact O-N 3.14Å; H113-I124 PolarHBondContact CE1-O 3.45Å; H113-I124 VanDerWaalsContact CE1-O 3.26Å; H113-L129 HydrophobicContact CB-CD1 4.12Å |
| 114 | R | 79.5 | Confident | 75.6 | Confident | 155 Ų | 155 | 63.4 Ų | 63.4 | 59% | 0.585 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -63.7 | -45.8 | 176.6 | -72.3 | -174.9 | -69.8 | -169 | 0.6 | 112.1 | E110 A111 L112 L116 Q117 Q118 | E110-R114 WeakPolarHBondContact O-CG 3.37Å; E110-R114 PolarHBondContact O-N 2.85Å; A111-R114 PolarHBondContact O-N 3.43Å; L112-R114 VanDerWaalsContact C-N 3.34Å; L112-R114 PolarHBondContact O-N 3.24Å; R114-L116 VanDerWaalsContact C-N 3.35Å; R114-L116 PolarHBondContact O-N 3.31Å; R114-Q117 PolarHBondContact O-N 2.91Å; R114-Q118 VanDerWaalsContact O-CG 3.3Å; R114-Q118 WeakPolarHBondContact O-CG 3.49Å; R114-Q118 PolarHBondContact O-N 3.48Å |
| 115 | E | 79.4 | Confident | 75.4 | Confident | 44 Ų | 44 | 64.1 Ų | 64.1 | 21% | 0.206 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -64.7 | -38.7 | 178 | -71.4 | 176 | 156.7 | 0 | 0 | 111.1 | L98 R101 A111 L112 Q118 C119 | L98-E115 HydrophobicContact CD1-CB 3.83Å; L98-E115 HydrophobicContact CD2-CB 4.27Å; L98-E115 WeakPolarHBondContact CD2-OE2 3.44Å; R101-E115 IonicContact CZ-OE1 2.76Å; R101-E115 IonicContact NH1-OE1 3.13Å; R101-E115 PolarHBondContact NH1-OE1 3.28Å; R101-E115 IonicContact NH1-OE2 2.74Å; A111-E115 WeakPolarHBondContact O-CG 3.12Å; A111-E115 PolarHBondContact O-N 2.93Å; L112-E115 PolarHBondContact O-N 2.84Å; E115-Q118 PolarHBondContact O-N 2.87Å; E115-C119 VanDerWaalsContact O-CB 3.3Å; E115-C119 WeakPolarHBondContact O-CB 3.49Å; E115-C119 PolarHBondContact O-N 2.93Å; E115-C119 PolarHBondContact O-SG 3.04Å |
| 116 | L | 79 | Confident | 75.4 | Confident | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.9 | -40.3 | 176.7 | -74.2 | -179.8 | 0 | 0 | 0 | 113 | L80 M95 L98 L112 H113 R114 Q118 C119 I120 I124 | L80-L116 HydrophobicContact CD1-CD1 4.43Å; M95-L116 HydrophobicContact CE-CD2 3.09Å; M95-L116 HydrophobicContact CE-CG 4.49Å; M95-L116 HydrophobicContact SD-CD2 3.58Å; M95-L116 VanDerWaalsContact SD-CD2 3.58Å; L98-L116 HydrophobicContact CD1-CD2 4.17Å; L112-L116 HydrophobicContact CD1-CD1 3.85Å; L112-L116 HydrophobicContact CD1-CD2 4.35Å; L112-L116 HydrophobicContact CD1-CG 3.84Å; L112-L116 HydrophobicContact CD2-CD1 4.14Å; L112-L116 HydrophobicContact CG-CD1 3.65Å; L112-L116 HydrophobicContact CG-CG 4.03Å; L112-L116 VanDerWaalsContact O-CB 3.28Å; L112-L116 WeakPolarHBondContact O-CB 3.45Å; L112-L116 WeakPolarHBondContact O-CG 3.4Å; L112-L116 PolarHBondContact O-N 2.76Å; H113-L116 PolarHBondContact O-N 3.21Å; R114-L116 VanDerWaalsContact C-N 3.35Å; R114-L116 PolarHBondContact O-N 3.31Å; L116-Q118 VanDerWaalsContact C-N 3.3Å; L116-Q118 PolarHBondContact O-N 3.22Å; L116-C119 PolarHBondContact O-N 3.16Å; L116-I120 PolarHBondContact O-N 3.33Å; L116-I124 HydrophobicContact CB-CD1 4.07Å; L116-I124 HydrophobicContact CD1-CD1 3.24Å; L116-I124 HydrophobicContact CD1-CG1 4.43Å; L116-I124 HydrophobicContact CG-CD1 4.26Å |
| 117 | Q | 76.9 | Confident | 75.6 | Confident | 102 Ų | 102 | 58.2 Ų | 58.2 | 48% | 0.477 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -62.6 | -40.3 | 173.6 | -169.4 | 175.8 | 3.7 | 0 | 0 | 110.9 | H113 R114 N121 | H113-Q117 WeakPolarHBondContact O-CB 3.48Å; H113-Q117 PolarHBondContact O-N 3.14Å; R114-Q117 PolarHBondContact O-N 2.91Å; Q117-N121 VanDerWaalsContact O-CA 3.3Å; Q117-N121 WeakPolarHBondContact O-CA 3.42Å; Q117-N121 PolarHBondContact O-N 2.82Å; Q117-N121 PolarHBondContact O-OD1 3.44Å |
| 118 | Q | 76.5 | Confident | 75.3 | Confident | 154 Ų | 154 | 57.7 Ų | 57.7 | 72% | 0.72 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -71.6 | -38 | 177.9 | -70.9 | 172.4 | -3.8 | 0 | 0 | 113.3 | R114 E115 L116 | R114-Q118 VanDerWaalsContact O-CG 3.3Å; R114-Q118 WeakPolarHBondContact O-CG 3.49Å; R114-Q118 PolarHBondContact O-N 3.48Å; E115-Q118 PolarHBondContact O-N 2.87Å; L116-Q118 VanDerWaalsContact C-N 3.3Å; L116-Q118 PolarHBondContact O-N 3.22Å |
| 119 | C | 68.1 | Low | 75.2 | Confident | 34 Ų | 34 | 55.8 Ų | 55.8 | 23% | 0.23 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -85.6 | -36.6 | -172 | -66.3 | 0 | 0 | 0 | 0 | 113.9 | K91 L94 E115 L116 | K91-C119 WeakPolarHBondContact CE-O 3.27Å; K91-C119 PolarHBondContact NZ-O 3.38Å; L94-C119 HydrophobicContact CD2-CB 3.98Å; L94-C119 WeakPolarHBondContact CD2-SG 3.29Å; E115-C119 VanDerWaalsContact O-CB 3.3Å; E115-C119 WeakPolarHBondContact O-CB 3.49Å; E115-C119 PolarHBondContact O-N 2.93Å; E115-C119 PolarHBondContact O-SG 3.04Å; L116-C119 PolarHBondContact O-N 3.16Å |
| 120 | I | 68.1 | Low | 74.9 | Confident | 10 Ų | 10 | 59.4 Ų | 59.4 | 5% | 0.051 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -123.7 | -5.1 | -168.4 | -56 | -171.4 | 0 | 0 | 0 | 111.7 | A84 Q87 M95 L116 L122 | A84-I120 HydrophobicContact CB-CD1 3.52Å; Q87-I120 VanDerWaalsContact NE2-CG2 3.31Å; Q87-I120 PolarHBondContact NE2-O 3.45Å; M95-I120 HydrophobicContact CE-CD1 3.18Å; M95-I120 HydrophobicContact CE-CG1 4.45Å; L116-I120 PolarHBondContact O-N 3.33Å; I120-L122 HydrophobicContact CB-CB 4.28Å; I120-L122 HydrophobicContact CG2-CB 4.08Å; I120-L122 PolarHBondContact O-N 2.79Å |
| 121 | N | 70.2 | Confident | 74.7 | Confident | 137 Ų | 137 | 57 Ų | 57 | 73% | 0.733 | 29% | 0.289 | S | S | * | . | trans | 52.4 | 36.8 | -169.5 | -68 | -25.7 | 0 | 0 | 0 | 111.5 | Q117 P123 | Q117-N121 VanDerWaalsContact O-CA 3.3Å; Q117-N121 WeakPolarHBondContact O-CA 3.42Å; Q117-N121 PolarHBondContact O-N 2.82Å; Q117-N121 PolarHBondContact O-OD1 3.44Å; N121-P123 VanDerWaalsContact O-CD 3.26Å; N121-P123 WeakPolarHBondContact O-CD 3.13Å | ||
| 122 | L | 67.2 | Low | 74.7 | Confident | 18 Ų | 18 | 56.1 Ų | 56.1 | 9% | 0.094 | 28% | 0.282 | C | S | . | . | trans | -100 | 104.6 | -179.9 | -171.1 | 72.7 | 0 | 0 | 0 | 109.8 | L46 L54 L80 L83 I120 I124 | L46-L122 HydrophobicContact CD1-CD1 4.43Å; L54-L122 HydrophobicContact CD1-CD1 4.21Å; L54-L122 HydrophobicContact CD1-CD2 4.36Å; L54-L122 HydrophobicContact CD2-CD2 4.33Å; L80-L122 HydrophobicContact CD2-CD2 3.62Å; L83-L122 HydrophobicContact CD1-CD2 4.27Å; I120-L122 HydrophobicContact CB-CB 4.28Å; I120-L122 HydrophobicContact CG2-CB 4.08Å; I120-L122 PolarHBondContact O-N 2.79Å; L122-I124 PolarHBondContact O-N 2.81Å | ||
| 123 | P | 67.9 | Low | 74.6 | Confident | 101 Ų | 101 | 61 Ų | 61 | 66% | 0.656 | 30% | 0.303 | S | S | * | . | P | Polyproline II helix | trans | -71.3 | 116.7 | 170.4 | 29.2 | -32.2 | 0 | 0 | 0 | 108.9 | N121 | N121-P123 VanDerWaalsContact O-CD 3.26Å; N121-P123 WeakPolarHBondContact O-CD 3.13Å |
| 124 | I | 69.2 | Low | 74.5 | Confident | 12 Ų | 12 | 61.5 Ų | 61.5 | 6% | 0.062 | 32% | 0.316 | C | S | . | . | P | Polyproline II helix | trans | -86.9 | 135.4 | 173.9 | -59.4 | 165.4 | 0 | 0 | 0 | 108.6 | H113 L116 L122 T128 | H113-I124 PolarHBondContact CE1-O 3.45Å; H113-I124 VanDerWaalsContact CE1-O 3.26Å; L116-I124 HydrophobicContact CB-CD1 4.07Å; L116-I124 HydrophobicContact CD1-CD1 3.24Å; L116-I124 HydrophobicContact CD1-CG1 4.43Å; L116-I124 HydrophobicContact CG-CD1 4.26Å; L122-I124 PolarHBondContact O-N 2.81Å; I124-T128 VanDerWaalsContact CG2-CB 3.41Å; I124-T128 HydrophobicContact CG2-CG2 3.39Å |
| 125 | H | 71.7 | Confident | 74.7 | Confident | 100 Ų | 100 | 54.1 Ų | 54.1 | 46% | 0.463 | 29% | 0.288 | S | S | . | . | P | Polyproline II helix | trans | -66.5 | 149.2 | 177.3 | -165.3 | -97.3 | 0 | 0 | 0 | 111.6 | L54 S127 T128 L129 | L54-H125 WeakPolarHBondContact O-CB 3.01Å; H125-S127 PolarHBondContact ND1-N 2.62Å; H125-S127 PolarHBondContact ND1-OG 3.29Å; H125-S127 PolarHBondContact O-N 3.48Å; H125-T128 WeakPolarHBondContact O-CB 3.38Å; H125-T128 PolarHBondContact O-N 3.17Å; H125-L129 PolarHBondContact O-N 3.14Å |
| 126 | V | 72.3 | Confident | 74.9 | Confident | 97 Ų | 97 | 52.6 Ų | 52.6 | 59% | 0.588 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -56.3 | -36.8 | -178.8 | 177.9 | 0 | 0 | 0 | 0 | 112 | T128 L129 Q130 | V126-T128 VanDerWaalsContact C-N 3.28Å; V126-T128 PolarHBondContact O-N 3.37Å; V126-L129 WeakPolarHBondContact O-CB 3.3Å; V126-L129 PolarHBondContact O-N 3.18Å; V126-L129 VanDerWaalsContact O-N 3.17Å; V126-Q130 PolarHBondContact O-N 2.82Å |
| 127 | S | 71.3 | Confident | 75 | Confident | 18 Ų | 18 | 55.5 Ų | 55.5 | 13% | 0.126 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.1 | -34 | 175.9 | 58.7 | 0 | 0 | 0 | 0 | 113 | H125 Q130 F131 | H125-S127 PolarHBondContact ND1-N 2.62Å; H125-S127 PolarHBondContact ND1-OG 3.29Å; H125-S127 PolarHBondContact O-N 3.48Å; S127-Q130 PolarHBondContact O-N 3.46Å; S127-F131 WeakPolarHBondContact O-CB 3.29Å; S127-F131 PolarHBondContact O-N 3.13Å |
| 128 | T | 72.8 | Confident | 75.2 | Confident | 2 Ų | 2 | 55.1 Ų | 55.1 | 1% | 0.012 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -72.7 | -33.7 | 176.7 | -63.3 | 0 | 0 | 0 | 0 | 111.2 | L54 L56 L76 I124 H125 V126 F131 L132 | L54-T128 VanDerWaalsContact C-OG1 3.31Å; L54-T128 PolarHBondContact O-OG1 3.2Å; L56-T128 HydrophobicContact CD1-CG2 4.46Å; L76-T128 HydrophobicContact CD1-CG2 4.49Å; L76-T128 HydrophobicContact CD2-CG2 3.9Å; I124-T128 VanDerWaalsContact CG2-CB 3.41Å; I124-T128 HydrophobicContact CG2-CG2 3.39Å; H125-T128 WeakPolarHBondContact O-CB 3.38Å; H125-T128 PolarHBondContact O-N 3.17Å; V126-T128 VanDerWaalsContact C-N 3.28Å; V126-T128 PolarHBondContact O-N 3.37Å; T128-F131 PolarHBondContact O-N 2.83Å; T128-L132 WeakPolarHBondContact O-CB 3.32Å; T128-L132 VanDerWaalsContact O-CG 3.26Å; T128-L132 WeakPolarHBondContact O-CG 3.13Å; T128-L132 PolarHBondContact O-N 3.5Å |
| 129 | L | 77.7 | Confident | 75.5 | Confident | 31 Ų | 31 | 47.8 Ų | 47.8 | 16% | 0.162 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.9 | -43.1 | 171.6 | -174.2 | 71.2 | 0 | 0 | 0 | 111.5 | P109 E110 H113 H125 V126 L132 K133 | P109-L129 VanDerWaalsContact C-CD1 3.48Å; P109-L129 HydrophobicContact CB-CD1 3.72Å; P109-L129 VanDerWaalsContact O-CD1 3.28Å; P109-L129 WeakPolarHBondContact O-CD1 3.25Å; E110-L129 HydrophobicContact CG-CD2 4.46Å; H113-L129 HydrophobicContact CB-CD1 4.12Å; H125-L129 PolarHBondContact O-N 3.14Å; V126-L129 WeakPolarHBondContact O-CB 3.3Å; V126-L129 PolarHBondContact O-N 3.18Å; V126-L129 VanDerWaalsContact O-N 3.17Å; L129-L132 PolarHBondContact O-N 3.41Å; L129-K133 WeakPolarHBondContact O-CG 3.21Å; L129-K133 PolarHBondContact O-N 3Å; L129-K133 VanDerWaalsContact O-N 3.12Å |
| 130 | Q | 74.8 | Confident | 76.1 | Confident | 97 Ų | 97 | 48.6 Ų | 48.6 | 45% | 0.453 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64.5 | -42.5 | 175 | -71.1 | 175.1 | -17.7 | 0 | 0 | 111.7 | E60 V126 S127 L132 K133 A134 | E60-Q130 PolarHBondContact OE1-OE1 2.86Å; V126-Q130 PolarHBondContact O-N 2.82Å; S127-Q130 PolarHBondContact O-N 3.46Å; Q130-L132 PolarHBondContact O-N 3.12Å; Q130-K133 WeakPolarHBondContact O-CB 3.28Å; Q130-K133 PolarHBondContact O-N 2.86Å; Q130-A134 PolarHBondContact O-N 2.88Å; Q130-A134 VanDerWaalsContact O-N 3.07Å |
| 131 | F | 79.4 | Confident | 76.7 | Confident | 16 Ų | 16 | 54.5 Ų | 54.5 | 7% | 0.07 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.7 | -45.6 | 174.2 | 174.9 | -103.2 | 0 | 0 | 0 | 112 | L56 L59 I69 K72 L73 L76 S127 T128 K133 A134 A135 | L56-F131 HydrophobicContact CD1-CB 4.13Å; L56-F131 HydrophobicContact CD1-CD1 3.35Å; L56-F131 HydrophobicContact CD1-CD2 4.41Å; L56-F131 HydrophobicContact CD1-CE1 3.79Å; L56-F131 HydrophobicContact CD1-CG 3.69Å; L56-F131 HydrophobicContact CD1-CZ 4.48Å; L59-F131 HydrophobicContact CD1-CD2 3.62Å; L59-F131 HydrophobicContact CD1-CE2 3.52Å; L59-F131 HydrophobicContact CD1-CG 4.46Å; L59-F131 HydrophobicContact CD1-CZ 4.32Å; L59-F131 HydrophobicContact CD2-CE2 4.29Å; L59-F131 HydrophobicContact CG-CD2 4.49Å; L59-F131 HydrophobicContact CG-CE2 4.45Å; I69-F131 HydrophobicContact CG2-CE2 4.13Å; I69-F131 HydrophobicContact CG2-CZ 4.42Å; K72-F131 HydrophobicContact CB-CZ 3.9Å; L73-F131 HydrophobicContact CB-CE1 4.17Å; L73-F131 HydrophobicContact CB-CZ 4.27Å; L73-F131 HydrophobicContact CD1-CE1 4.07Å; L76-F131 HydrophobicContact CD2-CD1 4.28Å; L76-F131 HydrophobicContact CD2-CE1 4.36Å; S127-F131 WeakPolarHBondContact O-CB 3.29Å; S127-F131 PolarHBondContact O-N 3.13Å; T128-F131 PolarHBondContact O-N 2.83Å; F131-K133 VanDerWaalsContact C-N 3.34Å; F131-K133 PolarHBondContact O-N 3.16Å; F131-A134 PolarHBondContact O-N 3.15Å; F131-A134 VanDerWaalsContact O-N 3.15Å; F131-A135 HydrophobicContact CD1-CB 4.35Å; F131-A135 HydrophobicContact CD2-CB 4.39Å; F131-A135 HydrophobicContact CE1-CB 3.96Å; F131-A135 HydrophobicContact CE2-CB 4Å; F131-A135 HydrophobicContact CZ-CB 3.77Å; F131-A135 WeakPolarHBondContact O-CB 3.47Å; F131-A135 PolarHBondContact O-N 3.29Å |
| 132 | L | 81.9 | Confident | 77.1 | Confident | 4 Ų | 4 | 51.1 Ų | 51.1 | 2% | 0.021 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -56.4 | -48.5 | 176.5 | -75.5 | 172.1 | 0 | 0 | 0 | 110.9 | L73 L76 F77 L102 P109 L112 T128 L129 Q130 A134 A135 I136 | L73-L132 HydrophobicContact CD1-CD2 3.61Å; L76-L132 HydrophobicContact CD2-CD2 3.98Å; L76-L132 HydrophobicContact CD2-CG 4.46Å; F77-L132 HydrophobicContact CE1-CD2 3.96Å; L102-L132 HydrophobicContact CD2-CD2 4.23Å; P109-L132 HydrophobicContact CB-CB 4.27Å; L112-L132 HydrophobicContact CD2-CD1 4.23Å; T128-L132 WeakPolarHBondContact O-CB 3.32Å; T128-L132 VanDerWaalsContact O-CG 3.26Å; T128-L132 WeakPolarHBondContact O-CG 3.13Å; T128-L132 PolarHBondContact O-N 3.5Å; L129-L132 PolarHBondContact O-N 3.41Å; Q130-L132 PolarHBondContact O-N 3.12Å; L132-A134 VanDerWaalsContact C-N 3.28Å; L132-A134 PolarHBondContact O-N 3.39Å; L132-A135 PolarHBondContact O-N 2.82Å; L132-I136 HydrophobicContact CB-CD1 4.08Å; L132-I136 WeakPolarHBondContact O-CB 3.39Å; L132-I136 WeakPolarHBondContact O-CD1 3.3Å; L132-I136 WeakPolarHBondContact O-CG1 3.35Å; L132-I136 PolarHBondContact O-N 2.9Å |
| 133 | K | 81.7 | Confident | 77.6 | Confident | 101 Ų | 101 | 50.8 Ų | 50.8 | 44% | 0.439 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -56.1 | -41.6 | 176.8 | -72.5 | 175.4 | 178 | -167.6 | 0 | 112.9 | P109 E110 L129 Q130 F131 P137 | P109-K133 HydrophobicContact CB-CG 4.06Å; P109-K133 HydrophobicContact CG-CG 3.78Å; E110-K133 WeakPolarHBondContact OE1-CE 3.26Å; E110-K133 IonicContact OE1-NZ 2.73Å; E110-K133 PolarHBondContact OE1-NZ 3.45Å; L129-K133 WeakPolarHBondContact O-CG 3.21Å; L129-K133 PolarHBondContact O-N 3Å; L129-K133 VanDerWaalsContact O-N 3.12Å; Q130-K133 WeakPolarHBondContact O-CB 3.28Å; Q130-K133 PolarHBondContact O-N 2.86Å; F131-K133 VanDerWaalsContact C-N 3.34Å; F131-K133 PolarHBondContact O-N 3.16Å; K133-P137 WeakPolarHBondContact O-CD 3.48Å |
| 134 | A | 79 | Confident | 78 | Confident | 58 Ų | 58 | 50.7 Ų | 50.7 | 48% | 0.479 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -75.6 | -36.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113 | Q130 F131 L132 Y138 | Q130-A134 PolarHBondContact O-N 2.88Å; Q130-A134 VanDerWaalsContact O-N 3.07Å; F131-A134 PolarHBondContact O-N 3.15Å; F131-A134 VanDerWaalsContact O-N 3.15Å; L132-A134 VanDerWaalsContact C-N 3.28Å; L132-A134 PolarHBondContact O-N 3.39Å; A134-Y138 WeakPolarHBondContact O-CD2 3.16Å; A134-Y138 VanDerWaalsContact O-CE2 3.23Å; A134-Y138 WeakPolarHBondContact O-CE2 3.4Å |
| 135 | A | 83.2 | Confident | 77.9 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -87.2 | -33.7 | -170.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | I69 L73 F131 L132 Y138 L139 | I69-A135 HydrophobicContact CG2-CB 3.51Å; L73-A135 HydrophobicContact CB-CB 4.17Å; L73-A135 HydrophobicContact CD1-CB 4.24Å; L73-A135 HydrophobicContact CD2-CB 3.9Å; L73-A135 HydrophobicContact CG-CB 4.34Å; F131-A135 HydrophobicContact CD1-CB 4.35Å; F131-A135 HydrophobicContact CD2-CB 4.39Å; F131-A135 HydrophobicContact CE1-CB 3.96Å; F131-A135 HydrophobicContact CE2-CB 4Å; F131-A135 HydrophobicContact CZ-CB 3.77Å; F131-A135 WeakPolarHBondContact O-CB 3.47Å; F131-A135 PolarHBondContact O-N 3.29Å; L132-A135 PolarHBondContact O-N 2.82Å; A135-Y138 WeakPolarHBondContact O-CB 3.46Å; A135-Y138 PolarHBondContact O-N 3.23Å; A135-Y138 VanDerWaalsContact O-N 3.14Å; A135-L139 PolarHBondContact O-N 3.14Å |
| 136 | I | 83.9 | Confident | 77.8 | Confident | 12 Ų | 12 | 53.2 Ų | 53.2 | 6% | 0.062 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -55.9 | -44.8 | -176.5 | -71.3 | 157.9 | 0 | 0 | 0 | 112.8 | L102 P109 L132 Y138 L139 Q140 | L102-I136 HydrophobicContact CD1-CD1 3.6Å; L102-I136 HydrophobicContact CD2-CD1 3.39Å; L102-I136 HydrophobicContact CD2-CG1 3.88Å; L102-I136 HydrophobicContact CG-CD1 3.48Å; L102-I136 VanDerWaalsContact CG-CD1 3.48Å; L102-I136 HydrophobicContact CG-CG1 4.14Å; P109-I136 HydrophobicContact CG-CD1 3.71Å; L132-I136 HydrophobicContact CB-CD1 4.08Å; L132-I136 WeakPolarHBondContact O-CB 3.39Å; L132-I136 WeakPolarHBondContact O-CD1 3.3Å; L132-I136 WeakPolarHBondContact O-CG1 3.35Å; L132-I136 PolarHBondContact O-N 2.9Å; I136-Y138 PolarHBondContact O-N 3.01Å; I136-L139 PolarHBondContact O-N 3.22Å; I136-L139 VanDerWaalsContact O-N 3.09Å; I136-Q140 HydrophobicContact CG2-CG 4.01Å; I136-Q140 WeakPolarHBondContact O-CG 3.35Å; I136-Q140 PolarHBondContact O-N 3.09Å |
| 137 | P | 82 | Confident | 77.5 | Confident | 62 Ų | 62 | 51.6 Ų | 51.6 | 40% | 0.403 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -57.1 | -36 | 178.8 | -27.2 | 36.3 | 0 | 0 | 0 | 113.3 | K133 Q140 L141 | K133-P137 WeakPolarHBondContact O-CD 3.48Å; P137-Q140 PolarHBondContact O-N 2.88Å; P137-L141 VanDerWaalsContact O-CG 3.32Å; P137-L141 WeakPolarHBondContact O-CG 3.23Å; P137-L141 PolarHBondContact O-N 2.74Å |
| 138 | Y | 81 | Confident | 77 | Confident | 93 Ų | 93 | 55.4 Ų | 55.4 | 37% | 0.365 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -68.3 | -39.6 | 177.3 | -62.7 | -75.3 | 0 | 0 | 0 | 112.3 | P66 I69 A134 A135 I136 L141 E142 | P66-Y138 HydrophobicContact CB-CD1 3.77Å; P66-Y138 HydrophobicContact CB-CE1 3.91Å; P66-Y138 HydrophobicContact CG-CD1 4.46Å; P66-Y138 HydrophobicContact CG-CE1 4.12Å; I69-Y138 HydrophobicContact CD1-CD2 4.4Å; I69-Y138 HydrophobicContact CD1-CE2 3.97Å; I69-Y138 HydrophobicContact CG2-CD2 4.04Å; I69-Y138 HydrophobicContact CG2-CE2 4.5Å; A134-Y138 WeakPolarHBondContact O-CD2 3.16Å; A134-Y138 VanDerWaalsContact O-CE2 3.23Å; A134-Y138 WeakPolarHBondContact O-CE2 3.4Å; A135-Y138 WeakPolarHBondContact O-CB 3.46Å; A135-Y138 PolarHBondContact O-N 3.23Å; A135-Y138 VanDerWaalsContact O-N 3.14Å; I136-Y138 PolarHBondContact O-N 3.01Å; Y138-L141 PolarHBondContact O-N 2.73Å; Y138-E142 PolarHBondContact O-N 2.94Å |
| 139 | L | 81.8 | Confident | 76.6 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -69.5 | -38.4 | 175.8 | 179.1 | 62.7 | 0 | 0 | 0 | 111.6 | V70 L73 K74 F77 V103 A135 I136 L141 E142 I143 I154 I155 | V70-L139 HydrophobicContact CG1-CB 4.36Å; V70-L139 HydrophobicContact CG1-CD1 3.83Å; L73-L139 HydrophobicContact CD2-CB 3.75Å; L73-L139 HydrophobicContact CD2-CD2 3.61Å; L73-L139 HydrophobicContact CD2-CG 4.32Å; L73-L139 HydrophobicContact CG-CD2 4.28Å; K74-L139 HydrophobicContact CG-CD1 4.46Å; F77-L139 HydrophobicContact CD2-CD2 4.36Å; F77-L139 HydrophobicContact CE2-CD2 3.67Å; F77-L139 HydrophobicContact CZ-CD2 4.38Å; V103-L139 HydrophobicContact CG1-CD2 4.43Å; V103-L139 HydrophobicContact CG1-CG 4.41Å; V103-L139 HydrophobicContact CG2-CD2 3.66Å; V103-L139 HydrophobicContact CG2-CG 4.47Å; A135-L139 PolarHBondContact O-N 3.14Å; I136-L139 PolarHBondContact O-N 3.22Å; I136-L139 VanDerWaalsContact O-N 3.09Å; L139-L141 VanDerWaalsContact C-N 3.32Å; L139-L141 PolarHBondContact O-N 3.3Å; L139-E142 PolarHBondContact O-N 3.34Å; L139-E142 VanDerWaalsContact O-N 3.12Å; L139-I143 HydrophobicContact CD1-CG2 4.4Å; L139-I143 WeakPolarHBondContact O-CG1 3.48Å; L139-I143 PolarHBondContact O-N 3.09Å; L139-I154 HydrophobicContact CD1-CG2 4.43Å; L139-I155 HydrophobicContact CD1-CG1 4.38Å; L139-I155 HydrophobicContact CD2-CG1 4.36Å |
| 140 | Q | 81.1 | Confident | 76 | Confident | 52 Ų | 52 | 63.1 Ų | 63.1 | 24% | 0.243 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -59 | -42.4 | 173.7 | -77.4 | 175.1 | -21.5 | 0 | 0 | 111.9 | V103 I136 P137 E142 I143 C144 | V103-Q140 WeakPolarHBondContact O-CG 3.28Å; V103-Q140 PolarHBondContact O-NE2 2.8Å; I136-Q140 HydrophobicContact CG2-CG 4.01Å; I136-Q140 WeakPolarHBondContact O-CG 3.35Å; I136-Q140 PolarHBondContact O-N 3.09Å; P137-Q140 PolarHBondContact O-N 2.88Å; Q140-E142 VanDerWaalsContact C-N 3.32Å; Q140-E142 PolarHBondContact O-N 3Å; Q140-I143 WeakPolarHBondContact O-CG1 3.21Å; Q140-I143 PolarHBondContact O-N 3.02Å; Q140-C144 WeakPolarHBondContact O-CB 3.34Å; Q140-C144 PolarHBondContact O-N 3.06Å |
| 141 | L | 81.4 | Confident | 75.7 | Confident | 133 Ų | 133 | 58.5 Ų | 58.5 | 70% | 0.696 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -62.2 | -38.1 | 173.6 | -73.2 | 166.5 | 0 | 0 | 0 | 112.1 | P137 Y138 L139 | P137-L141 VanDerWaalsContact O-CG 3.32Å; P137-L141 WeakPolarHBondContact O-CG 3.23Å; P137-L141 PolarHBondContact O-N 2.74Å; Y138-L141 PolarHBondContact O-N 2.73Å; L139-L141 VanDerWaalsContact C-N 3.32Å; L139-L141 PolarHBondContact O-N 3.3Å |
| 142 | E | 77.9 | Confident | 75.2 | Confident | 67 Ų | 67 | 60.4 Ų | 60.4 | 31% | 0.313 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -69.8 | -32.3 | 179.3 | -165.4 | -172.8 | 160.7 | 0 | 0 | 113.2 | V70 K74 Y138 L139 Q140 K146 I154 | V70-E142 WeakPolarHBondContact CG1-OE2 3.35Å; K74-E142 WeakPolarHBondContact CE-OE2 3.33Å; K74-E142 IonicContact NZ-OE1 3.81Å; K74-E142 PolarHBondContact NZ-OE1 3.11Å; K74-E142 IonicContact NZ-OE2 2.84Å; K74-E142 PolarHBondContact NZ-OE2 2.8Å; Y138-E142 PolarHBondContact O-N 2.94Å; L139-E142 PolarHBondContact O-N 3.34Å; L139-E142 VanDerWaalsContact O-N 3.12Å; Q140-E142 VanDerWaalsContact C-N 3.32Å; Q140-E142 PolarHBondContact O-N 3Å; E142-K146 WeakPolarHBondContact O-CD 3.33Å; E142-K146 WeakPolarHBondContact O-CE 3.12Å; E142-K146 PolarHBondContact O-NZ 3.42Å; E142-I154 HydrophobicContact CG-CG2 4.43Å; E142-I154 WeakPolarHBondContact OE1-CG2 3.43Å |
| 143 | I | 77.8 | Confident | 74.6 | Confident | 10 Ų | 10 | 64 Ų | 64 | 5% | 0.051 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -93.3 | -12.1 | 180 | 64.6 | 144 | 0 | 0 | 0 | 113.7 | V103 Y104 L139 Q140 G145 K146 A151 I154 I155 | V103-I143 HydrophobicContact CG1-CD1 3.31Å; V103-I143 HydrophobicContact CG1-CG1 4.06Å; Y104-I143 HydrophobicContact CD1-CD1 4.39Å; Y104-I143 HydrophobicContact CE1-CD1 3.95Å; L139-I143 HydrophobicContact CD1-CG2 4.4Å; L139-I143 WeakPolarHBondContact O-CG1 3.48Å; L139-I143 PolarHBondContact O-N 3.09Å; Q140-I143 WeakPolarHBondContact O-CG1 3.21Å; Q140-I143 PolarHBondContact O-N 3.02Å; I143-G145 PolarHBondContact O-N 2.91Å; I143-K146 WeakPolarHBondContact O-CB 3.3Å; I143-K146 PolarHBondContact O-N 3.1Å; I143-A151 HydrophobicContact CB-CB 4.02Å; I143-A151 HydrophobicContact CG2-CB 4.05Å; I143-I154 HydrophobicContact CG2-CB 4.49Å; I143-I154 HydrophobicContact CG2-CG2 4.19Å; I143-I155 HydrophobicContact CG2-CD1 4.4Å; I143-I155 HydrophobicContact CG2-CG1 4.17Å |
| 144 | C | 75.5 | Confident | 74.2 | Confident | 99 Ų | 99 | 60.3 Ų | 60.3 | 67% | 0.669 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | 128.8 | -178.3 | -169.8 | 0 | 0 | 0 | 0 | 110.6 | Q140 K146 | Q140-C144 WeakPolarHBondContact O-CB 3.34Å; Q140-C144 PolarHBondContact O-N 3.06Å; C144-K146 PolarHBondContact O-N 2.93Å |
| 145 | G | 68.3 | Low | 74 | Confident | 83 Ų | 83 | 57.5 Ų | 57.5 | 86% | 0.856 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.4 | -0.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | I143 | I143-G145 PolarHBondContact O-N 2.91Š|
| 146 | K | 69 | Low | 73.6 | Confident | 83 Ų | 83 | 58.4 Ų | 58.4 | 36% | 0.361 | 33% | 0.328 | S | S | . | . | trans | -88 | 143.4 | 175.7 | -62.8 | -176 | 178.7 | 161.5 | 0 | 111 | E142 I143 C144 I150 I154 | E142-K146 WeakPolarHBondContact O-CD 3.33Å; E142-K146 WeakPolarHBondContact O-CE 3.12Å; E142-K146 PolarHBondContact O-NZ 3.42Å; I143-K146 WeakPolarHBondContact O-CB 3.3Å; I143-K146 PolarHBondContact O-N 3.1Å; C144-K146 PolarHBondContact O-N 2.93Å; K146-I150 HydrophobicContact CB-CB 4.44Å; K146-I150 HydrophobicContact CB-CG2 4.3Å; K146-I150 HydrophobicContact CD-CG2 3.98Å; K146-I154 HydrophobicContact CD-CD1 3.33Å; K146-I154 VanDerWaalsContact NZ-CD1 3.26Å | ||
| 147 | P | 65.5 | Low | 72.9 | Confident | 63 Ų | 63 | 60.1 Ų | 60.1 | 41% | 0.409 | 34% | 0.341 | S | S | . | . | trans | -65.4 | 150.3 | 174.4 | 28.9 | -35.4 | 0 | 0 | 0 | 110.9 | H149 I150 A151 | P147-H149 VanDerWaalsContact C-N 3.27Å; P147-H149 VanDerWaalsContact CG-CE1 3.45Å; P147-H149 WeakPolarHBondContact CG-CE1 3.46Å; P147-H149 PolarHBondContact O-N 2.86Å; P147-H149 VanDerWaalsContact O-N 3.1Å; P147-I150 HydrophobicContact CG-CB 4.09Å; P147-I150 HydrophobicContact CG-CD1 3.51Å; P147-I150 HydrophobicContact CG-CG1 3.74Å; P147-I150 PolarHBondContact O-N 2.82Å; P147-A151 PolarHBondContact O-N 2.97Å | ||
| 148 | L | 61.7 | Low | 71.8 | Confident | 98 Ų | 98 | 60.5 Ų | 60.5 | 51% | 0.513 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -50.2 | -42.2 | -171.2 | 179.8 | 62.3 | 0 | 0 | 0 | 113.6 | Y104 I150 A151 E152 | Y104-L148 HydrophobicContact CE2-CD1 3.76Å; Y104-L148 WeakPolarHBondContact OH-CD1 3.49Å; L148-I150 VanDerWaalsContact C-N 3.34Å; L148-I150 PolarHBondContact O-N 2.89Å; L148-A151 PolarHBondContact O-N 3.5Å; L148-E152 HydrophobicContact CD1-CG 4.24Å; L148-E152 HydrophobicContact CG-CG 4.5Å; L148-E152 WeakPolarHBondContact O-CB 3.26Å; L148-E152 WeakPolarHBondContact O-CG 3.44Å; L148-E152 PolarHBondContact O-N 3.37Å |
| 149 | H | 64.2 | Low | 70.5 | Confident | 124 Ų | 124 | 56.2 Ų | 56.2 | 57% | 0.574 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -64.8 | -35.5 | 179.8 | 64.2 | -85.9 | 0 | 0 | 0 | 112.9 | P147 S153 | P147-H149 VanDerWaalsContact C-N 3.27Å; P147-H149 VanDerWaalsContact CG-CE1 3.45Å; P147-H149 WeakPolarHBondContact CG-CE1 3.46Å; P147-H149 PolarHBondContact O-N 2.86Å; P147-H149 VanDerWaalsContact O-N 3.1Å; H149-S153 WeakPolarHBondContact O-CB 3.35Å; H149-S153 PolarHBondContact O-N 3.41Å; H149-S153 VanDerWaalsContact O-N 3.16Å |
| 150 | I | 65.7 | Low | 68.4 | Low | 71 Ų | 71 | 62 Ų | 62 | 36% | 0.364 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -73.6 | -42.8 | 175 | -62.2 | -177.8 | 0 | 0 | 0 | 109.7 | K146 P147 L148 E152 S153 I154 | K146-I150 HydrophobicContact CB-CB 4.44Å; K146-I150 HydrophobicContact CB-CG2 4.3Å; K146-I150 HydrophobicContact CD-CG2 3.98Å; P147-I150 HydrophobicContact CG-CB 4.09Å; P147-I150 HydrophobicContact CG-CD1 3.51Å; P147-I150 HydrophobicContact CG-CG1 3.74Å; P147-I150 PolarHBondContact O-N 2.82Å; L148-I150 VanDerWaalsContact C-N 3.34Å; L148-I150 PolarHBondContact O-N 2.89Å; I150-E152 PolarHBondContact O-N 3.43Å; I150-S153 WeakPolarHBondContact O-CB 3.27Å; I150-S153 PolarHBondContact O-N 3.43Å; I150-I154 HydrophobicContact CG2-CD1 3.82Å; I150-I154 HydrophobicContact CG2-CG1 4.43Å; I150-I154 VanDerWaalsContact O-CG1 3.27Å; I150-I154 WeakPolarHBondContact O-CG1 3.17Å; I150-I154 PolarHBondContact O-N 3.23Å |
| 151 | A | 67.4 | Low | 66.3 | Low | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.3 | -46.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y104 I143 P147 L148 S153 I154 I155 | Y104-A151 WeakPolarHBondContact OH-CB 3.19Å; I143-A151 HydrophobicContact CB-CB 4.02Å; I143-A151 HydrophobicContact CG2-CB 4.05Å; P147-A151 PolarHBondContact O-N 2.97Å; L148-A151 PolarHBondContact O-N 3.5Å; A151-S153 VanDerWaalsContact C-N 3.34Å; A151-S153 PolarHBondContact O-N 2.9Å; A151-I154 WeakPolarHBondContact O-CB 3.37Å; A151-I154 PolarHBondContact O-N 2.83Å; A151-I154 VanDerWaalsContact O-N 3.14Å; A151-I155 WeakPolarHBondContact O-CB 3.48Å; A151-I155 WeakPolarHBondContact O-CD1 3.43Å; A151-I155 WeakPolarHBondContact O-CG1 3.36Å; A151-I155 PolarHBondContact O-N 3.45Å |
| 152 | E | 68.6 | Low | 64.1 | Low | 56 Ų | 56 | 58.2 Ų | 58.2 | 26% | 0.262 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -58.9 | -44.1 | 174.3 | -76.5 | -175.6 | 166.9 | 0 | 0 | 112.1 | L100 L148 I150 I154 I155 F156 | L100-E152 HydrophobicContact CD1-CG 4.27Å; L100-E152 HydrophobicContact CD2-CG 3.91Å; L148-E152 HydrophobicContact CD1-CG 4.24Å; L148-E152 HydrophobicContact CG-CG 4.5Å; L148-E152 WeakPolarHBondContact O-CB 3.26Å; L148-E152 WeakPolarHBondContact O-CG 3.44Å; L148-E152 PolarHBondContact O-N 3.37Å; I150-E152 PolarHBondContact O-N 3.43Å; E152-I154 VanDerWaalsContact C-N 3.27Å; E152-I154 PolarHBondContact O-N 3.22Å; E152-I155 PolarHBondContact O-N 3.49Å; E152-F156 HydrophobicContact CB-CD2 4.5Å; E152-F156 WeakPolarHBondContact O-CB 3.35Å; E152-F156 WeakPolarHBondContact O-CD2 3.3Å; E152-F156 PolarHBondContact O-N 2.84Å |
| 153 | S | 70.8 | Confident | 62 | Low | 78 Ų | 78 | 59.6 Ų | 59.6 | 55% | 0.545 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -61.7 | -35.6 | 176.3 | -171.6 | 0 | 0 | 0 | 0 | 112.3 | H149 I150 A151 S157 | H149-S153 WeakPolarHBondContact O-CB 3.35Å; H149-S153 PolarHBondContact O-N 3.41Å; H149-S153 VanDerWaalsContact O-N 3.16Å; I150-S153 WeakPolarHBondContact O-CB 3.27Å; I150-S153 PolarHBondContact O-N 3.43Å; A151-S153 VanDerWaalsContact C-N 3.34Å; A151-S153 PolarHBondContact O-N 2.9Å; S153-S157 WeakPolarHBondContact O-CA 3.44Å; S153-S157 VanDerWaalsContact O-CB 3.28Å; S153-S157 WeakPolarHBondContact O-CB 3.28Å; S153-S157 PolarHBondContact O-N 2.88Å |
| 154 | I | 73.3 | Confident | 59.7 | Low | 24 Ų | 24 | 64.7 Ų | 64.7 | 12% | 0.123 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -70.3 | -49.6 | 176.8 | -70.8 | 164.6 | 0 | 0 | 0 | 110.5 | K74 L139 E142 I143 K146 I150 A151 E152 F156 S157 | K74-I154 WeakPolarHBondContact CD-O 3.34Å; K74-I154 WeakPolarHBondContact CE-O 3.38Å; L139-I154 HydrophobicContact CD1-CG2 4.43Å; E142-I154 HydrophobicContact CG-CG2 4.43Å; E142-I154 WeakPolarHBondContact OE1-CG2 3.43Å; I143-I154 HydrophobicContact CG2-CB 4.49Å; I143-I154 HydrophobicContact CG2-CG2 4.19Å; K146-I154 HydrophobicContact CD-CD1 3.33Å; K146-I154 VanDerWaalsContact NZ-CD1 3.26Å; I150-I154 HydrophobicContact CG2-CD1 3.82Å; I150-I154 HydrophobicContact CG2-CG1 4.43Å; I150-I154 VanDerWaalsContact O-CG1 3.27Å; I150-I154 WeakPolarHBondContact O-CG1 3.17Å; I150-I154 PolarHBondContact O-N 3.23Å; A151-I154 WeakPolarHBondContact O-CB 3.37Å; A151-I154 PolarHBondContact O-N 2.83Å; A151-I154 VanDerWaalsContact O-N 3.14Å; E152-I154 VanDerWaalsContact C-N 3.27Å; E152-I154 PolarHBondContact O-N 3.22Å; I154-F156 PolarHBondContact O-N 3.33Å; I154-S157 PolarHBondContact O-OG 2.85Å |
| 155 | I | 73.3 | Confident | 57.5 | Low | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -62.9 | -44 | -176.7 | -66.1 | 164.1 | 0 | 0 | 0 | 110.6 | F77 L100 V103 L139 I143 A151 E152 | F77-I155 HydrophobicContact CD2-CG2 3.64Å; F77-I155 HydrophobicContact CE2-CG2 4.02Å; L100-I155 HydrophobicContact CD2-CD1 3.77Å; V103-I155 HydrophobicContact CB-CD1 4.21Å; V103-I155 HydrophobicContact CG1-CD1 3.81Å; V103-I155 HydrophobicContact CG1-CG1 4.43Å; V103-I155 HydrophobicContact CG2-CD1 4.28Å; L139-I155 HydrophobicContact CD1-CG1 4.38Å; L139-I155 HydrophobicContact CD2-CG1 4.36Å; I143-I155 HydrophobicContact CG2-CD1 4.4Å; I143-I155 HydrophobicContact CG2-CG1 4.17Å; A151-I155 WeakPolarHBondContact O-CB 3.48Å; A151-I155 WeakPolarHBondContact O-CD1 3.43Å; A151-I155 WeakPolarHBondContact O-CG1 3.36Å; A151-I155 PolarHBondContact O-N 3.45Å; E152-I155 PolarHBondContact O-N 3.49Å |
| 156 | F | 76.5 | Confident | 55.8 | Low | 19 Ų | 19 | 63.8 Ų | 63.8 | 8% | 0.083 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.9 | 16.6 | -175 | -60 | -60.9 | 0 | 0 | 0 | 113.9 | R96 L99 L100 E152 I154 Y158 A159 | R96-F156 HydrophobicContact CB-CE1 4.35Å; R96-F156 HydrophobicContact CB-CE2 4.25Å; R96-F156 HydrophobicContact CB-CZ 3.83Å; R96-F156 HydrophobicContact CG-CD1 4.44Å; R96-F156 HydrophobicContact CG-CE1 3.95Å; R96-F156 HydrophobicContact CG-CE2 4.31Å; R96-F156 HydrophobicContact CG-CZ 3.88Å; L99-F156 HydrophobicContact CB-CE1 4.27Å; L99-F156 HydrophobicContact CB-CZ 4.19Å; L99-F156 HydrophobicContact CD1-CE1 3.94Å; L100-F156 HydrophobicContact CD1-CE2 4.13Å; L100-F156 HydrophobicContact CD2-CE2 3.91Å; L100-F156 HydrophobicContact CD2-CZ 4.45Å; L100-F156 HydrophobicContact CG-CE2 3.84Å; L100-F156 HydrophobicContact CG-CZ 4.09Å; E152-F156 HydrophobicContact CB-CD2 4.5Å; E152-F156 WeakPolarHBondContact O-CB 3.35Å; E152-F156 WeakPolarHBondContact O-CD2 3.3Å; E152-F156 PolarHBondContact O-N 2.84Å; I154-F156 PolarHBondContact O-N 3.33Å; F156-Y158 PolarHBondContact O-N 3.4Å; F156-Y158 VanDerWaalsContact O-N 3.16Å; F156-A159 HydrophobicContact CB-CB 3.96Å; F156-A159 HydrophobicContact CD1-CB 4.3Å; F156-A159 WeakPolarHBondContact O-CB 3.5Å; F156-A159 PolarHBondContact O-N 2.76Å |
| 157 | S | 67.6 | Low | 53.8 | Low | 47 Ų | 47 | 66.6 Ų | 66.6 | 33% | 0.329 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.4 | -36.9 | 174.8 | 48.8 | 0 | 0 | 0 | 0 | 112.9 | S153 I154 P161 | S153-S157 WeakPolarHBondContact O-CA 3.44Å; S153-S157 VanDerWaalsContact O-CB 3.28Å; S153-S157 WeakPolarHBondContact O-CB 3.28Å; S153-S157 PolarHBondContact O-N 2.88Å; I154-S157 PolarHBondContact O-OG 2.85Å; S157-P161 WeakPolarHBondContact O-CD 3.21Å |
| 158 | Y | 58.6 | Low | 51.9 | Low | 71 Ų | 71 | 72.7 Ų | 72.7 | 28% | 0.278 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.5 | -4.9 | 176.8 | -67.9 | -93.9 | 0 | 0 | 0 | 114.4 | D71 K74 F156 P161 R178 | D71-Y158 VanDerWaalsContact CG-OH 3.27Å; D71-Y158 PolarHBondContact OD1-OH 2.88Å; K74-Y158 HydrophobicContact CB-CD2 3.35Å; K74-Y158 HydrophobicContact CB-CE2 3.73Å; K74-Y158 HydrophobicContact CB-CG 4.31Å; K74-Y158 HydrophobicContact CD-CD2 4.19Å; K74-Y158 HydrophobicContact CD-CE2 3.96Å; K74-Y158 HydrophobicContact CG-CD2 4.38Å; F156-Y158 PolarHBondContact O-N 3.4Å; F156-Y158 VanDerWaalsContact O-N 3.16Å; Y158-P161 WeakPolarHBondContact O-CD 3.49Å; Y158-R178 PolarHBondContact OH-NH2 3.16Å |
| 159 | A | 54 | Low | 50.1 | Low | 2 Ų | 2 | 75.4 Ų | 75.4 | 2% | 0.017 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -81.6 | -25.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | C81 F156 | C81-A159 HydrophobicContact CB-CB 4.37Å; F156-A159 HydrophobicContact CB-CB 3.96Å; F156-A159 HydrophobicContact CD1-CB 4.3Å; F156-A159 WeakPolarHBondContact O-CB 3.5Å; F156-A159 PolarHBondContact O-N 2.76Å |
| 160 | L | 38.8 | Very low | 48.2 | Very low | 122 Ų | 122 | 76.1 Ų | 76.1 | 64% | 0.639 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -66.9 | -43.6 | 176.1 | -88.2 | 139.8 | 0 | 0 | 0 | 113.2 | A162 | L160-A162 VanDerWaalsContact C-N 3.33Å; L160-A162 PolarHBondContact O-N 2.76Å |
| 161 | P | 37.1 | Very low | 46.1 | Very low | 80 Ų | 80 | 80.7 Ų | 80.7 | 52% | 0.519 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -65.8 | -31.1 | 173.8 | -19.8 | 28.9 | 0 | 0 | 0 | 114.1 | S157 Y158 Q163 V164 G165 | S157-P161 WeakPolarHBondContact O-CD 3.21Å; Y158-P161 WeakPolarHBondContact O-CD 3.49Å; P161-Q163 VanDerWaalsContact C-N 3.31Å; P161-Q163 PolarHBondContact O-N 2.71Å; P161-V164 PolarHBondContact O-N 2.89Å; P161-G165 PolarHBondContact O-N 3.49Å |
| 162 | A | 34.5 | Very low | 43.9 | Very low | 26 Ų | 26 | 86.6 Ų | 86.6 | 22% | 0.215 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -74.4 | -19.2 | -174 | 0 | 0 | 0 | 0 | 0 | 113.8 | A82 L160 | A82-A162 HydrophobicContact CB-CB 3.8Å; L160-A162 VanDerWaalsContact C-N 3.33Å; L160-A162 PolarHBondContact O-N 2.76Å |
| 163 | Q | 33.6 | Very low | 41.7 | Very low | 95 Ų | 95 | 89.4 Ų | 89.4 | 44% | 0.444 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -83.7 | -20.9 | 174.2 | -70.6 | -174.2 | -12.1 | 0 | 0 | 113 | P161 | P161-Q163 VanDerWaalsContact C-N 3.31Å; P161-Q163 PolarHBondContact O-N 2.71Å |
| 164 | V | 29.6 | Very low | 39.6 | Very low | 117 Ų | 117 | 92.6 Ų | 92.6 | 71% | 0.709 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -91.7 | -29.5 | -179 | -172.1 | 0 | 0 | 0 | 0 | 111.7 | P161 I166 | P161-V164 PolarHBondContact O-N 2.89Å; V164-I166 PolarHBondContact O-N 3.25Å |
| 165 | G | 29.6 | Very low | 37.2 | Very low | 59 Ų | 59 | 98 Ų | 98 | 61% | 0.608 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -80.7 | -6.9 | -174.7 | 0 | 0 | 0 | 0 | 0 | 117.3 | P161 | P161-G165 PolarHBondContact O-N 3.49Š|
| 166 | I | 33.1 | Very low | 35 | Very low | 104 Ų | 104 | 104.6 Ų | 104.6 | 53% | 0.533 | 58% | 0.579 | S | S | . | * | S | Bend | trans | -108.2 | -14.6 | -175.7 | -52 | -178.1 | 0 | 0 | 0 | 111.8 | V164 K168 | V164-I166 PolarHBondContact O-N 3.25Å; I166-K168 VanDerWaalsContact C-N 3.27Å; I166-K168 PolarHBondContact O-N 2.96Å; I166-K168 VanDerWaalsContact O-N 3.1Å |
| 167 | Q | 26.5 | Very low | 32.5 | Very low | 142 Ų | 142 | 106.3 Ų | 106.3 | 66% | 0.664 | 60% | 0.602 | S | S | * | * | trans | -82 | 76 | 160.4 | -71.3 | -143.7 | 14.3 | 0 | 0 | 109.8 | N169 | Q167-N169 PolarHBondContact O-N 3.49Š| ||
| 168 | K | 26.4 | Very low | 30.5 | Very low | 192 Ų | 192 | 113.7 Ų | 113.7 | 84% | 0.835 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.6 | 79.9 | 160 | -76.7 | -178 | 174.4 | -179 | 0 | 108.6 | I166 | I166-K168 VanDerWaalsContact C-N 3.27Å; I166-K168 PolarHBondContact O-N 2.96Å; I166-K168 VanDerWaalsContact O-N 3.1Å |
| 169 | N | 23 | Very low | 29 | Very low | 155 Ų | 155 | 117 Ų | 117 | 83% | 0.829 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -169 | 17.1 | 163 | -97.3 | -18.6 | 0 | 0 | 0 | 114.6 | Q167 | Q167-N169 PolarHBondContact O-N 3.49Š|
| 170 | L | 24.1 | Very low | 27.7 | Very low | 138 Ų | 138 | 127.9 Ų | 127.9 | 72% | 0.723 | 69% | 0.691 | S | S | * | * | trans | -132.9 | 101.1 | 173.4 | -86.3 | 154.4 | 0 | 0 | 0 | 110.6 | L172 | L170-L172 VanDerWaalsContact C-N 3.33Å; L170-L172 PolarHBondContact O-N 3.42Å | ||
| 171 | N | 21.2 | Very low | 27.2 | Very low | 168 Ų | 168 | 129.7 Ų | 129.7 | 90% | 0.898 | 70% | 0.701 | S | S | * | * | trans | -55 | 91.9 | 162 | -75.7 | -32.2 | 0 | 0 | 0 | 109.4 | ||||
| 172 | L | 22.9 | Very low | 26.8 | Very low | 124 Ų | 124 | 134.1 Ų | 134.1 | 65% | 0.649 | 72% | 0.72 | S | S | * | * | trans | -143.9 | 119.5 | 162.7 | -119.1 | 106.2 | 0 | 0 | 0 | 109.7 | L170 L174 | L170-L172 VanDerWaalsContact C-N 3.33Å; L170-L172 PolarHBondContact O-N 3.42Å; L172-L174 HydrophobicContact CD2-CD1 4.25Å; L172-L174 HydrophobicContact CD2-CG 4.32Å; L172-L174 PolarHBondContact O-N 2.98Å | ||
| 173 | P | 22.3 | Very low | 26.4 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 75% | 0.747 | 75% | 0.751 | S | S | * | * | trans | -81.7 | 108.6 | 174.2 | 32.4 | -26.6 | 0 | 0 | 0 | 107.5 | ||||
| 174 | L | 25.9 | Very low | 26.1 | Very low | 145 Ų | 145 | 143.1 Ų | 143.1 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | trans | -117.3 | 92 | 167.5 | -74.1 | 173.9 | 0 | 0 | 0 | 109.7 | L172 V176 | L172-L174 HydrophobicContact CD2-CD1 4.25Å; L172-L174 HydrophobicContact CD2-CG 4.32Å; L172-L174 PolarHBondContact O-N 2.98Å; L174-V176 PolarHBondContact O-N 3.34Å | ||
| 175 | T | 22.5 | Very low | 25.9 | Very low | 136 Ų | 136 | 143.8 Ų | 143.8 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | -54.7 | 107.6 | 165.7 | -22.1 | 0 | 0 | 0 | 0 | 109.3 | G177 | T175-G177 PolarHBondContact O-N 3.06Š| ||
| 176 | V | 26.8 | Very low | 25.8 | Very low | 139 Ų | 139 | 144.3 Ų | 144.3 | 84% | 0.842 | 78% | 0.784 | S | S | * | * | trans | -95.9 | 86.1 | 161.1 | -175.6 | 0 | 0 | 0 | 0 | 106.6 | L174 R178 | L174-V176 PolarHBondContact O-N 3.34Å; V176-R178 PolarHBondContact O-N 3.35Å | ||
| 177 | G | 24.9 | Very low | 25.6 | Very low | 56 Ų | 56 | 149 Ų | 149 | 58% | 0.577 | 80% | 0.803 | S | S | * | * | trans | -65.9 | 110.5 | 176 | 0 | 0 | 0 | 0 | 0 | 110.7 | T175 T179 | T175-G177 PolarHBondContact O-N 3.06Å; G177-T179 PolarHBondContact O-N 3.25Å; G177-T179 VanDerWaalsContact O-N 3.14Å | ||
| 178 | R | 24.7 | Very low | 25.6 | Very low | 202 Ų | 202 | 153.5 Ų | 153.5 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | trans | -69.9 | 91.7 | 156.2 | -79.1 | 178 | 169.1 | 171.9 | -4.8 | 107.7 | Y158 V176 R180 | Y158-R178 PolarHBondContact OH-NH2 3.16Å; V176-R178 PolarHBondContact O-N 3.35Å; R178-R180 PolarHBondContact O-N 3.1Å | ||
| 179 | T | 28 | Very low | 25.6 | Very low | 140 Ų | 140 | 148.3 Ų | 148.3 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -83.5 | 89.3 | 168.3 | 39.8 | 0 | 0 | 0 | 0 | 109.5 | G177 | G177-T179 PolarHBondContact O-N 3.25Å; G177-T179 VanDerWaalsContact O-N 3.14Å | ||
| 180 | R | 27.3 | Very low | 25.8 | Very low | 230 Ų | 230 | 148.8 Ų | 148.8 | 87% | 0.868 | 80% | 0.802 | S | S | * | * | trans | -64.7 | 131.5 | 156.4 | -92.4 | 178.1 | 172.9 | 165.4 | -2.9 | 108.3 | R178 L182 | R178-R180 PolarHBondContact O-N 3.1Å; R180-L182 PolarHBondContact O-N 3.05Å | ||
| 181 | N | 26.6 | Very low | 26 | Very low | 160 Ų | 160 | 149.2 Ų | 149.2 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | trans | 8.7 | 106.1 | 156.6 | -80 | -36.7 | 0 | 0 | 0 | 116.4 | ||||
| 182 | L | 28.9 | Very low | 26.3 | Very low | 173 Ų | 173 | 148.9 Ų | 148.9 | 91% | 0.906 | 80% | 0.804 | S | S | * | * | trans | -150.2 | 122.3 | 150.5 | -96.4 | 140.9 | 0 | 0 | 0 | 108.3 | R180 Q184 | R180-L182 PolarHBondContact O-N 3.05Å; L182-Q184 PolarHBondContact O-N 3.32Å | ||
| 183 | S | 26 | Very low | 26.6 | Very low | 123 Ų | 123 | 151.5 Ų | 151.5 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | trans | -63.4 | 121.7 | -174.7 | -36.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 184 | Q | 27.8 | Very low | 26.8 | Very low | 187 Ų | 187 | 154.5 Ų | 154.5 | 87% | 0.874 | 82% | 0.821 | S | S | * | * | trans | -154 | 134.4 | 154.9 | -110.7 | 174.7 | 12.7 | 0 | 0 | 110.1 | L182 | L182-Q184 PolarHBondContact O-N 3.32Š| ||
| 185 | P | 26.6 | Very low | 26.9 | Very low | 132 Ų | 132 | 156.5 Ų | 156.5 | 86% | 0.857 | 83% | 0.827 | S | S | * | * | trans | -86.4 | 132.5 | -173.1 | 33.8 | -29.8 | 0 | 0 | 0 | 110.4 | ||||
| 186 | G | 26.6 | Very low | 27.1 | Very low | 70 Ų | 70 | 154.4 Ų | 154.4 | 72% | 0.722 | 81% | 0.814 | S | S | * | * | trans | 120.5 | 80.3 | 165.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 187 | E | 28.3 | Very low | 27.4 | Very low | 201 Ų | 201 | 153.6 Ų | 153.6 | 94% | 0.939 | 81% | 0.812 | S | S | * | * | trans | -167.6 | 132.7 | 136.6 | -108.4 | 165.6 | -175 | 0 | 0 | 109.3 | ||||
| 188 | R | 26.8 | Very low | 27.8 | Very low | 238 Ų | 238 | 156.3 Ų | 156.3 | 90% | 0.898 | 82% | 0.817 | S | S | * | * | trans | -82.5 | 134 | -159.4 | -72.1 | 168.1 | 168.1 | 172 | -4.6 | 111.8 | ||||
| 189 | S | 27.1 | Very low | 28.1 | Very low | 83 Ų | 83 | 151.7 Ų | 151.7 | 58% | 0.58 | 81% | 0.811 | S | S | * | * | trans | 27.5 | 104.4 | 141 | -151.9 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 190 | I | 27.7 | Very low | 28 | Very low | 164 Ų | 164 | 152.1 Ų | 152.1 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -118.4 | 12.6 | 167.7 | -53.1 | 170.3 | 0 | 0 | 0 | 110.8 | ||
| 191 | V | 26.7 | Very low | 28.1 | Very low | 147 Ų | 147 | 144.3 Ų | 144.3 | 89% | 0.891 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -112.3 | 16.6 | -175.8 | -171.3 | 0 | 0 | 0 | 0 | 112 | ||
| 192 | Q | 27.8 | Very low | 28.2 | Very low | 162 Ų | 162 | 140.7 Ų | 140.7 | 76% | 0.757 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -128.9 | 12.8 | -171.2 | -138.3 | 168.3 | 5.1 | 0 | 0 | 116 | ||
| 193 | E | 29.1 | Very low | 28.1 | Very low | 179 Ų | 179 | 138.7 Ų | 138.7 | 84% | 0.836 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -113.7 | 5.2 | -175 | -106.4 | 178.9 | 172.4 | 0 | 0 | 116.3 | ||
| 194 | L | 27.4 | Very low | 28.1 | Very low | 177 Ų | 177 | 137.3 Ų | 137.3 | 93% | 0.927 | 75% | 0.749 | S | S | * | * | trans | -99.5 | 21.5 | -179 | -98.7 | 111.2 | 0 | 0 | 0 | 115.6 | ||||
| 195 | E | 27.4 | Very low | 28.1 | Very low | 188 Ų | 188 | 132.3 Ų | 132.3 | 88% | 0.879 | 73% | 0.731 | S | S | * | * | trans | -103.7 | 20 | 176.3 | -73.2 | -169.5 | 158.2 | 0 | 0 | 114.6 | ||||
| 196 | T | 27 | Very low | 28.1 | Very low | 92 Ų | 92 | 128.8 Ų | 128.8 | 56% | 0.564 | 71% | 0.713 | S | S | * | * | trans | -95.7 | 120.9 | 177.3 | 38.7 | 0 | 0 | 0 | 0 | 113.2 | T198 | T196-T198 PolarHBondContact O-N 3.21Š| ||
| 197 | P | 32.8 | Very low | 28.2 | Very low | 122 Ų | 122 | 128.5 Ų | 128.5 | 79% | 0.792 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | 15.4 | -173.5 | 28.9 | -34.2 | 0 | 0 | 0 | 115.3 | ||
| 198 | T | 33.3 | Very low | 28.1 | Very low | 112 Ų | 112 | 129.2 Ų | 129.2 | 69% | 0.687 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | -6.8 | -172.1 | 14 | 0 | 0 | 0 | 0 | 114.4 | T196 | T196-T198 PolarHBondContact O-N 3.21Š|
| 199 | V | 30.7 | Very low | 28.3 | Very low | 105 Ų | 105 | 123.8 Ų | 123.8 | 64% | 0.636 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -90.9 | -6.3 | -176 | -170.1 | 0 | 0 | 0 | 0 | 113.4 | P202 | V199-P202 WeakPolarHBondContact O-CD 3.35Š|
| 200 | M | 26.9 | Very low | 28.3 | Very low | 149 Ų | 149 | 123.2 Ų | 123.2 | 73% | 0.734 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -83 | -15.3 | 179.9 | -82.8 | -144.7 | -63 | 0 | 0 | 115.8 | T204 | M200-T204 PolarHBondContact O-OG1 2.85Å |
| 201 | A | 28.3 | Very low | 28.3 | Very low | 66 Ų | 66 | 119.2 Ų | 119.2 | 55% | 0.545 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -72.7 | -37.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | T204 T205 | A201-T204 PolarHBondContact O-OG1 3.05Å; A201-T205 PolarHBondContact O-OG1 3.05Å |
| 202 | P | 29.4 | Very low | 28.3 | Very low | 85 Ų | 85 | 116.3 Ų | 116.3 | 55% | 0.552 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -76.4 | -25 | 176.1 | 18.6 | -17.8 | 0 | 0 | 0 | 113.4 | V199 T205 A206 | V199-P202 WeakPolarHBondContact O-CD 3.35Å; P202-T205 PolarHBondContact O-N 3.21Å; P202-A206 PolarHBondContact O-N 2.87Å |
| 203 | M | 25.9 | Very low | 28.7 | Very low | 131 Ų | 131 | 113.2 Ų | 113.2 | 65% | 0.645 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -67.8 | -38.2 | 178.8 | -114.1 | 178.6 | 158.8 | 0 | 0 | 113.1 | T205 V207 | M203-T205 VanDerWaalsContact C-N 3.31Å; M203-T205 PolarHBondContact O-N 3.31Å; M203-V207 VanDerWaalsContact O-CG2 3.24Å; M203-V207 WeakPolarHBondContact O-CG2 3.43Å; M203-V207 PolarHBondContact O-N 3.08Å |
| 204 | T | 27.5 | Very low | 28.9 | Very low | 94 Ų | 94 | 110.6 Ų | 110.6 | 58% | 0.577 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -72.5 | -25.1 | 176 | 35.7 | 0 | 0 | 0 | 0 | 112.8 | M200 A201 R208 | M200-T204 PolarHBondContact O-OG1 2.85Å; A201-T204 PolarHBondContact O-OG1 3.05Å; T204-R208 PolarHBondContact O-N 3.02Å |
| 205 | T | 27.1 | Very low | 29.2 | Very low | 81 Ų | 81 | 104 Ų | 104 | 50% | 0.497 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -80 | -39.1 | 177.5 | -47.8 | 0 | 0 | 0 | 0 | 111.7 | A201 P202 M203 R208 N209 | A201-T205 PolarHBondContact O-OG1 3.05Å; P202-T205 PolarHBondContact O-N 3.21Å; M203-T205 VanDerWaalsContact C-N 3.31Å; M203-T205 PolarHBondContact O-N 3.31Å; T205-R208 PolarHBondContact O-N 3.37Å; T205-N209 PolarHBondContact O-N 3.22Å |
| 206 | A | 26.1 | Very low | 29.7 | Very low | 58 Ų | 58 | 99.1 Ų | 99.1 | 48% | 0.479 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.9 | -34.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | P202 N209 | P202-A206 PolarHBondContact O-N 2.87Å; A206-N209 PolarHBondContact O-N 3.28Å |
| 207 | V | 28.9 | Very low | 29.9 | Very low | 64 Ų | 64 | 98.9 Ų | 98.9 | 39% | 0.388 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -72.6 | -29.7 | 176 | 174.7 | 0 | 0 | 0 | 0 | 112.2 | M203 N209 M236 | M203-V207 VanDerWaalsContact O-CG2 3.24Å; M203-V207 WeakPolarHBondContact O-CG2 3.43Å; M203-V207 PolarHBondContact O-N 3.08Å; V207-N209 VanDerWaalsContact C-N 3.35Å; V207-M236 WeakPolarHBondContact CG1-O 3.45Å |
| 208 | R | 26.9 | Very low | 29.9 | Very low | 216 Ų | 216 | 95.2 Ų | 95.2 | 82% | 0.815 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -71.1 | -25.4 | 173.1 | -94.9 | -176.3 | 179.5 | 172.6 | 1.2 | 114.1 | T204 T205 | T204-R208 PolarHBondContact O-N 3.02Å; T205-R208 PolarHBondContact O-N 3.37Å |
| 209 | N | 30.1 | Very low | 29.9 | Very low | 125 Ų | 125 | 97.4 Ų | 97.4 | 67% | 0.668 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90 | -4.8 | -178 | -71.4 | -14 | 0 | 0 | 0 | 114.1 | T205 A206 V207 S211 | T205-N209 PolarHBondContact O-N 3.22Å; A206-N209 PolarHBondContact O-N 3.28Å; V207-N209 VanDerWaalsContact C-N 3.35Å; N209-S211 PolarHBondContact O-N 2.96Å |
| 210 | C | 27.4 | Very low | 30.1 | Very low | 71 Ų | 71 | 99.7 Ų | 99.7 | 48% | 0.48 | 56% | 0.558 | S | S | . | * | trans | -78 | 49.6 | 169.2 | -77 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 211 | S | 27.5 | Very low | 30.7 | Very low | 79 Ų | 79 | 97.8 Ų | 97.8 | 55% | 0.552 | 55% | 0.546 | S | S | * | . | trans | -75.9 | 128.7 | 168.2 | 53.3 | 0 | 0 | 0 | 0 | 109.5 | N209 | N209-S211 PolarHBondContact O-N 2.96Š| ||
| 212 | T | 27.4 | Very low | 31.3 | Very low | 86 Ų | 86 | 99.5 Ų | 99.5 | 53% | 0.528 | 55% | 0.552 | S | S | . | * | trans | 95.1 | 56.4 | 171.6 | 79.3 | 0 | 0 | 0 | 0 | 118.7 | N214 | T212-N214 PolarHBondContact O-N 3.12Š| ||
| 213 | I | 35.7 | Very low | 32 | Very low | 97 Ų | 97 | 102.5 Ų | 102.5 | 50% | 0.497 | 55% | 0.552 | S | S | . | * | trans | -76.6 | 99.9 | 146.9 | -59.7 | 172.1 | 0 | 0 | 0 | 107.5 | L215 K232 | I213-L215 PolarHBondContact O-N 3.29Å; I213-L215 VanDerWaalsContact O-N 3.14Å; I213-K232 HydrophobicContact CB-CD 4.33Å; I213-K232 WeakPolarHBondContact O-CE 3.3Å; I213-K232 PolarHBondContact O-NZ 3.47Å | ||
| 214 | N | 33.1 | Very low | 32.9 | Very low | 125 Ų | 125 | 99 Ų | 99 | 67% | 0.668 | 54% | 0.536 | S | S | * | . | trans | -72.7 | 101.3 | 171.5 | -77.6 | -30.2 | 0 | 0 | 0 | 108.7 | T212 | T212-N214 PolarHBondContact O-N 3.12Š| ||
| 215 | L | 33.9 | Very low | 33.7 | Very low | 39 Ų | 39 | 96.9 Ų | 96.9 | 20% | 0.204 | 52% | 0.519 | C | S | . | . | trans | -66.6 | 126.9 | 170.5 | -85.7 | 159.8 | 0 | 0 | 0 | 108.3 | I213 V217 L228 C229 K232 | I213-L215 PolarHBondContact O-N 3.29Å; I213-L215 VanDerWaalsContact O-N 3.14Å; L215-V217 PolarHBondContact O-N 3.41Å; L215-L228 HydrophobicContact CD1-CB 4.2Å; L215-L228 HydrophobicContact CD2-CB 3.77Å; L215-L228 HydrophobicContact CD2-CD1 4.37Å; L215-C229 HydrophobicContact CD1-CB 4.27Å; L215-C229 VanDerWaalsContact CD1-SG 3.55Å; L215-K232 HydrophobicContact CD1-CB 3.98Å; L215-K232 HydrophobicContact CD1-CD 3.71Å; L215-K232 HydrophobicContact CD1-CG 4.47Å; L215-K232 HydrophobicContact CG-CD 4.29Å | ||
| 216 | P | 37.1 | Very low | 34.7 | Very low | 85 Ų | 85 | 95.8 Ų | 95.8 | 55% | 0.552 | 52% | 0.518 | S | S | * | . | trans | -57.2 | 128.3 | 173.2 | 22.8 | -30.9 | 0 | 0 | 0 | 108.4 | V218 | P216-V218 PolarHBondContact O-N 3.24Š| ||
| 217 | V | 31.4 | Very low | 35.9 | Very low | 87 Ų | 87 | 94.9 Ų | 94.9 | 53% | 0.527 | 51% | 0.505 | S | S | . | . | trans | -66.9 | 107.9 | 177.8 | -169.5 | 0 | 0 | 0 | 0 | 107.3 | L215 H219 | L215-V217 PolarHBondContact O-N 3.41Å; V217-H219 WeakPolarHBondContact CG1-CE1 3.31Å; V217-H219 WeakPolarHBondContact CG1-ND1 3.3Å; V217-H219 PolarHBondContact O-N 3.15Å | ||
| 218 | V | 34 | Very low | 36.9 | Very low | 44 Ų | 44 | 93.9 Ų | 93.9 | 27% | 0.267 | 50% | 0.497 | S | S | . | . | trans | -79.3 | 80 | 175 | -169.9 | 0 | 0 | 0 | 0 | 107.1 | P216 N220 K221 L224 | P216-V218 PolarHBondContact O-N 3.24Å; V218-N220 PolarHBondContact O-N 3.31Å; V218-K221 HydrophobicContact CG1-CB 3.82Å; V218-K221 HydrophobicContact CG1-CG 4.36Å; V218-K221 CarbonylContact O-C 3.57Å; V218-K221 PolarHBondContact O-N 2.8Å; V218-L224 HydrophobicContact CG1-CD2 4.5Å | ||
| 219 | H | 32.9 | Very low | 38.1 | Very low | 159 Ų | 159 | 85.5 Ų | 85.5 | 74% | 0.736 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.9 | -24.1 | -175.4 | -71.5 | -39.9 | 0 | 0 | 0 | 113.6 | V217 | V217-H219 WeakPolarHBondContact CG1-CE1 3.31Å; V217-H219 WeakPolarHBondContact CG1-ND1 3.3Å; V217-H219 PolarHBondContact O-N 3.15Å |
| 220 | N | 34.5 | Very low | 39.1 | Very low | 152 Ų | 152 | 86.6 Ų | 86.6 | 81% | 0.813 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | 0.9 | -178.6 | -67 | -8.5 | 0 | 0 | 0 | 114.7 | V218 | V218-N220 PolarHBondContact O-N 3.31Š|
| 221 | K | 38.8 | Very low | 40.3 | Very low | 109 Ų | 109 | 84.5 Ų | 84.5 | 47% | 0.474 | 45% | 0.45 | S | S | . | . | trans | -145.7 | 77.4 | 178.1 | -65.1 | -172.5 | 177.4 | -177.8 | 0 | 111 | V218 R223 L224 H225 | V218-K221 HydrophobicContact CG1-CB 3.82Å; V218-K221 HydrophobicContact CG1-CG 4.36Å; V218-K221 CarbonylContact O-C 3.57Å; V218-K221 PolarHBondContact O-N 2.8Å; K221-R223 PolarHBondContact O-N 3.07Å; K221-L224 HydrophobicContact CB-CB 3.7Å; K221-L224 HydrophobicContact CB-CD2 4.46Å; K221-L224 HydrophobicContact CD-CB 4.31Å; K221-L224 HydrophobicContact CD-CD2 3.97Å; K221-L224 PolarHBondContact O-N 3.34Å; K221-H225 PolarHBondContact O-N 3.01Å | ||
| 222 | P | 42.2 | Very low | 41.3 | Very low | 102 Ų | 102 | 83.1 Ų | 83.1 | 66% | 0.662 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -59.1 | -33 | -178.7 | 22.7 | -33.2 | 0 | 0 | 0 | 112.8 | H225 A226 | P222-H225 PolarHBondContact O-N 3.42Å; P222-A226 WeakPolarHBondContact O-CB 3.48Å; P222-A226 PolarHBondContact O-N 3.43Å |
| 223 | R | 43.1 | Very low | 42.4 | Very low | 149 Ų | 149 | 83.1 Ų | 83.1 | 56% | 0.562 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -66.1 | -43 | 174.5 | -75.5 | -172.2 | 167.5 | -178 | -1.4 | 113 | K221 H225 A226 I227 N255 | K221-R223 PolarHBondContact O-N 3.07Å; R223-H225 VanDerWaalsContact C-N 3.33Å; R223-A226 PolarHBondContact O-N 2.67Å; R223-I227 WeakPolarHBondContact O-CD1 3.45Å; R223-I227 WeakPolarHBondContact O-CG1 3.36Å; R223-I227 PolarHBondContact O-N 2.87Å; R223-N255 VanDerWaalsContact NH1-CB 3.31Å |
| 224 | L | 44.4 | Very low | 42.9 | Very low | 57 Ų | 57 | 80 Ų | 80 | 30% | 0.298 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -65.3 | -41 | 176.8 | -174.9 | 68.1 | 0 | 0 | 0 | 110.7 | V218 K221 A226 I227 L228 | V218-L224 HydrophobicContact CG1-CD2 4.5Å; K221-L224 HydrophobicContact CB-CB 3.7Å; K221-L224 HydrophobicContact CB-CD2 4.46Å; K221-L224 HydrophobicContact CD-CB 4.31Å; K221-L224 HydrophobicContact CD-CD2 3.97Å; K221-L224 PolarHBondContact O-N 3.34Å; L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 2.92Å; L224-I227 PolarHBondContact O-N 2.86Å; L224-L228 HydrophobicContact CG-CD1 4.05Å; L224-L228 HydrophobicContact CG-CG 4.44Å; L224-L228 WeakPolarHBondContact O-CB 3.34Å; L224-L228 VanDerWaalsContact O-CG 3.28Å; L224-L228 WeakPolarHBondContact O-CG 3.23Å; L224-L228 PolarHBondContact O-N 2.94Å |
| 225 | H | 45.9 | Very low | 43.6 | Very low | 49 Ų | 49 | 76.3 Ų | 76.3 | 23% | 0.227 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -62 | -41.8 | 174.5 | -170.9 | 71.1 | 0 | 0 | 0 | 111.7 | K221 P222 R223 L228 C229 | K221-H225 PolarHBondContact O-N 3.01Å; P222-H225 PolarHBondContact O-N 3.42Å; R223-H225 VanDerWaalsContact C-N 3.33Å; H225-L228 PolarHBondContact O-N 3.17Å; H225-C229 VanDerWaalsContact O-CB 3.31Å; H225-C229 WeakPolarHBondContact O-CB 3.4Å; H225-C229 PolarHBondContact O-N 3.3Å; H225-C229 PolarHBondContact O-SG 2.76Å; H225-C229 VanDerWaalsContact O-SG 3.36Å |
| 226 | A | 47 | Very low | 44.2 | Very low | 59 Ų | 59 | 77.7 Ų | 77.7 | 49% | 0.488 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.4 | -42.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | P222 R223 L224 C229 R230 | P222-A226 WeakPolarHBondContact O-CB 3.48Å; P222-A226 PolarHBondContact O-N 3.43Å; R223-A226 PolarHBondContact O-N 2.67Å; L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 2.92Å; A226-C229 PolarHBondContact O-N 3.12Å; A226-R230 VanDerWaalsContact O-CB 3.31Å; A226-R230 WeakPolarHBondContact O-CB 3.13Å; A226-R230 PolarHBondContact O-N 3.41Å |
| 227 | I | 50.8 | Low | 44.5 | Very low | 39 Ų | 39 | 80.4 Ų | 80.4 | 20% | 0.2 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -63.3 | -47.8 | 176 | -66.5 | 161.4 | 0 | 0 | 0 | 110.2 | R223 L224 C229 R230 I231 L249 A252 | R223-I227 WeakPolarHBondContact O-CD1 3.45Å; R223-I227 WeakPolarHBondContact O-CG1 3.36Å; R223-I227 PolarHBondContact O-N 2.87Å; L224-I227 PolarHBondContact O-N 2.86Å; I227-C229 PolarHBondContact O-N 3.38Å; I227-R230 PolarHBondContact O-N 2.91Å; I227-R230 VanDerWaalsContact O-N 3.17Å; I227-I231 HydrophobicContact CG2-CD1 3.64Å; I227-I231 HydrophobicContact CG2-CG1 4.28Å; I227-I231 WeakPolarHBondContact O-CB 3.35Å; I227-I231 VanDerWaalsContact O-CG1 3.23Å; I227-I231 WeakPolarHBondContact O-CG1 3.46Å; I227-I231 PolarHBondContact O-N 3.39Å; I227-L249 HydrophobicContact CG2-CD2 3.87Å; I227-A252 HydrophobicContact CD1-CB 3.49Å; I227-A252 VanDerWaalsContact CD1-CB 3.49Å; I227-A252 HydrophobicContact CG1-CB 4.1Å |
| 228 | L | 50.4 | Low | 44.9 | Very low | 43 Ų | 43 | 79.5 Ų | 79.5 | 23% | 0.225 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 178.1 | -71.2 | 170.4 | 0 | 0 | 0 | 112.2 | L215 L224 H225 R230 I231 K232 | L215-L228 HydrophobicContact CD1-CB 4.2Å; L215-L228 HydrophobicContact CD2-CB 3.77Å; L215-L228 HydrophobicContact CD2-CD1 4.37Å; L224-L228 HydrophobicContact CG-CD1 4.05Å; L224-L228 HydrophobicContact CG-CG 4.44Å; L224-L228 WeakPolarHBondContact O-CB 3.34Å; L224-L228 VanDerWaalsContact O-CG 3.28Å; L224-L228 WeakPolarHBondContact O-CG 3.23Å; L224-L228 PolarHBondContact O-N 2.94Å; H225-L228 PolarHBondContact O-N 3.17Å; L228-R230 VanDerWaalsContact C-N 3.34Å; L228-I231 PolarHBondContact O-N 3.46Å; L228-K232 VanDerWaalsContact O-CB 3.31Å; L228-K232 WeakPolarHBondContact O-CB 3.37Å; L228-K232 PolarHBondContact O-N 2.98Å |
| 229 | C | 51.9 | Low | 45.1 | Very low | 40 Ų | 40 | 80.2 Ų | 80.2 | 27% | 0.27 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -63.3 | -39.1 | 173 | -78.5 | 0 | 0 | 0 | 0 | 111.9 | L215 H225 A226 I227 K232 N233 | L215-C229 HydrophobicContact CD1-CB 4.27Å; L215-C229 VanDerWaalsContact CD1-SG 3.55Å; H225-C229 VanDerWaalsContact O-CB 3.31Å; H225-C229 WeakPolarHBondContact O-CB 3.4Å; H225-C229 PolarHBondContact O-N 3.3Å; H225-C229 PolarHBondContact O-SG 2.76Å; H225-C229 VanDerWaalsContact O-SG 3.36Å; A226-C229 PolarHBondContact O-N 3.12Å; I227-C229 PolarHBondContact O-N 3.38Å; C229-K232 PolarHBondContact O-N 3.36Å; C229-N233 WeakPolarHBondContact O-CB 3.37Å; C229-N233 PolarHBondContact O-N 3.29Å; C229-N233 PolarHBondContact O-ND2 2.94Å; C229-N233 PolarHBondContact O-OD1 3.49Å |
| 230 | R | 51.6 | Low | 45.6 | Very low | 147 Ų | 147 | 76.1 Ų | 76.1 | 56% | 0.555 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -69.7 | -41.2 | 176.7 | -165.6 | 168.7 | -174.5 | 163.6 | -1 | 111.8 | A226 I227 L228 N233 L234 | A226-R230 VanDerWaalsContact O-CB 3.31Å; A226-R230 WeakPolarHBondContact O-CB 3.13Å; A226-R230 PolarHBondContact O-N 3.41Å; I227-R230 PolarHBondContact O-N 2.91Å; I227-R230 VanDerWaalsContact O-N 3.17Å; L228-R230 VanDerWaalsContact C-N 3.34Å; R230-N233 PolarHBondContact O-N 3.38Å; R230-L234 HydrophobicContact CG-CD1 4.31Å; R230-L234 WeakPolarHBondContact O-CB 3.31Å; R230-L234 VanDerWaalsContact O-CG 3.29Å; R230-L234 WeakPolarHBondContact O-CG 3.3Å; R230-L234 PolarHBondContact O-N 2.91Å |
| 231 | I | 51.7 | Low | 46.1 | Very low | 27 Ų | 27 | 75 Ų | 75 | 14% | 0.138 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.8 | -45.3 | 173.3 | -69.3 | 169.9 | 0 | 0 | 0 | 110.2 | I227 L228 N233 L234 L235 L245 | I227-I231 HydrophobicContact CG2-CD1 3.64Å; I227-I231 HydrophobicContact CG2-CG1 4.28Å; I227-I231 WeakPolarHBondContact O-CB 3.35Å; I227-I231 VanDerWaalsContact O-CG1 3.23Å; I227-I231 WeakPolarHBondContact O-CG1 3.46Å; I227-I231 PolarHBondContact O-N 3.39Å; L228-I231 PolarHBondContact O-N 3.46Å; I231-N233 VanDerWaalsContact C-N 3.33Å; I231-N233 PolarHBondContact O-N 2.95Å; I231-L234 PolarHBondContact O-N 3.33Å; I231-L235 HydrophobicContact CG2-CD1 3.64Å; I231-L235 HydrophobicContact CG2-CG 4.32Å; I231-L235 VanDerWaalsContact O-CB 3.28Å; I231-L235 WeakPolarHBondContact O-CB 3.07Å; I231-L235 WeakPolarHBondContact O-CD1 3.17Å; I231-L235 VanDerWaalsContact O-CG 3.24Å; I231-L235 WeakPolarHBondContact O-CG 3.39Å; I231-L235 PolarHBondContact O-N 3.43Å; I231-L245 HydrophobicContact CD1-CD2 4.19Å; I231-L245 HydrophobicContact CD1-CG 4.39Å; I231-L245 HydrophobicContact CG1-CD1 3.94Å; I231-L245 HydrophobicContact CG1-CD2 4.34Å; I231-L245 HydrophobicContact CG1-CG 4.1Å; I231-L245 HydrophobicContact CG2-CD1 4.25Å |
| 232 | K | 49.6 | Very low | 46.4 | Very low | 50 Ų | 50 | 73.5 Ų | 73.5 | 22% | 0.217 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -56 | -45.8 | 171.9 | 174.4 | -174.3 | 166.7 | -173.7 | 0 | 111.4 | I213 L215 L228 C229 L235 M236 | I213-K232 HydrophobicContact CB-CD 4.33Å; I213-K232 WeakPolarHBondContact O-CE 3.3Å; I213-K232 PolarHBondContact O-NZ 3.47Å; L215-K232 HydrophobicContact CD1-CB 3.98Å; L215-K232 HydrophobicContact CD1-CD 3.71Å; L215-K232 HydrophobicContact CD1-CG 4.47Å; L215-K232 HydrophobicContact CG-CD 4.29Å; L228-K232 VanDerWaalsContact O-CB 3.31Å; L228-K232 WeakPolarHBondContact O-CB 3.37Å; L228-K232 PolarHBondContact O-N 2.98Å; C229-K232 PolarHBondContact O-N 3.36Å; K232-L235 WeakPolarHBondContact O-CB 3.47Å; K232-L235 PolarHBondContact O-N 2.94Å; K232-M236 HydrophobicContact CG-CG 4.36Å; K232-M236 WeakPolarHBondContact O-CB 3.48Å; K232-M236 WeakPolarHBondContact O-CG 3.42Å; K232-M236 PolarHBondContact O-N 2.91Å |
| 233 | N | 50.4 | Low | 46.3 | Very low | 86 Ų | 86 | 75 Ų | 75 | 46% | 0.46 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.5 | -38.6 | 179.1 | -70.5 | -13.8 | 0 | 0 | 0 | 112.5 | C229 R230 I231 M236 Q237 | C229-N233 WeakPolarHBondContact O-CB 3.37Å; C229-N233 PolarHBondContact O-N 3.29Å; C229-N233 PolarHBondContact O-ND2 2.94Å; C229-N233 PolarHBondContact O-OD1 3.49Å; R230-N233 PolarHBondContact O-N 3.38Å; I231-N233 VanDerWaalsContact C-N 3.33Å; I231-N233 PolarHBondContact O-N 2.95Å; N233-M236 PolarHBondContact O-N 3.22Å; N233-Q237 WeakPolarHBondContact O-CB 3.5Å; N233-Q237 VanDerWaalsContact O-CG 3.23Å; N233-Q237 WeakPolarHBondContact O-CG 3.4Å; N233-Q237 PolarHBondContact O-N 3.42Å |
| 234 | L | 46.5 | Very low | 46.4 | Very low | 32 Ų | 32 | 70.9 Ų | 70.9 | 17% | 0.168 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -68.6 | -37.8 | 175.8 | -70.7 | 168.9 | 0 | 0 | 0 | 112 | R230 I231 Q237 G238 | R230-L234 HydrophobicContact CG-CD1 4.31Å; R230-L234 WeakPolarHBondContact O-CB 3.31Å; R230-L234 VanDerWaalsContact O-CG 3.29Å; R230-L234 WeakPolarHBondContact O-CG 3.3Å; R230-L234 PolarHBondContact O-N 2.91Å; I231-L234 PolarHBondContact O-N 3.33Å; L234-Q237 PolarHBondContact O-N 3.38Å; L234-G238 PolarHBondContact O-N 3.19Å |
| 235 | L | 48.5 | Very low | 46.5 | Very low | 47 Ų | 47 | 68.7 Ų | 68.7 | 25% | 0.246 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -62.1 | -45.7 | 171.2 | -79.8 | 161.8 | 0 | 0 | 0 | 111.7 | I231 K232 Q237 G238 L240 L273 L277 | I231-L235 HydrophobicContact CG2-CD1 3.64Å; I231-L235 HydrophobicContact CG2-CG 4.32Å; I231-L235 VanDerWaalsContact O-CB 3.28Å; I231-L235 WeakPolarHBondContact O-CB 3.07Å; I231-L235 WeakPolarHBondContact O-CD1 3.17Å; I231-L235 VanDerWaalsContact O-CG 3.24Å; I231-L235 WeakPolarHBondContact O-CG 3.39Å; I231-L235 PolarHBondContact O-N 3.43Å; K232-L235 WeakPolarHBondContact O-CB 3.47Å; K232-L235 PolarHBondContact O-N 2.94Å; L235-Q237 PolarHBondContact O-N 3.39Å; L235-G238 PolarHBondContact O-N 3.47Å; L235-L240 HydrophobicContact CB-CD1 4.42Å; L235-L240 HydrophobicContact CD2-CD1 3.12Å; L235-L240 HydrophobicContact CG-CD1 3.5Å; L235-L273 HydrophobicContact CD1-CD2 3.65Å; L235-L277 HydrophobicContact CD2-CD1 3.68Å |
| 236 | M | 45.3 | Very low | 46.5 | Very low | 68 Ų | 68 | 70.4 Ų | 70.4 | 34% | 0.335 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -66.9 | -22.6 | 177 | -67 | -103.8 | -63.3 | 0 | 0 | 113 | V207 K232 N233 | V207-M236 WeakPolarHBondContact CG1-O 3.45Å; K232-M236 HydrophobicContact CG-CG 4.36Å; K232-M236 WeakPolarHBondContact O-CB 3.48Å; K232-M236 WeakPolarHBondContact O-CG 3.42Å; K232-M236 PolarHBondContact O-N 2.91Å; N233-M236 PolarHBondContact O-N 3.22Å |
| 237 | Q | 44 | Very low | 46.5 | Very low | 143 Ų | 143 | 72.2 Ų | 72.2 | 67% | 0.668 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.3 | 0.2 | 178.6 | -74.3 | 175.5 | 0.7 | 0 | 0 | 113.3 | N233 L234 L235 A239 | N233-Q237 WeakPolarHBondContact O-CB 3.5Å; N233-Q237 VanDerWaalsContact O-CG 3.23Å; N233-Q237 WeakPolarHBondContact O-CG 3.4Å; N233-Q237 PolarHBondContact O-N 3.42Å; L234-Q237 PolarHBondContact O-N 3.38Å; L235-Q237 PolarHBondContact O-N 3.39Å; Q237-A239 PolarHBondContact O-N 3.38Å |
| 238 | G | 39.9 | Very low | 46.3 | Very low | 68 Ų | 68 | 73 Ų | 73 | 70% | 0.701 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.6 | 7.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | L234 L235 | L234-G238 PolarHBondContact O-N 3.19Å; L235-G238 PolarHBondContact O-N 3.47Å |
| 239 | A | 38.5 | Very low | 46.2 | Very low | 58 Ų | 58 | 72 Ų | 72 | 48% | 0.479 | 39% | 0.385 | S | S | . | . | trans | -109.3 | 66.1 | -173.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q237 H241 | Q237-A239 PolarHBondContact O-N 3.38Å; A239-H241 PolarHBondContact O-N 2.94Å | ||
| 240 | L | 42.8 | Very low | 45.9 | Very low | 73 Ų | 73 | 75 Ų | 75 | 38% | 0.382 | 40% | 0.398 | S | S | . | . | trans | -96.6 | 75.9 | 179 | -135.3 | 144.9 | 0 | 0 | 0 | 110.4 | L235 V242 L245 | L235-L240 HydrophobicContact CB-CD1 4.42Å; L235-L240 HydrophobicContact CD2-CD1 3.12Å; L235-L240 HydrophobicContact CG-CD1 3.5Å; L240-V242 VanDerWaalsContact C-N 3.33Å; L240-V242 HydrophobicContact CD2-CG2 3.85Å; L240-V242 PolarHBondContact O-N 3.44Å; L240-V242 VanDerWaalsContact O-N 3.07Å; L240-L245 HydrophobicContact CD2-CD1 3.96Å; L240-L245 HydrophobicContact CG-CD1 4.18Å | ||
| 241 | H | 45.7 | Very low | 45.8 | Very low | 130 Ų | 130 | 73.4 Ų | 73.4 | 60% | 0.602 | 40% | 0.404 | S | S | * | . | trans | -66.4 | 100.4 | 152.6 | -94.5 | -93 | 0 | 0 | 0 | 107 | A239 E243 V244 L245 | A239-H241 PolarHBondContact O-N 2.94Å; H241-E243 PolarHBondContact O-N 3.3Å; H241-E243 VanDerWaalsContact O-N 3.07Å; H241-V244 HydrophobicContact CB-CB 4.33Å; H241-V244 HydrophobicContact CB-CG2 3.79Å; H241-V244 WeakPolarHBondContact O-CB 3.4Å; H241-V244 PolarHBondContact O-N 2.9Å; H241-L245 PolarHBondContact O-N 3.01Å | ||
| 242 | V | 43.6 | Very low | 45.4 | Very low | 77 Ų | 77 | 73.8 Ų | 73.8 | 47% | 0.467 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -50.5 | -31 | 175.3 | 176.5 | 0 | 0 | 0 | 0 | 111.2 | L240 V244 L245 I246 | L240-V242 VanDerWaalsContact C-N 3.33Å; L240-V242 HydrophobicContact CD2-CG2 3.85Å; L240-V242 PolarHBondContact O-N 3.44Å; L240-V242 VanDerWaalsContact O-N 3.07Å; V242-V244 PolarHBondContact O-N 3.48Å; V242-L245 WeakPolarHBondContact O-CB 3.45Å; V242-L245 PolarHBondContact O-N 3.44Å; V242-I246 HydrophobicContact CG1-CD1 3.83Å; V242-I246 HydrophobicContact CG1-CG1 4.35Å; V242-I246 WeakPolarHBondContact O-CG1 3Å; V242-I246 PolarHBondContact O-N 2.96Å |
| 243 | E | 41 | Very low | 45.1 | Very low | 134 Ų | 134 | 73.1 Ų | 73.1 | 63% | 0.626 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -61.5 | -38.5 | 173.1 | -69.8 | -176.9 | 151.4 | 0 | 0 | 114 | H241 L245 N247 | H241-E243 PolarHBondContact O-N 3.3Å; H241-E243 VanDerWaalsContact O-N 3.07Å; E243-L245 VanDerWaalsContact C-N 3.29Å; E243-L245 PolarHBondContact O-N 2.89Å; E243-N247 VanDerWaalsContact O-CB 3.26Å; E243-N247 WeakPolarHBondContact O-CB 3.46Å; E243-N247 PolarHBondContact O-N 3.44Å; E243-N247 PolarHBondContact O-ND2 3.49Å |
| 244 | V | 45.9 | Very low | 44.5 | Very low | 61 Ų | 61 | 71.6 Ų | 71.6 | 37% | 0.37 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -68.5 | -35.1 | 176 | 177.6 | 0 | 0 | 0 | 0 | 110 | H241 V242 Q248 | H241-V244 HydrophobicContact CB-CB 4.33Å; H241-V244 HydrophobicContact CB-CG2 3.79Å; H241-V244 WeakPolarHBondContact O-CB 3.4Å; H241-V244 PolarHBondContact O-N 2.9Å; V242-V244 PolarHBondContact O-N 3.48Å; V244-Q248 HydrophobicContact CG1-CG 4.3Å; V244-Q248 VanDerWaalsContact O-CB 3.24Å; V244-Q248 WeakPolarHBondContact O-CB 3.28Å; V244-Q248 WeakPolarHBondContact O-CG 2.81Å; V244-Q248 PolarHBondContact O-N 3.05Å |
| 245 | L | 46.7 | Very low | 44.4 | Very low | 12 Ų | 12 | 76.4 Ų | 76.4 | 6% | 0.063 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -67.6 | -45.9 | 177.9 | -140.3 | 108.2 | 0 | 0 | 0 | 111.4 | I231 L240 H241 V242 E243 Q248 L249 I270 | I231-L245 HydrophobicContact CD1-CD2 4.19Å; I231-L245 HydrophobicContact CD1-CG 4.39Å; I231-L245 HydrophobicContact CG1-CD1 3.94Å; I231-L245 HydrophobicContact CG1-CD2 4.34Å; I231-L245 HydrophobicContact CG1-CG 4.1Å; I231-L245 HydrophobicContact CG2-CD1 4.25Å; L240-L245 HydrophobicContact CD2-CD1 3.96Å; L240-L245 HydrophobicContact CG-CD1 4.18Å; H241-L245 PolarHBondContact O-N 3.01Å; V242-L245 WeakPolarHBondContact O-CB 3.45Å; V242-L245 PolarHBondContact O-N 3.44Å; E243-L245 VanDerWaalsContact C-N 3.29Å; E243-L245 PolarHBondContact O-N 2.89Å; L245-Q248 PolarHBondContact O-N 3.44Å; L245-L249 HydrophobicContact CD2-CD1 4.15Å; L245-L249 VanDerWaalsContact O-CB 3.31Å; L245-L249 WeakPolarHBondContact O-CB 3.29Å; L245-L249 WeakPolarHBondContact O-CD1 3.43Å; L245-L249 VanDerWaalsContact O-CG 3.28Å; L245-L249 WeakPolarHBondContact O-CG 3.48Å; L245-L249 PolarHBondContact O-N 3.09Å; L245-I270 HydrophobicContact CD2-CD1 3.96Å; L245-I270 HydrophobicContact CD2-CG1 4.35Å |
| 246 | I | 45.6 | Very low | 44.1 | Very low | 85 Ų | 85 | 77.4 Ų | 77.4 | 44% | 0.436 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.7 | -45.7 | 176.9 | -67.9 | 169.4 | 0 | 0 | 0 | 110.4 | V242 Q248 L249 L250 | V242-I246 HydrophobicContact CG1-CD1 3.83Å; V242-I246 HydrophobicContact CG1-CG1 4.35Å; V242-I246 WeakPolarHBondContact O-CG1 3Å; V242-I246 PolarHBondContact O-N 2.96Å; I246-Q248 PolarHBondContact O-N 3.28Å; I246-L249 PolarHBondContact O-N 3.3Å; I246-L250 HydrophobicContact CG2-CD1 3.68Å; I246-L250 HydrophobicContact CG2-CG 4.39Å; I246-L250 WeakPolarHBondContact O-CB 3.45Å; I246-L250 VanDerWaalsContact O-CG 3.29Å; I246-L250 WeakPolarHBondContact O-CG 3.43Å; I246-L250 PolarHBondContact O-N 2.94Å |
| 247 | N | 45.6 | Very low | 43.9 | Very low | 96 Ų | 96 | 80.3 Ų | 80.3 | 51% | 0.513 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.9 | -37.2 | 178.1 | -77.8 | -31.3 | 0 | 0 | 0 | 112.3 | E243 T251 | E243-N247 VanDerWaalsContact O-CB 3.26Å; E243-N247 WeakPolarHBondContact O-CB 3.46Å; E243-N247 PolarHBondContact O-N 3.44Å; E243-N247 PolarHBondContact O-ND2 3.49Å; N247-T251 VanDerWaalsContact O-CB 3.28Å; N247-T251 WeakPolarHBondContact O-CB 3.09Å; N247-T251 PolarHBondContact O-N 2.93Å; N247-T251 PolarHBondContact O-OG1 2.96Å |
| 248 | Q | 48.1 | Very low | 44 | Very low | 56 Ų | 56 | 76.4 Ų | 76.4 | 26% | 0.262 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -71.8 | -34.6 | 175 | -75 | 178.7 | 16.9 | 0 | 0 | 112.5 | V244 L245 I246 A252 | V244-Q248 HydrophobicContact CG1-CG 4.3Å; V244-Q248 VanDerWaalsContact O-CB 3.24Å; V244-Q248 WeakPolarHBondContact O-CB 3.28Å; V244-Q248 WeakPolarHBondContact O-CG 2.81Å; V244-Q248 PolarHBondContact O-N 3.05Å; L245-Q248 PolarHBondContact O-N 3.44Å; I246-Q248 PolarHBondContact O-N 3.28Å; Q248-A252 WeakPolarHBondContact O-CB 3.46Å; Q248-A252 PolarHBondContact O-N 3.17Å |
| 249 | L | 47.8 | Very low | 44.3 | Very low | 23 Ų | 23 | 76.7 Ų | 76.7 | 12% | 0.12 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -67.2 | -41.3 | 173 | -80.3 | 162.6 | 0 | 0 | 0 | 111.8 | I227 L245 I246 A252 S253 I266 I270 | I227-L249 HydrophobicContact CG2-CD2 3.87Å; L245-L249 HydrophobicContact CD2-CD1 4.15Å; L245-L249 VanDerWaalsContact O-CB 3.31Å; L245-L249 WeakPolarHBondContact O-CB 3.29Å; L245-L249 WeakPolarHBondContact O-CD1 3.43Å; L245-L249 VanDerWaalsContact O-CG 3.28Å; L245-L249 WeakPolarHBondContact O-CG 3.48Å; L245-L249 PolarHBondContact O-N 3.09Å; I246-L249 PolarHBondContact O-N 3.3Å; L249-A252 PolarHBondContact O-N 2.92Å; L249-S253 WeakPolarHBondContact O-CB 3.28Å; L249-S253 PolarHBondContact O-N 3.29Å; L249-I266 HydrophobicContact CD1-CG2 4Å; L249-I266 HydrophobicContact CD2-CD1 4.4Å; L249-I266 HydrophobicContact CD2-CG2 4.36Å; L249-I270 HydrophobicContact CD1-CD1 4.13Å |
| 250 | L | 45.2 | Very low | 44.5 | Very low | 103 Ų | 103 | 78.8 Ų | 78.8 | 54% | 0.539 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -66.6 | -41.6 | 174 | -74.1 | 165.8 | 0 | 0 | 0 | 111.8 | I246 A252 S253 G254 | I246-L250 HydrophobicContact CG2-CD1 3.68Å; I246-L250 HydrophobicContact CG2-CG 4.39Å; I246-L250 WeakPolarHBondContact O-CB 3.45Å; I246-L250 VanDerWaalsContact O-CG 3.29Å; I246-L250 WeakPolarHBondContact O-CG 3.43Å; I246-L250 PolarHBondContact O-N 2.94Å; L250-A252 VanDerWaalsContact C-N 3.33Å; L250-A252 PolarHBondContact O-N 2.61Å; L250-S253 PolarHBondContact O-N 3.4Å; L250-S253 PolarHBondContact O-OG 3.17Å; L250-S253 VanDerWaalsContact O-OG 3.12Å; L250-G254 PolarHBondContact O-N 2.79Å |
| 251 | T | 50.3 | Low | 44.5 | Very low | 113 Ų | 113 | 80.7 Ų | 80.7 | 69% | 0.693 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -67.9 | -34.9 | 176.1 | -50.1 | 0 | 0 | 0 | 0 | 111.4 | N247 G254 | N247-T251 VanDerWaalsContact O-CB 3.28Å; N247-T251 WeakPolarHBondContact O-CB 3.09Å; N247-T251 PolarHBondContact O-N 2.93Å; N247-T251 PolarHBondContact O-OG1 2.96Å; T251-G254 PolarHBondContact O-N 3Å |
| 252 | A | 43.2 | Very low | 44.3 | Very low | 34 Ų | 34 | 77.1 Ų | 77.1 | 28% | 0.281 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -75.7 | -24.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | I227 Q248 L249 L250 G254 | I227-A252 HydrophobicContact CD1-CB 3.49Å; I227-A252 VanDerWaalsContact CD1-CB 3.49Å; I227-A252 HydrophobicContact CG1-CB 4.1Å; Q248-A252 WeakPolarHBondContact O-CB 3.46Å; Q248-A252 PolarHBondContact O-N 3.17Å; L249-A252 PolarHBondContact O-N 2.92Å; L250-A252 VanDerWaalsContact C-N 3.33Å; L250-A252 PolarHBondContact O-N 2.61Å; A252-G254 VanDerWaalsContact C-N 3.27Å |
| 253 | S | 42.3 | Very low | 44.3 | Very low | 36 Ų | 36 | 76.3 Ų | 76.3 | 25% | 0.252 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -71.6 | -23.3 | 171.3 | 102.6 | 0 | 0 | 0 | 0 | 112.8 | L249 L250 N255 S256 | L249-S253 WeakPolarHBondContact O-CB 3.28Å; L249-S253 PolarHBondContact O-N 3.29Å; L250-S253 PolarHBondContact O-N 3.4Å; L250-S253 PolarHBondContact O-OG 3.17Å; L250-S253 VanDerWaalsContact O-OG 3.12Å; S253-N255 PolarHBondContact O-N 2.93Å; S253-S256 CarbonylContact O-C 3.6Å; S253-S256 PolarHBondContact O-N 3.26Å; S253-S256 VanDerWaalsContact O-O 3.09Å |
| 254 | G | 38.6 | Very low | 44.3 | Very low | 54 Ų | 54 | 73.2 Ų | 73.2 | 56% | 0.557 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | 19.8 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | L250 T251 A252 | L250-G254 PolarHBondContact O-N 2.79Å; T251-G254 PolarHBondContact O-N 3Å; A252-G254 VanDerWaalsContact C-N 3.27Å |
| 255 | N | 44.2 | Very low | 44.2 | Very low | 133 Ų | 133 | 72.6 Ų | 72.6 | 71% | 0.711 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -150.7 | 6.8 | 170.1 | -94 | -36.7 | 0 | 0 | 0 | 114.3 | R223 S253 | R223-N255 VanDerWaalsContact NH1-CB 3.31Å; S253-N255 PolarHBondContact O-N 2.93Å |
| 256 | S | 42.3 | Very low | 44.2 | Very low | 68 Ų | 68 | 73.7 Ų | 73.7 | 48% | 0.476 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -160.6 | 118 | 174 | 52.6 | 0 | 0 | 0 | 0 | 108.5 | S253 I258 | S253-S256 CarbonylContact O-C 3.6Å; S253-S256 PolarHBondContact O-N 3.26Å; S253-S256 VanDerWaalsContact O-O 3.09Å; S256-I258 PolarHBondContact O-N 3.43Å |
| 257 | T | 41.7 | Very low | 44.3 | Very low | 130 Ų | 130 | 71.6 Ų | 71.6 | 80% | 0.798 | 43% | 0.428 | S | S | * | . | trans | -40.2 | 97.6 | 176.6 | 49 | 0 | 0 | 0 | 0 | 111.3 | R259 | T257-R259 PolarHBondContact O-N 2.89Š| ||
| 258 | I | 46 | Very low | 44.4 | Very low | 60 Ų | 60 | 71.6 Ų | 71.6 | 31% | 0.308 | 43% | 0.431 | S | S | . | . | trans | -67.4 | 114.5 | 165.4 | -71.5 | -174.3 | 0 | 0 | 0 | 104.8 | S256 D262 V263 | S256-I258 PolarHBondContact O-N 3.43Å; I258-D262 HydrophobicContact CG2-CB 3.7Å; I258-V263 HydrophobicContact CG2-CG2 3.54Å | ||
| 259 | R | 46 | Very low | 44.4 | Very low | 74 Ų | 74 | 73.4 Ų | 73.4 | 28% | 0.279 | 44% | 0.442 | S | S | . | . | trans | -68.3 | 151.7 | 176.8 | -68.7 | -178.4 | 171.8 | -160 | -8.6 | 108.7 | T257 D261 D262 V263 | T257-R259 PolarHBondContact O-N 2.89Å; R259-D261 HydrophobicContact CB-CB 4.5Å; R259-D261 PolarHBondContact O-N 3.41Å; R259-D262 PolarHBondContact N-OD2 3.34Å; R259-D262 VanDerWaalsContact N-OD2 3.08Å; R259-D262 WeakPolarHBondContact O-CA 3.18Å; R259-D262 WeakPolarHBondContact O-CB 3.41Å; R259-D262 PolarHBondContact O-N 3.39Å; R259-V263 PolarHBondContact O-N 2.88Å | ||
| 260 | P | 41.9 | Very low | 44.5 | Very low | 102 Ų | 102 | 74.7 Ų | 74.7 | 66% | 0.662 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -50.1 | -33.1 | 171.9 | -24.3 | 32.7 | 0 | 0 | 0 | 112.4 | V263 C264 | P260-V263 WeakPolarHBondContact O-CB 3.28Å; P260-V263 PolarHBondContact O-N 3.15Å; P260-C264 PolarHBondContact O-N 3.48Å |
| 261 | D | 43.7 | Very low | 44.7 | Very low | 114 Ų | 114 | 73.8 Ų | 73.8 | 61% | 0.61 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -65 | -37 | 175.6 | -51.4 | -39.7 | 0 | 0 | 0 | 113 | R259 V263 C264 A265 | R259-D261 HydrophobicContact CB-CB 4.5Å; R259-D261 PolarHBondContact O-N 3.41Å; D261-V263 VanDerWaalsContact C-N 3.33Å; D261-C264 PolarHBondContact O-N 3.41Å; D261-A265 PolarHBondContact O-N 2.86Å |
| 262 | D | 41.7 | Very low | 44.7 | Very low | 55 Ų | 55 | 70.7 Ų | 70.7 | 29% | 0.294 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.3 | -35 | 174.8 | -67.8 | -54.2 | 0 | 0 | 0 | 110.5 | I258 R259 A265 I266 | I258-D262 HydrophobicContact CG2-CB 3.7Å; R259-D262 PolarHBondContact N-OD2 3.34Å; R259-D262 VanDerWaalsContact N-OD2 3.08Å; R259-D262 WeakPolarHBondContact O-CA 3.18Å; R259-D262 WeakPolarHBondContact O-CB 3.41Å; R259-D262 PolarHBondContact O-N 3.39Å; D262-A265 PolarHBondContact O-N 3.05Å; D262-I266 WeakPolarHBondContact O-CB 3.26Å; D262-I266 WeakPolarHBondContact O-CD1 3.36Å; D262-I266 WeakPolarHBondContact O-CG1 3.38Å; D262-I266 PolarHBondContact O-N 3.24Å |
| 263 | V | 42.9 | Very low | 45 | Very low | 60 Ų | 60 | 72.3 Ų | 72.3 | 36% | 0.364 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 175 | -174.4 | 0 | 0 | 0 | 0 | 110.7 | I258 R259 P260 D261 A265 I266 D267 | I258-V263 HydrophobicContact CG2-CG2 3.54Å; R259-V263 PolarHBondContact O-N 2.88Å; P260-V263 WeakPolarHBondContact O-CB 3.28Å; P260-V263 PolarHBondContact O-N 3.15Å; D261-V263 VanDerWaalsContact C-N 3.33Å; V263-A265 VanDerWaalsContact C-N 3.32Å; V263-A265 PolarHBondContact O-N 2.84Å; V263-I266 PolarHBondContact O-N 3.37Å; V263-D267 WeakPolarHBondContact O-CB 3.33Å; V263-D267 VanDerWaalsContact O-CG 3.25Å; V263-D267 PolarHBondContact O-N 3.13Å |
| 264 | C | 41.2 | Very low | 45.3 | Very low | 68 Ų | 68 | 75 Ų | 75 | 46% | 0.459 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.4 | -41.5 | 173.6 | -96.2 | 0 | 0 | 0 | 0 | 112.1 | P260 D261 T268 | P260-C264 PolarHBondContact O-N 3.48Å; D261-C264 PolarHBondContact O-N 3.41Å; C264-T268 VanDerWaalsContact O-CB 3.3Å; C264-T268 WeakPolarHBondContact O-CB 3.47Å; C264-T268 PolarHBondContact O-N 3.39Å; C264-T268 PolarHBondContact O-OG1 3.01Å |
| 265 | A | 44.1 | Very low | 46 | Very low | 48 Ų | 48 | 75.9 Ų | 75.9 | 40% | 0.397 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.8 | -41.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | D261 D262 V263 T268 L269 | D261-A265 PolarHBondContact O-N 2.86Å; D262-A265 PolarHBondContact O-N 3.05Å; V263-A265 VanDerWaalsContact C-N 3.32Å; V263-A265 PolarHBondContact O-N 2.84Å; A265-T268 PolarHBondContact O-N 3.43Å; A265-L269 WeakPolarHBondContact O-CB 3.13Å; A265-L269 PolarHBondContact O-N 3.19Å |
| 266 | I | 46.9 | Very low | 46.2 | Very low | 36 Ų | 36 | 73.4 Ų | 73.4 | 19% | 0.185 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -66.8 | -45.4 | 177.3 | -69.9 | 162.8 | 0 | 0 | 0 | 110.7 | L249 D262 V263 T268 L269 I270 | L249-I266 HydrophobicContact CD1-CG2 4Å; L249-I266 HydrophobicContact CD2-CD1 4.4Å; L249-I266 HydrophobicContact CD2-CG2 4.36Å; D262-I266 WeakPolarHBondContact O-CB 3.26Å; D262-I266 WeakPolarHBondContact O-CD1 3.36Å; D262-I266 WeakPolarHBondContact O-CG1 3.38Å; D262-I266 PolarHBondContact O-N 3.24Å; V263-I266 PolarHBondContact O-N 3.37Å; I266-T268 VanDerWaalsContact C-N 3.32Å; I266-T268 PolarHBondContact O-N 3.31Å; I266-L269 WeakPolarHBondContact O-CB 3.27Å; I266-L269 PolarHBondContact O-N 3.48Å; I266-I270 HydrophobicContact CG2-CD1 3.65Å; I266-I270 HydrophobicContact CG2-CG1 4.32Å; I266-I270 WeakPolarHBondContact O-CB 3.36Å; I266-I270 VanDerWaalsContact O-CG1 3.25Å; I266-I270 WeakPolarHBondContact O-CG1 3.5Å; I266-I270 PolarHBondContact O-N 3.12Å |
| 267 | D | 47.4 | Very low | 46.4 | Very low | 41 Ų | 41 | 73.5 Ų | 73.5 | 22% | 0.219 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -61.7 | -42.1 | 176.5 | -74.7 | -23 | 0 | 0 | 0 | 111.1 | R97 V263 I270 L271 | R97-D267 IonicContact CZ-OD2 2.87Å; R97-D267 IonicContact NH1-OD2 2.61Å; R97-D267 PolarHBondContact NH1-OD2 3.12Å; R97-D267 IonicContact NH2-OD2 3.73Å; R97-D267 PolarHBondContact NH2-OD2 2.95Å; V263-D267 WeakPolarHBondContact O-CB 3.33Å; V263-D267 VanDerWaalsContact O-CG 3.25Å; V263-D267 PolarHBondContact O-N 3.13Å; D267-I270 PolarHBondContact O-N 3.49Å; D267-L271 VanDerWaalsContact O-CB 3.28Å; D267-L271 WeakPolarHBondContact O-CB 3.49Å; D267-L271 WeakPolarHBondContact O-CD1 3.39Å; D267-L271 WeakPolarHBondContact O-CG 3.32Å; D267-L271 PolarHBondContact O-N 3Å |
| 268 | T | 46.2 | Very low | 46.8 | Very low | 95 Ų | 95 | 74.1 Ų | 74.1 | 58% | 0.583 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -64.7 | -41.3 | 176.2 | -54.6 | 0 | 0 | 0 | 0 | 111.2 | C264 A265 I266 L271 S272 | C264-T268 VanDerWaalsContact O-CB 3.3Å; C264-T268 WeakPolarHBondContact O-CB 3.47Å; C264-T268 PolarHBondContact O-N 3.39Å; C264-T268 PolarHBondContact O-OG1 3.01Å; A265-T268 PolarHBondContact O-N 3.43Å; I266-T268 VanDerWaalsContact C-N 3.32Å; I266-T268 PolarHBondContact O-N 3.31Å; T268-L271 PolarHBondContact O-N 3.12Å; T268-S272 VanDerWaalsContact O-CB 3.26Å; T268-S272 WeakPolarHBondContact O-CB 3.44Å; T268-S272 PolarHBondContact O-N 2.87Å |
| 269 | L | 48.5 | Very low | 47 | Very low | 95 Ų | 95 | 76.2 Ų | 76.2 | 50% | 0.497 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63 | -46.5 | 174.7 | -99.2 | 156.5 | 0 | 0 | 0 | 111.9 | A265 I266 S272 L273 | A265-L269 WeakPolarHBondContact O-CB 3.13Å; A265-L269 PolarHBondContact O-N 3.19Å; I266-L269 WeakPolarHBondContact O-CB 3.27Å; I266-L269 PolarHBondContact O-N 3.48Å; L269-S272 PolarHBondContact O-N 3.33Å; L269-L273 HydrophobicContact CD2-CD1 4.43Å; L269-L273 WeakPolarHBondContact O-CB 3.46Å; L269-L273 WeakPolarHBondContact O-CD1 3.31Å; L269-L273 PolarHBondContact O-N 3.31Å |
| 270 | I | 50.1 | Low | 46.7 | Very low | 49 Ų | 49 | 77 Ų | 77 | 25% | 0.251 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.4 | -45.9 | 178 | -69.6 | 168.7 | 0 | 0 | 0 | 110.1 | L245 L249 I266 D267 L273 M274 | L245-I270 HydrophobicContact CD2-CD1 3.96Å; L245-I270 HydrophobicContact CD2-CG1 4.35Å; L249-I270 HydrophobicContact CD1-CD1 4.13Å; I266-I270 HydrophobicContact CG2-CD1 3.65Å; I266-I270 HydrophobicContact CG2-CG1 4.32Å; I266-I270 WeakPolarHBondContact O-CB 3.36Å; I266-I270 VanDerWaalsContact O-CG1 3.25Å; I266-I270 WeakPolarHBondContact O-CG1 3.5Å; I266-I270 PolarHBondContact O-N 3.12Å; D267-I270 PolarHBondContact O-N 3.49Å; I270-L273 PolarHBondContact O-N 3.32Å; I270-M274 HydrophobicContact CG2-CG 4.47Å; I270-M274 HydrophobicContact CG2-SD 4.13Å; I270-M274 WeakPolarHBondContact O-CB 3.31Å; I270-M274 VanDerWaalsContact O-CG 3.26Å; I270-M274 WeakPolarHBondContact O-CG 3.33Å; I270-M274 PolarHBondContact O-N 3.05Å |
| 271 | L | 49.7 | Very low | 46.8 | Very low | 84 Ų | 84 | 78 Ų | 78 | 44% | 0.44 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -67.4 | -38.8 | 178.6 | -82.3 | 156.4 | 0 | 0 | 0 | 112.7 | D267 T268 M274 M275 | D267-L271 VanDerWaalsContact O-CB 3.28Å; D267-L271 WeakPolarHBondContact O-CB 3.49Å; D267-L271 WeakPolarHBondContact O-CD1 3.39Å; D267-L271 WeakPolarHBondContact O-CG 3.32Å; D267-L271 PolarHBondContact O-N 3Å; T268-L271 PolarHBondContact O-N 3.12Å; L271-M274 PolarHBondContact O-N 3.14Å; L271-M275 PolarHBondContact O-N 3.43Å |
| 272 | S | 49.8 | Very low | 46.8 | Very low | 49 Ų | 49 | 75.7 Ų | 75.7 | 34% | 0.343 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.8 | -45.5 | 173.3 | -165 | 0 | 0 | 0 | 0 | 110.6 | T268 L269 M274 M275 D276 | T268-S272 VanDerWaalsContact O-CB 3.26Å; T268-S272 WeakPolarHBondContact O-CB 3.44Å; T268-S272 PolarHBondContact O-N 2.87Å; L269-S272 PolarHBondContact O-N 3.33Å; S272-M274 VanDerWaalsContact C-N 3.34Å; S272-M274 PolarHBondContact O-N 2.94Å; S272-M275 PolarHBondContact O-N 2.86Å; S272-D276 WeakPolarHBondContact O-CB 3.34Å; S272-D276 PolarHBondContact O-N 3.19Å |
| 273 | L | 49.8 | Very low | 46.5 | Very low | 68 Ų | 68 | 75.1 Ų | 75.1 | 36% | 0.356 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61 | -41.6 | 174.2 | -102.7 | 125.5 | 0 | 0 | 0 | 112 | L235 L269 I270 D276 L277 | L235-L273 HydrophobicContact CD1-CD2 3.65Å; L269-L273 HydrophobicContact CD2-CD1 4.43Å; L269-L273 WeakPolarHBondContact O-CB 3.46Å; L269-L273 WeakPolarHBondContact O-CD1 3.31Å; L269-L273 PolarHBondContact O-N 3.31Å; I270-L273 PolarHBondContact O-N 3.32Å; L273-D276 PolarHBondContact O-N 2.92Å; L273-L277 VanDerWaalsContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CB 3.46Å; L273-L277 WeakPolarHBondContact O-CD1 3.39Å; L273-L277 WeakPolarHBondContact O-CG 3.33Å; L273-L277 PolarHBondContact O-N 3.22Å |
| 274 | M | 49.6 | Very low | 46.3 | Very low | 91 Ų | 91 | 77.6 Ų | 77.6 | 45% | 0.448 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.4 | -37 | 176 | -74.6 | -178.7 | 72.1 | 0 | 0 | 112.3 | I270 L271 S272 R278 | I270-M274 HydrophobicContact CG2-CG 4.47Å; I270-M274 HydrophobicContact CG2-SD 4.13Å; I270-M274 WeakPolarHBondContact O-CB 3.31Å; I270-M274 VanDerWaalsContact O-CG 3.26Å; I270-M274 WeakPolarHBondContact O-CG 3.33Å; I270-M274 PolarHBondContact O-N 3.05Å; L271-M274 PolarHBondContact O-N 3.14Å; S272-M274 VanDerWaalsContact C-N 3.34Å; S272-M274 PolarHBondContact O-N 2.94Å; M274-R278 VanDerWaalsContact O-CB 3.3Å; M274-R278 WeakPolarHBondContact O-CB 3.45Å; M274-R278 PolarHBondContact O-N 3.39Å |
| 275 | M | 52.2 | Low | 46.1 | Very low | 74 Ų | 74 | 77.5 Ų | 77.5 | 37% | 0.365 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -69.6 | -43.9 | 175.1 | -81.9 | -162.3 | 152.7 | 0 | 0 | 112.3 | F93 L271 S272 L277 R278 N279 | F93-M275 HydrophobicContact CE1-CE 3.34Å; F93-M275 HydrophobicContact CE1-SD 3.72Å; F93-M275 HydrophobicContact CZ-CE 3.57Å; F93-M275 HydrophobicContact CZ-SD 3.55Å; F93-M275 VanDerWaalsContact CZ-SD 3.55Å; L271-M275 PolarHBondContact O-N 3.43Å; S272-M275 PolarHBondContact O-N 2.86Å; M275-L277 VanDerWaalsContact C-N 3.3Å; M275-L277 PolarHBondContact O-N 3.4Å; M275-R278 PolarHBondContact O-N 3.42Å; M275-R278 VanDerWaalsContact O-N 3.17Å; M275-N279 WeakPolarHBondContact O-CB 3.3Å; M275-N279 VanDerWaalsContact O-CG 3.26Å; M275-N279 PolarHBondContact O-N 3.48Å; M275-N279 PolarHBondContact O-ND2 2.97Å |
| 276 | D | 48.9 | Very low | 45.9 | Very low | 80 Ų | 80 | 79.6 Ų | 79.6 | 43% | 0.428 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 176.3 | -71.7 | -26.4 | 0 | 0 | 0 | 110.8 | S272 L273 N279 L280 | S272-D276 WeakPolarHBondContact O-CB 3.34Å; S272-D276 PolarHBondContact O-N 3.19Å; L273-D276 PolarHBondContact O-N 2.92Å; D276-N279 PolarHBondContact O-N 2.85Å; D276-L280 WeakPolarHBondContact O-CB 3.48Å; D276-L280 PolarHBondContact O-N 2.98Å |
| 277 | L | 47 | Very low | 45.5 | Very low | 71 Ų | 71 | 81.6 Ų | 81.6 | 37% | 0.372 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65.8 | -37.8 | 173.2 | -72.9 | 166.5 | 0 | 0 | 0 | 112.5 | L235 L273 M275 L280 Q281 | L235-L277 HydrophobicContact CD2-CD1 3.68Å; L273-L277 VanDerWaalsContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CB 3.46Å; L273-L277 WeakPolarHBondContact O-CD1 3.39Å; L273-L277 WeakPolarHBondContact O-CG 3.33Å; L273-L277 PolarHBondContact O-N 3.22Å; M275-L277 VanDerWaalsContact C-N 3.3Å; M275-L277 PolarHBondContact O-N 3.4Å; L277-L280 PolarHBondContact O-N 3.43Å; L277-Q281 WeakPolarHBondContact O-CB 3.3Å; L277-Q281 VanDerWaalsContact O-CG 3.32Å; L277-Q281 WeakPolarHBondContact O-CG 3.18Å; L277-Q281 PolarHBondContact O-N 2.77Å |
| 278 | R | 49.4 | Very low | 45.1 | Very low | 142 Ų | 142 | 84.1 Ų | 84.1 | 54% | 0.536 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -71.2 | -37.8 | 177 | -163.5 | -177.6 | -69.8 | -177.3 | -1.7 | 111.6 | M274 M275 Q281 S282 | M274-R278 VanDerWaalsContact O-CB 3.3Å; M274-R278 WeakPolarHBondContact O-CB 3.45Å; M274-R278 PolarHBondContact O-N 3.39Å; M275-R278 PolarHBondContact O-N 3.42Å; M275-R278 VanDerWaalsContact O-N 3.17Å; R278-Q281 PolarHBondContact O-N 3.27Å; R278-S282 VanDerWaalsContact O-CB 3.26Å; R278-S282 WeakPolarHBondContact O-CB 3.43Å; R278-S282 PolarHBondContact O-N 3.44Å |
| 279 | N | 49 | Very low | 44.6 | Very low | 104 Ų | 104 | 86.4 Ų | 86.4 | 56% | 0.556 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -67.2 | -38.8 | 172.7 | -71.6 | -22.8 | 0 | 0 | 0 | 111.2 | M275 D276 S282 A283 | M275-N279 WeakPolarHBondContact O-CB 3.3Å; M275-N279 VanDerWaalsContact O-CG 3.26Å; M275-N279 PolarHBondContact O-N 3.48Å; M275-N279 PolarHBondContact O-ND2 2.97Å; D276-N279 PolarHBondContact O-N 2.85Å; N279-S282 PolarHBondContact O-N 3.5Å; N279-A283 VanDerWaalsContact O-CB 3.3Å; N279-A283 WeakPolarHBondContact O-CB 3.41Å; N279-A283 PolarHBondContact O-N 3.39Å |
| 280 | L | 40.1 | Very low | 43.7 | Very low | 90 Ų | 90 | 86 Ų | 86 | 47% | 0.471 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.3 | -45 | 174.2 | -165.9 | 77.4 | 0 | 0 | 0 | 111 | D276 L277 S282 A283 I284 | D276-L280 WeakPolarHBondContact O-CB 3.48Å; D276-L280 PolarHBondContact O-N 2.98Å; L277-L280 PolarHBondContact O-N 3.43Å; L280-S282 VanDerWaalsContact C-N 3.35Å; L280-S282 PolarHBondContact O-N 3.23Å; L280-A283 PolarHBondContact O-N 3.4Å; L280-I284 HydrophobicContact CG-CD1 4.05Å; L280-I284 WeakPolarHBondContact O-CB 3.22Å; L280-I284 WeakPolarHBondContact O-CD1 3.43Å; L280-I284 WeakPolarHBondContact O-CG1 3.4Å; L280-I284 PolarHBondContact O-N 3.06Å |
| 281 | Q | 43.9 | Very low | 42.9 | Very low | 124 Ų | 124 | 86.5 Ų | 86.5 | 58% | 0.579 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.9 | -41.1 | 173.5 | -80.7 | -179.3 | -19.2 | 0 | 0 | 112 | L277 R278 I284 A285 | L277-Q281 WeakPolarHBondContact O-CB 3.3Å; L277-Q281 VanDerWaalsContact O-CG 3.32Å; L277-Q281 WeakPolarHBondContact O-CG 3.18Å; L277-Q281 PolarHBondContact O-N 2.77Å; R278-Q281 PolarHBondContact O-N 3.27Å; Q281-I284 PolarHBondContact O-N 3.08Å; Q281-A285 VanDerWaalsContact O-CB 3.22Å; Q281-A285 WeakPolarHBondContact O-CB 3.47Å; Q281-A285 PolarHBondContact O-N 3.05Å |
| 282 | S | 43.6 | Very low | 41.9 | Very low | 66 Ų | 66 | 92.2 Ų | 92.2 | 46% | 0.462 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.1 | -46.5 | 173.6 | 177.4 | 0 | 0 | 0 | 0 | 111.3 | R278 N279 L280 I284 A285 T286 | R278-S282 VanDerWaalsContact O-CB 3.26Å; R278-S282 WeakPolarHBondContact O-CB 3.43Å; R278-S282 PolarHBondContact O-N 3.44Å; N279-S282 PolarHBondContact O-N 3.5Å; L280-S282 VanDerWaalsContact C-N 3.35Å; L280-S282 PolarHBondContact O-N 3.23Å; S282-I284 VanDerWaalsContact C-N 3.3Å; S282-I284 PolarHBondContact O-N 3.42Å; S282-A285 PolarHBondContact O-N 3.28Å; S282-T286 WeakPolarHBondContact O-CG2 3.39Å; S282-T286 PolarHBondContact O-N 3.17Å; S282-T286 PolarHBondContact O-OG1 2.94Å |
| 283 | A | 35.6 | Very low | 41.1 | Very low | 43 Ų | 43 | 94.4 Ų | 94.4 | 36% | 0.355 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.6 | -35.5 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | N279 L280 T286 N287 | N279-A283 VanDerWaalsContact O-CB 3.3Å; N279-A283 WeakPolarHBondContact O-CB 3.41Å; N279-A283 PolarHBondContact O-N 3.39Å; L280-A283 PolarHBondContact O-N 3.4Å; A283-T286 WeakPolarHBondContact CA-OG1 3.28Å; A283-T286 PolarHBondContact O-OG1 3.49Å; A283-N287 WeakPolarHBondContact O-CB 3.39Å; A283-N287 PolarHBondContact O-N 3.2Å; A283-N287 PolarHBondContact O-ND2 3.01Å |
| 284 | I | 38.1 | Very low | 40.3 | Very low | 111 Ų | 111 | 99.1 Ų | 99.1 | 57% | 0.569 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -70.2 | -40.8 | 173.9 | -67.3 | 164 | 0 | 0 | 0 | 110.8 | L280 Q281 S282 N287 | L280-I284 HydrophobicContact CG-CD1 4.05Å; L280-I284 WeakPolarHBondContact O-CB 3.22Å; L280-I284 WeakPolarHBondContact O-CD1 3.43Å; L280-I284 WeakPolarHBondContact O-CG1 3.4Å; L280-I284 PolarHBondContact O-N 3.06Å; Q281-I284 PolarHBondContact O-N 3.08Å; S282-I284 VanDerWaalsContact C-N 3.3Å; S282-I284 PolarHBondContact O-N 3.42Å; I284-N287 PolarHBondContact O-N 3.26Å |
| 285 | A | 38.2 | Very low | 39.7 | Very low | 67 Ų | 67 | 100.7 Ų | 100.7 | 55% | 0.554 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -74.3 | -24.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q281 S282 S288 | Q281-A285 VanDerWaalsContact O-CB 3.22Å; Q281-A285 WeakPolarHBondContact O-CB 3.47Å; Q281-A285 PolarHBondContact O-N 3.05Å; S282-A285 PolarHBondContact O-N 3.28Å; A285-S288 PolarHBondContact O-OG 3.31Å |
| 286 | T | 39.8 | Very low | 38.9 | Very low | 92 Ų | 92 | 100.4 Ų | 100.4 | 56% | 0.564 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -86.1 | -17 | 173.5 | 52 | 0 | 0 | 0 | 0 | 113.1 | S282 A283 | S282-T286 WeakPolarHBondContact O-CG2 3.39Å; S282-T286 PolarHBondContact O-N 3.17Å; S282-T286 PolarHBondContact O-OG1 2.94Å; A283-T286 WeakPolarHBondContact CA-OG1 3.28Å; A283-T286 PolarHBondContact O-OG1 3.49Å |
| 287 | N | 39.5 | Very low | 38.4 | Very low | 77 Ų | 77 | 99.7 Ų | 99.7 | 41% | 0.412 | 59% | 0.585 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92.7 | 7.2 | 178.1 | -76.2 | -13.3 | 0 | 0 | 0 | 113.6 | A283 I284 D289 | A283-N287 WeakPolarHBondContact O-CB 3.39Å; A283-N287 PolarHBondContact O-N 3.2Å; A283-N287 PolarHBondContact O-ND2 3.01Å; I284-N287 PolarHBondContact O-N 3.26Å; N287-D289 PolarHBondContact O-N 3.43Å |
| 288 | S | 37.7 | Very low | 37.8 | Very low | 95 Ų | 95 | 100.5 Ų | 100.5 | 66% | 0.664 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -8.1 | 171.7 | 48.9 | 0 | 0 | 0 | 0 | 113.9 | A285 | A285-S288 PolarHBondContact O-OG 3.31Š|
| 289 | D | 35.8 | Very low | 37.3 | Very low | 143 Ų | 143 | 99.7 Ų | 99.7 | 77% | 0.765 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -100.4 | 82.4 | 167.6 | -81 | -31.7 | 0 | 0 | 0 | 110.8 | N287 A291 | N287-D289 PolarHBondContact O-N 3.43Å; D289-A291 VanDerWaalsContact C-N 3.3Å; D289-A291 PolarHBondContact O-N 3.37Å |
| 290 | G | 29.9 | Very low | 36.9 | Very low | 87 Ų | 87 | 100.3 Ų | 100.3 | 90% | 0.897 | 60% | 0.599 | S | S | * | * | S | Bend | trans | 62.5 | -0.5 | 145.7 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||
| 291 | A | 32.9 | Very low | 36.8 | Very low | 58 Ų | 58 | 100.4 Ų | 100.4 | 48% | 0.479 | 60% | 0.6 | S | S | . | * | trans | -115.8 | 113.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | D289 T293 | D289-A291 VanDerWaalsContact C-N 3.3Å; D289-A291 PolarHBondContact O-N 3.37Å; A291-T293 PolarHBondContact O-N 3.17Å; A291-T293 VanDerWaalsContact O-N 3.08Å | ||
| 292 | Q | 28.9 | Very low | 36.4 | Very low | 205 Ų | 205 | 97.2 Ų | 97.2 | 96% | 0.958 | 59% | 0.589 | S | S | * | * | trans | -66.2 | 98.9 | 167.4 | -69.9 | 179.5 | 2.5 | 0 | 0 | 109.7 | ||||
| 293 | T | 34 | Very low | 36.3 | Very low | 95 Ų | 95 | 97 Ų | 97 | 58% | 0.583 | 59% | 0.591 | S | S | * | * | trans | -132.7 | 115.5 | 170 | 20.2 | 0 | 0 | 0 | 0 | 111.4 | A291 V295 | A291-T293 PolarHBondContact O-N 3.17Å; A291-T293 VanDerWaalsContact O-N 3.08Å; T293-V295 PolarHBondContact O-N 2.97Å | ||
| 294 | L | 32.9 | Very low | 36.8 | Very low | 167 Ų | 167 | 102.2 Ų | 102.2 | 87% | 0.874 | 61% | 0.605 | S | S | * | * | trans | -10.6 | 106.4 | 175.8 | -77.5 | 82.3 | 0 | 0 | 0 | 116.3 | ||||
| 295 | V | 35.2 | Very low | 36.9 | Very low | 123 Ų | 123 | 101 Ų | 101 | 75% | 0.745 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 126.3 | 154.8 | 176.9 | 0 | 0 | 0 | 0 | 107.4 | T293 S297 | T293-V295 PolarHBondContact O-N 2.97Å; V295-S297 PolarHBondContact O-N 3.04Å; V295-S297 VanDerWaalsContact O-N 3.13Å |
| 296 | P | 36.6 | Very low | 36.8 | Very low | 69 Ų | 69 | 100.4 Ų | 100.4 | 45% | 0.448 | 59% | 0.594 | S | S | . | * | P | Polyproline II helix | trans | -56.9 | 124.2 | 173.6 | 22.8 | -30.9 | 0 | 0 | 0 | 107.8 | T298 L301 | P296-T298 PolarHBondContact O-N 2.83Å; P296-L301 HydrophobicContact CG-CD1 4.43Å |
| 297 | S | 37.3 | Very low | 37 | Very low | 64 Ų | 64 | 98.8 Ų | 98.8 | 45% | 0.448 | 59% | 0.59 | S | S | . | * | P | Polyproline II helix | trans | -52.1 | 143.9 | -178.4 | 68.5 | 0 | 0 | 0 | 0 | 109.7 | V295 N299 E300 | V295-S297 PolarHBondContact O-N 3.04Å; V295-S297 VanDerWaalsContact O-N 3.13Å; S297-N299 PolarHBondContact O-N 2.7Å; S297-E300 PolarHBondContact O-N 3.12Å |
| 298 | T | 35.4 | Very low | 37.1 | Very low | 88 Ų | 88 | 101.3 Ų | 101.3 | 54% | 0.54 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -45.7 | -25.2 | 178.5 | 6.6 | 0 | 0 | 0 | 0 | 113.2 | P296 T302 | P296-T298 PolarHBondContact O-N 2.83Å; T298-T302 WeakPolarHBondContact O-CB 3.44Å; T298-T302 PolarHBondContact O-N 3.47Å; T298-T302 PolarHBondContact O-OG1 3.37Å |
| 299 | N | 37.9 | Very low | 37 | Very low | 125 Ų | 125 | 99.5 Ų | 99.5 | 67% | 0.668 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -72.4 | -36.1 | 177.6 | -65.2 | -18.8 | 0 | 0 | 0 | 114 | S297 A303 | S297-N299 PolarHBondContact O-N 2.7Å; N299-A303 WeakPolarHBondContact O-CB 3.45Å; N299-A303 PolarHBondContact O-N 2.94Å |
| 300 | E | 42 | Very low | 37.2 | Very low | 118 Ų | 118 | 98.4 Ų | 98.4 | 55% | 0.551 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -73.2 | -39.4 | -179.7 | -79.9 | -171.3 | 137 | 0 | 0 | 112.6 | S297 A303 K304 | S297-E300 PolarHBondContact O-N 3.12Å; E300-A303 PolarHBondContact O-N 3.28Å; E300-K304 PolarHBondContact O-N 2.82Å |
| 301 | L | 37.5 | Very low | 37.6 | Very low | 92 Ų | 92 | 98.1 Ų | 98.1 | 48% | 0.482 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -67.7 | -40.7 | 176.5 | -139.6 | 100.2 | 0 | 0 | 0 | 110.7 | P296 A303 K304 I305 | P296-L301 HydrophobicContact CG-CD1 4.43Å; L301-A303 VanDerWaalsContact C-N 3.35Å; L301-A303 PolarHBondContact O-N 3.48Å; L301-K304 PolarHBondContact O-N 2.96Å; L301-I305 HydrophobicContact CD2-CD1 4.2Å; L301-I305 VanDerWaalsContact O-CG1 3.31Å; L301-I305 WeakPolarHBondContact O-CG1 3.42Å; L301-I305 PolarHBondContact O-N 3.1Å |
| 302 | T | 35.7 | Very low | 37.7 | Very low | 57 Ų | 57 | 101.2 Ų | 101.2 | 35% | 0.35 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -63.7 | -40.1 | 175.9 | -53.9 | 0 | 0 | 0 | 0 | 111.4 | T298 A306 | T298-T302 WeakPolarHBondContact O-CB 3.44Å; T298-T302 PolarHBondContact O-N 3.47Å; T298-T302 PolarHBondContact O-OG1 3.37Å; T302-A306 VanDerWaalsContact O-CB 3.3Å; T302-A306 WeakPolarHBondContact O-CB 3.35Å; T302-A306 PolarHBondContact O-N 2.79Å |
| 303 | A | 42.5 | Very low | 38 | Very low | 60 Ų | 60 | 96.3 Ų | 96.3 | 50% | 0.496 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.9 | -40 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | N299 E300 L301 A306 A307 | N299-A303 WeakPolarHBondContact O-CB 3.45Å; N299-A303 PolarHBondContact O-N 2.94Å; E300-A303 PolarHBondContact O-N 3.28Å; L301-A303 VanDerWaalsContact C-N 3.35Å; L301-A303 PolarHBondContact O-N 3.48Å; A303-A306 PolarHBondContact O-N 2.96Å; A303-A307 WeakPolarHBondContact O-CB 3.26Å; A303-A307 PolarHBondContact O-N 3.44Å |
| 304 | K | 45.2 | Very low | 38.1 | Very low | 153 Ų | 153 | 103.8 Ų | 103.8 | 67% | 0.665 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -66.3 | -41.6 | 176.6 | -77.3 | -177.4 | 178.3 | 178.4 | 0 | 112.7 | E300 L301 A307 Q308 | E300-K304 PolarHBondContact O-N 2.82Å; L301-K304 PolarHBondContact O-N 2.96Å; K304-A307 PolarHBondContact O-N 3.07Å; K304-Q308 PolarHBondContact O-N 3.2Å; K304-Q308 VanDerWaalsContact O-N 3.09Å |
| 305 | I | 39.4 | Very low | 38.2 | Very low | 85 Ų | 85 | 101.4 Ų | 101.4 | 44% | 0.436 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67.7 | -41.1 | 177.2 | -66.1 | 167.1 | 0 | 0 | 0 | 110.7 | L301 Q308 A309 | L301-I305 HydrophobicContact CD2-CD1 4.2Å; L301-I305 VanDerWaalsContact O-CG1 3.31Å; L301-I305 WeakPolarHBondContact O-CG1 3.42Å; L301-I305 PolarHBondContact O-N 3.1Å; I305-Q308 PolarHBondContact O-N 3.41Å; I305-A309 WeakPolarHBondContact O-CB 3.3Å; I305-A309 PolarHBondContact O-N 3.47Å |
| 306 | A | 37.1 | Very low | 38.3 | Very low | 55 Ų | 55 | 100 Ų | 100 | 46% | 0.455 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -62.6 | -43.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | T302 A303 Q308 A309 T310 | T302-A306 VanDerWaalsContact O-CB 3.3Å; T302-A306 WeakPolarHBondContact O-CB 3.35Å; T302-A306 PolarHBondContact O-N 2.79Å; A303-A306 PolarHBondContact O-N 2.96Å; A306-Q308 PolarHBondContact O-N 3.43Å; A306-A309 PolarHBondContact O-N 3.48Å; A306-T310 PolarHBondContact O-N 3.38Å; A306-T310 VanDerWaalsContact O-N 3.12Å; A306-T310 PolarHBondContact O-OG1 2.89Å |
| 307 | A | 43.1 | Very low | 38.3 | Very low | 58 Ų | 58 | 99.4 Ų | 99.4 | 48% | 0.479 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -62.9 | -40.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | A303 K304 T310 A311 | A303-A307 WeakPolarHBondContact O-CB 3.26Å; A303-A307 PolarHBondContact O-N 3.44Å; K304-A307 PolarHBondContact O-N 3.07Å; A307-T310 WeakPolarHBondContact CA-OG1 3.49Å; A307-T310 PolarHBondContact O-OG1 2.81Å; A307-A311 PolarHBondContact O-N 3.19Å |
| 308 | Q | 43.1 | Very low | 38.3 | Very low | 131 Ų | 131 | 100.6 Ų | 100.6 | 61% | 0.612 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -70 | -36.3 | 175.5 | -85.1 | -179.7 | -15.5 | 0 | 0 | 113 | K304 I305 A306 T310 A311 | K304-Q308 PolarHBondContact O-N 3.2Å; K304-Q308 VanDerWaalsContact O-N 3.09Å; I305-Q308 PolarHBondContact O-N 3.41Å; A306-Q308 PolarHBondContact O-N 3.43Å; Q308-T310 VanDerWaalsContact C-N 3.34Å; Q308-T310 PolarHBondContact O-N 2.96Å; Q308-A311 PolarHBondContact O-N 3.36Å |
| 309 | A | 35.6 | Very low | 38.5 | Very low | 56 Ų | 56 | 104.4 Ų | 104.4 | 46% | 0.463 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -67.9 | -32 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | I305 A306 | I305-A309 WeakPolarHBondContact O-CB 3.3Å; I305-A309 PolarHBondContact O-N 3.47Å; A306-A309 PolarHBondContact O-N 3.48Å |
| 310 | T | 39.5 | Very low | 38.6 | Very low | 121 Ų | 121 | 104.8 Ų | 104.8 | 74% | 0.742 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -78.4 | -17.3 | 174.4 | 38.4 | 0 | 0 | 0 | 0 | 114.5 | A306 A307 Q308 | A306-T310 PolarHBondContact O-N 3.38Å; A306-T310 VanDerWaalsContact O-N 3.12Å; A306-T310 PolarHBondContact O-OG1 2.89Å; A307-T310 WeakPolarHBondContact CA-OG1 3.49Å; A307-T310 PolarHBondContact O-OG1 2.81Å; Q308-T310 VanDerWaalsContact C-N 3.34Å; Q308-T310 PolarHBondContact O-N 2.96Å |
| 311 | A | 38.1 | Very low | 38.7 | Very low | 80 Ų | 80 | 104.2 Ų | 104.2 | 66% | 0.661 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -4.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114 | A307 Q308 | A307-A311 PolarHBondContact O-N 3.19Å; Q308-A311 PolarHBondContact O-N 3.36Å |
| 312 | L | 34.3 | Very low | 38.6 | Very low | 123 Ų | 123 | 107.5 Ų | 107.5 | 64% | 0.644 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -71.2 | 122.4 | 174.9 | -83 | 156 | 0 | 0 | 0 | 110.2 | R314 | L312-R314 PolarHBondContact O-N 3.1Å; L312-R314 VanDerWaalsContact O-N 3.15Å |
| 313 | P | 35.4 | Very low | 38.8 | Very low | 103 Ų | 103 | 110.7 Ų | 110.7 | 67% | 0.669 | 61% | 0.614 | S | S | * | * | trans | -63.6 | 118.7 | 179.9 | 24 | -30.9 | 0 | 0 | 0 | 110 | T315 | P313-T315 PolarHBondContact O-N 3.29Š| ||
| 314 | R | 35.9 | Very low | 38.8 | Very low | 252 Ų | 252 | 111.6 Ų | 111.6 | 95% | 0.951 | 62% | 0.622 | S | S | * | * | trans | -72.9 | 74.6 | 164 | -70.7 | -178.7 | 174.9 | 176.1 | -0.3 | 108.4 | L312 A316 | L312-R314 PolarHBondContact O-N 3.1Å; L312-R314 VanDerWaalsContact O-N 3.15Å; R314-A316 PolarHBondContact O-N 3.4Å; R314-A316 VanDerWaalsContact O-N 3.17Å | ||
| 315 | T | 36.6 | Very low | 38.4 | Very low | 117 Ų | 117 | 113.7 Ų | 113.7 | 72% | 0.718 | 63% | 0.627 | S | S | * | * | trans | -74.6 | 105.9 | 169.3 | 32.7 | 0 | 0 | 0 | 0 | 108.8 | P313 V317 | P313-T315 PolarHBondContact O-N 3.29Å; T315-V317 PolarHBondContact O-N 3.17Å; T315-V317 VanDerWaalsContact O-N 3.08Å | ||
| 316 | A | 35.8 | Very low | 38.2 | Very low | 94 Ų | 94 | 113.8 Ų | 113.8 | 78% | 0.777 | 64% | 0.635 | S | S | * | * | trans | -64.1 | 102.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | R314 T318 | R314-A316 PolarHBondContact O-N 3.4Å; R314-A316 VanDerWaalsContact O-N 3.17Å; A316-T318 PolarHBondContact O-N 3.16Å | ||
| 317 | V | 36.7 | Very low | 38.1 | Very low | 55 Ų | 55 | 117.9 Ų | 117.9 | 33% | 0.333 | 65% | 0.65 | S | S | . | * | trans | -64.9 | 116.7 | 171.8 | 176.2 | 0 | 0 | 0 | 0 | 108.1 | T315 E321 | T315-V317 PolarHBondContact O-N 3.17Å; T315-V317 VanDerWaalsContact O-N 3.08Å; V317-E321 HydrophobicContact CG1-CB 3.81Å | ||
| 318 | T | 37.6 | Very low | 37.5 | Very low | 90 Ų | 90 | 123.7 Ų | 123.7 | 55% | 0.552 | 67% | 0.667 | S | S | * | * | trans | -66 | 152.9 | 176.9 | 48.7 | 0 | 0 | 0 | 0 | 110.4 | A316 D320 E321 | A316-T318 PolarHBondContact O-N 3.16Å; T318-D320 PolarHBondContact O-N 3.26Å; T318-D320 VanDerWaalsContact O-N 3.16Å; T318-E321 PolarHBondContact O-N 3.22Å; T318-E321 VanDerWaalsContact O-N 3.17Å | ||
| 319 | Q | 38.7 | Very low | 36.9 | Very low | 168 Ų | 168 | 123 Ų | 123 | 79% | 0.785 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.1 | -21.2 | -172.8 | -151.4 | 166.5 | -9.5 | 0 | 0 | 112.9 | R322 | Q319-R322 WeakPolarHBondContact O-CB 3.15Å; Q319-R322 PolarHBondContact O-N 3.23Å |
| 320 | D | 40.7 | Very low | 36.7 | Very low | 133 Ų | 133 | 125.5 Ų | 125.5 | 71% | 0.711 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | -34.4 | 175 | -83.5 | -47.9 | 0 | 0 | 0 | 113.8 | T318 R322 L323 | T318-D320 PolarHBondContact O-N 3.26Å; T318-D320 VanDerWaalsContact O-N 3.16Å; D320-R322 PolarHBondContact O-N 3.31Å; D320-L323 PolarHBondContact O-N 3.27Å |
| 321 | E | 43.4 | Very low | 36.1 | Very low | 106 Ų | 106 | 126.3 Ų | 126.3 | 50% | 0.495 | 69% | 0.693 | S | S | . | * | H | α-helix | trans | -68.9 | -21 | 174.1 | -77.9 | -176.1 | 142.5 | 0 | 0 | 111.8 | V317 T318 L323 Y325 | V317-E321 HydrophobicContact CG1-CB 3.81Å; T318-E321 PolarHBondContact O-N 3.22Å; T318-E321 VanDerWaalsContact O-N 3.17Å; E321-L323 VanDerWaalsContact C-N 3.31Å; E321-L323 PolarHBondContact O-N 3.24Å; E321-Y325 WeakPolarHBondContact O-CD2 3.18Å |
| 322 | R | 36.7 | Very low | 35.6 | Very low | 160 Ų | 160 | 131.2 Ų | 131.2 | 60% | 0.604 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -70.6 | -24.1 | 175.6 | -74.1 | -175 | 168.2 | -156.4 | -6.2 | 113.7 | Q319 D320 | Q319-R322 WeakPolarHBondContact O-CB 3.15Å; Q319-R322 PolarHBondContact O-N 3.23Å; D320-R322 PolarHBondContact O-N 3.31Å |
| 323 | L | 40.1 | Very low | 35.3 | Very low | 124 Ų | 124 | 131.8 Ų | 131.8 | 65% | 0.649 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -86 | -25.7 | -178.5 | -76.9 | 159.9 | 0 | 0 | 0 | 112.5 | D320 E321 Y325 | D320-L323 PolarHBondContact O-N 3.27Å; E321-L323 VanDerWaalsContact C-N 3.31Å; E321-L323 PolarHBondContact O-N 3.24Å; L323-Y325 PolarHBondContact O-N 2.71Å |
| 324 | A | 40.9 | Very low | 35.1 | Very low | 80 Ų | 80 | 133 Ų | 133 | 66% | 0.661 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -72.6 | -25.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 325 | Y | 37.3 | Very low | 34.9 | Very low | 196 Ų | 196 | 126.8 Ų | 126.8 | 77% | 0.769 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | 0.9 | -178.5 | -73 | -81.4 | 0 | 0 | 0 | 114.5 | E321 L323 N327 | E321-Y325 WeakPolarHBondContact O-CD2 3.18Å; L323-Y325 PolarHBondContact O-N 2.71Å; Y325-N327 VanDerWaalsContact C-N 3.33Å; Y325-N327 PolarHBondContact O-N 3.06Å |
| 326 | S | 36.2 | Very low | 34.6 | Very low | 87 Ų | 87 | 128 Ų | 128 | 61% | 0.608 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | -9.3 | -176.6 | -179.4 | 0 | 0 | 0 | 0 | 114.7 | ||
| 327 | N | 33.5 | Very low | 34.5 | Very low | 142 Ų | 142 | 129.3 Ų | 129.3 | 76% | 0.759 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.5 | 19.1 | -165.9 | -75.5 | -20 | 0 | 0 | 0 | 115.5 | Y325 | Y325-N327 VanDerWaalsContact C-N 3.33Å; Y325-N327 PolarHBondContact O-N 3.06Å |
| 328 | Q | 31 | Very low | 34.3 | Very low | 180 Ų | 180 | 130.5 Ų | 130.5 | 84% | 0.841 | 70% | 0.699 | S | S | * | * | trans | -106.3 | 120.6 | 170.6 | -77.8 | -158.3 | -16.8 | 0 | 0 | 112.1 | S330 | Q328-S330 PolarHBondContact O-N 3.45Š| ||
| 329 | P | 30.3 | Very low | 34.1 | Very low | 116 Ų | 116 | 133.1 Ų | 133.1 | 75% | 0.753 | 71% | 0.709 | S | S | * | * | trans | -70.5 | 119.9 | 174.1 | 27.5 | -30.3 | 0 | 0 | 0 | 109.9 | T331 | P329-T331 PolarHBondContact O-N 2.87Å; P329-T331 VanDerWaalsContact O-N 3.1Å | ||
| 330 | S | 31 | Very low | 34 | Very low | 109 Ų | 109 | 129.1 Ų | 129.1 | 76% | 0.762 | 70% | 0.704 | S | S | * | * | trans | -69.5 | 97.5 | 171.8 | 54.9 | 0 | 0 | 0 | 0 | 110.3 | Q328 F332 | Q328-S330 PolarHBondContact O-N 3.45Å; S330-F332 PolarHBondContact O-N 2.99Å | ||
| 331 | T | 28.3 | Very low | 33.7 | Very low | 138 Ų | 138 | 130.1 Ų | 130.1 | 85% | 0.847 | 70% | 0.704 | S | S | * | * | trans | -79.7 | 74.4 | 165.9 | 38.5 | 0 | 0 | 0 | 0 | 109.8 | P329 N333 | P329-T331 PolarHBondContact O-N 2.87Å; P329-T331 VanDerWaalsContact O-N 3.1Å; T331-N333 PolarHBondContact O-N 3.18Å | ||
| 332 | F | 28 | Very low | 33 | Very low | 183 Ų | 183 | 128.8 Ų | 128.8 | 80% | 0.803 | 72% | 0.718 | S | S | * | * | trans | -81.5 | 100.1 | 160.7 | -112.9 | -91.3 | 0 | 0 | 0 | 107.4 | S330 L334 | S330-F332 PolarHBondContact O-N 2.99Å; F332-L334 PolarHBondContact O-N 3.41Å; F332-L334 VanDerWaalsContact O-N 3.12Å | ||
| 333 | N | 27.6 | Very low | 32.9 | Very low | 134 Ų | 134 | 130.5 Ų | 130.5 | 72% | 0.717 | 73% | 0.73 | S | S | * | * | trans | -76.6 | 98.6 | 176.9 | -142.1 | -20.9 | 0 | 0 | 0 | 108.4 | T331 D335 | T331-N333 PolarHBondContact O-N 3.18Å; N333-D335 PolarHBondContact O-N 2.85Å | ||
| 334 | L | 31.2 | Very low | 32.6 | Very low | 130 Ų | 130 | 130.1 Ų | 130.1 | 68% | 0.681 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -75.2 | 2.4 | -177.2 | -95.2 | 148.2 | 0 | 0 | 0 | 113.8 | F332 L336 | F332-L334 PolarHBondContact O-N 3.41Å; F332-L334 VanDerWaalsContact O-N 3.12Å; L334-L336 PolarHBondContact O-N 2.92Å |
| 335 | D | 30.2 | Very low | 32.2 | Very low | 120 Ų | 120 | 133.6 Ų | 133.6 | 64% | 0.642 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -79.4 | -8.6 | -171.5 | -75.9 | -23.2 | 0 | 0 | 0 | 115.5 | N333 | N333-D335 PolarHBondContact O-N 2.85Š|
| 336 | L | 31.6 | Very low | 32.3 | Very low | 143 Ų | 143 | 133.4 Ų | 133.4 | 75% | 0.749 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -90.5 | -6.4 | -179.2 | -99.4 | 154.1 | 0 | 0 | 0 | 115.1 | L334 | L334-L336 PolarHBondContact O-N 2.92Š|
| 337 | I | 34.2 | Very low | 32.4 | Very low | 122 Ų | 122 | 140.3 Ų | 140.3 | 63% | 0.626 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -86.9 | -17.4 | 174 | -61.2 | 176.6 | 0 | 0 | 0 | 111.3 | L339 | I337-L339 VanDerWaalsContact C-N 3.34Š|
| 338 | A | 31.9 | Very low | 32.7 | Very low | 80 Ų | 80 | 138 Ų | 138 | 66% | 0.661 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -77.5 | -16.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 339 | L | 32.4 | Very low | 33.3 | Very low | 145 Ų | 145 | 138.4 Ų | 138.4 | 76% | 0.759 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -93.7 | -12.2 | -178.8 | -91.7 | 145.6 | 0 | 0 | 0 | 114.3 | I337 | I337-L339 VanDerWaalsContact C-N 3.34Š|
| 340 | A | 37.2 | Very low | 34.3 | Very low | 83 Ų | 83 | 142.2 Ų | 142.2 | 69% | 0.686 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -90.8 | -10.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 341 | H | 34.6 | Very low | 34.4 | Very low | 155 Ų | 155 | 143.9 Ų | 143.9 | 72% | 0.718 | 79% | 0.789 | S | S | * | * | trans | -104.4 | 75.2 | 172.3 | -72.3 | -65.7 | 0 | 0 | 0 | 110.5 | K343 | H341-K343 PolarHBondContact O-N 3.25Š| ||
| 342 | G | 29.3 | Very low | 34.7 | Very low | 77 Ų | 77 | 144.2 Ų | 144.2 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | -61.1 | 94.5 | 165.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 343 | K | 34.3 | Very low | 35.1 | Very low | 196 Ų | 196 | 142 Ų | 142 | 85% | 0.852 | 79% | 0.785 | S | S | * | * | trans | -93.4 | 124.7 | 155.3 | -90.1 | -173 | 175.6 | 179.4 | 0 | 108.6 | H341 | H341-K343 PolarHBondContact O-N 3.25Š| ||
| 344 | P | 33.9 | Very low | 35.6 | Very low | 117 Ų | 117 | 142.5 Ų | 142.5 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | trans | -80 | 142.5 | 174.5 | 33.2 | -31.1 | 0 | 0 | 0 | 110.4 | ||||
| 345 | N | 31.3 | Very low | 35.8 | Very low | 153 Ų | 153 | 143.3 Ų | 143.3 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | 42.3 | 113.5 | 139.9 | -106.4 | -9.5 | 0 | 0 | 0 | 119.1 | ||||
| 346 | Q | 39.9 | Very low | 36.2 | Very low | 192 Ų | 192 | 144.8 Ų | 144.8 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | -159 | 102.5 | 123.9 | -67.4 | -156.9 | 2.2 | 0 | 0 | 106.5 | |||||
| 347 | R | 39.5 | Very low | 36.5 | Very low | 231 Ų | 231 | 144.9 Ų | 144.9 | 87% | 0.872 | 81% | 0.81 | S | S | * | * | 59.5 | 123 | 88.2 | -133.9 | -177.7 | -165.3 | 176.7 | 3.2 | 113.9 | |||||
| 348 | S | 38.7 | Very low | 36.7 | Very low | 94 Ų | 94 | 146.7 Ų | 146.7 | 66% | 0.657 | 83% | 0.825 | S | S | * | * | trans | 103.2 | 102.5 | 147.3 | -52.4 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 349 | Q | 44.7 | Very low | 37.1 | Very low | 189 Ų | 189 | 152.3 Ų | 152.3 | 88% | 0.883 | 84% | 0.838 | S | S | * | * | 53.8 | 104.8 | 120.5 | -65.3 | -177.4 | -13.2 | 0 | 0 | 118.9 | |||||
| 350 | S | 49.6 | Very low | 37.5 | Very low | 195 Ų | 195 | 152.9 Ų | 152.9 | 100% | 1.364 | 85% | 0.846 | S | S | * | * | -167.2 | 0 | 115.8 | 56.6 | 0 | 0 | 0 | 0 | 109.3 |
Retrieved 350 of 350 residues in 153.8 ms
(Link to these results)