| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 36.1 | Very low | 31.9 | Very low | 228 Ų | 228 | 158.5 Ų | 158.5 | 100% | 1.123 | 84% | 0.841 | S | S | * | * | 0 | 60.6 | 0 | -77.3 | 171 | 154.8 | 0 | 0 | 106.6 | |||||
| 2 | D | 33 | Very low | 32.4 | Very low | 152 Ų | 152 | 151.4 Ų | 151.4 | 81% | 0.813 | 83% | 0.834 | S | S | * | * | 56.8 | 91.9 | 59.3 | -57.7 | -50.8 | 0 | 0 | 0 | 112.5 | |||||
| 3 | T | 34 | Very low | 32.3 | Very low | 149 Ų | 149 | 148.4 Ų | 148.4 | 91% | 0.914 | 83% | 0.83 | S | S | * | * | trans | -145.8 | 106.5 | 136.9 | 42.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 4 | L | 32.2 | Very low | 32.5 | Very low | 146 Ų | 146 | 148.6 Ų | 148.6 | 76% | 0.764 | 84% | 0.837 | S | S | * | * | trans | -96.7 | 122.4 | 168.2 | -173.1 | 153.7 | 0 | 0 | 0 | 105.2 | E6 | L4-E6 HydrophobicContact CD2-CB 4.11Š| ||
| 5 | E | 34.7 | Very low | 32.9 | Very low | 206 Ų | 206 | 144.6 Ų | 144.6 | 96% | 0.963 | 83% | 0.83 | S | S | * | * | trans | -127.5 | 102.8 | 159.2 | -90.8 | -170.3 | 123.5 | 0 | 0 | 107.9 | ||||
| 6 | E | 32.9 | Very low | 33 | Very low | 171 Ų | 171 | 145.3 Ų | 145.3 | 80% | 0.799 | 83% | 0.829 | S | S | * | * | trans | -123.1 | 116.9 | 170.6 | -167.1 | -174.9 | 179.2 | 0 | 0 | 106.3 | L4 | L4-E6 HydrophobicContact CD2-CB 4.11Š| ||
| 7 | A | 30.1 | Very low | 33.5 | Very low | 86 Ų | 86 | 142.8 Ų | 142.8 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | trans | 175.1 | 134.1 | 161.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 8 | T | 27.4 | Very low | 34.1 | Very low | 113 Ų | 113 | 141.3 Ų | 141.3 | 69% | 0.693 | 82% | 0.816 | S | S | * | * | cis | -177.8 | 133.2 | 1.5 | 21.8 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 9 | W | 28.5 | Very low | 34.3 | Very low | 246 Ų | 246 | 140.3 Ų | 140.3 | 93% | 0.932 | 82% | 0.815 | S | S | * | * | trans | 59.9 | 151.2 | 146.1 | -66.4 | 64.1 | 0 | 0 | 0 | 119.6 | ||||
| 10 | A | 29.9 | Very low | 34.6 | Very low | 76 Ų | 76 | 141.7 Ų | 141.7 | 63% | 0.628 | 82% | 0.818 | S | S | * | * | cis | 177.4 | 128 | -20 | 0 | 0 | 0 | 0 | 0 | 102.5 | ||||
| 11 | N | 32.4 | Very low | 35.1 | Very low | 171 Ų | 171 | 138.6 Ų | 138.6 | 91% | 0.914 | 81% | 0.809 | S | S | * | * | trans | -149.2 | 123.3 | 151.1 | -138.2 | 2.8 | 0 | 0 | 0 | 109.9 | ||||
| 12 | G | 37.3 | Very low | 35.5 | Very low | 73 Ų | 73 | 133.1 Ų | 133.1 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | trans | -73.4 | 134.9 | -167.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 13 | S | 31.1 | Very low | 35.7 | Very low | 112 Ų | 112 | 133.6 Ų | 133.6 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | -149 | 88.6 | 146.1 | 40 | 0 | 0 | 0 | 0 | 106.4 | A15 | S13-A15 PolarHBondContact O-N 3.48Š| ||
| 14 | T | 35.9 | Very low | 36.4 | Very low | 152 Ų | 152 | 131.1 Ų | 131.1 | 93% | 0.933 | 77% | 0.774 | S | S | * | * | trans | -66.5 | 76.6 | 168.1 | -6.2 | 0 | 0 | 0 | 0 | 107.9 | L16 | T14-L16 PolarHBondContact O-N 3.5Š| ||
| 15 | A | 37.4 | Very low | 37.1 | Very low | 88 Ų | 88 | 129.5 Ų | 129.5 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -74.1 | 107.5 | 162.8 | 0 | 0 | 0 | 0 | 0 | 106.4 | S13 | S13-A15 PolarHBondContact O-N 3.48Š| ||
| 16 | L | 34.9 | Very low | 37.9 | Very low | 155 Ų | 155 | 125.1 Ų | 125.1 | 81% | 0.812 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -46.9 | 128.6 | 168.5 | -147.2 | 93.8 | 0 | 0 | 0 | 107.9 | T14 | T14-L16 PolarHBondContact O-N 3.5Š|
| 17 | P | 41.8 | Very low | 39.2 | Very low | 104 Ų | 104 | 119.6 Ų | 119.6 | 68% | 0.675 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 135.7 | 169.1 | 23.4 | -30.6 | 0 | 0 | 0 | 107.8 | ||
| 18 | P | 43.5 | Very low | 41 | Very low | 115 Ų | 115 | 118.8 Ų | 118.8 | 75% | 0.747 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 141.8 | 177.7 | 23.6 | -32 | 0 | 0 | 0 | 108.7 | L20 | P18-L20 PolarHBondContact O-N 2.69Š|
| 19 | P | 38.8 | Very low | 43 | Very low | 122 Ų | 122 | 124.1 Ų | 124.1 | 79% | 0.792 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 123 | 179.7 | 22.1 | -31.2 | 0 | 0 | 0 | 108.6 | A21 | P19-A21 PolarHBondContact O-N 2.66Š|
| 20 | L | 40.9 | Very low | 45.1 | Very low | 169 Ų | 169 | 114 Ų | 114 | 89% | 0.885 | 70% | 0.696 | S | S | * | * | trans | -48.4 | 112.3 | 174 | -160.9 | 74.8 | 0 | 0 | 0 | 107.5 | P18 | P18-L20 PolarHBondContact O-N 2.69Š| ||
| 21 | A | 45.1 | Very low | 46.9 | Very low | 77 Ų | 77 | 111.1 Ų | 111.1 | 64% | 0.636 | 67% | 0.669 | S | S | * | * | trans | -52.2 | 130.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | P19 N23 | P19-A21 PolarHBondContact O-N 2.66Å; A21-N23 PolarHBondContact O-N 2.92Å; A21-N23 VanDerWaalsContact O-N 3.1Å | ||
| 22 | P | 43.5 | Very low | 48.6 | Very low | 113 Ų | 113 | 106.4 Ų | 106.4 | 73% | 0.734 | 64% | 0.644 | S | S | * | * | trans | -58.3 | 123.7 | 177.4 | 23.2 | -30.8 | 0 | 0 | 0 | 107.9 | I24 | P22-I24 PolarHBondContact O-N 3.15Š| ||
| 23 | N | 38 | Very low | 50.1 | Low | 161 Ų | 161 | 106.7 Ų | 106.7 | 86% | 0.861 | 63% | 0.628 | S | S | * | * | trans | -54.9 | 100.2 | 170.2 | -105 | -2.2 | 0 | 0 | 0 | 108.4 | A21 S25 | A21-N23 PolarHBondContact O-N 2.92Å; A21-N23 VanDerWaalsContact O-N 3.1Å; N23-S25 PolarHBondContact O-N 2.69Å | ||
| 24 | I | 47.5 | Very low | 51.8 | Low | 98 Ų | 98 | 101.7 Ų | 101.7 | 50% | 0.503 | 59% | 0.592 | S | S | . | * | trans | -72.1 | 83.6 | 174.1 | -59.2 | 171.6 | 0 | 0 | 0 | 106.7 | P22 V26 I254 | P22-I24 PolarHBondContact O-N 3.15Å; I24-V26 VanDerWaalsContact CG2-O 3.28Å; I24-V26 WeakPolarHBondContact CG2-O 3.36Å; I24-V26 PolarHBondContact O-N 3.23Å; I24-I254 HydrophobicContact CD1-CD1 4.15Å | ||
| 25 | S | 47.3 | Very low | 53.2 | Low | 112 Ų | 112 | 98 Ų | 98 | 78% | 0.783 | 56% | 0.562 | S | S | * | * | trans | -79.9 | -3 | 178 | 47.7 | 0 | 0 | 0 | 0 | 113.2 | N23 | N23-S25 PolarHBondContact O-N 2.69Š| ||
| 26 | V | 51.1 | Low | 54.7 | Low | 114 Ų | 114 | 98 Ų | 98 | 69% | 0.691 | 55% | 0.547 | S | S | * | . | S | Bend | trans | -134.5 | 112.4 | 174.3 | -174.2 | 0 | 0 | 0 | 0 | 108.4 | I24 | I24-V26 VanDerWaalsContact CG2-O 3.28Å; I24-V26 WeakPolarHBondContact CG2-O 3.36Å; I24-V26 PolarHBondContact O-N 3.23Å |
| 27 | P | 61.1 | Low | 56.4 | Low | 55 Ų | 55 | 94.1 Ų | 94.1 | 36% | 0.357 | 53% | 0.527 | S | S | . | . | trans | -62 | 144.6 | 176.6 | 23.9 | -31.3 | 0 | 0 | 0 | 110.7 | L31 L32 | P27-L31 HydrophobicContact CB-CD2 3.67Å; P27-L32 HydrophobicContact CG-CD1 3.97Å | ||
| 28 | H | 66.9 | Low | 57.8 | Low | 69 Ų | 69 | 91.9 Ų | 91.9 | 32% | 0.319 | 51% | 0.509 | S | S | . | . | trans | -57.4 | 144.1 | 175.5 | -93.8 | -91.3 | 0 | 0 | 0 | 110.8 | C30 L31 L32 I254 E255 | H28-C30 PolarHBondContact O-N 3.02Å; H28-C30 VanDerWaalsContact O-N 3.11Å; H28-L31 WeakPolarHBondContact O-CA 3.16Å; H28-L31 VanDerWaalsContact O-CB 3.24Å; H28-L31 WeakPolarHBondContact O-CB 3.38Å; H28-L31 PolarHBondContact O-N 3.42Å; H28-L32 PolarHBondContact O-N 3.15Å; H28-L32 VanDerWaalsContact O-N 3.13Å; H28-I254 HydrophobicContact CB-CG2 4.05Å; H28-I254 WeakPolarHBondContact CD2-CG2 3.2Å; H28-E255 IonicContact CE1-OE1 2.93Å; H28-E255 PolarHBondContact CE1-OE1 3.35Å; H28-E255 IonicContact ND1-OE1 3.71Å; H28-E255 PolarHBondContact ND1-OE1 2.95Å | ||
| 29 | R | 70 | Confident | 58.8 | Low | 224 Ų | 224 | 89.8 Ų | 89.8 | 85% | 0.845 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -56.1 | -32.6 | -174 | -69.5 | -171.3 | 178 | -159.7 | -0.2 | 114.6 | L31 L32 L33 | R29-L31 VanDerWaalsContact C-N 3.34Å; R29-L32 WeakPolarHBondContact O-CB 3.44Å; R29-L32 PolarHBondContact O-N 3.39Å; R29-L33 PolarHBondContact O-N 2.98Å; R29-L33 VanDerWaalsContact O-N 3.15Å |
| 30 | C | 73.1 | Confident | 59.7 | Low | 34 Ų | 34 | 91.5 Ų | 91.5 | 23% | 0.23 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -70.9 | -33 | 178.6 | -59 | 0 | 0 | 0 | 0 | 112.3 | H28 C258 | H28-C30 PolarHBondContact O-N 3.02Å; H28-C30 VanDerWaalsContact O-N 3.11Å; C30-C258 HydrophobicContact CB-CB 3.88Å; C30-C258 WeakPolarHBondContact CB-SG 3.28Å; C30-C258 VanDerWaalsContact SG-CA 3.6Å; C30-C258 WeakPolarHBondContact SG-CB 3.37Å; C30-C258 CovalentContact SG-SG 2.01Å; C30-C258 PolarHBondContact SG-SG 2.69Å |
| 31 | L | 68.2 | Low | 60.5 | Low | 15 Ų | 15 | 86.3 Ų | 86.3 | 8% | 0.079 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -67.4 | -42.9 | 171.3 | -165.1 | 91 | 0 | 0 | 0 | 111.2 | P27 H28 R29 L33 L34 Y35 F183 L257 | P27-L31 HydrophobicContact CB-CD2 3.67Å; H28-L31 WeakPolarHBondContact O-CA 3.16Å; H28-L31 VanDerWaalsContact O-CB 3.24Å; H28-L31 WeakPolarHBondContact O-CB 3.38Å; H28-L31 PolarHBondContact O-N 3.42Å; R29-L31 VanDerWaalsContact C-N 3.34Å; L31-L33 VanDerWaalsContact C-N 3.28Å; L31-L33 PolarHBondContact O-N 3.11Å; L31-L34 WeakPolarHBondContact O-CB 3.42Å; L31-L34 PolarHBondContact O-N 2.64Å; L31-Y35 HydrophobicContact CD1-CE2 4.38Å; L31-Y35 HydrophobicContact CG-CD2 4.28Å; L31-Y35 HydrophobicContact CG-CE2 4.49Å; L31-Y35 PolarHBondContact O-N 2.78Å; L31-F183 HydrophobicContact CD1-CD1 3.26Å; L31-F183 HydrophobicContact CD1-CE1 3.48Å; L31-F183 VanDerWaalsContact CD1-CE1 3.48Å; L31-F183 HydrophobicContact CD1-CG 4.43Å; L31-F183 HydrophobicContact CD2-CD1 3.85Å; L31-F183 HydrophobicContact CD2-CE1 3.31Å; L31-F183 HydrophobicContact CD2-CZ 3.99Å; L31-F183 HydrophobicContact CG-CD1 4.14Å; L31-F183 HydrophobicContact CG-CE1 3.92Å; L31-L257 HydrophobicContact CB-CD2 4.37Å; L31-L257 HydrophobicContact CD1-CD2 3.74Å |
| 32 | L | 67.9 | Low | 61.5 | Low | 73 Ų | 73 | 90.9 Ų | 90.9 | 38% | 0.382 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.9 | -45.3 | 179.2 | -158.3 | 86.2 | 0 | 0 | 0 | 110.3 | P27 H28 R29 L34 Y35 E36 | P27-L32 HydrophobicContact CG-CD1 3.97Å; H28-L32 PolarHBondContact O-N 3.15Å; H28-L32 VanDerWaalsContact O-N 3.13Å; R29-L32 WeakPolarHBondContact O-CB 3.44Å; R29-L32 PolarHBondContact O-N 3.39Å; L32-L34 PolarHBondContact O-N 3.14Å; L32-L34 VanDerWaalsContact O-N 3.13Å; L32-Y35 PolarHBondContact O-N 3.07Å; L32-E36 WeakPolarHBondContact CD2-OE2 3.16Å; L32-E36 HydrophobicContact CG-CB 4.35Å; L32-E36 WeakPolarHBondContact CG-OE2 3.43Å; L32-E36 WeakPolarHBondContact O-CA 3.46Å; L32-E36 WeakPolarHBondContact O-CB 3.29Å; L32-E36 PolarHBondContact O-N 2.75Å |
| 33 | L | 68.9 | Low | 63 | Low | 79 Ų | 79 | 86.9 Ų | 86.9 | 41% | 0.414 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -57.3 | -30.2 | 177.5 | -164.4 | 88.5 | 0 | 0 | 0 | 113.7 | R29 L31 W46 L49 | R29-L33 PolarHBondContact O-N 2.98Å; R29-L33 VanDerWaalsContact O-N 3.15Å; L31-L33 VanDerWaalsContact C-N 3.28Å; L31-L33 PolarHBondContact O-N 3.11Å; L33-W46 HydrophobicContact CD2-CE3 4.04Å; L33-W46 HydrophobicContact CD2-CZ3 4.03Å; L33-L49 HydrophobicContact CD2-CD2 4.2Å |
| 34 | L | 66.1 | Low | 64.9 | Low | 7 Ų | 7 | 81.6 Ų | 81.6 | 4% | 0.037 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -77.8 | -33 | -176.4 | -151.5 | 72.7 | 0 | 0 | 0 | 112.5 | L31 L32 W46 Y186 | L31-L34 WeakPolarHBondContact O-CB 3.42Å; L31-L34 PolarHBondContact O-N 2.64Å; L32-L34 PolarHBondContact O-N 3.14Å; L32-L34 VanDerWaalsContact O-N 3.13Å; L34-W46 HydrophobicContact CD1-CB 4.49Å; L34-W46 HydrophobicContact CD1-CD2 3.49Å; L34-W46 VanDerWaalsContact CD1-CD2 3.49Å; L34-W46 HydrophobicContact CD1-CE3 3.88Å; L34-W46 HydrophobicContact CD1-CG 3.77Å; L34-W46 HydrophobicContact CD1-CH2 4.3Å; L34-W46 HydrophobicContact CD1-CZ2 3.98Å; L34-W46 HydrophobicContact CD1-CZ3 4.26Å; L34-Y186 HydrophobicContact CD2-CD2 3.75Å; L34-Y186 HydrophobicContact CD2-CE2 4.29Å; L34-Y186 HydrophobicContact CG-CD2 4.16Å; L34-Y186 HydrophobicContact CG-CE2 4.39Å |
| 35 | Y | 64.1 | Low | 66.5 | Low | 74 Ų | 74 | 81.9 Ų | 81.9 | 29% | 0.29 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -115.9 | -11.9 | -172.7 | -70.5 | -80.9 | 0 | 0 | 0 | 114.7 | L31 L32 D37 N184 Y186 | L31-Y35 HydrophobicContact CD1-CE2 4.38Å; L31-Y35 HydrophobicContact CG-CD2 4.28Å; L31-Y35 HydrophobicContact CG-CE2 4.49Å; L31-Y35 PolarHBondContact O-N 2.78Å; L32-Y35 PolarHBondContact O-N 3.07Å; Y35-D37 PolarHBondContact O-N 2.82Å; Y35-N184 VanDerWaalsContact OH-C 3.29Å; Y35-N184 PolarHBondContact OH-O 3.49Å; Y35-Y186 HydrophobicContact CD1-CE2 4.29Å; Y35-Y186 AromaticContact CE1-CE2 3.47Å; Y35-Y186 HydrophobicContact CE1-CE2 3.47Å; Y35-Y186 VanDerWaalsContact CE1-CE2 3.47Å; Y35-Y186 AromaticContact CE1-CZ 3.95Å; Y35-Y186 HydrophobicContact CE2-CE2 4.29Å; Y35-Y186 AromaticContact CZ-CE2 3.48Å; Y35-Y186 VanDerWaalsContact CZ-CE2 3.48Å; Y35-Y186 WeakPolarHBondContact OH-CE2 3.39Å |
| 36 | E | 69.1 | Low | 68.2 | Low | 89 Ų | 89 | 77.2 Ų | 77.2 | 42% | 0.416 | 40% | 0.397 | S | S | . | . | trans | -70 | 124 | -178.3 | -168.9 | 163.9 | -158.9 | 0 | 0 | 110.5 | L32 Y45 | L32-E36 WeakPolarHBondContact CD2-OE2 3.16Å; L32-E36 HydrophobicContact CG-CB 4.35Å; L32-E36 WeakPolarHBondContact CG-OE2 3.43Å; L32-E36 WeakPolarHBondContact O-CA 3.46Å; L32-E36 WeakPolarHBondContact O-CB 3.29Å; L32-E36 PolarHBondContact O-N 2.75Å; E36-Y45 HydrophobicContact CB-CD2 4.01Å; E36-Y45 HydrophobicContact CB-CE2 4.49Å; E36-Y45 HydrophobicContact CG-CD2 4.02Å; E36-Y45 HydrophobicContact CG-CE2 3.99Å; E36-Y45 VanDerWaalsContact O-CD2 3.26Å; E36-Y45 WeakPolarHBondContact O-CD2 3.4Å; E36-Y45 PolarHBondContact O-N 3.5Å; E36-Y45 VanDerWaalsContact O-N 3.08Å | ||
| 37 | D | 71.1 | Confident | 69.8 | Low | 73 Ų | 73 | 71.9 Ų | 71.9 | 39% | 0.39 | 37% | 0.365 | S | S | . | . | B | Isolated β-bridge | trans | -86.4 | 148.2 | 174.2 | -76.2 | -37.3 | 0 | 0 | 0 | 110.3 | Y35 G39 R44 | Y35-D37 PolarHBondContact O-N 2.82Å; D37-G39 PolarHBondContact O-N 3.07Å; D37-R44 WeakPolarHBondContact OD1-CG 3.46Å |
| 38 | I | 71.8 | Confident | 71 | Confident | 57 Ų | 57 | 71.7 Ų | 71.7 | 29% | 0.292 | 36% | 0.361 | S | S | . | . | trans | -75.2 | 94 | 176.2 | -65.7 | 171.9 | 0 | 0 | 0 | 109.9 | T40 S41 V43 Y45 L48 | I38-T40 PolarHBondContact O-N 2.81Å; I38-S41 WeakPolarHBondContact O-CA 3.2Å; I38-S41 WeakPolarHBondContact O-CB 3.42Å; I38-S41 PolarHBondContact O-N 3.36Å; I38-V43 PolarHBondContact N-O 3.45Å; I38-Y45 HydrophobicContact CD1-CD1 4.14Å; I38-Y45 HydrophobicContact CD1-CE1 4.01Å; I38-Y45 HydrophobicContact CG1-CD1 3.96Å; I38-Y45 HydrophobicContact CG1-CD2 4Å; I38-Y45 HydrophobicContact CG1-CE1 3.66Å; I38-Y45 HydrophobicContact CG1-CE2 3.67Å; I38-Y45 HydrophobicContact CG1-CG 4.13Å; I38-L48 HydrophobicContact CD1-CD1 3.1Å; I38-L48 HydrophobicContact CG1-CD1 4.49Å | ||
| 39 | G | 64.7 | Low | 71.9 | Confident | 71 Ų | 71 | 71.4 Ų | 71.4 | 73% | 0.732 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.6 | -122 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | D37 | D37-G39 PolarHBondContact O-N 3.07Š|
| 40 | T | 57.1 | Low | 72.7 | Confident | 157 Ų | 157 | 61 Ų | 61 | 96% | 0.963 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.2 | 1.7 | 174.9 | 60.9 | 0 | 0 | 0 | 0 | 113.3 | I38 | I38-T40 PolarHBondContact O-N 2.81Š|
| 41 | S | 58.8 | Low | 73.6 | Confident | 60 Ų | 60 | 60.7 Ų | 60.7 | 42% | 0.42 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -86.7 | 137.9 | -179.4 | -167.4 | 0 | 0 | 0 | 0 | 110.1 | I38 V43 | I38-S41 WeakPolarHBondContact O-CA 3.2Å; I38-S41 WeakPolarHBondContact O-CB 3.42Å; I38-S41 PolarHBondContact O-N 3.36Å; S41-V43 PolarHBondContact O-N 2.93Å |
| 42 | R | 66.1 | Low | 74.7 | Confident | 173 Ų | 173 | 64.6 Ų | 64.6 | 65% | 0.653 | 34% | 0.338 | S | S | * | . | S | Bend | trans | -74.3 | 28.4 | 180 | -66.6 | -178.9 | -81.3 | -171.5 | -4.9 | 113.4 | ||
| 43 | V | 74.1 | Confident | 75.9 | Confident | 30 Ų | 30 | 62.1 Ų | 62.1 | 18% | 0.182 | 33% | 0.326 | C | S | . | . | trans | -112.8 | 115.4 | -174 | -179.6 | 0 | 0 | 0 | 0 | 108.6 | I38 S41 L48 M102 | I38-V43 PolarHBondContact N-O 3.45Å; S41-V43 PolarHBondContact O-N 2.93Å; V43-L48 HydrophobicContact CG1-CD1 3.54Å; V43-L48 HydrophobicContact CG1-CG 3.75Å; V43-M102 HydrophobicContact CG1-CE 3.85Å; V43-M102 HydrophobicContact CG1-CG 4.07Å; V43-M102 HydrophobicContact CG1-SD 3.9Å; V43-M102 HydrophobicContact CG2-CG 4.41Å | ||
| 44 | R | 78.4 | Confident | 77 | Confident | 49 Ų | 49 | 58.6 Ų | 58.6 | 19% | 0.185 | 31% | 0.308 | C | S | . | . | B | Isolated β-bridge | trans | -73.3 | 141.2 | 177.8 | -59.7 | 175.8 | -169 | 149.5 | -0.9 | 110.9 | D37 W46 D47 L48 D114 Y186 | D37-R44 WeakPolarHBondContact OD1-CG 3.46Å; R44-W46 PolarHBondContact O-N 2.65Å; R44-D47 PolarHBondContact O-N 2.89Å; R44-L48 PolarHBondContact O-N 3.35Å; R44-D114 IonicContact CZ-OD2 3.13Å; R44-D114 IonicContact NH1-OD2 2.75Å; R44-D114 PolarHBondContact NH1-OD2 3.12Å; R44-D114 IonicContact NH2-OD2 2.91Å; R44-Y186 PolarHBondContact NH1-OH 3.48Å |
| 45 | Y | 81.3 | Confident | 78.3 | Confident | 104 Ų | 104 | 60.6 Ų | 60.6 | 41% | 0.408 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -56.3 | -39.2 | 174.6 | -82.2 | -76.7 | 0 | 0 | 0 | 112.2 | E36 I38 D47 L48 L49 | E36-Y45 HydrophobicContact CB-CD2 4.01Å; E36-Y45 HydrophobicContact CB-CE2 4.49Å; E36-Y45 HydrophobicContact CG-CD2 4.02Å; E36-Y45 HydrophobicContact CG-CE2 3.99Å; E36-Y45 VanDerWaalsContact O-CD2 3.26Å; E36-Y45 WeakPolarHBondContact O-CD2 3.4Å; E36-Y45 PolarHBondContact O-N 3.5Å; E36-Y45 VanDerWaalsContact O-N 3.08Å; I38-Y45 HydrophobicContact CD1-CD1 4.14Å; I38-Y45 HydrophobicContact CD1-CE1 4.01Å; I38-Y45 HydrophobicContact CG1-CD1 3.96Å; I38-Y45 HydrophobicContact CG1-CD2 4Å; I38-Y45 HydrophobicContact CG1-CE1 3.66Å; I38-Y45 HydrophobicContact CG1-CE2 3.67Å; I38-Y45 HydrophobicContact CG1-CG 4.13Å; Y45-D47 PolarHBondContact O-N 2.89Å; Y45-L48 PolarHBondContact O-N 3.39Å; Y45-L49 WeakPolarHBondContact O-CB 3.42Å; Y45-L49 PolarHBondContact O-N 2.93Å |
| 46 | W | 81.8 | Confident | 79.7 | Confident | 14 Ų | 14 | 62.5 Ų | 62.5 | 5% | 0.053 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.4 | -43.1 | 179 | -170.3 | -115.6 | 0 | 0 | 0 | 113.7 | L33 L34 R44 L48 L49 L50 W118 D261 T264 F265 | L33-W46 HydrophobicContact CD2-CE3 4.04Å; L33-W46 HydrophobicContact CD2-CZ3 4.03Å; L34-W46 HydrophobicContact CD1-CB 4.49Å; L34-W46 HydrophobicContact CD1-CD2 3.49Å; L34-W46 VanDerWaalsContact CD1-CD2 3.49Å; L34-W46 HydrophobicContact CD1-CE3 3.88Å; L34-W46 HydrophobicContact CD1-CG 3.77Å; L34-W46 HydrophobicContact CD1-CH2 4.3Å; L34-W46 HydrophobicContact CD1-CZ2 3.98Å; L34-W46 HydrophobicContact CD1-CZ3 4.26Å; R44-W46 PolarHBondContact O-N 2.65Å; W46-L48 PolarHBondContact O-N 3.01Å; W46-L49 HydrophobicContact CE3-CD2 4.11Å; W46-L49 HydrophobicContact CZ3-CD2 4.13Å; W46-L49 PolarHBondContact O-N 3.21Å; W46-L50 HydrophobicContact CG-CD1 4.44Å; W46-L50 WeakPolarHBondContact O-CG 3.47Å; W46-L50 PolarHBondContact O-N 2.68Å; W46-W118 HydrophobicContact CZ2-CH2 4.4Å; W46-W118 AromaticContact NE1-CH2 3.31Å; W46-W118 VanDerWaalsContact NE1-CH2 3.31Å; W46-W118 AromaticContact NE1-CZ3 3.55Å; W46-D261 HydrophobicContact CH2-CB 4.08Å; W46-D261 WeakPolarHBondContact CH2-O 3.39Å; W46-T264 HydrophobicContact CZ2-CG2 4.41Å; W46-F265 HydrophobicContact CH2-CB 3.76Å; W46-F265 HydrophobicContact CZ2-CB 4.46Å; W46-F265 HydrophobicContact CZ3-CB 4.27Å |
| 47 | D | 85.4 | Confident | 80.9 | Confident | 3 Ų | 3 | 59 Ų | 59 | 2% | 0.016 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -68.5 | -36.8 | -179.7 | -69.5 | -48.7 | 0 | 0 | 0 | 112.1 | R44 Y45 L50 L51 R97 S101 M102 | R44-D47 PolarHBondContact O-N 2.89Å; Y45-D47 PolarHBondContact O-N 2.89Å; D47-L50 PolarHBondContact O-N 3.48Å; D47-L51 WeakPolarHBondContact O-CB 3.25Å; D47-L51 PolarHBondContact O-N 3.04Å; D47-R97 IonicContact OD1-CZ 3.6Å; D47-R97 VanDerWaalsContact OD1-CZ 3.26Å; D47-R97 IonicContact OD1-NH1 3.73Å; D47-R97 PolarHBondContact OD1-NH1 3.29Å; D47-R97 IonicContact OD1-NH2 3.32Å; D47-R97 PolarHBondContact OD1-NH2 2.97Å; D47-S101 PolarHBondContact OD2-OG 2.97Å; D47-M102 HydrophobicContact CB-CE 3.57Å; D47-M102 HydrophobicContact CB-CG 4.3Å |
| 48 | L | 86.1 | Confident | 81.9 | Confident | 51 Ų | 51 | 56.6 Ų | 56.6 | 27% | 0.267 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -66.9 | -42.3 | 172.7 | -84.2 | 164 | 0 | 0 | 0 | 112.3 | I38 V43 R44 Y45 W46 L50 L51 I52 M102 | I38-L48 HydrophobicContact CD1-CD1 3.1Å; I38-L48 HydrophobicContact CG1-CD1 4.49Å; V43-L48 HydrophobicContact CG1-CD1 3.54Å; V43-L48 HydrophobicContact CG1-CG 3.75Å; R44-L48 PolarHBondContact O-N 3.35Å; Y45-L48 PolarHBondContact O-N 3.39Å; W46-L48 PolarHBondContact O-N 3.01Å; L48-L50 PolarHBondContact O-N 3.49Å; L48-L51 HydrophobicContact CD2-CD2 4.43Å; L48-L51 PolarHBondContact O-N 3.34Å; L48-L51 VanDerWaalsContact O-N 3.14Å; L48-I52 VanDerWaalsContact O-CG1 3.26Å; L48-I52 WeakPolarHBondContact O-CG1 3.45Å; L48-I52 PolarHBondContact O-N 3.46Å; L48-M102 HydrophobicContact CD2-CE 4.13Å; L48-M102 HydrophobicContact CG-CE 3.86Å |
| 49 | L | 87.1 | Confident | 82.9 | Confident | 63 Ų | 63 | 58.8 Ų | 58.8 | 33% | 0.33 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.8 | -38.4 | 178.1 | -174.2 | 64.8 | 0 | 0 | 0 | 110.8 | L33 Y45 W46 P53 F265 | L33-L49 HydrophobicContact CD2-CD2 4.2Å; Y45-L49 WeakPolarHBondContact O-CB 3.42Å; Y45-L49 PolarHBondContact O-N 2.93Å; W46-L49 HydrophobicContact CE3-CD2 4.11Å; W46-L49 HydrophobicContact CZ3-CD2 4.13Å; W46-L49 PolarHBondContact O-N 3.21Å; L49-P53 WeakPolarHBondContact O-CD 3.41Å; L49-P53 WeakPolarHBondContact O-CG 3.32Å; L49-F265 HydrophobicContact CD1-CE2 3.87Å; L49-F265 HydrophobicContact CD1-CZ 4.01Å; L49-F265 HydrophobicContact CD2-CD2 3.81Å; L49-F265 HydrophobicContact CD2-CE2 3.99Å; L49-F265 HydrophobicContact CD2-CG 4.27Å; L49-F265 HydrophobicContact CG-CD2 3.7Å; L49-F265 HydrophobicContact CG-CE2 3.43Å; L49-F265 VanDerWaalsContact CG-CE2 3.43Å; L49-F265 HydrophobicContact CG-CZ 4.06Å; L49-F265 WeakPolarHBondContact O-CE2 3.04Å |
| 50 | L | 86.7 | Confident | 84.2 | Confident | 4 Ų | 4 | 58.6 Ų | 58.6 | 2% | 0.021 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -78.2 | -33.7 | 174 | -66.7 | 173.5 | 0 | 0 | 0 | 113.6 | W46 D47 L48 N54 R97 W118 F265 F268 | W46-L50 HydrophobicContact CG-CD1 4.44Å; W46-L50 WeakPolarHBondContact O-CG 3.47Å; W46-L50 PolarHBondContact O-N 2.68Å; D47-L50 PolarHBondContact O-N 3.48Å; L48-L50 PolarHBondContact O-N 3.49Å; L50-N54 PolarHBondContact O-ND2 2.99Å; L50-R97 VanDerWaalsContact CD1-NH2 3.26Å; L50-W118 HydrophobicContact CD1-CH2 3.81Å; L50-W118 HydrophobicContact CD1-CZ3 3.74Å; L50-F265 HydrophobicContact CD2-CD2 3.91Å; L50-F268 HydrophobicContact CD2-CB 3.76Å |
| 51 | L | 90.3 | Very high | 85.7 | Confident | 29 Ų | 29 | 51.1 Ų | 51.1 | 15% | 0.152 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -70 | -48.6 | -177.7 | 179.2 | 66.8 | 0 | 0 | 0 | 112.2 | D47 L48 N54 V55 I95 A98 M102 | D47-L51 WeakPolarHBondContact O-CB 3.25Å; D47-L51 PolarHBondContact O-N 3.04Å; L48-L51 HydrophobicContact CD2-CD2 4.43Å; L48-L51 PolarHBondContact O-N 3.34Å; L48-L51 VanDerWaalsContact O-N 3.14Å; L51-N54 PolarHBondContact O-N 3.27Å; L51-V55 HydrophobicContact CD1-CG2 3.55Å; L51-V55 HydrophobicContact CG-CG2 3.87Å; L51-V55 WeakPolarHBondContact O-CG2 3.48Å; L51-V55 PolarHBondContact O-N 3.19Å; L51-I95 HydrophobicContact CD1-CB 4.32Å; L51-I95 HydrophobicContact CD1-CG1 4.19Å; L51-I95 HydrophobicContact CD1-CG2 4.01Å; L51-A98 HydrophobicContact CB-CB 3.87Å; L51-A98 HydrophobicContact CD1-CB 3.87Å; L51-A98 HydrophobicContact CG-CB 4.35Å; L51-M102 HydrophobicContact CB-CE 4.44Å; L51-M102 HydrophobicContact CD2-CE 3.85Å; L51-M102 HydrophobicContact CD2-SD 4.39Å |
| 52 | I | 91.8 | Very high | 87.2 | Confident | 96 Ų | 96 | 52.1 Ų | 52.1 | 49% | 0.492 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -52.2 | -55.9 | -175 | -68.6 | 164.4 | 0 | 0 | 0 | 112.4 | L48 N54 V55 L56 | L48-I52 VanDerWaalsContact O-CG1 3.26Å; L48-I52 WeakPolarHBondContact O-CG1 3.45Å; L48-I52 PolarHBondContact O-N 3.46Å; I52-N54 VanDerWaalsContact C-N 3.31Å; I52-N54 PolarHBondContact O-N 3.08Å; I52-V55 PolarHBondContact O-N 2.99Å; I52-L56 HydrophobicContact CG2-CD1 3.81Å; I52-L56 HydrophobicContact CG2-CG 4.37Å; I52-L56 WeakPolarHBondContact O-CB 3.4Å; I52-L56 VanDerWaalsContact O-CG 3.25Å; I52-L56 WeakPolarHBondContact O-CG 3.15Å; I52-L56 PolarHBondContact O-N 3.19Å |
| 53 | P | 92.6 | Very high | 88.3 | Confident | 22 Ų | 22 | 53.4 Ų | 53.4 | 14% | 0.143 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.3 | -37.4 | -178.6 | 23 | -32.1 | 0 | 0 | 0 | 112.3 | L49 F57 S269 | L49-P53 WeakPolarHBondContact O-CD 3.41Å; L49-P53 WeakPolarHBondContact O-CG 3.32Å; P53-F57 VanDerWaalsContact O-CB 3.22Å; P53-F57 WeakPolarHBondContact O-CB 3.32Å; P53-F57 PolarHBondContact O-N 3.27Å; P53-S269 VanDerWaalsContact CG-CB 3.48Å; P53-S269 WeakPolarHBondContact CG-OG 3.27Å |
| 54 | N | 92 | Very high | 88.8 | Confident | 4 Ų | 4 | 56.3 Ų | 56.3 | 2% | 0.021 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.8 | -41.8 | 178.6 | -80.6 | -62.2 | 0 | 0 | 0 | 112.4 | L50 L51 I52 F57 L58 I95 F268 | L50-N54 PolarHBondContact O-ND2 2.99Å; L51-N54 PolarHBondContact O-N 3.27Å; I52-N54 VanDerWaalsContact C-N 3.31Å; I52-N54 PolarHBondContact O-N 3.08Å; N54-F57 PolarHBondContact O-N 2.89Å; N54-L58 WeakPolarHBondContact O-CB 3.31Å; N54-L58 PolarHBondContact O-N 3.46Å; N54-I95 HydrophobicContact CB-CG1 4Å; N54-F268 PolarHBondContact ND2-O 2.87Å |
| 55 | V | 93.8 | Very high | 88.9 | Confident | 50 Ų | 50 | 55.6 Ų | 55.6 | 30% | 0.303 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -65.6 | -47.7 | 175.6 | 171.3 | 0 | 0 | 0 | 0 | 111.1 | L51 I52 F57 L58 I59 I95 | L51-V55 HydrophobicContact CD1-CG2 3.55Å; L51-V55 HydrophobicContact CG-CG2 3.87Å; L51-V55 WeakPolarHBondContact O-CG2 3.48Å; L51-V55 PolarHBondContact O-N 3.19Å; I52-V55 PolarHBondContact O-N 2.99Å; V55-F57 VanDerWaalsContact C-N 3.25Å; V55-F57 PolarHBondContact O-N 3.35Å; V55-L58 PolarHBondContact O-N 2.92Å; V55-I59 HydrophobicContact CG1-CD1 3.74Å; V55-I59 HydrophobicContact CG1-CG1 4.34Å; V55-I59 VanDerWaalsContact O-CG1 3.3Å; V55-I59 WeakPolarHBondContact O-CG1 3.47Å; V55-I59 PolarHBondContact O-N 2.9Å; V55-I95 HydrophobicContact CG2-CD1 3.96Å; V55-I95 HydrophobicContact CG2-CG1 3.86Å |
| 56 | L | 94.1 | Very high | 88.8 | Confident | 113 Ų | 113 | 54.6 Ų | 54.6 | 59% | 0.592 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -57.3 | -43.1 | 177.4 | -71.7 | 175 | 0 | 0 | 0 | 111.1 | I52 F60 | I52-L56 HydrophobicContact CG2-CD1 3.81Å; I52-L56 HydrophobicContact CG2-CG 4.37Å; I52-L56 WeakPolarHBondContact O-CB 3.4Å; I52-L56 VanDerWaalsContact O-CG 3.25Å; I52-L56 WeakPolarHBondContact O-CG 3.15Å; I52-L56 PolarHBondContact O-N 3.19Å; L56-F60 WeakPolarHBondContact O-CB 3.28Å; L56-F60 PolarHBondContact O-N 3.19Å |
| 57 | F | 93.3 | Very high | 88.5 | Confident | 16 Ų | 16 | 57.5 Ų | 57.5 | 7% | 0.07 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -69.1 | -39.7 | 178 | -176.6 | -113.6 | 0 | 0 | 0 | 112.8 | P53 N54 V55 F60 L61 V87 A91 A272 P273 Y276 | P53-F57 VanDerWaalsContact O-CB 3.22Å; P53-F57 WeakPolarHBondContact O-CB 3.32Å; P53-F57 PolarHBondContact O-N 3.27Å; N54-F57 PolarHBondContact O-N 2.89Å; V55-F57 VanDerWaalsContact C-N 3.25Å; V55-F57 PolarHBondContact O-N 3.35Å; F57-F60 HydrophobicContact CD2-CD1 4.18Å; F57-F60 HydrophobicContact CE2-CD1 4.16Å; F57-F60 WeakPolarHBondContact O-CB 3.38Å; F57-F60 PolarHBondContact O-N 2.75Å; F57-L61 HydrophobicContact CD1-CD1 4.08Å; F57-L61 HydrophobicContact CD1-CG 4.42Å; F57-L61 HydrophobicContact CE1-CD1 3.59Å; F57-L61 HydrophobicContact CE1-CD2 4.4Å; F57-L61 HydrophobicContact CE1-CG 4.02Å; F57-L61 HydrophobicContact CE2-CD2 4.29Å; F57-L61 HydrophobicContact CE2-CG 4.33Å; F57-L61 HydrophobicContact CZ-CD1 3.97Å; F57-L61 HydrophobicContact CZ-CD2 3.92Å; F57-L61 HydrophobicContact CZ-CG 3.97Å; F57-L61 WeakPolarHBondContact O-CG 3.11Å; F57-L61 PolarHBondContact O-N 2.8Å; F57-V87 HydrophobicContact CE1-CG1 3.34Å; F57-V87 HydrophobicContact CZ-CG1 3.42Å; F57-V87 VanDerWaalsContact CZ-CG1 3.42Å; F57-A91 HydrophobicContact CD1-CB 4.28Å; F57-A272 HydrophobicContact CD1-CB 4.03Å; F57-A272 HydrophobicContact CE1-CB 3.6Å; F57-A272 HydrophobicContact CZ-CB 4.44Å; F57-A272 WeakPolarHBondContact CZ-O 3.34Å; F57-P273 HydrophobicContact CB-CG 4.24Å; F57-P273 HydrophobicContact CD1-CG 4.21Å; F57-P273 HydrophobicContact CD2-CB 4.14Å; F57-P273 HydrophobicContact CD2-CG 3.77Å; F57-P273 HydrophobicContact CE2-CB 4.16Å; F57-P273 HydrophobicContact CE2-CG 4.15Å; F57-P273 HydrophobicContact CG-CG 3.8Å; F57-Y276 HydrophobicContact CE2-CG 4.21Å; F57-Y276 HydrophobicContact CZ-CG 4.34Å |
| 58 | L | 92.5 | Very high | 88 | Confident | 23 Ų | 23 | 57.4 Ų | 57.4 | 12% | 0.12 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 174.5 | -176.8 | 67.5 | 0 | 0 | 0 | 111.5 | N54 V55 F60 L61 L62 F88 A91 L92 I95 | N54-L58 WeakPolarHBondContact O-CB 3.31Å; N54-L58 PolarHBondContact O-N 3.46Å; V55-L58 PolarHBondContact O-N 2.92Å; L58-F60 VanDerWaalsContact C-N 3.28Å; L58-F60 PolarHBondContact O-N 3.4Å; L58-L61 PolarHBondContact O-N 2.88Å; L58-L61 VanDerWaalsContact O-N 3.16Å; L58-L62 HydrophobicContact CG-CD1 4.12Å; L58-L62 HydrophobicContact CG-CG 4.45Å; L58-L62 WeakPolarHBondContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.31Å; L58-L62 PolarHBondContact O-N 3.48Å; L58-F88 HydrophobicContact CD1-CD2 3.86Å; L58-F88 HydrophobicContact CD1-CE2 3.54Å; L58-F88 HydrophobicContact CD1-CZ 4.2Å; L58-A91 HydrophobicContact CB-CB 4.37Å; L58-A91 HydrophobicContact CD1-CB 4.26Å; L58-L92 HydrophobicContact CD1-CD2 4.37Å; L58-L92 HydrophobicContact CD2-CD2 3.96Å; L58-I95 HydrophobicContact CB-CD1 3.89Å; L58-I95 HydrophobicContact CD2-CD1 3.42Å; L58-I95 VanDerWaalsContact CD2-CD1 3.42Å; L58-I95 HydrophobicContact CG-CD1 4.24Å |
| 59 | I | 93.4 | Very high | 87.6 | Confident | 102 Ų | 102 | 62.7 Ų | 62.7 | 52% | 0.523 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -57.7 | -44.9 | 175.3 | -68.8 | 168 | 0 | 0 | 0 | 109.9 | V55 L61 L62 W63 | V55-I59 HydrophobicContact CG1-CD1 3.74Å; V55-I59 HydrophobicContact CG1-CG1 4.34Å; V55-I59 VanDerWaalsContact O-CG1 3.3Å; V55-I59 WeakPolarHBondContact O-CG1 3.47Å; V55-I59 PolarHBondContact O-N 2.9Å; I59-L61 PolarHBondContact O-N 2.97Å; I59-L62 PolarHBondContact O-N 3.32Å; I59-W63 WeakPolarHBondContact O-CB 3.37Å; I59-W63 PolarHBondContact O-N 3.02Å |
| 60 | F | 91.9 | Very high | 87 | Confident | 67 Ų | 67 | 62.3 Ų | 62.3 | 29% | 0.294 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 175.6 | 169 | -96.7 | 0 | 0 | 0 | 112.7 | L56 F57 L58 W63 K64 Y276 | L56-F60 WeakPolarHBondContact O-CB 3.28Å; L56-F60 PolarHBondContact O-N 3.19Å; F57-F60 HydrophobicContact CD2-CD1 4.18Å; F57-F60 HydrophobicContact CE2-CD1 4.16Å; F57-F60 WeakPolarHBondContact O-CB 3.38Å; F57-F60 PolarHBondContact O-N 2.75Å; L58-F60 VanDerWaalsContact C-N 3.28Å; L58-F60 PolarHBondContact O-N 3.4Å; F60-W63 PolarHBondContact O-N 2.97Å; F60-K64 HydrophobicContact CE2-CG 4.13Å; F60-K64 HydrophobicContact CZ-CG 4.15Å; F60-K64 PolarHBondContact O-N 3.18Å; F60-Y276 AromaticContact CE1-CD1 4Å; F60-Y276 HydrophobicContact CE1-CD1 4Å; F60-Y276 HydrophobicContact CE1-CD2 4.36Å; F60-Y276 AromaticContact CE1-CE1 3.51Å; F60-Y276 HydrophobicContact CE1-CE1 3.51Å; F60-Y276 AromaticContact CE1-CE2 3.9Å; F60-Y276 HydrophobicContact CE1-CE2 3.9Å; F60-Y276 HydrophobicContact CE1-CG 4.42Å; F60-Y276 AromaticContact CE1-CZ 3.45Å; F60-Y276 VanDerWaalsContact CE1-CZ 3.45Å; F60-Y276 AromaticContact CZ-CE1 3.66Å; F60-Y276 HydrophobicContact CZ-CE1 3.66Å; F60-Y276 HydrophobicContact CZ-CE2 4.5Å; F60-Y276 AromaticContact CZ-CZ 3.65Å; F60-Y276 WeakPolarHBondContact CZ-OH 3.47Å |
| 61 | L | 89.3 | Confident | 86.4 | Confident | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -63.5 | -41.7 | 176.7 | -71.8 | 178.5 | 0 | 0 | 0 | 112.4 | F57 L58 I59 K64 L65 Y84 V87 F88 Y276 | F57-L61 HydrophobicContact CD1-CD1 4.08Å; F57-L61 HydrophobicContact CD1-CG 4.42Å; F57-L61 HydrophobicContact CE1-CD1 3.59Å; F57-L61 HydrophobicContact CE1-CD2 4.4Å; F57-L61 HydrophobicContact CE1-CG 4.02Å; F57-L61 HydrophobicContact CE2-CD2 4.29Å; F57-L61 HydrophobicContact CE2-CG 4.33Å; F57-L61 HydrophobicContact CZ-CD1 3.97Å; F57-L61 HydrophobicContact CZ-CD2 3.92Å; F57-L61 HydrophobicContact CZ-CG 3.97Å; F57-L61 WeakPolarHBondContact O-CG 3.11Å; F57-L61 PolarHBondContact O-N 2.8Å; L58-L61 PolarHBondContact O-N 2.88Å; L58-L61 VanDerWaalsContact O-N 3.16Å; I59-L61 PolarHBondContact O-N 2.97Å; L61-K64 CarbonylContact O-C 3.59Å; L61-K64 PolarHBondContact O-N 3.37Å; L61-L65 PolarHBondContact O-N 3.41Å; L61-Y84 HydrophobicContact CD2-CE2 4.05Å; L61-Y84 PolarHBondContact O-OH 3.33Å; L61-Y84 VanDerWaalsContact O-OH 3.12Å; L61-V87 HydrophobicContact CD1-CG1 4.01Å; L61-V87 HydrophobicContact CD2-CG1 4.5Å; L61-F88 HydrophobicContact CD1-CD2 4.37Å; L61-Y276 HydrophobicContact CD2-CD2 3.87Å; L61-Y276 HydrophobicContact CD2-CE2 4.16Å |
| 62 | L | 89.1 | Confident | 85.5 | Confident | 81 Ų | 81 | 64.6 Ų | 64.6 | 42% | 0.424 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -66.1 | -40.8 | 177.6 | -72.3 | 173.3 | 0 | 0 | 0 | 111.4 | L58 I59 K64 L65 F88 | L58-L62 HydrophobicContact CG-CD1 4.12Å; L58-L62 HydrophobicContact CG-CG 4.45Å; L58-L62 WeakPolarHBondContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.31Å; L58-L62 PolarHBondContact O-N 3.48Å; I59-L62 PolarHBondContact O-N 3.32Å; L62-K64 VanDerWaalsContact C-N 3.31Å; L62-K64 PolarHBondContact O-N 3.06Å; L62-L65 HydrophobicContact CD2-CD2 4.39Å; L62-L65 WeakPolarHBondContact O-CB 3.49Å; L62-L65 PolarHBondContact O-N 2.89Å; L62-F88 HydrophobicContact CD2-CE2 3.92Å; L62-F88 HydrophobicContact CD2-CZ 4.42Å; L62-F88 HydrophobicContact CG-CE2 4.48Å |
| 63 | W | 89.1 | Confident | 84.6 | Confident | 201 Ų | 201 | 70.7 Ų | 70.7 | 76% | 0.761 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -64.7 | -36.2 | 176 | -175.9 | 26.3 | 0 | 0 | 0 | 112.2 | I59 F60 P66 | I59-W63 WeakPolarHBondContact O-CB 3.37Å; I59-W63 PolarHBondContact O-N 3.02Å; F60-W63 PolarHBondContact O-N 2.97Å; W63-P66 WeakPolarHBondContact O-CD 3.46Å |
| 64 | K | 84.5 | Confident | 83.5 | Confident | 90 Ų | 90 | 76.7 Ų | 76.7 | 39% | 0.391 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -82.3 | -8.3 | 175.2 | -73.1 | -68.4 | -173.7 | -176.7 | 0 | 114.3 | F60 L61 L62 S67 A68 | F60-K64 HydrophobicContact CE2-CG 4.13Å; F60-K64 HydrophobicContact CZ-CG 4.15Å; F60-K64 PolarHBondContact O-N 3.18Å; L61-K64 CarbonylContact O-C 3.59Å; L61-K64 PolarHBondContact O-N 3.37Å; L62-K64 VanDerWaalsContact C-N 3.31Å; L62-K64 PolarHBondContact O-N 3.06Å; K64-S67 PolarHBondContact O-N 3.43Å; K64-A68 VanDerWaalsContact O-CB 3.31Å; K64-A68 WeakPolarHBondContact O-CB 3.36Å; K64-A68 PolarHBondContact O-N 2.81Å |
| 65 | L | 81.2 | Confident | 82.2 | Confident | 34 Ų | 34 | 79 Ų | 79 | 18% | 0.178 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -54.6 | -45.5 | -178.3 | -172.4 | 68 | 0 | 0 | 0 | 114.6 | L61 L62 A68 R69 Y84 | L61-L65 PolarHBondContact O-N 3.41Å; L62-L65 HydrophobicContact CD2-CD2 4.39Å; L62-L65 WeakPolarHBondContact O-CB 3.49Å; L62-L65 PolarHBondContact O-N 2.89Å; L65-A68 PolarHBondContact O-N 3.29Å; L65-R69 HydrophobicContact CD1-CG 4.28Å; L65-R69 HydrophobicContact CG-CG 4.36Å; L65-R69 VanDerWaalsContact O-CB 3.31Å; L65-R69 WeakPolarHBondContact O-CB 3.4Å; L65-R69 VanDerWaalsContact O-CG 3.29Å; L65-R69 WeakPolarHBondContact O-CG 3.44Å; L65-R69 PolarHBondContact O-N 3.12Å; L65-Y84 HydrophobicContact CD1-CE1 3.84Å; L65-Y84 WeakPolarHBondContact CD1-OH 3.4Å |
| 66 | P | 78.4 | Confident | 80.5 | Confident | 84 Ų | 84 | 82 Ų | 82 | 55% | 0.545 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -64.4 | -43.8 | 179.7 | 22.9 | -33.2 | 0 | 0 | 0 | 112.6 | W63 A68 R69 A70 | W63-P66 WeakPolarHBondContact O-CD 3.46Å; P66-A68 VanDerWaalsContact C-N 3.34Å; P66-R69 PolarHBondContact O-N 3.16Å; P66-A70 PolarHBondContact O-N 3.36Å |
| 67 | S | 76.4 | Confident | 79.4 | Confident | 74 Ų | 74 | 78.2 Ų | 78.2 | 52% | 0.517 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.4 | -40.8 | 175.3 | -53 | 0 | 0 | 0 | 0 | 111.6 | K64 A70 K71 | K64-S67 PolarHBondContact O-N 3.43Å; S67-A70 PolarHBondContact O-N 3.2Å; S67-K71 PolarHBondContact O-N 3.45Å; S67-K71 VanDerWaalsContact O-N 3.12Å |
| 68 | A | 74.4 | Confident | 78.6 | Confident | 2 Ų | 2 | 78.8 Ų | 78.8 | 2% | 0.017 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63.3 | -46.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | K64 L65 P66 A70 K71 I72 Y84 F284 | K64-A68 VanDerWaalsContact O-CB 3.31Å; K64-A68 WeakPolarHBondContact O-CB 3.36Å; K64-A68 PolarHBondContact O-N 2.81Å; L65-A68 PolarHBondContact O-N 3.29Å; P66-A68 VanDerWaalsContact C-N 3.34Å; A68-A70 PolarHBondContact O-N 2.81Å; A68-K71 PolarHBondContact O-N 3.02Å; A68-I72 HydrophobicContact CB-CD1 4.37Å; A68-I72 WeakPolarHBondContact O-CB 3.46Å; A68-I72 WeakPolarHBondContact O-CD1 3.38Å; A68-I72 WeakPolarHBondContact O-CG1 3.34Å; A68-I72 PolarHBondContact O-N 2.84Å; A68-Y84 HydrophobicContact CB-CE2 4.44Å; A68-F284 HydrophobicContact CB-CD1 3.8Å; A68-F284 HydrophobicContact CB-CE1 3.31Å; A68-F284 HydrophobicContact CB-CE2 4.43Å; A68-F284 HydrophobicContact CB-CZ 3.68Å |
| 69 | R | 77.1 | Confident | 78 | Confident | 161 Ų | 161 | 78.1 Ų | 78.1 | 61% | 0.608 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -60.2 | -43.1 | 177.5 | -80.4 | 178.7 | 169.9 | 165.6 | -1.9 | 112.4 | L65 P66 K71 R73 | L65-R69 HydrophobicContact CD1-CG 4.28Å; L65-R69 HydrophobicContact CG-CG 4.36Å; L65-R69 VanDerWaalsContact O-CB 3.31Å; L65-R69 WeakPolarHBondContact O-CB 3.4Å; L65-R69 VanDerWaalsContact O-CG 3.29Å; L65-R69 WeakPolarHBondContact O-CG 3.44Å; L65-R69 PolarHBondContact O-N 3.12Å; P66-R69 PolarHBondContact O-N 3.16Å; R69-K71 VanDerWaalsContact C-N 3.33Å; R69-K71 PolarHBondContact O-N 3.19Å; R69-R73 WeakPolarHBondContact O-CB 3.48Å; R69-R73 PolarHBondContact O-N 3.17Å |
| 70 | A | 74.9 | Confident | 77.4 | Confident | 55 Ų | 55 | 74.4 Ų | 74.4 | 46% | 0.455 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | P66 S67 A68 R73 I74 | P66-A70 PolarHBondContact O-N 3.36Å; S67-A70 PolarHBondContact O-N 3.2Å; A68-A70 PolarHBondContact O-N 2.81Å; A70-R73 PolarHBondContact O-N 2.82Å; A70-I74 WeakPolarHBondContact O-CG1 3.05Å |
| 71 | K | 73.9 | Confident | 76.9 | Confident | 45 Ų | 45 | 73.8 Ų | 73.8 | 20% | 0.196 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -73.6 | -35.7 | -178.9 | -156.4 | 167.3 | -171.8 | 178.3 | 0 | 113.5 | S67 A68 R69 R73 I74 T75 F283 S286 | S67-K71 PolarHBondContact O-N 3.45Å; S67-K71 VanDerWaalsContact O-N 3.12Å; A68-K71 PolarHBondContact O-N 3.02Å; R69-K71 VanDerWaalsContact C-N 3.33Å; R69-K71 PolarHBondContact O-N 3.19Å; K71-R73 VanDerWaalsContact C-N 3.34Å; K71-I74 PolarHBondContact O-N 2.93Å; K71-T75 PolarHBondContact O-N 2.71Å; K71-F283 WeakPolarHBondContact CD-O 2.88Å; K71-F283 WeakPolarHBondContact CE-O 3.32Å; K71-F283 HydrophobicContact CG-CE1 4.46Å; K71-F283 HydrophobicContact CG-CZ 4.22Å; K71-F283 PolarHBondContact NZ-O 2.75Å; K71-S286 PolarHBondContact NZ-O 3.05Å; K71-S286 PolarHBondContact NZ-OG 2.83Å |
| 72 | I | 72.8 | Confident | 76.7 | Confident | 36 Ų | 36 | 74.9 Ų | 74.9 | 19% | 0.185 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.8 | -35.1 | 174.3 | -70.7 | 163.8 | 0 | 0 | 0 | 111.2 | A68 I74 T75 I81 F283 F284 | A68-I72 HydrophobicContact CB-CD1 4.37Å; A68-I72 WeakPolarHBondContact O-CB 3.46Å; A68-I72 WeakPolarHBondContact O-CD1 3.38Å; A68-I72 WeakPolarHBondContact O-CG1 3.34Å; A68-I72 PolarHBondContact O-N 2.84Å; I72-I74 PolarHBondContact O-N 3.13Å; I72-T75 CarbonylContact O-C 3.6Å; I72-I81 HydrophobicContact CG1-CG1 4.4Å; I72-I81 HydrophobicContact CG2-CD1 3.6Å; I72-I81 HydrophobicContact CG2-CG1 3.69Å; I72-F283 HydrophobicContact CG1-CE1 4.34Å; I72-F284 HydrophobicContact CD1-CE1 4.26Å; I72-F284 HydrophobicContact CD1-CZ 4.12Å; I72-F284 HydrophobicContact CG1-CE1 4.2Å; I72-F284 HydrophobicContact CG1-CZ 4.37Å |
| 73 | R | 71.3 | Confident | 76.5 | Confident | 225 Ų | 225 | 71 Ų | 71 | 85% | 0.849 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -62.6 | -33.5 | 175.5 | -170.2 | -176.4 | -62 | -142.1 | 0.9 | 112 | R69 A70 K71 | R69-R73 WeakPolarHBondContact O-CB 3.48Å; R69-R73 PolarHBondContact O-N 3.17Å; A70-R73 PolarHBondContact O-N 2.82Å; K71-R73 VanDerWaalsContact C-N 3.34Å |
| 74 | I | 69.5 | Low | 76.4 | Confident | 147 Ų | 147 | 62.3 Ų | 62.3 | 75% | 0.754 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -89 | -35.2 | -176.5 | -60.3 | 166.3 | 0 | 0 | 0 | 111.2 | A70 K71 I72 | A70-I74 WeakPolarHBondContact O-CG1 3.05Å; K71-I74 PolarHBondContact O-N 2.93Å; I72-I74 PolarHBondContact O-N 3.13Å |
| 75 | T | 65.3 | Low | 76.6 | Confident | 54 Ų | 54 | 62.4 Ų | 62.4 | 33% | 0.331 | 33% | 0.331 | S | S | . | . | trans | -104.9 | 114 | 179 | -61 | 0 | 0 | 0 | 0 | 111.6 | K71 I72 S77 F283 | K71-T75 PolarHBondContact O-N 2.71Å; I72-T75 CarbonylContact O-C 3.6Å; T75-S77 VanDerWaalsContact C-N 3.32Å; T75-S77 PolarHBondContact O-N 3.07Å; T75-F283 HydrophobicContact CG2-CE2 3.67Å; T75-F283 HydrophobicContact CG2-CZ 3.95Å | ||
| 76 | S | 58.3 | Low | 76.8 | Confident | 113 Ų | 113 | 62 Ų | 62 | 79% | 0.79 | 33% | 0.328 | S | S | * | . | trans | -83.6 | 12.5 | -173.4 | 58 | 0 | 0 | 0 | 0 | 115.9 | P78 | S76-P78 WeakPolarHBondContact O-CD 3.37Š| ||
| 77 | S | 71.4 | Confident | 77.3 | Confident | 32 Ų | 32 | 58 Ų | 58 | 22% | 0.224 | 30% | 0.302 | C | S | . | . | trans | -71.7 | 112.2 | -177.2 | 178.3 | 0 | 0 | 0 | 0 | 110.9 | T75 I79 | T75-S77 VanDerWaalsContact C-N 3.32Å; T75-S77 PolarHBondContact O-N 3.07Å; S77-I79 PolarHBondContact O-N 3.12Å | ||
| 78 | P | 76.4 | Confident | 77.9 | Confident | 29 Ų | 29 | 57.2 Ų | 57.2 | 19% | 0.188 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.1 | -24.2 | -173.8 | 27 | -33.9 | 0 | 0 | 0 | 112.9 | S76 I81 T82 K145 I148 | S76-P78 WeakPolarHBondContact O-CD 3.37Å; P78-I81 PolarHBondContact O-N 3.4Å; P78-T82 PolarHBondContact O-N 3.04Å; P78-T82 PolarHBondContact O-OG1 3.16Å; P78-T82 VanDerWaalsContact O-OG1 3.11Å; P78-K145 HydrophobicContact CB-CG 4.45Å; P78-I148 HydrophobicContact CB-CD1 3.88Å; P78-I148 HydrophobicContact CG-CD1 3.82Å |
| 79 | I | 79.5 | Confident | 78.6 | Confident | 8 Ų | 8 | 59.7 Ų | 59.7 | 4% | 0.041 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -67 | -45.9 | -175.8 | -60 | 171.6 | 0 | 0 | 0 | 111.4 | S77 I81 T82 F83 F139 I148 | S77-I79 PolarHBondContact O-N 3.12Å; I79-I81 VanDerWaalsContact C-N 3.28Å; I79-I81 PolarHBondContact O-N 2.91Å; I79-T82 WeakPolarHBondContact O-CB 3.49Å; I79-T82 PolarHBondContact O-N 3.21Å; I79-F83 HydrophobicContact CG2-CD2 4.14Å; I79-F83 HydrophobicContact CG2-CE1 4.47Å; I79-F83 HydrophobicContact CG2-CE2 3.67Å; I79-F83 HydrophobicContact CG2-CZ 3.86Å; I79-F83 PolarHBondContact O-N 2.94Å; I79-F139 HydrophobicContact CG2-CE2 3.92Å; I79-F139 HydrophobicContact CG2-CZ 4.14Å; I79-I148 HydrophobicContact CG1-CD1 3.86Å |
| 80 | F | 80.9 | Confident | 79 | Confident | 24 Ų | 24 | 52.1 Ų | 52.1 | 11% | 0.105 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -66.4 | -33.3 | 178.9 | -67.5 | -70.2 | 0 | 0 | 0 | 112.1 | Y84 F139 L280 F283 | F80-Y84 WeakPolarHBondContact O-CB 3.15Å; F80-Y84 PolarHBondContact O-N 2.83Å; F80-F139 HydrophobicContact CZ-CZ 4.28Å; F80-L280 HydrophobicContact CD1-CD2 4.34Å; F80-F283 HydrophobicContact CB-CD1 4.42Å; F80-F283 HydrophobicContact CD1-CB 4.18Å; F80-F283 HydrophobicContact CD1-CG 4.28Å; F80-F283 HydrophobicContact CD2-CD2 4.25Å; F80-F283 HydrophobicContact CD2-CE2 4.47Å; F80-F283 HydrophobicContact CE1-CB 4.3Å; F80-F283 HydrophobicContact CE2-CD2 4.46Å; F80-F283 HydrophobicContact CG-CD2 4.34Å; F80-F283 HydrophobicContact CG-CG 4.25Å |
| 81 | I | 82.3 | Confident | 79.7 | Confident | 55 Ų | 55 | 49.5 Ų | 49.5 | 28% | 0.282 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65 | -47.3 | 173.7 | -59 | 174.1 | 0 | 0 | 0 | 109.7 | I72 P78 I79 F83 Y84 I85 | I72-I81 HydrophobicContact CG1-CG1 4.4Å; I72-I81 HydrophobicContact CG2-CD1 3.6Å; I72-I81 HydrophobicContact CG2-CG1 3.69Å; P78-I81 PolarHBondContact O-N 3.4Å; I79-I81 VanDerWaalsContact C-N 3.28Å; I79-I81 PolarHBondContact O-N 2.91Å; I81-F83 PolarHBondContact O-N 2.84Å; I81-Y84 PolarHBondContact O-N 3.05Å; I81-I85 HydrophobicContact CG2-CD1 3.85Å; I81-I85 HydrophobicContact CG2-CG1 4.47Å; I81-I85 WeakPolarHBondContact O-CG1 3.41Å; I81-I85 PolarHBondContact O-N 3.35Å |
| 82 | T | 84.4 | Confident | 80.4 | Confident | 23 Ų | 23 | 51.1 Ų | 51.1 | 14% | 0.141 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -57.2 | -49.1 | 175.9 | -63 | 0 | 0 | 0 | 0 | 111.2 | P78 I79 Y84 I85 L86 L135 I148 L152 | P78-T82 PolarHBondContact O-N 3.04Å; P78-T82 PolarHBondContact O-OG1 3.16Å; P78-T82 VanDerWaalsContact O-OG1 3.11Å; I79-T82 WeakPolarHBondContact O-CB 3.49Å; I79-T82 PolarHBondContact O-N 3.21Å; T82-Y84 VanDerWaalsContact C-N 3.33Å; T82-Y84 PolarHBondContact O-N 3.2Å; T82-I85 PolarHBondContact O-N 3.3Å; T82-L86 HydrophobicContact CG2-CD1 3.78Å; T82-L86 HydrophobicContact CG2-CG 4.17Å; T82-L86 VanDerWaalsContact O-CG 3.25Å; T82-L86 WeakPolarHBondContact O-CG 3.36Å; T82-L86 PolarHBondContact O-N 3.06Å; T82-L135 HydrophobicContact CG2-CD1 4.39Å; T82-I148 HydrophobicContact CG2-CG2 4.09Å; T82-L152 HydrophobicContact CG2-CD1 4.15Å; T82-L152 HydrophobicContact CG2-CD2 4.43Å |
| 83 | F | 85.2 | Confident | 81.1 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.5 | -40.3 | 177.2 | -68.3 | -22.5 | 0 | 0 | 0 | 113.1 | I79 I81 L86 V87 V132 L135 F139 F279 L280 | I79-F83 HydrophobicContact CG2-CD2 4.14Å; I79-F83 HydrophobicContact CG2-CE1 4.47Å; I79-F83 HydrophobicContact CG2-CE2 3.67Å; I79-F83 HydrophobicContact CG2-CZ 3.86Å; I79-F83 PolarHBondContact O-N 2.94Å; I81-F83 PolarHBondContact O-N 2.84Å; F83-L86 HydrophobicContact CD1-CD1 4.33Å; F83-L86 PolarHBondContact O-N 3.49Å; F83-V87 WeakPolarHBondContact O-CB 2.97Å; F83-V87 WeakPolarHBondContact O-CG2 3.47Å; F83-V87 PolarHBondContact O-N 2.81Å; F83-V132 HydrophobicContact CD1-CG2 4Å; F83-V132 HydrophobicContact CE1-CB 4.34Å; F83-V132 HydrophobicContact CE1-CG1 4.43Å; F83-V132 HydrophobicContact CE1-CG2 3.87Å; F83-L135 HydrophobicContact CE1-CB 4Å; F83-L135 HydrophobicContact CE1-CD1 3.83Å; F83-L135 HydrophobicContact CZ-CB 3.98Å; F83-F139 HydrophobicContact CE2-CE2 4.31Å; F83-F279 HydrophobicContact CD2-CB 3.91Å; F83-F279 HydrophobicContact CD2-CG 4.17Å; F83-F279 HydrophobicContact CE2-CB 4.27Å; F83-F279 HydrophobicContact CE2-CD1 4.05Å; F83-F279 HydrophobicContact CE2-CG 4.1Å; F83-L280 HydrophobicContact CB-CD2 4.05Å; F83-L280 HydrophobicContact CB-CG 4.47Å |
| 84 | Y | 87.1 | Confident | 81.9 | Confident | 18 Ų | 18 | 40.4 Ų | 40.4 | 7% | 0.071 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.1 | -44.3 | 175.8 | -174.6 | -97.6 | 0 | 0 | 0 | 112 | L61 L65 A68 F80 I81 T82 F88 L280 F284 | L61-Y84 HydrophobicContact CD2-CE2 4.05Å; L61-Y84 PolarHBondContact O-OH 3.33Å; L61-Y84 VanDerWaalsContact O-OH 3.12Å; L65-Y84 HydrophobicContact CD1-CE1 3.84Å; L65-Y84 WeakPolarHBondContact CD1-OH 3.4Å; A68-Y84 HydrophobicContact CB-CE2 4.44Å; F80-Y84 WeakPolarHBondContact O-CB 3.15Å; F80-Y84 PolarHBondContact O-N 2.83Å; I81-Y84 PolarHBondContact O-N 3.05Å; T82-Y84 VanDerWaalsContact C-N 3.33Å; T82-Y84 PolarHBondContact O-N 3.2Å; Y84-F88 WeakPolarHBondContact O-CB 3.5Å; Y84-F88 PolarHBondContact O-N 3.11Å; Y84-L280 HydrophobicContact CD2-CD1 4.24Å; Y84-F284 AromaticContact CD2-CE2 3.97Å; Y84-F284 HydrophobicContact CD2-CE2 3.97Å; Y84-F284 HydrophobicContact CD2-CZ 4.18Å |
| 85 | I | 87.2 | Confident | 82.9 | Confident | 92 Ų | 92 | 34.9 Ų | 34.9 | 47% | 0.472 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -64.1 | -46.4 | 177 | -66.2 | 168.9 | 0 | 0 | 0 | 110.8 | I81 T82 V87 F88 V89 | I81-I85 HydrophobicContact CG2-CD1 3.85Å; I81-I85 HydrophobicContact CG2-CG1 4.47Å; I81-I85 WeakPolarHBondContact O-CG1 3.41Å; I81-I85 PolarHBondContact O-N 3.35Å; T82-I85 PolarHBondContact O-N 3.3Å; I85-V87 VanDerWaalsContact C-N 3.35Å; I85-V87 PolarHBondContact O-N 2.97Å; I85-F88 WeakPolarHBondContact O-CB 3.38Å; I85-F88 PolarHBondContact O-N 3.21Å; I85-V89 HydrophobicContact CG2-CG2 4.25Å; I85-V89 WeakPolarHBondContact O-CG2 3.48Å; I85-V89 PolarHBondContact O-N 3.36Å |
| 86 | L | 85.5 | Confident | 83.9 | Confident | 24 Ų | 24 | 34.7 Ų | 34.7 | 13% | 0.126 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.9 | -46 | -179.3 | -68.1 | 170.6 | 0 | 0 | 0 | 111.3 | T82 F83 F88 V89 V90 I128 L152 | T82-L86 HydrophobicContact CG2-CD1 3.78Å; T82-L86 HydrophobicContact CG2-CG 4.17Å; T82-L86 VanDerWaalsContact O-CG 3.25Å; T82-L86 WeakPolarHBondContact O-CG 3.36Å; T82-L86 PolarHBondContact O-N 3.06Å; F83-L86 HydrophobicContact CD1-CD1 4.33Å; F83-L86 PolarHBondContact O-N 3.49Å; L86-F88 VanDerWaalsContact C-N 3.32Å; L86-F88 PolarHBondContact O-N 2.84Å; L86-V89 PolarHBondContact O-N 3.05Å; L86-V90 WeakPolarHBondContact O-CG2 3.19Å; L86-V90 PolarHBondContact O-N 3.32Å; L86-I128 HydrophobicContact CB-CD1 4.09Å; L86-I128 HydrophobicContact CB-CG1 4.22Å; L86-I128 HydrophobicContact CB-CG2 4.07Å; L86-I128 HydrophobicContact CD2-CD1 4.09Å; L86-I128 HydrophobicContact CD2-CG1 3.81Å; L86-I128 HydrophobicContact CG-CG1 4.43Å; L86-L152 HydrophobicContact CD1-CD2 4.22Å; L86-L152 HydrophobicContact CD2-CD2 4.2Å |
| 87 | V | 88.6 | Confident | 85.3 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.5 | -38 | 178.3 | 170.6 | 0 | 0 | 0 | 0 | 111.8 | F57 L61 F83 I85 A91 A272 I275 L280 | F57-V87 HydrophobicContact CE1-CG1 3.34Å; F57-V87 HydrophobicContact CZ-CG1 3.42Å; F57-V87 VanDerWaalsContact CZ-CG1 3.42Å; L61-V87 HydrophobicContact CD1-CG1 4.01Å; L61-V87 HydrophobicContact CD2-CG1 4.5Å; F83-V87 WeakPolarHBondContact O-CB 2.97Å; F83-V87 WeakPolarHBondContact O-CG2 3.47Å; F83-V87 PolarHBondContact O-N 2.81Å; I85-V87 VanDerWaalsContact C-N 3.35Å; I85-V87 PolarHBondContact O-N 2.97Å; V87-A91 PolarHBondContact O-N 3.36Å; V87-A272 HydrophobicContact CG1-CB 4.15Å; V87-I275 HydrophobicContact CG2-CB 3.68Å; V87-I275 HydrophobicContact CG2-CD1 4.28Å; V87-I275 HydrophobicContact CG2-CG2 3.33Å; V87-L280 HydrophobicContact CG2-CD1 4.43Å |
| 88 | F | 89.6 | Confident | 85.8 | Confident | 59 Ų | 59 | 28 Ų | 28 | 26% | 0.259 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -66.2 | -43.2 | 174.6 | -173 | -95.2 | 0 | 0 | 0 | 112.1 | L58 L61 L62 Y84 I85 L86 A91 L92 | L58-F88 HydrophobicContact CD1-CD2 3.86Å; L58-F88 HydrophobicContact CD1-CE2 3.54Å; L58-F88 HydrophobicContact CD1-CZ 4.2Å; L61-F88 HydrophobicContact CD1-CD2 4.37Å; L62-F88 HydrophobicContact CD2-CE2 3.92Å; L62-F88 HydrophobicContact CD2-CZ 4.42Å; L62-F88 HydrophobicContact CG-CE2 4.48Å; Y84-F88 WeakPolarHBondContact O-CB 3.5Å; Y84-F88 PolarHBondContact O-N 3.11Å; I85-F88 WeakPolarHBondContact O-CB 3.38Å; I85-F88 PolarHBondContact O-N 3.21Å; L86-F88 VanDerWaalsContact C-N 3.32Å; L86-F88 PolarHBondContact O-N 2.84Å; F88-A91 PolarHBondContact O-N 3.42Å; F88-L92 HydrophobicContact CD1-CD1 3.76Å; F88-L92 HydrophobicContact CD1-CG 4.28Å; F88-L92 HydrophobicContact CE1-CD1 3.3Å; F88-L92 HydrophobicContact CE1-CG 3.99Å; F88-L92 HydrophobicContact CZ-CD1 4.04Å; F88-L92 HydrophobicContact CZ-CG 4.39Å; F88-L92 PolarHBondContact O-N 2.97Å |
| 89 | V | 88.6 | Confident | 86.2 | Confident | 53 Ų | 53 | 30 Ų | 30 | 32% | 0.321 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -61 | -45.2 | 176.5 | 170 | 0 | 0 | 0 | 0 | 110.9 | I85 L86 A91 L92 V93 | I85-V89 HydrophobicContact CG2-CG2 4.25Å; I85-V89 WeakPolarHBondContact O-CG2 3.48Å; I85-V89 PolarHBondContact O-N 3.36Å; L86-V89 PolarHBondContact O-N 3.05Å; V89-A91 PolarHBondContact O-N 3.28Å; V89-L92 PolarHBondContact O-N 3.37Å; V89-V93 HydrophobicContact CG1-CG2 4.16Å; V89-V93 VanDerWaalsContact O-CG2 3.3Å; V89-V93 WeakPolarHBondContact O-CG2 3.22Å; V89-V93 PolarHBondContact O-N 3.23Å |
| 90 | V | 86.5 | Confident | 86.4 | Confident | 3 Ų | 3 | 32.4 Ų | 32.4 | 2% | 0.018 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -58.7 | -47.2 | 177.3 | 173.5 | 0 | 0 | 0 | 0 | 111.6 | L86 L92 V93 G94 L125 I128 F271 A272 | L86-V90 WeakPolarHBondContact O-CG2 3.19Å; L86-V90 PolarHBondContact O-N 3.32Å; V90-L92 VanDerWaalsContact C-N 3.3Å; V90-L92 PolarHBondContact O-N 3.04Å; V90-V93 PolarHBondContact O-N 3.09Å; V90-G94 PolarHBondContact O-N 2.87Å; V90-L125 HydrophobicContact CG1-CD1 4.15Å; V90-L125 HydrophobicContact CG1-CG 4.16Å; V90-I128 HydrophobicContact CG2-CB 4.48Å; V90-I128 HydrophobicContact CG2-CD1 3.19Å; V90-I128 HydrophobicContact CG2-CG1 4.38Å; V90-I128 HydrophobicContact CG2-CG2 4.42Å; V90-F271 HydrophobicContact CG1-CD1 4.45Å; V90-A272 HydrophobicContact CB-CB 4.23Å; V90-A272 HydrophobicContact CG1-CB 3.93Å |
| 91 | A | 89.1 | Confident | 86.2 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.8 | -42 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | F57 L58 V87 F88 V89 G94 I95 | F57-A91 HydrophobicContact CD1-CB 4.28Å; L58-A91 HydrophobicContact CB-CB 4.37Å; L58-A91 HydrophobicContact CD1-CB 4.26Å; V87-A91 PolarHBondContact O-N 3.36Å; F88-A91 PolarHBondContact O-N 3.42Å; V89-A91 PolarHBondContact O-N 3.28Å; A91-G94 PolarHBondContact O-N 3.29Å; A91-I95 WeakPolarHBondContact O-CD1 3.44Å; A91-I95 VanDerWaalsContact O-CG1 3.26Å; A91-I95 WeakPolarHBondContact O-CG1 3.39Å; A91-I95 PolarHBondContact O-N 3.21Å |
| 92 | L | 89.6 | Confident | 85.9 | Confident | 79 Ų | 79 | 31.2 Ų | 31.2 | 41% | 0.414 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -64.7 | -45.6 | 175.7 | -76.6 | -179.1 | 0 | 0 | 0 | 112.8 | L58 F88 V89 V90 G94 I95 A96 | L58-L92 HydrophobicContact CD1-CD2 4.37Å; L58-L92 HydrophobicContact CD2-CD2 3.96Å; F88-L92 HydrophobicContact CD1-CD1 3.76Å; F88-L92 HydrophobicContact CD1-CG 4.28Å; F88-L92 HydrophobicContact CE1-CD1 3.3Å; F88-L92 HydrophobicContact CE1-CG 3.99Å; F88-L92 HydrophobicContact CZ-CD1 4.04Å; F88-L92 HydrophobicContact CZ-CG 4.39Å; F88-L92 PolarHBondContact O-N 2.97Å; V89-L92 PolarHBondContact O-N 3.37Å; V90-L92 VanDerWaalsContact C-N 3.3Å; V90-L92 PolarHBondContact O-N 3.04Å; L92-G94 VanDerWaalsContact C-N 3.33Å; L92-G94 PolarHBondContact O-N 3.38Å; L92-I95 PolarHBondContact O-N 2.87Å; L92-A96 VanDerWaalsContact O-CB 3.28Å; L92-A96 WeakPolarHBondContact O-CB 3.37Å; L92-A96 PolarHBondContact O-N 3.27Å |
| 93 | V | 87.6 | Confident | 85.6 | Confident | 28 Ų | 28 | 34.6 Ų | 34.6 | 17% | 0.17 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.8 | -42.2 | 178.3 | 175.2 | 0 | 0 | 0 | 0 | 110.2 | V89 V90 I95 A96 R97 T121 F124 | V89-V93 HydrophobicContact CG1-CG2 4.16Å; V89-V93 VanDerWaalsContact O-CG2 3.3Å; V89-V93 WeakPolarHBondContact O-CG2 3.22Å; V89-V93 PolarHBondContact O-N 3.23Å; V90-V93 PolarHBondContact O-N 3.09Å; V93-I95 PolarHBondContact O-N 3.2Å; V93-A96 PolarHBondContact O-N 2.97Å; V93-R97 WeakPolarHBondContact O-CB 3.42Å; V93-R97 PolarHBondContact O-N 3.36Å; V93-T121 HydrophobicContact CG1-CG2 4.04Å; V93-F124 HydrophobicContact CG1-CD2 3.98Å; V93-F124 HydrophobicContact CG2-CD2 4.15Å; V93-F124 HydrophobicContact CG2-CE2 4.47Å; V93-F124 HydrophobicContact CG2-CG 4.48Å |
| 94 | G | 87.4 | Confident | 85.1 | Confident | 8 Ų | 8 | 37.7 Ų | 37.7 | 8% | 0.082 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.9 | -42.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | V90 A91 L92 A98 | V90-G94 PolarHBondContact O-N 2.87Å; A91-G94 PolarHBondContact O-N 3.29Å; L92-G94 VanDerWaalsContact C-N 3.33Å; L92-G94 PolarHBondContact O-N 3.38Å; G94-A98 PolarHBondContact O-N 3.33Å |
| 95 | I | 89.7 | Confident | 83.7 | Confident | 30 Ų | 30 | 39.8 Ų | 39.8 | 15% | 0.154 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -67.9 | -46.5 | 175.4 | -67.4 | 162.8 | 0 | 0 | 0 | 110.8 | L51 N54 V55 L58 A91 L92 V93 R97 A98 V99 | L51-I95 HydrophobicContact CD1-CB 4.32Å; L51-I95 HydrophobicContact CD1-CG1 4.19Å; L51-I95 HydrophobicContact CD1-CG2 4.01Å; N54-I95 HydrophobicContact CB-CG1 4Å; V55-I95 HydrophobicContact CG2-CD1 3.96Å; V55-I95 HydrophobicContact CG2-CG1 3.86Å; L58-I95 HydrophobicContact CB-CD1 3.89Å; L58-I95 HydrophobicContact CD2-CD1 3.42Å; L58-I95 VanDerWaalsContact CD2-CD1 3.42Å; L58-I95 HydrophobicContact CG-CD1 4.24Å; A91-I95 WeakPolarHBondContact O-CD1 3.44Å; A91-I95 VanDerWaalsContact O-CG1 3.26Å; A91-I95 WeakPolarHBondContact O-CG1 3.39Å; A91-I95 PolarHBondContact O-N 3.21Å; L92-I95 PolarHBondContact O-N 2.87Å; V93-I95 PolarHBondContact O-N 3.2Å; I95-R97 VanDerWaalsContact C-N 3.26Å; I95-R97 PolarHBondContact O-N 2.9Å; I95-A98 PolarHBondContact O-N 3.06Å; I95-V99 HydrophobicContact CG2-CG2 4.18Å; I95-V99 WeakPolarHBondContact O-CG2 3.46Å; I95-V99 PolarHBondContact O-N 2.99Å |
| 96 | A | 87.7 | Confident | 82.4 | Confident | 50 Ų | 50 | 41.1 Ų | 41.1 | 41% | 0.413 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -57.6 | -41.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111 | L92 V93 V99 V100 | L92-A96 VanDerWaalsContact O-CB 3.28Å; L92-A96 WeakPolarHBondContact O-CB 3.37Å; L92-A96 PolarHBondContact O-N 3.27Å; V93-A96 PolarHBondContact O-N 2.97Å; A96-V99 PolarHBondContact O-N 3.38Å; A96-V100 WeakPolarHBondContact O-CB 3.48Å; A96-V100 WeakPolarHBondContact O-CG2 3.3Å; A96-V100 PolarHBondContact O-N 3.4Å |
| 97 | R | 86.1 | Confident | 81.5 | Confident | 4 Ų | 4 | 43 Ų | 43 | 2% | 0.015 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -56.1 | -54.3 | 174.6 | -170.2 | -150.3 | 68.8 | 73.7 | 1 | 111.6 | D47 L50 V93 I95 V99 V100 S101 L117 T121 | D47-R97 IonicContact OD1-CZ 3.6Å; D47-R97 VanDerWaalsContact OD1-CZ 3.26Å; D47-R97 IonicContact OD1-NH1 3.73Å; D47-R97 PolarHBondContact OD1-NH1 3.29Å; D47-R97 IonicContact OD1-NH2 3.32Å; D47-R97 PolarHBondContact OD1-NH2 2.97Å; L50-R97 VanDerWaalsContact CD1-NH2 3.26Å; V93-R97 WeakPolarHBondContact O-CB 3.42Å; V93-R97 PolarHBondContact O-N 3.36Å; I95-R97 VanDerWaalsContact C-N 3.26Å; I95-R97 PolarHBondContact O-N 2.9Å; R97-V99 PolarHBondContact O-N 3.23Å; R97-V100 PolarHBondContact O-N 3.45Å; R97-S101 WeakPolarHBondContact O-CB 3.34Å; R97-S101 PolarHBondContact O-N 3.22Å; R97-L117 HydrophobicContact CB-CD2 4.26Å; R97-L117 HydrophobicContact CB-CG 4.3Å; R97-L117 HydrophobicContact CG-CD2 3.91Å; R97-L117 HydrophobicContact CG-CG 3.84Å; R97-T121 WeakPolarHBondContact CG-OG1 3.37Å |
| 98 | A | 83.7 | Confident | 80.4 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.4 | -41.8 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L51 G94 I95 S101 M102 | L51-A98 HydrophobicContact CB-CB 3.87Å; L51-A98 HydrophobicContact CD1-CB 3.87Å; L51-A98 HydrophobicContact CG-CB 4.35Å; G94-A98 PolarHBondContact O-N 3.33Å; I95-A98 PolarHBondContact O-N 3.06Å; A98-S101 PolarHBondContact O-N 3.03Å; A98-M102 HydrophobicContact CB-CE 4.5Å; A98-M102 WeakPolarHBondContact O-CB 3.4Å; A98-M102 WeakPolarHBondContact O-CG 3.49Å; A98-M102 PolarHBondContact O-N 3.43Å |
| 99 | V | 84.6 | Confident | 79.4 | Confident | 71 Ų | 71 | 50.1 Ų | 50.1 | 43% | 0.43 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.4 | -44.5 | 177.2 | 172.1 | 0 | 0 | 0 | 0 | 111.6 | I95 A96 R97 M102 T103 | I95-V99 HydrophobicContact CG2-CG2 4.18Å; I95-V99 WeakPolarHBondContact O-CG2 3.46Å; I95-V99 PolarHBondContact O-N 2.99Å; A96-V99 PolarHBondContact O-N 3.38Å; R97-V99 PolarHBondContact O-N 3.23Å; V99-M102 PolarHBondContact O-N 3.25Å; V99-T103 HydrophobicContact CG1-CG2 4.42Å; V99-T103 WeakPolarHBondContact O-CB 3.13Å; V99-T103 WeakPolarHBondContact O-CG2 3.35Å; V99-T103 PolarHBondContact O-N 2.98Å; V99-T103 VanDerWaalsContact O-N 3.12Å; V99-T103 PolarHBondContact O-OG1 2.96Å |
| 100 | V | 82.9 | Confident | 78.5 | Confident | 59 Ų | 59 | 48 Ų | 48 | 36% | 0.358 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -65.5 | -45.4 | 177.6 | 171.8 | 0 | 0 | 0 | 0 | 110.1 | A96 R97 M102 T103 V104 L117 | A96-V100 WeakPolarHBondContact O-CB 3.48Å; A96-V100 WeakPolarHBondContact O-CG2 3.3Å; A96-V100 PolarHBondContact O-N 3.4Å; R97-V100 PolarHBondContact O-N 3.45Å; V100-M102 VanDerWaalsContact C-N 3.27Å; V100-M102 PolarHBondContact O-N 3.11Å; V100-T103 WeakPolarHBondContact CA-OG1 3.37Å; V100-T103 PolarHBondContact O-N 2.89Å; V100-T103 PolarHBondContact O-OG1 3.38Å; V100-V104 HydrophobicContact CG1-CG2 3.88Å; V100-V104 WeakPolarHBondContact O-CG2 3.17Å; V100-V104 PolarHBondContact O-N 3.39Å; V100-L117 HydrophobicContact CB-CD2 3.52Å; V100-L117 HydrophobicContact CG1-CD2 3.48Å; V100-L117 VanDerWaalsContact CG1-CD2 3.48Å; V100-L117 HydrophobicContact CG2-CD2 4.37Å |
| 101 | S | 77.3 | Confident | 77.8 | Confident | 12 Ų | 12 | 50.1 Ų | 50.1 | 8% | 0.084 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -56.9 | -40.1 | 177.1 | -160.7 | 0 | 0 | 0 | 0 | 112.3 | D47 R97 A98 T103 D114 | D47-S101 PolarHBondContact OD2-OG 2.97Å; R97-S101 WeakPolarHBondContact O-CB 3.34Å; R97-S101 PolarHBondContact O-N 3.22Å; A98-S101 PolarHBondContact O-N 3.03Å; S101-T103 VanDerWaalsContact C-N 3.35Å; S101-T103 PolarHBondContact O-N 2.94Å; S101-D114 VanDerWaalsContact CB-OD1 3.3Å; S101-D114 WeakPolarHBondContact CB-OD1 3.45Å; S101-D114 VanDerWaalsContact OG-CG 3.23Å; S101-D114 PolarHBondContact OG-OD1 3.38Å; S101-D114 PolarHBondContact OG-OD2 3.01Å |
| 102 | M | 76.4 | Confident | 77.1 | Confident | 42 Ų | 42 | 53.6 Ų | 53.6 | 21% | 0.207 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -72.4 | -20.6 | 176.1 | -68.3 | 175.7 | -169 | 0 | 0 | 114.7 | V43 D47 L48 L51 A98 V99 V100 | V43-M102 HydrophobicContact CG1-CE 3.85Å; V43-M102 HydrophobicContact CG1-CG 4.07Å; V43-M102 HydrophobicContact CG1-SD 3.9Å; V43-M102 HydrophobicContact CG2-CG 4.41Å; D47-M102 HydrophobicContact CB-CE 3.57Å; D47-M102 HydrophobicContact CB-CG 4.3Å; L48-M102 HydrophobicContact CD2-CE 4.13Å; L48-M102 HydrophobicContact CG-CE 3.86Å; L51-M102 HydrophobicContact CB-CE 4.44Å; L51-M102 HydrophobicContact CD2-CE 3.85Å; L51-M102 HydrophobicContact CD2-SD 4.39Å; A98-M102 HydrophobicContact CB-CE 4.5Å; A98-M102 WeakPolarHBondContact O-CB 3.4Å; A98-M102 WeakPolarHBondContact O-CG 3.49Å; A98-M102 PolarHBondContact O-N 3.43Å; V99-M102 PolarHBondContact O-N 3.25Å; V100-M102 VanDerWaalsContact C-N 3.27Å; V100-M102 PolarHBondContact O-N 3.11Å |
| 103 | T | 77 | Confident | 76.6 | Confident | 95 Ų | 95 | 51.8 Ų | 51.8 | 58% | 0.583 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -99.5 | -26.9 | -173.7 | 51 | 0 | 0 | 0 | 0 | 113.4 | V99 V100 S101 S105 | V99-T103 HydrophobicContact CG1-CG2 4.42Å; V99-T103 WeakPolarHBondContact O-CB 3.13Å; V99-T103 WeakPolarHBondContact O-CG2 3.35Å; V99-T103 PolarHBondContact O-N 2.98Å; V99-T103 VanDerWaalsContact O-N 3.12Å; V99-T103 PolarHBondContact O-OG1 2.96Å; V100-T103 WeakPolarHBondContact CA-OG1 3.37Å; V100-T103 PolarHBondContact O-N 2.89Å; V100-T103 PolarHBondContact O-OG1 3.38Å; S101-T103 VanDerWaalsContact C-N 3.35Å; S101-T103 PolarHBondContact O-N 2.94Å; T103-S105 PolarHBondContact O-N 2.94Å |
| 104 | V | 75.1 | Confident | 76 | Confident | 64 Ų | 64 | 50.9 Ų | 50.9 | 39% | 0.388 | 33% | 0.326 | S | S | . | . | S | Bend | trans | -78.2 | 124.3 | -179.1 | -167.8 | 0 | 0 | 0 | 0 | 110.2 | V100 A110 | V100-V104 HydrophobicContact CG1-CG2 3.88Å; V100-V104 WeakPolarHBondContact O-CG2 3.17Å; V100-V104 PolarHBondContact O-N 3.39Å; V104-A110 HydrophobicContact CB-CB 4.05Å; V104-A110 HydrophobicContact CG1-CB 3.28Å |
| 105 | S | 58.5 | Low | 75.5 | Confident | 62 Ų | 62 | 52.8 Ų | 52.8 | 43% | 0.434 | 33% | 0.332 | S | S | . | . | trans | -69.4 | 144.1 | -175.9 | -61 | 0 | 0 | 0 | 0 | 112.1 | T103 S107 A110 | T103-S105 PolarHBondContact O-N 2.94Å; S105-S107 PolarHBondContact O-N 2.75Å; S105-S107 PolarHBondContact O-OG 3.47Å; S105-S107 VanDerWaalsContact O-OG 3.09Å; S105-A110 WeakPolarHBondContact O-CB 3.41Å | ||
| 106 | T | 59.4 | Low | 75.1 | Confident | 121 Ų | 121 | 55.8 Ų | 55.8 | 74% | 0.742 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -50.5 | 13.1 | -175.5 | 53.5 | 0 | 0 | 0 | 0 | 118.8 | ||
| 107 | S | 65.3 | Low | 74.8 | Confident | 62 Ų | 62 | 55.1 Ų | 55.1 | 43% | 0.434 | 34% | 0.336 | S | S | . | . | S | Bend | trans | -54.5 | 152.7 | 165.5 | 67.3 | 0 | 0 | 0 | 0 | 112.3 | S105 A109 A110 T111 | S105-S107 PolarHBondContact O-N 2.75Å; S105-S107 PolarHBondContact O-OG 3.47Å; S105-S107 VanDerWaalsContact O-OG 3.09Å; S107-A109 PolarHBondContact O-N 2.89Å; S107-A109 VanDerWaalsContact O-N 3.1Å; S107-A110 WeakPolarHBondContact O-CA 3.2Å; S107-A110 WeakPolarHBondContact O-CB 3.5Å; S107-A110 PolarHBondContact O-N 3.34Å; S107-A110 PolarHBondContact OG-N 3.19Å; S107-T111 PolarHBondContact O-N 3.43Å |
| 108 | N | 65.4 | Low | 74.5 | Confident | 137 Ų | 137 | 55.2 Ų | 55.2 | 73% | 0.733 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -57.9 | -24.4 | 173.8 | -165.9 | 36.7 | 0 | 0 | 0 | 113 | A110 T111 V112 | N108-A110 VanDerWaalsContact C-N 3.29Å; N108-A110 PolarHBondContact O-N 3.45Å; N108-T111 PolarHBondContact O-OG1 3.27Å; N108-V112 WeakPolarHBondContact O-CG2 3.35Å |
| 109 | A | 69.6 | Low | 74.5 | Confident | 72 Ų | 72 | 56.4 Ų | 56.4 | 60% | 0.595 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -69.2 | -28.8 | 173 | 0 | 0 | 0 | 0 | 0 | 112.5 | S107 A113 | S107-A109 PolarHBondContact O-N 2.89Å; S107-A109 VanDerWaalsContact O-N 3.1Å; A109-A113 WeakPolarHBondContact O-CB 3.15Å; A109-A113 PolarHBondContact O-N 3.36Å |
| 110 | A | 70.3 | Confident | 74.5 | Confident | 8 Ų | 8 | 56.6 Ų | 56.6 | 7% | 0.066 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -76.8 | -37 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | V104 S105 S107 N108 V112 A113 D114 | V104-A110 HydrophobicContact CB-CB 4.05Å; V104-A110 HydrophobicContact CG1-CB 3.28Å; S105-A110 WeakPolarHBondContact O-CB 3.41Å; S107-A110 WeakPolarHBondContact O-CA 3.2Å; S107-A110 WeakPolarHBondContact O-CB 3.5Å; S107-A110 PolarHBondContact O-N 3.34Å; S107-A110 PolarHBondContact OG-N 3.19Å; N108-A110 VanDerWaalsContact C-N 3.29Å; N108-A110 PolarHBondContact O-N 3.45Å; A110-V112 VanDerWaalsContact C-N 3.3Å; A110-V112 PolarHBondContact O-N 3.33Å; A110-A113 PolarHBondContact O-N 3.5Å; A110-D114 VanDerWaalsContact O-CB 3.24Å; A110-D114 WeakPolarHBondContact O-CB 3.36Å; A110-D114 PolarHBondContact O-N 2.88Å |
| 111 | T | 71.7 | Confident | 74.7 | Confident | 48 Ų | 48 | 53.8 Ų | 53.8 | 29% | 0.294 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.6 | -40.4 | 174.4 | 53.6 | 0 | 0 | 0 | 0 | 110.6 | S107 N108 K115 | S107-T111 PolarHBondContact O-N 3.43Å; N108-T111 PolarHBondContact O-OG1 3.27Å; T111-K115 WeakPolarHBondContact O-CG 3.47Å; T111-K115 PolarHBondContact O-N 3.22Å; T111-K115 VanDerWaalsContact O-N 3.1Å |
| 112 | V | 74.6 | Confident | 75.2 | Confident | 74 Ų | 74 | 54.1 Ų | 54.1 | 45% | 0.448 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -66.5 | -45.4 | 173.5 | 177.4 | 0 | 0 | 0 | 0 | 111.5 | N108 A110 D114 K115 I116 | N108-V112 WeakPolarHBondContact O-CG2 3.35Å; A110-V112 VanDerWaalsContact C-N 3.3Å; A110-V112 PolarHBondContact O-N 3.33Å; V112-D114 VanDerWaalsContact C-N 3.3Å; V112-D114 PolarHBondContact O-N 2.87Å; V112-K115 PolarHBondContact O-N 3.05Å; V112-I116 HydrophobicContact CG1-CD1 3.87Å; V112-I116 HydrophobicContact CG1-CG1 4.47Å; V112-I116 WeakPolarHBondContact O-CG1 3.38Å; V112-I116 PolarHBondContact O-N 3.42Å |
| 113 | A | 77.7 | Confident | 75.9 | Confident | 40 Ų | 40 | 53.6 Ų | 53.6 | 33% | 0.331 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.4 | -40.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A109 A110 I116 L117 | A109-A113 WeakPolarHBondContact O-CB 3.15Å; A109-A113 PolarHBondContact O-N 3.36Å; A110-A113 PolarHBondContact O-N 3.5Å; A113-I116 PolarHBondContact O-N 3.26Å; A113-L117 VanDerWaalsContact O-CB 3.27Å; A113-L117 WeakPolarHBondContact O-CB 3.18Å; A113-L117 PolarHBondContact O-N 2.94Å |
| 114 | D | 75.4 | Confident | 76.4 | Confident | 10 Ų | 10 | 52.6 Ų | 52.6 | 5% | 0.053 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -66.7 | -40.8 | 178.3 | -169.1 | 38.5 | 0 | 0 | 0 | 111.9 | R44 S101 A110 V112 L117 W118 Y186 | R44-D114 IonicContact CZ-OD2 3.13Å; R44-D114 IonicContact NH1-OD2 2.75Å; R44-D114 PolarHBondContact NH1-OD2 3.12Å; R44-D114 IonicContact NH2-OD2 2.91Å; S101-D114 VanDerWaalsContact CB-OD1 3.3Å; S101-D114 WeakPolarHBondContact CB-OD1 3.45Å; S101-D114 VanDerWaalsContact OG-CG 3.23Å; S101-D114 PolarHBondContact OG-OD1 3.38Å; S101-D114 PolarHBondContact OG-OD2 3.01Å; A110-D114 VanDerWaalsContact O-CB 3.24Å; A110-D114 WeakPolarHBondContact O-CB 3.36Å; A110-D114 PolarHBondContact O-N 2.88Å; V112-D114 VanDerWaalsContact C-N 3.3Å; V112-D114 PolarHBondContact O-N 2.87Å; D114-L117 PolarHBondContact O-N 2.84Å; D114-W118 WeakPolarHBondContact O-CB 3.42Å; D114-W118 PolarHBondContact O-N 2.98Å; D114-Y186 WeakPolarHBondContact OD2-CE1 3.27Å |
| 115 | K | 77.5 | Confident | 77.2 | Confident | 48 Ų | 48 | 49.7 Ų | 49.7 | 21% | 0.209 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.8 | -47 | 170.8 | -74.4 | -178.9 | 174.9 | -160 | 0 | 112.4 | T111 V112 L117 W118 E119 N184 | T111-K115 WeakPolarHBondContact O-CG 3.47Å; T111-K115 PolarHBondContact O-N 3.22Å; T111-K115 VanDerWaalsContact O-N 3.1Å; V112-K115 PolarHBondContact O-N 3.05Å; K115-L117 VanDerWaalsContact C-N 3.31Å; K115-L117 PolarHBondContact O-N 3.32Å; K115-W118 WeakPolarHBondContact O-CB 3.46Å; K115-W118 PolarHBondContact O-N 2.89Å; K115-E119 PolarHBondContact O-N 2.97Å; K115-N184 PolarHBondContact NZ-ND2 3.44Å; K115-N184 PolarHBondContact NZ-OD1 2.75Å |
| 116 | I | 81 | Confident | 78.8 | Confident | 92 Ų | 92 | 47.1 Ų | 47.1 | 47% | 0.472 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.6 | -43.4 | 177.7 | -68.3 | 168 | 0 | 0 | 0 | 110.3 | V112 A113 W118 E119 I120 | V112-I116 HydrophobicContact CG1-CD1 3.87Å; V112-I116 HydrophobicContact CG1-CG1 4.47Å; V112-I116 WeakPolarHBondContact O-CG1 3.38Å; V112-I116 PolarHBondContact O-N 3.42Å; A113-I116 PolarHBondContact O-N 3.26Å; I116-W118 VanDerWaalsContact C-N 3.3Å; I116-W118 PolarHBondContact O-N 3.45Å; I116-E119 PolarHBondContact O-N 2.88Å; I116-I120 HydrophobicContact CG2-CD1 3.78Å; I116-I120 HydrophobicContact CG2-CG1 4.36Å; I116-I120 VanDerWaalsContact O-CG1 3.27Å; I116-I120 WeakPolarHBondContact O-CG1 3.47Å; I116-I120 PolarHBondContact O-N 3.43Å |
| 117 | L | 81.6 | Confident | 80.3 | Confident | 36 Ų | 36 | 41.6 Ų | 41.6 | 19% | 0.188 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.9 | -35.1 | -179.6 | -167.9 | 66.4 | 0 | 0 | 0 | 112.3 | R97 V100 A113 D114 K115 T121 | R97-L117 HydrophobicContact CB-CD2 4.26Å; R97-L117 HydrophobicContact CB-CG 4.3Å; R97-L117 HydrophobicContact CG-CD2 3.91Å; R97-L117 HydrophobicContact CG-CG 3.84Å; V100-L117 HydrophobicContact CB-CD2 3.52Å; V100-L117 HydrophobicContact CG1-CD2 3.48Å; V100-L117 VanDerWaalsContact CG1-CD2 3.48Å; V100-L117 HydrophobicContact CG2-CD2 4.37Å; A113-L117 VanDerWaalsContact O-CB 3.27Å; A113-L117 WeakPolarHBondContact O-CB 3.18Å; A113-L117 PolarHBondContact O-N 2.94Å; D114-L117 PolarHBondContact O-N 2.84Å; K115-L117 VanDerWaalsContact C-N 3.31Å; K115-L117 PolarHBondContact O-N 3.32Å; L117-T121 WeakPolarHBondContact O-CB 3.47Å; L117-T121 PolarHBondContact O-N 3.35Å; L117-T121 PolarHBondContact O-OG1 3.19Å |
| 118 | W | 80.2 | Confident | 81.5 | Confident | 6 Ų | 6 | 39 Ų | 39 | 2% | 0.023 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.6 | -48.8 | 171.2 | -170.2 | -85.4 | 0 | 0 | 0 | 111.5 | W46 L50 D114 K115 I116 I120 T121 R122 T264 F268 | W46-W118 HydrophobicContact CZ2-CH2 4.4Å; W46-W118 AromaticContact NE1-CH2 3.31Å; W46-W118 VanDerWaalsContact NE1-CH2 3.31Å; W46-W118 AromaticContact NE1-CZ3 3.55Å; L50-W118 HydrophobicContact CD1-CH2 3.81Å; L50-W118 HydrophobicContact CD1-CZ3 3.74Å; D114-W118 WeakPolarHBondContact O-CB 3.42Å; D114-W118 PolarHBondContact O-N 2.98Å; K115-W118 WeakPolarHBondContact O-CB 3.46Å; K115-W118 PolarHBondContact O-N 2.89Å; I116-W118 VanDerWaalsContact C-N 3.3Å; I116-W118 PolarHBondContact O-N 3.45Å; W118-I120 PolarHBondContact O-N 2.91Å; W118-T121 PolarHBondContact O-N 2.91Å; W118-R122 PolarHBondContact O-N 3.25Å; W118-T264 HydrophobicContact CH2-CG2 4.21Å; W118-T264 HydrophobicContact CZ2-CG2 3.65Å; W118-F268 HydrophobicContact CZ2-CD2 4.44Å; W118-F268 AromaticContact CZ2-CE2 3.97Å; W118-F268 HydrophobicContact CZ2-CE2 3.97Å; W118-F268 HydrophobicContact CZ2-CZ 4.03Å |
| 119 | E | 83 | Confident | 82.9 | Confident | 25 Ų | 25 | 32.7 Ų | 32.7 | 12% | 0.117 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.4 | -44.5 | 176.5 | -169 | 62.5 | -123.1 | 0 | 0 | 111.6 | K115 I116 T121 R122 F123 S163 Q166 | K115-E119 PolarHBondContact O-N 2.97Å; I116-E119 PolarHBondContact O-N 2.88Å; E119-T121 VanDerWaalsContact C-N 3.33Å; E119-T121 PolarHBondContact O-N 3.46Å; E119-R122 PolarHBondContact O-N 3.44Å; E119-F123 WeakPolarHBondContact O-CB 3.33Å; E119-F123 PolarHBondContact O-N 3.33Å; E119-S163 WeakPolarHBondContact OE1-CA 3.36Å; E119-S163 WeakPolarHBondContact OE1-CB 3.06Å; E119-Q166 PolarHBondContact OE1-NE2 2.79Å; E119-Q166 PolarHBondContact OE2-NE2 3.14Å |
| 120 | I | 85.2 | Confident | 83.9 | Confident | 75 Ų | 75 | 30.6 Ų | 30.6 | 39% | 0.385 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -59.9 | -43.9 | 175.8 | -70.3 | 167.8 | 0 | 0 | 0 | 111 | I116 W118 R122 F123 F124 | I116-I120 HydrophobicContact CG2-CD1 3.78Å; I116-I120 HydrophobicContact CG2-CG1 4.36Å; I116-I120 VanDerWaalsContact O-CG1 3.27Å; I116-I120 WeakPolarHBondContact O-CG1 3.47Å; I116-I120 PolarHBondContact O-N 3.43Å; W118-I120 PolarHBondContact O-N 2.91Å; I120-R122 VanDerWaalsContact C-N 3.34Å; I120-F123 WeakPolarHBondContact O-CB 3.41Å; I120-F123 PolarHBondContact O-N 2.82Å; I120-F124 HydrophobicContact CG2-CD2 3.95Å; I120-F124 HydrophobicContact CG2-CE2 3.67Å; I120-F124 WeakPolarHBondContact O-CD2 3.27Å; I120-F124 PolarHBondContact O-N 2.84Å |
| 121 | T | 86.1 | Confident | 84.9 | Confident | 1 Ų | 1 | 30.3 Ų | 30.3 | 1% | 0.006 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.3 | -47 | 178.9 | -56.3 | 0 | 0 | 0 | 0 | 109.8 | V93 R97 L117 W118 E119 F123 F124 L125 F268 | V93-T121 HydrophobicContact CG1-CG2 4.04Å; R97-T121 WeakPolarHBondContact CG-OG1 3.37Å; L117-T121 WeakPolarHBondContact O-CB 3.47Å; L117-T121 PolarHBondContact O-N 3.35Å; L117-T121 PolarHBondContact O-OG1 3.19Å; W118-T121 PolarHBondContact O-N 2.91Å; E119-T121 VanDerWaalsContact C-N 3.33Å; E119-T121 PolarHBondContact O-N 3.46Å; T121-F123 VanDerWaalsContact C-N 3.33Å; T121-F123 PolarHBondContact O-N 3.35Å; T121-F124 PolarHBondContact O-N 3.39Å; T121-L125 HydrophobicContact CG2-CD1 3.69Å; T121-L125 WeakPolarHBondContact O-CD1 3.44Å; T121-L125 PolarHBondContact O-N 2.86Å; T121-L125 VanDerWaalsContact O-N 3.09Å; T121-F268 HydrophobicContact CG2-CD1 3.88Å; T121-F268 HydrophobicContact CG2-CE1 3.57Å |
| 122 | R | 87.5 | Confident | 85.7 | Confident | 18 Ų | 18 | 28 Ų | 28 | 7% | 0.068 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.7 | -41.3 | 178.5 | -163.6 | -175.5 | -169.7 | 158.2 | 5.7 | 112.7 | W118 E119 I120 F124 L125 L126 Q166 G187 W194 F268 | W118-R122 PolarHBondContact O-N 3.25Å; E119-R122 PolarHBondContact O-N 3.44Å; I120-R122 VanDerWaalsContact C-N 3.34Å; R122-F124 VanDerWaalsContact C-N 3.33Å; R122-F124 PolarHBondContact O-N 3.01Å; R122-L125 PolarHBondContact O-N 2.81Å; R122-L126 WeakPolarHBondContact O-CB 3.36Å; R122-L126 PolarHBondContact O-N 2.97Å; R122-Q166 VanDerWaalsContact CD-NE2 3.26Å; R122-G187 PolarHBondContact NH1-O 3.49Å; R122-W194 VanDerWaalsContact NH2-CE3 3.33Å; R122-F268 HydrophobicContact CB-CZ 4.1Å; R122-F268 HydrophobicContact CG-CZ 4.29Å |
| 123 | F | 91 | Very high | 86.5 | Confident | 31 Ų | 31 | 25 Ų | 25 | 14% | 0.136 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -52.8 | -50.2 | 173.7 | 161.3 | -105.9 | 0 | 0 | 0 | 111.7 | E119 I120 T121 L126 A127 T156 S159 L160 S163 | E119-F123 WeakPolarHBondContact O-CB 3.33Å; E119-F123 PolarHBondContact O-N 3.33Å; I120-F123 WeakPolarHBondContact O-CB 3.41Å; I120-F123 PolarHBondContact O-N 2.82Å; T121-F123 VanDerWaalsContact C-N 3.33Å; T121-F123 PolarHBondContact O-N 3.35Å; F123-L126 PolarHBondContact O-N 3.48Å; F123-A127 WeakPolarHBondContact O-CB 3.05Å; F123-A127 PolarHBondContact O-N 2.96Å; F123-T156 HydrophobicContact CE2-CG2 4.35Å; F123-T156 HydrophobicContact CZ-CG2 3.76Å; F123-S159 VanDerWaalsContact CE2-OG 3.3Å; F123-S159 WeakPolarHBondContact CE2-OG 3.08Å; F123-L160 HydrophobicContact CD2-CB 4.35Å; F123-L160 HydrophobicContact CE2-CB 3.71Å; F123-L160 HydrophobicContact CE2-CD1 4.25Å; F123-L160 HydrophobicContact CZ-CB 4.49Å; F123-S163 WeakPolarHBondContact CA-OG 3.45Å; F123-S163 WeakPolarHBondContact CB-OG 3.42Å |
| 124 | F | 89.4 | Confident | 87.1 | Confident | 74 Ų | 74 | 26.2 Ų | 26.2 | 33% | 0.325 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -64.4 | -41.4 | 179.2 | -77.7 | -66.7 | 0 | 0 | 0 | 112.7 | V93 I120 T121 R122 A127 I128 | V93-F124 HydrophobicContact CG1-CD2 3.98Å; V93-F124 HydrophobicContact CG2-CD2 4.15Å; V93-F124 HydrophobicContact CG2-CE2 4.47Å; V93-F124 HydrophobicContact CG2-CG 4.48Å; I120-F124 HydrophobicContact CG2-CD2 3.95Å; I120-F124 HydrophobicContact CG2-CE2 3.67Å; I120-F124 WeakPolarHBondContact O-CD2 3.27Å; I120-F124 PolarHBondContact O-N 2.84Å; T121-F124 PolarHBondContact O-N 3.39Å; R122-F124 VanDerWaalsContact C-N 3.33Å; R122-F124 PolarHBondContact O-N 3.01Å; F124-A127 PolarHBondContact O-N 3.4Å; F124-I128 WeakPolarHBondContact O-CB 3.44Å; F124-I128 WeakPolarHBondContact O-CD1 3.12Å; F124-I128 VanDerWaalsContact O-CG1 3.26Å; F124-I128 WeakPolarHBondContact O-CG1 3.44Å; F124-I128 PolarHBondContact O-N 3.14Å; F124-I128 VanDerWaalsContact O-N 3.09Å |
| 125 | L | 90.2 | Very high | 87.6 | Confident | 3 Ų | 3 | 25.9 Ų | 25.9 | 2% | 0.016 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.9 | -47.4 | 177 | -85.2 | 81.5 | 0 | 0 | 0 | 111 | V90 T121 R122 A127 I128 E129 Y267 F268 F271 | V90-L125 HydrophobicContact CG1-CD1 4.15Å; V90-L125 HydrophobicContact CG1-CG 4.16Å; T121-L125 HydrophobicContact CG2-CD1 3.69Å; T121-L125 WeakPolarHBondContact O-CD1 3.44Å; T121-L125 PolarHBondContact O-N 2.86Å; T121-L125 VanDerWaalsContact O-N 3.09Å; R122-L125 PolarHBondContact O-N 2.81Å; L125-A127 PolarHBondContact O-N 2.92Å; L125-I128 PolarHBondContact O-N 3.48Å; L125-E129 WeakPolarHBondContact O-CB 2.9Å; L125-E129 PolarHBondContact O-N 3.33Å; L125-Y267 HydrophobicContact CB-CE1 3.68Å; L125-Y267 HydrophobicContact CD2-CD1 3.7Å; L125-Y267 HydrophobicContact CD2-CE1 3.43Å; L125-Y267 VanDerWaalsContact CD2-CE1 3.43Å; L125-Y267 HydrophobicContact CG-CE1 4.19Å; L125-F268 HydrophobicContact CD1-CD1 4.4Å; L125-F268 HydrophobicContact CD1-CE1 4.42Å; L125-F268 HydrophobicContact CD2-CD1 4.08Å; L125-F268 HydrophobicContact CD2-CE1 4.47Å; L125-F268 HydrophobicContact CD2-CG 4.22Å; L125-F271 HydrophobicContact CD2-CD1 4.31Å; L125-F271 HydrophobicContact CG-CD1 4.28Å |
| 126 | L | 91.8 | Very high | 87.9 | Confident | 9 Ų | 9 | 23.7 Ų | 23.7 | 5% | 0.047 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -64.5 | -42.5 | 179 | -177.5 | 65.3 | 0 | 0 | 0 | 112 | R122 F123 I128 E129 L130 Y162 F201 | R122-L126 WeakPolarHBondContact O-CB 3.36Å; R122-L126 PolarHBondContact O-N 2.97Å; F123-L126 PolarHBondContact O-N 3.48Å; L126-I128 PolarHBondContact O-N 3.31Å; L126-E129 PolarHBondContact O-N 2.83Å; L126-L130 HydrophobicContact CD1-CD1 4.41Å; L126-L130 HydrophobicContact CD1-CG 4.25Å; L126-L130 HydrophobicContact CG-CD1 4.29Å; L126-L130 HydrophobicContact CG-CG 4.47Å; L126-L130 WeakPolarHBondContact O-CG 3.36Å; L126-L130 PolarHBondContact O-N 2.92Å; L126-Y162 HydrophobicContact CD2-CD1 3.22Å; L126-Y162 HydrophobicContact CD2-CD2 4.35Å; L126-Y162 HydrophobicContact CD2-CE1 3.87Å; L126-Y162 HydrophobicContact CD2-CG 3.51Å; L126-F201 HydrophobicContact CD1-CE1 4.12Å; L126-F201 HydrophobicContact CD1-CE2 4.28Å; L126-F201 HydrophobicContact CD1-CZ 3.7Å; L126-F201 HydrophobicContact CD2-CZ 4.48Å |
| 127 | A | 92.6 | Very high | 88 | Confident | 5 Ų | 5 | 21.5 Ų | 21.5 | 4% | 0.041 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -55.7 | -42.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111 | F123 F124 L125 S131 S159 | F123-A127 WeakPolarHBondContact O-CB 3.05Å; F123-A127 PolarHBondContact O-N 2.96Å; F124-A127 PolarHBondContact O-N 3.4Å; L125-A127 PolarHBondContact O-N 2.92Å; A127-S131 VanDerWaalsContact O-CB 3.3Å; A127-S131 WeakPolarHBondContact O-CB 3.42Å; A127-S131 PolarHBondContact O-N 2.83Å; A127-S131 PolarHBondContact O-OG 3.28Å; A127-S159 VanDerWaalsContact CB-OG 3.27Å; A127-S159 WeakPolarHBondContact CB-OG 3.3Å |
| 128 | I | 90.7 | Very high | 87.8 | Confident | 7 Ų | 7 | 21 Ų | 21 | 4% | 0.036 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -74.5 | -39.1 | -178.9 | -70.2 | 171.5 | 0 | 0 | 0 | 111.3 | L86 V90 F124 L125 L126 S131 V132 F271 I275 | L86-I128 HydrophobicContact CB-CD1 4.09Å; L86-I128 HydrophobicContact CB-CG1 4.22Å; L86-I128 HydrophobicContact CB-CG2 4.07Å; L86-I128 HydrophobicContact CD2-CD1 4.09Å; L86-I128 HydrophobicContact CD2-CG1 3.81Å; L86-I128 HydrophobicContact CG-CG1 4.43Å; V90-I128 HydrophobicContact CG2-CB 4.48Å; V90-I128 HydrophobicContact CG2-CD1 3.19Å; V90-I128 HydrophobicContact CG2-CG1 4.38Å; V90-I128 HydrophobicContact CG2-CG2 4.42Å; F124-I128 WeakPolarHBondContact O-CB 3.44Å; F124-I128 WeakPolarHBondContact O-CD1 3.12Å; F124-I128 VanDerWaalsContact O-CG1 3.26Å; F124-I128 WeakPolarHBondContact O-CG1 3.44Å; F124-I128 PolarHBondContact O-N 3.14Å; F124-I128 VanDerWaalsContact O-N 3.09Å; L125-I128 PolarHBondContact O-N 3.48Å; L126-I128 PolarHBondContact O-N 3.31Å; I128-S131 WeakPolarHBondContact O-CB 3.21Å; I128-S131 PolarHBondContact O-N 3.47Å; I128-V132 HydrophobicContact CG2-CG2 4.15Å; I128-V132 WeakPolarHBondContact O-CB 3.26Å; I128-V132 VanDerWaalsContact O-CG2 3.26Å; I128-V132 WeakPolarHBondContact O-CG2 3.26Å; I128-V132 PolarHBondContact O-N 3.21Å; I128-F271 HydrophobicContact CB-CE1 4.26Å; I128-F271 HydrophobicContact CG2-CE1 3.83Å; I128-F271 HydrophobicContact CG2-CZ 4.1Å; I128-I275 HydrophobicContact CG2-CD1 3.89Å |
| 129 | E | 92.9 | Very high | 87.3 | Confident | 4 Ų | 4 | 24.2 Ų | 24.2 | 2% | 0.019 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -56.9 | -52.7 | 175.3 | -175.7 | 177.9 | 168.6 | 0 | 0 | 111.1 | L125 L126 S131 V132 I133 Y205 L235 Y267 F271 | L125-E129 WeakPolarHBondContact O-CB 2.9Å; L125-E129 PolarHBondContact O-N 3.33Å; L126-E129 PolarHBondContact O-N 2.83Å; E129-S131 VanDerWaalsContact C-N 3.33Å; E129-S131 PolarHBondContact O-N 3.04Å; E129-V132 PolarHBondContact O-N 3.05Å; E129-I133 WeakPolarHBondContact O-CG1 3.44Å; E129-I133 PolarHBondContact O-N 3.24Å; E129-Y205 WeakPolarHBondContact CG-OH 3.4Å; E129-Y205 WeakPolarHBondContact OE1-CE2 3.39Å; E129-Y205 PolarHBondContact OE1-OH 3.05Å; E129-L235 HydrophobicContact CG-CD1 3.79Å; E129-Y267 VanDerWaalsContact OE2-CE2 3.27Å; E129-Y267 WeakPolarHBondContact OE2-CE2 3.33Å; E129-Y267 VanDerWaalsContact OE2-CZ 3.27Å; E129-Y267 PolarHBondContact OE2-OH 3.28Å; E129-F271 HydrophobicContact CB-CE2 3.9Å; E129-F271 HydrophobicContact CB-CZ 3.72Å; E129-F271 HydrophobicContact CG-CE2 4.09Å; E129-F271 HydrophobicContact CG-CZ 4.4Å |
| 130 | L | 92.4 | Very high | 86.2 | Confident | 29 Ų | 29 | 25.9 Ų | 25.9 | 15% | 0.152 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63.3 | -40.4 | 176.7 | -62.6 | -179.1 | 0 | 0 | 0 | 111.4 | L126 V132 I133 I134 T155 L158 F201 | L126-L130 HydrophobicContact CD1-CD1 4.41Å; L126-L130 HydrophobicContact CD1-CG 4.25Å; L126-L130 HydrophobicContact CG-CD1 4.29Å; L126-L130 HydrophobicContact CG-CG 4.47Å; L126-L130 WeakPolarHBondContact O-CG 3.36Å; L126-L130 PolarHBondContact O-N 2.92Å; L130-V132 PolarHBondContact O-N 3.5Å; L130-I133 PolarHBondContact O-N 3.06Å; L130-I134 WeakPolarHBondContact O-CB 3.35Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.3Å; L130-I134 PolarHBondContact O-N 3.21Å; L130-T155 HydrophobicContact CB-CG2 3.74Å; L130-L158 HydrophobicContact CD1-CB 4.29Å; L130-F201 HydrophobicContact CD2-CE1 4.18Å |
| 131 | S | 90.9 | Very high | 85.1 | Confident | 2 Ų | 2 | 30.1 Ų | 30.1 | 1% | 0.014 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.2 | -47.7 | 176.4 | -63 | 0 | 0 | 0 | 0 | 111.9 | A127 I128 E129 I134 L135 L152 T155 | A127-S131 VanDerWaalsContact O-CB 3.3Å; A127-S131 WeakPolarHBondContact O-CB 3.42Å; A127-S131 PolarHBondContact O-N 2.83Å; A127-S131 PolarHBondContact O-OG 3.28Å; I128-S131 WeakPolarHBondContact O-CB 3.21Å; I128-S131 PolarHBondContact O-N 3.47Å; E129-S131 VanDerWaalsContact C-N 3.33Å; E129-S131 PolarHBondContact O-N 3.04Å; S131-I134 PolarHBondContact O-N 3.43Å; S131-L135 WeakPolarHBondContact O-CB 3.17Å; S131-L135 WeakPolarHBondContact O-CG 3.18Å; S131-L135 PolarHBondContact O-N 3.25Å; S131-L152 WeakPolarHBondContact OG-CD2 3.36Å; S131-T155 PolarHBondContact OG-OG1 3.38Å |
| 132 | V | 88.7 | Confident | 84 | Confident | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -68.6 | -38.5 | -177.7 | 171.3 | 0 | 0 | 0 | 0 | 111 | F83 I128 E129 L130 G136 Y231 I275 F279 | F83-V132 HydrophobicContact CD1-CG2 4Å; F83-V132 HydrophobicContact CE1-CB 4.34Å; F83-V132 HydrophobicContact CE1-CG1 4.43Å; F83-V132 HydrophobicContact CE1-CG2 3.87Å; I128-V132 HydrophobicContact CG2-CG2 4.15Å; I128-V132 WeakPolarHBondContact O-CB 3.26Å; I128-V132 VanDerWaalsContact O-CG2 3.26Å; I128-V132 WeakPolarHBondContact O-CG2 3.26Å; I128-V132 PolarHBondContact O-N 3.21Å; E129-V132 PolarHBondContact O-N 3.05Å; L130-V132 PolarHBondContact O-N 3.5Å; V132-G136 VanDerWaalsContact O-CA 3.3Å; V132-G136 WeakPolarHBondContact O-CA 3.33Å; V132-G136 PolarHBondContact O-N 3.4Å; V132-Y231 HydrophobicContact CB-CE1 4.5Å; V132-Y231 HydrophobicContact CG1-CD1 4.46Å; V132-Y231 HydrophobicContact CG1-CE1 3.74Å; V132-I275 HydrophobicContact CG2-CD1 4.11Å; V132-I275 HydrophobicContact CG2-CG2 4.45Å; V132-F279 HydrophobicContact CG1-CD2 4.13Å; V132-F279 HydrophobicContact CG1-CE2 3.4Å; V132-F279 VanDerWaalsContact CG1-CE2 3.4Å; V132-F279 HydrophobicContact CG1-CZ 3.76Å |
| 133 | I | 90.6 | Very high | 83.1 | Confident | 9 Ų | 9 | 37.4 Ų | 37.4 | 5% | 0.046 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.3 | -47.4 | 175.9 | -69.5 | -69.9 | 0 | 0 | 0 | 111 | E129 L130 G136 L137 Y205 F228 Y231 A232 L235 | E129-I133 WeakPolarHBondContact O-CG1 3.44Å; E129-I133 PolarHBondContact O-N 3.24Å; L130-I133 PolarHBondContact O-N 3.06Å; I133-G136 PolarHBondContact O-N 2.88Å; I133-L137 HydrophobicContact CG2-CD1 4.04Å; I133-L137 WeakPolarHBondContact O-CB 3.26Å; I133-L137 WeakPolarHBondContact O-CG 3.4Å; I133-L137 PolarHBondContact O-N 2.98Å; I133-Y205 HydrophobicContact CD1-CD1 4.29Å; I133-Y205 HydrophobicContact CD1-CE1 4.27Å; I133-Y205 HydrophobicContact CG1-CD1 4.43Å; I133-Y205 HydrophobicContact CG1-CE1 3.92Å; I133-F228 HydrophobicContact CD1-CE2 4.34Å; I133-F228 HydrophobicContact CD1-CZ 4.32Å; I133-Y231 HydrophobicContact CD1-CD1 3.95Å; I133-Y231 HydrophobicContact CD1-CE1 3.6Å; I133-Y231 HydrophobicContact CG1-CE1 4.07Å; I133-A232 HydrophobicContact CD1-CB 4.21Å; I133-L235 HydrophobicContact CD1-CD1 4.28Å; I133-L235 HydrophobicContact CG1-CD1 4.45Å |
| 134 | I | 89.7 | Confident | 82.6 | Confident | 66 Ų | 66 | 39.3 Ų | 39.3 | 34% | 0.338 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -69.8 | -47.2 | -178.4 | -64.3 | 173.4 | 0 | 0 | 0 | 111.2 | L130 S131 G136 L137 A138 V151 T155 | L130-I134 WeakPolarHBondContact O-CB 3.35Å; L130-I134 VanDerWaalsContact O-CG1 3.29Å; L130-I134 WeakPolarHBondContact O-CG1 3.3Å; L130-I134 PolarHBondContact O-N 3.21Å; S131-I134 PolarHBondContact O-N 3.43Å; I134-G136 PolarHBondContact O-N 3.43Å; I134-L137 PolarHBondContact O-N 2.87Å; I134-A138 WeakPolarHBondContact O-CB 3.42Å; I134-A138 PolarHBondContact O-N 3.37Å; I134-V151 HydrophobicContact CB-CG1 3.95Å; I134-V151 HydrophobicContact CG2-CG1 3.63Å; I134-V151 HydrophobicContact CG2-CG2 4.16Å; I134-T155 HydrophobicContact CD1-CG2 3.6Å |
| 135 | L | 86.1 | Confident | 82.2 | Confident | 4 Ų | 4 | 43.2 Ų | 43.2 | 2% | 0.021 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.3 | -36.1 | 175.3 | -70.1 | 171.1 | 0 | 0 | 0 | 111.3 | T82 F83 S131 F139 I148 V151 | T82-L135 HydrophobicContact CG2-CD1 4.39Å; F83-L135 HydrophobicContact CE1-CB 4Å; F83-L135 HydrophobicContact CE1-CD1 3.83Å; F83-L135 HydrophobicContact CZ-CB 3.98Å; S131-L135 WeakPolarHBondContact O-CB 3.17Å; S131-L135 WeakPolarHBondContact O-CG 3.18Å; S131-L135 PolarHBondContact O-N 3.25Å; L135-F139 WeakPolarHBondContact O-CD2 3.32Å; L135-F139 PolarHBondContact O-N 3.13Å; L135-I148 HydrophobicContact CD2-CG1 4.17Å; L135-I148 HydrophobicContact CD2-CG2 4.36Å; L135-V151 HydrophobicContact CD2-CB 4.16Å; L135-V151 HydrophobicContact CD2-CG1 4.08Å; L135-V151 HydrophobicContact CD2-CG2 4.34Å; L135-V151 HydrophobicContact CG-CG1 3.98Å |
| 136 | G | 83.6 | Confident | 81.8 | Confident | 1 Ų | 1 | 47.2 Ų | 47.2 | 1% | 0.01 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.6 | -57.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | V132 I133 I134 A138 F139 P223 | V132-G136 VanDerWaalsContact O-CA 3.3Å; V132-G136 WeakPolarHBondContact O-CA 3.33Å; V132-G136 PolarHBondContact O-N 3.4Å; I133-G136 PolarHBondContact O-N 2.88Å; I134-G136 PolarHBondContact O-N 3.43Å; G136-A138 PolarHBondContact O-N 3.21Å; G136-F139 WeakPolarHBondContact O-CB 3.38Å; G136-F139 PolarHBondContact O-N 3.43Å; G136-P223 WeakPolarHBondContact O-CG 3.33Å |
| 137 | L | 83.5 | Confident | 81.5 | Confident | 46 Ų | 46 | 47.8 Ų | 47.8 | 24% | 0.241 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.4 | -33 | 178.8 | -74.5 | 172.1 | 0 | 0 | 0 | 113.5 | I133 I134 F139 V208 L211 F228 | I133-L137 HydrophobicContact CG2-CD1 4.04Å; I133-L137 WeakPolarHBondContact O-CB 3.26Å; I133-L137 WeakPolarHBondContact O-CG 3.4Å; I133-L137 PolarHBondContact O-N 2.98Å; I134-L137 PolarHBondContact O-N 2.87Å; L137-F139 VanDerWaalsContact C-N 3.28Å; L137-F139 PolarHBondContact O-N 3.47Å; L137-V208 HydrophobicContact CD1-CG2 4.04Å; L137-V208 HydrophobicContact CD2-CG1 4.1Å; L137-V208 HydrophobicContact CD2-CG2 4.5Å; L137-L211 HydrophobicContact CD2-CD2 4.36Å; L137-F228 HydrophobicContact CD2-CE1 3.82Å; L137-F228 HydrophobicContact CD2-CZ 3.94Å; L137-F228 HydrophobicContact CG-CE1 4.26Å; L137-F228 HydrophobicContact CG-CZ 3.84Å |
| 138 | A | 78.3 | Confident | 81.2 | Confident | 25 Ų | 25 | 47.9 Ų | 47.9 | 21% | 0.207 | 27% | 0.266 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.6 | 12.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | I134 G136 G140 H141 L142 | I134-A138 WeakPolarHBondContact O-CB 3.42Å; I134-A138 PolarHBondContact O-N 3.37Å; G136-A138 PolarHBondContact O-N 3.21Å; A138-G140 PolarHBondContact O-N 3.02Å; A138-H141 PolarHBondContact O-N 3.18Å; A138-L142 HydrophobicContact CB-CB 4.41Å; A138-L142 HydrophobicContact CB-CD1 3.34Å; A138-L142 HydrophobicContact CB-CG 3.66Å; A138-L142 PolarHBondContact O-N 3.21Å |
| 139 | F | 68.6 | Low | 81.1 | Confident | 75 Ų | 75 | 54.9 Ų | 54.9 | 33% | 0.329 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.6 | 107.3 | 173.3 | -115.2 | -95 | 0 | 0 | 0 | 109.8 | I79 F80 F83 L135 G136 L137 | I79-F139 HydrophobicContact CG2-CE2 3.92Å; I79-F139 HydrophobicContact CG2-CZ 4.14Å; F80-F139 HydrophobicContact CZ-CZ 4.28Å; F83-F139 HydrophobicContact CE2-CE2 4.31Å; L135-F139 WeakPolarHBondContact O-CD2 3.32Å; L135-F139 PolarHBondContact O-N 3.13Å; G136-F139 WeakPolarHBondContact O-CB 3.38Å; G136-F139 PolarHBondContact O-N 3.43Å; L137-F139 VanDerWaalsContact C-N 3.28Å; L137-F139 PolarHBondContact O-N 3.47Å |
| 140 | G | 59.3 | Low | 80.9 | Confident | 60 Ų | 60 | 62.9 Ų | 62.9 | 62% | 0.619 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 122.7 | -20.8 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | A138 | A138-G140 PolarHBondContact O-N 3.02Š|
| 141 | H | 62.8 | Low | 80.8 | Confident | 163 Ų | 163 | 62 Ų | 62 | 76% | 0.755 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.9 | -18.4 | -179.4 | -162.3 | -72.6 | 0 | 0 | 0 | 113.8 | A138 | A138-H141 PolarHBondContact O-N 3.18Š|
| 142 | L | 63.5 | Low | 80.8 | Confident | 32 Ų | 32 | 64.1 Ų | 64.1 | 17% | 0.168 | 33% | 0.332 | C | S | . | . | trans | -118.3 | 47.1 | -172.8 | -51.4 | -176.8 | 0 | 0 | 0 | 113.8 | A138 S144 S147 V151 | A138-L142 HydrophobicContact CB-CB 4.41Å; A138-L142 HydrophobicContact CB-CD1 3.34Å; A138-L142 HydrophobicContact CB-CG 3.66Å; A138-L142 PolarHBondContact O-N 3.21Å; L142-S144 PolarHBondContact O-N 3.34Å; L142-S147 WeakPolarHBondContact CB-OG 3.48Å; L142-S147 WeakPolarHBondContact CD2-OG 3.48Å; L142-S147 WeakPolarHBondContact CG-OG 3.25Å; L142-V151 HydrophobicContact CD1-CG2 3.71Å | ||
| 143 | E | 68.6 | Low | 80.9 | Confident | 141 Ų | 141 | 66.7 Ų | 66.7 | 66% | 0.659 | 35% | 0.354 | S | S | * | . | trans | -74.6 | -12.7 | 177.2 | -63.7 | -160.1 | 147.9 | 0 | 0 | 113.9 | ||||
| 144 | S | 79.6 | Confident | 81 | Confident | 70 Ų | 70 | 69.6 Ų | 69.6 | 49% | 0.49 | 37% | 0.368 | S | S | . | . | S | Bend | trans | -76 | 136.9 | 178.9 | 178 | 0 | 0 | 0 | 0 | 112.8 | L142 S146 S147 I148 | L142-S144 PolarHBondContact O-N 3.34Å; S144-S146 PolarHBondContact O-N 2.87Å; S144-S146 PolarHBondContact OG-N 3.07Å; S144-S147 WeakPolarHBondContact O-CB 3.31Å; S144-S147 PolarHBondContact O-N 3.32Å; S144-I148 PolarHBondContact O-N 3.13Å; S144-I148 VanDerWaalsContact O-N 3.13Å |
| 145 | K | 81 | Confident | 81.2 | Confident | 157 Ų | 157 | 66.5 Ų | 66.5 | 68% | 0.683 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -53.9 | -34.8 | 173.1 | -64.5 | 179.5 | -177.8 | 175.2 | 0 | 112.7 | P78 K149 | P78-K145 HydrophobicContact CB-CG 4.45Å; K145-K149 WeakPolarHBondContact O-CG 3.4Å; K145-K149 PolarHBondContact O-N 2.86Å; K145-K149 VanDerWaalsContact O-N 3.14Å |
| 146 | S | 83.1 | Confident | 81.5 | Confident | 86 Ų | 86 | 69.1 Ų | 69.1 | 60% | 0.601 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -68 | -40.3 | 178.3 | -176.1 | 0 | 0 | 0 | 0 | 111.5 | S144 K149 R150 | S144-S146 PolarHBondContact O-N 2.87Å; S144-S146 PolarHBondContact OG-N 3.07Å; S146-K149 PolarHBondContact O-N 3.49Å; S146-R150 PolarHBondContact O-N 3.06Å |
| 147 | S | 84.1 | Confident | 82.1 | Confident | 22 Ų | 22 | 73.8 Ų | 73.8 | 15% | 0.154 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -66.2 | -43.5 | 178.3 | -167.4 | 0 | 0 | 0 | 0 | 111.9 | L142 S144 K149 R150 V151 | L142-S147 WeakPolarHBondContact CB-OG 3.48Å; L142-S147 WeakPolarHBondContact CD2-OG 3.48Å; L142-S147 WeakPolarHBondContact CG-OG 3.25Å; S144-S147 WeakPolarHBondContact O-CB 3.31Å; S144-S147 PolarHBondContact O-N 3.32Å; S147-K149 VanDerWaalsContact C-N 3.33Å; S147-K149 PolarHBondContact O-N 3.25Å; S147-R150 WeakPolarHBondContact O-CB 3.48Å; S147-R150 PolarHBondContact O-N 3.27Å; S147-R150 VanDerWaalsContact O-N 3.15Å; S147-V151 WeakPolarHBondContact O-CG2 3.5Å; S147-V151 PolarHBondContact O-N 3.22Å |
| 148 | I | 87 | Confident | 82.6 | Confident | 7 Ų | 7 | 76.4 Ų | 76.4 | 4% | 0.036 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59.3 | -45.6 | 175.6 | -62.1 | 169.1 | 0 | 0 | 0 | 110.4 | P78 I79 T82 L135 S144 R150 V151 L152 | P78-I148 HydrophobicContact CB-CD1 3.88Å; P78-I148 HydrophobicContact CG-CD1 3.82Å; I79-I148 HydrophobicContact CG1-CD1 3.86Å; T82-I148 HydrophobicContact CG2-CG2 4.09Å; L135-I148 HydrophobicContact CD2-CG1 4.17Å; L135-I148 HydrophobicContact CD2-CG2 4.36Å; S144-I148 PolarHBondContact O-N 3.13Å; S144-I148 VanDerWaalsContact O-N 3.13Å; I148-R150 VanDerWaalsContact C-N 3.32Å; I148-R150 PolarHBondContact O-N 3.29Å; I148-V151 PolarHBondContact O-N 3.46Å; I148-L152 HydrophobicContact CG2-CD1 4.05Å; I148-L152 HydrophobicContact CG2-CG 4.37Å; I148-L152 VanDerWaalsContact O-CG 3.3Å; I148-L152 WeakPolarHBondContact O-CG 3.2Å; I148-L152 PolarHBondContact O-N 2.84Å |
| 149 | K | 87.9 | Confident | 83.4 | Confident | 154 Ų | 154 | 75.2 Ų | 75.2 | 67% | 0.67 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -59.2 | -42.3 | 175.8 | -74.4 | 179.7 | -179.8 | -173 | 0 | 112.3 | K145 S146 S147 L152 A153 | K145-K149 WeakPolarHBondContact O-CG 3.4Å; K145-K149 PolarHBondContact O-N 2.86Å; K145-K149 VanDerWaalsContact O-N 3.14Å; S146-K149 PolarHBondContact O-N 3.49Å; S147-K149 VanDerWaalsContact C-N 3.33Å; S147-K149 PolarHBondContact O-N 3.25Å; K149-L152 PolarHBondContact O-N 2.87Å; K149-A153 WeakPolarHBondContact O-CB 3.33Å; K149-A153 PolarHBondContact O-N 3.22Å |
| 150 | R | 89.9 | Confident | 84.5 | Confident | 172 Ų | 172 | 75.9 Ų | 75.9 | 65% | 0.649 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -63.4 | -44.5 | 177.1 | 179.2 | -178.5 | 165.5 | -142 | -3.2 | 111.6 | S146 S147 I148 A153 I154 | S146-R150 PolarHBondContact O-N 3.06Å; S147-R150 WeakPolarHBondContact O-CB 3.48Å; S147-R150 PolarHBondContact O-N 3.27Å; S147-R150 VanDerWaalsContact O-N 3.15Å; I148-R150 VanDerWaalsContact C-N 3.32Å; I148-R150 PolarHBondContact O-N 3.29Å; R150-A153 PolarHBondContact O-N 3.33Å; R150-I154 HydrophobicContact CG-CD1 3.81Å; R150-I154 HydrophobicContact CG-CG1 4.46Å; R150-I154 VanDerWaalsContact O-CG1 3.28Å; R150-I154 WeakPolarHBondContact O-CG1 3.32Å; R150-I154 PolarHBondContact O-N 3.42Å |
| 151 | V | 90.2 | Very high | 86.1 | Confident | 11 Ų | 11 | 75.7 Ų | 75.7 | 7% | 0.067 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -60.6 | -50.6 | 176.9 | 173.4 | 0 | 0 | 0 | 0 | 110.2 | I134 L135 L142 S147 I148 A153 I154 T155 | I134-V151 HydrophobicContact CB-CG1 3.95Å; I134-V151 HydrophobicContact CG2-CG1 3.63Å; I134-V151 HydrophobicContact CG2-CG2 4.16Å; L135-V151 HydrophobicContact CD2-CB 4.16Å; L135-V151 HydrophobicContact CD2-CG1 4.08Å; L135-V151 HydrophobicContact CD2-CG2 4.34Å; L135-V151 HydrophobicContact CG-CG1 3.98Å; L142-V151 HydrophobicContact CD1-CG2 3.71Å; S147-V151 WeakPolarHBondContact O-CG2 3.5Å; S147-V151 PolarHBondContact O-N 3.22Å; I148-V151 PolarHBondContact O-N 3.46Å; V151-A153 VanDerWaalsContact C-N 3.29Å; V151-A153 PolarHBondContact O-N 3.28Å; V151-I154 PolarHBondContact O-N 3.42Å; V151-T155 HydrophobicContact CG1-CG2 4.35Å; V151-T155 WeakPolarHBondContact O-CG2 3.44Å; V151-T155 PolarHBondContact O-N 2.86Å; V151-T155 PolarHBondContact O-OG1 2.94Å |
| 152 | L | 90.2 | Very high | 87.5 | Confident | 45 Ų | 45 | 69.6 Ų | 69.6 | 24% | 0.236 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -56.6 | -42.9 | 177.1 | -68.5 | 174.4 | 0 | 0 | 0 | 111.7 | T82 L86 S131 I148 K149 T155 T156 | T82-L152 HydrophobicContact CG2-CD1 4.15Å; T82-L152 HydrophobicContact CG2-CD2 4.43Å; L86-L152 HydrophobicContact CD1-CD2 4.22Å; L86-L152 HydrophobicContact CD2-CD2 4.2Å; S131-L152 WeakPolarHBondContact OG-CD2 3.36Å; I148-L152 HydrophobicContact CG2-CD1 4.05Å; I148-L152 HydrophobicContact CG2-CG 4.37Å; I148-L152 VanDerWaalsContact O-CG 3.3Å; I148-L152 WeakPolarHBondContact O-CG 3.2Å; I148-L152 PolarHBondContact O-N 2.84Å; K149-L152 PolarHBondContact O-N 2.87Å; L152-T155 WeakPolarHBondContact CA-OG1 2.98Å; L152-T155 PolarHBondContact O-OG1 3.43Å; L152-T156 VanDerWaalsContact O-CB 3.29Å; L152-T156 WeakPolarHBondContact O-CB 2.98Å; L152-T156 PolarHBondContact O-N 3.23Å; L152-T156 PolarHBondContact O-OG1 3.11Å |
| 153 | A | 92.3 | Very high | 88.8 | Confident | 55 Ų | 55 | 68.5 Ų | 68.5 | 46% | 0.455 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.6 | -46.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | K149 R150 V151 T156 V157 | K149-A153 WeakPolarHBondContact O-CB 3.33Å; K149-A153 PolarHBondContact O-N 3.22Å; R150-A153 PolarHBondContact O-N 3.33Å; V151-A153 VanDerWaalsContact C-N 3.29Å; V151-A153 PolarHBondContact O-N 3.28Å; A153-T156 PolarHBondContact O-N 2.86Å; A153-V157 WeakPolarHBondContact O-CG2 3.46Å; A153-V157 PolarHBondContact O-N 2.01Å |
| 154 | I | 92.7 | Very high | 89.7 | Confident | 69 Ų | 69 | 65.7 Ų | 65.7 | 35% | 0.354 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60.6 | -49.6 | 178.5 | -70.5 | 168.1 | 0 | 0 | 0 | 110.2 | R150 V151 T156 V157 L158 | R150-I154 HydrophobicContact CG-CD1 3.81Å; R150-I154 HydrophobicContact CG-CG1 4.46Å; R150-I154 VanDerWaalsContact O-CG1 3.28Å; R150-I154 WeakPolarHBondContact O-CG1 3.32Å; R150-I154 PolarHBondContact O-N 3.42Å; V151-I154 PolarHBondContact O-N 3.42Å; I154-T156 VanDerWaalsContact C-N 3.3Å; I154-T156 PolarHBondContact O-N 3.48Å; I154-V157 PolarHBondContact O-N 3.28Å; I154-V157 VanDerWaalsContact O-N 3.11Å; I154-L158 HydrophobicContact CG2-CD1 3.54Å; I154-L158 WeakPolarHBondContact O-CD1 3.41Å; I154-L158 PolarHBondContact O-N 3.09Å |
| 155 | T | 93.4 | Very high | 90.1 | Very high | 1 Ų | 1 | 65.6 Ų | 65.6 | 1% | 0.006 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.1 | -34.3 | -179.2 | 49.9 | 0 | 0 | 0 | 0 | 112.7 | L130 S131 I134 V151 L152 S159 | L130-T155 HydrophobicContact CB-CG2 3.74Å; S131-T155 PolarHBondContact OG-OG1 3.38Å; I134-T155 HydrophobicContact CD1-CG2 3.6Å; V151-T155 HydrophobicContact CG1-CG2 4.35Å; V151-T155 WeakPolarHBondContact O-CG2 3.44Å; V151-T155 PolarHBondContact O-N 2.86Å; V151-T155 PolarHBondContact O-OG1 2.94Å; L152-T155 WeakPolarHBondContact CA-OG1 2.98Å; L152-T155 PolarHBondContact O-OG1 3.43Å; T155-S159 VanDerWaalsContact O-CB 3.3Å; T155-S159 WeakPolarHBondContact O-CB 3.39Å; T155-S159 PolarHBondContact O-N 2.97Å; T155-S159 PolarHBondContact O-OG 3.21Å |
| 156 | T | 92.9 | Very high | 90.2 | Very high | 60 Ų | 60 | 58.1 Ų | 58.1 | 37% | 0.368 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 171.9 | -62.8 | 0 | 0 | 0 | 0 | 111.3 | F123 L152 A153 I154 S159 L160 | F123-T156 HydrophobicContact CE2-CG2 4.35Å; F123-T156 HydrophobicContact CZ-CG2 3.76Å; L152-T156 VanDerWaalsContact O-CB 3.29Å; L152-T156 WeakPolarHBondContact O-CB 2.98Å; L152-T156 PolarHBondContact O-N 3.23Å; L152-T156 PolarHBondContact O-OG1 3.11Å; A153-T156 PolarHBondContact O-N 2.86Å; I154-T156 VanDerWaalsContact C-N 3.3Å; I154-T156 PolarHBondContact O-N 3.48Å; T156-S159 VanDerWaalsContact CA-OG 3.32Å; T156-S159 WeakPolarHBondContact CA-OG 3.45Å; T156-S159 PolarHBondContact O-OG 3.27Å; T156-L160 VanDerWaalsContact O-CB 3.23Å; T156-L160 WeakPolarHBondContact O-CB 3.48Å; T156-L160 PolarHBondContact O-N 3.27Å |
| 157 | V | 95.3 | Very high | 90 | Very high | 99 Ų | 99 | 54.7 Ų | 54.7 | 60% | 0.6 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -66.2 | -44.6 | 176.2 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | A153 I154 L160 A161 | A153-V157 WeakPolarHBondContact O-CG2 3.46Å; A153-V157 PolarHBondContact O-N 2.01Å; I154-V157 PolarHBondContact O-N 3.28Å; I154-V157 VanDerWaalsContact O-N 3.11Å; V157-L160 PolarHBondContact O-N 3.19Å; V157-A161 PolarHBondContact O-N 2.92Å |
| 158 | L | 94.1 | Very high | 89.9 | Confident | 100 Ų | 100 | 56.7 Ų | 56.7 | 52% | 0.524 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.1 | -46.1 | 177.9 | -87.6 | 82.7 | 0 | 0 | 0 | 112 | L130 I154 L160 A161 Y162 | L130-L158 HydrophobicContact CD1-CB 4.29Å; I154-L158 HydrophobicContact CG2-CD1 3.54Å; I154-L158 WeakPolarHBondContact O-CD1 3.41Å; I154-L158 PolarHBondContact O-N 3.09Å; L158-L160 VanDerWaalsContact C-N 3.3Å; L158-L160 PolarHBondContact O-N 3.41Å; L158-A161 PolarHBondContact O-N 2.83Å; L158-Y162 PolarHBondContact O-N 2.77Å |
| 159 | S | 94 | Very high | 89.3 | Confident | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -65.5 | -34.1 | 177.5 | 51.8 | 0 | 0 | 0 | 0 | 112.1 | F123 A127 T155 T156 Y162 S163 | F123-S159 VanDerWaalsContact CE2-OG 3.3Å; F123-S159 WeakPolarHBondContact CE2-OG 3.08Å; A127-S159 VanDerWaalsContact CB-OG 3.27Å; A127-S159 WeakPolarHBondContact CB-OG 3.3Å; T155-S159 VanDerWaalsContact O-CB 3.3Å; T155-S159 WeakPolarHBondContact O-CB 3.39Å; T155-S159 PolarHBondContact O-N 2.97Å; T155-S159 PolarHBondContact O-OG 3.21Å; T156-S159 VanDerWaalsContact CA-OG 3.32Å; T156-S159 WeakPolarHBondContact CA-OG 3.45Å; T156-S159 PolarHBondContact O-OG 3.27Å; S159-Y162 PolarHBondContact O-N 3.11Å; S159-S163 WeakPolarHBondContact O-CB 3.35Å; S159-S163 PolarHBondContact O-N 2.88Å; S159-S163 PolarHBondContact O-OG 2.98Å |
| 160 | L | 93 | Very high | 88.5 | Confident | 90 Ų | 90 | 53.3 Ų | 53.3 | 47% | 0.471 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -65.2 | -46.7 | 174.7 | -177.4 | 63.4 | 0 | 0 | 0 | 110.6 | F123 T156 V157 L158 Y162 S163 V164 | F123-L160 HydrophobicContact CD2-CB 4.35Å; F123-L160 HydrophobicContact CE2-CB 3.71Å; F123-L160 HydrophobicContact CE2-CD1 4.25Å; F123-L160 HydrophobicContact CZ-CB 4.49Å; T156-L160 VanDerWaalsContact O-CB 3.23Å; T156-L160 WeakPolarHBondContact O-CB 3.48Å; T156-L160 PolarHBondContact O-N 3.27Å; V157-L160 PolarHBondContact O-N 3.19Å; L158-L160 VanDerWaalsContact C-N 3.3Å; L158-L160 PolarHBondContact O-N 3.41Å; L160-Y162 VanDerWaalsContact C-N 3.3Å; L160-Y162 PolarHBondContact O-N 2.88Å; L160-S163 PolarHBondContact O-N 3.31Å; L160-V164 HydrophobicContact CD1-CG2 4.08Å; L160-V164 HydrophobicContact CG-CG2 4.29Å; L160-V164 WeakPolarHBondContact O-CB 3.42Å; L160-V164 VanDerWaalsContact O-CG2 3.26Å; L160-V164 WeakPolarHBondContact O-CG2 3.1Å; L160-V164 PolarHBondContact O-N 3.15Å |
| 161 | A | 93.2 | Very high | 87.5 | Confident | 56 Ų | 56 | 51.5 Ų | 51.5 | 46% | 0.463 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.5 | -41.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | V157 L158 T165 | V157-A161 PolarHBondContact O-N 2.92Å; L158-A161 PolarHBondContact O-N 2.83Å; A161-T165 WeakPolarHBondContact O-CB 3.37Å; A161-T165 PolarHBondContact O-N 3.35Å; A161-T165 PolarHBondContact O-OG1 3.23Å |
| 162 | Y | 91.8 | Very high | 86.3 | Confident | 35 Ų | 35 | 56.3 Ų | 56.3 | 14% | 0.137 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -61.4 | -50.8 | 173.9 | 178.7 | -88.5 | 0 | 0 | 0 | 111.9 | L126 L158 S159 L160 V164 T165 Q166 F193 S197 F201 | L126-Y162 HydrophobicContact CD2-CD1 3.22Å; L126-Y162 HydrophobicContact CD2-CD2 4.35Å; L126-Y162 HydrophobicContact CD2-CE1 3.87Å; L126-Y162 HydrophobicContact CD2-CG 3.51Å; L158-Y162 PolarHBondContact O-N 2.77Å; S159-Y162 PolarHBondContact O-N 3.11Å; L160-Y162 VanDerWaalsContact C-N 3.3Å; L160-Y162 PolarHBondContact O-N 2.88Å; Y162-V164 PolarHBondContact O-N 2.88Å; Y162-T165 WeakPolarHBondContact O-CB 3.38Å; Y162-T165 PolarHBondContact O-N 3.46Å; Y162-Q166 WeakPolarHBondContact O-CB 3.07Å; Y162-Q166 PolarHBondContact O-N 3.01Å; Y162-Q166 PolarHBondContact OH-OE1 3.21Å; Y162-F193 AromaticContact CD2-CZ 3.99Å; Y162-F193 HydrophobicContact CD2-CZ 3.99Å; Y162-F193 HydrophobicContact CE1-CE1 4.39Å; Y162-F193 AromaticContact CE2-CE1 3.89Å; Y162-F193 HydrophobicContact CE2-CE1 3.89Å; Y162-F193 AromaticContact CE2-CZ 3.53Å; Y162-F193 HydrophobicContact CE2-CZ 3.53Å; Y162-F193 AromaticContact CZ-CE1 3.7Å; Y162-F193 AromaticContact CZ-CZ 3.83Å; Y162-S197 PolarHBondContact OH-OG 2.87Å; Y162-S197 VanDerWaalsContact OH-OG 3.14Å; Y162-F201 HydrophobicContact CD2-CE2 4.42Å; Y162-F201 HydrophobicContact CD2-CZ 4.42Å; Y162-F201 AromaticContact CE2-CE2 3.89Å; Y162-F201 HydrophobicContact CE2-CE2 3.89Å; Y162-F201 HydrophobicContact CE2-CZ 4.34Å |
| 163 | S | 89.6 | Confident | 85.1 | Confident | 8 Ų | 8 | 62.5 Ų | 62.5 | 6% | 0.056 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -67.8 | -35.7 | -176.2 | -49.2 | 0 | 0 | 0 | 0 | 112 | E119 F123 S159 L160 Q166 G167 | E119-S163 WeakPolarHBondContact OE1-CA 3.36Å; E119-S163 WeakPolarHBondContact OE1-CB 3.06Å; F123-S163 WeakPolarHBondContact CA-OG 3.45Å; F123-S163 WeakPolarHBondContact CB-OG 3.42Å; S159-S163 WeakPolarHBondContact O-CB 3.35Å; S159-S163 PolarHBondContact O-N 2.88Å; S159-S163 PolarHBondContact O-OG 2.98Å; L160-S163 PolarHBondContact O-N 3.31Å; S163-Q166 PolarHBondContact O-N 2.88Å; S163-G167 PolarHBondContact O-N 2.54Å |
| 164 | V | 88.1 | Confident | 83.5 | Confident | 82 Ų | 82 | 63.9 Ų | 63.9 | 50% | 0.497 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.3 | -41.7 | 172.8 | 169.7 | 0 | 0 | 0 | 0 | 110.8 | L160 Y162 T168 | L160-V164 HydrophobicContact CD1-CG2 4.08Å; L160-V164 HydrophobicContact CG-CG2 4.29Å; L160-V164 WeakPolarHBondContact O-CB 3.42Å; L160-V164 VanDerWaalsContact O-CG2 3.26Å; L160-V164 WeakPolarHBondContact O-CG2 3.1Å; L160-V164 PolarHBondContact O-N 3.15Å; Y162-V164 PolarHBondContact O-N 2.88Å; V164-T168 VanDerWaalsContact O-CB 3.25Å; V164-T168 WeakPolarHBondContact O-CB 3.49Å; V164-T168 PolarHBondContact O-N 2.84Å; V164-T168 PolarHBondContact O-OG1 3.36Å |
| 165 | T | 87.4 | Confident | 81.6 | Confident | 68 Ų | 68 | 63 Ų | 63 | 42% | 0.417 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 176.7 | -57.6 | 0 | 0 | 0 | 0 | 110.5 | A161 Y162 T168 L169 F193 | A161-T165 WeakPolarHBondContact O-CB 3.37Å; A161-T165 PolarHBondContact O-N 3.35Å; A161-T165 PolarHBondContact O-OG1 3.23Å; Y162-T165 WeakPolarHBondContact O-CB 3.38Å; Y162-T165 PolarHBondContact O-N 3.46Å; T165-T168 PolarHBondContact O-N 2.79Å; T165-L169 HydrophobicContact CG2-CD1 4.27Å; T165-L169 WeakPolarHBondContact O-CG 3.49Å; T165-L169 PolarHBondContact O-N 3.47Å; T165-F193 HydrophobicContact CG2-CD2 4.42Å; T165-F193 HydrophobicContact CG2-CE2 3.72Å; T165-F193 HydrophobicContact CG2-CZ 4.3Å |
| 166 | Q | 84.4 | Confident | 79.4 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -59 | -51.8 | 176.3 | -172.4 | -178.8 | -70.2 | 0 | 0 | 111.8 | E119 R122 Y162 S163 T168 L169 E170 G187 F193 | E119-Q166 PolarHBondContact OE1-NE2 2.79Å; E119-Q166 PolarHBondContact OE2-NE2 3.14Å; R122-Q166 VanDerWaalsContact CD-NE2 3.26Å; Y162-Q166 WeakPolarHBondContact O-CB 3.07Å; Y162-Q166 PolarHBondContact O-N 3.01Å; Y162-Q166 PolarHBondContact OH-OE1 3.21Å; S163-Q166 PolarHBondContact O-N 2.88Å; Q166-T168 VanDerWaalsContact C-N 3.34Å; Q166-T168 PolarHBondContact O-N 2.53Å; Q166-L169 PolarHBondContact O-N 3.13Å; Q166-E170 PolarHBondContact O-N 2.99Å; Q166-G187 PolarHBondContact NE2-O 2.86Å; Q166-G187 VanDerWaalsContact NE2-O 3.16Å; Q166-F193 HydrophobicContact CB-CD1 4.44Å; Q166-F193 HydrophobicContact CB-CE1 3.65Å; Q166-F193 HydrophobicContact CB-CZ 4.09Å; Q166-F193 HydrophobicContact CG-CD1 4.28Å; Q166-F193 HydrophobicContact CG-CE1 3.8Å |
| 167 | G | 79.5 | Confident | 77.1 | Confident | 15 Ų | 15 | 71.6 Ų | 71.6 | 16% | 0.155 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.2 | -35 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S163 E170 I171 | S163-G167 PolarHBondContact O-N 2.54Å; G167-E170 PolarHBondContact O-N 3.4Å; G167-I171 VanDerWaalsContact O-CG1 3.26Å; G167-I171 WeakPolarHBondContact O-CG1 3.26Å; G167-I171 PolarHBondContact O-N 3.27Å |
| 168 | T | 80.8 | Confident | 74.8 | Confident | 63 Ų | 63 | 69.5 Ų | 69.5 | 39% | 0.387 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65 | -44.6 | 174.9 | -57.9 | 0 | 0 | 0 | 0 | 110.7 | V164 T165 Q166 E170 I171 L172 | V164-T168 VanDerWaalsContact O-CB 3.25Å; V164-T168 WeakPolarHBondContact O-CB 3.49Å; V164-T168 PolarHBondContact O-N 2.84Å; V164-T168 PolarHBondContact O-OG1 3.36Å; T165-T168 PolarHBondContact O-N 2.79Å; Q166-T168 VanDerWaalsContact C-N 3.34Å; Q166-T168 PolarHBondContact O-N 2.53Å; T168-E170 VanDerWaalsContact C-N 3.29Å; T168-E170 PolarHBondContact O-N 2.9Å; T168-I171 PolarHBondContact O-N 3.3Å; T168-L172 HydrophobicContact CG2-CD1 4.36Å; T168-L172 HydrophobicContact CG2-CD2 4.3Å; T168-L172 WeakPolarHBondContact O-CB 3.04Å; T168-L172 PolarHBondContact O-N 3.5Å |
| 169 | L | 74.9 | Confident | 72.1 | Confident | 55 Ų | 55 | 68.3 Ų | 68.3 | 29% | 0.288 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.1 | -36.5 | 177.3 | -70.6 | 173.3 | 0 | 0 | 0 | 111.9 | T165 Q166 Y173 G189 F193 | T165-L169 HydrophobicContact CG2-CD1 4.27Å; T165-L169 WeakPolarHBondContact O-CG 3.49Å; T165-L169 PolarHBondContact O-N 3.47Å; Q166-L169 PolarHBondContact O-N 3.13Å; L169-Y173 HydrophobicContact CD2-CD2 4.31Å; L169-Y173 CarbonylContact O-C 3.38Å; L169-Y173 PolarHBondContact O-N 3.22Å; L169-Y173 VanDerWaalsContact O-N 3.17Å; L169-G189 WeakPolarHBondContact CB-O 3.49Å; L169-F193 HydrophobicContact CD1-CB 3.72Å; L169-F193 HydrophobicContact CD1-CD1 4.47Å; L169-F193 HydrophobicContact CD1-CD2 3.47Å; L169-F193 VanDerWaalsContact CD1-CD2 3.47Å; L169-F193 HydrophobicContact CD1-CE2 4.2Å; L169-F193 HydrophobicContact CD1-CG 3.63Å |
| 170 | E | 71.3 | Confident | 69.3 | Low | 36 Ų | 36 | 71.1 Ų | 71.1 | 17% | 0.168 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -67.7 | -33.2 | 176.4 | -172.9 | 168.4 | 166.4 | 0 | 0 | 113.6 | Q166 G167 T168 G187 | Q166-E170 PolarHBondContact O-N 2.99Å; G167-E170 PolarHBondContact O-N 3.4Å; T168-E170 VanDerWaalsContact C-N 3.29Å; T168-E170 PolarHBondContact O-N 2.9Å; E170-G187 PolarHBondContact OE1-N 2.64Å; E170-G187 WeakPolarHBondContact OE2-CA 3.35Å |
| 171 | I | 68.8 | Low | 66.8 | Low | 133 Ų | 133 | 76.6 Ų | 76.6 | 68% | 0.682 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -91.5 | -43.6 | -176.8 | -62.9 | 167.3 | 0 | 0 | 0 | 112.1 | G167 T168 | G167-I171 VanDerWaalsContact O-CG1 3.26Å; G167-I171 WeakPolarHBondContact O-CG1 3.26Å; G167-I171 PolarHBondContact O-N 3.27Å; T168-I171 PolarHBondContact O-N 3.3Å |
| 172 | L | 64.9 | Low | 64.3 | Low | 113 Ų | 113 | 79.8 Ų | 79.8 | 59% | 0.592 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -85.9 | -29.6 | -174.8 | -98.6 | 70.6 | 0 | 0 | 0 | 113.7 | T168 P174 | T168-L172 HydrophobicContact CG2-CD1 4.36Å; T168-L172 HydrophobicContact CG2-CD2 4.3Å; T168-L172 WeakPolarHBondContact O-CB 3.04Å; T168-L172 PolarHBondContact O-N 3.5Å; L172-P174 VanDerWaalsContact C-CD 3.47Å |
| 173 | Y | 63.8 | Low | 62.1 | Low | 174 Ų | 174 | 81 Ų | 81 | 68% | 0.682 | 44% | 0.444 | S | S | * | . | trans | -129.5 | 65.7 | -175.4 | -66.6 | -81.6 | 0 | 0 | 0 | 111.6 | L169 D175 | L169-Y173 HydrophobicContact CD2-CD2 4.31Å; L169-Y173 CarbonylContact O-C 3.38Å; L169-Y173 PolarHBondContact O-N 3.22Å; L169-Y173 VanDerWaalsContact O-N 3.17Å; Y173-D175 PolarHBondContact O-N 3.45Å; Y173-D175 VanDerWaalsContact O-N 3.14Å | ||
| 174 | P | 60.3 | Low | 60 | Low | 85 Ų | 85 | 85 Ų | 85 | 55% | 0.552 | 47% | 0.465 | S | S | * | . | trans | -60.5 | 119.2 | 172 | 26.2 | -32.5 | 0 | 0 | 0 | 109.4 | L172 A176 | L172-P174 VanDerWaalsContact C-CD 3.47Å; P174-A176 PolarHBondContact O-N 3.24Å; P174-A176 VanDerWaalsContact O-N 3.11Å | ||
| 175 | D | 52.8 | Low | 58.3 | Low | 51 Ų | 51 | 82.7 Ų | 82.7 | 27% | 0.273 | 45% | 0.45 | S | S | . | . | trans | -68.1 | 107.1 | -172.7 | -144.7 | -16.8 | 0 | 0 | 0 | 109.3 | Y173 H177 L178 S179 R191 | Y173-D175 PolarHBondContact O-N 3.45Å; Y173-D175 VanDerWaalsContact O-N 3.14Å; D175-H177 VanDerWaalsContact C-N 3.25Å; D175-H177 PolarHBondContact O-N 2.98Å; D175-H177 VanDerWaalsContact O-N 3.12Å; D175-L178 CarbonylContact O-C 3.53Å; D175-L178 PolarHBondContact O-N 2.98Å; D175-S179 WeakPolarHBondContact O-CB 3.29Å; D175-S179 PolarHBondContact O-N 3Å; D175-R191 IonicContact OD1-CZ 3.26Å; D175-R191 IonicContact OD1-NE 3.94Å; D175-R191 IonicContact OD1-NH2 3.75Å; D175-R191 PolarHBondContact OD1-NH2 3Å; D175-R191 IonicContact OD2-CZ 2.82Å; D175-R191 IonicContact OD2-NE 3.78Å; D175-R191 PolarHBondContact OD2-NE 2.9Å; D175-R191 IonicContact OD2-NH2 2.7Å | ||
| 176 | A | 46.3 | Very low | 56.6 | Low | 81 Ų | 81 | 80.6 Ų | 80.6 | 67% | 0.669 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -25.9 | -167.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | P174 L178 S179 | P174-A176 PolarHBondContact O-N 3.24Å; P174-A176 VanDerWaalsContact O-N 3.11Å; A176-L178 VanDerWaalsContact C-N 3.32Å; A176-S179 PolarHBondContact O-N 3.08Å |
| 177 | H | 46 | Very low | 55.1 | Low | 160 Ų | 160 | 80.6 Ų | 80.6 | 74% | 0.741 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.2 | -14.5 | 176.4 | -89.7 | -92.4 | 0 | 0 | 0 | 114.1 | D175 | D175-H177 VanDerWaalsContact C-N 3.25Å; D175-H177 PolarHBondContact O-N 2.98Å; D175-H177 VanDerWaalsContact O-N 3.12Å |
| 178 | L | 45.9 | Very low | 54.1 | Low | 54 Ų | 54 | 80.7 Ų | 80.7 | 28% | 0.283 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.5 | -9.6 | 169.5 | -81 | 157.6 | 0 | 0 | 0 | 111.5 | D175 A176 A180 I185 | D175-L178 CarbonylContact O-C 3.53Å; D175-L178 PolarHBondContact O-N 2.98Å; A176-L178 VanDerWaalsContact C-N 3.32Å; L178-A180 VanDerWaalsContact C-N 3.3Å; L178-A180 PolarHBondContact O-N 3.4Å; L178-I185 HydrophobicContact CD1-CD1 4.41Å; L178-I185 HydrophobicContact CD2-CD1 3.47Å; L178-I185 VanDerWaalsContact CD2-CD1 3.47Å; L178-I185 HydrophobicContact CD2-CG1 4.49Å; L178-I185 HydrophobicContact CG-CD1 4.49Å |
| 179 | S | 38.4 | Very low | 52.9 | Low | 75 Ų | 75 | 77.9 Ų | 77.9 | 52% | 0.524 | 42% | 0.415 | S | S | . | . | trans | -92.4 | 52 | 177.2 | -170.4 | 0 | 0 | 0 | 0 | 111.5 | D175 A176 | D175-S179 WeakPolarHBondContact O-CB 3.29Å; D175-S179 PolarHBondContact O-N 3Å; A176-S179 PolarHBondContact O-N 3.08Å | ||
| 180 | A | 33.7 | Very low | 52.7 | Low | 59 Ų | 59 | 76.7 Ų | 76.7 | 49% | 0.488 | 42% | 0.415 | S | S | . | . | S | Bend | trans | -78.1 | 148.1 | 145.4 | 0 | 0 | 0 | 0 | 0 | 106.7 | L178 D182 F183 | L178-A180 VanDerWaalsContact C-N 3.3Å; L178-A180 PolarHBondContact O-N 3.4Å; A180-D182 PolarHBondContact O-N 3.25Å; A180-F183 PolarHBondContact O-N 3.28Å |
| 181 | E | 40.8 | Very low | 52.9 | Low | 205 Ų | 205 | 77.3 Ų | 77.3 | 96% | 0.958 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -1.5 | -177.2 | -66.4 | 176.1 | 145.5 | 0 | 0 | 115.2 | ||
| 182 | D | 41.6 | Very low | 53.3 | Low | 123 Ų | 123 | 75.8 Ų | 75.8 | 66% | 0.658 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.8 | -2.8 | -174 | -63.3 | -45.7 | 0 | 0 | 0 | 116.7 | A180 | A180-D182 PolarHBondContact O-N 3.25Š|
| 183 | F | 44.2 | Very low | 54.2 | Low | 60 Ų | 60 | 72.4 Ų | 72.4 | 26% | 0.263 | 39% | 0.387 | S | S | . | . | trans | -130.7 | 61.3 | -174.7 | -64.5 | -90 | 0 | 0 | 0 | 114 | L31 A180 I185 | L31-F183 HydrophobicContact CD1-CD1 3.26Å; L31-F183 HydrophobicContact CD1-CE1 3.48Å; L31-F183 VanDerWaalsContact CD1-CE1 3.48Å; L31-F183 HydrophobicContact CD1-CG 4.43Å; L31-F183 HydrophobicContact CD2-CD1 3.85Å; L31-F183 HydrophobicContact CD2-CE1 3.31Å; L31-F183 HydrophobicContact CD2-CZ 3.99Å; L31-F183 HydrophobicContact CG-CD1 4.14Å; L31-F183 HydrophobicContact CG-CE1 3.92Å; A180-F183 PolarHBondContact O-N 3.28Å; F183-I185 PolarHBondContact O-N 3.09Å | ||
| 184 | N | 47.1 | Very low | 55.1 | Low | 93 Ų | 93 | 64.3 Ų | 64.3 | 50% | 0.497 | 36% | 0.355 | S | S | . | . | trans | -78.7 | 66 | 177.6 | -135.1 | -18.8 | 0 | 0 | 0 | 111.2 | Y35 K115 Y186 | Y35-N184 VanDerWaalsContact OH-C 3.29Å; Y35-N184 PolarHBondContact OH-O 3.49Å; K115-N184 PolarHBondContact NZ-ND2 3.44Å; K115-N184 PolarHBondContact NZ-OD1 2.75Å; N184-Y186 PolarHBondContact O-N 3.33Å | ||
| 185 | I | 52.2 | Low | 56.4 | Low | 34 Ų | 34 | 62.1 Ų | 62.1 | 17% | 0.174 | 34% | 0.338 | C | S | . | . | trans | -52 | 103.6 | -179.5 | -62.2 | 177.1 | 0 | 0 | 0 | 109.5 | L178 F183 G187 H188 L257 | L178-I185 HydrophobicContact CD1-CD1 4.41Å; L178-I185 HydrophobicContact CD2-CD1 3.47Å; L178-I185 VanDerWaalsContact CD2-CD1 3.47Å; L178-I185 HydrophobicContact CD2-CG1 4.49Å; L178-I185 HydrophobicContact CG-CD1 4.49Å; F183-I185 PolarHBondContact O-N 3.09Å; I185-G187 PolarHBondContact O-N 3.09Å; I185-H188 HydrophobicContact CG2-CB 4.28Å; I185-L257 HydrophobicContact CD1-CD1 3.73Å; I185-L257 HydrophobicContact CG1-CD1 4.03Å; I185-L257 HydrophobicContact CG2-CD1 4.27Å | ||
| 186 | Y | 50.2 | Low | 58.2 | Low | 23 Ų | 23 | 64.4 Ų | 64.4 | 9% | 0.09 | 35% | 0.354 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | 115.8 | -168.2 | -80.6 | -89.8 | 0 | 0 | 0 | 113.3 | L34 Y35 R44 D114 N184 H188 | L34-Y186 HydrophobicContact CD2-CD2 3.75Å; L34-Y186 HydrophobicContact CD2-CE2 4.29Å; L34-Y186 HydrophobicContact CG-CD2 4.16Å; L34-Y186 HydrophobicContact CG-CE2 4.39Å; Y35-Y186 HydrophobicContact CD1-CE2 4.29Å; Y35-Y186 AromaticContact CE1-CE2 3.47Å; Y35-Y186 HydrophobicContact CE1-CE2 3.47Å; Y35-Y186 VanDerWaalsContact CE1-CE2 3.47Å; Y35-Y186 AromaticContact CE1-CZ 3.95Å; Y35-Y186 HydrophobicContact CE2-CE2 4.29Å; Y35-Y186 AromaticContact CZ-CE2 3.48Å; Y35-Y186 VanDerWaalsContact CZ-CE2 3.48Å; Y35-Y186 WeakPolarHBondContact OH-CE2 3.39Å; R44-Y186 PolarHBondContact NH1-OH 3.48Å; D114-Y186 WeakPolarHBondContact OD2-CE1 3.27Å; N184-Y186 PolarHBondContact O-N 3.33Å; Y186-H188 PolarHBondContact O-CE1 3.28Å; Y186-H188 VanDerWaalsContact O-CE1 3.28Å; Y186-H188 PolarHBondContact O-N 3.47Å; Y186-H188 PolarHBondContact O-ND1 2.91Å |
| 187 | G | 52.9 | Low | 60.4 | Low | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 75.8 | 22.5 | 155.2 | 0 | 0 | 0 | 0 | 0 | 116 | R122 Q166 E170 I185 | R122-G187 PolarHBondContact NH1-O 3.49Å; Q166-G187 PolarHBondContact NE2-O 2.86Å; Q166-G187 VanDerWaalsContact NE2-O 3.16Å; E170-G187 PolarHBondContact OE1-N 2.64Å; E170-G187 WeakPolarHBondContact OE2-CA 3.35Å; I185-G187 PolarHBondContact O-N 3.09Å |
| 188 | H | 59.7 | Low | 62.6 | Low | 18 Ų | 18 | 53.3 Ų | 53.3 | 8% | 0.083 | 29% | 0.29 | C | S | . | . | trans | -100 | -1.7 | -174.1 | -70.8 | 41.5 | 0 | 0 | 0 | 115.2 | I185 Y186 G190 W194 V260 | I185-H188 HydrophobicContact CG2-CB 4.28Å; Y186-H188 PolarHBondContact O-CE1 3.28Å; Y186-H188 VanDerWaalsContact O-CE1 3.28Å; Y186-H188 PolarHBondContact O-N 3.47Å; Y186-H188 PolarHBondContact O-ND1 2.91Å; H188-G190 PolarHBondContact O-N 2.95Å; H188-W194 HydrophobicContact CB-CD2 4.03Å; H188-W194 HydrophobicContact CB-CE3 3.17Å; H188-W194 HydrophobicContact CB-CH2 4.36Å; H188-W194 HydrophobicContact CB-CZ3 3.33Å; H188-W194 AromaticContact CD2-CD2 3.55Å; H188-W194 AromaticContact CD2-CE2 3.56Å; H188-W194 AromaticContact CD2-CE3 3.21Å; H188-W194 AromaticContact CD2-CH2 2.99Å; H188-W194 WeakPolarHBondContact CD2-CH2 3.3Å; H188-W194 AromaticContact CD2-CZ2 3.35Å; H188-W194 WeakPolarHBondContact CD2-CZ2 3.45Å; H188-W194 AromaticContact CD2-CZ3 2.86Å; H188-W194 WeakPolarHBondContact CD2-CZ3 3.49Å; H188-W194 AromaticContact CE1-CH2 3.27Å; H188-W194 WeakPolarHBondContact CE1-CH2 3.47Å; H188-W194 AromaticContact CE1-CZ3 3.42Å; H188-W194 VanDerWaalsContact CE1-CZ3 3.42Å; H188-W194 WeakPolarHBondContact CE1-CZ3 3.14Å; H188-W194 AromaticContact CG-CD2 3.98Å; H188-W194 AromaticContact CG-CE3 3.19Å; H188-W194 AromaticContact CG-CH2 3.45Å; H188-W194 VanDerWaalsContact CG-CH2 3.45Å; H188-W194 AromaticContact CG-CZ3 2.82Å; H188-W194 AromaticContact ND1-CH2 3.57Å; H188-W194 AromaticContact ND1-CZ3 3.16Å; H188-W194 WeakPolarHBondContact ND1-CZ3 3.29Å; H188-W194 AromaticContact NE2-CH2 2.87Å; H188-W194 WeakPolarHBondContact NE2-CH2 3.4Å; H188-W194 AromaticContact NE2-CZ2 3.33Å; H188-W194 VanDerWaalsContact NE2-CZ2 3.33Å; H188-W194 WeakPolarHBondContact NE2-CZ2 3.01Å; H188-W194 AromaticContact NE2-CZ3 3.25Å; H188-W194 VanDerWaalsContact NE2-CZ3 3.25Å; H188-W194 WeakPolarHBondContact NE2-CZ3 3.45Å; H188-W194 VanDerWaalsContact O-CE3 3.29Å; H188-V260 WeakPolarHBondContact CD2-CG1 3.42Å; H188-V260 WeakPolarHBondContact NE2-CG1 3.44Å | ||
| 189 | G | 55.6 | Low | 64.9 | Low | 4 Ų | 4 | 53.8 Ų | 53.8 | 4% | 0.041 | 30% | 0.296 | C | S | . | . | trans | 57.8 | 14.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | L169 F193 | L169-G189 WeakPolarHBondContact CB-O 3.49Å; G189-F193 WeakPolarHBondContact O-CB 3.45Å | ||
| 190 | G | 71.4 | Confident | 67.6 | Low | 29 Ų | 29 | 56.2 Ų | 56.2 | 30% | 0.299 | 30% | 0.298 | S | S | . | . | trans | 93.5 | 150.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | H188 Q192 F193 W194 | H188-G190 PolarHBondContact O-N 2.95Å; G190-Q192 VanDerWaalsContact C-N 3.33Å; G190-Q192 PolarHBondContact O-N 3.43Å; G190-F193 PolarHBondContact O-N 3.15Å; G190-W194 WeakPolarHBondContact O-CB 3.43Å; G190-W194 PolarHBondContact O-N 3.41Å | ||
| 191 | R | 73.7 | Confident | 70.5 | Confident | 50 Ų | 50 | 54.4 Ų | 54.4 | 19% | 0.189 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.9 | -38 | -175.6 | 66 | -166.9 | 142.7 | 139.1 | -1.6 | 113.6 | D175 L195 | D175-R191 IonicContact OD1-CZ 3.26Å; D175-R191 IonicContact OD1-NE 3.94Å; D175-R191 IonicContact OD1-NH2 3.75Å; D175-R191 PolarHBondContact OD1-NH2 3Å; D175-R191 IonicContact OD2-CZ 2.82Å; D175-R191 IonicContact OD2-NE 3.78Å; D175-R191 PolarHBondContact OD2-NE 2.9Å; D175-R191 IonicContact OD2-NH2 2.7Å; R191-L195 VanDerWaalsContact O-CB 3.28Å; R191-L195 WeakPolarHBondContact O-CB 3.26Å; R191-L195 PolarHBondContact O-N 3.26Å |
| 192 | Q | 78.8 | Confident | 73.2 | Confident | 101 Ų | 101 | 47.2 Ų | 47.2 | 47% | 0.472 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -73.5 | -45.8 | -177.4 | -65.5 | -61.4 | -26.6 | 0 | 0 | 111.7 | G190 W194 L195 V196 C250 | G190-Q192 VanDerWaalsContact C-N 3.33Å; G190-Q192 PolarHBondContact O-N 3.43Å; Q192-W194 VanDerWaalsContact C-N 3.32Å; Q192-W194 PolarHBondContact O-N 3.48Å; Q192-L195 PolarHBondContact O-N 3.43Å; Q192-V196 VanDerWaalsContact O-CG2 3.3Å; Q192-V196 WeakPolarHBondContact O-CG2 3.2Å; Q192-V196 PolarHBondContact O-N 3.36Å; Q192-C250 PolarHBondContact NE2-SG 3.47Å; Q192-C250 VanDerWaalsContact NE2-SG 3.4Å |
| 193 | F | 83.6 | Confident | 75.8 | Confident | 41 Ų | 41 | 46.3 Ų | 46.3 | 18% | 0.18 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.2 | -47.2 | 176.3 | 175.8 | -101.1 | 0 | 0 | 0 | 110.8 | Y162 T165 Q166 L169 G189 G190 L195 V196 S197 | Y162-F193 AromaticContact CD2-CZ 3.99Å; Y162-F193 HydrophobicContact CD2-CZ 3.99Å; Y162-F193 HydrophobicContact CE1-CE1 4.39Å; Y162-F193 AromaticContact CE2-CE1 3.89Å; Y162-F193 HydrophobicContact CE2-CE1 3.89Å; Y162-F193 AromaticContact CE2-CZ 3.53Å; Y162-F193 HydrophobicContact CE2-CZ 3.53Å; Y162-F193 AromaticContact CZ-CE1 3.7Å; Y162-F193 AromaticContact CZ-CZ 3.83Å; T165-F193 HydrophobicContact CG2-CD2 4.42Å; T165-F193 HydrophobicContact CG2-CE2 3.72Å; T165-F193 HydrophobicContact CG2-CZ 4.3Å; Q166-F193 HydrophobicContact CB-CD1 4.44Å; Q166-F193 HydrophobicContact CB-CE1 3.65Å; Q166-F193 HydrophobicContact CB-CZ 4.09Å; Q166-F193 HydrophobicContact CG-CD1 4.28Å; Q166-F193 HydrophobicContact CG-CE1 3.8Å; L169-F193 HydrophobicContact CD1-CB 3.72Å; L169-F193 HydrophobicContact CD1-CD1 4.47Å; L169-F193 HydrophobicContact CD1-CD2 3.47Å; L169-F193 VanDerWaalsContact CD1-CD2 3.47Å; L169-F193 HydrophobicContact CD1-CE2 4.2Å; L169-F193 HydrophobicContact CD1-CG 3.63Å; G189-F193 WeakPolarHBondContact O-CB 3.45Å; G190-F193 PolarHBondContact O-N 3.15Å; F193-L195 VanDerWaalsContact C-N 3.35Å; F193-L195 PolarHBondContact O-N 3.19Å; F193-V196 PolarHBondContact O-N 3.49Å; F193-S197 WeakPolarHBondContact O-CB 3.45Å; F193-S197 PolarHBondContact O-N 2.91Å; F193-S197 PolarHBondContact O-OG 2.86Å; F193-S197 VanDerWaalsContact O-OG 3.11Å |
| 194 | W | 82.3 | Confident | 78.2 | Confident | 4 Ų | 4 | 46 Ų | 46 | 2% | 0.015 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.7 | -39.1 | 179.5 | -169.7 | -63.6 | 0 | 0 | 0 | 112.2 | R122 H188 G190 Q192 S197 S198 Q242 V260 | R122-W194 VanDerWaalsContact NH2-CE3 3.33Å; H188-W194 HydrophobicContact CB-CD2 4.03Å; H188-W194 HydrophobicContact CB-CE3 3.17Å; H188-W194 HydrophobicContact CB-CH2 4.36Å; H188-W194 HydrophobicContact CB-CZ3 3.33Å; H188-W194 AromaticContact CD2-CD2 3.55Å; H188-W194 AromaticContact CD2-CE2 3.56Å; H188-W194 AromaticContact CD2-CE3 3.21Å; H188-W194 AromaticContact CD2-CH2 2.99Å; H188-W194 WeakPolarHBondContact CD2-CH2 3.3Å; H188-W194 AromaticContact CD2-CZ2 3.35Å; H188-W194 WeakPolarHBondContact CD2-CZ2 3.45Å; H188-W194 AromaticContact CD2-CZ3 2.86Å; H188-W194 WeakPolarHBondContact CD2-CZ3 3.49Å; H188-W194 AromaticContact CE1-CH2 3.27Å; H188-W194 WeakPolarHBondContact CE1-CH2 3.47Å; H188-W194 AromaticContact CE1-CZ3 3.42Å; H188-W194 VanDerWaalsContact CE1-CZ3 3.42Å; H188-W194 WeakPolarHBondContact CE1-CZ3 3.14Å; H188-W194 AromaticContact CG-CD2 3.98Å; H188-W194 AromaticContact CG-CE3 3.19Å; H188-W194 AromaticContact CG-CH2 3.45Å; H188-W194 VanDerWaalsContact CG-CH2 3.45Å; H188-W194 AromaticContact CG-CZ3 2.82Å; H188-W194 AromaticContact ND1-CH2 3.57Å; H188-W194 AromaticContact ND1-CZ3 3.16Å; H188-W194 WeakPolarHBondContact ND1-CZ3 3.29Å; H188-W194 AromaticContact NE2-CH2 2.87Å; H188-W194 WeakPolarHBondContact NE2-CH2 3.4Å; H188-W194 AromaticContact NE2-CZ2 3.33Å; H188-W194 VanDerWaalsContact NE2-CZ2 3.33Å; H188-W194 WeakPolarHBondContact NE2-CZ2 3.01Å; H188-W194 AromaticContact NE2-CZ3 3.25Å; H188-W194 VanDerWaalsContact NE2-CZ3 3.25Å; H188-W194 WeakPolarHBondContact NE2-CZ3 3.45Å; H188-W194 VanDerWaalsContact O-CE3 3.29Å; G190-W194 WeakPolarHBondContact O-CB 3.43Å; G190-W194 PolarHBondContact O-N 3.41Å; Q192-W194 VanDerWaalsContact C-N 3.32Å; Q192-W194 PolarHBondContact O-N 3.48Å; W194-S197 WeakPolarHBondContact CA-OG 3.18Å; W194-S197 PolarHBondContact O-OG 3.36Å; W194-S198 VanDerWaalsContact CD1-OG 3.3Å; W194-S198 WeakPolarHBondContact O-CB 3.46Å; W194-S198 PolarHBondContact O-N 3.29Å; W194-S198 PolarHBondContact O-OG 2.89Å; W194-Q242 VanDerWaalsContact CZ2-CD 3.43Å; W194-Q242 HydrophobicContact CZ2-CG 3.84Å; W194-Q242 VanDerWaalsContact CZ2-NE2 3.35Å; W194-V260 HydrophobicContact CH2-CG1 4.45Å; W194-V260 HydrophobicContact CZ2-CG1 3.76Å |
| 195 | L | 88.2 | Confident | 80.5 | Confident | 39 Ų | 39 | 41.6 Ų | 41.6 | 20% | 0.204 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.4 | -49.7 | 173.6 | 175.8 | 59.1 | 0 | 0 | 0 | 111.7 | R191 Q192 F193 S198 C199 G243 V247 | R191-L195 VanDerWaalsContact O-CB 3.28Å; R191-L195 WeakPolarHBondContact O-CB 3.26Å; R191-L195 PolarHBondContact O-N 3.26Å; Q192-L195 PolarHBondContact O-N 3.43Å; F193-L195 VanDerWaalsContact C-N 3.35Å; F193-L195 PolarHBondContact O-N 3.19Å; L195-S198 PolarHBondContact O-N 3.21Å; L195-C199 VanDerWaalsContact O-CB 3.32Å; L195-C199 WeakPolarHBondContact O-CB 2.96Å; L195-C199 PolarHBondContact O-N 3.49Å; L195-G243 WeakPolarHBondContact CD1-O 3.33Å; L195-V247 HydrophobicContact CD1-CG2 3.46Å; L195-V247 VanDerWaalsContact CD1-CG2 3.46Å; L195-V247 HydrophobicContact CD2-CG2 4.18Å; L195-V247 HydrophobicContact CG-CG2 4.49Å |
| 196 | V | 90.6 | Very high | 82.5 | Confident | 99 Ų | 99 | 41.5 Ų | 41.5 | 60% | 0.6 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -63.2 | -45.9 | -178.9 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | Q192 F193 C199 F200 | Q192-V196 VanDerWaalsContact O-CG2 3.3Å; Q192-V196 WeakPolarHBondContact O-CG2 3.2Å; Q192-V196 PolarHBondContact O-N 3.36Å; F193-V196 PolarHBondContact O-N 3.49Å; V196-C199 PolarHBondContact O-N 3.41Å; V196-F200 WeakPolarHBondContact O-CB 3.42Å; V196-F200 PolarHBondContact O-N 2.99Å |
| 197 | S | 91.4 | Very high | 84.5 | Confident | 9 Ų | 9 | 45.6 Ų | 45.6 | 6% | 0.063 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -66.2 | -43.3 | 179.7 | 65 | 0 | 0 | 0 | 0 | 112.2 | Y162 F193 W194 C199 F200 F201 | Y162-S197 PolarHBondContact OH-OG 2.87Å; Y162-S197 VanDerWaalsContact OH-OG 3.14Å; F193-S197 WeakPolarHBondContact O-CB 3.45Å; F193-S197 PolarHBondContact O-N 2.91Å; F193-S197 PolarHBondContact O-OG 2.86Å; F193-S197 VanDerWaalsContact O-OG 3.11Å; W194-S197 WeakPolarHBondContact CA-OG 3.18Å; W194-S197 PolarHBondContact O-OG 3.36Å; S197-C199 VanDerWaalsContact C-N 3.33Å; S197-C199 PolarHBondContact O-N 3.34Å; S197-F200 PolarHBondContact O-N 2.85Å; S197-F201 WeakPolarHBondContact O-CD2 3.48Å; S197-F201 PolarHBondContact O-N 3.27Å |
| 198 | S | 92.2 | Very high | 86.3 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.7 | -40 | 177.8 | -54.5 | 0 | 0 | 0 | 0 | 111.4 | W194 L195 F202 Q242 | W194-S198 VanDerWaalsContact CD1-OG 3.3Å; W194-S198 WeakPolarHBondContact O-CB 3.46Å; W194-S198 PolarHBondContact O-N 3.29Å; W194-S198 PolarHBondContact O-OG 2.89Å; L195-S198 PolarHBondContact O-N 3.21Å; S198-F202 WeakPolarHBondContact O-CB 3.41Å; S198-F202 PolarHBondContact O-N 3.1Å; S198-Q242 PolarHBondContact OG-NE2 3.32Å |
| 199 | C | 94.3 | Very high | 87.9 | Confident | 63 Ų | 63 | 47.1 Ų | 47.1 | 43% | 0.426 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 173.6 | -174.4 | 0 | 0 | 0 | 0 | 111.6 | L195 V196 S197 F202 L203 | L195-C199 VanDerWaalsContact O-CB 3.32Å; L195-C199 WeakPolarHBondContact O-CB 2.96Å; L195-C199 PolarHBondContact O-N 3.49Å; V196-C199 PolarHBondContact O-N 3.41Å; S197-C199 VanDerWaalsContact C-N 3.33Å; S197-C199 PolarHBondContact O-N 3.34Å; C199-F202 WeakPolarHBondContact O-CB 3.3Å; C199-F202 PolarHBondContact O-N 3.14Å; C199-L203 WeakPolarHBondContact O-CG 3.34Å; C199-L203 PolarHBondContact O-N 2.97Å |
| 200 | F | 95.3 | Very high | 89.6 | Confident | 127 Ų | 127 | 50.3 Ų | 50.3 | 56% | 0.557 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -59.2 | -50.8 | 176.8 | 175.6 | -98.6 | 0 | 0 | 0 | 112 | V196 S197 F202 L203 V204 | V196-F200 WeakPolarHBondContact O-CB 3.42Å; V196-F200 PolarHBondContact O-N 2.99Å; S197-F200 PolarHBondContact O-N 2.85Å; F200-F202 VanDerWaalsContact C-N 3.35Å; F200-F202 PolarHBondContact O-N 3.45Å; F200-L203 PolarHBondContact O-N 3.07Å; F200-V204 HydrophobicContact CD1-CG2 4.37Å; F200-V204 HydrophobicContact CE1-CG2 3.96Å; F200-V204 HydrophobicContact CE2-CG2 4.14Å; F200-V204 HydrophobicContact CZ-CG2 3.83Å; F200-V204 WeakPolarHBondContact O-CG2 3.28Å; F200-V204 PolarHBondContact O-N 3.2Å |
| 201 | F | 94.6 | Very high | 90.4 | Very high | 20 Ų | 20 | 50 Ų | 50 | 9% | 0.088 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 177.8 | -72.9 | -56 | 0 | 0 | 0 | 112.2 | L126 L130 Y162 S197 L203 V204 Y205 N239 | L126-F201 HydrophobicContact CD1-CE1 4.12Å; L126-F201 HydrophobicContact CD1-CE2 4.28Å; L126-F201 HydrophobicContact CD1-CZ 3.7Å; L126-F201 HydrophobicContact CD2-CZ 4.48Å; L130-F201 HydrophobicContact CD2-CE1 4.18Å; Y162-F201 HydrophobicContact CD2-CE2 4.42Å; Y162-F201 HydrophobicContact CD2-CZ 4.42Å; Y162-F201 AromaticContact CE2-CE2 3.89Å; Y162-F201 HydrophobicContact CE2-CE2 3.89Å; Y162-F201 HydrophobicContact CE2-CZ 4.34Å; S197-F201 WeakPolarHBondContact O-CD2 3.48Å; S197-F201 PolarHBondContact O-N 3.27Å; F201-L203 VanDerWaalsContact C-N 3.34Å; F201-L203 PolarHBondContact O-N 3Å; F201-V204 PolarHBondContact O-N 2.97Å; F201-Y205 HydrophobicContact CB-CD2 4.25Å; F201-Y205 HydrophobicContact CB-CE2 3.8Å; F201-Y205 HydrophobicContact CD1-CE2 4.3Å; F201-Y205 HydrophobicContact CG-CE2 4.36Å; F201-Y205 WeakPolarHBondContact O-CB 3.47Å; F201-Y205 WeakPolarHBondContact O-CD2 3.45Å; F201-Y205 VanDerWaalsContact O-CG 3.26Å; F201-Y205 PolarHBondContact O-N 3.39Å; F201-N239 HydrophobicContact CB-CB 4.37Å; F201-N239 WeakPolarHBondContact CB-OD1 3.46Å |
| 202 | F | 96.6 | Very high | 90.9 | Very high | 55 Ų | 55 | 49.5 Ų | 49.5 | 24% | 0.241 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -56.8 | -46.4 | 173.1 | 167.9 | -109.9 | 0 | 0 | 0 | 112.1 | S198 C199 F200 S206 A236 N239 L240 | S198-F202 WeakPolarHBondContact O-CB 3.41Å; S198-F202 PolarHBondContact O-N 3.1Å; C199-F202 WeakPolarHBondContact O-CB 3.3Å; C199-F202 PolarHBondContact O-N 3.14Å; F200-F202 VanDerWaalsContact C-N 3.35Å; F200-F202 PolarHBondContact O-N 3.45Å; F202-S206 WeakPolarHBondContact CD2-OG 3.22Å; F202-S206 WeakPolarHBondContact CE2-OG 3.4Å; F202-S206 WeakPolarHBondContact O-CB 3.36Å; F202-S206 PolarHBondContact O-N 3.34Å; F202-S206 PolarHBondContact O-OG 3.15Å; F202-A236 HydrophobicContact CD2-CB 4.22Å; F202-A236 WeakPolarHBondContact CD2-O 3.3Å; F202-N239 HydrophobicContact CB-CB 4.11Å; F202-L240 HydrophobicContact CD2-CB 3.77Å; F202-L240 HydrophobicContact CD2-CD1 4.45Å; F202-L240 HydrophobicContact CE1-CD1 4.36Å; F202-L240 HydrophobicContact CE2-CB 3.92Å; F202-L240 HydrophobicContact CE2-CD1 4.2Å; F202-L240 HydrophobicContact CE2-CD2 4.19Å; F202-L240 HydrophobicContact CE2-CG 4.33Å; F202-L240 HydrophobicContact CG-CB 4.41Å; F202-L240 HydrophobicContact CZ-CD1 4.14Å |
| 203 | L | 96.2 | Very high | 91.2 | Very high | 104 Ų | 104 | 52.9 Ų | 52.9 | 55% | 0.545 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -64.3 | -44.8 | 178.2 | -70.4 | 176 | 0 | 0 | 0 | 111.6 | C199 F200 F201 S206 L207 | C199-L203 WeakPolarHBondContact O-CG 3.34Å; C199-L203 PolarHBondContact O-N 2.97Å; F200-L203 PolarHBondContact O-N 3.07Å; F201-L203 VanDerWaalsContact C-N 3.34Å; F201-L203 PolarHBondContact O-N 3Å; L203-S206 PolarHBondContact O-N 3.38Å; L203-L207 VanDerWaalsContact O-CB 3.32Å; L203-L207 WeakPolarHBondContact O-CB 3.37Å; L203-L207 PolarHBondContact O-N 2.94Å |
| 204 | V | 94.9 | Very high | 91.3 | Very high | 53 Ų | 53 | 52.7 Ų | 52.7 | 32% | 0.321 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.7 | -48.2 | 177.8 | 171.5 | 0 | 0 | 0 | 0 | 111 | F200 F201 L207 V208 | F200-V204 HydrophobicContact CD1-CG2 4.37Å; F200-V204 HydrophobicContact CE1-CG2 3.96Å; F200-V204 HydrophobicContact CE2-CG2 4.14Å; F200-V204 HydrophobicContact CZ-CG2 3.83Å; F200-V204 WeakPolarHBondContact O-CG2 3.28Å; F200-V204 PolarHBondContact O-N 3.2Å; F201-V204 PolarHBondContact O-N 2.97Å; V204-L207 WeakPolarHBondContact O-CB 3.46Å; V204-L207 PolarHBondContact O-N 3.2Å; V204-V208 WeakPolarHBondContact O-CG2 3.24Å; V204-V208 PolarHBondContact O-N 2.97Å |
| 205 | Y | 95.1 | Very high | 91 | Very high | 1 Ų | 1 | 57.6 Ų | 57.6 | 0% | 0.004 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -71.5 | -36.5 | -179.2 | -60.2 | -35 | 0 | 0 | 0 | 113 | E129 I133 F201 L207 V208 V209 L235 N239 | E129-Y205 WeakPolarHBondContact CG-OH 3.4Å; E129-Y205 WeakPolarHBondContact OE1-CE2 3.39Å; E129-Y205 PolarHBondContact OE1-OH 3.05Å; I133-Y205 HydrophobicContact CD1-CD1 4.29Å; I133-Y205 HydrophobicContact CD1-CE1 4.27Å; I133-Y205 HydrophobicContact CG1-CD1 4.43Å; I133-Y205 HydrophobicContact CG1-CE1 3.92Å; F201-Y205 HydrophobicContact CB-CD2 4.25Å; F201-Y205 HydrophobicContact CB-CE2 3.8Å; F201-Y205 HydrophobicContact CD1-CE2 4.3Å; F201-Y205 HydrophobicContact CG-CE2 4.36Å; F201-Y205 WeakPolarHBondContact O-CB 3.47Å; F201-Y205 WeakPolarHBondContact O-CD2 3.45Å; F201-Y205 VanDerWaalsContact O-CG 3.26Å; F201-Y205 PolarHBondContact O-N 3.39Å; Y205-L207 VanDerWaalsContact C-N 3.31Å; Y205-L207 PolarHBondContact O-N 2.98Å; Y205-V208 WeakPolarHBondContact O-CB 3.46Å; Y205-V208 PolarHBondContact O-N 2.94Å; Y205-V209 WeakPolarHBondContact O-CG2 3.36Å; Y205-V209 PolarHBondContact O-N 2.95Å; Y205-L235 HydrophobicContact CD2-CB 3.68Å; Y205-L235 HydrophobicContact CE2-CB 3.92Å; Y205-L235 HydrophobicContact CE2-CD1 4.35Å; Y205-L235 HydrophobicContact CG-CB 4.18Å; Y205-N239 WeakPolarHBondContact CE2-ND2 3.36Å |
| 206 | S | 94.4 | Very high | 90.4 | Very high | 31 Ų | 31 | 60 Ų | 60 | 22% | 0.217 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.5 | -42.2 | 172.2 | -63.7 | 0 | 0 | 0 | 0 | 111.1 | F202 L203 V208 V209 V210 | F202-S206 WeakPolarHBondContact CD2-OG 3.22Å; F202-S206 WeakPolarHBondContact CE2-OG 3.4Å; F202-S206 WeakPolarHBondContact O-CB 3.36Å; F202-S206 PolarHBondContact O-N 3.34Å; F202-S206 PolarHBondContact O-OG 3.15Å; L203-S206 PolarHBondContact O-N 3.38Å; S206-V208 VanDerWaalsContact C-N 3.34Å; S206-V208 PolarHBondContact O-N 3.36Å; S206-V209 PolarHBondContact O-N 2.87Å; S206-V210 WeakPolarHBondContact O-CB 3.19Å; S206-V210 VanDerWaalsContact O-CG2 3.28Å; S206-V210 WeakPolarHBondContact O-CG2 3.12Å; S206-V210 PolarHBondContact O-N 3.22Å |
| 207 | L | 92.5 | Very high | 89.5 | Confident | 110 Ų | 110 | 61.4 Ų | 61.4 | 58% | 0.576 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -59.2 | -45.4 | 174.2 | -179.6 | 64.9 | 0 | 0 | 0 | 111 | L203 V204 Y205 V209 V210 L211 | L203-L207 VanDerWaalsContact O-CB 3.32Å; L203-L207 WeakPolarHBondContact O-CB 3.37Å; L203-L207 PolarHBondContact O-N 2.94Å; V204-L207 WeakPolarHBondContact O-CB 3.46Å; V204-L207 PolarHBondContact O-N 3.2Å; Y205-L207 VanDerWaalsContact C-N 3.31Å; Y205-L207 PolarHBondContact O-N 2.98Å; L207-V209 VanDerWaalsContact C-N 3.3Å; L207-V209 PolarHBondContact O-N 3.49Å; L207-V210 PolarHBondContact O-N 3.34Å; L207-L211 WeakPolarHBondContact O-CB 3.32Å; L207-L211 PolarHBondContact O-N 3.44Å |
| 208 | V | 91.7 | Very high | 88.4 | Confident | 9 Ų | 9 | 69 Ų | 69 | 6% | 0.055 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -58.3 | -40.1 | 176 | 169.6 | 0 | 0 | 0 | 0 | 112.2 | L137 V204 Y205 S206 L211 F228 A232 | L137-V208 HydrophobicContact CD1-CG2 4.04Å; L137-V208 HydrophobicContact CD2-CG1 4.1Å; L137-V208 HydrophobicContact CD2-CG2 4.5Å; V204-V208 WeakPolarHBondContact O-CG2 3.24Å; V204-V208 PolarHBondContact O-N 2.97Å; Y205-V208 WeakPolarHBondContact O-CB 3.46Å; Y205-V208 PolarHBondContact O-N 2.94Å; S206-V208 VanDerWaalsContact C-N 3.34Å; S206-V208 PolarHBondContact O-N 3.36Å; V208-L211 WeakPolarHBondContact O-CB 3.46Å; V208-F228 HydrophobicContact CG1-CE1 3.63Å; V208-F228 HydrophobicContact CG1-CZ 3.96Å; V208-A232 HydrophobicContact CB-CB 4.47Å; V208-A232 HydrophobicContact CG1-CB 3.84Å |
| 209 | V | 92.6 | Very high | 87.3 | Confident | 40 Ų | 40 | 79.2 Ų | 79.2 | 24% | 0.242 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -71.8 | -33 | 178.5 | 173.6 | 0 | 0 | 0 | 0 | 112.5 | Y205 S206 L207 P212 A232 | Y205-V209 WeakPolarHBondContact O-CG2 3.36Å; Y205-V209 PolarHBondContact O-N 2.95Å; S206-V209 PolarHBondContact O-N 2.87Å; L207-V209 VanDerWaalsContact C-N 3.3Å; L207-V209 PolarHBondContact O-N 3.49Å; V209-P212 WeakPolarHBondContact O-CD 3.14Å; V209-P212 WeakPolarHBondContact O-CG 3.5Å; V209-A232 HydrophobicContact CG2-CB 3.87Å |
| 210 | V | 91.4 | Very high | 86.3 | Confident | 71 Ų | 71 | 80.1 Ų | 80.1 | 43% | 0.43 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -82.5 | -27.6 | 179.5 | 175.2 | 0 | 0 | 0 | 0 | 111.9 | S206 L207 P212 K213 T214 | S206-V210 WeakPolarHBondContact O-CB 3.19Å; S206-V210 VanDerWaalsContact O-CG2 3.28Å; S206-V210 WeakPolarHBondContact O-CG2 3.12Å; S206-V210 PolarHBondContact O-N 3.22Å; L207-V210 PolarHBondContact O-N 3.34Å; V210-P212 VanDerWaalsContact C-CD 3.41Å; V210-P212 VanDerWaalsContact O-N 3.15Å; V210-K213 WeakPolarHBondContact O-CA 3.49Å; V210-K213 WeakPolarHBondContact O-CB 3.36Å; V210-K213 PolarHBondContact O-N 3.45Å; V210-T214 HydrophobicContact CG1-CG2 4.02Å |
| 211 | L | 87.2 | Confident | 85.1 | Confident | 22 Ų | 22 | 78.7 Ų | 78.7 | 12% | 0.115 | 40% | 0.404 | C | S | . | . | G | 310 helix | trans | -43.7 | -46.2 | -179.6 | -156.1 | 60.2 | 0 | 0 | 0 | 115.1 | L137 L207 V208 K213 T214 L216 L222 | L137-L211 HydrophobicContact CD2-CD2 4.36Å; L207-L211 WeakPolarHBondContact O-CB 3.32Å; L207-L211 PolarHBondContact O-N 3.44Å; V208-L211 WeakPolarHBondContact O-CB 3.46Å; L211-K213 PolarHBondContact O-N 3.45Å; L211-K213 VanDerWaalsContact O-N 3.17Å; L211-T214 PolarHBondContact O-N 3.13Å; L211-T214 PolarHBondContact O-OG1 2.64Å; L211-L216 HydrophobicContact CD1-CB 4.25Å; L211-L216 HydrophobicContact CD1-CD1 4.17Å; L211-L222 HydrophobicContact CB-CD1 4.4Å; L211-L222 HydrophobicContact CD2-CD1 4.48Å; L211-L222 HydrophobicContact CD2-CD2 3.41Å; L211-L222 VanDerWaalsContact CD2-CD2 3.41Å; L211-L222 HydrophobicContact CG-CD1 4.04Å; L211-L222 HydrophobicContact CG-CD2 3.87Å |
| 212 | P | 85 | Confident | 84.3 | Confident | 40 Ų | 40 | 79 Ų | 79 | 26% | 0.26 | 41% | 0.407 | S | S | . | . | G | 310 helix | trans | -66.6 | -16 | 178.8 | 26.7 | -37.3 | 0 | 0 | 0 | 114.7 | V209 V210 L222 Y229 | V209-P212 WeakPolarHBondContact O-CD 3.14Å; V209-P212 WeakPolarHBondContact O-CG 3.5Å; V210-P212 VanDerWaalsContact C-CD 3.41Å; V210-P212 VanDerWaalsContact O-N 3.15Å; P212-L222 HydrophobicContact CB-CD1 4.3Å; P212-Y229 HydrophobicContact CB-CE1 4.19Å; P212-Y229 HydrophobicContact CG-CD1 3.94Å; P212-Y229 HydrophobicContact CG-CE1 3.58Å |
| 213 | K | 85.4 | Confident | 83.5 | Confident | 172 Ų | 172 | 77 Ų | 77 | 75% | 0.748 | 40% | 0.399 | S | S | * | . | G | 310 helix | trans | -90.2 | -9.5 | 174.7 | -56.9 | -163.9 | -179.6 | 82.8 | 0 | 113 | V210 L211 | V210-K213 WeakPolarHBondContact O-CA 3.49Å; V210-K213 WeakPolarHBondContact O-CB 3.36Å; V210-K213 PolarHBondContact O-N 3.45Å; L211-K213 PolarHBondContact O-N 3.45Å; L211-K213 VanDerWaalsContact O-N 3.17Å |
| 214 | T | 85.4 | Confident | 82.3 | Confident | 38 Ų | 38 | 77.7 Ų | 77.7 | 23% | 0.233 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -95.3 | 154.9 | -178.4 | 67.4 | 0 | 0 | 0 | 0 | 111 | V210 L211 L216 K217 | V210-T214 HydrophobicContact CG1-CG2 4.02Å; L211-T214 PolarHBondContact O-N 3.13Å; L211-T214 PolarHBondContact O-OG1 2.64Å; T214-L216 PolarHBondContact O-N 2.96Å; T214-K217 WeakPolarHBondContact O-CB 3.25Å; T214-K217 PolarHBondContact O-N 2.96Å; T214-K217 VanDerWaalsContact O-N 3.13Å |
| 215 | P | 76.9 | Confident | 81.7 | Confident | 107 Ų | 107 | 81.4 Ų | 81.4 | 70% | 0.695 | 42% | 0.421 | S | S | * | . | G | 310 helix | trans | -63.3 | -13.5 | 177.4 | 26.9 | -36.1 | 0 | 0 | 0 | 113.2 | K217 E218 | P215-K217 PolarHBondContact O-N 3.11Å; P215-K217 VanDerWaalsContact O-N 3.16Å; P215-E218 PolarHBondContact O-N 2.95Å; P215-E218 VanDerWaalsContact O-N 3.12Å |
| 216 | L | 73.8 | Confident | 81.3 | Confident | 89 Ų | 89 | 91.7 Ų | 91.7 | 47% | 0.466 | 46% | 0.46 | S | S | . | . | G | 310 helix | trans | -62.3 | -18.4 | 173.8 | -66.4 | 170.2 | 0 | 0 | 0 | 113.2 | L211 T214 E218 R219 I220 | L211-L216 HydrophobicContact CD1-CB 4.25Å; L211-L216 HydrophobicContact CD1-CD1 4.17Å; T214-L216 PolarHBondContact O-N 2.96Å; L216-E218 PolarHBondContact O-N 3.14Å; L216-R219 PolarHBondContact O-N 2.9Å; L216-I220 PolarHBondContact O-N 3.16Å; L216-I220 VanDerWaalsContact O-N 3.11Å |
| 217 | K | 72.7 | Confident | 81 | Confident | 128 Ų | 128 | 92 Ų | 92 | 56% | 0.557 | 46% | 0.462 | S | S | * | . | G | 310 helix | trans | -54.7 | -30.8 | 171 | 175.1 | 179.7 | 173.3 | -159.8 | 0 | 112.9 | T214 P215 R219 L222 | T214-K217 WeakPolarHBondContact O-CB 3.25Å; T214-K217 PolarHBondContact O-N 2.96Å; T214-K217 VanDerWaalsContact O-N 3.13Å; P215-K217 PolarHBondContact O-N 3.11Å; P215-K217 VanDerWaalsContact O-N 3.16Å; K217-R219 VanDerWaalsContact C-N 3.33Å; K217-L222 HydrophobicContact CB-CD1 3.76Å; K217-L222 HydrophobicContact CG-CD1 3.93Å |
| 218 | E | 67.6 | Low | 80.8 | Confident | 169 Ų | 169 | 86.9 Ų | 86.9 | 79% | 0.79 | 44% | 0.435 | S | S | * | . | G | 310 helix | trans | -79 | -20.3 | -179.4 | -64.2 | 175.7 | -175.3 | 0 | 0 | 112.5 | P215 L216 | P215-E218 PolarHBondContact O-N 2.95Å; P215-E218 VanDerWaalsContact O-N 3.12Å; L216-E218 PolarHBondContact O-N 3.14Å |
| 219 | R | 70.4 | Confident | 80.8 | Confident | 215 Ų | 215 | 88.2 Ų | 88.2 | 81% | 0.811 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.9 | -23.1 | -179.2 | -66.8 | -65.7 | -136.1 | -94.6 | -0.9 | 113.2 | L216 K217 | L216-R219 PolarHBondContact O-N 2.9Å; K217-R219 VanDerWaalsContact C-N 3.33Å |
| 220 | I | 72.9 | Confident | 80.8 | Confident | 82 Ų | 82 | 90.6 Ų | 90.6 | 42% | 0.421 | 45% | 0.454 | S | S | . | . | S | Bend | trans | -124.1 | 126.4 | -176 | -58.3 | 172.6 | 0 | 0 | 0 | 108.3 | L216 L222 | L216-I220 PolarHBondContact O-N 3.16Å; L216-I220 VanDerWaalsContact O-N 3.11Å; I220-L222 VanDerWaalsContact C-N 3.33Å; I220-L222 HydrophobicContact CB-CD2 4.38Å; I220-L222 HydrophobicContact CG2-CD2 3.97Å; I220-L222 PolarHBondContact O-N 3.38Å |
| 221 | S | 69.4 | Low | 80.9 | Confident | 96 Ų | 96 | 87.3 Ų | 87.3 | 67% | 0.671 | 43% | 0.434 | S | S | * | . | trans | -64.8 | 91.7 | 172 | -62.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 222 | L | 78.1 | Confident | 81.2 | Confident | 27 Ų | 27 | 86.2 Ų | 86.2 | 14% | 0.141 | 43% | 0.428 | C | S | . | . | trans | -80.3 | 152.8 | -178.4 | -67.1 | -179.2 | 0 | 0 | 0 | 112.1 | L211 P212 K217 I220 S224 Y229 | L211-L222 HydrophobicContact CB-CD1 4.4Å; L211-L222 HydrophobicContact CD2-CD1 4.48Å; L211-L222 HydrophobicContact CD2-CD2 3.41Å; L211-L222 VanDerWaalsContact CD2-CD2 3.41Å; L211-L222 HydrophobicContact CG-CD1 4.04Å; L211-L222 HydrophobicContact CG-CD2 3.87Å; P212-L222 HydrophobicContact CB-CD1 4.3Å; K217-L222 HydrophobicContact CB-CD1 3.76Å; K217-L222 HydrophobicContact CG-CD1 3.93Å; I220-L222 VanDerWaalsContact C-N 3.33Å; I220-L222 HydrophobicContact CB-CD2 4.38Å; I220-L222 HydrophobicContact CG2-CD2 3.97Å; I220-L222 PolarHBondContact O-N 3.38Å; L222-S224 PolarHBondContact O-N 3.04Å; L222-Y229 WeakPolarHBondContact CB-OH 3.27Å | ||
| 223 | P | 79 | Confident | 81.7 | Confident | 12 Ų | 12 | 85.6 Ų | 85.6 | 8% | 0.078 | 43% | 0.428 | C | S | . | . | trans | -58.5 | 128.8 | 175.9 | -26.2 | 38.5 | 0 | 0 | 0 | 110.9 | G136 R225 F228 Y229 | G136-P223 WeakPolarHBondContact O-CG 3.33Å; P223-R225 VanDerWaalsContact C-N 3.34Å; P223-F228 HydrophobicContact CB-CB 4.21Å; P223-F228 HydrophobicContact CB-CD1 3.89Å; P223-F228 HydrophobicContact CB-CG 4.05Å; P223-F228 HydrophobicContact CG-CD1 3.74Å; P223-F228 HydrophobicContact CG-CE1 3.94Å; P223-F228 HydrophobicContact CG-CG 4.14Å; P223-Y229 WeakPolarHBondContact O-CE2 3.42Å; P223-Y229 PolarHBondContact O-OH 3.25Å | ||
| 224 | S | 71.4 | Confident | 82.2 | Confident | 119 Ų | 119 | 80.3 Ų | 80.3 | 83% | 0.832 | 41% | 0.408 | S | S | * | . | trans | -80 | -18.1 | 178.7 | 61.3 | 0 | 0 | 0 | 0 | 113 | L222 | L222-S224 PolarHBondContact O-N 3.04Š| ||
| 225 | R | 82.1 | Confident | 82.6 | Confident | 131 Ų | 131 | 78.5 Ų | 78.5 | 49% | 0.494 | 40% | 0.397 | S | S | . | . | trans | -80.6 | 122.6 | -176.9 | -66.4 | -163.8 | 179.4 | -155.8 | 1.2 | 111.5 | P223 S227 F228 | P223-R225 VanDerWaalsContact C-N 3.34Å; R225-S227 PolarHBondContact O-N 2.64Å; R225-F228 PolarHBondContact O-N 3.32Å | ||
| 226 | R | 86.6 | Confident | 83.6 | Confident | 217 Ų | 217 | 73.7 Ų | 73.7 | 82% | 0.819 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -57.1 | -30.9 | 174.3 | -66.1 | -173.4 | -177.7 | 178.9 | 1.1 | 113.1 | F228 Y229 V230 | R226-F228 PolarHBondContact O-N 3.42Å; R226-Y229 PolarHBondContact O-N 3.28Å; R226-V230 WeakPolarHBondContact O-CG2 3.16Å; R226-V230 PolarHBondContact O-N 2.82Å; R226-V230 VanDerWaalsContact O-N 3.08Å |
| 227 | S | 88.1 | Confident | 84.7 | Confident | 38 Ų | 38 | 74.1 Ų | 74.1 | 27% | 0.266 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60.8 | -30.9 | -179.9 | 59.3 | 0 | 0 | 0 | 0 | 113.5 | R225 Y231 A278 | R225-S227 PolarHBondContact O-N 2.64Å; S227-Y231 WeakPolarHBondContact O-CB 2.87Å; S227-Y231 PolarHBondContact O-N 2.92Å; S227-A278 WeakPolarHBondContact CB-O 3.33Å; S227-A278 PolarHBondContact OG-O 3.38Å |
| 228 | F | 89.8 | Confident | 85.7 | Confident | 3 Ų | 3 | 69 Ų | 69 | 1% | 0.013 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.8 | -45 | 175.3 | 174.9 | -98.3 | 0 | 0 | 0 | 111.9 | I133 L137 V208 P223 R225 R226 Y231 A232 F279 | I133-F228 HydrophobicContact CD1-CE2 4.34Å; I133-F228 HydrophobicContact CD1-CZ 4.32Å; L137-F228 HydrophobicContact CD2-CE1 3.82Å; L137-F228 HydrophobicContact CD2-CZ 3.94Å; L137-F228 HydrophobicContact CG-CE1 4.26Å; L137-F228 HydrophobicContact CG-CZ 3.84Å; V208-F228 HydrophobicContact CG1-CE1 3.63Å; V208-F228 HydrophobicContact CG1-CZ 3.96Å; P223-F228 HydrophobicContact CB-CB 4.21Å; P223-F228 HydrophobicContact CB-CD1 3.89Å; P223-F228 HydrophobicContact CB-CG 4.05Å; P223-F228 HydrophobicContact CG-CD1 3.74Å; P223-F228 HydrophobicContact CG-CE1 3.94Å; P223-F228 HydrophobicContact CG-CG 4.14Å; R225-F228 PolarHBondContact O-N 3.32Å; R226-F228 PolarHBondContact O-N 3.42Å; F228-Y231 WeakPolarHBondContact O-CB 2.86Å; F228-Y231 PolarHBondContact O-N 2.7Å; F228-A232 PolarHBondContact O-N 3.47Å; F228-F279 HydrophobicContact CB-CE1 4.21Å; F228-F279 AromaticContact CD2-CE1 3.77Å; F228-F279 HydrophobicContact CD2-CE1 3.77Å; F228-F279 AromaticContact CD2-CZ 3.69Å; F228-F279 HydrophobicContact CD2-CZ 3.69Å; F228-F279 HydrophobicContact CE2-CZ 4.45Å; F228-F279 HydrophobicContact CG-CE1 4.49Å |
| 229 | Y | 91.1 | Very high | 87 | Confident | 36 Ų | 36 | 61.6 Ų | 61.6 | 14% | 0.141 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -72.5 | -31.8 | 179.1 | -57.4 | -76.6 | 0 | 0 | 0 | 112.6 | P212 L222 P223 R226 A232 G233 | P212-Y229 HydrophobicContact CB-CE1 4.19Å; P212-Y229 HydrophobicContact CG-CD1 3.94Å; P212-Y229 HydrophobicContact CG-CE1 3.58Å; L222-Y229 WeakPolarHBondContact CB-OH 3.27Å; P223-Y229 WeakPolarHBondContact O-CE2 3.42Å; P223-Y229 PolarHBondContact O-OH 3.25Å; R226-Y229 PolarHBondContact O-N 3.28Å; Y229-A232 PolarHBondContact O-N 3.24Å; Y229-G233 PolarHBondContact O-N 3.2Å |
| 230 | V | 92.8 | Very high | 88.2 | Confident | 90 Ų | 90 | 54.4 Ų | 54.4 | 55% | 0.545 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -64.2 | -43.3 | 171.4 | 174.8 | 0 | 0 | 0 | 0 | 110.2 | R226 G233 I234 | R226-V230 WeakPolarHBondContact O-CG2 3.16Å; R226-V230 PolarHBondContact O-N 2.82Å; R226-V230 VanDerWaalsContact O-N 3.08Å; V230-G233 PolarHBondContact O-N 2.95Å; V230-I234 HydrophobicContact CG1-CD1 3.94Å; V230-I234 WeakPolarHBondContact O-CG1 2.99Å; V230-I234 PolarHBondContact O-N 3.38Å |
| 231 | Y | 93 | Very high | 89.3 | Confident | 2 Ų | 2 | 53.7 Ų | 53.7 | 1% | 0.008 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.3 | -52.8 | 173.3 | 168 | -101.2 | 0 | 0 | 0 | 111.9 | V132 I133 S227 F228 G233 I234 L235 F271 L274 I275 F279 | V132-Y231 HydrophobicContact CB-CE1 4.5Å; V132-Y231 HydrophobicContact CG1-CD1 4.46Å; V132-Y231 HydrophobicContact CG1-CE1 3.74Å; I133-Y231 HydrophobicContact CD1-CD1 3.95Å; I133-Y231 HydrophobicContact CD1-CE1 3.6Å; I133-Y231 HydrophobicContact CG1-CE1 4.07Å; S227-Y231 WeakPolarHBondContact O-CB 2.87Å; S227-Y231 PolarHBondContact O-N 2.92Å; F228-Y231 WeakPolarHBondContact O-CB 2.86Å; F228-Y231 PolarHBondContact O-N 2.7Å; Y231-G233 VanDerWaalsContact C-N 3.28Å; Y231-G233 PolarHBondContact O-N 3.18Å; Y231-I234 PolarHBondContact O-N 2.88Å; Y231-L235 HydrophobicContact CD1-CD1 4.26Å; Y231-L235 HydrophobicContact CE1-CD1 3.58Å; Y231-L235 HydrophobicContact CE2-CD1 4.11Å; Y231-L235 HydrophobicContact CE2-CG 4.37Å; Y231-L235 VanDerWaalsContact CZ-CD1 3.5Å; Y231-L235 PolarHBondContact O-N 2.78Å; Y231-F271 HydrophobicContact CE2-CE2 4.44Å; Y231-F271 WeakPolarHBondContact OH-CE2 3.44Å; Y231-L274 HydrophobicContact CD2-CD2 3.61Å; Y231-L274 HydrophobicContact CD2-CG 3.79Å; Y231-L274 HydrophobicContact CE2-CD2 3.91Å; Y231-L274 HydrophobicContact CE2-CG 4.28Å; Y231-I275 HydrophobicContact CE2-CG1 3.8Å; Y231-F279 HydrophobicContact CD1-CE2 4.1Å; Y231-F279 HydrophobicContact CD1-CZ 4.1Å; Y231-F279 HydrophobicContact CD2-CE2 4.35Å; Y231-F279 HydrophobicContact CE1-CE2 4.42Å; Y231-F279 HydrophobicContact CG-CE2 4.06Å; Y231-F279 HydrophobicContact CG-CZ 4.31Å |
| 232 | A | 93.9 | Very high | 90.3 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.3 | -36.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | I133 V208 V209 F228 Y229 L235 A236 | I133-A232 HydrophobicContact CD1-CB 4.21Å; V208-A232 HydrophobicContact CB-CB 4.47Å; V208-A232 HydrophobicContact CG1-CB 3.84Å; V209-A232 HydrophobicContact CG2-CB 3.87Å; F228-A232 PolarHBondContact O-N 3.47Å; Y229-A232 PolarHBondContact O-N 3.24Å; A232-L235 PolarHBondContact O-N 2.94Å; A232-A236 WeakPolarHBondContact O-CB 3.3Å; A232-A236 PolarHBondContact O-N 2.88Å |
| 233 | G | 94.9 | Very high | 91 | Very high | 26 Ų | 26 | 48.9 Ų | 48.9 | 27% | 0.268 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -66.5 | -37.9 | 176 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y229 V230 Y231 A236 L237 | Y229-G233 PolarHBondContact O-N 3.2Å; V230-G233 PolarHBondContact O-N 2.95Å; Y231-G233 VanDerWaalsContact C-N 3.28Å; Y231-G233 PolarHBondContact O-N 3.18Å; G233-A236 PolarHBondContact O-N 3.22Å; G233-L237 WeakPolarHBondContact O-CB 3.45Å; G233-L237 PolarHBondContact O-N 3.4Å |
| 234 | I | 95.8 | Very high | 91.6 | Very high | 61 Ų | 61 | 52.6 Ų | 52.6 | 31% | 0.313 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 174.1 | -69.4 | 163.8 | 0 | 0 | 0 | 110.3 | V230 Y231 L237 L238 L274 | V230-I234 HydrophobicContact CG1-CD1 3.94Å; V230-I234 WeakPolarHBondContact O-CG1 2.99Å; V230-I234 PolarHBondContact O-N 3.38Å; Y231-I234 PolarHBondContact O-N 2.88Å; I234-L237 PolarHBondContact O-N 2.99Å; I234-L238 HydrophobicContact CG2-CD1 4.23Å; I234-L238 WeakPolarHBondContact O-CG 3.35Å; I234-L238 PolarHBondContact O-N 2.8Å; I234-L274 HydrophobicContact CB-CD2 4.22Å; I234-L274 HydrophobicContact CD1-CD1 3.56Å; I234-L274 HydrophobicContact CG2-CD2 3.79Å |
| 235 | L | 94.8 | Very high | 92.4 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63 | -40.7 | 174.4 | -69.1 | -179.8 | 0 | 0 | 0 | 112.3 | E129 I133 Y205 Y231 A232 L238 N239 Y267 F271 | E129-L235 HydrophobicContact CG-CD1 3.79Å; I133-L235 HydrophobicContact CD1-CD1 4.28Å; I133-L235 HydrophobicContact CG1-CD1 4.45Å; Y205-L235 HydrophobicContact CD2-CB 3.68Å; Y205-L235 HydrophobicContact CE2-CB 3.92Å; Y205-L235 HydrophobicContact CE2-CD1 4.35Å; Y205-L235 HydrophobicContact CG-CB 4.18Å; Y231-L235 HydrophobicContact CD1-CD1 4.26Å; Y231-L235 HydrophobicContact CE1-CD1 3.58Å; Y231-L235 HydrophobicContact CE2-CD1 4.11Å; Y231-L235 HydrophobicContact CE2-CG 4.37Å; Y231-L235 VanDerWaalsContact CZ-CD1 3.5Å; Y231-L235 PolarHBondContact O-N 2.78Å; A232-L235 PolarHBondContact O-N 2.94Å; L235-L238 PolarHBondContact O-N 3.36Å; L235-N239 WeakPolarHBondContact O-CB 3.45Å; L235-N239 PolarHBondContact O-N 3.25Å; L235-N239 PolarHBondContact O-ND2 3.41Å; L235-Y267 HydrophobicContact CD2-CE2 4.47Å; L235-F271 HydrophobicContact CD2-CD2 4.31Å; L235-F271 HydrophobicContact CD2-CE2 4.32Å |
| 236 | A | 96.6 | Very high | 92.6 | Very high | 7 Ų | 7 | 40.9 Ų | 40.9 | 6% | 0.058 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.1 | -46.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | F202 A232 G233 L238 N239 L240 | F202-A236 HydrophobicContact CD2-CB 4.22Å; F202-A236 WeakPolarHBondContact CD2-O 3.3Å; A232-A236 WeakPolarHBondContact O-CB 3.3Å; A232-A236 PolarHBondContact O-N 2.88Å; G233-A236 PolarHBondContact O-N 3.22Å; A236-L238 PolarHBondContact O-N 3.38Å; A236-N239 PolarHBondContact O-N 2.68Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 2.97Å |
| 237 | L | 96.8 | Very high | 92.7 | Very high | 97 Ų | 97 | 33.4 Ų | 33.4 | 51% | 0.508 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -62.8 | -43.4 | 178.5 | -179.3 | 62.9 | 0 | 0 | 0 | 112.3 | G233 I234 L240 L241 | G233-L237 WeakPolarHBondContact O-CB 3.45Å; G233-L237 PolarHBondContact O-N 3.4Å; I234-L237 PolarHBondContact O-N 2.99Å; L237-L240 PolarHBondContact O-N 2.96Å; L237-L241 HydrophobicContact CD1-CD1 4.41Å; L237-L241 HydrophobicContact CD1-CG 4.29Å; L237-L241 HydrophobicContact CG-CD1 4.25Å; L237-L241 WeakPolarHBondContact O-CG 3.4Å; L237-L241 PolarHBondContact O-N 3.11Å |
| 238 | L | 94.9 | Very high | 92.7 | Very high | 22 Ų | 22 | 34.5 Ų | 34.5 | 12% | 0.115 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.7 | -47.8 | 175.9 | -75.9 | 173.7 | 0 | 0 | 0 | 110.9 | I234 L235 A236 L240 L241 Q242 L266 | I234-L238 HydrophobicContact CG2-CD1 4.23Å; I234-L238 WeakPolarHBondContact O-CG 3.35Å; I234-L238 PolarHBondContact O-N 2.8Å; L235-L238 PolarHBondContact O-N 3.36Å; A236-L238 PolarHBondContact O-N 3.38Å; L238-L240 VanDerWaalsContact C-N 3.32Å; L238-L240 PolarHBondContact O-N 2.96Å; L238-L241 PolarHBondContact O-N 3.19Å; L238-Q242 WeakPolarHBondContact O-CB 3.2Å; L238-Q242 PolarHBondContact O-N 2.94Å; L238-L266 HydrophobicContact CD2-CB 3.95Å; L238-L266 HydrophobicContact CD2-CD1 3.99Å |
| 239 | N | 95.3 | Very high | 92.3 | Very high | 13 Ų | 13 | 35.6 Ų | 35.6 | 7% | 0.07 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.4 | -31.2 | 177.9 | -79 | -80.1 | 0 | 0 | 0 | 113 | F201 F202 Y205 L235 A236 G243 | F201-N239 HydrophobicContact CB-CB 4.37Å; F201-N239 WeakPolarHBondContact CB-OD1 3.46Å; F202-N239 HydrophobicContact CB-CB 4.11Å; Y205-N239 WeakPolarHBondContact CE2-ND2 3.36Å; L235-N239 WeakPolarHBondContact O-CB 3.45Å; L235-N239 PolarHBondContact O-N 3.25Å; L235-N239 PolarHBondContact O-ND2 3.41Å; A236-N239 PolarHBondContact O-N 2.68Å; N239-G243 PolarHBondContact O-N 2.89Å |
| 240 | L | 95.8 | Very high | 91.8 | Very high | 64 Ų | 64 | 35.5 Ų | 35.5 | 34% | 0.335 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -66.6 | -51.9 | 173.1 | 177.7 | 64.3 | 0 | 0 | 0 | 111.4 | F202 A236 L237 L238 Q242 G243 L244 | F202-L240 HydrophobicContact CD2-CB 3.77Å; F202-L240 HydrophobicContact CD2-CD1 4.45Å; F202-L240 HydrophobicContact CE1-CD1 4.36Å; F202-L240 HydrophobicContact CE2-CB 3.92Å; F202-L240 HydrophobicContact CE2-CD1 4.2Å; F202-L240 HydrophobicContact CE2-CD2 4.19Å; F202-L240 HydrophobicContact CE2-CG 4.33Å; F202-L240 HydrophobicContact CG-CB 4.41Å; F202-L240 HydrophobicContact CZ-CD1 4.14Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 2.97Å; L237-L240 PolarHBondContact O-N 2.96Å; L238-L240 VanDerWaalsContact C-N 3.32Å; L238-L240 PolarHBondContact O-N 2.96Å; L240-Q242 VanDerWaalsContact C-N 3.27Å; L240-Q242 PolarHBondContact O-N 2.93Å; L240-G243 PolarHBondContact O-N 3.26Å; L240-L244 HydrophobicContact CD1-CD1 4.44Å; L240-L244 HydrophobicContact CD1-CG 4.43Å; L240-L244 HydrophobicContact CG-CD1 4.2Å; L240-L244 VanDerWaalsContact O-CG 3.31Å; L240-L244 WeakPolarHBondContact O-CG 3.27Å; L240-L244 PolarHBondContact O-N 3.4Å |
| 241 | L | 94.7 | Very high | 91.4 | Very high | 66 Ų | 66 | 36.6 Ų | 36.6 | 35% | 0.346 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -59.9 | -42.8 | 178.2 | -70.1 | 175.3 | 0 | 0 | 0 | 110.8 | L237 L238 L244 G245 C259 T263 | L237-L241 HydrophobicContact CD1-CD1 4.41Å; L237-L241 HydrophobicContact CD1-CG 4.29Å; L237-L241 HydrophobicContact CG-CD1 4.25Å; L237-L241 WeakPolarHBondContact O-CG 3.4Å; L237-L241 PolarHBondContact O-N 3.11Å; L238-L241 PolarHBondContact O-N 3.19Å; L241-L244 PolarHBondContact O-N 3.44Å; L241-G245 PolarHBondContact O-N 3.35Å; L241-C259 PolarHBondContact O-SG 3.46Å; L241-T263 HydrophobicContact CB-CG2 3.6Å; L241-T263 HydrophobicContact CD1-CG2 4.49Å |
| 242 | Q | 91.8 | Very high | 90.6 | Very high | 15 Ų | 15 | 42.3 Ų | 42.3 | 7% | 0.07 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61.6 | -45.3 | 176.4 | -178.5 | 176 | -47.9 | 0 | 0 | 111.5 | W194 S198 L238 L240 G245 S246 T263 | W194-Q242 VanDerWaalsContact CZ2-CD 3.43Å; W194-Q242 HydrophobicContact CZ2-CG 3.84Å; W194-Q242 VanDerWaalsContact CZ2-NE2 3.35Å; S198-Q242 PolarHBondContact OG-NE2 3.32Å; L238-Q242 WeakPolarHBondContact O-CB 3.2Å; L238-Q242 PolarHBondContact O-N 2.94Å; L240-Q242 VanDerWaalsContact C-N 3.27Å; L240-Q242 PolarHBondContact O-N 2.93Å; Q242-G245 PolarHBondContact O-N 2.9Å; Q242-S246 PolarHBondContact O-N 2.91Å; Q242-S246 PolarHBondContact O-OG 3.33Å; Q242-S246 VanDerWaalsContact O-OG 3.11Å; Q242-T263 HydrophobicContact CB-CG2 4.32Å |
| 243 | G | 90.9 | Very high | 89.9 | Confident | 8 Ų | 8 | 45.8 Ų | 45.8 | 8% | 0.082 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.5 | -42.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L195 N239 L240 G245 S246 V247 | L195-G243 WeakPolarHBondContact CD1-O 3.33Å; N239-G243 PolarHBondContact O-N 2.89Å; L240-G243 PolarHBondContact O-N 3.26Å; G243-G245 PolarHBondContact O-N 2.99Å; G243-S246 PolarHBondContact O-N 2.99Å; G243-V247 WeakPolarHBondContact O-CG2 3.29Å; G243-V247 PolarHBondContact O-N 2.9Å |
| 244 | L | 92.4 | Very high | 89 | Confident | 90 Ų | 90 | 47.8 Ų | 47.8 | 47% | 0.471 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.1 | -43 | 174.5 | -71.1 | 171.1 | 0 | 0 | 0 | 111.6 | L240 L241 S246 V247 L248 | L240-L244 HydrophobicContact CD1-CD1 4.44Å; L240-L244 HydrophobicContact CD1-CG 4.43Å; L240-L244 HydrophobicContact CG-CD1 4.2Å; L240-L244 VanDerWaalsContact O-CG 3.31Å; L240-L244 WeakPolarHBondContact O-CG 3.27Å; L240-L244 PolarHBondContact O-N 3.4Å; L241-L244 PolarHBondContact O-N 3.44Å; L244-S246 VanDerWaalsContact C-N 3.33Å; L244-S246 PolarHBondContact O-N 2.86Å; L244-V247 PolarHBondContact O-N 3.38Å; L244-L248 WeakPolarHBondContact O-CG 3.4Å; L244-L248 PolarHBondContact O-N 2.85Å |
| 245 | G | 88.5 | Confident | 88.2 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.1 | -42.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L241 Q242 G243 L248 L249 | L241-G245 PolarHBondContact O-N 3.35Å; Q242-G245 PolarHBondContact O-N 2.9Å; G243-G245 PolarHBondContact O-N 2.99Å; G245-L248 PolarHBondContact O-N 3.4Å; G245-L249 WeakPolarHBondContact O-CG 3.28Å; G245-L249 PolarHBondContact O-N 3.29Å |
| 246 | S | 86.4 | Confident | 87.5 | Confident | 3 Ų | 3 | 49.8 Ų | 49.8 | 2% | 0.021 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -67.4 | -35.4 | 174.4 | -55.1 | 0 | 0 | 0 | 0 | 113.6 | Q242 G243 L244 L249 C250 | Q242-S246 PolarHBondContact O-N 2.91Å; Q242-S246 PolarHBondContact O-OG 3.33Å; Q242-S246 VanDerWaalsContact O-OG 3.11Å; G243-S246 PolarHBondContact O-N 2.99Å; L244-S246 VanDerWaalsContact C-N 3.33Å; L244-S246 PolarHBondContact O-N 2.86Å; S246-L249 PolarHBondContact O-N 3.33Å; S246-C250 PolarHBondContact O-N 3.12Å; S246-C250 PolarHBondContact O-SG 3.05Å |
| 247 | V | 89.1 | Confident | 86.7 | Confident | 60 Ų | 60 | 49.7 Ų | 49.7 | 36% | 0.364 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -62.3 | -45.6 | 172.3 | 172.6 | 0 | 0 | 0 | 0 | 110.5 | L195 G243 L244 L249 C250 L251 | L195-V247 HydrophobicContact CD1-CG2 3.46Å; L195-V247 VanDerWaalsContact CD1-CG2 3.46Å; L195-V247 HydrophobicContact CD2-CG2 4.18Å; L195-V247 HydrophobicContact CG-CG2 4.49Å; G243-V247 WeakPolarHBondContact O-CG2 3.29Å; G243-V247 PolarHBondContact O-N 2.9Å; L244-V247 PolarHBondContact O-N 3.38Å; V247-L249 VanDerWaalsContact C-N 3.28Å; V247-L249 PolarHBondContact O-N 3.39Å; V247-C250 CarbonylContact O-C 3.51Å; V247-C250 WeakPolarHBondContact O-CA 3.32Å; V247-C250 WeakPolarHBondContact O-CB 3.3Å; V247-C250 PolarHBondContact O-N 3.49Å; V247-L251 HydrophobicContact CG1-CD1 4.2Å; V247-L251 WeakPolarHBondContact O-CG 3.33Å; V247-L251 PolarHBondContact O-N 2.88Å |
| 248 | L | 87.4 | Confident | 86.1 | Confident | 61 Ų | 61 | 46.5 Ų | 46.5 | 32% | 0.319 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -58.7 | -41.7 | 176.7 | -70 | 172.7 | 0 | 0 | 0 | 111.5 | L244 G245 C250 L251 D252 I253 | L244-L248 WeakPolarHBondContact O-CG 3.4Å; L244-L248 PolarHBondContact O-N 2.85Å; G245-L248 PolarHBondContact O-N 3.4Å; L248-C250 VanDerWaalsContact C-N 3.31Å; L248-C250 PolarHBondContact O-N 3.31Å; L248-L251 CarbonylContact O-C 3.58Å; L248-L251 PolarHBondContact O-N 2.97Å; L248-L251 VanDerWaalsContact O-N 3.1Å; L248-D252 PolarHBondContact O-N 2.98Å; L248-I253 HydrophobicContact CB-CB 4.31Å; L248-I253 HydrophobicContact CD2-CB 4.49Å; L248-I253 HydrophobicContact CD2-CD1 3.83Å; L248-I253 WeakPolarHBondContact O-CB 3.36Å; L248-I253 PolarHBondContact O-N 3.46Å |
| 249 | L | 80.7 | Confident | 85.7 | Confident | 27 Ų | 27 | 47.2 Ų | 47.2 | 14% | 0.141 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.2 | -30.1 | 173.7 | -69 | 175 | 0 | 0 | 0 | 113 | G245 S246 V247 L251 D252 L257 V260 | G245-L249 WeakPolarHBondContact O-CG 3.28Å; G245-L249 PolarHBondContact O-N 3.29Å; S246-L249 PolarHBondContact O-N 3.33Å; V247-L249 VanDerWaalsContact C-N 3.28Å; V247-L249 PolarHBondContact O-N 3.39Å; L249-L251 VanDerWaalsContact C-N 3.25Å; L249-L251 PolarHBondContact O-N 3.06Å; L249-D252 PolarHBondContact O-N 3.44Å; L249-L257 HydrophobicContact CD2-CB 4.26Å; L249-V260 HydrophobicContact CD1-CG2 4.19Å |
| 250 | C | 80.6 | Confident | 85.3 | Confident | 33 Ų | 33 | 46.7 Ų | 46.7 | 22% | 0.223 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -72.7 | -19.3 | 172.5 | -66 | 0 | 0 | 0 | 0 | 113.1 | Q192 S246 V247 L248 | Q192-C250 PolarHBondContact NE2-SG 3.47Å; Q192-C250 VanDerWaalsContact NE2-SG 3.4Å; S246-C250 PolarHBondContact O-N 3.12Å; S246-C250 PolarHBondContact O-SG 3.05Å; V247-C250 CarbonylContact O-C 3.51Å; V247-C250 WeakPolarHBondContact O-CA 3.32Å; V247-C250 WeakPolarHBondContact O-CB 3.3Å; V247-C250 PolarHBondContact O-N 3.49Å; L248-C250 VanDerWaalsContact C-N 3.31Å; L248-C250 PolarHBondContact O-N 3.31Å |
| 251 | L | 84.1 | Confident | 84.7 | Confident | 113 Ų | 113 | 44.1 Ų | 44.1 | 59% | 0.592 | 24% | 0.239 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -96.2 | 13.6 | 174.9 | -62.9 | 174.8 | 0 | 0 | 0 | 112.6 | V247 L248 L249 I253 | V247-L251 HydrophobicContact CG1-CD1 4.2Å; V247-L251 WeakPolarHBondContact O-CG 3.33Å; V247-L251 PolarHBondContact O-N 2.88Å; L248-L251 CarbonylContact O-C 3.58Å; L248-L251 PolarHBondContact O-N 2.97Å; L248-L251 VanDerWaalsContact O-N 3.1Å; L249-L251 VanDerWaalsContact C-N 3.25Å; L249-L251 PolarHBondContact O-N 3.06Å; L251-I253 HydrophobicContact CB-CD1 4.23Å; L251-I253 HydrophobicContact CB-CG1 4.33Å; L251-I253 PolarHBondContact O-N 2.85Å |
| 252 | D | 76.7 | Confident | 84.4 | Confident | 123 Ų | 123 | 43.3 Ų | 43.3 | 66% | 0.658 | 24% | 0.243 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 59.5 | 26.3 | -177.6 | -58.5 | -47.5 | 0 | 0 | 0 | 114.5 | L248 L249 | L248-D252 PolarHBondContact O-N 2.98Å; L249-D252 PolarHBondContact O-N 3.44Å |
| 253 | I | 80.6 | Confident | 84.4 | Confident | 73 Ų | 73 | 42.8 Ų | 42.8 | 37% | 0.374 | 24% | 0.241 | S | C | . | . | trans | -93.6 | 108.8 | 175.1 | -58.5 | 171.3 | 0 | 0 | 0 | 109.3 | L248 L251 E255 G256 | L248-I253 HydrophobicContact CB-CB 4.31Å; L248-I253 HydrophobicContact CD2-CB 4.49Å; L248-I253 HydrophobicContact CD2-CD1 3.83Å; L248-I253 WeakPolarHBondContact O-CB 3.36Å; L248-I253 PolarHBondContact O-N 3.46Å; L251-I253 HydrophobicContact CB-CD1 4.23Å; L251-I253 HydrophobicContact CB-CG1 4.33Å; L251-I253 PolarHBondContact O-N 2.85Å; I253-E255 HydrophobicContact CG2-CB 4.08Å; I253-E255 HydrophobicContact CG2-CG 4.47Å; I253-E255 PolarHBondContact O-N 2.78Å; I253-G256 PolarHBondContact O-N 3.39Å | ||
| 254 | I | 75.1 | Confident | 84.3 | Confident | 67 Ų | 67 | 42.6 Ų | 42.6 | 34% | 0.344 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -27.8 | -174.9 | -57.4 | 170 | 0 | 0 | 0 | 112.8 | I24 H28 G256 L257 | I24-I254 HydrophobicContact CD1-CD1 4.15Å; H28-I254 HydrophobicContact CB-CG2 4.05Å; H28-I254 WeakPolarHBondContact CD2-CG2 3.2Å; I254-G256 PolarHBondContact O-N 3.19Å; I254-L257 VanDerWaalsContact O-CB 3.22Å; I254-L257 WeakPolarHBondContact O-CB 3.33Å; I254-L257 PolarHBondContact O-N 2.88Å |
| 255 | E | 79.6 | Confident | 84.2 | Confident | 103 Ų | 103 | 40.3 Ų | 40.3 | 48% | 0.481 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -59.2 | -20.6 | 175.7 | -60.9 | -59.8 | 153.1 | 0 | 0 | 113.3 | H28 I253 L257 C258 | H28-E255 IonicContact CE1-OE1 2.93Å; H28-E255 PolarHBondContact CE1-OE1 3.35Å; H28-E255 IonicContact ND1-OE1 3.71Å; H28-E255 PolarHBondContact ND1-OE1 2.95Å; I253-E255 HydrophobicContact CG2-CB 4.08Å; I253-E255 HydrophobicContact CG2-CG 4.47Å; I253-E255 PolarHBondContact O-N 2.78Å; E255-L257 PolarHBondContact O-N 2.86Å; E255-C258 WeakPolarHBondContact O-CB 3.47Å; E255-C258 PolarHBondContact O-N 3.24Å |
| 256 | G | 80.6 | Confident | 84.4 | Confident | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -57.9 | -30.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113 | I253 I254 C259 V260 | I253-G256 PolarHBondContact O-N 3.39Å; I254-G256 PolarHBondContact O-N 3.19Å; G256-C259 WeakPolarHBondContact O-CB 3.28Å; G256-C259 PolarHBondContact O-N 2.9Å; G256-V260 WeakPolarHBondContact O-CG2 3.36Å; G256-V260 PolarHBondContact O-N 3.44Å; G256-V260 VanDerWaalsContact O-N 3.09Å |
| 257 | L | 79.1 | Confident | 84.6 | Confident | 6 Ų | 6 | 44.7 Ų | 44.7 | 3% | 0.031 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.4 | -46.8 | 178 | -173.8 | 63.1 | 0 | 0 | 0 | 111.4 | L31 I185 L249 I254 E255 C259 V260 D261 | L31-L257 HydrophobicContact CB-CD2 4.37Å; L31-L257 HydrophobicContact CD1-CD2 3.74Å; I185-L257 HydrophobicContact CD1-CD1 3.73Å; I185-L257 HydrophobicContact CG1-CD1 4.03Å; I185-L257 HydrophobicContact CG2-CD1 4.27Å; L249-L257 HydrophobicContact CD2-CB 4.26Å; I254-L257 VanDerWaalsContact O-CB 3.22Å; I254-L257 WeakPolarHBondContact O-CB 3.33Å; I254-L257 PolarHBondContact O-N 2.88Å; E255-L257 PolarHBondContact O-N 2.86Å; L257-C259 PolarHBondContact O-N 2.68Å; L257-V260 PolarHBondContact O-N 3.39Å; L257-D261 WeakPolarHBondContact O-CB 3.22Å; L257-D261 VanDerWaalsContact O-CG 3.31Å; L257-D261 PolarHBondContact O-N 3.3Å |
| 258 | C | 84 | Confident | 84.6 | Confident | 29 Ų | 29 | 42.5 Ų | 42.5 | 20% | 0.196 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -56.9 | -40.4 | 177 | -60.6 | 0 | 0 | 0 | 0 | 112.3 | C30 E255 A262 | C30-C258 HydrophobicContact CB-CB 3.88Å; C30-C258 WeakPolarHBondContact CB-SG 3.28Å; C30-C258 VanDerWaalsContact SG-CA 3.6Å; C30-C258 WeakPolarHBondContact SG-CB 3.37Å; C30-C258 CovalentContact SG-SG 2.01Å; C30-C258 PolarHBondContact SG-SG 2.69Å; E255-C258 WeakPolarHBondContact O-CB 3.47Å; E255-C258 PolarHBondContact O-N 3.24Å; C258-A262 WeakPolarHBondContact O-CB 3.35Å; C258-A262 PolarHBondContact O-N 3.16Å |
| 259 | C | 87.3 | Confident | 84.8 | Confident | 37 Ų | 37 | 39.6 Ų | 39.6 | 25% | 0.25 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.7 | -47.8 | 179.6 | -171.9 | 0 | 0 | 0 | 0 | 110.8 | L241 G256 L257 A262 T263 | L241-C259 PolarHBondContact O-SG 3.46Å; G256-C259 WeakPolarHBondContact O-CB 3.28Å; G256-C259 PolarHBondContact O-N 2.9Å; L257-C259 PolarHBondContact O-N 2.68Å; C259-A262 PolarHBondContact O-N 2.89Å; C259-T263 WeakPolarHBondContact O-CG2 3.43Å; C259-T263 PolarHBondContact O-N 3.24Å; C259-T263 PolarHBondContact O-OG1 3.18Å |
| 260 | V | 85.4 | Confident | 85.3 | Confident | 2 Ų | 2 | 43.1 Ų | 43.1 | 1% | 0.012 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64 | -46.1 | 178.9 | 175.7 | 0 | 0 | 0 | 0 | 111.1 | H188 W194 L249 G256 L257 A262 T263 T264 | H188-V260 WeakPolarHBondContact CD2-CG1 3.42Å; H188-V260 WeakPolarHBondContact NE2-CG1 3.44Å; W194-V260 HydrophobicContact CH2-CG1 4.45Å; W194-V260 HydrophobicContact CZ2-CG1 3.76Å; L249-V260 HydrophobicContact CD1-CG2 4.19Å; G256-V260 WeakPolarHBondContact O-CG2 3.36Å; G256-V260 PolarHBondContact O-N 3.44Å; G256-V260 VanDerWaalsContact O-N 3.09Å; L257-V260 PolarHBondContact O-N 3.39Å; V260-A262 PolarHBondContact O-N 2.91Å; V260-T263 WeakPolarHBondContact CA-OG1 3.3Å; V260-T263 PolarHBondContact O-N 3.33Å; V260-T263 PolarHBondContact O-OG1 3.1Å; V260-T264 WeakPolarHBondContact O-CB 3.32Å; V260-T264 PolarHBondContact O-N 3.01Å; V260-T264 PolarHBondContact O-OG1 3.33Å |
| 261 | D | 84.6 | Confident | 85.9 | Confident | 10 Ų | 10 | 41.8 Ų | 41.8 | 5% | 0.053 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.2 | -45.5 | 177 | -70.8 | -19.6 | 0 | 0 | 0 | 111.2 | W46 L257 T263 T264 F265 | W46-D261 HydrophobicContact CH2-CB 4.08Å; W46-D261 WeakPolarHBondContact CH2-O 3.39Å; L257-D261 WeakPolarHBondContact O-CB 3.22Å; L257-D261 VanDerWaalsContact O-CG 3.31Å; L257-D261 PolarHBondContact O-N 3.3Å; D261-T263 PolarHBondContact O-N 3.38Å; D261-T264 WeakPolarHBondContact O-CB 3.37Å; D261-T264 PolarHBondContact O-N 2.99Å; D261-F265 WeakPolarHBondContact O-CB 3.13Å; D261-F265 PolarHBondContact O-N 2.65Å |
| 262 | A | 88.4 | Confident | 86.2 | Confident | 50 Ų | 50 | 36.5 Ų | 36.5 | 41% | 0.413 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -60.6 | -43.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | C258 C259 V260 F265 L266 | C258-A262 WeakPolarHBondContact O-CB 3.35Å; C258-A262 PolarHBondContact O-N 3.16Å; C259-A262 PolarHBondContact O-N 2.89Å; V260-A262 PolarHBondContact O-N 2.91Å; A262-F265 PolarHBondContact O-N 3.46Å; A262-L266 WeakPolarHBondContact O-CB 3.37Å; A262-L266 VanDerWaalsContact O-CG 3.27Å; A262-L266 WeakPolarHBondContact O-CG 3.38Å; A262-L266 PolarHBondContact O-N 2.92Å |
| 263 | T | 91.3 | Very high | 86.9 | Confident | 4 Ų | 4 | 32 Ų | 32 | 3% | 0.025 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.3 | -39.2 | 176.8 | 55.6 | 0 | 0 | 0 | 0 | 112.3 | L241 Q242 C259 V260 D261 L266 Y267 | L241-T263 HydrophobicContact CB-CG2 3.6Å; L241-T263 HydrophobicContact CD1-CG2 4.49Å; Q242-T263 HydrophobicContact CB-CG2 4.32Å; C259-T263 WeakPolarHBondContact O-CG2 3.43Å; C259-T263 PolarHBondContact O-N 3.24Å; C259-T263 PolarHBondContact O-OG1 3.18Å; V260-T263 WeakPolarHBondContact CA-OG1 3.3Å; V260-T263 PolarHBondContact O-N 3.33Å; V260-T263 PolarHBondContact O-OG1 3.1Å; D261-T263 PolarHBondContact O-N 3.38Å; T263-L266 PolarHBondContact O-N 2.86Å; T263-Y267 WeakPolarHBondContact O-CB 3.35Å; T263-Y267 PolarHBondContact O-N 3.3Å |
| 264 | T | 88.3 | Confident | 87.5 | Confident | 3 Ų | 3 | 30.2 Ų | 30.2 | 2% | 0.018 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.4 | -48.5 | 174.9 | -66.9 | 0 | 0 | 0 | 0 | 110.8 | W46 W118 V260 D261 L266 Y267 F268 | W46-T264 HydrophobicContact CZ2-CG2 4.41Å; W118-T264 HydrophobicContact CH2-CG2 4.21Å; W118-T264 HydrophobicContact CZ2-CG2 3.65Å; V260-T264 WeakPolarHBondContact O-CB 3.32Å; V260-T264 PolarHBondContact O-N 3.01Å; V260-T264 PolarHBondContact O-OG1 3.33Å; D261-T264 WeakPolarHBondContact O-CB 3.37Å; D261-T264 PolarHBondContact O-N 2.99Å; T264-L266 VanDerWaalsContact C-N 3.3Å; T264-L266 PolarHBondContact O-N 3.32Å; T264-Y267 PolarHBondContact O-N 3.26Å; T264-F268 HydrophobicContact CG2-CD2 3.7Å; T264-F268 HydrophobicContact CG2-CE2 3.76Å; T264-F268 VanDerWaalsContact O-CD2 3.29Å; T264-F268 WeakPolarHBondContact O-CD2 3.24Å; T264-F268 PolarHBondContact O-N 3.43Å |
| 265 | F | 89.7 | Confident | 88.2 | Confident | 43 Ų | 43 | 27 Ų | 27 | 19% | 0.189 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -54.8 | -47.1 | 173.9 | 165.3 | -108.5 | 0 | 0 | 0 | 111.6 | W46 L49 L50 D261 A262 Y267 S269 F270 | W46-F265 HydrophobicContact CH2-CB 3.76Å; W46-F265 HydrophobicContact CZ2-CB 4.46Å; W46-F265 HydrophobicContact CZ3-CB 4.27Å; L49-F265 HydrophobicContact CD1-CE2 3.87Å; L49-F265 HydrophobicContact CD1-CZ 4.01Å; L49-F265 HydrophobicContact CD2-CD2 3.81Å; L49-F265 HydrophobicContact CD2-CE2 3.99Å; L49-F265 HydrophobicContact CD2-CG 4.27Å; L49-F265 HydrophobicContact CG-CD2 3.7Å; L49-F265 HydrophobicContact CG-CE2 3.43Å; L49-F265 VanDerWaalsContact CG-CE2 3.43Å; L49-F265 HydrophobicContact CG-CZ 4.06Å; L49-F265 WeakPolarHBondContact O-CE2 3.04Å; L50-F265 HydrophobicContact CD2-CD2 3.91Å; D261-F265 WeakPolarHBondContact O-CB 3.13Å; D261-F265 PolarHBondContact O-N 2.65Å; A262-F265 PolarHBondContact O-N 3.46Å; F265-Y267 VanDerWaalsContact C-N 3.34Å; F265-Y267 PolarHBondContact O-N 2.97Å; F265-S269 VanDerWaalsContact CD2-OG 3.3Å; F265-S269 WeakPolarHBondContact CD2-OG 3.47Å; F265-S269 WeakPolarHBondContact CE2-OG 3.23Å; F265-S269 WeakPolarHBondContact O-CB 3.37Å; F265-S269 PolarHBondContact O-N 2.88Å; F265-S269 PolarHBondContact O-OG 3.36Å; F265-F270 AromaticContact CE1-CE2 3.83Å; F265-F270 HydrophobicContact CE1-CE2 3.83Å; F265-F270 AromaticContact CZ-CE2 3.89Å; F265-F270 HydrophobicContact CZ-CE2 3.89Å; F265-F270 HydrophobicContact CZ-CZ 4.49Å |
| 266 | L | 92.8 | Very high | 88.7 | Confident | 71 Ų | 71 | 23.1 Ų | 23.1 | 37% | 0.372 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -61.5 | -43.7 | 179.3 | -74 | 173.9 | 0 | 0 | 0 | 111.9 | L238 A262 T263 T264 F270 | L238-L266 HydrophobicContact CD2-CB 3.95Å; L238-L266 HydrophobicContact CD2-CD1 3.99Å; A262-L266 WeakPolarHBondContact O-CB 3.37Å; A262-L266 VanDerWaalsContact O-CG 3.27Å; A262-L266 WeakPolarHBondContact O-CG 3.38Å; A262-L266 PolarHBondContact O-N 2.92Å; T263-L266 PolarHBondContact O-N 2.86Å; T264-L266 VanDerWaalsContact C-N 3.3Å; T264-L266 PolarHBondContact O-N 3.32Å; L266-F270 HydrophobicContact CD2-CD2 3.73Å; L266-F270 HydrophobicContact CD2-CE2 3.89Å; L266-F270 WeakPolarHBondContact O-CA 3.37Å; L266-F270 WeakPolarHBondContact O-CB 3.27Å; L266-F270 PolarHBondContact O-N 2.92Å |
| 267 | Y | 91.7 | Very high | 89.1 | Confident | 24 Ų | 24 | 27 Ų | 27 | 9% | 0.094 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -63.7 | -55.4 | 178.1 | -176.7 | -108 | 0 | 0 | 0 | 111.2 | L125 E129 L235 T263 T264 F265 S269 F271 | L125-Y267 HydrophobicContact CB-CE1 3.68Å; L125-Y267 HydrophobicContact CD2-CD1 3.7Å; L125-Y267 HydrophobicContact CD2-CE1 3.43Å; L125-Y267 VanDerWaalsContact CD2-CE1 3.43Å; L125-Y267 HydrophobicContact CG-CE1 4.19Å; E129-Y267 VanDerWaalsContact OE2-CE2 3.27Å; E129-Y267 WeakPolarHBondContact OE2-CE2 3.33Å; E129-Y267 VanDerWaalsContact OE2-CZ 3.27Å; E129-Y267 PolarHBondContact OE2-OH 3.28Å; L235-Y267 HydrophobicContact CD2-CE2 4.47Å; T263-Y267 WeakPolarHBondContact O-CB 3.35Å; T263-Y267 PolarHBondContact O-N 3.3Å; T264-Y267 PolarHBondContact O-N 3.26Å; F265-Y267 VanDerWaalsContact C-N 3.34Å; F265-Y267 PolarHBondContact O-N 2.97Å; Y267-S269 VanDerWaalsContact C-N 3.28Å; Y267-S269 PolarHBondContact O-N 2.97Å; Y267-F271 HydrophobicContact CD2-CB 4.49Å; Y267-F271 HydrophobicContact CD2-CD2 4.22Å; Y267-F271 AromaticContact CE2-CD2 3.83Å; Y267-F271 HydrophobicContact CE2-CD2 3.83Å; Y267-F271 HydrophobicContact CE2-CE2 4.16Å; Y267-F271 HydrophobicContact CE2-CG 4.35Å; Y267-F271 WeakPolarHBondContact O-CB 3.3Å; Y267-F271 PolarHBondContact O-N 3.45Å; Y267-F271 VanDerWaalsContact O-N 3.14Å |
| 268 | F | 89.5 | Confident | 89.5 | Confident | 14 Ų | 14 | 27.2 Ų | 27.2 | 6% | 0.061 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67.4 | -25.1 | -177.2 | -80.1 | -98.7 | 0 | 0 | 0 | 114.2 | L50 N54 W118 T121 R122 L125 T264 | L50-F268 HydrophobicContact CD2-CB 3.76Å; N54-F268 PolarHBondContact ND2-O 2.87Å; W118-F268 HydrophobicContact CZ2-CD2 4.44Å; W118-F268 AromaticContact CZ2-CE2 3.97Å; W118-F268 HydrophobicContact CZ2-CE2 3.97Å; W118-F268 HydrophobicContact CZ2-CZ 4.03Å; T121-F268 HydrophobicContact CG2-CD1 3.88Å; T121-F268 HydrophobicContact CG2-CE1 3.57Å; R122-F268 HydrophobicContact CB-CZ 4.1Å; R122-F268 HydrophobicContact CG-CZ 4.29Å; L125-F268 HydrophobicContact CD1-CD1 4.4Å; L125-F268 HydrophobicContact CD1-CE1 4.42Å; L125-F268 HydrophobicContact CD2-CD1 4.08Å; L125-F268 HydrophobicContact CD2-CE1 4.47Å; L125-F268 HydrophobicContact CD2-CG 4.22Å; T264-F268 HydrophobicContact CG2-CD2 3.7Å; T264-F268 HydrophobicContact CG2-CE2 3.76Å; T264-F268 VanDerWaalsContact O-CD2 3.29Å; T264-F268 WeakPolarHBondContact O-CD2 3.24Å; T264-F268 PolarHBondContact O-N 3.43Å |
| 269 | S | 90.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -95.5 | -40.7 | -176.8 | -59.5 | 0 | 0 | 0 | 0 | 113.8 | P53 F265 Y267 | P53-S269 VanDerWaalsContact CG-CB 3.48Å; P53-S269 WeakPolarHBondContact CG-OG 3.27Å; F265-S269 VanDerWaalsContact CD2-OG 3.3Å; F265-S269 WeakPolarHBondContact CD2-OG 3.47Å; F265-S269 WeakPolarHBondContact CE2-OG 3.23Å; F265-S269 WeakPolarHBondContact O-CB 3.37Å; F265-S269 PolarHBondContact O-N 2.88Å; F265-S269 PolarHBondContact O-OG 3.36Å; Y267-S269 VanDerWaalsContact C-N 3.28Å; Y267-S269 PolarHBondContact O-N 2.97Å |
| 270 | F | 91.8 | Very high | 89.4 | Confident | 101 Ų | 101 | 24.7 Ų | 24.7 | 44% | 0.443 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -109.3 | -5.2 | -170 | -61.1 | -79.3 | 0 | 0 | 0 | 114 | F265 L266 P273 L274 | F265-F270 AromaticContact CE1-CE2 3.83Å; F265-F270 HydrophobicContact CE1-CE2 3.83Å; F265-F270 AromaticContact CZ-CE2 3.89Å; F265-F270 HydrophobicContact CZ-CE2 3.89Å; F265-F270 HydrophobicContact CZ-CZ 4.49Å; L266-F270 HydrophobicContact CD2-CD2 3.73Å; L266-F270 HydrophobicContact CD2-CE2 3.89Å; L266-F270 WeakPolarHBondContact O-CA 3.37Å; L266-F270 WeakPolarHBondContact O-CB 3.27Å; L266-F270 PolarHBondContact O-N 2.92Å; F270-P273 WeakPolarHBondContact O-CD 3.38Å; F270-L274 WeakPolarHBondContact O-CB 3.4Å; F270-L274 PolarHBondContact O-N 3.46Å |
| 271 | F | 91.6 | Very high | 89.3 | Confident | 5 Ų | 5 | 32.4 Ų | 32.4 | 2% | 0.022 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.2 | -49.4 | 177.8 | 176.2 | -104.7 | 0 | 0 | 0 | 113.2 | V90 L125 I128 E129 Y231 L235 Y267 L274 I275 | V90-F271 HydrophobicContact CG1-CD1 4.45Å; L125-F271 HydrophobicContact CD2-CD1 4.31Å; L125-F271 HydrophobicContact CG-CD1 4.28Å; I128-F271 HydrophobicContact CB-CE1 4.26Å; I128-F271 HydrophobicContact CG2-CE1 3.83Å; I128-F271 HydrophobicContact CG2-CZ 4.1Å; E129-F271 HydrophobicContact CB-CE2 3.9Å; E129-F271 HydrophobicContact CB-CZ 3.72Å; E129-F271 HydrophobicContact CG-CE2 4.09Å; E129-F271 HydrophobicContact CG-CZ 4.4Å; Y231-F271 HydrophobicContact CE2-CE2 4.44Å; Y231-F271 WeakPolarHBondContact OH-CE2 3.44Å; L235-F271 HydrophobicContact CD2-CD2 4.31Å; L235-F271 HydrophobicContact CD2-CE2 4.32Å; Y267-F271 HydrophobicContact CD2-CB 4.49Å; Y267-F271 HydrophobicContact CD2-CD2 4.22Å; Y267-F271 AromaticContact CE2-CD2 3.83Å; Y267-F271 HydrophobicContact CE2-CD2 3.83Å; Y267-F271 HydrophobicContact CE2-CE2 4.16Å; Y267-F271 HydrophobicContact CE2-CG 4.35Å; Y267-F271 WeakPolarHBondContact O-CB 3.3Å; Y267-F271 PolarHBondContact O-N 3.45Å; Y267-F271 VanDerWaalsContact O-N 3.14Å; F271-L274 WeakPolarHBondContact O-CB 3.47Å; F271-L274 PolarHBondContact O-N 3.1Å; F271-I275 HydrophobicContact CD1-CD1 4.01Å; F271-I275 HydrophobicContact CE1-CD1 3.48Å; F271-I275 VanDerWaalsContact CE1-CD1 3.48Å; F271-I275 HydrophobicContact CE2-CD1 4.11Å; F271-I275 HydrophobicContact CZ-CD1 3.53Å; F271-I275 HydrophobicContact CZ-CG1 4.45Å; F271-I275 WeakPolarHBondContact O-CG1 3.36Å; F271-I275 PolarHBondContact O-N 2.99Å |
| 272 | A | 90.9 | Very high | 88.9 | Confident | 2 Ų | 2 | 34 Ų | 34 | 2% | 0.017 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -65.6 | -45.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | F57 V87 V90 L274 I275 Y276 | F57-A272 HydrophobicContact CD1-CB 4.03Å; F57-A272 HydrophobicContact CE1-CB 3.6Å; F57-A272 HydrophobicContact CZ-CB 4.44Å; F57-A272 WeakPolarHBondContact CZ-O 3.34Å; V87-A272 HydrophobicContact CG1-CB 4.15Å; V90-A272 HydrophobicContact CB-CB 4.23Å; V90-A272 HydrophobicContact CG1-CB 3.93Å; A272-L274 VanDerWaalsContact C-N 3.28Å; A272-L274 PolarHBondContact O-N 2.93Å; A272-I275 PolarHBondContact O-N 3.38Å; A272-Y276 PolarHBondContact O-N 3.33Å; A272-Y276 VanDerWaalsContact O-N 3.09Å |
| 273 | P | 92.1 | Very high | 88.3 | Confident | 27 Ų | 27 | 32.8 Ų | 32.8 | 18% | 0.175 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -54.2 | -40.7 | 168 | -28.1 | 32.9 | 0 | 0 | 0 | 114.1 | F57 F270 Y276 V277 | F57-P273 HydrophobicContact CB-CG 4.24Å; F57-P273 HydrophobicContact CD1-CG 4.21Å; F57-P273 HydrophobicContact CD2-CB 4.14Å; F57-P273 HydrophobicContact CD2-CG 3.77Å; F57-P273 HydrophobicContact CE2-CB 4.16Å; F57-P273 HydrophobicContact CE2-CG 4.15Å; F57-P273 HydrophobicContact CG-CG 3.8Å; F270-P273 WeakPolarHBondContact O-CD 3.38Å; P273-Y276 WeakPolarHBondContact O-CB 3.37Å; P273-Y276 PolarHBondContact O-N 2.86Å; P273-V277 WeakPolarHBondContact O-CG2 3.38Å; P273-V277 PolarHBondContact O-N 2.96Å |
| 274 | L | 92.1 | Very high | 87.3 | Confident | 36 Ų | 36 | 34.3 Ų | 34.3 | 19% | 0.188 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64 | -45.8 | -179.2 | -178.4 | 69.7 | 0 | 0 | 0 | 111.3 | Y231 I234 F270 F271 A272 Y276 V277 A278 | Y231-L274 HydrophobicContact CD2-CD2 3.61Å; Y231-L274 HydrophobicContact CD2-CG 3.79Å; Y231-L274 HydrophobicContact CE2-CD2 3.91Å; Y231-L274 HydrophobicContact CE2-CG 4.28Å; I234-L274 HydrophobicContact CB-CD2 4.22Å; I234-L274 HydrophobicContact CD1-CD1 3.56Å; I234-L274 HydrophobicContact CG2-CD2 3.79Å; F270-L274 WeakPolarHBondContact O-CB 3.4Å; F270-L274 PolarHBondContact O-N 3.46Å; F271-L274 WeakPolarHBondContact O-CB 3.47Å; F271-L274 PolarHBondContact O-N 3.1Å; A272-L274 VanDerWaalsContact C-N 3.28Å; A272-L274 PolarHBondContact O-N 2.93Å; L274-Y276 VanDerWaalsContact C-N 3.3Å; L274-Y276 PolarHBondContact O-N 2.91Å; L274-V277 PolarHBondContact O-N 3.3Å; L274-A278 VanDerWaalsContact O-CB 3.29Å; L274-A278 WeakPolarHBondContact O-CB 3.26Å; L274-A278 PolarHBondContact O-N 2.69Å |
| 275 | I | 90.5 | Very high | 85.8 | Confident | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.005 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.5 | -43.5 | 174.2 | -65.4 | 168.4 | 0 | 0 | 0 | 110.3 | V87 I128 V132 Y231 F271 A272 V277 A278 F279 | V87-I275 HydrophobicContact CG2-CB 3.68Å; V87-I275 HydrophobicContact CG2-CD1 4.28Å; V87-I275 HydrophobicContact CG2-CG2 3.33Å; I128-I275 HydrophobicContact CG2-CD1 3.89Å; V132-I275 HydrophobicContact CG2-CD1 4.11Å; V132-I275 HydrophobicContact CG2-CG2 4.45Å; Y231-I275 HydrophobicContact CE2-CG1 3.8Å; F271-I275 HydrophobicContact CD1-CD1 4.01Å; F271-I275 HydrophobicContact CE1-CD1 3.48Å; F271-I275 VanDerWaalsContact CE1-CD1 3.48Å; F271-I275 HydrophobicContact CE2-CD1 4.11Å; F271-I275 HydrophobicContact CZ-CD1 3.53Å; F271-I275 HydrophobicContact CZ-CG1 4.45Å; F271-I275 WeakPolarHBondContact O-CG1 3.36Å; F271-I275 PolarHBondContact O-N 2.99Å; A272-I275 PolarHBondContact O-N 3.38Å; I275-V277 PolarHBondContact O-N 3.25Å; I275-A278 PolarHBondContact O-N 3.44Å; I275-F279 HydrophobicContact CG2-CD2 3.9Å; I275-F279 WeakPolarHBondContact O-CD2 3.22Å; I275-F279 PolarHBondContact O-N 3.01Å |
| 276 | Y | 90.3 | Very high | 84.3 | Confident | 21 Ų | 21 | 37.8 Ų | 37.8 | 8% | 0.082 | 21% | 0.213 | C | C | . | . | I | π-helix | trans | -59.4 | -47.8 | 177.7 | 178.1 | -86.2 | 0 | 0 | 0 | 111.9 | F57 F60 L61 A272 P273 L274 L280 R281 F284 | F57-Y276 HydrophobicContact CE2-CG 4.21Å; F57-Y276 HydrophobicContact CZ-CG 4.34Å; F60-Y276 AromaticContact CE1-CD1 4Å; F60-Y276 HydrophobicContact CE1-CD1 4Å; F60-Y276 HydrophobicContact CE1-CD2 4.36Å; F60-Y276 AromaticContact CE1-CE1 3.51Å; F60-Y276 HydrophobicContact CE1-CE1 3.51Å; F60-Y276 AromaticContact CE1-CE2 3.9Å; F60-Y276 HydrophobicContact CE1-CE2 3.9Å; F60-Y276 HydrophobicContact CE1-CG 4.42Å; F60-Y276 AromaticContact CE1-CZ 3.45Å; F60-Y276 VanDerWaalsContact CE1-CZ 3.45Å; F60-Y276 AromaticContact CZ-CE1 3.66Å; F60-Y276 HydrophobicContact CZ-CE1 3.66Å; F60-Y276 HydrophobicContact CZ-CE2 4.5Å; F60-Y276 AromaticContact CZ-CZ 3.65Å; F60-Y276 WeakPolarHBondContact CZ-OH 3.47Å; L61-Y276 HydrophobicContact CD2-CD2 3.87Å; L61-Y276 HydrophobicContact CD2-CE2 4.16Å; A272-Y276 PolarHBondContact O-N 3.33Å; A272-Y276 VanDerWaalsContact O-N 3.09Å; P273-Y276 WeakPolarHBondContact O-CB 3.37Å; P273-Y276 PolarHBondContact O-N 2.86Å; L274-Y276 VanDerWaalsContact C-N 3.3Å; L274-Y276 PolarHBondContact O-N 2.91Å; Y276-L280 HydrophobicContact CD2-CB 3.7Å; Y276-L280 HydrophobicContact CD2-CD1 3.88Å; Y276-L280 HydrophobicContact CD2-CG 4.44Å; Y276-L280 HydrophobicContact CE2-CB 4Å; Y276-L280 HydrophobicContact CG-CB 4.21Å; Y276-L280 CarbonylContact O-C 3.5Å; Y276-L280 WeakPolarHBondContact O-CA 3.26Å; Y276-L280 WeakPolarHBondContact O-CB 3.25Å; Y276-L280 PolarHBondContact O-N 2.9Å; Y276-R281 HydrophobicContact CD1-CB 4.47Å; Y276-R281 HydrophobicContact CE1-CB 4.14Å; Y276-R281 PolarHBondContact O-N 3.27Å; Y276-F284 HydrophobicContact CE2-CD2 4.31Å |
| 277 | V | 89.3 | Confident | 82.1 | Confident | 80 Ų | 80 | 42.4 Ų | 42.4 | 49% | 0.485 | 23% | 0.232 | S | C | . | . | I | π-helix | trans | -65.2 | -41.1 | 179.4 | 173.5 | 0 | 0 | 0 | 0 | 111.5 | P273 L274 I275 | P273-V277 WeakPolarHBondContact O-CG2 3.38Å; P273-V277 PolarHBondContact O-N 2.96Å; L274-V277 PolarHBondContact O-N 3.3Å; I275-V277 PolarHBondContact O-N 3.25Å |
| 278 | A | 87.9 | Confident | 80.1 | Confident | 12 Ų | 12 | 46.3 Ų | 46.3 | 10% | 0.099 | 26% | 0.261 | C | S | . | . | I | π-helix | trans | -70.5 | -37.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | S227 L274 I275 | S227-A278 WeakPolarHBondContact CB-O 3.33Å; S227-A278 PolarHBondContact OG-O 3.38Å; L274-A278 VanDerWaalsContact O-CB 3.29Å; L274-A278 WeakPolarHBondContact O-CB 3.26Å; L274-A278 PolarHBondContact O-N 2.69Å; I275-A278 PolarHBondContact O-N 3.44Å |
| 279 | F | 84.9 | Confident | 77.7 | Confident | 13 Ų | 13 | 54.6 Ų | 54.6 | 6% | 0.057 | 30% | 0.297 | C | S | . | . | I | π-helix | trans | -119.7 | -39.2 | -169.4 | -58.3 | -74.5 | 0 | 0 | 0 | 114.4 | F83 V132 F228 Y231 I275 | F83-F279 HydrophobicContact CD2-CB 3.91Å; F83-F279 HydrophobicContact CD2-CG 4.17Å; F83-F279 HydrophobicContact CE2-CB 4.27Å; F83-F279 HydrophobicContact CE2-CD1 4.05Å; F83-F279 HydrophobicContact CE2-CG 4.1Å; V132-F279 HydrophobicContact CG1-CD2 4.13Å; V132-F279 HydrophobicContact CG1-CE2 3.4Å; V132-F279 VanDerWaalsContact CG1-CE2 3.4Å; V132-F279 HydrophobicContact CG1-CZ 3.76Å; F228-F279 HydrophobicContact CB-CE1 4.21Å; F228-F279 AromaticContact CD2-CE1 3.77Å; F228-F279 HydrophobicContact CD2-CE1 3.77Å; F228-F279 AromaticContact CD2-CZ 3.69Å; F228-F279 HydrophobicContact CD2-CZ 3.69Å; F228-F279 HydrophobicContact CE2-CZ 4.45Å; F228-F279 HydrophobicContact CG-CE1 4.49Å; Y231-F279 HydrophobicContact CD1-CE2 4.1Å; Y231-F279 HydrophobicContact CD1-CZ 4.1Å; Y231-F279 HydrophobicContact CD2-CE2 4.35Å; Y231-F279 HydrophobicContact CE1-CE2 4.42Å; Y231-F279 HydrophobicContact CG-CE2 4.06Å; Y231-F279 HydrophobicContact CG-CZ 4.31Å; I275-F279 HydrophobicContact CG2-CD2 3.9Å; I275-F279 WeakPolarHBondContact O-CD2 3.22Å; I275-F279 PolarHBondContact O-N 3.01Å |
| 280 | L | 83.5 | Confident | 75.9 | Confident | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 33% | 0.332 | C | S | . | . | I | π-helix | trans | -96.2 | -30.4 | -168.8 | -61.8 | 174.4 | 0 | 0 | 0 | 113.3 | F80 F83 Y84 V87 Y276 G282 F283 F284 | F80-L280 HydrophobicContact CD1-CD2 4.34Å; F83-L280 HydrophobicContact CB-CD2 4.05Å; F83-L280 HydrophobicContact CB-CG 4.47Å; Y84-L280 HydrophobicContact CD2-CD1 4.24Å; V87-L280 HydrophobicContact CG2-CD1 4.43Å; Y276-L280 HydrophobicContact CD2-CB 3.7Å; Y276-L280 HydrophobicContact CD2-CD1 3.88Å; Y276-L280 HydrophobicContact CD2-CG 4.44Å; Y276-L280 HydrophobicContact CE2-CB 4Å; Y276-L280 HydrophobicContact CG-CB 4.21Å; Y276-L280 CarbonylContact O-C 3.5Å; Y276-L280 WeakPolarHBondContact O-CA 3.26Å; Y276-L280 WeakPolarHBondContact O-CB 3.25Å; Y276-L280 PolarHBondContact O-N 2.9Å; L280-G282 PolarHBondContact O-N 2.88Å; L280-F283 PolarHBondContact O-N 3.39Å; L280-F284 HydrophobicContact CB-CD2 4.01Å; L280-F284 HydrophobicContact CB-CE2 3.99Å; L280-F284 HydrophobicContact CD2-CE2 4Å; L280-F284 HydrophobicContact CG-CE2 4.43Å; L280-F284 WeakPolarHBondContact O-CD2 3.38Å; L280-F284 PolarHBondContact O-N 2.77Å |
| 281 | R | 83.7 | Confident | 73.6 | Confident | 163 Ų | 163 | 63.5 Ų | 63.5 | 62% | 0.615 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -57.8 | -45.3 | -178.1 | -179.8 | 178.5 | 175 | 147 | 0.1 | 112.3 | Y276 F283 G285 | Y276-R281 HydrophobicContact CD1-CB 4.47Å; Y276-R281 HydrophobicContact CE1-CB 4.14Å; Y276-R281 PolarHBondContact O-N 3.27Å; R281-F283 VanDerWaalsContact C-N 3.3Å; R281-F283 PolarHBondContact O-N 3.43Å; R281-G285 WeakPolarHBondContact O-CA 3.48Å; R281-G285 PolarHBondContact O-N 3.49Å |
| 282 | G | 75.4 | Confident | 71.5 | Confident | 43 Ų | 43 | 72.6 Ų | 72.6 | 44% | 0.443 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -67.7 | -30.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L280 S286 | L280-G282 PolarHBondContact O-N 2.88Å; G282-S286 PolarHBondContact O-OG 3Å |
| 283 | F | 75.3 | Confident | 69.3 | Low | 25 Ų | 25 | 76.9 Ų | 76.9 | 11% | 0.11 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -74.5 | -41.9 | 177.5 | 179.1 | -106.2 | 0 | 0 | 0 | 112.1 | K71 I72 T75 F80 L280 R281 S286 | K71-F283 WeakPolarHBondContact CD-O 2.88Å; K71-F283 WeakPolarHBondContact CE-O 3.32Å; K71-F283 HydrophobicContact CG-CE1 4.46Å; K71-F283 HydrophobicContact CG-CZ 4.22Å; K71-F283 PolarHBondContact NZ-O 2.75Å; I72-F283 HydrophobicContact CG1-CE1 4.34Å; T75-F283 HydrophobicContact CG2-CE2 3.67Å; T75-F283 HydrophobicContact CG2-CZ 3.95Å; F80-F283 HydrophobicContact CB-CD1 4.42Å; F80-F283 HydrophobicContact CD1-CB 4.18Å; F80-F283 HydrophobicContact CD1-CG 4.28Å; F80-F283 HydrophobicContact CD2-CD2 4.25Å; F80-F283 HydrophobicContact CD2-CE2 4.47Å; F80-F283 HydrophobicContact CE1-CB 4.3Å; F80-F283 HydrophobicContact CE2-CD2 4.46Å; F80-F283 HydrophobicContact CG-CD2 4.34Å; F80-F283 HydrophobicContact CG-CG 4.25Å; L280-F283 PolarHBondContact O-N 3.39Å; R281-F283 VanDerWaalsContact C-N 3.3Å; R281-F283 PolarHBondContact O-N 3.43Å; F283-S286 PolarHBondContact O-OG 2.84Å |
| 284 | F | 71.3 | Confident | 66.8 | Low | 36 Ų | 36 | 84.7 Ų | 84.7 | 16% | 0.158 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -92 | -24.4 | -178.9 | -64.1 | -62.8 | 0 | 0 | 0 | 114.7 | A68 I72 Y84 Y276 L280 | A68-F284 HydrophobicContact CB-CD1 3.8Å; A68-F284 HydrophobicContact CB-CE1 3.31Å; A68-F284 HydrophobicContact CB-CE2 4.43Å; A68-F284 HydrophobicContact CB-CZ 3.68Å; I72-F284 HydrophobicContact CD1-CE1 4.26Å; I72-F284 HydrophobicContact CD1-CZ 4.12Å; I72-F284 HydrophobicContact CG1-CE1 4.2Å; I72-F284 HydrophobicContact CG1-CZ 4.37Å; Y84-F284 AromaticContact CD2-CE2 3.97Å; Y84-F284 HydrophobicContact CD2-CE2 3.97Å; Y84-F284 HydrophobicContact CD2-CZ 4.18Å; Y276-F284 HydrophobicContact CE2-CD2 4.31Å; L280-F284 HydrophobicContact CB-CD2 4.01Å; L280-F284 HydrophobicContact CB-CE2 3.99Å; L280-F284 HydrophobicContact CD2-CE2 4Å; L280-F284 HydrophobicContact CG-CE2 4.43Å; L280-F284 WeakPolarHBondContact O-CD2 3.38Å; L280-F284 PolarHBondContact O-N 2.77Å |
| 285 | G | 57.3 | Low | 64.2 | Low | 61 Ų | 61 | 91.6 Ų | 91.6 | 63% | 0.629 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -89.6 | -13.2 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115 | R281 E287 | R281-G285 WeakPolarHBondContact O-CA 3.48Å; R281-G285 PolarHBondContact O-N 3.49Å; G285-E287 PolarHBondContact O-N 3.44Å; G285-E287 VanDerWaalsContact O-N 3.15Å |
| 286 | S | 57.2 | Low | 62 | Low | 59 Ų | 59 | 96.6 Ų | 96.6 | 41% | 0.413 | 51% | 0.506 | S | S | . | . | S | Bend | trans | -68.4 | 109.4 | 165.2 | 38.5 | 0 | 0 | 0 | 0 | 107.8 | K71 G282 F283 | K71-S286 PolarHBondContact NZ-O 3.05Å; K71-S286 PolarHBondContact NZ-OG 2.83Å; G282-S286 PolarHBondContact O-OG 3Å; F283-S286 PolarHBondContact O-OG 2.84Å |
| 287 | E | 47.9 | Very low | 59.6 | Low | 167 Ų | 167 | 103.5 Ų | 103.5 | 78% | 0.78 | 54% | 0.539 | S | S | * | . | trans | -49.6 | 143.7 | 160.2 | -71.7 | 177.8 | 163.5 | 0 | 0 | 108.2 | G285 K289 | G285-E287 PolarHBondContact O-N 3.44Å; G285-E287 VanDerWaalsContact O-N 3.15Å; E287-K289 PolarHBondContact O-N 2.67Å | ||
| 288 | P | 48.1 | Very low | 57.4 | Low | 106 Ų | 106 | 105.8 Ų | 105.8 | 69% | 0.688 | 55% | 0.553 | S | S | * | * | trans | -62.6 | 90.5 | 172.5 | 27.6 | -31.2 | 0 | 0 | 0 | 107.1 | I290 | P288-I290 VanDerWaalsContact C-N 3.26Å; P288-I290 PolarHBondContact O-N 2.83Å | ||
| 289 | K | 40.7 | Very low | 55.1 | Low | 188 Ų | 188 | 112 Ų | 112 | 82% | 0.817 | 58% | 0.584 | S | S | * | * | trans | -58.7 | 108 | 154 | -76.5 | -173.2 | 179.1 | -178 | 0 | 103 | E287 L291 | E287-K289 PolarHBondContact O-N 2.67Å; K289-L291 PolarHBondContact O-N 3.03Å | ||
| 290 | I | 52.9 | Low | 52.9 | Low | 144 Ų | 144 | 119.4 Ų | 119.4 | 74% | 0.738 | 62% | 0.619 | S | S | * | * | trans | -62.4 | 74.5 | 174.9 | -49.4 | 170.4 | 0 | 0 | 0 | 105.5 | P288 F292 | P288-I290 VanDerWaalsContact C-N 3.26Å; P288-I290 PolarHBondContact O-N 2.83Å; I290-F292 VanDerWaalsContact C-N 3.28Å; I290-F292 HydrophobicContact CG2-CD2 3.9Å; I290-F292 HydrophobicContact CG2-CE2 4.13Å; I290-F292 PolarHBondContact O-N 2.89Å; I290-F292 VanDerWaalsContact O-N 3.15Å | ||
| 291 | L | 43.9 | Very low | 50.9 | Low | 144 Ų | 144 | 125.6 Ų | 125.6 | 75% | 0.754 | 66% | 0.657 | S | S | * | * | trans | -79.4 | 97.6 | 164.9 | -135.2 | 94.2 | 0 | 0 | 0 | 102.8 | K289 S293 | K289-L291 PolarHBondContact O-N 3.03Å; L291-S293 PolarHBondContact O-N 3.5Å | ||
| 292 | F | 46.8 | Very low | 48.8 | Very low | 196 Ų | 196 | 126.7 Ų | 126.7 | 86% | 0.86 | 67% | 0.669 | S | S | * | * | trans | -53.2 | 73.6 | 151.7 | -97.1 | -91.7 | 0 | 0 | 0 | 107.7 | I290 Y294 | I290-F292 VanDerWaalsContact C-N 3.28Å; I290-F292 HydrophobicContact CG2-CD2 3.9Å; I290-F292 HydrophobicContact CG2-CE2 4.13Å; I290-F292 PolarHBondContact O-N 2.89Å; I290-F292 VanDerWaalsContact O-N 3.15Å; F292-Y294 PolarHBondContact O-N 3.4Å | ||
| 293 | S | 43.6 | Very low | 47.1 | Very low | 93 Ų | 93 | 133.1 Ų | 133.1 | 65% | 0.65 | 69% | 0.688 | S | S | * | * | trans | -77.6 | 100.3 | 161.5 | -172.2 | 0 | 0 | 0 | 0 | 103.5 | L291 K295 | L291-S293 PolarHBondContact O-N 3.5Å; S293-K295 PolarHBondContact O-N 3.48Å | ||
| 294 | Y | 40.9 | Very low | 45.4 | Very low | 190 Ų | 190 | 137.1 Ų | 137.1 | 75% | 0.745 | 72% | 0.716 | S | S | * | * | trans | -55.6 | 96.8 | 164.2 | -157.5 | -92.5 | 0 | 0 | 0 | 105.5 | F292 C296 | F292-Y294 PolarHBondContact O-N 3.4Å; Y294-C296 PolarHBondContact O-N 3.41Å; Y294-C296 VanDerWaalsContact O-N 3.07Å | ||
| 295 | K | 37.4 | Very low | 43.9 | Very low | 182 Ų | 182 | 142.8 Ų | 142.8 | 79% | 0.791 | 75% | 0.748 | S | S | * | * | trans | -60.2 | 113.6 | 164.5 | -159.3 | 179.8 | -174.2 | 175.1 | 0 | 102.3 | S293 Q297 | S293-K295 PolarHBondContact O-N 3.48Å; K295-Q297 PolarHBondContact O-N 3.09Å | ||
| 296 | C | 42.9 | Very low | 43.2 | Very low | 105 Ų | 105 | 145 Ų | 145 | 71% | 0.709 | 75% | 0.749 | S | S | * | * | trans | -51.8 | 104.9 | 162.4 | -94.9 | 0 | 0 | 0 | 0 | 104.7 | Y294 V298 | Y294-C296 PolarHBondContact O-N 3.41Å; Y294-C296 VanDerWaalsContact O-N 3.07Å; C296-V298 VanDerWaalsContact C-N 3.26Å; C296-V298 PolarHBondContact O-N 2.84Å | ||
| 297 | Q | 41.2 | Very low | 42.4 | Very low | 167 Ų | 167 | 150.7 Ų | 150.7 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | trans | -56.1 | 108.8 | 156.2 | -81.6 | 170 | -53.9 | 0 | 0 | 102.9 | K295 D299 | K295-Q297 PolarHBondContact O-N 3.09Å; Q297-D299 PolarHBondContact O-N 3.1Å | ||
| 298 | V | 41.8 | Very low | 42.1 | Very low | 128 Ų | 128 | 149.4 Ų | 149.4 | 78% | 0.776 | 77% | 0.767 | S | S | * | * | trans | -58.8 | 105.2 | 153.6 | 173.1 | 0 | 0 | 0 | 0 | 102.4 | C296 E300 | C296-V298 VanDerWaalsContact C-N 3.26Å; C296-V298 PolarHBondContact O-N 2.84Å; V298-E300 VanDerWaalsContact C-N 3.28Å; V298-E300 PolarHBondContact O-N 2.65Å | ||
| 299 | D | 41.2 | Very low | 41.4 | Very low | 141 Ų | 141 | 150 Ų | 150 | 75% | 0.754 | 77% | 0.77 | S | S | * | * | trans | -52.9 | 101.8 | 165.4 | -157.6 | 26 | 0 | 0 | 0 | 104.6 | Q297 T301 | Q297-D299 PolarHBondContact O-N 3.1Å; D299-T301 PolarHBondContact O-N 2.95Å | ||
| 300 | E | 38.8 | Very low | 41.2 | Very low | 169 Ų | 169 | 149.4 Ų | 149.4 | 79% | 0.79 | 77% | 0.771 | S | S | * | * | trans | -63.5 | 117.7 | 159.1 | -75.5 | -161.5 | 127.8 | 0 | 0 | 103.5 | V298 E302 | V298-E300 VanDerWaalsContact C-N 3.28Å; V298-E300 PolarHBondContact O-N 2.65Å; E300-E302 PolarHBondContact O-N 3.07Å | ||
| 301 | T | 41.4 | Very low | 40.4 | Very low | 131 Ų | 131 | 148.1 Ų | 148.1 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | trans | -60.4 | 82.3 | 175.9 | -33.6 | 0 | 0 | 0 | 0 | 108.2 | D299 E303 | D299-T301 PolarHBondContact O-N 2.95Å; T301-E303 PolarHBondContact O-N 3Å | ||
| 302 | E | 38 | Very low | 39.7 | Very low | 185 Ų | 185 | 152 Ų | 152 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | -67.1 | 125.4 | 163 | -111.1 | 179.6 | 142.7 | 0 | 0 | 106.3 | E300 | E300-E302 PolarHBondContact O-N 3.07Š| ||
| 303 | E | 39.8 | Very low | 39.1 | Very low | 179 Ų | 179 | 147.4 Ų | 147.4 | 84% | 0.836 | 78% | 0.776 | S | S | * | * | trans | -55.2 | 135.9 | -179.1 | -57.3 | -139.6 | 125.6 | 0 | 0 | 110.5 | T301 D305 | T301-E303 PolarHBondContact O-N 3Å; E303-D305 PolarHBondContact O-N 3.11Å | ||
| 304 | P | 40.8 | Very low | 38.6 | Very low | 108 Ų | 108 | 150.1 Ų | 150.1 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | -81.5 | 89.6 | -170.6 | 33 | -36.3 | 0 | 0 | 0 | 111.2 | V306 | P304-V306 HydrophobicContact CB-CG2 3.83Å; P304-V306 PolarHBondContact O-N 3.12Å | ||
| 305 | D | 39.8 | Very low | 38.1 | Very low | 156 Ų | 156 | 145.2 Ų | 145.2 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | trans | -77.5 | 78.1 | 156.2 | -95.7 | -19.8 | 0 | 0 | 0 | 109 | E303 H307 | E303-D305 PolarHBondContact O-N 3.11Å; D305-H307 PolarHBondContact O-N 3.14Å; D305-H307 VanDerWaalsContact O-N 3.11Å | ||
| 306 | V | 42.9 | Very low | 37.6 | Very low | 107 Ų | 107 | 147.4 Ų | 147.4 | 65% | 0.648 | 79% | 0.791 | S | S | * | * | trans | -76 | 92.2 | 175.1 | -171.8 | 0 | 0 | 0 | 0 | 109 | P304 L308 | P304-V306 HydrophobicContact CB-CG2 3.83Å; P304-V306 PolarHBondContact O-N 3.12Å; V306-L308 HydrophobicContact CG1-CD1 3.88Å; V306-L308 PolarHBondContact O-N 3.17Å | ||
| 307 | H | 39.2 | Very low | 36.9 | Very low | 178 Ų | 178 | 151.9 Ų | 151.9 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | -84.8 | 100.6 | 159 | -82.3 | -69.3 | 0 | 0 | 0 | 109.8 | D305 | D305-H307 PolarHBondContact O-N 3.14Å; D305-H307 VanDerWaalsContact O-N 3.11Å | ||
| 308 | L | 41 | Very low | 36.4 | Very low | 140 Ų | 140 | 151.3 Ų | 151.3 | 73% | 0.733 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 138.3 | 168 | -97.6 | 93.6 | 0 | 0 | 0 | 110.8 | V306 Q310 | V306-L308 HydrophobicContact CG1-CD1 3.88Å; V306-L308 PolarHBondContact O-N 3.17Å; L308-Q310 PolarHBondContact O-N 2.84Å |
| 309 | P | 35 | Very low | 35.8 | Very low | 118 Ų | 118 | 148.6 Ų | 148.6 | 77% | 0.766 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 125.6 | 159.3 | -7.9 | 24.2 | 0 | 0 | 0 | 109.4 | ||
| 310 | Q | 35 | Very low | 35.3 | Very low | 177 Ų | 177 | 149.6 Ų | 149.6 | 83% | 0.827 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 136.6 | 175.7 | -88.2 | 167.1 | -37.1 | 0 | 0 | 111.9 | L308 | L308-Q310 PolarHBondContact O-N 2.84Š|
| 311 | P | 35.9 | Very low | 34.9 | Very low | 117 Ų | 117 | 150 Ų | 150 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 134.6 | 176.6 | 28.9 | -31.4 | 0 | 0 | 0 | 111.5 | A313 | P311-A313 PolarHBondContact O-N 3.29Š|
| 312 | Y | 30.4 | Very low | 34.2 | Very low | 225 Ų | 225 | 148 Ų | 148 | 88% | 0.882 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 121.2 | 171.6 | 7.8 | -92.7 | 0 | 0 | 0 | 110.3 | ||
| 313 | A | 33.9 | Very low | 34.4 | Very low | 100 Ų | 100 | 145.5 Ų | 145.5 | 83% | 0.826 | 79% | 0.791 | S | S | * | * | trans | -132.4 | 121.8 | 159.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | P311 | P311-A313 PolarHBondContact O-N 3.29Š| ||
| 314 | V | 32.2 | Very low | 33.8 | Very low | 150 Ų | 150 | 140.4 Ų | 140.4 | 91% | 0.909 | 79% | 0.787 | S | S | * | * | trans | -79 | 127.2 | 176.5 | 171.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 315 | A | 31.7 | Very low | 33.2 | Very low | 87 Ų | 87 | 140 Ų | 140 | 72% | 0.719 | 79% | 0.792 | S | S | * | * | trans | -176.7 | 115.2 | 135.7 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 316 | R | 27.1 | Very low | 32.6 | Very low | 228 Ų | 228 | 137.9 Ų | 137.9 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | 63.3 | 99.4 | 125.4 | -159.3 | 170.1 | -167.8 | 157.5 | 2.5 | 119.7 | |||||
| 317 | R | 28.3 | Very low | 31.7 | Very low | 198 Ų | 198 | 136 Ų | 136 | 75% | 0.747 | 80% | 0.799 | S | S | * | * | 65.5 | 130.8 | 117.9 | -166.1 | 170.4 | 175.8 | 171.8 | -4.7 | 120.2 | |||||
| 318 | E | 30.8 | Very low | 31.2 | Very low | 156 Ų | 156 | 132.3 Ų | 132.3 | 73% | 0.729 | 80% | 0.799 | S | S | * | * | trans | 95.3 | 126.5 | 148.8 | -91.2 | 158.5 | -168.3 | 0 | 0 | 120.9 | ||||
| 319 | G | 28.9 | Very low | 30.7 | Very low | 70 Ų | 70 | 131 Ų | 131 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | 81.3 | 103.3 | 144.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 320 | L | 30.6 | Very low | 30.5 | Very low | 163 Ų | 163 | 130.2 Ų | 130.2 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | 73.1 | 127.6 | 81.3 | -151.7 | 81.3 | 0 | 0 | 0 | 114.1 | |||||
| 321 | E | 30.2 | Very low | 30.2 | Very low | 177 Ų | 177 | 126.2 Ų | 126.2 | 83% | 0.827 | 80% | 0.802 | S | S | * | * | trans | 103.5 | 121.4 | 158.6 | -50.3 | -155.9 | 148.9 | 0 | 0 | 119.4 | ||||
| 322 | A | 27 | Very low | 29.8 | Very low | 90 Ų | 90 | 125.1 Ų | 125.1 | 74% | 0.744 | 80% | 0.797 | S | S | * | * | trans | -85 | -165.3 | 160.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 323 | P | 40.8 | Very low | 29.7 | Very low | 131 Ų | 131 | 124.2 Ų | 124.2 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | cis | -126.7 | -179.3 | -33.2 | 28.6 | -7.9 | 0 | 0 | 0 | 111.8 | ||||
| 324 | G | 28.3 | Very low | 29.4 | Very low | 73 Ų | 73 | 124.2 Ų | 124.2 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | trans | 152 | 109.1 | 152.7 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 325 | A | 27.8 | Very low | 29.4 | Very low | 100 Ų | 100 | 122 Ų | 122 | 83% | 0.826 | 78% | 0.779 | S | S | * | * | 60.2 | 131 | 128.1 | 0 | 0 | 0 | 0 | 0 | 124.4 | |||||
| 326 | A | 27.5 | Very low | 29.6 | Very low | 110 Ų | 110 | 124.5 Ų | 124.5 | 91% | 0.909 | 79% | 0.785 | S | S | * | * | trans | 63.6 | 144.7 | 143.2 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 327 | G | 25 | Very low | 29.6 | Very low | 69 Ų | 69 | 120.7 Ų | 120.7 | 71% | 0.711 | 78% | 0.777 | S | S | * | * | cis | 150.8 | 140.4 | 10.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 328 | A | 28.7 | Very low | 29.7 | Very low | 100 Ų | 100 | 121.4 Ų | 121.4 | 83% | 0.826 | 79% | 0.786 | S | S | * | * | trans | 73.6 | 148.5 | 151.2 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 329 | S | 29.6 | Very low | 29.7 | Very low | 112 Ų | 112 | 119.8 Ų | 119.8 | 78% | 0.783 | 78% | 0.783 | S | S | * | * | trans | 83 | 119.2 | 159.8 | 71.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 330 | A | 30 | Very low | 29.7 | Very low | 102 Ų | 102 | 122.6 Ų | 122.6 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | cis | 78.2 | 104.2 | 43.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 331 | A | 30 | Very low | 29.7 | Very low | 92 Ų | 92 | 120 Ų | 120 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | trans | -176.3 | 118.4 | 151.9 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 332 | S | 26.6 | Very low | 29.6 | Very low | 94 Ų | 94 | 115.3 Ų | 115.3 | 66% | 0.657 | 79% | 0.793 | S | S | * | * | cis | 92.2 | 128.8 | 47.3 | -152.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 333 | Y | 28.4 | Very low | 29.7 | Very low | 206 Ų | 206 | 114.6 Ų | 114.6 | 81% | 0.808 | 79% | 0.793 | S | S | * | * | trans | 64.8 | 148.9 | 159.5 | 61.3 | -105.8 | 0 | 0 | 0 | 119.6 | ||||
| 334 | S | 28.3 | Very low | 29.1 | Very low | 101 Ų | 101 | 115.2 Ų | 115.2 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | cis | -170.2 | 151.6 | 19.2 | -159.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 335 | S | 31.7 | Very low | 29.1 | Very low | 102 Ų | 102 | 115.9 Ų | 115.9 | 71% | 0.713 | 79% | 0.793 | S | S | * | * | trans | 62.6 | 136 | 143.6 | 60.6 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 336 | T | 36 | Very low | 29.2 | Very low | 140 Ų | 140 | 120.8 Ų | 120.8 | 86% | 0.859 | 79% | 0.792 | S | S | * | * | cis | -153.4 | 150.3 | 42.4 | 43.5 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 337 | Q | 27.8 | Very low | 29.4 | Very low | 149 Ų | 149 | 124.2 Ų | 124.2 | 70% | 0.696 | 79% | 0.794 | S | S | * | * | trans | -97 | 146.8 | 175.1 | 177.6 | -177.7 | 10.6 | 0 | 0 | 111.2 | D339 | Q337-D339 PolarHBondContact NE2-OD2 3.5Š| ||
| 338 | F | 30.3 | Very low | 29.6 | Very low | 213 Ų | 213 | 125.9 Ų | 125.9 | 93% | 0.934 | 79% | 0.787 | S | S | * | * | trans | -149.1 | 117 | 145.4 | -103.4 | -77.6 | 0 | 0 | 0 | 109.1 | ||||
| 339 | D | 30.6 | Very low | 29.7 | Very low | 122 Ų | 122 | 127.9 Ų | 127.9 | 65% | 0.652 | 78% | 0.783 | S | S | * | * | trans | -86.1 | 140.9 | 171.7 | -78.7 | -55.8 | 0 | 0 | 0 | 110.6 | Q337 | Q337-D339 PolarHBondContact NE2-OD2 3.5Š| ||
| 340 | S | 29.5 | Very low | 29.8 | Very low | 128 Ų | 128 | 130.5 Ų | 130.5 | 90% | 0.895 | 79% | 0.787 | S | S | * | * | trans | -158.5 | 131.9 | 143.7 | -86.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 341 | A | 30.3 | Very low | 29.9 | Very low | 109 Ų | 109 | 129.9 Ų | 129.9 | 90% | 0.901 | 78% | 0.782 | S | S | * | * | trans | -75.8 | 157.9 | -171 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 342 | G | 28.1 | Very low | 30 | Very low | 79 Ų | 79 | 130.9 Ų | 130.9 | 81% | 0.814 | 78% | 0.783 | S | S | * | * | trans | 155.3 | 104.2 | 163.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 343 | G | 27.5 | Very low | 30.3 | Very low | 74 Ų | 74 | 135 Ų | 135 | 76% | 0.763 | 79% | 0.794 | S | S | * | * | trans | -77.7 | -175 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 344 | V | 29.8 | Very low | 30.7 | Very low | 145 Ų | 145 | 129.9 Ų | 129.9 | 88% | 0.879 | 79% | 0.786 | S | S | * | * | trans | 82.8 | 104.2 | 162.3 | -124 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 345 | A | 28.5 | Very low | 30.6 | Very low | 87 Ų | 87 | 131.3 Ų | 131.3 | 72% | 0.719 | 80% | 0.795 | S | S | * | * | trans | 47.7 | 111.7 | 134 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 346 | Y | 28.7 | Very low | 30.5 | Very low | 202 Ų | 202 | 135.1 Ų | 135.1 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | 176.1 | 121.3 | 119.7 | -131.1 | -106.5 | 0 | 0 | 0 | 108.3 | D348 | Y346-D348 WeakPolarHBondContact CE1-OD2 3.48Š| |||
| 347 | L | 31.3 | Very low | 30.3 | Very low | 182 Ų | 182 | 135.4 Ų | 135.4 | 95% | 0.953 | 80% | 0.802 | S | S | * | * | trans | -143.7 | 97.9 | 156.4 | -99 | 177.5 | 0 | 0 | 0 | 108.8 | ||||
| 348 | D | 30.8 | Very low | 30.4 | Very low | 105 Ų | 105 | 131.8 Ų | 131.8 | 56% | 0.561 | 81% | 0.805 | S | S | * | * | trans | -72.2 | 144 | 164.7 | -118.3 | -41.7 | 0 | 0 | 0 | 110.4 | Y346 | Y346-D348 WeakPolarHBondContact CE1-OD2 3.48Š| ||
| 349 | D | 30.5 | Very low | 30.4 | Very low | 142 Ų | 142 | 127 Ų | 127 | 76% | 0.759 | 80% | 0.798 | S | S | * | * | trans | 34.7 | 108.7 | 149.6 | -74.9 | -25 | 0 | 0 | 0 | 121.2 | ||||
| 350 | I | 31.7 | Very low | 30.4 | Very low | 166 Ų | 166 | 129 Ų | 129 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | trans | -103.8 | 99 | 142.7 | -70 | 177.3 | 0 | 0 | 0 | 107.9 | S352 | I350-S352 PolarHBondContact O-N 3.27Š| ||
| 351 | A | 31.2 | Very low | 30.6 | Very low | 90 Ų | 90 | 130.2 Ų | 130.2 | 74% | 0.744 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 116.9 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 352 | S | 33.1 | Very low | 30.7 | Very low | 113 Ų | 113 | 130 Ų | 130 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 116.3 | 164.5 | -53 | 0 | 0 | 0 | 0 | 108.4 | I350 | I350-S352 PolarHBondContact O-N 3.27Š|
| 353 | M | 32.5 | Very low | 31 | Very low | 180 Ų | 180 | 132 Ų | 132 | 89% | 0.887 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -58 | 140.5 | 177.7 | -86.9 | -75.9 | 171.2 | 0 | 0 | 112.9 | ||
| 354 | P | 35.7 | Very low | 31.3 | Very low | 99 Ų | 99 | 134.7 Ų | 134.7 | 64% | 0.643 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 139.1 | 171.5 | 25.4 | -18.3 | 0 | 0 | 0 | 112.7 | H356 | P354-H356 PolarHBondContact O-N 2.78Å; P354-H356 VanDerWaalsContact O-N 3.14Å |
| 355 | C | 26.8 | Very low | 31.7 | Very low | 130 Ų | 130 | 133.4 Ų | 133.4 | 88% | 0.878 | 79% | 0.787 | S | S | * | * | trans | -61.4 | 109.1 | 170.6 | -70.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 356 | H | 29.3 | Very low | 32.3 | Very low | 183 Ų | 183 | 138.3 Ų | 138.3 | 85% | 0.847 | 79% | 0.794 | S | S | * | * | trans | -79.1 | 113.8 | 164 | -87.9 | -83.6 | 0 | 0 | 0 | 110.1 | P354 | P354-H356 PolarHBondContact O-N 2.78Å; P354-H356 VanDerWaalsContact O-N 3.14Å | ||
| 357 | T | 31.8 | Very low | 32.8 | Very low | 145 Ų | 145 | 138.2 Ų | 138.2 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -102.1 | 95.2 | 160.7 | 31.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 358 | G | 30 | Very low | 33.1 | Very low | 73 Ų | 73 | 140.8 Ų | 140.8 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | -80.8 | 117.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 359 | S | 31.1 | Very low | 33.6 | Very low | 113 Ų | 113 | 145.5 Ų | 145.5 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | trans | -68.5 | 124.7 | 166.1 | 153.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 360 | I | 30.7 | Very low | 34.3 | Very low | 165 Ų | 165 | 142.9 Ų | 142.9 | 85% | 0.846 | 80% | 0.804 | S | S | * | * | trans | -124.6 | 113.6 | 157.7 | -46.5 | 176.4 | 0 | 0 | 0 | 106.8 | ||||
| 361 | N | 33.9 | Very low | 35 | Very low | 152 Ų | 152 | 142.2 Ų | 142.2 | 81% | 0.813 | 80% | 0.8 | S | S | * | * | trans | -109.8 | 142.8 | 166.5 | -133.2 | 7.4 | 0 | 0 | 0 | 107 | ||||
| 362 | S | 32.6 | Very low | 35.7 | Very low | 104 Ų | 104 | 146 Ų | 146 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | trans | 118.8 | 133.1 | 155.1 | -161.3 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 363 | T | 33.7 | Very low | 36 | Very low | 122 Ų | 122 | 149 Ų | 149 | 75% | 0.748 | 84% | 0.839 | S | S | * | * | S | Bend | trans | 78 | 71.6 | 165 | 74.5 | 0 | 0 | 0 | 0 | 118.4 | ||
| 364 | D | 34.2 | Very low | 36.1 | Very low | 130 Ų | 130 | 147.5 Ų | 147.5 | 70% | 0.695 | 84% | 0.837 | S | S | * | * | trans | -157.6 | 14.4 | 142.8 | -117.6 | -18.1 | 0 | 0 | 0 | 116.8 | ||||
| 365 | S | 38.1 | Very low | 36.2 | Very low | 119 Ų | 119 | 150 Ų | 150 | 83% | 0.832 | 85% | 0.847 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | 3.6 | -179 | -168.6 | 0 | 0 | 0 | 0 | 115.3 | ||
| 366 | E | 41.2 | Very low | 36.7 | Very low | 189 Ų | 189 | 151.1 Ų | 151.1 | 88% | 0.883 | 85% | 0.845 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | -11.6 | 177.5 | -71.6 | -98.1 | 137.1 | 0 | 0 | 112.7 | ||
| 367 | R | 39 | Very low | 37.1 | Very low | 200 Ų | 200 | 149.2 Ų | 149.2 | 76% | 0.755 | 85% | 0.845 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.5 | -11.1 | -171.7 | -159.6 | 170.5 | -177.2 | -148.1 | -1.4 | 115.3 | ||
| 368 | W | 37.3 | Very low | 37.5 | Very low | 237 Ų | 237 | 149.5 Ų | 149.5 | 90% | 0.898 | 84% | 0.843 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.5 | 8.9 | -173.1 | -85.3 | 92.7 | 0 | 0 | 0 | 115.8 | ||
| 369 | K | 42.1 | Very low | 38 | Very low | 204 Ų | 204 | 154.6 Ų | 154.6 | 89% | 0.887 | 85% | 0.849 | S | S | * | * | S | Bend | trans | -112 | 6.1 | 179.1 | -99.9 | -175.5 | 179 | 178.4 | 0 | 116.4 | ||
| 370 | A | 44.7 | Very low | 38.5 | Very low | 87 Ų | 87 | 157.6 Ų | 157.6 | 72% | 0.719 | 85% | 0.853 | S | S | * | * | S | Bend | trans | -114.8 | 27.2 | -175 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 371 | I | 47.1 | Very low | 39 | Very low | 152 Ų | 152 | 157 Ų | 157 | 78% | 0.779 | 85% | 0.853 | S | S | * | * | S | Bend | trans | -121.1 | 2.2 | 178.7 | -62.2 | -178.8 | 0 | 0 | 0 | 114.1 | ||
| 372 | N | 44 | Very low | 39.5 | Very low | 170 Ų | 170 | 157.4 Ų | 157.4 | 91% | 0.909 | 86% | 0.857 | S | S | * | * | trans | -131.6 | 67.3 | 170.5 | -76.4 | -24.6 | 0 | 0 | 0 | 111.8 | ||||
| 373 | A | 39.8 | Very low | 40.1 | Very low | 175 Ų | 175 | 162.3 Ų | 162.3 | 100% | 1.446 | 87% | 0.868 | S | S | * | * | trans | -135 | 0 | 161.3 | 0 | 0 | 0 | 0 | 0 | 109.1 |
Retrieved 373 of 373 residues in 885.1 ms
(Link to these results)