| 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 | 35.1 | Very low | 36.5 | Very low | 206 Ų | 206 | 117.5 Ų | 117.5 | 100% | 1.015 | 62% | 0.619 | S | S | * | * | 0 | -41.1 | 0 | -153.7 | 158.7 | 53.2 | 0 | 0 | 112 | L4 C5 | M1-L4 PolarHBondContact O-N 3.28Å; M1-C5 PolarHBondContact O-N 3.1Å | |||
| 2 | E | 36.1 | Very low | 37 | Very low | 162 Ų | 162 | 116.1 Ų | 116.1 | 76% | 0.757 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -68.4 | -38.6 | 172 | -61.1 | -170.2 | 152 | 0 | 0 | 113.5 | L4 C5 L6 | E2-L4 VanDerWaalsContact C-N 3.29Å; E2-L4 PolarHBondContact O-N 3.17Å; E2-C5 PolarHBondContact O-N 3.09Å; E2-L6 PolarHBondContact O-N 3.42Å; E2-L6 VanDerWaalsContact O-N 3.15Å |
| 3 | A | 29.1 | Very low | 37.5 | Very low | 68 Ų | 68 | 113.8 Ų | 113.8 | 56% | 0.562 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -67.3 | -26 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | R7 | A3-R7 WeakPolarHBondContact O-CB 3.3Å; A3-R7 VanDerWaalsContact O-CG 3.26Å; A3-R7 WeakPolarHBondContact O-CG 3.03Å; A3-R7 PolarHBondContact O-N 3.42Å |
| 4 | L | 34.6 | Very low | 37.4 | Very low | 121 Ų | 121 | 113.4 Ų | 113.4 | 63% | 0.634 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -74.6 | -32.7 | 176.2 | -157.5 | 79.3 | 0 | 0 | 0 | 110.7 | M1 E2 R7 V8 | M1-L4 PolarHBondContact O-N 3.28Å; E2-L4 VanDerWaalsContact C-N 3.29Å; E2-L4 PolarHBondContact O-N 3.17Å; L4-R7 PolarHBondContact O-N 3.26Å; L4-V8 VanDerWaalsContact O-CG2 3.26Å; L4-V8 WeakPolarHBondContact O-CG2 3.32Å; L4-V8 PolarHBondContact O-N 3.19Å |
| 5 | C | 38.7 | Very low | 37.4 | Very low | 61 Ų | 61 | 111.1 Ų | 111.1 | 41% | 0.412 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -76.9 | -35.9 | 179.7 | -155.5 | 0 | 0 | 0 | 0 | 112.1 | M1 E2 R7 V8 S9 | M1-C5 PolarHBondContact O-N 3.1Å; E2-C5 PolarHBondContact O-N 3.09Å; C5-R7 VanDerWaalsContact C-N 3.32Å; C5-V8 PolarHBondContact O-N 2.8Å; C5-S9 WeakPolarHBondContact O-CB 3.39Å; C5-S9 PolarHBondContact O-N 3.12Å; C5-S9 PolarHBondContact O-OG 2.93Å |
| 6 | L | 38.1 | Very low | 37.1 | Very low | 125 Ų | 125 | 108.9 Ų | 108.9 | 65% | 0.654 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -64 | -39.9 | 169.2 | -140.8 | 90.5 | 0 | 0 | 0 | 110.9 | E2 L10 | E2-L6 PolarHBondContact O-N 3.42Å; E2-L6 VanDerWaalsContact O-N 3.15Å; L6-L10 WeakPolarHBondContact O-CB 3.42Å; L6-L10 PolarHBondContact O-N 3.2Å |
| 7 | R | 36 | Very low | 36.6 | Very low | 179 Ų | 179 | 112.8 Ų | 112.8 | 68% | 0.675 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -67.9 | -40.6 | 176.1 | -77.2 | 179.6 | 179.8 | -139.5 | 1.1 | 113.2 | A3 L4 C5 L10 L11 | A3-R7 WeakPolarHBondContact O-CB 3.3Å; A3-R7 VanDerWaalsContact O-CG 3.26Å; A3-R7 WeakPolarHBondContact O-CG 3.03Å; A3-R7 PolarHBondContact O-N 3.42Å; L4-R7 PolarHBondContact O-N 3.26Å; C5-R7 VanDerWaalsContact C-N 3.32Å; R7-L10 PolarHBondContact O-N 3.15Å; R7-L11 VanDerWaalsContact O-CB 3.23Å; R7-L11 WeakPolarHBondContact O-CB 3.49Å; R7-L11 WeakPolarHBondContact O-CD1 3.06Å; R7-L11 VanDerWaalsContact O-CG 3.31Å; R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.12Å |
| 8 | V | 40.2 | Very low | 36 | Very low | 69 Ų | 69 | 112 Ų | 112 | 42% | 0.418 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -69.9 | -37.3 | 176.2 | 171 | 0 | 0 | 0 | 0 | 111.4 | L4 C5 L11 L12 | L4-V8 VanDerWaalsContact O-CG2 3.26Å; L4-V8 WeakPolarHBondContact O-CG2 3.32Å; L4-V8 PolarHBondContact O-N 3.19Å; C5-V8 PolarHBondContact O-N 2.8Å; V8-L11 PolarHBondContact O-N 3.16Å; V8-L12 WeakPolarHBondContact O-CG 3.35Å; V8-L12 PolarHBondContact O-N 3.44Å; V8-L12 VanDerWaalsContact O-N 3.15Å |
| 9 | S | 36.4 | Very low | 35.4 | Very low | 63 Ų | 63 | 114.7 Ų | 114.7 | 44% | 0.441 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -67.2 | -38.6 | 173.6 | -53.9 | 0 | 0 | 0 | 0 | 111.4 | C5 L13 | C5-S9 WeakPolarHBondContact O-CB 3.39Å; C5-S9 PolarHBondContact O-N 3.12Å; C5-S9 PolarHBondContact O-OG 2.93Å; S9-L13 WeakPolarHBondContact O-CD1 3.37Å; S9-L13 WeakPolarHBondContact O-CG 3.49Å |
| 10 | L | 38 | Very low | 34.9 | Very low | 103 Ų | 103 | 114.7 Ų | 114.7 | 54% | 0.539 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -69.6 | -36.3 | 172 | -110.5 | 83.8 | 0 | 0 | 0 | 113.5 | L6 R7 L12 L13 V14 | L6-L10 WeakPolarHBondContact O-CB 3.42Å; L6-L10 PolarHBondContact O-N 3.2Å; R7-L10 PolarHBondContact O-N 3.15Å; L10-L12 VanDerWaalsContact C-N 3.25Å; L10-L12 PolarHBondContact O-N 2.85Å; L10-L13 WeakPolarHBondContact O-CA 3.42Å; L10-L13 WeakPolarHBondContact O-CB 3.3Å; L10-L13 PolarHBondContact O-N 2.65Å; L10-V14 PolarHBondContact O-N 2.9Å |
| 11 | L | 39.7 | Very low | 34.4 | Very low | 135 Ų | 135 | 116.5 Ų | 116.5 | 71% | 0.707 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -67.4 | -26.7 | 178.6 | -88.8 | 155.4 | 0 | 0 | 0 | 112.3 | R7 V8 L13 | R7-L11 VanDerWaalsContact O-CB 3.23Å; R7-L11 WeakPolarHBondContact O-CB 3.49Å; R7-L11 WeakPolarHBondContact O-CD1 3.06Å; R7-L11 VanDerWaalsContact O-CG 3.31Å; R7-L11 WeakPolarHBondContact O-CG 3.47Å; R7-L11 PolarHBondContact O-N 3.12Å; V8-L11 PolarHBondContact O-N 3.16Å; L11-L13 VanDerWaalsContact C-N 3.3Å |
| 12 | L | 42.7 | Very low | 33.9 | Very low | 101 Ų | 101 | 112 Ų | 112 | 53% | 0.529 | 65% | 0.646 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.1 | -5.4 | 170.5 | -68.7 | 170.3 | 0 | 0 | 0 | 113.3 | V8 L10 | V8-L12 WeakPolarHBondContact O-CG 3.35Å; V8-L12 PolarHBondContact O-N 3.44Å; V8-L12 VanDerWaalsContact O-N 3.15Å; L10-L12 VanDerWaalsContact C-N 3.25Å; L10-L12 PolarHBondContact O-N 2.85Å |
| 13 | L | 42.8 | Very low | 33.3 | Very low | 87 Ų | 87 | 108.9 Ų | 108.9 | 46% | 0.455 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -105.3 | -4.9 | -175.4 | -74.5 | 168 | 0 | 0 | 0 | 114.5 | S9 L10 L11 L206 | S9-L13 WeakPolarHBondContact O-CD1 3.37Å; S9-L13 WeakPolarHBondContact O-CG 3.49Å; L10-L13 WeakPolarHBondContact O-CA 3.42Å; L10-L13 WeakPolarHBondContact O-CB 3.3Å; L10-L13 PolarHBondContact O-N 2.65Å; L11-L13 VanDerWaalsContact C-N 3.3Å; L13-L206 HydrophobicContact CD2-CD2 3.5Å |
| 14 | V | 36.6 | Very low | 33.2 | Very low | 107 Ų | 107 | 110.9 Ų | 110.9 | 65% | 0.648 | 64% | 0.643 | S | S | * | * | trans | -101.8 | 111.5 | 176.9 | -176.2 | 0 | 0 | 0 | 0 | 109.1 | L10 G16 | L10-V14 PolarHBondContact O-N 2.9Å; V14-G16 PolarHBondContact O-N 3.09Å | ||
| 15 | P | 36.4 | Very low | 32.8 | Very low | 80 Ų | 80 | 114.8 Ų | 114.8 | 52% | 0.519 | 65% | 0.65 | S | S | . | * | trans | -65.4 | 118 | 162.8 | 1.5 | 13 | 0 | 0 | 0 | 106.7 | F17 | P15-F17 PolarHBondContact O-N 3.06Š| ||
| 16 | G | 33.4 | Very low | 32.2 | Very low | 76 Ų | 76 | 119.6 Ų | 119.6 | 78% | 0.784 | 67% | 0.671 | S | S | * | * | trans | -60.3 | 97.4 | 173 | 0 | 0 | 0 | 0 | 0 | 110.2 | V14 A18 | V14-G16 PolarHBondContact O-N 3.09Å; G16-A18 VanDerWaalsContact C-N 3.34Å; G16-A18 PolarHBondContact O-N 3.16Å | ||
| 17 | F | 28 | Very low | 31.6 | Very low | 174 Ų | 174 | 119.8 Ų | 119.8 | 76% | 0.763 | 68% | 0.678 | S | S | * | * | trans | -76 | 94.9 | 155.9 | -82.8 | -82.6 | 0 | 0 | 0 | 106.8 | P15 L19 | P15-F17 PolarHBondContact O-N 3.06Å; F17-L19 VanDerWaalsContact C-N 3.28Å; F17-L19 PolarHBondContact O-N 2.86Å | ||
| 18 | A | 26.3 | Very low | 31.2 | Very low | 99 Ų | 99 | 115.5 Ų | 115.5 | 82% | 0.818 | 68% | 0.68 | S | S | * | * | trans | -67.1 | 94.9 | 159.9 | 0 | 0 | 0 | 0 | 0 | 107.3 | G16 S20 | G16-A18 VanDerWaalsContact C-N 3.34Å; G16-A18 PolarHBondContact O-N 3.16Å; A18-S20 PolarHBondContact O-N 3.14Å | ||
| 19 | L | 25.3 | Very low | 30.5 | Very low | 164 Ų | 164 | 119.5 Ų | 119.5 | 86% | 0.859 | 70% | 0.7 | S | S | * | * | trans | -67.1 | 108.1 | 156.5 | -82.3 | 162.4 | 0 | 0 | 0 | 106.2 | F17 D21 | F17-L19 VanDerWaalsContact C-N 3.28Å; F17-L19 PolarHBondContact O-N 2.86Å; L19-D21 PolarHBondContact O-N 2.84Å; L19-D21 VanDerWaalsContact O-N 3.09Å | ||
| 20 | S | 25.1 | Very low | 29.9 | Very low | 114 Ų | 114 | 127.8 Ų | 127.8 | 80% | 0.797 | 72% | 0.721 | S | S | * | * | trans | -70.5 | 98.7 | 167.9 | -171.5 | 0 | 0 | 0 | 0 | 107.4 | A18 | A18-S20 PolarHBondContact O-N 3.14Š| ||
| 21 | D | 24.1 | Very low | 29.3 | Very low | 153 Ų | 153 | 127.4 Ų | 127.4 | 82% | 0.818 | 73% | 0.727 | S | S | * | * | trans | -81.1 | 111.3 | 164.6 | -155.2 | 1.2 | 0 | 0 | 0 | 107.1 | L19 | L19-D21 PolarHBondContact O-N 2.84Å; L19-D21 VanDerWaalsContact O-N 3.09Å | ||
| 22 | S | 25 | Very low | 28.7 | Very low | 111 Ų | 111 | 129.3 Ų | 129.3 | 78% | 0.776 | 73% | 0.733 | S | S | * | * | trans | -131.5 | 91.2 | 162.4 | 78.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 23 | S | 23.5 | Very low | 27.8 | Very low | 96 Ų | 96 | 132.7 Ų | 132.7 | 67% | 0.671 | 75% | 0.75 | S | S | * | * | trans | -103.6 | 115.3 | 155.2 | 178.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 24 | D | 27.2 | Very low | 26.9 | Very low | 110 Ų | 110 | 131.4 Ų | 131.4 | 59% | 0.588 | 76% | 0.758 | S | S | * | * | -176.6 | 108.6 | 128 | -96.7 | -11.8 | 0 | 0 | 0 | 107.8 | |||||
| 25 | R | 26.5 | Very low | 26.6 | Very low | 203 Ų | 203 | 133.6 Ų | 133.6 | 77% | 0.766 | 77% | 0.766 | S | S | * | * | 88.1 | 102.7 | 95.7 | -95.5 | -173.7 | -94.5 | -170.2 | 0.2 | 110.7 | |||||
| 26 | D | 25.4 | Very low | 26 | Very low | 162 Ų | 162 | 140.8 Ų | 140.8 | 87% | 0.866 | 79% | 0.785 | S | S | * | * | trans | -140.5 | 118.7 | 135.9 | -95.4 | -34.2 | 0 | 0 | 0 | 110.5 | ||||
| 27 | T | 25.6 | Very low | 25.7 | Very low | 130 Ų | 130 | 144.8 Ų | 144.8 | 80% | 0.798 | 79% | 0.787 | S | S | * | * | trans | -29.6 | 134.9 | 161.6 | 28 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 28 | A | 26.9 | Very low | 25.8 | Very low | 88 Ų | 88 | 142 Ų | 142 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | 159.5 | 120.6 | 99.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 29 | N | 25.2 | Very low | 25.7 | Very low | 154 Ų | 154 | 143.2 Ų | 143.2 | 82% | 0.824 | 78% | 0.784 | S | S | * | * | trans | 49.4 | 114.1 | 135.6 | -74.3 | -8.5 | 0 | 0 | 0 | 120.6 | ||||
| 30 | R | 25.3 | Very low | 25.6 | Very low | 237 Ų | 237 | 145.1 Ų | 145.1 | 89% | 0.894 | 79% | 0.785 | S | S | * | * | 140.9 | 129.4 | 92.7 | -144.9 | 169.6 | -174.5 | 176.2 | -0.4 | 111.4 | |||||
| 31 | S | 24.4 | Very low | 25.6 | Very low | 95 Ų | 95 | 144 Ų | 144 | 66% | 0.664 | 78% | 0.778 | S | S | * | * | trans | -74.2 | 162.6 | 174.4 | 48.6 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 32 | E | 26.6 | Very low | 25.5 | Very low | 175 Ų | 175 | 140.1 Ų | 140.1 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | 90.9 | 145.4 | 151.3 | -73.2 | -177.6 | 142.8 | 0 | 0 | 121.9 | ||||
| 33 | L | 24.7 | Very low | 25.4 | Very low | 171 Ų | 171 | 142.4 Ų | 142.4 | 90% | 0.895 | 78% | 0.775 | S | S | * | * | trans | 76.7 | 129 | 163.6 | -110.4 | 63.7 | 0 | 0 | 0 | 116 | ||||
| 34 | G | 23.6 | Very low | 25.5 | Very low | 60 Ų | 60 | 146.3 Ų | 146.3 | 62% | 0.619 | 78% | 0.783 | S | S | * | * | cis | 138.4 | 134.9 | 22.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 35 | N | 29.9 | Very low | 25.4 | Very low | 154 Ų | 154 | 146.6 Ų | 146.6 | 82% | 0.824 | 79% | 0.794 | S | S | * | * | trans | -28.7 | 131.8 | 175.7 | -63.4 | -29 | 0 | 0 | 0 | 115.5 | ||||
| 36 | Y | 24.7 | Very low | 25.6 | Very low | 231 Ų | 231 | 141.9 Ų | 141.9 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | -155.9 | 109.6 | 142.7 | -82.8 | -70.2 | 0 | 0 | 0 | 110.9 | ||||
| 37 | L | 26.2 | Very low | 25.7 | Very low | 159 Ų | 159 | 139.6 Ų | 139.6 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | trans | -70 | 148.1 | 144.2 | -103.9 | 136.7 | 0 | 0 | 0 | 107.6 | ||||
| 38 | P | 30.6 | Very low | 26 | Very low | 116 Ų | 116 | 141.5 Ų | 141.5 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | -142.3 | 153.8 | 106 | 31.7 | -14.4 | 0 | 0 | 0 | 115.1 | |||||
| 39 | T | 24.9 | Very low | 25.9 | Very low | 125 Ų | 125 | 144 Ų | 144 | 77% | 0.767 | 80% | 0.795 | S | S | * | * | trans | -45.9 | 138.4 | 159.8 | 21.5 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 40 | F | 23.1 | Very low | 26.1 | Very low | 203 Ų | 203 | 142.4 Ų | 142.4 | 89% | 0.89 | 79% | 0.791 | S | S | * | * | trans | -154.9 | 151.1 | 134.8 | -141.3 | -99.6 | 0 | 0 | 0 | 112.4 | ||||
| 41 | S | 23.5 | Very low | 26.2 | Very low | 92 Ų | 92 | 137.3 Ų | 137.3 | 64% | 0.643 | 79% | 0.786 | S | S | * | * | trans | -94.8 | 145.9 | -157.6 | 47.7 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 42 | G | 22.5 | Very low | 26.5 | Very low | 70 Ų | 70 | 144.1 Ų | 144.1 | 72% | 0.722 | 80% | 0.797 | S | S | * | * | trans | 73.5 | 121 | 134 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 43 | I | 24 | Very low | 26.7 | Very low | 159 Ų | 159 | 144 Ų | 144 | 82% | 0.815 | 80% | 0.797 | S | S | * | * | 171.1 | 129.9 | 110.1 | -82.3 | 158.6 | 0 | 0 | 0 | 109.6 | |||||
| 44 | E | 25.9 | Very low | 26.9 | Very low | 178 Ų | 178 | 141.2 Ų | 141.2 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | trans | 35.4 | 125.5 | 156.6 | -65.6 | -179.6 | 154 | 0 | 0 | 122 | ||||
| 45 | S | 24.7 | Very low | 27.3 | Very low | 116 Ų | 116 | 146.4 Ų | 146.4 | 81% | 0.811 | 80% | 0.802 | S | S | * | * | -172.3 | 122.4 | 123 | -81.2 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 46 | A | 30.6 | Very low | 27.5 | Very low | 105 Ų | 105 | 144.9 Ų | 144.9 | 87% | 0.868 | 80% | 0.798 | S | S | * | * | trans | -74.1 | 117.5 | 160.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 47 | V | 26.4 | Very low | 28 | Very low | 113 Ų | 113 | 137.1 Ų | 137.1 | 69% | 0.685 | 78% | 0.777 | S | S | * | * | trans | -143.7 | 114.2 | 159.1 | -178.1 | 0 | 0 | 0 | 0 | 109.9 | L49 | V47-L49 HydrophobicContact CG1-CD1 4.04Å; V47-L49 PolarHBondContact O-N 3.36Å | ||
| 48 | L | 32.2 | Very low | 28.7 | Very low | 170 Ų | 170 | 137.1 Ų | 137.1 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | trans | -60.3 | 112.9 | 164.6 | -165.1 | 89.9 | 0 | 0 | 0 | 109.2 | ||||
| 49 | L | 26.1 | Very low | 29.3 | Very low | 142 Ų | 142 | 139.3 Ų | 139.3 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | trans | -139.7 | 102.2 | 166.7 | -112.6 | 147.1 | 0 | 0 | 0 | 109.6 | V47 T51 | V47-L49 HydrophobicContact CG1-CD1 4.04Å; V47-L49 PolarHBondContact O-N 3.36Å; L49-T51 PolarHBondContact O-N 2.85Å; L49-T51 VanDerWaalsContact O-N 3.11Å | ||
| 50 | T | 27.6 | Very low | 30.7 | Very low | 120 Ų | 120 | 139.1 Ų | 139.1 | 74% | 0.736 | 78% | 0.777 | S | S | * | * | trans | -46 | 107.5 | 168.2 | 38.7 | 0 | 0 | 0 | 0 | 111.4 | R52 | T50-R52 PolarHBondContact O-N 3.28Š| ||
| 51 | T | 29.2 | Very low | 32.5 | Very low | 130 Ų | 130 | 132.6 Ų | 132.6 | 80% | 0.798 | 75% | 0.754 | S | S | * | * | trans | -69.6 | 93.9 | 166.6 | -43.3 | 0 | 0 | 0 | 0 | 108.7 | L49 Q53 | L49-T51 PolarHBondContact O-N 2.85Å; L49-T51 VanDerWaalsContact O-N 3.11Å; T51-Q53 PolarHBondContact O-N 2.85Å | ||
| 52 | R | 30.4 | Very low | 34.3 | Very low | 237 Ų | 237 | 137.2 Ų | 137.2 | 89% | 0.894 | 76% | 0.762 | S | S | * | * | trans | -64.9 | 101.8 | 159.5 | -82.2 | -174.7 | 178.6 | 177.1 | 0.4 | 107.6 | T50 | T50-R52 PolarHBondContact O-N 3.28Š| ||
| 53 | Q | 29.2 | Very low | 36.2 | Very low | 172 Ų | 172 | 135.4 Ų | 135.4 | 80% | 0.804 | 74% | 0.738 | S | S | * | * | trans | -62.7 | 131 | 159.9 | -74.2 | 175.1 | -27.3 | 0 | 0 | 108.4 | T51 L55 | T51-Q53 PolarHBondContact O-N 2.85Å; Q53-L55 PolarHBondContact O-N 3.37Å | ||
| 54 | P | 30.8 | Very low | 37.7 | Very low | 114 Ų | 114 | 133.6 Ų | 133.6 | 74% | 0.74 | 74% | 0.739 | S | S | * | * | trans | -71 | 113.8 | 165.8 | 27.7 | -28.2 | 0 | 0 | 0 | 107.9 | V56 | P54-V56 VanDerWaalsContact C-N 3.32Å; P54-V56 PolarHBondContact O-N 2.92Å | ||
| 55 | L | 30.3 | Very low | 39.4 | Very low | 169 Ų | 169 | 131.4 Ų | 131.4 | 89% | 0.885 | 73% | 0.729 | S | S | * | * | trans | -66.3 | 92.6 | 170.1 | -156.9 | 105.4 | 0 | 0 | 0 | 107.7 | Q53 S57 | Q53-L55 PolarHBondContact O-N 3.37Å; L55-S57 VanDerWaalsContact C-N 3.27Å; L55-S57 PolarHBondContact O-N 3.42Å | ||
| 56 | V | 35.2 | Very low | 41.1 | Very low | 121 Ų | 121 | 130 Ų | 130 | 73% | 0.733 | 71% | 0.71 | S | S | * | * | trans | -67.6 | 92.9 | 169.6 | 178.9 | 0 | 0 | 0 | 0 | 106.9 | P54 N58 | P54-V56 VanDerWaalsContact C-N 3.32Å; P54-V56 PolarHBondContact O-N 2.92Å; V56-N58 PolarHBondContact O-N 2.89Å | ||
| 57 | S | 35.6 | Very low | 42.7 | Very low | 68 Ų | 68 | 127.4 Ų | 127.4 | 48% | 0.476 | 68% | 0.683 | S | S | . | * | trans | -63.1 | 103.1 | 169.2 | -177.7 | 0 | 0 | 0 | 0 | 108 | L55 Q59 | L55-S57 VanDerWaalsContact C-N 3.27Å; L55-S57 PolarHBondContact O-N 3.42Å; S57-Q59 PolarHBondContact O-N 2.82Å; S57-Q59 WeakPolarHBondContact OG-CB 3.3Å; S57-Q59 VanDerWaalsContact OG-CG 3.31Å; S57-Q59 WeakPolarHBondContact OG-CG 3.47Å; S57-Q59 PolarHBondContact OG-OE1 3.25Å; S57-Q59 VanDerWaalsContact OG-OE1 3.06Å | ||
| 58 | N | 39.8 | Very low | 44.7 | Very low | 160 Ų | 160 | 129 Ų | 129 | 86% | 0.856 | 68% | 0.681 | S | S | * | * | trans | -72.1 | 52 | 165.4 | -113.5 | -7.3 | 0 | 0 | 0 | 109.6 | V56 T60 | V56-N58 PolarHBondContact O-N 2.89Å; N58-T60 PolarHBondContact O-N 3.36Å | ||
| 59 | Q | 44.4 | Very low | 46.9 | Very low | 162 Ų | 162 | 121.9 Ų | 121.9 | 76% | 0.757 | 64% | 0.644 | S | S | * | * | trans | -78.8 | 105.2 | 173.4 | -99.3 | 170.2 | -24.1 | 0 | 0 | 108.6 | S57 V61 | S57-Q59 PolarHBondContact O-N 2.82Å; S57-Q59 WeakPolarHBondContact OG-CB 3.3Å; S57-Q59 VanDerWaalsContact OG-CG 3.31Å; S57-Q59 WeakPolarHBondContact OG-CG 3.47Å; S57-Q59 PolarHBondContact OG-OE1 3.25Å; S57-Q59 VanDerWaalsContact OG-OE1 3.06Å; Q59-V61 PolarHBondContact O-N 3.05Å; Q59-V61 VanDerWaalsContact O-N 3.11Å | ||
| 60 | T | 54.2 | Low | 49.7 | Very low | 120 Ų | 120 | 118 Ų | 118 | 74% | 0.736 | 63% | 0.632 | S | S | * | * | trans | -57 | 113.3 | 163.5 | 30.8 | 0 | 0 | 0 | 0 | 108.6 | N58 K62 | N58-T60 PolarHBondContact O-N 3.36Å; T60-K62 PolarHBondContact O-N 3.25Å | ||
| 61 | V | 60.8 | Low | 52.4 | Low | 67 Ų | 67 | 119.2 Ų | 119.2 | 41% | 0.406 | 63% | 0.63 | S | S | . | * | trans | -58.1 | 109.9 | 178.6 | -179.7 | 0 | 0 | 0 | 0 | 108.7 | Q59 P332 R334 | Q59-V61 PolarHBondContact O-N 3.05Å; Q59-V61 VanDerWaalsContact O-N 3.11Å; V61-P332 HydrophobicContact CG1-CB 4.12Å; V61-R334 PolarHBondContact O-NH2 3.4Å | ||
| 62 | K | 61.3 | Low | 55.3 | Low | 188 Ų | 188 | 117.9 Ų | 117.9 | 82% | 0.817 | 62% | 0.621 | S | S | * | * | trans | -73.4 | 135.6 | 178.7 | -66.3 | -178 | -179.5 | 178.9 | 0 | 108.7 | T60 | T60-K62 PolarHBondContact O-N 3.25Š| ||
| 63 | C | 62.4 | Low | 58.2 | Low | 33 Ų | 33 | 108.4 Ų | 108.4 | 22% | 0.223 | 59% | 0.587 | C | S | . | * | trans | -63.6 | 142.2 | 176.3 | -76.2 | 0 | 0 | 0 | 0 | 111.8 | Q65 C335 | C63-Q65 VanDerWaalsContact C-N 3.32Å; C63-Q65 PolarHBondContact O-N 3.25Å; C63-C335 HydrophobicContact CB-CB 3.48Å; C63-C335 VanDerWaalsContact CB-CB 3.48Å; C63-C335 WeakPolarHBondContact CB-SG 3.49Å; C63-C335 WeakPolarHBondContact SG-CB 3.31Å; C63-C335 CovalentContact SG-SG 2.02Å; C63-C335 PolarHBondContact SG-SG 3.37Å | ||
| 64 | S | 55 | Low | 61.1 | Low | 120 Ų | 120 | 102.4 Ų | 102.4 | 84% | 0.839 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -66.9 | -30.9 | 176.3 | -169.8 | 0 | 0 | 0 | 0 | 112.8 | ||
| 65 | Q | 61 | Low | 64.1 | Low | 132 Ų | 132 | 105.3 Ų | 105.3 | 62% | 0.617 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -134.9 | 148.7 | -177.7 | -158.6 | 169.3 | 15.9 | 0 | 0 | 112 | C63 C335 | C63-Q65 VanDerWaalsContact C-N 3.32Å; C63-Q65 PolarHBondContact O-N 3.25Å; Q65-C335 VanDerWaalsContact O-CB 3.27Å; Q65-C335 WeakPolarHBondContact O-CB 3.18Å |
| 66 | Q | 60.8 | Low | 67.1 | Low | 88 Ų | 88 | 102.1 Ų | 102.1 | 41% | 0.411 | 54% | 0.538 | S | S | . | . | trans | -76.1 | 134.1 | 178.2 | -173.9 | 174.5 | 11.9 | 0 | 0 | 110.4 | K68 | Q66-K68 HydrophobicContact CB-CG 4.24Å; Q66-K68 HydrophobicContact CG-CG 4.02Å; Q66-K68 PolarHBondContact O-N 2.88Å | ||
| 67 | T | 63.6 | Low | 69.9 | Low | 49 Ų | 49 | 96.7 Ų | 96.7 | 30% | 0.301 | 51% | 0.505 | S | S | . | . | trans | -64.6 | 104.6 | 167.7 | 44.7 | 0 | 0 | 0 | 0 | 109.8 | C335 L338 S339 | T67-C335 HydrophobicContact CG2-CB 4.09Å; T67-C335 WeakPolarHBondContact CG2-O 3.01Å; T67-L338 HydrophobicContact CG2-CB 3.89Å; T67-L338 HydrophobicContact CG2-CD2 4Å; T67-L338 HydrophobicContact CG2-CG 3.98Å; T67-S339 WeakPolarHBondContact CA-OG 3.47Å | ||
| 68 | K | 69 | Low | 72.7 | Confident | 147 Ų | 147 | 94.7 Ų | 94.7 | 64% | 0.639 | 49% | 0.49 | S | S | * | . | trans | -118.9 | 125.1 | 177.6 | -70.3 | -173.4 | 179.8 | -177.2 | 0 | 109.4 | Q66 | Q66-K68 HydrophobicContact CB-CG 4.24Å; Q66-K68 HydrophobicContact CG-CG 4.02Å; Q66-K68 PolarHBondContact O-N 2.88Å | ||
| 69 | I | 77.9 | Confident | 75.4 | Confident | 20 Ų | 20 | 91.9 Ų | 91.9 | 10% | 0.103 | 48% | 0.478 | C | S | . | . | trans | -85.9 | 122 | 165.5 | -60.4 | 175.5 | 0 | 0 | 0 | 106.7 | E71 F73 K74 L135 L342 Y346 | I69-E71 PolarHBondContact O-N 3.47Å; I69-F73 HydrophobicContact CG2-CB 4.27Å; I69-F73 HydrophobicContact CG2-CD1 3.35Å; I69-F73 HydrophobicContact CG2-CE1 4.08Å; I69-F73 HydrophobicContact CG2-CG 4.16Å; I69-K74 HydrophobicContact CG2-CG 3.88Å; I69-L135 HydrophobicContact CD1-CD1 4.06Å; I69-L135 HydrophobicContact CG2-CD1 4.34Å; I69-L342 HydrophobicContact CD1-CB 4.39Å; I69-L342 HydrophobicContact CG1-CB 4.47Å; I69-Y346 HydrophobicContact CD1-CD2 4.25Å; I69-Y346 HydrophobicContact CD1-CE2 3.83Å | ||
| 70 | A | 84.4 | Confident | 77.8 | Confident | 61 Ų | 61 | 87.3 Ų | 87.3 | 50% | 0.504 | 46% | 0.461 | S | S | . | . | trans | -55.5 | 137.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111 | T72 F73 K74 | A70-T72 VanDerWaalsContact C-N 3.27Å; A70-T72 PolarHBondContact O-N 3.18Å; A70-F73 HydrophobicContact CB-CB 4.32Å; A70-F73 WeakPolarHBondContact O-CB 3.39Å; A70-F73 PolarHBondContact O-N 3.47Å; A70-K74 PolarHBondContact O-N 3.49Å; A70-K74 VanDerWaalsContact O-N 3.15Å | ||
| 71 | E | 85.4 | Confident | 79.8 | Confident | 146 Ų | 146 | 81.6 Ų | 81.6 | 68% | 0.682 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -60.4 | -40 | -179.5 | -66 | -171.4 | 156.9 | 0 | 0 | 111.8 | I69 F73 K74 Y75 | I69-E71 PolarHBondContact O-N 3.47Å; E71-F73 PolarHBondContact O-N 2.93Å; E71-K74 WeakPolarHBondContact O-CA 3.42Å; E71-K74 WeakPolarHBondContact O-CB 3.37Å; E71-K74 PolarHBondContact O-N 2.88Å; E71-Y75 WeakPolarHBondContact O-CD2 3.02Å; E71-Y75 PolarHBondContact O-N 3.14Å |
| 72 | T | 88.9 | Confident | 81.4 | Confident | 102 Ų | 102 | 81.3 Ų | 81.3 | 63% | 0.626 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -53.2 | -42.1 | 172.9 | -45.7 | 0 | 0 | 0 | 0 | 111.9 | A70 Y75 I76 | A70-T72 VanDerWaalsContact C-N 3.27Å; A70-T72 PolarHBondContact O-N 3.18Å; T72-Y75 PolarHBondContact O-N 3.1Å; T72-I76 HydrophobicContact CG2-CD1 3.94Å; T72-I76 VanDerWaalsContact O-CG1 3.27Å; T72-I76 WeakPolarHBondContact O-CG1 3.48Å; T72-I76 PolarHBondContact O-N 3.3Å |
| 73 | F | 91.6 | Very high | 83.1 | Confident | 38 Ų | 38 | 74.9 Ų | 74.9 | 17% | 0.167 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65.1 | -42.4 | 176.4 | 175.7 | -89.8 | 0 | 0 | 0 | 111.5 | I69 A70 E71 Y75 I76 N77 L135 P343 Y346 I347 | I69-F73 HydrophobicContact CG2-CB 4.27Å; I69-F73 HydrophobicContact CG2-CD1 3.35Å; I69-F73 HydrophobicContact CG2-CE1 4.08Å; I69-F73 HydrophobicContact CG2-CG 4.16Å; A70-F73 HydrophobicContact CB-CB 4.32Å; A70-F73 WeakPolarHBondContact O-CB 3.39Å; A70-F73 PolarHBondContact O-N 3.47Å; E71-F73 PolarHBondContact O-N 2.93Å; F73-Y75 VanDerWaalsContact C-N 3.35Å; F73-Y75 PolarHBondContact O-N 3.33Å; F73-I76 PolarHBondContact O-N 2.91Å; F73-N77 HydrophobicContact CD1-CB 4.45Å; F73-N77 HydrophobicContact CE1-CB 4.05Å; F73-N77 HydrophobicContact CZ-CB 4.14Å; F73-N77 WeakPolarHBondContact O-CB 3.31Å; F73-N77 PolarHBondContact O-N 3.19Å; F73-L135 HydrophobicContact CE1-CD1 4.43Å; F73-P343 HydrophobicContact CD1-CB 4.39Å; F73-P343 HydrophobicContact CD2-CB 4.11Å; F73-P343 HydrophobicContact CE1-CB 4.04Å; F73-P343 HydrophobicContact CE2-CB 3.76Å; F73-P343 HydrophobicContact CG-CB 4.41Å; F73-P343 HydrophobicContact CZ-CB 3.71Å; F73-P343 WeakPolarHBondContact CZ-O 3.16Å; F73-Y346 HydrophobicContact CE1-CD2 4.48Å; F73-Y346 HydrophobicContact CE1-CG 4.42Å; F73-I347 HydrophobicContact CE2-CD1 3.83Å; F73-I347 HydrophobicContact CE2-CG1 3.71Å; F73-I347 HydrophobicContact CZ-CD1 4.47Å; F73-I347 HydrophobicContact CZ-CG1 3.99Å |
| 74 | K | 91.8 | Very high | 84.7 | Confident | 46 Ų | 46 | 74 Ų | 74 | 20% | 0.2 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -57.6 | -48.8 | 177.7 | -62.2 | -177.5 | -178.3 | 178.5 | 0 | 110.9 | I69 A70 E71 N77 T78 L135 L136 | I69-K74 HydrophobicContact CG2-CG 3.88Å; A70-K74 PolarHBondContact O-N 3.49Å; A70-K74 VanDerWaalsContact O-N 3.15Å; E71-K74 WeakPolarHBondContact O-CA 3.42Å; E71-K74 WeakPolarHBondContact O-CB 3.37Å; E71-K74 PolarHBondContact O-N 2.88Å; K74-N77 PolarHBondContact O-N 3.33Å; K74-T78 WeakPolarHBondContact O-CB 3.45Å; K74-T78 PolarHBondContact O-N 3.45Å; K74-T78 PolarHBondContact O-OG1 3.48Å; K74-L135 HydrophobicContact CB-CG 4.38Å; K74-L135 HydrophobicContact CG-CD1 4.05Å; K74-L135 HydrophobicContact CG-CG 4.19Å; K74-L136 HydrophobicContact CB-CD2 4.44Å |
| 75 | Y | 92.8 | Very high | 86.7 | Confident | 174 Ų | 174 | 71.5 Ų | 71.5 | 68% | 0.682 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -60.7 | -49.7 | 178 | -81.8 | -77.1 | 0 | 0 | 0 | 112.5 | E71 T72 F73 N77 T78 V79 | E71-Y75 WeakPolarHBondContact O-CD2 3.02Å; E71-Y75 PolarHBondContact O-N 3.14Å; T72-Y75 PolarHBondContact O-N 3.1Å; F73-Y75 VanDerWaalsContact C-N 3.35Å; F73-Y75 PolarHBondContact O-N 3.33Å; Y75-N77 PolarHBondContact O-N 3.36Å; Y75-T78 PolarHBondContact O-N 3.29Å; Y75-V79 WeakPolarHBondContact O-CG2 3.47Å; Y75-V79 PolarHBondContact O-N 3.02Å |
| 76 | I | 94.2 | Very high | 88.3 | Confident | 103 Ų | 103 | 70.2 Ų | 70.2 | 53% | 0.528 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -59.7 | -49.2 | 179.5 | -67.7 | 168.1 | 0 | 0 | 0 | 110.3 | T72 F73 T78 V79 V80 | T72-I76 HydrophobicContact CG2-CD1 3.94Å; T72-I76 VanDerWaalsContact O-CG1 3.27Å; T72-I76 WeakPolarHBondContact O-CG1 3.48Å; T72-I76 PolarHBondContact O-N 3.3Å; F73-I76 PolarHBondContact O-N 2.91Å; I76-T78 VanDerWaalsContact C-N 3.35Å; I76-T78 PolarHBondContact O-N 3.09Å; I76-V79 PolarHBondContact O-N 3Å; I76-V80 HydrophobicContact CG2-CG2 4.5Å; I76-V80 WeakPolarHBondContact O-CG2 3.3Å; I76-V80 PolarHBondContact O-N 3.05Å |
| 77 | N | 93.6 | Very high | 90 | Very high | 6 Ų | 6 | 69.4 Ų | 69.4 | 3% | 0.032 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.5 | -42.2 | -178.5 | -170.5 | 90 | 0 | 0 | 0 | 111.6 | F73 K74 Y75 V80 S81 L135 N350 | F73-N77 HydrophobicContact CD1-CB 4.45Å; F73-N77 HydrophobicContact CE1-CB 4.05Å; F73-N77 HydrophobicContact CZ-CB 4.14Å; F73-N77 WeakPolarHBondContact O-CB 3.31Å; F73-N77 PolarHBondContact O-N 3.19Å; K74-N77 PolarHBondContact O-N 3.33Å; Y75-N77 PolarHBondContact O-N 3.36Å; N77-V80 PolarHBondContact O-N 2.89Å; N77-S81 WeakPolarHBondContact O-CB 3.42Å; N77-S81 PolarHBondContact O-N 3.32Å; N77-S81 PolarHBondContact O-OG 3.4Å; N77-L135 HydrophobicContact CB-CD2 3.82Å; N77-L135 VanDerWaalsContact ND2-CD2 3.3Å; N77-L135 WeakPolarHBondContact ND2-CD2 3.37Å; N77-N350 PolarHBondContact ND2-ND2 3.47Å; N77-N350 VanDerWaalsContact ND2-ND2 3.19Å; N77-N350 PolarHBondContact OD1-ND2 2.86Å |
| 78 | T | 94.6 | Very high | 91.5 | Very high | 26 Ų | 26 | 67.1 Ų | 67.1 | 16% | 0.16 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -61.8 | -44.7 | 176.5 | -66.2 | 0 | 0 | 0 | 0 | 111.9 | K74 Y75 I76 V80 S81 C82 V132 L136 | K74-T78 WeakPolarHBondContact O-CB 3.45Å; K74-T78 PolarHBondContact O-N 3.45Å; K74-T78 PolarHBondContact O-OG1 3.48Å; Y75-T78 PolarHBondContact O-N 3.29Å; I76-T78 VanDerWaalsContact C-N 3.35Å; I76-T78 PolarHBondContact O-N 3.09Å; T78-V80 VanDerWaalsContact C-N 3.35Å; T78-V80 PolarHBondContact O-N 2.95Å; T78-S81 PolarHBondContact O-N 2.68Å; T78-C82 PolarHBondContact O-N 3.29Å; T78-C82 PolarHBondContact O-SG 2.65Å; T78-V132 HydrophobicContact CG2-CG1 4Å; T78-L136 HydrophobicContact CG2-CD1 4.48Å |
| 79 | V | 95.6 | Very high | 92.8 | Very high | 101 Ų | 101 | 62.8 Ų | 62.8 | 61% | 0.612 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -61.5 | -44.5 | 177.3 | 172.1 | 0 | 0 | 0 | 0 | 111 | Y75 I76 C82 A83 | Y75-V79 WeakPolarHBondContact O-CG2 3.47Å; Y75-V79 PolarHBondContact O-N 3.02Å; I76-V79 PolarHBondContact O-N 3Å; V79-C82 PolarHBondContact O-N 2.79Å; V79-A83 PolarHBondContact O-N 3.1Å |
| 80 | V | 95.6 | Very high | 93.6 | Very high | 67 Ų | 67 | 65.6 Ų | 65.6 | 41% | 0.406 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.7 | -47.8 | 175.8 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | I76 N77 T78 C82 A83 I84 | I76-V80 HydrophobicContact CG2-CG2 4.5Å; I76-V80 WeakPolarHBondContact O-CG2 3.3Å; I76-V80 PolarHBondContact O-N 3.05Å; N77-V80 PolarHBondContact O-N 2.89Å; T78-V80 VanDerWaalsContact C-N 3.35Å; T78-V80 PolarHBondContact O-N 2.95Å; V80-C82 VanDerWaalsContact C-N 3.34Å; V80-C82 PolarHBondContact O-N 3.01Å; V80-A83 PolarHBondContact O-N 3.17Å; V80-I84 HydrophobicContact CG1-CD1 3.78Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 VanDerWaalsContact O-CG1 3.3Å; V80-I84 WeakPolarHBondContact O-CG1 3.41Å; V80-I84 PolarHBondContact O-N 3.36Å |
| 81 | S | 95.5 | Very high | 94 | Very high | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.5 | -41.6 | 177.2 | -61.8 | 0 | 0 | 0 | 0 | 112.3 | N77 T78 I84 F85 I128 N350 | N77-S81 WeakPolarHBondContact O-CB 3.42Å; N77-S81 PolarHBondContact O-N 3.32Å; N77-S81 PolarHBondContact O-OG 3.4Å; T78-S81 PolarHBondContact O-N 2.68Å; S81-I84 PolarHBondContact O-N 3.43Å; S81-F85 WeakPolarHBondContact O-CB 3.36Å; S81-F85 PolarHBondContact O-N 2.77Å; S81-I128 WeakPolarHBondContact O-CD1 3.4Å; S81-N350 VanDerWaalsContact OG-CG 3.27Å; S81-N350 PolarHBondContact OG-ND2 2.96Å; S81-N350 PolarHBondContact OG-OD1 3.49Å |
| 82 | C | 95.4 | Very high | 94.5 | Very high | 61 Ų | 61 | 56.4 Ų | 56.4 | 41% | 0.412 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.9 | -40.9 | 175.9 | -70.9 | 0 | 0 | 0 | 0 | 112.4 | T78 V79 V80 F85 I86 | T78-C82 PolarHBondContact O-N 3.29Å; T78-C82 PolarHBondContact O-SG 2.65Å; V79-C82 PolarHBondContact O-N 2.79Å; V80-C82 VanDerWaalsContact C-N 3.34Å; V80-C82 PolarHBondContact O-N 3.01Å; C82-F85 WeakPolarHBondContact O-CB 3.19Å; C82-F85 PolarHBondContact O-N 3.35Å; C82-I86 WeakPolarHBondContact O-CG1 3.47Å; C82-I86 PolarHBondContact O-N 2.95Å |
| 83 | A | 95.9 | Very high | 94.8 | Very high | 52 Ų | 52 | 53.8 Ų | 53.8 | 43% | 0.43 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.4 | -45.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | V79 V80 F85 I86 V87 | V79-A83 PolarHBondContact O-N 3.1Å; V80-A83 PolarHBondContact O-N 3.17Å; A83-F85 VanDerWaalsContact C-N 3.32Å; A83-F85 PolarHBondContact O-N 3.49Å; A83-I86 PolarHBondContact O-N 3.44Å; A83-V87 WeakPolarHBondContact O-CB 3.43Å; A83-V87 VanDerWaalsContact O-CG2 3.3Å; A83-V87 WeakPolarHBondContact O-CG2 3.4Å; A83-V87 PolarHBondContact O-N 2.93Å |
| 84 | I | 95.9 | Very high | 94.9 | Very high | 15 Ų | 15 | 53 Ų | 53 | 8% | 0.077 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -58.5 | -45.3 | 175.2 | -66.6 | 170.4 | 0 | 0 | 0 | 110.1 | V80 S81 I86 V87 G88 I128 N350 T353 M354 C357 | V80-I84 HydrophobicContact CG1-CD1 3.78Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 VanDerWaalsContact O-CG1 3.3Å; V80-I84 WeakPolarHBondContact O-CG1 3.41Å; V80-I84 PolarHBondContact O-N 3.36Å; S81-I84 PolarHBondContact O-N 3.43Å; I84-I86 PolarHBondContact O-N 3.04Å; I84-V87 PolarHBondContact O-N 3.45Å; I84-G88 PolarHBondContact O-N 3.44Å; I84-I128 HydrophobicContact CB-CD1 4.01Å; I84-I128 HydrophobicContact CG2-CD1 3.67Å; I84-N350 HydrophobicContact CD1-CB 4.14Å; I84-N350 WeakPolarHBondContact CD1-O 3.35Å; I84-T353 HydrophobicContact CG2-CG2 4.04Å; I84-M354 HydrophobicContact CD1-CB 4.29Å; I84-C357 WeakPolarHBondContact CG2-SG 3.18Å; I84-C357 PolarHBondContact O-SG 2.98Å |
| 85 | F | 96.6 | Very high | 94.9 | Very high | 68 Ų | 68 | 50.9 Ų | 50.9 | 30% | 0.298 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -57.1 | -51.7 | 177.8 | -175 | -96 | 0 | 0 | 0 | 112.2 | S81 C82 A83 M89 I124 I128 P129 | S81-F85 WeakPolarHBondContact O-CB 3.36Å; S81-F85 PolarHBondContact O-N 2.77Å; C82-F85 WeakPolarHBondContact O-CB 3.19Å; C82-F85 PolarHBondContact O-N 3.35Å; A83-F85 VanDerWaalsContact C-N 3.32Å; A83-F85 PolarHBondContact O-N 3.49Å; F85-M89 HydrophobicContact CD1-CG 4.23Å; F85-M89 HydrophobicContact CD2-CG 4.41Å; F85-M89 HydrophobicContact CE1-CG 3.99Å; F85-M89 HydrophobicContact CE2-CG 4.2Å; F85-M89 HydrophobicContact CG-CG 4.43Å; F85-M89 HydrophobicContact CZ-CG 3.98Å; F85-M89 VanDerWaalsContact O-CB 3.24Å; F85-M89 WeakPolarHBondContact O-CB 3.26Å; F85-M89 WeakPolarHBondContact O-CG 3.28Å; F85-M89 PolarHBondContact O-N 3.35Å; F85-I124 HydrophobicContact CD2-CG2 3.66Å; F85-I124 HydrophobicContact CE2-CG2 4.21Å; F85-I124 HydrophobicContact CG-CG2 4.38Å; F85-I128 HydrophobicContact CB-CD1 3.89Å; F85-I128 HydrophobicContact CB-CG2 4.17Å; F85-I128 HydrophobicContact CD2-CB 4.13Å; F85-I128 HydrophobicContact CD2-CD1 4.46Å; F85-I128 HydrophobicContact CD2-CG2 4.26Å; F85-P129 HydrophobicContact CE2-CG 4.43Å |
| 86 | I | 95.9 | Very high | 95 | Very high | 105 Ų | 105 | 44.7 Ų | 44.7 | 54% | 0.538 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.1 | -50.1 | -178 | -66 | 166.2 | 0 | 0 | 0 | 110.6 | C82 A83 I84 G88 M89 V90 | C82-I86 WeakPolarHBondContact O-CG1 3.47Å; C82-I86 PolarHBondContact O-N 2.95Å; A83-I86 PolarHBondContact O-N 3.44Å; I84-I86 PolarHBondContact O-N 3.04Å; I86-G88 PolarHBondContact O-N 2.92Å; I86-M89 PolarHBondContact O-N 3.49Å; I86-V90 HydrophobicContact CG2-CG2 4.46Å; I86-V90 WeakPolarHBondContact O-CB 3.39Å; I86-V90 VanDerWaalsContact O-CG2 3.3Å; I86-V90 WeakPolarHBondContact O-CG2 3.46Å; I86-V90 PolarHBondContact O-N 3.04Å |
| 87 | V | 95.5 | Very high | 94.9 | Very high | 71 Ų | 71 | 46.5 Ų | 46.5 | 43% | 0.43 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.8 | -45.4 | -178.4 | 173.8 | 0 | 0 | 0 | 0 | 110.8 | A83 I84 G91 C357 I361 | A83-V87 WeakPolarHBondContact O-CB 3.43Å; A83-V87 VanDerWaalsContact O-CG2 3.3Å; A83-V87 WeakPolarHBondContact O-CG2 3.4Å; A83-V87 PolarHBondContact O-N 2.93Å; I84-V87 PolarHBondContact O-N 3.45Å; V87-G91 PolarHBondContact O-N 2.91Å; V87-C357 HydrophobicContact CG1-CB 4.27Å; V87-I361 HydrophobicContact CG1-CD1 4.23Å |
| 88 | G | 95.6 | Very high | 94.7 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.7 | -43.6 | -180 | 0 | 0 | 0 | 0 | 0 | 113 | I84 I86 N92 C357 | I84-G88 PolarHBondContact O-N 3.44Å; I86-G88 PolarHBondContact O-N 2.92Å; G88-N92 WeakPolarHBondContact O-CB 3.48Å; G88-N92 PolarHBondContact O-N 3.24Å; G88-N92 PolarHBondContact O-ND2 3.14Å; G88-C357 WeakPolarHBondContact CA-SG 3.3Å |
| 89 | M | 95.9 | Very high | 94.5 | Very high | 57 Ų | 57 | 45.6 Ų | 45.6 | 28% | 0.281 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.7 | -52.9 | 176.1 | -74.7 | -61.6 | -62.2 | 0 | 0 | 111.5 | F85 I86 G91 A93 L121 I124 V125 | F85-M89 HydrophobicContact CD1-CG 4.23Å; F85-M89 HydrophobicContact CD2-CG 4.41Å; F85-M89 HydrophobicContact CE1-CG 3.99Å; F85-M89 HydrophobicContact CE2-CG 4.2Å; F85-M89 HydrophobicContact CG-CG 4.43Å; F85-M89 HydrophobicContact CZ-CG 3.98Å; F85-M89 VanDerWaalsContact O-CB 3.24Å; F85-M89 WeakPolarHBondContact O-CB 3.26Å; F85-M89 WeakPolarHBondContact O-CG 3.28Å; F85-M89 PolarHBondContact O-N 3.35Å; I86-M89 PolarHBondContact O-N 3.49Å; M89-G91 PolarHBondContact O-N 3.21Å; M89-A93 WeakPolarHBondContact O-CB 3.2Å; M89-A93 PolarHBondContact O-N 3.04Å; M89-L121 HydrophobicContact CE-CD2 4.1Å; M89-L121 HydrophobicContact SD-CD2 3.64Å; M89-I124 HydrophobicContact CG-CG2 4.28Å; M89-I124 HydrophobicContact SD-CG2 4.41Å; M89-V125 HydrophobicContact CE-CG2 4Å; M89-V125 HydrophobicContact SD-CG2 3.46Å; M89-V125 WeakPolarHBondContact SD-CG2 3.44Å |
| 90 | V | 94.8 | Very high | 94.1 | Very high | 78 Ų | 78 | 48.9 Ų | 48.9 | 47% | 0.473 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.4 | -45.5 | -178.5 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | I86 T94 L378 | I86-V90 HydrophobicContact CG2-CG2 4.46Å; I86-V90 WeakPolarHBondContact O-CB 3.39Å; I86-V90 VanDerWaalsContact O-CG2 3.3Å; I86-V90 WeakPolarHBondContact O-CG2 3.46Å; I86-V90 PolarHBondContact O-N 3.04Å; V90-T94 WeakPolarHBondContact O-CB 3.31Å; V90-T94 PolarHBondContact O-N 3.07Å; V90-T94 PolarHBondContact O-OG1 3.47Å; V90-L378 HydrophobicContact CG1-CD2 4.49Å |
| 91 | G | 93.9 | Very high | 93.7 | Very high | 15 Ų | 15 | 50.6 Ų | 50.6 | 16% | 0.155 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62 | -54 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V87 M89 T94 L95 | V87-G91 PolarHBondContact O-N 2.91Å; M89-G91 PolarHBondContact O-N 3.21Å; G91-T94 PolarHBondContact O-N 3.49Å; G91-L95 WeakPolarHBondContact O-CB 3.32Å; G91-L95 PolarHBondContact O-N 2.85Å |
| 92 | N | 95.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -71.3 | -37.5 | -176.9 | -71.1 | -65.8 | 0 | 0 | 0 | 112.5 | G88 T94 L95 L96 A117 L121 S356 P360 | G88-N92 WeakPolarHBondContact O-CB 3.48Å; G88-N92 PolarHBondContact O-N 3.24Å; G88-N92 PolarHBondContact O-ND2 3.14Å; N92-T94 PolarHBondContact O-N 2.98Å; N92-L95 PolarHBondContact O-N 3.05Å; N92-L96 WeakPolarHBondContact O-CG 3.48Å; N92-L96 PolarHBondContact O-N 3.42Å; N92-A117 HydrophobicContact CB-CB 4.36Å; N92-L121 HydrophobicContact CB-CD1 4.28Å; N92-L121 HydrophobicContact CB-CD2 3.74Å; N92-L121 HydrophobicContact CB-CG 3.65Å; N92-S356 PolarHBondContact ND2-O 2.86Å; N92-P360 HydrophobicContact CB-CG 4.49Å; N92-P360 VanDerWaalsContact OD1-CG 3.32Å; N92-P360 WeakPolarHBondContact OD1-CG 3.26Å |
| 93 | A | 95.1 | Very high | 92.5 | Very high | 47 Ų | 47 | 57.9 Ų | 57.9 | 39% | 0.388 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64 | -40.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | M89 L96 R97 | M89-A93 WeakPolarHBondContact O-CB 3.2Å; M89-A93 PolarHBondContact O-N 3.04Å; A93-L96 PolarHBondContact O-N 3.32Å; A93-R97 WeakPolarHBondContact O-CB 3.37Å; A93-R97 PolarHBondContact O-N 2.93Å |
| 94 | T | 92.8 | Very high | 91.7 | Very high | 20 Ų | 20 | 60 Ų | 60 | 12% | 0.123 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 175.5 | -58.8 | 0 | 0 | 0 | 0 | 111.3 | V90 G91 N92 R97 I98 F374 C377 L378 | V90-T94 WeakPolarHBondContact O-CB 3.31Å; V90-T94 PolarHBondContact O-N 3.07Å; V90-T94 PolarHBondContact O-OG1 3.47Å; G91-T94 PolarHBondContact O-N 3.49Å; N92-T94 PolarHBondContact O-N 2.98Å; T94-R97 WeakPolarHBondContact O-CB 3.35Å; T94-R97 PolarHBondContact O-N 3.49Å; T94-I98 HydrophobicContact CG2-CD1 3.93Å; T94-I98 HydrophobicContact CG2-CG1 4.41Å; T94-I98 VanDerWaalsContact O-CG1 3.3Å; T94-I98 WeakPolarHBondContact O-CG1 3.33Å; T94-I98 PolarHBondContact O-N 2.98Å; T94-F374 HydrophobicContact CG2-CD1 3.71Å; T94-F374 HydrophobicContact CG2-CE1 3.79Å; T94-C377 HydrophobicContact CG2-CB 4.05Å; T94-L378 HydrophobicContact CG2-CD2 4.24Å; T94-L378 HydrophobicContact CG2-CG 4.33Å |
| 95 | L | 92.6 | Very high | 90.9 | Very high | 2 Ų | 2 | 59.4 Ų | 59.4 | 1% | 0.01 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.9 | -47.1 | 176.4 | -179.8 | 56.9 | 0 | 0 | 0 | 111.8 | G91 N92 R97 I98 I99 I113 A117 P360 L363 F370 F374 | G91-L95 WeakPolarHBondContact O-CB 3.32Å; G91-L95 PolarHBondContact O-N 2.85Å; N92-L95 PolarHBondContact O-N 3.05Å; L95-R97 PolarHBondContact O-N 3.03Å; L95-I98 PolarHBondContact O-N 3.49Å; L95-I99 HydrophobicContact CD1-CD1 4.02Å; L95-I99 HydrophobicContact CG-CD1 4.2Å; L95-I99 WeakPolarHBondContact O-CG1 3.48Å; L95-I99 PolarHBondContact O-N 3.47Å; L95-I99 VanDerWaalsContact O-N 3.14Å; L95-I113 HydrophobicContact CD1-CG2 4.18Å; L95-I113 HydrophobicContact CD2-CG2 3.81Å; L95-I113 HydrophobicContact CG-CG2 4.24Å; L95-A117 HydrophobicContact CD2-CB 3.98Å; L95-A117 HydrophobicContact CG-CB 4.41Å; L95-P360 HydrophobicContact CD2-CG 4.25Å; L95-L363 HydrophobicContact CD1-CD1 4.13Å; L95-L363 HydrophobicContact CD2-CD1 3.79Å; L95-F370 HydrophobicContact CD1-CD1 3.98Å; L95-F370 HydrophobicContact CD1-CE1 3.72Å; L95-F374 HydrophobicContact CB-CE1 4.49Å; L95-F374 HydrophobicContact CB-CZ 4.02Å; L95-F374 HydrophobicContact CD1-CE2 4.29Å; L95-F374 HydrophobicContact CD1-CZ 3.96Å |
| 96 | L | 93.9 | Very high | 90.3 | Very high | 44 Ų | 44 | 60.6 Ų | 60.6 | 23% | 0.23 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60 | -44.8 | 174.4 | -73.6 | 177.8 | 0 | 0 | 0 | 111.7 | N92 A93 I98 I99 Y100 A114 A117 L121 | N92-L96 WeakPolarHBondContact O-CG 3.48Å; N92-L96 PolarHBondContact O-N 3.42Å; A93-L96 PolarHBondContact O-N 3.32Å; L96-I98 PolarHBondContact O-N 3.07Å; L96-I99 PolarHBondContact O-N 3.37Å; L96-Y100 VanDerWaalsContact O-CB 3.31Å; L96-Y100 WeakPolarHBondContact O-CB 3.49Å; L96-Y100 PolarHBondContact O-N 3.2Å; L96-A114 HydrophobicContact CD2-CB 3.84Å; L96-A114 WeakPolarHBondContact CD2-O 3.47Å; L96-A117 HydrophobicContact CD2-CB 3.99Å; L96-A117 HydrophobicContact CG-CB 3.98Å; L96-L121 HydrophobicContact CD1-CD1 3.53Å |
| 97 | R | 92.3 | Very high | 89.8 | Confident | 142 Ų | 142 | 57.1 Ų | 57.1 | 54% | 0.536 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -59.2 | -44.7 | 177 | -177.3 | 179.6 | 177.7 | 176 | 0.9 | 111.9 | A93 T94 L95 I99 Y100 Q101 | A93-R97 WeakPolarHBondContact O-CB 3.37Å; A93-R97 PolarHBondContact O-N 2.93Å; T94-R97 WeakPolarHBondContact O-CB 3.35Å; T94-R97 PolarHBondContact O-N 3.49Å; L95-R97 PolarHBondContact O-N 3.03Å; R97-I99 PolarHBondContact O-N 2.74Å; R97-Y100 PolarHBondContact O-N 2.77Å; R97-Q101 HydrophobicContact CG-CG 4.21Å; R97-Q101 WeakPolarHBondContact O-CB 3.47Å; R97-Q101 VanDerWaalsContact O-CG 3.32Å; R97-Q101 WeakPolarHBondContact O-CG 3.22Å; R97-Q101 PolarHBondContact O-N 3Å |
| 98 | I | 89.5 | Confident | 89.2 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.7 | -47 | 178.6 | -73.8 | 165.1 | 0 | 0 | 0 | 111 | T94 L95 L96 N102 F370 C373 F374 C377 | T94-I98 HydrophobicContact CG2-CD1 3.93Å; T94-I98 HydrophobicContact CG2-CG1 4.41Å; T94-I98 VanDerWaalsContact O-CG1 3.3Å; T94-I98 WeakPolarHBondContact O-CG1 3.33Å; T94-I98 PolarHBondContact O-N 2.98Å; L95-I98 PolarHBondContact O-N 3.49Å; L96-I98 PolarHBondContact O-N 3.07Å; I98-N102 WeakPolarHBondContact O-CB 3.35Å; I98-N102 PolarHBondContact O-N 2.91Å; I98-N102 VanDerWaalsContact O-N 3.12Å; I98-N102 PolarHBondContact O-ND2 2.84Å; I98-F370 HydrophobicContact CG2-CD1 4.47Å; I98-C373 HydrophobicContact CB-CB 4.46Å; I98-C373 HydrophobicContact CD1-CB 4.01Å; I98-C373 HydrophobicContact CG1-CB 4.1Å; I98-C373 HydrophobicContact CG2-CB 3.52Å; I98-F374 HydrophobicContact CD1-CB 4.31Å; I98-F374 HydrophobicContact CD1-CD1 3.55Å; I98-F374 HydrophobicContact CD1-CD2 4.05Å; I98-F374 HydrophobicContact CD1-CE1 3.79Å; I98-F374 HydrophobicContact CD1-CE2 4.26Å; I98-F374 HydrophobicContact CD1-CG 3.68Å; I98-F374 HydrophobicContact CD1-CZ 4.13Å; I98-C377 HydrophobicContact CG1-CB 4.4Å |
| 99 | I | 89.8 | Confident | 88.7 | Confident | 13 Ų | 13 | 54.4 Ų | 54.4 | 7% | 0.067 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -68.8 | -39.5 | -178.5 | -64.3 | 165.5 | 0 | 0 | 0 | 110.4 | L95 L96 R97 R106 I113 A114 F370 | L95-I99 HydrophobicContact CD1-CD1 4.02Å; L95-I99 HydrophobicContact CG-CD1 4.2Å; L95-I99 WeakPolarHBondContact O-CG1 3.48Å; L95-I99 PolarHBondContact O-N 3.47Å; L95-I99 VanDerWaalsContact O-N 3.14Å; L96-I99 PolarHBondContact O-N 3.37Å; R97-I99 PolarHBondContact O-N 2.74Å; I99-R106 WeakPolarHBondContact O-CG 3.36Å; I99-I113 HydrophobicContact CD1-CG2 4.09Å; I99-A114 HydrophobicContact CD1-CB 4.04Å; I99-A114 HydrophobicContact CG2-CB 4.39Å; I99-F370 HydrophobicContact CD1-CE1 4.41Å; I99-F370 HydrophobicContact CG1-CE1 4.18Å |
| 100 | Y | 88.8 | Confident | 88.3 | Confident | 170 Ų | 170 | 52.4 Ų | 52.4 | 67% | 0.667 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -64.7 | -50 | 176.4 | -178.2 | -100.5 | 0 | 0 | 0 | 111.4 | L96 R97 R106 | L96-Y100 VanDerWaalsContact O-CB 3.31Å; L96-Y100 WeakPolarHBondContact O-CB 3.49Å; L96-Y100 PolarHBondContact O-N 3.2Å; R97-Y100 PolarHBondContact O-N 2.77Å; Y100-R106 VanDerWaalsContact O-CZ 3.25Å; Y100-R106 PolarHBondContact O-NE 3.43Å; Y100-R106 VanDerWaalsContact O-NE 3.09Å; Y100-R106 PolarHBondContact O-NH2 3.45Å |
| 101 | Q | 87.6 | Confident | 88.1 | Confident | 103 Ų | 103 | 49.2 Ų | 49.2 | 48% | 0.481 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -72 | -35.1 | -173.7 | -69.1 | -175.6 | -24 | 0 | 0 | 113.3 | R97 K103 | R97-Q101 HydrophobicContact CG-CG 4.21Å; R97-Q101 WeakPolarHBondContact O-CB 3.47Å; R97-Q101 VanDerWaalsContact O-CG 3.32Å; R97-Q101 WeakPolarHBondContact O-CG 3.22Å; R97-Q101 PolarHBondContact O-N 3Å; Q101-K103 PolarHBondContact O-N 3.5Å |
| 102 | N | 83.3 | Confident | 88 | Confident | 62 Ų | 62 | 48.5 Ų | 48.5 | 33% | 0.332 | 24% | 0.236 | S | C | . | . | trans | -92.9 | 102.5 | -175.1 | -65.8 | -66.2 | 0 | 0 | 0 | 111.9 | I98 C104 M105 | I98-N102 WeakPolarHBondContact O-CB 3.35Å; I98-N102 PolarHBondContact O-N 2.91Å; I98-N102 VanDerWaalsContact O-N 3.12Å; I98-N102 PolarHBondContact O-ND2 2.84Å; N102-C104 PolarHBondContact O-N 3.11Å; N102-C104 VanDerWaalsContact O-N 3.16Å; N102-M105 HydrophobicContact CB-CB 3.99Å; N102-M105 HydrophobicContact CB-CG 3.7Å; N102-M105 WeakPolarHBondContact O-CA 3.47Å; N102-M105 WeakPolarHBondContact O-CB 3.1Å; N102-M105 PolarHBondContact O-N 2.9Å | ||
| 103 | K | 81.4 | Confident | 87.8 | Confident | 152 Ų | 152 | 49.3 Ų | 49.3 | 66% | 0.661 | 24% | 0.24 | S | C | * | . | G | 310 helix | trans | -53.8 | -37.1 | 176.4 | -67.2 | -176.3 | -178.8 | 179.1 | 0 | 112.8 | Q101 M105 R106 | Q101-K103 PolarHBondContact O-N 3.5Å; K103-M105 PolarHBondContact O-N 3.05Å; K103-M105 VanDerWaalsContact O-N 3.14Å; K103-R106 WeakPolarHBondContact O-CB 3.23Å; K103-R106 PolarHBondContact O-N 3.37Å |
| 104 | C | 78.8 | Confident | 87.8 | Confident | 95 Ų | 95 | 48 Ų | 48 | 64% | 0.642 | 23% | 0.23 | S | C | * | . | G | 310 helix | trans | -68.4 | -7.2 | 176.8 | -53.6 | 0 | 0 | 0 | 0 | 114.4 | N102 K369 | N102-C104 PolarHBondContact O-N 3.11Å; N102-C104 VanDerWaalsContact O-N 3.16Å; C104-K369 PolarHBondContact O-NZ 3.24Å |
| 105 | M | 80.3 | Confident | 87.9 | Confident | 3 Ų | 3 | 47.5 Ų | 47.5 | 2% | 0.015 | 23% | 0.227 | C | C | . | . | G | 310 helix | trans | -101.9 | -4.8 | 173.8 | -65.8 | -66.6 | -83.1 | 0 | 0 | 112.2 | N102 K103 N107 N110 K369 F370 | N102-M105 HydrophobicContact CB-CB 3.99Å; N102-M105 HydrophobicContact CB-CG 3.7Å; N102-M105 WeakPolarHBondContact O-CA 3.47Å; N102-M105 WeakPolarHBondContact O-CB 3.1Å; N102-M105 PolarHBondContact O-N 2.9Å; K103-M105 PolarHBondContact O-N 3.05Å; K103-M105 VanDerWaalsContact O-N 3.14Å; M105-N107 PolarHBondContact O-N 3.12Å; M105-N107 VanDerWaalsContact O-N 3.09Å; M105-N110 WeakPolarHBondContact O-CB 3.47Å; M105-N110 PolarHBondContact O-ND2 3.46Å; M105-K369 HydrophobicContact CE-CD 4.39Å; M105-K369 HydrophobicContact CE-CG 4.4Å; M105-K369 HydrophobicContact SD-CD 3.42Å; M105-K369 WeakPolarHBondContact SD-CD 3.14Å; M105-K369 WeakPolarHBondContact SD-CE 3.09Å; M105-K369 HydrophobicContact SD-CG 3.85Å; M105-K369 PolarHBondContact SD-NZ 3.04Å; M105-F370 HydrophobicContact CE-CD1 3.52Å; M105-F370 HydrophobicContact CE-CD2 4.11Å; M105-F370 HydrophobicContact CE-CE1 3.2Å; M105-F370 HydrophobicContact CE-CE2 3.82Å; M105-F370 HydrophobicContact CE-CG 3.97Å; M105-F370 HydrophobicContact CE-CZ 3.36Å |
| 106 | R | 84.3 | Confident | 87.9 | Confident | 93 Ų | 93 | 47.8 Ų | 47.8 | 35% | 0.351 | 23% | 0.228 | S | C | . | . | trans | -86.7 | 79.3 | -179.2 | -60.1 | -179.2 | -173.7 | 179 | -2.9 | 110.9 | I99 Y100 K103 G191 | I99-R106 WeakPolarHBondContact O-CG 3.36Å; Y100-R106 VanDerWaalsContact O-CZ 3.25Å; Y100-R106 PolarHBondContact O-NE 3.43Å; Y100-R106 VanDerWaalsContact O-NE 3.09Å; Y100-R106 PolarHBondContact O-NH2 3.45Å; K103-R106 WeakPolarHBondContact O-CB 3.23Å; K103-R106 PolarHBondContact O-N 3.37Å; R106-G191 CarbonylContact O-C 3.57Å; R106-G191 WeakPolarHBondContact O-CA 3.24Å; R106-G191 PolarHBondContact O-N 2.77Å | ||
| 107 | N | 84.4 | Confident | 88 | Confident | 33 Ų | 33 | 45.8 Ų | 45.8 | 18% | 0.176 | 22% | 0.218 | C | C | . | . | B | Isolated β-bridge | trans | -128.3 | 168 | 174.6 | 60.4 | 45.9 | 0 | 0 | 0 | 110.1 | M105 P109 N110 A111 | M105-N107 PolarHBondContact O-N 3.12Å; M105-N107 VanDerWaalsContact O-N 3.09Å; N107-P109 VanDerWaalsContact OD1-CD 3.31Å; N107-P109 WeakPolarHBondContact OD1-CD 3.37Å; N107-N110 PolarHBondContact ND2-ND2 3.19Å; N107-N110 PolarHBondContact O-N 3.08Å; N107-N110 VanDerWaalsContact OD1-CB 3.32Å; N107-N110 WeakPolarHBondContact OD1-CB 2.75Å; N107-N110 VanDerWaalsContact OD1-CG 3.24Å; N107-N110 PolarHBondContact OD1-N 3.45Å; N107-N110 PolarHBondContact OD1-ND2 2.83Å; N107-A111 PolarHBondContact O-N 3.43Å |
| 108 | G | 83.9 | Confident | 88.2 | Confident | 4 Ų | 4 | 42.6 Ų | 42.6 | 4% | 0.041 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -48.4 | -55.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | N110 A111 L112 T196 | G108-N110 VanDerWaalsContact C-N 3.34Å; G108-N110 PolarHBondContact O-N 3.46Å; G108-A111 WeakPolarHBondContact O-CA 3.26Å; G108-A111 WeakPolarHBondContact O-CB 3.29Å; G108-A111 PolarHBondContact O-N 3.32Å; G108-L112 PolarHBondContact O-N 3.45Å; G108-L112 VanDerWaalsContact O-N 3.11Å; G108-T196 WeakPolarHBondContact O-CG2 3.36Å |
| 109 | P | 83.4 | Confident | 88.5 | Confident | 9 Ų | 9 | 42.6 Ų | 42.6 | 6% | 0.058 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.7 | -35.4 | -178.6 | -10.8 | 14.8 | 0 | 0 | 0 | 115.1 | N107 A111 L112 I113 D176 | N107-P109 VanDerWaalsContact OD1-CD 3.31Å; N107-P109 WeakPolarHBondContact OD1-CD 3.37Å; P109-A111 VanDerWaalsContact C-N 3.27Å; P109-A111 PolarHBondContact O-N 2.84Å; P109-L112 WeakPolarHBondContact O-CB 3.45Å; P109-L112 PolarHBondContact O-N 3.04Å; P109-I113 WeakPolarHBondContact O-CG1 3.46Å; P109-I113 PolarHBondContact O-N 3.01Å; P109-D176 WeakPolarHBondContact CG-OD2 3.32Å |
| 110 | N | 88.8 | Confident | 88.8 | Confident | 15 Ų | 15 | 42 Ų | 42 | 8% | 0.08 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -71.2 | -25.6 | 174.7 | -70.1 | -9.4 | 0 | 0 | 0 | 111.8 | M105 N107 G108 I113 A114 F370 | M105-N110 WeakPolarHBondContact O-CB 3.47Å; M105-N110 PolarHBondContact O-ND2 3.46Å; N107-N110 PolarHBondContact ND2-ND2 3.19Å; N107-N110 PolarHBondContact O-N 3.08Å; N107-N110 VanDerWaalsContact OD1-CB 3.32Å; N107-N110 WeakPolarHBondContact OD1-CB 2.75Å; N107-N110 VanDerWaalsContact OD1-CG 3.24Å; N107-N110 PolarHBondContact OD1-N 3.45Å; N107-N110 PolarHBondContact OD1-ND2 2.83Å; G108-N110 VanDerWaalsContact C-N 3.34Å; G108-N110 PolarHBondContact O-N 3.46Å; N110-I113 PolarHBondContact O-N 3.38Å; N110-A114 WeakPolarHBondContact O-CB 3.37Å; N110-A114 PolarHBondContact O-N 2.99Å; N110-F370 WeakPolarHBondContact OD1-CZ 3.36Å |
| 111 | A | 90.9 | Very high | 89.2 | Confident | 11 Ų | 11 | 35 Ų | 35 | 9% | 0.091 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -68.8 | -37.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112 | N107 G108 P109 A114 S115 I192 T196 I200 | N107-A111 PolarHBondContact O-N 3.43Å; G108-A111 WeakPolarHBondContact O-CA 3.26Å; G108-A111 WeakPolarHBondContact O-CB 3.29Å; G108-A111 PolarHBondContact O-N 3.32Å; P109-A111 VanDerWaalsContact C-N 3.27Å; P109-A111 PolarHBondContact O-N 2.84Å; A111-A114 PolarHBondContact O-N 3.36Å; A111-S115 PolarHBondContact O-N 3.09Å; A111-I192 HydrophobicContact CB-CD1 3.93Å; A111-I192 HydrophobicContact CB-CG1 4.13Å; A111-I192 HydrophobicContact CB-CG2 4.2Å; A111-T196 HydrophobicContact CB-CG2 4.35Å; A111-I200 HydrophobicContact CB-CD1 3.89Å |
| 112 | L | 90.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.2 | -42 | 170.8 | -68.9 | 172 | 0 | 0 | 0 | 111.6 | G108 P109 A114 S115 L116 A172 L173 T196 E199 I200 I203 | G108-L112 PolarHBondContact O-N 3.45Å; G108-L112 VanDerWaalsContact O-N 3.11Å; P109-L112 WeakPolarHBondContact O-CB 3.45Å; P109-L112 PolarHBondContact O-N 3.04Å; L112-A114 VanDerWaalsContact C-N 3.3Å; L112-A114 PolarHBondContact O-N 2.77Å; L112-S115 WeakPolarHBondContact O-CB 3.43Å; L112-S115 PolarHBondContact O-N 3.31Å; L112-L116 WeakPolarHBondContact O-CB 3.12Å; L112-L116 PolarHBondContact O-N 2.94Å; L112-A172 HydrophobicContact CD1-CB 4.18Å; L112-A172 HydrophobicContact CD2-CB 4.14Å; L112-L173 HydrophobicContact CB-CD2 3.76Å; L112-L173 HydrophobicContact CB-CG 4.21Å; L112-L173 HydrophobicContact CD1-CD2 4.17Å; L112-T196 HydrophobicContact CD2-CG2 4.49Å; L112-T196 HydrophobicContact CG-CG2 4.23Å; L112-E199 HydrophobicContact CD2-CG 4.47Å; L112-I200 HydrophobicContact CD2-CD1 4.44Å; L112-I200 HydrophobicContact CD2-CG1 3.78Å; L112-I203 HydrophobicContact CD2-CD1 4.2Å |
| 113 | I | 91.6 | Very high | 90.2 | Very high | 17 Ų | 17 | 29.5 Ų | 29.5 | 9% | 0.087 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.5 | -39.3 | 173.4 | -67.3 | 169.7 | 0 | 0 | 0 | 111.1 | L95 I99 P109 N110 L116 A117 L173 L363 F370 | L95-I113 HydrophobicContact CD1-CG2 4.18Å; L95-I113 HydrophobicContact CD2-CG2 3.81Å; L95-I113 HydrophobicContact CG-CG2 4.24Å; I99-I113 HydrophobicContact CD1-CG2 4.09Å; P109-I113 WeakPolarHBondContact O-CG1 3.46Å; P109-I113 PolarHBondContact O-N 3.01Å; N110-I113 PolarHBondContact O-N 3.38Å; I113-L116 WeakPolarHBondContact O-CB 3.17Å; I113-L116 PolarHBondContact O-N 3.49Å; I113-A117 WeakPolarHBondContact O-CB 3.45Å; I113-A117 PolarHBondContact O-N 2.92Å; I113-L173 HydrophobicContact CG1-CD1 4.45Å; I113-L173 HydrophobicContact CG1-CD2 4.08Å; I113-L363 HydrophobicContact CD1-CD1 4.36Å; I113-L363 HydrophobicContact CD1-CD2 4.16Å; I113-L363 HydrophobicContact CG2-CD1 3.55Å; I113-F370 HydrophobicContact CD1-CE2 4.17Å; I113-F370 HydrophobicContact CD1-CZ 4.14Å |
| 114 | A | 93.9 | Very high | 90.9 | Very high | 21 Ų | 21 | 22.3 Ų | 22.3 | 17% | 0.174 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -66.7 | -40.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L96 I99 N110 A111 L112 L116 A117 L118 | L96-A114 HydrophobicContact CD2-CB 3.84Å; L96-A114 WeakPolarHBondContact CD2-O 3.47Å; I99-A114 HydrophobicContact CD1-CB 4.04Å; I99-A114 HydrophobicContact CG2-CB 4.39Å; N110-A114 WeakPolarHBondContact O-CB 3.37Å; N110-A114 PolarHBondContact O-N 2.99Å; A111-A114 PolarHBondContact O-N 3.36Å; L112-A114 VanDerWaalsContact C-N 3.3Å; L112-A114 PolarHBondContact O-N 2.77Å; A114-L116 VanDerWaalsContact C-N 3.33Å; A114-L116 PolarHBondContact O-N 3.42Å; A114-A117 PolarHBondContact O-N 3.06Å; A114-L118 WeakPolarHBondContact O-CB 3.41Å; A114-L118 PolarHBondContact O-N 2.88Å |
| 115 | S | 95.4 | Very high | 91.7 | Very high | 9 Ų | 9 | 21 Ų | 21 | 6% | 0.063 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -58.3 | -45.4 | 173.2 | -179.2 | 0 | 0 | 0 | 0 | 111.4 | A111 L112 L118 G119 N169 W204 | A111-S115 PolarHBondContact O-N 3.09Å; L112-S115 WeakPolarHBondContact O-CB 3.43Å; L112-S115 PolarHBondContact O-N 3.31Å; S115-L118 PolarHBondContact O-N 3.43Å; S115-G119 PolarHBondContact O-N 3.38Å; S115-N169 PolarHBondContact OG-ND2 2.96Å; S115-N169 PolarHBondContact OG-OD1 3.33Å; S115-W204 PolarHBondContact OG-NE1 3.46Å |
| 116 | L | 93.3 | Very high | 92.3 | Very high | 8 Ų | 8 | 22.3 Ų | 22.3 | 4% | 0.042 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.5 | -50.6 | 174.5 | 179.7 | 64.5 | 0 | 0 | 0 | 111.7 | L112 I113 A114 L118 G119 D120 T166 N169 L173 | L112-L116 WeakPolarHBondContact O-CB 3.12Å; L112-L116 PolarHBondContact O-N 2.94Å; I113-L116 WeakPolarHBondContact O-CB 3.17Å; I113-L116 PolarHBondContact O-N 3.49Å; A114-L116 VanDerWaalsContact C-N 3.33Å; A114-L116 PolarHBondContact O-N 3.42Å; L116-L118 VanDerWaalsContact C-N 3.27Å; L116-L118 PolarHBondContact O-N 3.28Å; L116-G119 PolarHBondContact O-N 3.28Å; L116-G119 VanDerWaalsContact O-N 3.12Å; L116-D120 PolarHBondContact O-N 3.11Å; L116-T166 HydrophobicContact CD1-CG2 3.79Å; L116-N169 HydrophobicContact CB-CB 4.17Å; L116-N169 HydrophobicContact CD1-CB 4.21Å; L116-L173 HydrophobicContact CD2-CD1 4.34Å |
| 117 | A | 95.4 | Very high | 92.8 | Very high | 1 Ų | 1 | 18 Ų | 18 | 1% | 0.008 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -61.4 | -34.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | N92 L95 L96 I113 A114 L121 | N92-A117 HydrophobicContact CB-CB 4.36Å; L95-A117 HydrophobicContact CD2-CB 3.98Å; L95-A117 HydrophobicContact CG-CB 4.41Å; L96-A117 HydrophobicContact CD2-CB 3.99Å; L96-A117 HydrophobicContact CG-CB 3.98Å; I113-A117 WeakPolarHBondContact O-CB 3.45Å; I113-A117 PolarHBondContact O-N 2.92Å; A114-A117 PolarHBondContact O-N 3.06Å; A117-L121 WeakPolarHBondContact O-CG 3.5Å; A117-L121 PolarHBondContact O-N 3.24Å |
| 118 | L | 96.6 | Very high | 93.3 | Very high | 76 Ų | 76 | 16.7 Ų | 16.7 | 40% | 0.398 | 10% | 0.097 | S | C | . | . | H | α-helix | trans | -68.9 | -43.2 | 174.4 | -176.8 | 60.7 | 0 | 0 | 0 | 111.6 | A114 S115 L116 L121 I122 W204 | A114-L118 WeakPolarHBondContact O-CB 3.41Å; A114-L118 PolarHBondContact O-N 2.88Å; S115-L118 PolarHBondContact O-N 3.43Å; L116-L118 VanDerWaalsContact C-N 3.27Å; L116-L118 PolarHBondContact O-N 3.28Å; L118-L121 PolarHBondContact O-N 2.77Å; L118-I122 HydrophobicContact CG-CD1 4.29Å; L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.31Å; L118-I122 PolarHBondContact O-N 3.03Å; L118-I122 VanDerWaalsContact O-N 3.09Å; L118-W204 HydrophobicContact CB-CZ2 4.37Å; L118-W204 HydrophobicContact CD2-CH2 3.81Å; L118-W204 HydrophobicContact CD2-CZ2 3.69Å; L118-W204 HydrophobicContact CG-CH2 4Å; L118-W204 HydrophobicContact CG-CZ2 4Å |
| 119 | G | 96.2 | Very high | 93.8 | Very high | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -61.1 | -42.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S115 L116 I122 Y123 | S115-G119 PolarHBondContact O-N 3.38Å; L116-G119 PolarHBondContact O-N 3.28Å; L116-G119 VanDerWaalsContact O-N 3.12Å; G119-I122 PolarHBondContact O-N 3.29Å; G119-Y123 WeakPolarHBondContact O-CB 3.41Å; G119-Y123 PolarHBondContact O-N 3.26Å |
| 120 | D | 95.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.7 | -43.9 | 176.1 | -78.9 | -31.2 | 0 | 0 | 0 | 112.1 | L116 Y123 I124 S356 N359 | L116-D120 PolarHBondContact O-N 3.11Å; D120-Y123 PolarHBondContact O-N 3.41Å; D120-I124 WeakPolarHBondContact O-CB 3.49Å; D120-I124 WeakPolarHBondContact O-CD1 3.41Å; D120-I124 VanDerWaalsContact O-CG1 3.26Å; D120-I124 WeakPolarHBondContact O-CG1 3.38Å; D120-I124 PolarHBondContact O-N 3.07Å; D120-S356 WeakPolarHBondContact OD1-CA 3.46Å; D120-S356 WeakPolarHBondContact OD1-CB 3.36Å; D120-S356 PolarHBondContact OD1-OG 2.91Å; D120-N359 PolarHBondContact OD2-ND2 3.33Å |
| 121 | L | 96.9 | Very high | 94.3 | Very high | 23 Ų | 23 | 20.5 Ų | 20.5 | 12% | 0.12 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.1 | -47.1 | 175.1 | -77.2 | 173 | 0 | 0 | 0 | 111.9 | M89 N92 L96 A117 L118 Y123 I124 V125 | M89-L121 HydrophobicContact CE-CD2 4.1Å; M89-L121 HydrophobicContact SD-CD2 3.64Å; N92-L121 HydrophobicContact CB-CD1 4.28Å; N92-L121 HydrophobicContact CB-CD2 3.74Å; N92-L121 HydrophobicContact CB-CG 3.65Å; L96-L121 HydrophobicContact CD1-CD1 3.53Å; A117-L121 WeakPolarHBondContact O-CG 3.5Å; A117-L121 PolarHBondContact O-N 3.24Å; L118-L121 PolarHBondContact O-N 2.77Å; L121-Y123 VanDerWaalsContact C-N 3.29Å; L121-Y123 PolarHBondContact O-N 3.02Å; L121-I124 PolarHBondContact O-N 3.44Å; L121-V125 WeakPolarHBondContact O-CB 3.32Å; L121-V125 WeakPolarHBondContact O-CG2 3.27Å; L121-V125 PolarHBondContact O-N 3.14Å |
| 122 | I | 96.5 | Very high | 94.4 | Very high | 46 Ų | 46 | 21 Ų | 21 | 24% | 0.236 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -59.8 | -45 | 178.7 | -67.1 | 167.6 | 0 | 0 | 0 | 110 | L118 G119 I126 I158 S162 W204 | L118-I122 HydrophobicContact CG-CD1 4.29Å; L118-I122 VanDerWaalsContact O-CG1 3.31Å; L118-I122 WeakPolarHBondContact O-CG1 3.31Å; L118-I122 PolarHBondContact O-N 3.03Å; L118-I122 VanDerWaalsContact O-N 3.09Å; G119-I122 PolarHBondContact O-N 3.29Å; I122-I126 HydrophobicContact CG2-CD1 3.93Å; I122-I126 WeakPolarHBondContact O-CB 3.49Å; I122-I126 PolarHBondContact O-N 2.98Å; I122-I158 HydrophobicContact CG2-CG2 3.29Å; I122-S162 VanDerWaalsContact CG2-OG 3.32Å; I122-S162 WeakPolarHBondContact CG2-OG 3.49Å; I122-W204 HydrophobicContact CD1-CH2 3.66Å; I122-W204 HydrophobicContact CD1-CZ3 4.17Å |
| 123 | Y | 95.9 | Very high | 94.5 | Very high | 4 Ų | 4 | 25.7 Ų | 25.7 | 2% | 0.016 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -59.4 | -54.1 | 177.3 | -174.1 | -103.4 | 0 | 0 | 0 | 111.4 | G119 D120 L121 V125 I126 D127 Q159 V163 T353 | G119-Y123 WeakPolarHBondContact O-CB 3.41Å; G119-Y123 PolarHBondContact O-N 3.26Å; D120-Y123 PolarHBondContact O-N 3.41Å; L121-Y123 VanDerWaalsContact C-N 3.29Å; L121-Y123 PolarHBondContact O-N 3.02Å; Y123-V125 PolarHBondContact O-N 2.87Å; Y123-I126 PolarHBondContact O-N 3.5Å; Y123-D127 HydrophobicContact CD1-CB 4.38Å; Y123-D127 HydrophobicContact CE1-CB 4.17Å; Y123-D127 HydrophobicContact CE2-CB 4.36Å; Y123-D127 WeakPolarHBondContact O-CB 3.38Å; Y123-D127 PolarHBondContact O-N 3.41Å; Y123-Q159 HydrophobicContact CD2-CG 3.98Å; Y123-Q159 HydrophobicContact CE2-CG 3.47Å; Y123-Q159 VanDerWaalsContact CE2-CG 3.47Å; Y123-V163 HydrophobicContact CD2-CG2 3.95Å; Y123-V163 HydrophobicContact CE2-CG2 3.55Å; Y123-T353 HydrophobicContact CD1-CG2 4.11Å; Y123-T353 HydrophobicContact CE1-CG2 3.8Å; Y123-T353 WeakPolarHBondContact CE1-OG1 3.35Å |
| 124 | I | 96.5 | Very high | 94.4 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.1 | -43.7 | -178.1 | -68.7 | 159 | 0 | 0 | 0 | 112.1 | F85 M89 D120 L121 I126 I128 T353 | F85-I124 HydrophobicContact CD2-CG2 3.66Å; F85-I124 HydrophobicContact CE2-CG2 4.21Å; F85-I124 HydrophobicContact CG-CG2 4.38Å; M89-I124 HydrophobicContact CG-CG2 4.28Å; M89-I124 HydrophobicContact SD-CG2 4.41Å; D120-I124 WeakPolarHBondContact O-CB 3.49Å; D120-I124 WeakPolarHBondContact O-CD1 3.41Å; D120-I124 VanDerWaalsContact O-CG1 3.26Å; D120-I124 WeakPolarHBondContact O-CG1 3.38Å; D120-I124 PolarHBondContact O-N 3.07Å; L121-I124 PolarHBondContact O-N 3.44Å; I124-I126 PolarHBondContact O-N 3.22Å; I124-I128 HydrophobicContact CG2-CD1 4.25Å; I124-I128 PolarHBondContact O-N 3.2Å; I124-T353 HydrophobicContact CG1-CG2 4.17Å |
| 125 | V | 95.9 | Very high | 94.2 | Very high | 69 Ų | 69 | 26.8 Ų | 26.8 | 42% | 0.418 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -62.6 | -33 | -178.5 | 168.7 | 0 | 0 | 0 | 0 | 112.1 | M89 L121 Y123 P129 | M89-V125 HydrophobicContact CE-CG2 4Å; M89-V125 HydrophobicContact SD-CG2 3.46Å; M89-V125 WeakPolarHBondContact SD-CG2 3.44Å; L121-V125 WeakPolarHBondContact O-CB 3.32Å; L121-V125 WeakPolarHBondContact O-CG2 3.27Å; L121-V125 PolarHBondContact O-N 3.14Å; Y123-V125 PolarHBondContact O-N 2.87Å; V125-P129 VanDerWaalsContact O-CD 3.27Å; V125-P129 WeakPolarHBondContact O-CD 3.41Å; V125-P129 VanDerWaalsContact O-CG 3.27Å; V125-P129 WeakPolarHBondContact O-CG 3.49Å |
| 126 | I | 93 | Very high | 94 | Very high | 29 Ų | 29 | 30.9 Ų | 30.9 | 15% | 0.149 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -94.1 | -45.6 | -175.4 | -75.8 | 166.6 | 0 | 0 | 0 | 111.7 | I122 Y123 I124 L155 I158 | I122-I126 HydrophobicContact CG2-CD1 3.93Å; I122-I126 WeakPolarHBondContact O-CB 3.49Å; I122-I126 PolarHBondContact O-N 2.98Å; Y123-I126 PolarHBondContact O-N 3.5Å; I124-I126 PolarHBondContact O-N 3.22Å; I126-L155 HydrophobicContact CB-CD2 4.46Å; I126-L155 HydrophobicContact CG1-CD2 4.33Å; I126-L155 HydrophobicContact CG2-CB 4.24Å; I126-L155 HydrophobicContact CG2-CD2 3.59Å; I126-I158 HydrophobicContact CD1-CB 3.95Å; I126-I158 HydrophobicContact CD1-CG2 3.2Å |
| 127 | D | 93.6 | Very high | 93.7 | Very high | 3 Ų | 3 | 32.4 Ų | 32.4 | 2% | 0.016 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -67.5 | -54.7 | -171.2 | -172.9 | 66.1 | 0 | 0 | 0 | 111.2 | Y123 I130 I131 Q159 T353 | Y123-D127 HydrophobicContact CD1-CB 4.38Å; Y123-D127 HydrophobicContact CE1-CB 4.17Å; Y123-D127 HydrophobicContact CE2-CB 4.36Å; Y123-D127 WeakPolarHBondContact O-CB 3.38Å; Y123-D127 PolarHBondContact O-N 3.41Å; D127-I130 PolarHBondContact O-N 2.86Å; D127-I131 HydrophobicContact CB-CD1 4.32Å; D127-I131 VanDerWaalsContact O-CD1 3.25Å; D127-I131 WeakPolarHBondContact O-CD1 3.46Å; D127-I131 VanDerWaalsContact O-CG1 3.22Å; D127-I131 WeakPolarHBondContact O-CG1 3.3Å; D127-I131 PolarHBondContact O-N 3.45Å; D127-I131 WeakPolarHBondContact OD1-CD1 3.47Å; D127-I131 WeakPolarHBondContact OD2-CD1 3.37Å; D127-Q159 PolarHBondContact OD1-NE2 3.12Å; D127-T353 PolarHBondContact OD2-OG1 3.19Å |
| 128 | I | 94.3 | Very high | 93.2 | Very high | 6 Ų | 6 | 36.9 Ų | 36.9 | 3% | 0.031 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.6 | -50.3 | -171.5 | -65.5 | -166.7 | 0 | 0 | 0 | 113.1 | S81 I84 F85 I124 I130 I131 V132 T353 | S81-I128 WeakPolarHBondContact O-CD1 3.4Å; I84-I128 HydrophobicContact CB-CD1 4.01Å; I84-I128 HydrophobicContact CG2-CD1 3.67Å; F85-I128 HydrophobicContact CB-CD1 3.89Å; F85-I128 HydrophobicContact CB-CG2 4.17Å; F85-I128 HydrophobicContact CD2-CB 4.13Å; F85-I128 HydrophobicContact CD2-CD1 4.46Å; F85-I128 HydrophobicContact CD2-CG2 4.26Å; I124-I128 HydrophobicContact CG2-CD1 4.25Å; I124-I128 PolarHBondContact O-N 3.2Å; I128-I130 VanDerWaalsContact C-N 3.25Å; I128-I130 PolarHBondContact O-N 2.96Å; I128-I131 PolarHBondContact O-N 3.42Å; I128-V132 HydrophobicContact CG2-CG2 4.09Å; I128-V132 WeakPolarHBondContact O-CB 3.36Å; I128-V132 WeakPolarHBondContact O-CG2 3.43Å; I128-V132 PolarHBondContact O-N 2.92Å; I128-T353 HydrophobicContact CD1-CG2 3.78Å; I128-T353 HydrophobicContact CG1-CG2 3.77Å |
| 129 | P | 94.1 | Very high | 92.7 | Very high | 60 Ų | 60 | 38.9 Ų | 38.9 | 39% | 0.39 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -58.7 | -39 | -179.6 | -27.4 | 38.2 | 0 | 0 | 0 | 112.5 | F85 V125 Y133 | F85-P129 HydrophobicContact CE2-CG 4.43Å; V125-P129 VanDerWaalsContact O-CD 3.27Å; V125-P129 WeakPolarHBondContact O-CD 3.41Å; V125-P129 VanDerWaalsContact O-CG 3.27Å; V125-P129 WeakPolarHBondContact O-CG 3.49Å; P129-Y133 VanDerWaalsContact O-CB 3.23Å; P129-Y133 WeakPolarHBondContact O-CB 3.48Å; P129-Y133 PolarHBondContact O-N 3.08Å |
| 130 | I | 92.4 | Very high | 92.4 | Very high | 36 Ų | 36 | 39.3 Ų | 39.3 | 19% | 0.185 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -69.9 | -41.3 | 178.3 | -89.1 | -2 | 0 | 0 | 0 | 112.7 | D127 I128 Y133 K134 W140 P141 L155 | D127-I130 PolarHBondContact O-N 2.86Å; I128-I130 VanDerWaalsContact C-N 3.25Å; I128-I130 PolarHBondContact O-N 2.96Å; I130-Y133 PolarHBondContact O-N 3.41Å; I130-K134 HydrophobicContact CG2-CD 4.28Å; I130-K134 WeakPolarHBondContact O-CB 3.35Å; I130-K134 WeakPolarHBondContact O-CG 3.46Å; I130-K134 PolarHBondContact O-N 3.38Å; I130-W140 HydrophobicContact CG2-CZ3 4.4Å; I130-P141 HydrophobicContact CD1-CG 3.93Å; I130-L155 HydrophobicContact CD1-CD1 4Å; I130-L155 HydrophobicContact CG1-CD1 3.54Å |
| 131 | I | 90.9 | Very high | 92.1 | Very high | 12 Ų | 12 | 39.7 Ų | 39.7 | 6% | 0.062 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64 | -46.9 | 177.7 | -69.4 | 157 | 0 | 0 | 0 | 110.3 | D127 I128 K134 L135 Y346 I349 | D127-I131 HydrophobicContact CB-CD1 4.32Å; D127-I131 VanDerWaalsContact O-CD1 3.25Å; D127-I131 WeakPolarHBondContact O-CD1 3.46Å; D127-I131 VanDerWaalsContact O-CG1 3.22Å; D127-I131 WeakPolarHBondContact O-CG1 3.3Å; D127-I131 PolarHBondContact O-N 3.45Å; D127-I131 WeakPolarHBondContact OD1-CD1 3.47Å; D127-I131 WeakPolarHBondContact OD2-CD1 3.37Å; I128-I131 PolarHBondContact O-N 3.42Å; I131-K134 PolarHBondContact O-N 3.31Å; I131-L135 WeakPolarHBondContact O-CB 3.4Å; I131-L135 PolarHBondContact O-N 3.2Å; I131-Y346 HydrophobicContact CG2-CD1 3.67Å; I131-Y346 HydrophobicContact CG2-CE1 3.78Å; I131-I349 HydrophobicContact CD1-CB 4.41Å; I131-I349 HydrophobicContact CD1-CG2 3.19Å; I131-I349 HydrophobicContact CG1-CG2 4.11Å |
| 132 | V | 93.6 | Very high | 91.6 | Very high | 22 Ų | 22 | 44.8 Ų | 44.8 | 13% | 0.133 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.6 | -43.9 | 179.2 | 173.2 | 0 | 0 | 0 | 0 | 110.4 | T78 I128 L135 L136 | T78-V132 HydrophobicContact CG2-CG1 4Å; I128-V132 HydrophobicContact CG2-CG2 4.09Å; I128-V132 WeakPolarHBondContact O-CB 3.36Å; I128-V132 WeakPolarHBondContact O-CG2 3.43Å; I128-V132 PolarHBondContact O-N 2.92Å; V132-L135 PolarHBondContact O-N 3.04Å; V132-L136 HydrophobicContact CG1-CD1 3.78Å; V132-L136 HydrophobicContact CG1-CG 4.32Å; V132-L136 WeakPolarHBondContact O-CG 3.36Å; V132-L136 PolarHBondContact O-N 3.47Å |
| 133 | Y | 92.6 | Very high | 90.7 | Very high | 98 Ų | 98 | 43.1 Ų | 43.1 | 38% | 0.384 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -60.8 | -47.9 | 176 | -174.5 | -84.9 | 0 | 0 | 0 | 111.6 | P129 I130 L135 L136 A137 K139 P141 | P129-Y133 VanDerWaalsContact O-CB 3.23Å; P129-Y133 WeakPolarHBondContact O-CB 3.48Å; P129-Y133 PolarHBondContact O-N 3.08Å; I130-Y133 PolarHBondContact O-N 3.41Å; Y133-L135 VanDerWaalsContact C-N 3.28Å; Y133-L135 PolarHBondContact O-N 2.94Å; Y133-L136 PolarHBondContact O-N 3.35Å; Y133-A137 HydrophobicContact CD1-CB 4.11Å; Y133-A137 HydrophobicContact CD2-CB 4.46Å; Y133-A137 HydrophobicContact CE1-CB 3.77Å; Y133-A137 HydrophobicContact CE2-CB 4.16Å; Y133-A137 HydrophobicContact CG-CB 4.45Å; Y133-A137 VanDerWaalsContact O-CB 3.3Å; Y133-A137 WeakPolarHBondContact O-CB 3.44Å; Y133-A137 PolarHBondContact O-N 3.44Å; Y133-K139 WeakPolarHBondContact CD1-O 3.33Å; Y133-K139 VanDerWaalsContact CE1-O 3.26Å; Y133-K139 WeakPolarHBondContact CE1-O 3.27Å; Y133-P141 HydrophobicContact CD1-CB 3.98Å; Y133-P141 HydrophobicContact CD1-CG 4.11Å; Y133-P141 HydrophobicContact CE1-CB 3.65Å; Y133-P141 HydrophobicContact CE1-CG 4.17Å; Y133-P141 HydrophobicContact CE2-CB 4.33Å; Y133-P141 HydrophobicContact CG-CB 4.44Å |
| 134 | K | 89.9 | Confident | 90 | Very high | 61 Ų | 61 | 50.4 Ų | 50.4 | 27% | 0.265 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.3 | -39.2 | 176.5 | -80.7 | -177.4 | 166.1 | 178.1 | 0 | 112.1 | I130 I131 Q138 | I130-K134 HydrophobicContact CG2-CD 4.28Å; I130-K134 WeakPolarHBondContact O-CB 3.35Å; I130-K134 WeakPolarHBondContact O-CG 3.46Å; I130-K134 PolarHBondContact O-N 3.38Å; I131-K134 PolarHBondContact O-N 3.31Å; K134-Q138 VanDerWaalsContact O-CA 3.29Å; K134-Q138 WeakPolarHBondContact O-CA 3.23Å; K134-Q138 PolarHBondContact O-N 2.83Å; K134-Q138 VanDerWaalsContact O-N 3.11Å; K134-Q138 PolarHBondContact O-NE2 3.2Å |
| 135 | L | 90.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -67.7 | -43 | 179.2 | -176.6 | 62.4 | 0 | 0 | 0 | 112.6 | I69 F73 K74 N77 I131 V132 Y133 Q138 Y346 | I69-L135 HydrophobicContact CD1-CD1 4.06Å; I69-L135 HydrophobicContact CG2-CD1 4.34Å; F73-L135 HydrophobicContact CE1-CD1 4.43Å; K74-L135 HydrophobicContact CB-CG 4.38Å; K74-L135 HydrophobicContact CG-CD1 4.05Å; K74-L135 HydrophobicContact CG-CG 4.19Å; N77-L135 HydrophobicContact CB-CD2 3.82Å; N77-L135 VanDerWaalsContact ND2-CD2 3.3Å; N77-L135 WeakPolarHBondContact ND2-CD2 3.37Å; I131-L135 WeakPolarHBondContact O-CB 3.4Å; I131-L135 PolarHBondContact O-N 3.2Å; V132-L135 PolarHBondContact O-N 3.04Å; Y133-L135 VanDerWaalsContact C-N 3.28Å; Y133-L135 PolarHBondContact O-N 2.94Å; L135-Q138 PolarHBondContact O-NE2 3.35Å; L135-Y346 HydrophobicContact CB-CD1 4.37Å; L135-Y346 HydrophobicContact CB-CE1 3.72Å; L135-Y346 HydrophobicContact CD1-CD1 4.16Å; L135-Y346 HydrophobicContact CD1-CD2 4.02Å; L135-Y346 HydrophobicContact CD1-CE1 3.94Å; L135-Y346 HydrophobicContact CD1-CE2 3.81Å; L135-Y346 HydrophobicContact CD1-CG 4.21Å; L135-Y346 HydrophobicContact CD2-CD1 4.42Å; L135-Y346 HydrophobicContact CG-CE1 4.29Å |
| 136 | L | 90.6 | Very high | 89.4 | Confident | 95 Ų | 95 | 55.9 Ų | 55.9 | 50% | 0.497 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -83.8 | -50.8 | -175.6 | -63.5 | 178.7 | 0 | 0 | 0 | 112.3 | K74 T78 V132 Y133 | K74-L136 HydrophobicContact CB-CD2 4.44Å; T78-L136 HydrophobicContact CG2-CD1 4.48Å; V132-L136 HydrophobicContact CG1-CD1 3.78Å; V132-L136 HydrophobicContact CG1-CG 4.32Å; V132-L136 WeakPolarHBondContact O-CG 3.36Å; V132-L136 PolarHBondContact O-N 3.47Å; Y133-L136 PolarHBondContact O-N 3.35Å |
| 137 | A | 87.4 | Confident | 89.3 | Confident | 39 Ų | 39 | 60 Ų | 60 | 32% | 0.322 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -84.9 | -17.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y133 K139 | Y133-A137 HydrophobicContact CD1-CB 4.11Å; Y133-A137 HydrophobicContact CD2-CB 4.46Å; Y133-A137 HydrophobicContact CE1-CB 3.77Å; Y133-A137 HydrophobicContact CE2-CB 4.16Å; Y133-A137 HydrophobicContact CG-CB 4.45Å; Y133-A137 VanDerWaalsContact O-CB 3.3Å; Y133-A137 WeakPolarHBondContact O-CB 3.44Å; Y133-A137 PolarHBondContact O-N 3.44Å; A137-K139 WeakPolarHBondContact O-CG 3.15Å; A137-K139 PolarHBondContact O-N 2.9Å |
| 138 | Q | 84.8 | Confident | 89.2 | Confident | 95 Ų | 95 | 59.9 Ų | 59.9 | 44% | 0.444 | 30% | 0.3 | S | S | . | . | trans | 52.4 | 25.6 | -177.4 | -61.5 | -69.3 | -56.6 | 0 | 0 | 113.6 | K134 L135 | K134-Q138 VanDerWaalsContact O-CA 3.29Å; K134-Q138 WeakPolarHBondContact O-CA 3.23Å; K134-Q138 PolarHBondContact O-N 2.83Å; K134-Q138 VanDerWaalsContact O-N 3.11Å; K134-Q138 PolarHBondContact O-NE2 3.2Å; L135-Q138 PolarHBondContact O-NE2 3.35Å | ||
| 139 | K | 86.3 | Confident | 89 | Confident | 119 Ų | 119 | 63.8 Ų | 63.8 | 52% | 0.517 | 32% | 0.318 | S | S | . | . | S | Bend | trans | -138.6 | 161.2 | -177.6 | -68.8 | -179.6 | -176.2 | -174.4 | 0 | 109.9 | Y133 A137 | Y133-K139 WeakPolarHBondContact CD1-O 3.33Å; Y133-K139 VanDerWaalsContact CE1-O 3.26Å; Y133-K139 WeakPolarHBondContact CE1-O 3.27Å; A137-K139 WeakPolarHBondContact O-CG 3.15Å; A137-K139 PolarHBondContact O-N 2.9Å |
| 140 | W | 90.1 | Very high | 89 | Confident | 9 Ų | 9 | 66.4 Ų | 66.4 | 3% | 0.034 | 32% | 0.324 | C | S | . | . | trans | -79.4 | 132.6 | 168.3 | -175.6 | -109.5 | 0 | 0 | 0 | 110.6 | I130 F142 G143 G148 L151 C152 L155 V231 C233 | I130-W140 HydrophobicContact CG2-CZ3 4.4Å; W140-F142 PolarHBondContact O-N 2.96Å; W140-G143 PolarHBondContact O-N 3.4Å; W140-G148 PolarHBondContact NE1-O 2.92Å; W140-L151 HydrophobicContact CZ2-CB 3.97Å; W140-C152 HydrophobicContact CZ2-CB 3.89Å; W140-L155 HydrophobicContact CH2-CD1 3.59Å; W140-L155 HydrophobicContact CZ2-CD1 3.87Å; W140-V231 PolarHBondContact N-O 2.85Å; W140-C233 HydrophobicContact CD2-CB 3.31Å; W140-C233 HydrophobicContact CE3-CB 3.36Å; W140-C233 HydrophobicContact CG-CB 3.85Å; W140-C233 HydrophobicContact CH2-CB 4.11Å; W140-C233 HydrophobicContact CZ2-CB 4.1Å; W140-C233 HydrophobicContact CZ3-CB 3.77Å | ||
| 141 | P | 88.6 | Confident | 89.1 | Confident | 8 Ų | 8 | 65.8 Ų | 65.8 | 5% | 0.052 | 32% | 0.321 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63 | 134.2 | 178 | 27.2 | -35.4 | 0 | 0 | 0 | 110.3 | I130 Y133 G143 | I130-P141 HydrophobicContact CD1-CG 3.93Å; Y133-P141 HydrophobicContact CD1-CB 3.98Å; Y133-P141 HydrophobicContact CD1-CG 4.11Å; Y133-P141 HydrophobicContact CE1-CB 3.65Å; Y133-P141 HydrophobicContact CE1-CG 4.17Å; Y133-P141 HydrophobicContact CE2-CB 4.33Å; Y133-P141 HydrophobicContact CG-CB 4.44Å; P141-G143 PolarHBondContact O-N 3.17Å |
| 142 | F | 85.5 | Confident | 89.3 | Confident | 130 Ų | 130 | 65.2 Ų | 65.2 | 57% | 0.57 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57 | 27.7 | 177.8 | -44.4 | -73.1 | 0 | 0 | 0 | 114.8 | W140 D144 S145 F147 G148 L151 | W140-F142 PolarHBondContact O-N 2.96Å; F142-D144 PolarHBondContact O-N 3.06Å; F142-S145 VanDerWaalsContact CB-OG 3.31Å; F142-S145 WeakPolarHBondContact CB-OG 3.27Å; F142-S145 PolarHBondContact O-N 3.25Å; F142-S145 PolarHBondContact O-OG 3.39Å; F142-F147 HydrophobicContact CB-CD1 4.48Å; F142-F147 AromaticContact CD2-CD1 3.89Å; F142-F147 HydrophobicContact CD2-CD1 3.89Å; F142-F147 HydrophobicContact CD2-CE1 4.04Å; F142-F147 HydrophobicContact CE2-CD1 4.36Å; F142-F147 HydrophobicContact CE2-CE1 4.13Å; F142-F147 HydrophobicContact CG-CD1 4.21Å; F142-G148 VanDerWaalsContact O-CA 3.31Å; F142-G148 WeakPolarHBondContact O-CA 3.34Å; F142-L151 HydrophobicContact CD2-CD1 4.16Å |
| 143 | G | 78.7 | Confident | 89.4 | Confident | 11 Ų | 11 | 68.3 Ų | 68.3 | 11% | 0.113 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.6 | -25.5 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | W140 P141 S145 | W140-G143 PolarHBondContact O-N 3.4Å; P141-G143 PolarHBondContact O-N 3.17Å; G143-S145 VanDerWaalsContact C-N 3.34Å |
| 144 | D | 82 | Confident | 89.5 | Confident | 157 Ų | 157 | 67.3 Ų | 67.3 | 84% | 0.84 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | 1.5 | 179.2 | -51.2 | -47.7 | 0 | 0 | 0 | 113.4 | F142 | F142-D144 PolarHBondContact O-N 3.06Š|
| 145 | S | 88.9 | Confident | 89.7 | Confident | 42 Ų | 42 | 65.2 Ų | 65.2 | 29% | 0.294 | 32% | 0.319 | S | S | . | . | S | Bend | trans | -114.8 | 154.4 | -178.3 | 74.1 | 0 | 0 | 0 | 0 | 112.3 | F142 G143 F147 G148 Q149 | F142-S145 VanDerWaalsContact CB-OG 3.31Å; F142-S145 WeakPolarHBondContact CB-OG 3.27Å; F142-S145 PolarHBondContact O-N 3.25Å; F142-S145 PolarHBondContact O-OG 3.39Å; G143-S145 VanDerWaalsContact C-N 3.34Å; S145-F147 PolarHBondContact O-N 2.86Å; S145-G148 PolarHBondContact O-N 3.34Å; S145-G148 PolarHBondContact OG-N 3.19Å; S145-G148 VanDerWaalsContact OG-N 3.17Å; S145-Q149 PolarHBondContact O-N 2.86Å |
| 146 | E | 89.8 | Confident | 89.9 | Confident | 142 Ų | 142 | 65.9 Ų | 65.9 | 66% | 0.664 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -56.4 | -33.1 | 172.2 | -64.5 | -56.4 | 119.3 | 0 | 0 | 112.3 | G148 Q149 F150 | E146-G148 PolarHBondContact O-N 3.24Å; E146-Q149 PolarHBondContact O-N 2.86Å; E146-Q149 PolarHBondContact OE1-NE2 3.37Å; E146-F150 PolarHBondContact O-N 3.26Å |
| 147 | F | 91.4 | Very high | 90.2 | Very high | 115 Ų | 115 | 63.1 Ų | 63.1 | 50% | 0.504 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.5 | -39.7 | 175.5 | -175.5 | -114.7 | 0 | 0 | 0 | 112.3 | F142 S145 Q149 F150 L151 | F142-F147 HydrophobicContact CB-CD1 4.48Å; F142-F147 AromaticContact CD2-CD1 3.89Å; F142-F147 HydrophobicContact CD2-CD1 3.89Å; F142-F147 HydrophobicContact CD2-CE1 4.04Å; F142-F147 HydrophobicContact CE2-CD1 4.36Å; F142-F147 HydrophobicContact CE2-CE1 4.13Å; F142-F147 HydrophobicContact CG-CD1 4.21Å; S145-F147 PolarHBondContact O-N 2.86Å; F147-Q149 VanDerWaalsContact C-N 3.33Å; F147-Q149 PolarHBondContact O-N 3.21Å; F147-F150 PolarHBondContact O-N 3.27Å; F147-L151 HydrophobicContact CD1-CD1 3.82Å; F147-L151 HydrophobicContact CD1-CG 4.31Å; F147-L151 HydrophobicContact CE1-CD1 3.39Å; F147-L151 HydrophobicContact CE1-CD2 4.49Å; F147-L151 HydrophobicContact CE1-CG 4Å; F147-L151 HydrophobicContact CE2-CD2 4.38Å; F147-L151 HydrophobicContact CE2-CG 4.29Å; F147-L151 HydrophobicContact CZ-CD1 3.8Å; F147-L151 HydrophobicContact CZ-CD2 4.05Å; F147-L151 HydrophobicContact CZ-CG 3.98Å; F147-L151 WeakPolarHBondContact O-CB 3.16Å; F147-L151 WeakPolarHBondContact O-CG 3.34Å; F147-L151 PolarHBondContact O-N 3.37Å |
| 148 | G | 91 | Very high | 90.7 | Very high | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -65.7 | -34.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | W140 F142 S145 E146 C152 | W140-G148 PolarHBondContact NE1-O 2.92Å; F142-G148 VanDerWaalsContact O-CA 3.31Å; F142-G148 WeakPolarHBondContact O-CA 3.34Å; S145-G148 PolarHBondContact O-N 3.34Å; S145-G148 PolarHBondContact OG-N 3.19Å; S145-G148 VanDerWaalsContact OG-N 3.17Å; E146-G148 PolarHBondContact O-N 3.24Å; G148-C152 WeakPolarHBondContact O-CB 3.26Å; G148-C152 PolarHBondContact O-N 3.26Å |
| 149 | Q | 91 | Very high | 91.2 | Very high | 88 Ų | 88 | 59.6 Ų | 59.6 | 41% | 0.411 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66.1 | -45.4 | 174.1 | -62.7 | 179.2 | 35.2 | 0 | 0 | 111.6 | S145 E146 F147 C152 K153 V220 | S145-Q149 PolarHBondContact O-N 2.86Å; E146-Q149 PolarHBondContact O-N 2.86Å; E146-Q149 PolarHBondContact OE1-NE2 3.37Å; F147-Q149 VanDerWaalsContact C-N 3.33Å; F147-Q149 PolarHBondContact O-N 3.21Å; Q149-C152 WeakPolarHBondContact O-CB 3.47Å; Q149-C152 PolarHBondContact O-N 3.39Å; Q149-K153 PolarHBondContact O-N 2.95Å; Q149-V220 HydrophobicContact CG-CG2 4.23Å |
| 150 | F | 93.9 | Very high | 91.6 | Very high | 116 Ų | 116 | 54.6 Ų | 54.6 | 51% | 0.509 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -58 | -50.1 | 173.8 | 170.3 | -100.7 | 0 | 0 | 0 | 111.4 | E146 F147 C152 K153 F154 | E146-F150 PolarHBondContact O-N 3.26Å; F147-F150 PolarHBondContact O-N 3.27Å; F150-C152 PolarHBondContact O-N 3.38Å; F150-K153 PolarHBondContact O-N 2.91Å; F150-K153 VanDerWaalsContact O-N 3.12Å; F150-F154 HydrophobicContact CD1-CB 4.34Å; F150-F154 HydrophobicContact CE1-CB 3.89Å; F150-F154 HydrophobicContact CE1-CD1 4.18Å; F150-F154 HydrophobicContact CE1-CD2 4.39Å; F150-F154 AromaticContact CE1-CG 3.9Å; F150-F154 HydrophobicContact CE1-CG 3.9Å; F150-F154 HydrophobicContact CE2-CB 4.25Å; F150-F154 HydrophobicContact CE2-CD2 4.46Å; F150-F154 HydrophobicContact CZ-CB 3.84Å; F150-F154 HydrophobicContact CZ-CD1 4.38Å; F150-F154 AromaticContact CZ-CD2 3.8Å; F150-F154 HydrophobicContact CZ-CD2 3.8Å; F150-F154 HydrophobicContact CZ-CE2 4.47Å; F150-F154 AromaticContact CZ-CG 3.74Å; F150-F154 HydrophobicContact CZ-CG 3.74Å; F150-F154 WeakPolarHBondContact O-CB 3.24Å; F150-F154 PolarHBondContact O-N 3.43Å |
| 151 | L | 94.1 | Very high | 91.9 | Very high | 23 Ų | 23 | 54.1 Ų | 54.1 | 12% | 0.12 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.1 | -35.4 | 178.6 | -75.3 | -177 | 0 | 0 | 0 | 112.4 | W140 F142 F147 K153 F154 L155 | W140-L151 HydrophobicContact CZ2-CB 3.97Å; F142-L151 HydrophobicContact CD2-CD1 4.16Å; F147-L151 HydrophobicContact CD1-CD1 3.82Å; F147-L151 HydrophobicContact CD1-CG 4.31Å; F147-L151 HydrophobicContact CE1-CD1 3.39Å; F147-L151 HydrophobicContact CE1-CD2 4.49Å; F147-L151 HydrophobicContact CE1-CG 4Å; F147-L151 HydrophobicContact CE2-CD2 4.38Å; F147-L151 HydrophobicContact CE2-CG 4.29Å; F147-L151 HydrophobicContact CZ-CD1 3.8Å; F147-L151 HydrophobicContact CZ-CD2 4.05Å; F147-L151 HydrophobicContact CZ-CG 3.98Å; F147-L151 WeakPolarHBondContact O-CB 3.16Å; F147-L151 WeakPolarHBondContact O-CG 3.34Å; F147-L151 PolarHBondContact O-N 3.37Å; L151-K153 PolarHBondContact O-N 3.39Å; L151-F154 PolarHBondContact O-N 2.64Å; L151-L155 HydrophobicContact CB-CD1 3.82Å; L151-L155 HydrophobicContact CB-CG 4.3Å; L151-L155 HydrophobicContact CD2-CD1 4.1Å; L151-L155 HydrophobicContact CD2-CD2 4.25Å; L151-L155 HydrophobicContact CD2-CG 4.1Å; L151-L155 HydrophobicContact CG-CD1 4.38Å; L151-L155 WeakPolarHBondContact O-CB 3.35Å; L151-L155 WeakPolarHBondContact O-CD1 3.32Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.48Å; L151-L155 PolarHBondContact O-N 3.08Å |
| 152 | C | 94.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.1 | -30.4 | -179.8 | 178.2 | 0 | 0 | 0 | 0 | 112.6 | W140 G148 Q149 F150 P156 F218 A219 V220 C233 | W140-C152 HydrophobicContact CZ2-CB 3.89Å; G148-C152 WeakPolarHBondContact O-CB 3.26Å; G148-C152 PolarHBondContact O-N 3.26Å; Q149-C152 WeakPolarHBondContact O-CB 3.47Å; Q149-C152 PolarHBondContact O-N 3.39Å; F150-C152 PolarHBondContact O-N 3.38Å; C152-P156 WeakPolarHBondContact O-CD 3.28Å; C152-P156 VanDerWaalsContact O-CG 3.25Å; C152-P156 WeakPolarHBondContact O-CG 3.37Å; C152-F218 VanDerWaalsContact O-CB 3.29Å; C152-F218 WeakPolarHBondContact O-CB 3.34Å; C152-A219 PolarHBondContact SG-O 3.03Å; C152-A219 VanDerWaalsContact SG-O 3.4Å; C152-V220 HydrophobicContact CB-CG2 3.61Å; C152-C233 WeakPolarHBondContact CA-SG 3.38Å; C152-C233 HydrophobicContact CB-CB 3.81Å; C152-C233 WeakPolarHBondContact CB-SG 3.48Å; C152-C233 PolarHBondContact O-SG 3.48Å; C152-C233 VanDerWaalsContact SG-CA 3.53Å; C152-C233 WeakPolarHBondContact SG-CB 3.3Å; C152-C233 CovalentContact SG-SG 2.02Å; C152-C233 PolarHBondContact SG-SG 3.36Å |
| 153 | K | 94.9 | Very high | 92.8 | Very high | 86 Ų | 86 | 47.9 Ų | 47.9 | 37% | 0.374 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -87.2 | -43.7 | 174.4 | -67.1 | 171.7 | 172.5 | -79.9 | 0 | 111.7 | Q149 F150 L151 F157 A215 I216 F218 | Q149-K153 PolarHBondContact O-N 2.95Å; F150-K153 PolarHBondContact O-N 2.91Å; F150-K153 VanDerWaalsContact O-N 3.12Å; L151-K153 PolarHBondContact O-N 3.39Å; K153-F157 VanDerWaalsContact O-CB 3.3Å; K153-F157 WeakPolarHBondContact O-CB 3.37Å; K153-F157 PolarHBondContact O-N 3.44Å; K153-A215 VanDerWaalsContact CG-O 3.29Å; K153-A215 WeakPolarHBondContact CG-O 3.32Å; K153-A215 PolarHBondContact NZ-O 3.01Å; K153-I216 PolarHBondContact NZ-O 2.98Å; K153-F218 VanDerWaalsContact CG-O 3.27Å; K153-F218 WeakPolarHBondContact CG-O 3.47Å; K153-F218 PolarHBondContact NZ-O 3.48Å |
| 154 | F | 95.3 | Very high | 93.6 | Very high | 77 Ų | 77 | 47.4 Ų | 47.4 | 34% | 0.338 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -69.3 | -42.6 | -173 | -178.7 | -105.9 | 0 | 0 | 0 | 113.4 | F150 L151 F157 I158 | F150-F154 HydrophobicContact CD1-CB 4.34Å; F150-F154 HydrophobicContact CE1-CB 3.89Å; F150-F154 HydrophobicContact CE1-CD1 4.18Å; F150-F154 HydrophobicContact CE1-CD2 4.39Å; F150-F154 AromaticContact CE1-CG 3.9Å; F150-F154 HydrophobicContact CE1-CG 3.9Å; F150-F154 HydrophobicContact CE2-CB 4.25Å; F150-F154 HydrophobicContact CE2-CD2 4.46Å; F150-F154 HydrophobicContact CZ-CB 3.84Å; F150-F154 HydrophobicContact CZ-CD1 4.38Å; F150-F154 AromaticContact CZ-CD2 3.8Å; F150-F154 HydrophobicContact CZ-CD2 3.8Å; F150-F154 HydrophobicContact CZ-CE2 4.47Å; F150-F154 AromaticContact CZ-CG 3.74Å; F150-F154 HydrophobicContact CZ-CG 3.74Å; F150-F154 WeakPolarHBondContact O-CB 3.24Å; F150-F154 PolarHBondContact O-N 3.43Å; L151-F154 PolarHBondContact O-N 2.64Å; F154-F157 WeakPolarHBondContact O-CB 3.24Å; F154-F157 PolarHBondContact O-N 2.76Å; F154-I158 HydrophobicContact CD2-CG1 4.22Å; F154-I158 HydrophobicContact CE1-CG1 4.1Å; F154-I158 HydrophobicContact CE2-CD1 4.31Å; F154-I158 HydrophobicContact CE2-CG1 3.66Å; F154-I158 HydrophobicContact CZ-CD1 4.41Å; F154-I158 HydrophobicContact CZ-CG1 3.6Å; F154-I158 PolarHBondContact O-N 3.28Å |
| 155 | L | 94.9 | Very high | 94.3 | Very high | 18 Ų | 18 | 40 Ų | 40 | 9% | 0.094 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -69 | -48.9 | -173.7 | -61.5 | 165.4 | 0 | 0 | 0 | 112.5 | I126 I130 W140 L151 F157 I158 Q159 | I126-L155 HydrophobicContact CB-CD2 4.46Å; I126-L155 HydrophobicContact CG1-CD2 4.33Å; I126-L155 HydrophobicContact CG2-CB 4.24Å; I126-L155 HydrophobicContact CG2-CD2 3.59Å; I130-L155 HydrophobicContact CD1-CD1 4Å; I130-L155 HydrophobicContact CG1-CD1 3.54Å; W140-L155 HydrophobicContact CH2-CD1 3.59Å; W140-L155 HydrophobicContact CZ2-CD1 3.87Å; L151-L155 HydrophobicContact CB-CD1 3.82Å; L151-L155 HydrophobicContact CB-CG 4.3Å; L151-L155 HydrophobicContact CD2-CD1 4.1Å; L151-L155 HydrophobicContact CD2-CD2 4.25Å; L151-L155 HydrophobicContact CD2-CG 4.1Å; L151-L155 HydrophobicContact CG-CD1 4.38Å; L151-L155 WeakPolarHBondContact O-CB 3.35Å; L151-L155 WeakPolarHBondContact O-CD1 3.32Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.48Å; L151-L155 PolarHBondContact O-N 3.08Å; L155-F157 VanDerWaalsContact C-N 3.27Å; L155-F157 PolarHBondContact O-N 2.96Å; L155-I158 PolarHBondContact O-N 3.17Å; L155-Q159 WeakPolarHBondContact O-CB 3.29Å; L155-Q159 PolarHBondContact O-N 3.11Å |
| 156 | P | 94.6 | Very high | 94.5 | Very high | 13 Ų | 13 | 38 Ų | 38 | 8% | 0.084 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -61.6 | -36.3 | 174.6 | -22.9 | 35.7 | 0 | 0 | 0 | 112.6 | C152 K160 E214 F218 | C152-P156 WeakPolarHBondContact O-CD 3.28Å; C152-P156 VanDerWaalsContact O-CG 3.25Å; C152-P156 WeakPolarHBondContact O-CG 3.37Å; P156-K160 WeakPolarHBondContact O-CG 3.27Å; P156-K160 PolarHBondContact O-N 2.78Å; P156-E214 HydrophobicContact CB-CB 4.27Å; P156-F218 HydrophobicContact CB-CD1 4.17Å; P156-F218 HydrophobicContact CB-CD2 4.27Å; P156-F218 HydrophobicContact CB-CE1 4.25Å; P156-F218 HydrophobicContact CB-CE2 4.41Å; P156-F218 HydrophobicContact CB-CG 4.17Å; P156-F218 HydrophobicContact CB-CZ 4.37Å; P156-F218 HydrophobicContact CG-CB 4.39Å; P156-F218 HydrophobicContact CG-CD1 3.56Å; P156-F218 HydrophobicContact CG-CD2 4.46Å; P156-F218 HydrophobicContact CG-CE1 3.89Å; P156-F218 HydrophobicContact CG-CG 3.86Å; P156-F218 HydrophobicContact CG-CZ 4.5Å |
| 157 | F | 97 | Very high | 94.7 | Very high | 38 Ų | 38 | 31.3 Ų | 31.3 | 17% | 0.167 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -60 | -56.6 | 175.4 | 167.4 | -102.2 | 0 | 0 | 0 | 111.9 | K153 F154 L155 Q159 K160 A161 F208 A211 I212 A215 | K153-F157 VanDerWaalsContact O-CB 3.3Å; K153-F157 WeakPolarHBondContact O-CB 3.37Å; K153-F157 PolarHBondContact O-N 3.44Å; F154-F157 WeakPolarHBondContact O-CB 3.24Å; F154-F157 PolarHBondContact O-N 2.76Å; L155-F157 VanDerWaalsContact C-N 3.27Å; L155-F157 PolarHBondContact O-N 2.96Å; F157-Q159 VanDerWaalsContact C-N 3.31Å; F157-Q159 PolarHBondContact O-N 3.33Å; F157-K160 PolarHBondContact O-N 3Å; F157-A161 WeakPolarHBondContact O-CB 3.28Å; F157-A161 PolarHBondContact O-N 3.31Å; F157-F208 HydrophobicContact CE1-CD1 4.24Å; F157-F208 WeakPolarHBondContact CE2-O 3.45Å; F157-F208 HydrophobicContact CZ-CB 4.27Å; F157-F208 AromaticContact CZ-CD1 3.83Å; F157-F208 HydrophobicContact CZ-CD1 3.83Å; F157-F208 HydrophobicContact CZ-CG 4.38Å; F157-A211 HydrophobicContact CD2-CB 3.65Å; F157-A211 WeakPolarHBondContact CD2-O 3.34Å; F157-A211 HydrophobicContact CE2-CB 3.81Å; F157-A211 WeakPolarHBondContact O-CB 3.27Å; F157-I212 HydrophobicContact CE2-CG1 4.44Å; F157-A215 HydrophobicContact CB-CB 3.99Å; F157-A215 HydrophobicContact CD2-CB 4.11Å; F157-A215 HydrophobicContact CG-CB 4.19Å |
| 158 | I | 96.7 | Very high | 94.9 | Very high | 19 Ų | 19 | 26.7 Ų | 26.7 | 10% | 0.097 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -66.4 | -35.5 | 179.3 | -73.2 | -60 | 0 | 0 | 0 | 111.6 | I122 I126 F154 L155 K160 A161 S162 F208 | I122-I158 HydrophobicContact CG2-CG2 3.29Å; I126-I158 HydrophobicContact CD1-CB 3.95Å; I126-I158 HydrophobicContact CD1-CG2 3.2Å; F154-I158 HydrophobicContact CD2-CG1 4.22Å; F154-I158 HydrophobicContact CE1-CG1 4.1Å; F154-I158 HydrophobicContact CE2-CD1 4.31Å; F154-I158 HydrophobicContact CE2-CG1 3.66Å; F154-I158 HydrophobicContact CZ-CD1 4.41Å; F154-I158 HydrophobicContact CZ-CG1 3.6Å; F154-I158 PolarHBondContact O-N 3.28Å; L155-I158 PolarHBondContact O-N 3.17Å; I158-K160 PolarHBondContact O-N 3.49Å; I158-A161 PolarHBondContact O-N 2.82Å; I158-S162 WeakPolarHBondContact O-CB 3.42Å; I158-S162 PolarHBondContact O-N 3.46Å; I158-S162 PolarHBondContact O-OG 3.41Å; I158-F208 HydrophobicContact CD1-CE1 3.99Å |
| 159 | Q | 95.1 | Very high | 95 | Very high | 40 Ų | 40 | 26.7 Ų | 26.7 | 19% | 0.187 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -55.9 | -53.5 | 174.3 | -172.2 | -171.2 | 11.7 | 0 | 0 | 109.6 | Y123 D127 L155 F157 A161 S162 V163 | Y123-Q159 HydrophobicContact CD2-CG 3.98Å; Y123-Q159 HydrophobicContact CE2-CG 3.47Å; Y123-Q159 VanDerWaalsContact CE2-CG 3.47Å; D127-Q159 PolarHBondContact OD1-NE2 3.12Å; L155-Q159 WeakPolarHBondContact O-CB 3.29Å; L155-Q159 PolarHBondContact O-N 3.11Å; F157-Q159 VanDerWaalsContact C-N 3.31Å; F157-Q159 PolarHBondContact O-N 3.33Å; Q159-A161 PolarHBondContact O-N 2.92Å; Q159-S162 PolarHBondContact O-N 3.31Å; Q159-V163 WeakPolarHBondContact O-CG2 3.45Å; Q159-V163 PolarHBondContact O-N 2.87Å; Q159-V163 VanDerWaalsContact O-N 3.11Å |
| 160 | K | 95.3 | Very high | 94.9 | Very high | 14 Ų | 14 | 22.7 Ų | 22.7 | 6% | 0.061 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -66.7 | -36.8 | 178.5 | -68 | -44.6 | -175.5 | 179 | 0 | 114.2 | P156 F157 I158 S162 V163 G164 A211 E214 L253 | P156-K160 WeakPolarHBondContact O-CG 3.27Å; P156-K160 PolarHBondContact O-N 2.78Å; F157-K160 PolarHBondContact O-N 3Å; I158-K160 PolarHBondContact O-N 3.49Å; K160-S162 VanDerWaalsContact C-N 3.3Å; K160-S162 PolarHBondContact O-N 2.97Å; K160-V163 PolarHBondContact O-N 3.38Å; K160-G164 PolarHBondContact O-N 3.4Å; K160-A211 HydrophobicContact CB-CB 3.95Å; K160-E214 HydrophobicContact CB-CG 4.17Å; K160-E214 VanDerWaalsContact CE-OE1 3.24Å; K160-E214 WeakPolarHBondContact CE-OE1 3.36Å; K160-E214 HydrophobicContact CG-CG 3.59Å; K160-E214 WeakPolarHBondContact CG-OE1 3.42Å; K160-L253 HydrophobicContact CD-CD2 4.32Å |
| 161 | A | 97.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -60.7 | -42.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111 | F157 I158 Q159 V163 G164 I165 S207 F208 A211 | F157-A161 WeakPolarHBondContact O-CB 3.28Å; F157-A161 PolarHBondContact O-N 3.31Å; I158-A161 PolarHBondContact O-N 2.82Å; Q159-A161 PolarHBondContact O-N 2.92Å; A161-V163 PolarHBondContact O-N 2.93Å; A161-G164 CarbonylContact O-C 3.46Å; A161-G164 WeakPolarHBondContact O-CA 3.24Å; A161-G164 PolarHBondContact O-N 3.01Å; A161-I165 WeakPolarHBondContact O-CG1 3.41Å; A161-I165 PolarHBondContact O-N 3.28Å; A161-S207 WeakPolarHBondContact O-CB 3.35Å; A161-F208 HydrophobicContact CB-CD1 3.52Å; A161-F208 HydrophobicContact CB-CE1 3.81Å; A161-A211 HydrophobicContact CB-CB 3.98Å |
| 162 | S | 96.7 | Very high | 94.7 | Very high | 2 Ų | 2 | 16.9 Ų | 16.9 | 1% | 0.014 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -67.2 | -37.7 | 179.9 | -52.2 | 0 | 0 | 0 | 0 | 112.5 | I122 I158 Q159 K160 G164 I165 T166 | I122-S162 VanDerWaalsContact CG2-OG 3.32Å; I122-S162 WeakPolarHBondContact CG2-OG 3.49Å; I158-S162 WeakPolarHBondContact O-CB 3.42Å; I158-S162 PolarHBondContact O-N 3.46Å; I158-S162 PolarHBondContact O-OG 3.41Å; Q159-S162 PolarHBondContact O-N 3.31Å; K160-S162 VanDerWaalsContact C-N 3.3Å; K160-S162 PolarHBondContact O-N 2.97Å; S162-G164 VanDerWaalsContact C-N 3.29Å; S162-G164 PolarHBondContact O-N 3.31Å; S162-I165 PolarHBondContact O-N 3.09Å; S162-T166 PolarHBondContact O-N 3.11Å; S162-T166 PolarHBondContact O-OG1 3.15Å |
| 163 | V | 94.8 | Very high | 94.3 | Very high | 5 Ų | 5 | 17.4 Ų | 17.4 | 3% | 0.03 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62.6 | -39.6 | 169.8 | -173 | 0 | 0 | 0 | 0 | 110.6 | Y123 Q159 K160 A161 T166 V167 Y257 W313 | Y123-V163 HydrophobicContact CD2-CG2 3.95Å; Y123-V163 HydrophobicContact CE2-CG2 3.55Å; Q159-V163 WeakPolarHBondContact O-CG2 3.45Å; Q159-V163 PolarHBondContact O-N 2.87Å; Q159-V163 VanDerWaalsContact O-N 3.11Å; K160-V163 PolarHBondContact O-N 3.38Å; A161-V163 PolarHBondContact O-N 2.93Å; V163-T166 WeakPolarHBondContact O-CB 3.36Å; V163-T166 PolarHBondContact O-N 3.44Å; V163-V167 HydrophobicContact CG1-CG1 4.36Å; V163-V167 WeakPolarHBondContact O-CG1 3.21Å; V163-V167 WeakPolarHBondContact O-CG2 3.46Å; V163-V167 PolarHBondContact O-N 2.85Å; V163-Y257 HydrophobicContact CB-CD1 4.12Å; V163-Y257 HydrophobicContact CB-CE1 4.25Å; V163-Y257 HydrophobicContact CG1-CD1 3.65Å; V163-Y257 HydrophobicContact CG1-CE1 4.28Å; V163-Y257 HydrophobicContact CG1-CG 4.46Å; V163-W313 HydrophobicContact CB-CH2 4.04Å; V163-W313 HydrophobicContact CG1-CE3 4.38Å; V163-W313 HydrophobicContact CG1-CH2 3.4Å; V163-W313 VanDerWaalsContact CG1-CH2 3.4Å; V163-W313 HydrophobicContact CG1-CZ2 3.89Å; V163-W313 HydrophobicContact CG1-CZ3 3.64Å; V163-W313 HydrophobicContact CG2-CH2 3.31Å; V163-W313 HydrophobicContact CG2-CZ2 4.08Å; V163-W313 HydrophobicContact CG2-CZ3 4.04Å |
| 164 | G | 96.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 13.6 Ų | 13.6 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -59.4 | -47.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | K160 A161 S162 T166 V167 L168 Y257 | K160-G164 PolarHBondContact O-N 3.4Å; A161-G164 CarbonylContact O-C 3.46Å; A161-G164 WeakPolarHBondContact O-CA 3.24Å; A161-G164 PolarHBondContact O-N 3.01Å; S162-G164 VanDerWaalsContact C-N 3.29Å; S162-G164 PolarHBondContact O-N 3.31Å; G164-T166 VanDerWaalsContact C-N 3.25Å; G164-T166 PolarHBondContact O-N 2.87Å; G164-V167 WeakPolarHBondContact O-CG2 3.43Å; G164-V167 PolarHBondContact O-N 2.91Å; G164-L168 WeakPolarHBondContact O-CB 3.43Å; G164-L168 VanDerWaalsContact O-CG 3.31Å; G164-L168 WeakPolarHBondContact O-CG 3.44Å; G164-L168 PolarHBondContact O-N 2.73Å; G164-Y257 VanDerWaalsContact CA-CE1 3.47Å |
| 165 | I | 96.2 | Very high | 93.4 | Very high | 1 Ų | 1 | 11.5 Ų | 11.5 | 1% | 0.005 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -58.9 | -43.2 | 176.9 | -68 | 164.7 | 0 | 0 | 0 | 109.4 | A161 S162 N169 W204 S207 | A161-I165 WeakPolarHBondContact O-CG1 3.41Å; A161-I165 PolarHBondContact O-N 3.28Å; S162-I165 PolarHBondContact O-N 3.09Å; I165-N169 VanDerWaalsContact CG2-ND2 3.27Å; I165-N169 WeakPolarHBondContact CG2-ND2 3.34Å; I165-N169 VanDerWaalsContact O-CB 3.24Å; I165-N169 WeakPolarHBondContact O-CB 3.45Å; I165-N169 PolarHBondContact O-N 3.31Å; I165-N169 PolarHBondContact O-ND2 3.37Å; I165-W204 HydrophobicContact CD1-CD2 3.69Å; I165-W204 HydrophobicContact CD1-CE3 3.64Å; I165-W204 HydrophobicContact CD1-CG 4.35Å; I165-W204 HydrophobicContact CD1-CH2 3.91Å; I165-W204 HydrophobicContact CD1-CZ2 3.93Å; I165-W204 HydrophobicContact CD1-CZ3 3.76Å; I165-W204 HydrophobicContact CG1-CD2 4.26Å; I165-W204 HydrophobicContact CG1-CG 4.44Å; I165-W204 HydrophobicContact CG2-CZ2 4.48Å; I165-S207 WeakPolarHBondContact CA-OG 3.47Å; I165-S207 PolarHBondContact N-OG 3.49Å |
| 166 | T | 93.7 | Very high | 92.9 | Very high | 2 Ų | 2 | 10.8 Ų | 10.8 | 1% | 0.012 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -60.5 | -55.5 | 179.1 | -57.6 | 0 | 0 | 0 | 0 | 111.5 | L116 S162 V163 G164 L168 N169 L170 | L116-T166 HydrophobicContact CD1-CG2 3.79Å; S162-T166 PolarHBondContact O-N 3.11Å; S162-T166 PolarHBondContact O-OG1 3.15Å; V163-T166 WeakPolarHBondContact O-CB 3.36Å; V163-T166 PolarHBondContact O-N 3.44Å; G164-T166 VanDerWaalsContact C-N 3.25Å; G164-T166 PolarHBondContact O-N 2.87Å; T166-L168 PolarHBondContact O-N 3.37Å; T166-N169 PolarHBondContact O-N 3.39Å; T166-L170 HydrophobicContact CG2-CD1 4.47Å; T166-L170 WeakPolarHBondContact O-CG 3.31Å; T166-L170 PolarHBondContact O-N 2.73Å |
| 167 | V | 93.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -67.8 | -39.6 | -173.9 | -59.4 | 0 | 0 | 0 | 0 | 112.3 | V163 G164 L170 C171 Y257 P261 F309 | V163-V167 HydrophobicContact CG1-CG1 4.36Å; V163-V167 WeakPolarHBondContact O-CG1 3.21Å; V163-V167 WeakPolarHBondContact O-CG2 3.46Å; V163-V167 PolarHBondContact O-N 2.85Å; G164-V167 WeakPolarHBondContact O-CG2 3.43Å; G164-V167 PolarHBondContact O-N 2.91Å; V167-L170 PolarHBondContact O-N 3.46Å; V167-C171 PolarHBondContact O-N 3.29Å; V167-C171 VanDerWaalsContact O-N 3.09Å; V167-C171 PolarHBondContact O-SG 2.86Å; V167-C171 VanDerWaalsContact O-SG 3.39Å; V167-Y257 VanDerWaalsContact CG1-O 3.28Å; V167-Y257 WeakPolarHBondContact CG1-O 3.33Å; V167-Y257 HydrophobicContact CG2-CD1 3.96Å; V167-P261 HydrophobicContact CB-CB 4.31Å; V167-P261 HydrophobicContact CB-CG 4.09Å; V167-P261 HydrophobicContact CG1-CG 4.24Å; V167-F309 HydrophobicContact CG1-CE2 3.73Å; V167-F309 HydrophobicContact CG1-CZ 3.65Å |
| 168 | L | 95 | Very high | 91.4 | Very high | 19 Ų | 19 | 13.5 Ų | 13.5 | 10% | 0.099 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -70.5 | -36.3 | 178.1 | -68.3 | 175.8 | 0 | 0 | 0 | 111.9 | G164 T166 C171 A172 I203 L206 F256 | G164-L168 WeakPolarHBondContact O-CB 3.43Å; G164-L168 VanDerWaalsContact O-CG 3.31Å; G164-L168 WeakPolarHBondContact O-CG 3.44Å; G164-L168 PolarHBondContact O-N 2.73Å; T166-L168 PolarHBondContact O-N 3.37Å; L168-C171 WeakPolarHBondContact O-CB 3.45Å; L168-C171 PolarHBondContact O-N 3.07Å; L168-A172 WeakPolarHBondContact O-CB 3.35Å; L168-A172 PolarHBondContact O-N 3.46Å; L168-I203 HydrophobicContact CB-CB 4.43Å; L168-I203 HydrophobicContact CB-CG1 4.11Å; L168-I203 HydrophobicContact CB-CG2 3.79Å; L168-I203 HydrophobicContact CD1-CG2 4.36Å; L168-L206 HydrophobicContact CD1-CB 4.18Å; L168-L206 HydrophobicContact CD1-CD2 3.82Å; L168-L206 HydrophobicContact CD1-CG 4.07Å; L168-L206 HydrophobicContact CD2-CD2 4.3Å; L168-F256 HydrophobicContact CD2-CZ 4.27Å |
| 169 | N | 92.9 | Very high | 90.6 | Very high | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -65 | -37.6 | 171.6 | -84.1 | -62.8 | 0 | 0 | 0 | 111.9 | S115 L116 I165 T166 C171 A172 L173 | S115-N169 PolarHBondContact OG-ND2 2.96Å; S115-N169 PolarHBondContact OG-OD1 3.33Å; L116-N169 HydrophobicContact CB-CB 4.17Å; L116-N169 HydrophobicContact CD1-CB 4.21Å; I165-N169 VanDerWaalsContact CG2-ND2 3.27Å; I165-N169 WeakPolarHBondContact CG2-ND2 3.34Å; I165-N169 VanDerWaalsContact O-CB 3.24Å; I165-N169 WeakPolarHBondContact O-CB 3.45Å; I165-N169 PolarHBondContact O-N 3.31Å; I165-N169 PolarHBondContact O-ND2 3.37Å; T166-N169 PolarHBondContact O-N 3.39Å; N169-C171 VanDerWaalsContact C-N 3.34Å; N169-C171 PolarHBondContact O-N 2.93Å; N169-A172 PolarHBondContact O-N 2.98Å; N169-L173 WeakPolarHBondContact O-CB 3.3Å; N169-L173 VanDerWaalsContact O-CG 3.24Å; N169-L173 WeakPolarHBondContact O-CG 3.36Å; N169-L173 PolarHBondContact O-N 3.25Å |
| 170 | L | 89.4 | Confident | 89.7 | Confident | 4 Ų | 4 | 15.6 Ų | 15.6 | 2% | 0.021 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -62.8 | -40.6 | 175.1 | -71.5 | 175 | 0 | 0 | 0 | 112 | T166 V167 S174 F309 | T166-L170 HydrophobicContact CG2-CD1 4.47Å; T166-L170 WeakPolarHBondContact O-CG 3.31Å; T166-L170 PolarHBondContact O-N 2.73Å; V167-L170 PolarHBondContact O-N 3.46Å; L170-S174 PolarHBondContact O-N 3.33Å; L170-S174 VanDerWaalsContact O-N 3.09Å; L170-S174 PolarHBondContact O-OG 3.37Å; L170-F309 HydrophobicContact CD1-CB 4.15Å; L170-F309 HydrophobicContact CD1-CD2 3.79Å; L170-F309 HydrophobicContact CD1-CE2 4.42Å; L170-F309 HydrophobicContact CD1-CG 3.92Å |
| 171 | C | 92.1 | Very high | 88.5 | Confident | 9 Ų | 9 | 15.5 Ų | 15.5 | 6% | 0.061 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -60.9 | -51.1 | 171.6 | -70 | 0 | 0 | 0 | 0 | 111.5 | V167 L168 N169 L173 S174 V175 P261 C264 | V167-C171 PolarHBondContact O-N 3.29Å; V167-C171 VanDerWaalsContact O-N 3.09Å; V167-C171 PolarHBondContact O-SG 2.86Å; V167-C171 VanDerWaalsContact O-SG 3.39Å; L168-C171 WeakPolarHBondContact O-CB 3.45Å; L168-C171 PolarHBondContact O-N 3.07Å; N169-C171 VanDerWaalsContact C-N 3.34Å; N169-C171 PolarHBondContact O-N 2.93Å; C171-L173 VanDerWaalsContact C-N 3.34Å; C171-L173 PolarHBondContact O-N 2.95Å; C171-S174 WeakPolarHBondContact O-CB 3.49Å; C171-S174 PolarHBondContact O-N 3.15Å; C171-S174 VanDerWaalsContact O-N 3.11Å; C171-V175 WeakPolarHBondContact O-CG2 3.23Å; C171-V175 PolarHBondContact O-N 3.43Å; C171-P261 VanDerWaalsContact SG-CA 3.58Å; C171-C264 VanDerWaalsContact SG-SG 3.64Å |
| 172 | A | 90.9 | Very high | 87.3 | Confident | 8 Ų | 8 | 16.9 Ų | 16.9 | 7% | 0.066 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -58.8 | -42.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L112 L168 N169 S174 V175 D176 E199 I203 | L112-A172 HydrophobicContact CD1-CB 4.18Å; L112-A172 HydrophobicContact CD2-CB 4.14Å; L168-A172 WeakPolarHBondContact O-CB 3.35Å; L168-A172 PolarHBondContact O-N 3.46Å; N169-A172 PolarHBondContact O-N 2.98Å; A172-S174 VanDerWaalsContact C-N 3.32Å; A172-S174 PolarHBondContact O-N 3.24Å; A172-V175 PolarHBondContact O-N 3.4Å; A172-D176 WeakPolarHBondContact O-CB 3.34Å; A172-D176 PolarHBondContact O-N 3.18Å; A172-E199 WeakPolarHBondContact CB-OE1 3.47Å; A172-I203 HydrophobicContact CB-CD1 3.92Å |
| 173 | L | 86.8 | Confident | 85.9 | Confident | 10 Ų | 10 | 19.6 Ų | 19.6 | 5% | 0.052 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.7 | -41.5 | 175.3 | -75.6 | 169.8 | 0 | 0 | 0 | 111.5 | L112 I113 L116 N169 C171 D176 R177 | L112-L173 HydrophobicContact CB-CD2 3.76Å; L112-L173 HydrophobicContact CB-CG 4.21Å; L112-L173 HydrophobicContact CD1-CD2 4.17Å; I113-L173 HydrophobicContact CG1-CD1 4.45Å; I113-L173 HydrophobicContact CG1-CD2 4.08Å; L116-L173 HydrophobicContact CD2-CD1 4.34Å; N169-L173 WeakPolarHBondContact O-CB 3.3Å; N169-L173 VanDerWaalsContact O-CG 3.24Å; N169-L173 WeakPolarHBondContact O-CG 3.36Å; N169-L173 PolarHBondContact O-N 3.25Å; C171-L173 VanDerWaalsContact C-N 3.34Å; C171-L173 PolarHBondContact O-N 2.95Å; L173-D176 PolarHBondContact O-N 2.93Å; L173-R177 VanDerWaalsContact O-CG 3.29Å; L173-R177 WeakPolarHBondContact O-CG 3.24Å; L173-R177 PolarHBondContact O-N 3.39Å |
| 174 | S | 85.6 | Confident | 84 | Confident | 7 Ų | 7 | 28 Ų | 28 | 5% | 0.049 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.7 | -43.2 | 177.3 | -57.7 | 0 | 0 | 0 | 0 | 112.3 | L170 C171 A172 R177 Y178 T265 V302 | L170-S174 PolarHBondContact O-N 3.33Å; L170-S174 VanDerWaalsContact O-N 3.09Å; L170-S174 PolarHBondContact O-OG 3.37Å; C171-S174 WeakPolarHBondContact O-CB 3.49Å; C171-S174 PolarHBondContact O-N 3.15Å; C171-S174 VanDerWaalsContact O-N 3.11Å; A172-S174 VanDerWaalsContact C-N 3.32Å; A172-S174 PolarHBondContact O-N 3.24Å; S174-R177 PolarHBondContact O-N 3.34Å; S174-Y178 PolarHBondContact O-N 2.91Å; S174-T265 WeakPolarHBondContact OG-CG2 3.32Å; S174-V302 WeakPolarHBondContact OG-CG1 3.1Å |
| 175 | V | 86.8 | Confident | 81.8 | Confident | 33 Ų | 33 | 32.9 Ų | 32.9 | 20% | 0.2 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.6 | -46.8 | 174 | 174.7 | 0 | 0 | 0 | 0 | 110.7 | C171 A172 R177 Y178 R179 F268 | C171-V175 WeakPolarHBondContact O-CG2 3.23Å; C171-V175 PolarHBondContact O-N 3.43Å; A172-V175 PolarHBondContact O-N 3.4Å; V175-R177 VanDerWaalsContact C-N 3.33Å; V175-R177 PolarHBondContact O-N 3.01Å; V175-Y178 PolarHBondContact O-N 3.4Å; V175-R179 HydrophobicContact CG1-CG 4.26Å; V175-R179 WeakPolarHBondContact O-CB 3.12Å; V175-R179 VanDerWaalsContact O-CG 3.28Å; V175-R179 WeakPolarHBondContact O-CG 3.29Å; V175-R179 PolarHBondContact O-N 2.67Å; V175-F268 HydrophobicContact CG2-CD2 3.76Å; V175-F268 HydrophobicContact CG2-CE1 4.16Å; V175-F268 HydrophobicContact CG2-CE2 3.36Å; V175-F268 HydrophobicContact CG2-CG 4.36Å; V175-F268 HydrophobicContact CG2-CZ 3.59Å |
| 176 | D | 83.4 | Confident | 79.9 | Confident | 2 Ų | 2 | 36.3 Ų | 36.3 | 1% | 0.011 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.3 | -40 | 178.8 | 179.1 | 79.3 | 0 | 0 | 0 | 111.8 | P109 A172 L173 R179 A180 R186 | P109-D176 WeakPolarHBondContact CG-OD2 3.32Å; A172-D176 WeakPolarHBondContact O-CB 3.34Å; A172-D176 PolarHBondContact O-N 3.18Å; L173-D176 PolarHBondContact O-N 2.93Å; D176-R179 PolarHBondContact O-N 3Å; D176-R179 IonicContact OD1-NH1 2.67Å; D176-A180 WeakPolarHBondContact O-CB 3.46Å; D176-A180 PolarHBondContact O-N 3.37Å; D176-R186 IonicContact OD1-NH1 2.73Å; D176-R186 PolarHBondContact OD1-NH1 3.47Å; D176-R186 VanDerWaalsContact OD1-NH1 3.14Å |
| 177 | R | 81 | Confident | 77.8 | Confident | 49 Ų | 49 | 42.8 Ų | 42.8 | 19% | 0.185 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.9 | -48.7 | 173.7 | -69 | -46.7 | 90 | -172.3 | 10.4 | 111.9 | L173 S174 V175 R179 A180 V181 V298 V302 | L173-R177 VanDerWaalsContact O-CG 3.29Å; L173-R177 WeakPolarHBondContact O-CG 3.24Å; L173-R177 PolarHBondContact O-N 3.39Å; S174-R177 PolarHBondContact O-N 3.34Å; V175-R177 VanDerWaalsContact C-N 3.33Å; V175-R177 PolarHBondContact O-N 3.01Å; R177-R179 PolarHBondContact O-N 3.29Å; R177-A180 PolarHBondContact O-N 3.02Å; R177-V181 WeakPolarHBondContact O-CG2 3.37Å; R177-V181 PolarHBondContact O-N 3.03Å; R177-V298 VanDerWaalsContact NH1-CG1 3.3Å; R177-V302 HydrophobicContact CG-CB 4.34Å; R177-V302 HydrophobicContact CG-CG2 3.54Å |
| 178 | Y | 80.5 | Confident | 75.9 | Confident | 59 Ų | 59 | 48.5 Ų | 48.5 | 23% | 0.231 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -58.7 | -48.2 | 177.5 | 168.2 | -108.3 | 0 | 0 | 0 | 111 | S174 V175 A180 V181 A182 F268 L271 M272 | S174-Y178 PolarHBondContact O-N 2.91Å; V175-Y178 PolarHBondContact O-N 3.4Å; Y178-A180 VanDerWaalsContact C-N 3.33Å; Y178-A180 PolarHBondContact O-N 2.98Å; Y178-V181 PolarHBondContact O-N 3.3Å; Y178-A182 HydrophobicContact CE1-CB 4.38Å; Y178-A182 HydrophobicContact CE2-CB 4.12Å; Y178-A182 WeakPolarHBondContact O-CB 3.48Å; Y178-A182 PolarHBondContact O-N 2.92Å; Y178-F268 AromaticContact CD1-CD1 3.71Å; Y178-F268 HydrophobicContact CD1-CD1 3.71Å; Y178-F268 HydrophobicContact CD1-CE1 4.03Å; Y178-F268 HydrophobicContact CE1-CD1 4.43Å; Y178-F268 AromaticContact CG-CD1 3.84Å; Y178-F268 HydrophobicContact CG-CD1 3.84Å; Y178-L271 HydrophobicContact CD2-CB 3.93Å; Y178-L271 HydrophobicContact CE2-CB 3.55Å; Y178-M272 HydrophobicContact CD2-CB 4.08Å |
| 179 | R | 79.5 | Confident | 74.1 | Confident | 86 Ų | 86 | 49.8 Ų | 49.8 | 33% | 0.325 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -60.1 | -40.4 | 178.3 | -73.7 | 176.2 | 64.9 | -119.1 | 1.1 | 112.6 | V175 D176 R177 V181 S183 R186 | V175-R179 HydrophobicContact CG1-CG 4.26Å; V175-R179 WeakPolarHBondContact O-CB 3.12Å; V175-R179 VanDerWaalsContact O-CG 3.28Å; V175-R179 WeakPolarHBondContact O-CG 3.29Å; V175-R179 PolarHBondContact O-N 2.67Å; D176-R179 PolarHBondContact O-N 3Å; D176-R179 IonicContact OD1-NH1 2.67Å; R177-R179 PolarHBondContact O-N 3.29Å; R179-V181 PolarHBondContact O-N 2.87Å; R179-S183 VanDerWaalsContact O-CB 3.27Å; R179-S183 WeakPolarHBondContact O-CB 3.38Å; R179-S183 PolarHBondContact O-N 2.95Å; R179-R186 VanDerWaalsContact NH1-NH1 3.15Å |
| 180 | A | 75 | Confident | 72.6 | Confident | 18 Ų | 18 | 57.2 Ų | 57.2 | 15% | 0.149 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.9 | -27.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | D176 R177 Y178 R295 | D176-A180 WeakPolarHBondContact O-CB 3.46Å; D176-A180 PolarHBondContact O-N 3.37Å; R177-A180 PolarHBondContact O-N 3.02Å; Y178-A180 VanDerWaalsContact C-N 3.33Å; Y178-A180 PolarHBondContact O-N 2.98Å; A180-R295 VanDerWaalsContact O-CZ 3.22Å; A180-R295 PolarHBondContact O-NH1 3.3Å |
| 181 | V | 70.3 | Confident | 71.6 | Confident | 11 Ų | 11 | 58.7 Ų | 58.7 | 7% | 0.067 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -88.1 | -44 | 179.2 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | R177 Y178 R179 M272 M276 R295 | R177-V181 WeakPolarHBondContact O-CG2 3.37Å; R177-V181 PolarHBondContact O-N 3.03Å; Y178-V181 PolarHBondContact O-N 3.3Å; R179-V181 PolarHBondContact O-N 2.87Å; V181-M272 HydrophobicContact CB-CE 4.27Å; V181-M272 HydrophobicContact CB-CG 4.13Å; V181-M272 HydrophobicContact CB-SD 4.46Å; V181-M272 HydrophobicContact CG1-CE 4.38Å; V181-M272 HydrophobicContact CG1-CG 4.03Å; V181-M272 HydrophobicContact CG2-CE 3.27Å; V181-M272 HydrophobicContact CG2-CG 4.06Å; V181-M272 HydrophobicContact CG2-SD 3.8Å; V181-M276 HydrophobicContact CG1-CG 3.66Å; V181-M276 HydrophobicContact CG1-SD 4.22Å; V181-R295 HydrophobicContact CG2-CB 4.18Å; V181-R295 HydrophobicContact CG2-CG 4.5Å |
| 182 | A | 73.1 | Confident | 70.9 | Confident | 30 Ų | 30 | 62.5 Ų | 62.5 | 25% | 0.248 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -73.2 | -36.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113 | Y178 | Y178-A182 HydrophobicContact CE1-CB 4.38Å; Y178-A182 HydrophobicContact CE2-CB 4.12Å; Y178-A182 WeakPolarHBondContact O-CB 3.48Å; Y178-A182 PolarHBondContact O-N 2.92Å |
| 183 | S | 67.6 | Low | 70.6 | Confident | 58 Ų | 58 | 64.3 Ų | 64.3 | 41% | 0.406 | 35% | 0.352 | S | S | . | . | trans | -98.7 | 109.6 | 177.6 | -173.1 | 0 | 0 | 0 | 0 | 110.4 | R179 | R179-S183 VanDerWaalsContact O-CB 3.27Å; R179-S183 WeakPolarHBondContact O-CB 3.38Å; R179-S183 PolarHBondContact O-N 2.95Å | ||
| 184 | W | 53.7 | Low | 70.5 | Confident | 182 Ų | 182 | 71 Ų | 71 | 69% | 0.689 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.2 | -14.6 | -178.3 | -159.7 | 60.6 | 0 | 0 | 0 | 113.4 | ||
| 185 | S | 50.8 | Low | 70.5 | Confident | 102 Ų | 102 | 75.5 Ų | 75.5 | 71% | 0.713 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.8 | 14.1 | -171.8 | 91.3 | 0 | 0 | 0 | 0 | 115.7 | V187 | S185-V187 PolarHBondContact O-N 3.23Š|
| 186 | R | 56.3 | Low | 70.5 | Confident | 74 Ų | 74 | 74 Ų | 74 | 28% | 0.279 | 40% | 0.398 | S | S | . | . | trans | -74.5 | 100.2 | 175.7 | -161.2 | 176.4 | -172.6 | -170.5 | -0.5 | 108.7 | D176 R179 Q188 | D176-R186 IonicContact OD1-NH1 2.73Å; D176-R186 PolarHBondContact OD1-NH1 3.47Å; D176-R186 VanDerWaalsContact OD1-NH1 3.14Å; R179-R186 VanDerWaalsContact NH1-NH1 3.15Å; R186-Q188 PolarHBondContact O-N 3.27Å | ||
| 187 | V | 50 | Low | 70.8 | Confident | 137 Ų | 137 | 76 Ų | 76 | 83% | 0.83 | 42% | 0.415 | S | S | * | . | trans | -58.8 | 110.8 | 168 | 179.6 | 0 | 0 | 0 | 0 | 107.1 | S185 G189 | S185-V187 PolarHBondContact O-N 3.23Å; V187-G189 PolarHBondContact O-N 2.96Å | ||
| 188 | Q | 54 | Low | 71.3 | Confident | 120 Ų | 120 | 78.5 Ų | 78.5 | 56% | 0.561 | 43% | 0.431 | S | S | * | . | trans | -75.2 | 75.4 | 178.3 | -135.8 | 106.9 | 6.4 | 0 | 0 | 108.4 | R186 | R186-Q188 PolarHBondContact O-N 3.27Š| ||
| 189 | G | 56.4 | Low | 71.9 | Confident | 46 Ų | 46 | 78 Ų | 78 | 47% | 0.474 | 43% | 0.431 | S | S | . | . | trans | -63.5 | 152.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | V187 G191 | V187-G189 PolarHBondContact O-N 2.96Å; G189-G191 PolarHBondContact O-N 2.66Å | ||
| 190 | I | 60.9 | Low | 72.6 | Confident | 157 Ų | 157 | 75.6 Ų | 75.6 | 81% | 0.805 | 42% | 0.424 | S | S | * | . | S | Bend | trans | -72.1 | 123.1 | 168.5 | -62.5 | 168.7 | 0 | 0 | 0 | 107.2 | ||
| 191 | G | 68.1 | Low | 73.5 | Confident | 35 Ų | 35 | 81.3 Ų | 81.3 | 36% | 0.361 | 45% | 0.445 | S | S | . | . | B | Isolated β-bridge | trans | 132.1 | 161 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | R106 G189 P193 | R106-G191 CarbonylContact O-C 3.57Å; R106-G191 WeakPolarHBondContact O-CA 3.24Å; R106-G191 PolarHBondContact O-N 2.77Å; G189-G191 PolarHBondContact O-N 2.66Å; G191-P193 WeakPolarHBondContact O-CD 3.02Å |
| 192 | I | 79.1 | Confident | 74.8 | Confident | 89 Ų | 89 | 83.7 Ų | 83.7 | 46% | 0.456 | 46% | 0.462 | S | S | . | . | trans | -89.8 | 114.5 | 174.5 | -57.7 | 173.2 | 0 | 0 | 0 | 106.8 | A111 T196 | A111-I192 HydrophobicContact CB-CD1 3.93Å; A111-I192 HydrophobicContact CB-CG1 4.13Å; A111-I192 HydrophobicContact CB-CG2 4.2Å; I192-T196 HydrophobicContact CG2-CG2 4.37Å | ||
| 193 | P | 82.8 | Confident | 75.9 | Confident | 46 Ų | 46 | 83 Ų | 83 | 30% | 0.299 | 45% | 0.454 | S | S | . | . | trans | -65.6 | 142.5 | 177.5 | 27 | -32 | 0 | 0 | 0 | 109.6 | G191 I195 T196 A197 | G191-P193 WeakPolarHBondContact O-CD 3.02Å; P193-I195 PolarHBondContact O-N 3.26Å; P193-I195 VanDerWaalsContact O-N 3.07Å; P193-T196 WeakPolarHBondContact CG-OG1 3.39Å; P193-T196 PolarHBondContact O-N 3.23Å; P193-A197 PolarHBondContact O-N 3.23Å | ||
| 194 | M | 85.2 | Confident | 77.3 | Confident | 149 Ų | 149 | 82.5 Ų | 82.5 | 73% | 0.734 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -51.5 | -35.7 | 178.5 | -76.3 | -64.9 | -75.9 | 0 | 0 | 112.5 | T196 A197 I198 | M194-T196 VanDerWaalsContact C-N 3.32Å; M194-T196 PolarHBondContact O-N 3.31Å; M194-A197 WeakPolarHBondContact O-CB 3.15Å; M194-A197 PolarHBondContact O-N 3.45Å; M194-A197 VanDerWaalsContact O-N 3.14Å; M194-I198 WeakPolarHBondContact O-CG1 3.46Å; M194-I198 PolarHBondContact O-N 2.87Å |
| 195 | I | 85.9 | Confident | 79.4 | Confident | 103 Ų | 103 | 77.9 Ų | 77.9 | 53% | 0.528 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -58.2 | -42.9 | 175.9 | -60.2 | 173.8 | 0 | 0 | 0 | 111.6 | P193 I198 E199 | P193-I195 PolarHBondContact O-N 3.26Å; P193-I195 VanDerWaalsContact O-N 3.07Å; I195-I198 PolarHBondContact O-N 3.43Å; I195-E199 WeakPolarHBondContact O-CB 3.41Å; I195-E199 PolarHBondContact O-N 2.89Å |
| 196 | T | 87.7 | Confident | 81.6 | Confident | 1 Ų | 1 | 75.1 Ų | 75.1 | 1% | 0.006 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -71.3 | -32.1 | 177.8 | -64 | 0 | 0 | 0 | 0 | 111.9 | G108 A111 L112 I192 P193 M194 E199 I200 | G108-T196 WeakPolarHBondContact O-CG2 3.36Å; A111-T196 HydrophobicContact CB-CG2 4.35Å; L112-T196 HydrophobicContact CD2-CG2 4.49Å; L112-T196 HydrophobicContact CG-CG2 4.23Å; I192-T196 HydrophobicContact CG2-CG2 4.37Å; P193-T196 WeakPolarHBondContact CG-OG1 3.39Å; P193-T196 PolarHBondContact O-N 3.23Å; M194-T196 VanDerWaalsContact C-N 3.32Å; M194-T196 PolarHBondContact O-N 3.31Å; T196-E199 PolarHBondContact O-N 3.29Å; T196-I200 HydrophobicContact CG2-CD1 4.08Å; T196-I200 HydrophobicContact CG2-CG1 4.47Å; T196-I200 VanDerWaalsContact O-CG1 3.32Å; T196-I200 WeakPolarHBondContact O-CG1 3.32Å; T196-I200 PolarHBondContact O-N 2.93Å |
| 197 | A | 89.1 | Confident | 83.6 | Confident | 44 Ų | 44 | 71.6 Ų | 71.6 | 36% | 0.364 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.2 | -43.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | P193 M194 I200 F201 | P193-A197 PolarHBondContact O-N 3.23Å; M194-A197 WeakPolarHBondContact O-CB 3.15Å; M194-A197 PolarHBondContact O-N 3.45Å; M194-A197 VanDerWaalsContact O-N 3.14Å; A197-I200 PolarHBondContact O-N 3.22Å; A197-F201 PolarHBondContact O-N 3Å |
| 198 | I | 92 | Very high | 85.9 | Confident | 102 Ų | 102 | 68.2 Ų | 68.2 | 52% | 0.523 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -61.2 | -45.5 | 174 | -66.1 | 166.5 | 0 | 0 | 0 | 110.3 | M194 I195 I200 F201 S202 | M194-I198 WeakPolarHBondContact O-CG1 3.46Å; M194-I198 PolarHBondContact O-N 2.87Å; I195-I198 PolarHBondContact O-N 3.43Å; I198-I200 PolarHBondContact O-N 3.34Å; I198-F201 PolarHBondContact O-N 3.25Å; I198-S202 WeakPolarHBondContact O-CB 3.09Å; I198-S202 PolarHBondContact O-N 3.34Å; I198-S202 PolarHBondContact O-OG 2.88Å; I198-S202 VanDerWaalsContact O-OG 3.08Å |
| 199 | E | 91.5 | Very high | 87.9 | Confident | 48 Ų | 48 | 66.8 Ų | 66.8 | 22% | 0.224 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -57 | -48 | 177.2 | -175.6 | 175.9 | -163.6 | 0 | 0 | 111.9 | L112 A172 I195 T196 F201 S202 I203 | L112-E199 HydrophobicContact CD2-CG 4.47Å; A172-E199 WeakPolarHBondContact CB-OE1 3.47Å; I195-E199 WeakPolarHBondContact O-CB 3.41Å; I195-E199 PolarHBondContact O-N 2.89Å; T196-E199 PolarHBondContact O-N 3.29Å; E199-F201 PolarHBondContact O-N 3.28Å; E199-S202 PolarHBondContact O-N 3.32Å; E199-I203 HydrophobicContact CG-CD1 4.27Å; E199-I203 VanDerWaalsContact O-CG1 3.27Å; E199-I203 WeakPolarHBondContact O-CG1 3.23Å; E199-I203 PolarHBondContact O-N 3.33Å |
| 200 | I | 94.4 | Very high | 89.8 | Confident | 35 Ų | 35 | 66.1 Ų | 66.1 | 18% | 0.179 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -60.6 | -47.6 | 175.8 | -69.8 | 167.2 | 0 | 0 | 0 | 110.7 | A111 L112 T196 A197 I198 S202 I203 W204 | A111-I200 HydrophobicContact CB-CD1 3.89Å; L112-I200 HydrophobicContact CD2-CD1 4.44Å; L112-I200 HydrophobicContact CD2-CG1 3.78Å; T196-I200 HydrophobicContact CG2-CD1 4.08Å; T196-I200 HydrophobicContact CG2-CG1 4.47Å; T196-I200 VanDerWaalsContact O-CG1 3.32Å; T196-I200 WeakPolarHBondContact O-CG1 3.32Å; T196-I200 PolarHBondContact O-N 2.93Å; A197-I200 PolarHBondContact O-N 3.22Å; I198-I200 PolarHBondContact O-N 3.34Å; I200-S202 VanDerWaalsContact C-N 3.32Å; I200-S202 PolarHBondContact O-N 3.45Å; I200-I203 WeakPolarHBondContact O-CB 3.47Å; I200-I203 PolarHBondContact O-N 2.95Å; I200-W204 PolarHBondContact O-N 3.42Å; I200-W204 VanDerWaalsContact O-N 3.07Å |
| 201 | F | 95.6 | Very high | 91.5 | Very high | 138 Ų | 138 | 58.7 Ų | 58.7 | 61% | 0.605 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -59.4 | -43.9 | 179 | 178.3 | -98.5 | 0 | 0 | 0 | 111.9 | A197 I198 E199 I203 W204 L205 | A197-F201 PolarHBondContact O-N 3Å; I198-F201 PolarHBondContact O-N 3.25Å; E199-F201 PolarHBondContact O-N 3.28Å; F201-I203 VanDerWaalsContact C-N 3.35Å; F201-I203 PolarHBondContact O-N 2.83Å; F201-W204 PolarHBondContact O-N 2.84Å; F201-L205 HydrophobicContact CE1-CD2 4.13Å; F201-L205 WeakPolarHBondContact O-CB 3.31Å; F201-L205 PolarHBondContact O-N 3.45Å |
| 202 | S | 96.3 | Very high | 92.8 | Very high | 61 Ų | 61 | 60.7 Ų | 60.7 | 43% | 0.427 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62.2 | -39.7 | 176 | -62.5 | 0 | 0 | 0 | 0 | 112.4 | I198 E199 I200 L206 | I198-S202 WeakPolarHBondContact O-CB 3.09Å; I198-S202 PolarHBondContact O-N 3.34Å; I198-S202 PolarHBondContact O-OG 2.88Å; I198-S202 VanDerWaalsContact O-OG 3.08Å; E199-S202 PolarHBondContact O-N 3.32Å; I200-S202 VanDerWaalsContact C-N 3.32Å; I200-S202 PolarHBondContact O-N 3.45Å; S202-L206 VanDerWaalsContact O-CB 3.24Å; S202-L206 WeakPolarHBondContact O-CB 3.33Å; S202-L206 PolarHBondContact O-N 2.93Å |
| 203 | I | 96.6 | Very high | 93.5 | Very high | 15 Ų | 15 | 57.6 Ų | 57.6 | 8% | 0.077 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.1 | -47.9 | 175.4 | -72.6 | 166.3 | 0 | 0 | 0 | 110.6 | L112 L168 A172 E199 I200 F201 S207 | L112-I203 HydrophobicContact CD2-CD1 4.2Å; L168-I203 HydrophobicContact CB-CB 4.43Å; L168-I203 HydrophobicContact CB-CG1 4.11Å; L168-I203 HydrophobicContact CB-CG2 3.79Å; L168-I203 HydrophobicContact CD1-CG2 4.36Å; A172-I203 HydrophobicContact CB-CD1 3.92Å; E199-I203 HydrophobicContact CG-CD1 4.27Å; E199-I203 VanDerWaalsContact O-CG1 3.27Å; E199-I203 WeakPolarHBondContact O-CG1 3.23Å; E199-I203 PolarHBondContact O-N 3.33Å; I200-I203 WeakPolarHBondContact O-CB 3.47Å; I200-I203 PolarHBondContact O-N 2.95Å; F201-I203 VanDerWaalsContact C-N 3.35Å; F201-I203 PolarHBondContact O-N 2.83Å; I203-S207 VanDerWaalsContact O-CB 3.3Å; I203-S207 WeakPolarHBondContact O-CB 3.36Å; I203-S207 PolarHBondContact O-N 3.33Å; I203-S207 PolarHBondContact O-OG 3.05Å |
| 204 | W | 97.7 | Very high | 94 | Very high | 49 Ų | 49 | 55.4 Ų | 55.4 | 19% | 0.186 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -65.6 | -48.2 | -179.6 | -81.8 | 69.3 | 0 | 0 | 0 | 111.8 | S115 L118 I122 I165 I200 F201 L206 S207 F208 | S115-W204 PolarHBondContact OG-NE1 3.46Å; L118-W204 HydrophobicContact CB-CZ2 4.37Å; L118-W204 HydrophobicContact CD2-CH2 3.81Å; L118-W204 HydrophobicContact CD2-CZ2 3.69Å; L118-W204 HydrophobicContact CG-CH2 4Å; L118-W204 HydrophobicContact CG-CZ2 4Å; I122-W204 HydrophobicContact CD1-CH2 3.66Å; I122-W204 HydrophobicContact CD1-CZ3 4.17Å; I165-W204 HydrophobicContact CD1-CD2 3.69Å; I165-W204 HydrophobicContact CD1-CE3 3.64Å; I165-W204 HydrophobicContact CD1-CG 4.35Å; I165-W204 HydrophobicContact CD1-CH2 3.91Å; I165-W204 HydrophobicContact CD1-CZ2 3.93Å; I165-W204 HydrophobicContact CD1-CZ3 3.76Å; I165-W204 HydrophobicContact CG1-CD2 4.26Å; I165-W204 HydrophobicContact CG1-CG 4.44Å; I165-W204 HydrophobicContact CG2-CZ2 4.48Å; I200-W204 PolarHBondContact O-N 3.42Å; I200-W204 VanDerWaalsContact O-N 3.07Å; F201-W204 PolarHBondContact O-N 2.84Å; W204-L206 PolarHBondContact O-N 2.91Å; W204-S207 PolarHBondContact O-N 3.12Å; W204-F208 HydrophobicContact CB-CE2 4.47Å; W204-F208 AromaticContact CE3-CE2 3.72Å; W204-F208 HydrophobicContact CE3-CE2 3.72Å; W204-F208 AromaticContact CE3-CZ 3.56Å; W204-F208 HydrophobicContact CE3-CZ 3.56Å; W204-F208 HydrophobicContact CZ3-CE2 4.44Å; W204-F208 AromaticContact CZ3-CZ 3.87Å; W204-F208 HydrophobicContact CZ3-CZ 3.87Å; W204-F208 WeakPolarHBondContact O-CD2 3.04Å; W204-F208 WeakPolarHBondContact O-CG 3.33Å; W204-F208 PolarHBondContact O-N 3.5Å |
| 205 | L | 97.7 | Very high | 94.5 | Very high | 84 Ų | 84 | 49.8 Ų | 49.8 | 44% | 0.44 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -58.9 | -48.3 | 179.1 | -179.6 | 61.6 | 0 | 0 | 0 | 111.5 | F201 S207 F208 I209 | F201-L205 HydrophobicContact CE1-CD2 4.13Å; F201-L205 WeakPolarHBondContact O-CB 3.31Å; F201-L205 PolarHBondContact O-N 3.45Å; L205-S207 VanDerWaalsContact C-N 3.34Å; L205-S207 PolarHBondContact O-N 2.94Å; L205-F208 PolarHBondContact O-N 2.87Å; L205-I209 HydrophobicContact CD1-CD1 4.08Å; L205-I209 HydrophobicContact CD1-CG1 4.47Å; L205-I209 HydrophobicContact CG-CD1 3.93Å; L205-I209 VanDerWaalsContact O-CG1 3.29Å; L205-I209 WeakPolarHBondContact O-CG1 3.18Å; L205-I209 PolarHBondContact O-N 2.86Å |
| 206 | L | 96.8 | Very high | 94.9 | Very high | 44 Ų | 44 | 49.5 Ų | 49.5 | 23% | 0.23 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 178.4 | -178 | 59.7 | 0 | 0 | 0 | 111.3 | L13 L168 S202 W204 F208 I209 L210 | L13-L206 HydrophobicContact CD2-CD2 3.5Å; L168-L206 HydrophobicContact CD1-CB 4.18Å; L168-L206 HydrophobicContact CD1-CD2 3.82Å; L168-L206 HydrophobicContact CD1-CG 4.07Å; L168-L206 HydrophobicContact CD2-CD2 4.3Å; S202-L206 VanDerWaalsContact O-CB 3.24Å; S202-L206 WeakPolarHBondContact O-CB 3.33Å; S202-L206 PolarHBondContact O-N 2.93Å; W204-L206 PolarHBondContact O-N 2.91Å; L206-F208 VanDerWaalsContact C-N 3.32Å; L206-F208 PolarHBondContact O-N 3.4Å; L206-I209 PolarHBondContact O-N 2.72Å; L206-L210 HydrophobicContact CD1-CD1 4.21Å; L206-L210 HydrophobicContact CD1-CD2 4.47Å; L206-L210 HydrophobicContact CD1-CG 4.11Å; L206-L210 HydrophobicContact CG-CD1 4.07Å; L206-L210 HydrophobicContact CG-CG 4.37Å; L206-L210 VanDerWaalsContact O-CG 3.27Å; L206-L210 WeakPolarHBondContact O-CG 3.36Å; L206-L210 PolarHBondContact O-N 2.84Å |
| 207 | S | 97.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.2 | -40.5 | 178.3 | -59.2 | 0 | 0 | 0 | 0 | 112.7 | A161 I165 I203 W204 L205 A211 | A161-S207 WeakPolarHBondContact O-CB 3.35Å; I165-S207 WeakPolarHBondContact CA-OG 3.47Å; I165-S207 PolarHBondContact N-OG 3.49Å; I203-S207 VanDerWaalsContact O-CB 3.3Å; I203-S207 WeakPolarHBondContact O-CB 3.36Å; I203-S207 PolarHBondContact O-N 3.33Å; I203-S207 PolarHBondContact O-OG 3.05Å; W204-S207 PolarHBondContact O-N 3.12Å; L205-S207 VanDerWaalsContact C-N 3.34Å; L205-S207 PolarHBondContact O-N 2.94Å; S207-A211 WeakPolarHBondContact O-CB 3.18Å; S207-A211 PolarHBondContact O-N 3.46Å |
| 208 | F | 97.5 | Very high | 95.3 | Very high | 67 Ų | 67 | 48.7 Ų | 48.7 | 29% | 0.294 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -66.5 | -45 | 174.6 | -69.3 | -44 | 0 | 0 | 0 | 111.8 | F157 I158 A161 W204 L205 L206 L210 A211 I212 | F157-F208 HydrophobicContact CE1-CD1 4.24Å; F157-F208 WeakPolarHBondContact CE2-O 3.45Å; F157-F208 HydrophobicContact CZ-CB 4.27Å; F157-F208 AromaticContact CZ-CD1 3.83Å; F157-F208 HydrophobicContact CZ-CD1 3.83Å; F157-F208 HydrophobicContact CZ-CG 4.38Å; I158-F208 HydrophobicContact CD1-CE1 3.99Å; A161-F208 HydrophobicContact CB-CD1 3.52Å; A161-F208 HydrophobicContact CB-CE1 3.81Å; W204-F208 HydrophobicContact CB-CE2 4.47Å; W204-F208 AromaticContact CE3-CE2 3.72Å; W204-F208 HydrophobicContact CE3-CE2 3.72Å; W204-F208 AromaticContact CE3-CZ 3.56Å; W204-F208 HydrophobicContact CE3-CZ 3.56Å; W204-F208 HydrophobicContact CZ3-CE2 4.44Å; W204-F208 AromaticContact CZ3-CZ 3.87Å; W204-F208 HydrophobicContact CZ3-CZ 3.87Å; W204-F208 WeakPolarHBondContact O-CD2 3.04Å; W204-F208 WeakPolarHBondContact O-CG 3.33Å; W204-F208 PolarHBondContact O-N 3.5Å; L205-F208 PolarHBondContact O-N 2.87Å; L206-F208 VanDerWaalsContact C-N 3.32Å; L206-F208 PolarHBondContact O-N 3.4Å; F208-L210 VanDerWaalsContact C-N 3.33Å; F208-L210 PolarHBondContact O-N 3.19Å; F208-A211 PolarHBondContact O-N 3.37Å; F208-A211 VanDerWaalsContact O-N 3.1Å; F208-I212 WeakPolarHBondContact O-CG1 3.09Å; F208-I212 PolarHBondContact O-N 3.42Å |
| 209 | I | 97.3 | Very high | 95.4 | Very high | 89 Ų | 89 | 45 Ų | 45 | 46% | 0.456 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -57.8 | -46.7 | 178.9 | -70.3 | 166.9 | 0 | 0 | 0 | 111 | L205 L206 A211 I212 | L205-I209 HydrophobicContact CD1-CD1 4.08Å; L205-I209 HydrophobicContact CD1-CG1 4.47Å; L205-I209 HydrophobicContact CG-CD1 3.93Å; L205-I209 VanDerWaalsContact O-CG1 3.29Å; L205-I209 WeakPolarHBondContact O-CG1 3.18Å; L205-I209 PolarHBondContact O-N 2.86Å; L206-I209 PolarHBondContact O-N 2.72Å; I209-A211 PolarHBondContact O-N 3.5Å; I209-I212 WeakPolarHBondContact O-CB 3.29Å; I209-I212 WeakPolarHBondContact O-CG1 3.39Å; I209-I212 PolarHBondContact O-N 3.11Å |
| 210 | L | 95.1 | Very high | 95.4 | Very high | 33 Ų | 33 | 44.4 Ų | 44.4 | 17% | 0.173 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -66 | -22.8 | -179.9 | -66.2 | 179.1 | 0 | 0 | 0 | 113.6 | L206 F208 W252 F256 | L206-L210 HydrophobicContact CD1-CD1 4.21Å; L206-L210 HydrophobicContact CD1-CD2 4.47Å; L206-L210 HydrophobicContact CD1-CG 4.11Å; L206-L210 HydrophobicContact CG-CD1 4.07Å; L206-L210 HydrophobicContact CG-CG 4.37Å; L206-L210 VanDerWaalsContact O-CG 3.27Å; L206-L210 WeakPolarHBondContact O-CG 3.36Å; L206-L210 PolarHBondContact O-N 2.84Å; F208-L210 VanDerWaalsContact C-N 3.33Å; F208-L210 PolarHBondContact O-N 3.19Å; L210-W252 HydrophobicContact CD2-CH2 4.29Å; L210-W252 HydrophobicContact CD2-CZ2 3.8Å; L210-F256 HydrophobicContact CD1-CD1 3.95Å; L210-F256 HydrophobicContact CD1-CE1 3.19Å; L210-F256 HydrophobicContact CD1-CE2 4.12Å; L210-F256 HydrophobicContact CD1-CZ 3.29Å |
| 211 | A | 96.5 | Very high | 95.2 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -87 | -14.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | F157 K160 A161 S207 F208 I209 P213 E214 | F157-A211 HydrophobicContact CD2-CB 3.65Å; F157-A211 WeakPolarHBondContact CD2-O 3.34Å; F157-A211 HydrophobicContact CE2-CB 3.81Å; F157-A211 WeakPolarHBondContact O-CB 3.27Å; K160-A211 HydrophobicContact CB-CB 3.95Å; A161-A211 HydrophobicContact CB-CB 3.98Å; S207-A211 WeakPolarHBondContact O-CB 3.18Å; S207-A211 PolarHBondContact O-N 3.46Å; F208-A211 PolarHBondContact O-N 3.37Å; F208-A211 VanDerWaalsContact O-N 3.1Å; I209-A211 PolarHBondContact O-N 3.5Å; A211-P213 VanDerWaalsContact C-N 3.33Å; A211-E214 VanDerWaalsContact O-CB 3.29Å; A211-E214 WeakPolarHBondContact O-CB 3.44Å; A211-E214 PolarHBondContact O-N 3.28Å |
| 212 | I | 95.6 | Very high | 94.8 | Very high | 78 Ų | 78 | 42.4 Ų | 42.4 | 40% | 0.4 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -49.5 | -43.9 | -177.6 | -69.1 | 172.1 | 0 | 0 | 0 | 113.5 | F157 F208 I209 E214 A215 I216 | F157-I212 HydrophobicContact CE2-CG1 4.44Å; F208-I212 WeakPolarHBondContact O-CG1 3.09Å; F208-I212 PolarHBondContact O-N 3.42Å; I209-I212 WeakPolarHBondContact O-CB 3.29Å; I209-I212 WeakPolarHBondContact O-CG1 3.39Å; I209-I212 PolarHBondContact O-N 3.11Å; I212-E214 PolarHBondContact O-N 3.42Å; I212-E214 VanDerWaalsContact O-N 3.1Å; I212-A215 PolarHBondContact O-N 3.47Å; I212-I216 HydrophobicContact CG2-CD1 3.63Å; I212-I216 HydrophobicContact CG2-CG1 4.19Å; I212-I216 PolarHBondContact O-N 2.87Å |
| 213 | P | 94 | Very high | 94.1 | Very high | 23 Ų | 23 | 43.7 Ų | 43.7 | 15% | 0.149 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57.8 | -27.6 | 180 | -27.3 | 37 | 0 | 0 | 0 | 114 | A211 G217 Y245 | A211-P213 VanDerWaalsContact C-N 3.33Å; P213-G217 PolarHBondContact O-N 3.37Å; P213-Y245 HydrophobicContact CB-CD1 4.19Å; P213-Y245 HydrophobicContact CB-CD2 3.72Å; P213-Y245 HydrophobicContact CB-CE1 3.94Å; P213-Y245 HydrophobicContact CB-CE2 3.45Å; P213-Y245 VanDerWaalsContact CB-CE2 3.45Å; P213-Y245 HydrophobicContact CB-CG 4.08Å; P213-Y245 HydrophobicContact CG-CD2 4.3Å; P213-Y245 HydrophobicContact CG-CE2 4.03Å |
| 214 | E | 94.3 | Very high | 93.3 | Very high | 1 Ų | 1 | 53.4 Ų | 53.4 | 1% | 0.005 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -68.4 | -42.6 | 176.4 | -57.9 | -77.8 | -164.5 | 0 | 0 | 111.2 | P156 K160 A211 I212 I216 G217 F218 Y245 K249 | P156-E214 HydrophobicContact CB-CB 4.27Å; K160-E214 HydrophobicContact CB-CG 4.17Å; K160-E214 VanDerWaalsContact CE-OE1 3.24Å; K160-E214 WeakPolarHBondContact CE-OE1 3.36Å; K160-E214 HydrophobicContact CG-CG 3.59Å; K160-E214 WeakPolarHBondContact CG-OE1 3.42Å; A211-E214 VanDerWaalsContact O-CB 3.29Å; A211-E214 WeakPolarHBondContact O-CB 3.44Å; A211-E214 PolarHBondContact O-N 3.28Å; I212-E214 PolarHBondContact O-N 3.42Å; I212-E214 VanDerWaalsContact O-N 3.1Å; E214-I216 VanDerWaalsContact C-N 3.32Å; E214-I216 PolarHBondContact O-N 3.39Å; E214-G217 PolarHBondContact O-N 3.49Å; E214-F218 WeakPolarHBondContact O-CB 3.41Å; E214-F218 WeakPolarHBondContact O-CD2 3.46Å; E214-F218 PolarHBondContact O-N 3.37Å; E214-F218 WeakPolarHBondContact OE2-CD2 3.34Å; E214-F218 WeakPolarHBondContact OE2-CE2 3.47Å; E214-Y245 PolarHBondContact OE1-OH 3.41Å; E214-Y245 VanDerWaalsContact OE1-OH 3.06Å; E214-K249 WeakPolarHBondContact OE1-CE 3.32Å; E214-K249 IonicContact OE1-NZ 3.99Å; E214-K249 PolarHBondContact OE1-NZ 3.47Å; E214-K249 IonicContact OE2-NZ 3.14Å; E214-K249 PolarHBondContact OE2-NZ 2.66Å |
| 215 | A | 94.6 | Very high | 92.1 | Very high | 30 Ų | 30 | 55.6 Ų | 55.6 | 25% | 0.248 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -65.5 | -35.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K153 F157 I212 | K153-A215 VanDerWaalsContact CG-O 3.29Å; K153-A215 WeakPolarHBondContact CG-O 3.32Å; K153-A215 PolarHBondContact NZ-O 3.01Å; F157-A215 HydrophobicContact CB-CB 3.99Å; F157-A215 HydrophobicContact CD2-CB 4.11Å; F157-A215 HydrophobicContact CG-CB 4.19Å; I212-A215 PolarHBondContact O-N 3.47Å |
| 216 | I | 94.1 | Very high | 90.8 | Very high | 97 Ų | 97 | 58.4 Ų | 58.4 | 50% | 0.497 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -74.3 | -46.7 | 179.3 | -61.2 | 174.9 | 0 | 0 | 0 | 109.9 | K153 I212 E214 M242 | K153-I216 PolarHBondContact NZ-O 2.98Å; I212-I216 HydrophobicContact CG2-CD1 3.63Å; I212-I216 HydrophobicContact CG2-CG1 4.19Å; I212-I216 PolarHBondContact O-N 2.87Å; E214-I216 VanDerWaalsContact C-N 3.32Å; E214-I216 PolarHBondContact O-N 3.39Å; I216-M242 HydrophobicContact CB-SD 4.39Å; I216-M242 HydrophobicContact CG2-CG 4.47Å; I216-M242 HydrophobicContact CG2-SD 4Å |
| 217 | G | 92.2 | Very high | 89.8 | Confident | 2 Ų | 2 | 64 Ų | 64 | 2% | 0.021 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -81.1 | -25.7 | -170 | 0 | 0 | 0 | 0 | 0 | 116.6 | P213 E214 N236 | P213-G217 PolarHBondContact O-N 3.37Å; E214-G217 PolarHBondContact O-N 3.49Å; G217-N236 PolarHBondContact O-N 2.87Å |
| 218 | F | 93.9 | Very high | 88.9 | Confident | 26 Ų | 26 | 69.5 Ų | 69.5 | 11% | 0.114 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.1 | 134.7 | -180 | -85.3 | -111.8 | 0 | 0 | 0 | 111.1 | C152 K153 P156 E214 L235 | C152-F218 VanDerWaalsContact O-CB 3.29Å; C152-F218 WeakPolarHBondContact O-CB 3.34Å; K153-F218 VanDerWaalsContact CG-O 3.27Å; K153-F218 WeakPolarHBondContact CG-O 3.47Å; K153-F218 PolarHBondContact NZ-O 3.48Å; P156-F218 HydrophobicContact CB-CD1 4.17Å; P156-F218 HydrophobicContact CB-CD2 4.27Å; P156-F218 HydrophobicContact CB-CE1 4.25Å; P156-F218 HydrophobicContact CB-CE2 4.41Å; P156-F218 HydrophobicContact CB-CG 4.17Å; P156-F218 HydrophobicContact CB-CZ 4.37Å; P156-F218 HydrophobicContact CG-CB 4.39Å; P156-F218 HydrophobicContact CG-CD1 3.56Å; P156-F218 HydrophobicContact CG-CD2 4.46Å; P156-F218 HydrophobicContact CG-CE1 3.89Å; P156-F218 HydrophobicContact CG-CG 3.86Å; P156-F218 HydrophobicContact CG-CZ 4.5Å; E214-F218 WeakPolarHBondContact O-CB 3.41Å; E214-F218 WeakPolarHBondContact O-CD2 3.46Å; E214-F218 PolarHBondContact O-N 3.37Å; E214-F218 WeakPolarHBondContact OE2-CD2 3.34Å; E214-F218 WeakPolarHBondContact OE2-CE2 3.47Å; F218-L235 HydrophobicContact CD2-CB 4.28Å; F218-L235 HydrophobicContact CD2-CD1 3.79Å; F218-L235 HydrophobicContact CE2-CB 3.84Å; F218-L235 HydrophobicContact CE2-CD1 3.75Å; F218-L235 HydrophobicContact CE2-CG 4.38Å; F218-L235 HydrophobicContact CZ-CB 4.19Å |
| 219 | A | 93.6 | Very high | 88.1 | Confident | 26 Ų | 26 | 69.1 Ų | 69.1 | 22% | 0.215 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.9 | 153.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | C152 M234 N236 | C152-A219 PolarHBondContact SG-O 3.03Å; C152-A219 VanDerWaalsContact SG-O 3.4Å; A219-M234 PolarHBondContact N-O 3.36Å; A219-M234 PolarHBondContact O-N 2.88Å; A219-M234 VanDerWaalsContact O-N 3.1Å; A219-M234 VanDerWaalsContact O-O 3.11Å; A219-N236 HydrophobicContact CB-CB 4.13Å |
| 220 | V | 92.2 | Very high | 87.4 | Confident | 35 Ų | 35 | 67.7 Ų | 67.7 | 21% | 0.212 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 122.9 | 169.6 | 178.5 | 0 | 0 | 0 | 0 | 107.5 | Q149 C152 V231 T232 | Q149-V220 HydrophobicContact CG-CG2 4.23Å; C152-V220 HydrophobicContact CB-CG2 3.61Å; V220-V231 HydrophobicContact CG1-CG1 3.22Å; V220-T232 WeakPolarHBondContact CA-O 3.39Å |
| 221 | V | 89.7 | Confident | 87 | Confident | 27 Ų | 27 | 67.9 Ų | 67.9 | 16% | 0.164 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 122.4 | -177.3 | -176.4 | 0 | 0 | 0 | 0 | 109.7 | T232 M234 N236 | V221-T232 PolarHBondContact N-O 3.48Å; V221-T232 PolarHBondContact O-N 3.37Å; V221-M234 HydrophobicContact CB-CE 3.53Å; V221-M234 HydrophobicContact CB-CG 4.27Å; V221-M234 HydrophobicContact CG1-CE 3.44Å; V221-M234 VanDerWaalsContact CG1-CE 3.44Å; V221-M234 HydrophobicContact CG2-CE 3.86Å; V221-M234 HydrophobicContact CG2-CG 4.04Å; V221-N236 HydrophobicContact CG2-CB 4.1Å |
| 222 | P | 86.9 | Confident | 86.6 | Confident | 103 Ų | 103 | 69.9 Ų | 69.9 | 67% | 0.669 | 36% | 0.363 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 137.9 | 171 | 32 | -32.4 | 0 | 0 | 0 | 110.5 | Y230 V231 | P222-Y230 CarbonylContact C-O 3.58Å; P222-Y230 WeakPolarHBondContact CA-O 3.4Å; P222-V231 HydrophobicContact CB-CG2 4.49Å |
| 223 | F | 82.6 | Confident | 86.5 | Confident | 88 Ų | 88 | 66.4 Ų | 66.4 | 39% | 0.386 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.6 | 147.7 | 171.2 | 63.4 | -83.9 | 0 | 0 | 0 | 110.7 | Y230 T232 | F223-Y230 HydrophobicContact CD2-CD2 4.49Å; F223-Y230 VanDerWaalsContact CE2-CB 3.45Å; F223-Y230 HydrophobicContact CE2-CD2 4.03Å; F223-Y230 AromaticContact CE2-CG 3.83Å; F223-Y230 HydrophobicContact CE2-CG 3.83Å; F223-Y230 HydrophobicContact CZ-CD1 4.5Å; F223-Y230 AromaticContact CZ-CG 3.9Å; F223-Y230 HydrophobicContact CZ-CG 3.9Å; F223-Y230 PolarHBondContact N-O 2.85Å; F223-Y230 PolarHBondContact O-N 3.39Å; F223-T232 HydrophobicContact CD1-CG2 4.03Å; F223-T232 HydrophobicContact CE1-CG2 3.54Å |
| 224 | R | 79.1 | Confident | 86.3 | Confident | 220 Ų | 220 | 69.2 Ų | 69.2 | 83% | 0.83 | 36% | 0.358 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.5 | 125.5 | 175 | -76.6 | -171.5 | 156.5 | 132.5 | -0.8 | 109.7 | E228 | R224-E228 WeakPolarHBondContact CA-O 3.41Å |
| 225 | Y | 73.6 | Confident | 86.2 | Confident | 95 Ų | 95 | 70.7 Ų | 70.7 | 37% | 0.373 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 118.2 | 175.1 | -175.5 | -98.7 | 0 | 0 | 0 | 109.2 | D227 E228 | Y225-D227 VanDerWaalsContact C-N 3.33Å; Y225-D227 PolarHBondContact O-N 3.19Å; Y225-E228 PolarHBondContact N-O 3.37Å; Y225-E228 PolarHBondContact O-N 3.35Å |
| 226 | K | 69.4 | Low | 86.1 | Confident | 142 Ų | 142 | 72.6 Ų | 72.6 | 62% | 0.617 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.7 | 50.3 | -176.9 | -61.5 | -176.9 | 177.1 | -175.4 | 0 | 112.9 | E228 | K226-E228 PolarHBondContact O-N 3.09Š|
| 227 | D | 76.3 | Confident | 85.8 | Confident | 161 Ų | 161 | 69.7 Ų | 69.7 | 86% | 0.861 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.5 | -0.5 | 178.3 | -51.7 | -51.6 | 0 | 0 | 0 | 116.2 | Y225 | Y225-D227 VanDerWaalsContact C-N 3.33Å; Y225-D227 PolarHBondContact O-N 3.19Å |
| 228 | E | 78.8 | Confident | 85.6 | Confident | 117 Ų | 117 | 74.5 Ų | 74.5 | 55% | 0.547 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.7 | 139.5 | 168.3 | -69.6 | -177.5 | 170.5 | 0 | 0 | 111.7 | R224 Y225 K226 Y230 | R224-E228 WeakPolarHBondContact CA-O 3.41Å; Y225-E228 PolarHBondContact N-O 3.37Å; Y225-E228 PolarHBondContact O-N 3.35Å; K226-E228 PolarHBondContact O-N 3.09Å; E228-Y230 HydrophobicContact CB-CD2 4.37Å; E228-Y230 HydrophobicContact CB-CE2 3.63Å; E228-Y230 PolarHBondContact OE2-OH 3.3Å |
| 229 | G | 79.9 | Confident | 85.5 | Confident | 58 Ų | 58 | 78.2 Ų | 78.2 | 60% | 0.598 | 41% | 0.409 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.1 | 127.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 230 | Y | 83.3 | Confident | 85.4 | Confident | 60 Ų | 60 | 83.8 Ų | 83.8 | 24% | 0.235 | 44% | 0.435 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 145.1 | 174.9 | -67.6 | -93 | 0 | 0 | 0 | 110.2 | P222 F223 E228 | P222-Y230 CarbonylContact C-O 3.58Å; P222-Y230 WeakPolarHBondContact CA-O 3.4Å; F223-Y230 HydrophobicContact CD2-CD2 4.49Å; F223-Y230 VanDerWaalsContact CE2-CB 3.45Å; F223-Y230 HydrophobicContact CE2-CD2 4.03Å; F223-Y230 AromaticContact CE2-CG 3.83Å; F223-Y230 HydrophobicContact CE2-CG 3.83Å; F223-Y230 HydrophobicContact CZ-CD1 4.5Å; F223-Y230 AromaticContact CZ-CG 3.9Å; F223-Y230 HydrophobicContact CZ-CG 3.9Å; F223-Y230 PolarHBondContact N-O 2.85Å; F223-Y230 PolarHBondContact O-N 3.39Å; E228-Y230 HydrophobicContact CB-CD2 4.37Å; E228-Y230 HydrophobicContact CB-CE2 3.63Å; E228-Y230 PolarHBondContact OE2-OH 3.3Å |
| 231 | V | 86.5 | Confident | 85.3 | Confident | 37 Ų | 37 | 88.1 Ų | 88.1 | 22% | 0.224 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 122.4 | 176.7 | 179.9 | 0 | 0 | 0 | 0 | 108.2 | W140 V220 P222 | W140-V231 PolarHBondContact N-O 2.85Å; V220-V231 HydrophobicContact CG1-CG1 3.22Å; P222-V231 HydrophobicContact CB-CG2 4.49Å |
| 232 | T | 89.1 | Confident | 85.4 | Confident | 41 Ų | 41 | 87 Ų | 87 | 25% | 0.252 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 158.6 | 178.7 | -163.9 | 0 | 0 | 0 | 0 | 111.7 | V220 V221 F223 M234 | V220-T232 WeakPolarHBondContact CA-O 3.39Å; V221-T232 PolarHBondContact N-O 3.48Å; V221-T232 PolarHBondContact O-N 3.37Å; F223-T232 HydrophobicContact CD1-CG2 4.03Å; F223-T232 HydrophobicContact CE1-CG2 3.54Å; T232-M234 HydrophobicContact CG2-CG 4.25Å; T232-M234 HydrophobicContact CG2-SD 4.23Å |
| 233 | C | 91.9 | Very high | 85.6 | Confident | 6 Ų | 6 | 86.1 Ų | 86.1 | 4% | 0.041 | 43% | 0.433 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 116.5 | 173.5 | 175.7 | 0 | 0 | 0 | 0 | 109.3 | W140 C152 | W140-C233 HydrophobicContact CD2-CB 3.31Å; W140-C233 HydrophobicContact CE3-CB 3.36Å; W140-C233 HydrophobicContact CG-CB 3.85Å; W140-C233 HydrophobicContact CH2-CB 4.11Å; W140-C233 HydrophobicContact CZ2-CB 4.1Å; W140-C233 HydrophobicContact CZ3-CB 3.77Å; C152-C233 WeakPolarHBondContact CA-SG 3.38Å; C152-C233 HydrophobicContact CB-CB 3.81Å; C152-C233 WeakPolarHBondContact CB-SG 3.48Å; C152-C233 PolarHBondContact O-SG 3.48Å; C152-C233 VanDerWaalsContact SG-CA 3.53Å; C152-C233 WeakPolarHBondContact SG-CB 3.3Å; C152-C233 CovalentContact SG-SG 2.02Å; C152-C233 PolarHBondContact SG-SG 3.36Å |
| 234 | M | 91.1 | Very high | 86.1 | Confident | 82 Ų | 82 | 87.9 Ų | 87.9 | 40% | 0.404 | 44% | 0.441 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.3 | 164.4 | -178.4 | 63.5 | 176.4 | 179.6 | 0 | 0 | 112.3 | A219 V221 T232 N236 | A219-M234 PolarHBondContact N-O 3.36Å; A219-M234 PolarHBondContact O-N 2.88Å; A219-M234 VanDerWaalsContact O-N 3.1Å; A219-M234 VanDerWaalsContact O-O 3.11Å; V221-M234 HydrophobicContact CB-CE 3.53Å; V221-M234 HydrophobicContact CB-CG 4.27Å; V221-M234 HydrophobicContact CG1-CE 3.44Å; V221-M234 VanDerWaalsContact CG1-CE 3.44Å; V221-M234 HydrophobicContact CG2-CE 3.86Å; V221-M234 HydrophobicContact CG2-CG 4.04Å; T232-M234 HydrophobicContact CG2-CG 4.25Å; T232-M234 HydrophobicContact CG2-SD 4.23Å; M234-N236 PolarHBondContact O-N 3.25Å |
| 235 | L | 91.7 | Very high | 86.8 | Confident | 32 Ų | 32 | 78.3 Ų | 78.3 | 17% | 0.168 | 41% | 0.405 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 113.3 | 175.5 | -174.3 | 74.9 | 0 | 0 | 0 | 109.6 | F218 M242 Y245 K246 K249 | F218-L235 HydrophobicContact CD2-CB 4.28Å; F218-L235 HydrophobicContact CD2-CD1 3.79Å; F218-L235 HydrophobicContact CE2-CB 3.84Å; F218-L235 HydrophobicContact CE2-CD1 3.75Å; F218-L235 HydrophobicContact CE2-CG 4.38Å; F218-L235 HydrophobicContact CZ-CB 4.19Å; L235-M242 HydrophobicContact CD1-CE 3.99Å; L235-Y245 HydrophobicContact CD1-CD1 4.2Å; L235-Y245 HydrophobicContact CD1-CE1 4.09Å; L235-Y245 HydrophobicContact CD2-CD1 4.27Å; L235-Y245 HydrophobicContact CD2-CE1 4.39Å; L235-K246 HydrophobicContact CD2-CB 3.71Å; L235-K246 HydrophobicContact CD2-CG 3.97Å; L235-K249 HydrophobicContact CD2-CD 4.31Å |
| 236 | N | 91.3 | Very high | 87.7 | Confident | 70 Ų | 70 | 78.6 Ų | 78.6 | 37% | 0.374 | 41% | 0.409 | S | S | . | . | trans | -115.7 | 101.7 | 179.1 | -173.1 | 30.3 | 0 | 0 | 0 | 110.1 | G217 A219 V221 M234 T238 | G217-N236 PolarHBondContact O-N 2.87Å; A219-N236 HydrophobicContact CB-CB 4.13Å; V221-N236 HydrophobicContact CG2-CB 4.1Å; M234-N236 PolarHBondContact O-N 3.25Å; N236-T238 PolarHBondContact O-N 2.92Å | ||
| 237 | P | 89.2 | Confident | 88.6 | Confident | 35 Ų | 35 | 76.2 Ų | 76.2 | 23% | 0.227 | 40% | 0.403 | C | S | . | . | trans | -73.8 | 112.2 | -176.2 | 30.5 | -34.3 | 0 | 0 | 0 | 111.1 | M242 L243 K246 | P237-M242 HydrophobicContact CB-CB 3.97Å; P237-L243 HydrophobicContact CB-CB 4.41Å; P237-L243 HydrophobicContact CG-CD1 4.31Å; P237-K246 HydrophobicContact CG-CD 3.89Å | ||
| 238 | T | 87.8 | Confident | 89.4 | Confident | 104 Ų | 104 | 69.8 Ų | 69.8 | 64% | 0.638 | 37% | 0.372 | S | S | * | . | trans | -92.3 | -26.5 | 177.4 | 61.8 | 0 | 0 | 0 | 0 | 113.5 | N236 | N236-T238 PolarHBondContact O-N 2.92Š| ||
| 239 | N | 90.9 | Very high | 90.1 | Very high | 103 Ų | 103 | 65.3 Ų | 65.3 | 55% | 0.551 | 35% | 0.35 | S | S | * | . | S | Bend | trans | -123.9 | 159 | -173.2 | -58.6 | -3.1 | 0 | 0 | 0 | 110.4 | F241 M242 L243 | N239-F241 VanDerWaalsContact C-N 3.25Å; N239-F241 PolarHBondContact O-N 3.21Å; N239-M242 WeakPolarHBondContact O-CA 3.31Å; N239-M242 WeakPolarHBondContact O-CB 3.33Å; N239-M242 PolarHBondContact O-N 3.17Å; N239-L243 PolarHBondContact O-N 3.36Å |
| 240 | N | 91.3 | Very high | 90.7 | Very high | 144 Ų | 144 | 64.2 Ų | 64.2 | 77% | 0.77 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -54.1 | -39.6 | 177.5 | -68.6 | -17.3 | 0 | 0 | 0 | 113.1 | M242 L243 F244 | N240-M242 VanDerWaalsContact C-N 3.34Å; N240-M242 PolarHBondContact O-N 2.93Å; N240-L243 WeakPolarHBondContact O-CB 3.46Å; N240-L243 PolarHBondContact O-N 3.47Å; N240-F244 PolarHBondContact O-N 3.04Å |
| 241 | F | 90.9 | Very high | 91.2 | Very high | 126 Ų | 126 | 67.3 Ų | 67.3 | 55% | 0.553 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -61.9 | -40.1 | 174.3 | 176.5 | -98.3 | 0 | 0 | 0 | 112.5 | N239 L243 F244 Y245 | N239-F241 VanDerWaalsContact C-N 3.25Å; N239-F241 PolarHBondContact O-N 3.21Å; F241-L243 VanDerWaalsContact C-N 3.32Å; F241-F244 PolarHBondContact O-N 3.29Å; F241-Y245 WeakPolarHBondContact O-CB 3.46Å; F241-Y245 PolarHBondContact O-N 2.89Å |
| 242 | M | 91.9 | Very high | 91.6 | Very high | 3 Ų | 3 | 69.6 Ų | 69.6 | 2% | 0.015 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -72.6 | -28.3 | 179.1 | -69.4 | -54.9 | -46.6 | 0 | 0 | 112.4 | I216 L235 P237 N239 N240 Y245 K246 | I216-M242 HydrophobicContact CB-SD 4.39Å; I216-M242 HydrophobicContact CG2-CG 4.47Å; I216-M242 HydrophobicContact CG2-SD 4Å; L235-M242 HydrophobicContact CD1-CE 3.99Å; P237-M242 HydrophobicContact CB-CB 3.97Å; N239-M242 WeakPolarHBondContact O-CA 3.31Å; N239-M242 WeakPolarHBondContact O-CB 3.33Å; N239-M242 PolarHBondContact O-N 3.17Å; N240-M242 VanDerWaalsContact C-N 3.34Å; N240-M242 PolarHBondContact O-N 2.93Å; M242-Y245 HydrophobicContact CE-CD1 3.66Å; M242-Y245 HydrophobicContact CE-CE1 4.41Å; M242-Y245 HydrophobicContact CE-CG 4.27Å; M242-Y245 PolarHBondContact O-N 3.49Å; M242-K246 WeakPolarHBondContact O-CB 3.45Å; M242-K246 PolarHBondContact O-N 3.01Å |
| 243 | L | 91.9 | Very high | 91.8 | Very high | 84 Ų | 84 | 67.9 Ų | 67.9 | 44% | 0.44 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -65.3 | -49.5 | 170.5 | -173.4 | 66.7 | 0 | 0 | 0 | 110.5 | P237 N239 N240 F241 Y245 K246 D247 | P237-L243 HydrophobicContact CB-CB 4.41Å; P237-L243 HydrophobicContact CG-CD1 4.31Å; N239-L243 PolarHBondContact O-N 3.36Å; N240-L243 WeakPolarHBondContact O-CB 3.46Å; N240-L243 PolarHBondContact O-N 3.47Å; F241-L243 VanDerWaalsContact C-N 3.32Å; L243-Y245 VanDerWaalsContact C-N 3.31Å; L243-Y245 PolarHBondContact O-N 3.12Å; L243-K246 WeakPolarHBondContact O-CB 3.27Å; L243-K246 PolarHBondContact O-N 3.35Å; L243-D247 PolarHBondContact O-N 2.86Å; L243-D247 VanDerWaalsContact O-N 3.11Å |
| 244 | F | 93.4 | Very high | 92 | Very high | 125 Ų | 125 | 70.4 Ų | 70.4 | 55% | 0.548 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -56.2 | -45.8 | 171.9 | 169.9 | -98.3 | 0 | 0 | 0 | 111.6 | N240 F241 K246 D247 A248 | N240-F244 PolarHBondContact O-N 3.04Å; F241-F244 PolarHBondContact O-N 3.29Å; F244-K246 PolarHBondContact O-N 2.88Å; F244-D247 CarbonylContact O-C 3.6Å; F244-D247 PolarHBondContact O-N 2.87Å; F244-A248 HydrophobicContact CE1-CB 4.09Å; F244-A248 HydrophobicContact CE2-CB 4.24Å; F244-A248 HydrophobicContact CZ-CB 3.94Å; F244-A248 VanDerWaalsContact O-CB 3.28Å; F244-A248 WeakPolarHBondContact O-CB 3.38Å; F244-A248 PolarHBondContact O-N 3.02Å |
| 245 | Y | 92.9 | Very high | 92.2 | Very high | 19 Ų | 19 | 68.1 Ų | 68.1 | 8% | 0.075 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.1 | -44.8 | 177.8 | 177.6 | -101.9 | 0 | 0 | 0 | 111.6 | P213 E214 L235 F241 M242 L243 D247 A248 K249 | P213-Y245 HydrophobicContact CB-CD1 4.19Å; P213-Y245 HydrophobicContact CB-CD2 3.72Å; P213-Y245 HydrophobicContact CB-CE1 3.94Å; P213-Y245 HydrophobicContact CB-CE2 3.45Å; P213-Y245 VanDerWaalsContact CB-CE2 3.45Å; P213-Y245 HydrophobicContact CB-CG 4.08Å; P213-Y245 HydrophobicContact CG-CD2 4.3Å; P213-Y245 HydrophobicContact CG-CE2 4.03Å; E214-Y245 PolarHBondContact OE1-OH 3.41Å; E214-Y245 VanDerWaalsContact OE1-OH 3.06Å; L235-Y245 HydrophobicContact CD1-CD1 4.2Å; L235-Y245 HydrophobicContact CD1-CE1 4.09Å; L235-Y245 HydrophobicContact CD2-CD1 4.27Å; L235-Y245 HydrophobicContact CD2-CE1 4.39Å; F241-Y245 WeakPolarHBondContact O-CB 3.46Å; F241-Y245 PolarHBondContact O-N 2.89Å; M242-Y245 HydrophobicContact CE-CD1 3.66Å; M242-Y245 HydrophobicContact CE-CE1 4.41Å; M242-Y245 HydrophobicContact CE-CG 4.27Å; M242-Y245 PolarHBondContact O-N 3.49Å; L243-Y245 VanDerWaalsContact C-N 3.31Å; L243-Y245 PolarHBondContact O-N 3.12Å; Y245-D247 VanDerWaalsContact C-N 3.27Å; Y245-D247 PolarHBondContact O-N 3.26Å; Y245-A248 PolarHBondContact O-N 2.94Å; Y245-K249 HydrophobicContact CE1-CB 4.31Å; Y245-K249 HydrophobicContact CE1-CD 3.85Å; Y245-K249 HydrophobicContact CE1-CG 4.3Å; Y245-K249 HydrophobicContact CE2-CB 4.49Å; Y245-K249 WeakPolarHBondContact O-CA 3.49Å; Y245-K249 WeakPolarHBondContact O-CB 3.29Å; Y245-K249 PolarHBondContact O-N 2.92Å |
| 246 | K | 91.3 | Very high | 92.2 | Very high | 102 Ų | 102 | 68 Ų | 68 | 44% | 0.443 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -54.8 | -45 | 175.6 | 174.4 | -179.7 | 173.6 | -177.4 | 0 | 111.4 | L235 P237 M242 L243 F244 | L235-K246 HydrophobicContact CD2-CB 3.71Å; L235-K246 HydrophobicContact CD2-CG 3.97Å; P237-K246 HydrophobicContact CG-CD 3.89Å; M242-K246 WeakPolarHBondContact O-CB 3.45Å; M242-K246 PolarHBondContact O-N 3.01Å; L243-K246 WeakPolarHBondContact O-CB 3.27Å; L243-K246 PolarHBondContact O-N 3.35Å; F244-K246 PolarHBondContact O-N 2.88Å |
| 247 | D | 90.3 | Very high | 92.4 | Very high | 92 Ų | 92 | 64.8 Ų | 64.8 | 49% | 0.492 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -77.7 | -27.7 | -178.8 | -66.4 | -22 | 0 | 0 | 0 | 112.9 | L243 F244 Y245 K324 | L243-D247 PolarHBondContact O-N 2.86Å; L243-D247 VanDerWaalsContact O-N 3.11Å; F244-D247 CarbonylContact O-C 3.6Å; F244-D247 PolarHBondContact O-N 2.87Å; Y245-D247 VanDerWaalsContact C-N 3.27Å; Y245-D247 PolarHBondContact O-N 3.26Å; D247-K324 PolarHBondContact O-NZ 3.4Å |
| 248 | A | 93 | Very high | 92.6 | Very high | 26 Ų | 26 | 63.8 Ų | 63.8 | 22% | 0.215 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -90.4 | -21.8 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | F244 Y245 D250 W251 W252 | F244-A248 HydrophobicContact CE1-CB 4.09Å; F244-A248 HydrophobicContact CE2-CB 4.24Å; F244-A248 HydrophobicContact CZ-CB 3.94Å; F244-A248 VanDerWaalsContact O-CB 3.28Å; F244-A248 WeakPolarHBondContact O-CB 3.38Å; F244-A248 PolarHBondContact O-N 3.02Å; Y245-A248 PolarHBondContact O-N 2.94Å; A248-D250 PolarHBondContact O-N 2.99Å; A248-W251 PolarHBondContact O-N 3.1Å; A248-W251 VanDerWaalsContact O-N 3.13Å; A248-W252 WeakPolarHBondContact O-CB 3.42Å; A248-W252 PolarHBondContact O-N 3.05Å |
| 249 | K | 92.8 | Very high | 92.9 | Very high | 22 Ų | 22 | 61.1 Ų | 61.1 | 10% | 0.096 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -50.8 | -53.9 | -166.4 | 172.7 | 175.7 | 176.2 | 164.4 | 0 | 113.6 | E214 L235 Y245 W251 W252 L253 | E214-K249 WeakPolarHBondContact OE1-CE 3.32Å; E214-K249 IonicContact OE1-NZ 3.99Å; E214-K249 PolarHBondContact OE1-NZ 3.47Å; E214-K249 IonicContact OE2-NZ 3.14Å; E214-K249 PolarHBondContact OE2-NZ 2.66Å; L235-K249 HydrophobicContact CD2-CD 4.31Å; Y245-K249 HydrophobicContact CE1-CB 4.31Å; Y245-K249 HydrophobicContact CE1-CD 3.85Å; Y245-K249 HydrophobicContact CE1-CG 4.3Å; Y245-K249 HydrophobicContact CE2-CB 4.49Å; Y245-K249 WeakPolarHBondContact O-CA 3.49Å; Y245-K249 WeakPolarHBondContact O-CB 3.29Å; Y245-K249 PolarHBondContact O-N 2.92Å; K249-W251 VanDerWaalsContact C-N 3.33Å; K249-W251 PolarHBondContact O-N 3.39Å; K249-W252 PolarHBondContact O-N 2.94Å; K249-L253 HydrophobicContact CG-CD1 3.83Å; K249-L253 HydrophobicContact CG-CG 4.27Å; K249-L253 WeakPolarHBondContact O-CB 3.26Å; K249-L253 WeakPolarHBondContact O-CG 3.33Å; K249-L253 PolarHBondContact O-N 3.23Å |
| 250 | D | 92.6 | Very high | 93 | Very high | 35 Ų | 35 | 58.4 Ų | 58.4 | 19% | 0.187 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -67.4 | -35.5 | -175.1 | -66.1 | -44.4 | 0 | 0 | 0 | 112.5 | A248 F254 I321 K324 | A248-D250 PolarHBondContact O-N 2.99Å; D250-F254 WeakPolarHBondContact O-CB 3.38Å; D250-F254 PolarHBondContact O-N 3.25Å; D250-I321 HydrophobicContact CB-CD1 3.93Å; D250-K324 HydrophobicContact CB-CD 4.49Å |
| 251 | W | 94 | Very high | 93 | Very high | 126 Ų | 126 | 51.7 Ų | 51.7 | 48% | 0.477 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -69.7 | -43.5 | 174.5 | -69.4 | 121.6 | 0 | 0 | 0 | 111.8 | A248 K249 F254 G255 I321 M325 | A248-W251 PolarHBondContact O-N 3.1Å; A248-W251 VanDerWaalsContact O-N 3.13Å; K249-W251 VanDerWaalsContact C-N 3.33Å; K249-W251 PolarHBondContact O-N 3.39Å; W251-F254 PolarHBondContact O-N 3Å; W251-G255 PolarHBondContact O-N 3.29Å; W251-I321 HydrophobicContact CD2-CD1 3.89Å; W251-I321 HydrophobicContact CE3-CD1 3.87Å; W251-I321 HydrophobicContact CG-CD1 4.48Å; W251-I321 HydrophobicContact CH2-CD1 4.34Å; W251-I321 HydrophobicContact CH2-CG2 4.13Å; W251-I321 HydrophobicContact CZ2-CD1 4.37Å; W251-I321 HydrophobicContact CZ2-CG2 4.47Å; W251-I321 HydrophobicContact CZ3-CD1 4.1Å; W251-M325 HydrophobicContact CZ2-SD 4.2Å |
| 252 | W | 94.4 | Very high | 93 | Very high | 84 Ų | 84 | 47.7 Ų | 47.7 | 32% | 0.318 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -58.8 | -47.9 | 173.4 | 164.9 | -105.3 | 0 | 0 | 0 | 111.2 | L210 A248 K249 F254 G255 F256 Y257 | L210-W252 HydrophobicContact CD2-CH2 4.29Å; L210-W252 HydrophobicContact CD2-CZ2 3.8Å; A248-W252 WeakPolarHBondContact O-CB 3.42Å; A248-W252 PolarHBondContact O-N 3.05Å; K249-W252 PolarHBondContact O-N 2.94Å; W252-F254 PolarHBondContact O-N 3.4Å; W252-G255 PolarHBondContact O-N 3.46Å; W252-F256 HydrophobicContact CD2-CB 4.23Å; W252-F256 HydrophobicContact CE3-CB 4.25Å; W252-F256 HydrophobicContact CH2-CB 3.83Å; W252-F256 AromaticContact CH2-CD2 3.51Å; W252-F256 HydrophobicContact CH2-CD2 3.51Å; W252-F256 HydrophobicContact CH2-CE2 4.24Å; W252-F256 AromaticContact CH2-CG 3.69Å; W252-F256 HydrophobicContact CH2-CG 3.69Å; W252-F256 HydrophobicContact CZ2-CB 3.78Å; W252-F256 HydrophobicContact CZ2-CD1 4.15Å; W252-F256 AromaticContact CZ2-CD2 3.93Å; W252-F256 HydrophobicContact CZ2-CD2 3.93Å; W252-F256 AromaticContact CZ2-CG 3.66Å; W252-F256 HydrophobicContact CZ2-CG 3.66Å; W252-F256 HydrophobicContact CZ3-CB 4.07Å; W252-F256 HydrophobicContact CZ3-CD2 4.19Å; W252-F256 HydrophobicContact CZ3-CG 4.37Å; W252-F256 WeakPolarHBondContact O-CB 3.27Å; W252-F256 PolarHBondContact O-N 2.98Å; W252-Y257 AromaticContact NE1-CE2 3.95Å |
| 253 | L | 93.9 | Very high | 93 | Very high | 5 Ų | 5 | 49.9 Ų | 49.9 | 3% | 0.026 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -61.8 | -43.7 | 177.8 | -72.9 | 177 | 0 | 0 | 0 | 111.2 | K160 K249 Y257 F258 H317 | K160-L253 HydrophobicContact CD-CD2 4.32Å; K249-L253 HydrophobicContact CG-CD1 3.83Å; K249-L253 HydrophobicContact CG-CG 4.27Å; K249-L253 WeakPolarHBondContact O-CB 3.26Å; K249-L253 WeakPolarHBondContact O-CG 3.33Å; K249-L253 PolarHBondContact O-N 3.23Å; L253-Y257 HydrophobicContact CD2-CD2 3.52Å; L253-Y257 HydrophobicContact CD2-CE2 3.56Å; L253-Y257 HydrophobicContact CD2-CG 4.31Å; L253-Y257 WeakPolarHBondContact O-CA 3.37Å; L253-Y257 VanDerWaalsContact O-CB 3.27Å; L253-Y257 WeakPolarHBondContact O-CB 3.3Å; L253-Y257 PolarHBondContact O-N 2.96Å; L253-F258 PolarHBondContact O-N 2.78Å; L253-H317 PolarHBondContact O-CE1 3.22Å |
| 254 | F | 95 | Very high | 93 | Very high | 60 Ų | 60 | 46.4 Ų | 46.4 | 26% | 0.263 | 24% | 0.236 | S | C | . | . | I | π-helix | trans | -64.1 | -46.8 | 175.9 | 179.3 | -113.1 | 0 | 0 | 0 | 112.2 | D250 W251 W252 F258 C259 H317 | D250-F254 WeakPolarHBondContact O-CB 3.38Å; D250-F254 PolarHBondContact O-N 3.25Å; W251-F254 PolarHBondContact O-N 3Å; W252-F254 PolarHBondContact O-N 3.4Å; F254-F258 HydrophobicContact CD2-CB 4.2Å; F254-F258 AromaticContact CD2-CD1 3.74Å; F254-F258 HydrophobicContact CD2-CD1 3.74Å; F254-F258 HydrophobicContact CD2-CG 4.23Å; F254-F258 AromaticContact CE2-CD1 3.37Å; F254-F258 HydrophobicContact CE2-CD1 3.37Å; F254-F258 AromaticContact CE2-CE1 3.75Å; F254-F258 HydrophobicContact CE2-CE1 3.75Å; F254-F258 HydrophobicContact CE2-CG 4.26Å; F254-F258 HydrophobicContact CZ-CD1 4.21Å; F254-F258 HydrophobicContact CZ-CE1 4.46Å; F254-F258 WeakPolarHBondContact O-CA 3.33Å; F254-F258 VanDerWaalsContact O-CB 3.26Å; F254-F258 WeakPolarHBondContact O-CB 3.32Å; F254-F258 PolarHBondContact O-N 2.93Å; F254-C259 VanDerWaalsContact CE1-SG 3.57Å; F254-C259 PolarHBondContact O-N 3.33Å; F254-H317 HydrophobicContact CD2-CB 3.78Å; F254-H317 HydrophobicContact CE2-CB 4.45Å |
| 255 | G | 95.1 | Very high | 92.6 | Very high | 33 Ų | 33 | 41 Ų | 41 | 34% | 0.34 | 21% | 0.213 | S | C | . | . | I | π-helix | trans | -64.2 | -54.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | W251 W252 C259 M260 | W251-G255 PolarHBondContact O-N 3.29Å; W252-G255 PolarHBondContact O-N 3.46Å; G255-C259 WeakPolarHBondContact O-CB 3.3Å; G255-C259 PolarHBondContact O-N 2.88Å; G255-M260 PolarHBondContact O-N 2.87Å |
| 256 | F | 93.4 | Very high | 92.4 | Very high | 29 Ų | 29 | 42.6 Ų | 42.6 | 13% | 0.127 | 23% | 0.23 | C | C | . | . | I | π-helix | trans | -81.3 | -46 | -172.2 | -171.7 | -88.3 | 0 | 0 | 0 | 113.2 | L168 L210 W252 M260 P261 | L168-F256 HydrophobicContact CD2-CZ 4.27Å; L210-F256 HydrophobicContact CD1-CD1 3.95Å; L210-F256 HydrophobicContact CD1-CE1 3.19Å; L210-F256 HydrophobicContact CD1-CE2 4.12Å; L210-F256 HydrophobicContact CD1-CZ 3.29Å; W252-F256 HydrophobicContact CD2-CB 4.23Å; W252-F256 HydrophobicContact CE3-CB 4.25Å; W252-F256 HydrophobicContact CH2-CB 3.83Å; W252-F256 AromaticContact CH2-CD2 3.51Å; W252-F256 HydrophobicContact CH2-CD2 3.51Å; W252-F256 HydrophobicContact CH2-CE2 4.24Å; W252-F256 AromaticContact CH2-CG 3.69Å; W252-F256 HydrophobicContact CH2-CG 3.69Å; W252-F256 HydrophobicContact CZ2-CB 3.78Å; W252-F256 HydrophobicContact CZ2-CD1 4.15Å; W252-F256 AromaticContact CZ2-CD2 3.93Å; W252-F256 HydrophobicContact CZ2-CD2 3.93Å; W252-F256 AromaticContact CZ2-CG 3.66Å; W252-F256 HydrophobicContact CZ2-CG 3.66Å; W252-F256 HydrophobicContact CZ3-CB 4.07Å; W252-F256 HydrophobicContact CZ3-CD2 4.19Å; W252-F256 HydrophobicContact CZ3-CG 4.37Å; W252-F256 WeakPolarHBondContact O-CB 3.27Å; W252-F256 PolarHBondContact O-N 2.98Å; F256-M260 WeakPolarHBondContact O-CB 3.35Å; F256-P261 WeakPolarHBondContact O-CD 3.35Å |
| 257 | Y | 93.5 | Very high | 92.4 | Very high | 3 Ų | 3 | 42.1 Ų | 42.1 | 1% | 0.012 | 23% | 0.231 | C | C | . | . | I | π-helix | trans | -87.1 | -20.4 | -175.2 | -67 | -99.8 | 0 | 0 | 0 | 112.8 | V163 G164 V167 W252 L253 P261 F309 | V163-Y257 HydrophobicContact CB-CD1 4.12Å; V163-Y257 HydrophobicContact CB-CE1 4.25Å; V163-Y257 HydrophobicContact CG1-CD1 3.65Å; V163-Y257 HydrophobicContact CG1-CE1 4.28Å; V163-Y257 HydrophobicContact CG1-CG 4.46Å; G164-Y257 VanDerWaalsContact CA-CE1 3.47Å; V167-Y257 VanDerWaalsContact CG1-O 3.28Å; V167-Y257 WeakPolarHBondContact CG1-O 3.33Å; V167-Y257 HydrophobicContact CG2-CD1 3.96Å; W252-Y257 AromaticContact NE1-CE2 3.95Å; L253-Y257 HydrophobicContact CD2-CD2 3.52Å; L253-Y257 HydrophobicContact CD2-CE2 3.56Å; L253-Y257 HydrophobicContact CD2-CG 4.31Å; L253-Y257 WeakPolarHBondContact O-CA 3.37Å; L253-Y257 VanDerWaalsContact O-CB 3.27Å; L253-Y257 WeakPolarHBondContact O-CB 3.3Å; L253-Y257 PolarHBondContact O-N 2.96Å; Y257-P261 VanDerWaalsContact O-CG 3.3Å; Y257-P261 WeakPolarHBondContact O-CG 3.47Å; Y257-F309 VanDerWaalsContact O-CZ 3.31Å; Y257-F309 WeakPolarHBondContact O-CZ 3.41Å |
| 258 | F | 93.8 | Very high | 92.2 | Very high | 15 Ų | 15 | 39.2 Ų | 39.2 | 7% | 0.066 | 21% | 0.214 | C | C | . | . | I | π-helix | trans | -111.9 | -57.1 | -179.9 | -177.5 | -96.1 | 0 | 0 | 0 | 113 | L253 F254 P261 L262 F309 W313 F314 H317 | L253-F258 PolarHBondContact O-N 2.78Å; F254-F258 HydrophobicContact CD2-CB 4.2Å; F254-F258 AromaticContact CD2-CD1 3.74Å; F254-F258 HydrophobicContact CD2-CD1 3.74Å; F254-F258 HydrophobicContact CD2-CG 4.23Å; F254-F258 AromaticContact CE2-CD1 3.37Å; F254-F258 HydrophobicContact CE2-CD1 3.37Å; F254-F258 AromaticContact CE2-CE1 3.75Å; F254-F258 HydrophobicContact CE2-CE1 3.75Å; F254-F258 HydrophobicContact CE2-CG 4.26Å; F254-F258 HydrophobicContact CZ-CD1 4.21Å; F254-F258 HydrophobicContact CZ-CE1 4.46Å; F254-F258 WeakPolarHBondContact O-CA 3.33Å; F254-F258 VanDerWaalsContact O-CB 3.26Å; F254-F258 WeakPolarHBondContact O-CB 3.32Å; F254-F258 PolarHBondContact O-N 2.93Å; F258-P261 WeakPolarHBondContact O-CD 3.04Å; F258-P261 VanDerWaalsContact O-CG 3.31Å; F258-P261 WeakPolarHBondContact O-CG 3.25Å; F258-L262 HydrophobicContact CD1-CD1 3.96Å; F258-L262 HydrophobicContact CD2-CD1 4.41Å; F258-L262 HydrophobicContact CE1-CD1 3.56Å; F258-L262 HydrophobicContact CE2-CD1 4.05Å; F258-L262 HydrophobicContact CG-CD1 4.37Å; F258-L262 HydrophobicContact CZ-CD1 3.6Å; F258-L262 VanDerWaalsContact O-CG 3.26Å; F258-L262 WeakPolarHBondContact O-CG 3.22Å; F258-F309 HydrophobicContact CD2-CE1 4.27Å; F258-W313 HydrophobicContact CD2-CB 3.94Å; F258-W313 HydrophobicContact CE2-CB 4.21Å; F258-F314 HydrophobicContact CE1-CD2 4.23Å; F258-F314 HydrophobicContact CE2-CB 3.87Å; F258-F314 HydrophobicContact CZ-CB 3.8Å; F258-F314 AromaticContact CZ-CD2 3.82Å; F258-F314 HydrophobicContact CZ-CD2 3.82Å; F258-F314 HydrophobicContact CZ-CG 4.31Å; F258-H317 AromaticContact CD2-CD2 3.83Å; F258-H317 AromaticContact CG-CD2 3.94Å |
| 259 | C | 94.9 | Very high | 91.7 | Very high | 47 Ų | 47 | 41.6 Ų | 41.6 | 32% | 0.318 | 22% | 0.218 | S | C | . | . | I | π-helix | trans | -70 | -41.8 | -175.3 | -63.8 | 0 | 0 | 0 | 0 | 113.3 | F254 G255 L262 A263 | F254-C259 VanDerWaalsContact CE1-SG 3.57Å; F254-C259 PolarHBondContact O-N 3.33Å; G255-C259 WeakPolarHBondContact O-CB 3.3Å; G255-C259 PolarHBondContact O-N 2.88Å; C259-L262 PolarHBondContact O-N 3.18Å; C259-A263 WeakPolarHBondContact O-CB 3.34Å; C259-A263 PolarHBondContact O-N 3.49Å |
| 260 | M | 93.1 | Very high | 91.4 | Very high | 47 Ų | 47 | 44.5 Ų | 44.5 | 23% | 0.232 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58 | -50.6 | -179.5 | -175.8 | -82.1 | 174.3 | 0 | 0 | 113.5 | G255 F256 L262 A263 C264 | G255-M260 PolarHBondContact O-N 2.87Å; F256-M260 WeakPolarHBondContact O-CB 3.35Å; M260-L262 VanDerWaalsContact C-N 3.32Å; M260-L262 PolarHBondContact O-N 3.36Å; M260-A263 PolarHBondContact O-N 3.42Å; M260-C264 HydrophobicContact CE-CB 4.32Å; M260-C264 WeakPolarHBondContact O-CB 3.49Å; M260-C264 PolarHBondContact O-N 3.03Å; M260-C264 HydrophobicContact SD-CB 4.44Å |
| 261 | P | 89.9 | Confident | 91 | Very high | 2 Ų | 2 | 46.4 Ų | 46.4 | 1% | 0.013 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.9 | -36.7 | 178.1 | 23.3 | -33.6 | 0 | 0 | 0 | 112.6 | V167 C171 F256 Y257 F258 T265 F309 | V167-P261 HydrophobicContact CB-CB 4.31Å; V167-P261 HydrophobicContact CB-CG 4.09Å; V167-P261 HydrophobicContact CG1-CG 4.24Å; C171-P261 VanDerWaalsContact SG-CA 3.58Å; F256-P261 WeakPolarHBondContact O-CD 3.35Å; Y257-P261 VanDerWaalsContact O-CG 3.3Å; Y257-P261 WeakPolarHBondContact O-CG 3.47Å; F258-P261 WeakPolarHBondContact O-CD 3.04Å; F258-P261 VanDerWaalsContact O-CG 3.31Å; F258-P261 WeakPolarHBondContact O-CG 3.25Å; P261-T265 VanDerWaalsContact O-CB 3.29Å; P261-T265 WeakPolarHBondContact O-CB 3.48Å; P261-T265 WeakPolarHBondContact O-CG2 3.33Å; P261-T265 PolarHBondContact O-N 3.44Å; P261-T265 PolarHBondContact O-OG1 2.86Å; P261-F309 HydrophobicContact CB-CE1 4.47Å; P261-F309 HydrophobicContact CG-CE1 3.8Å; P261-F309 HydrophobicContact CG-CZ 4.1Å |
| 262 | L | 91.6 | Very high | 90.3 | Very high | 43 Ų | 43 | 40.7 Ų | 40.7 | 23% | 0.225 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.9 | -44.2 | 175.2 | -63.3 | 177.1 | 0 | 0 | 0 | 112.1 | F258 C259 M260 T265 A266 V306 F309 A310 | F258-L262 HydrophobicContact CD1-CD1 3.96Å; F258-L262 HydrophobicContact CD2-CD1 4.41Å; F258-L262 HydrophobicContact CE1-CD1 3.56Å; F258-L262 HydrophobicContact CE2-CD1 4.05Å; F258-L262 HydrophobicContact CG-CD1 4.37Å; F258-L262 HydrophobicContact CZ-CD1 3.6Å; F258-L262 VanDerWaalsContact O-CG 3.26Å; F258-L262 WeakPolarHBondContact O-CG 3.22Å; C259-L262 PolarHBondContact O-N 3.18Å; M260-L262 VanDerWaalsContact C-N 3.32Å; M260-L262 PolarHBondContact O-N 3.36Å; L262-T265 WeakPolarHBondContact CA-OG1 3.22Å; L262-T265 PolarHBondContact O-OG1 3.43Å; L262-A266 WeakPolarHBondContact O-CB 3.36Å; L262-A266 PolarHBondContact O-N 3.47Å; L262-V306 HydrophobicContact CD2-CG1 3.62Å; L262-F309 HydrophobicContact CD2-CD1 4.27Å; L262-A310 HydrophobicContact CD1-CB 4.34Å; L262-A310 HydrophobicContact CD2-CB 3.76Å |
| 263 | A | 92.8 | Very high | 89.6 | Confident | 49 Ų | 49 | 39.3 Ų | 39.3 | 41% | 0.405 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -65.3 | -47.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | C259 M260 T265 A266 I267 | C259-A263 WeakPolarHBondContact O-CB 3.34Å; C259-A263 PolarHBondContact O-N 3.49Å; M260-A263 PolarHBondContact O-N 3.42Å; A263-T265 PolarHBondContact O-N 2.99Å; A263-A266 PolarHBondContact O-N 3.38Å; A263-I267 WeakPolarHBondContact O-CB 3.4Å; A263-I267 WeakPolarHBondContact O-CD1 3.49Å; A263-I267 WeakPolarHBondContact O-CG1 3.49Å; A263-I267 PolarHBondContact O-N 3.33Å |
| 264 | C | 90.6 | Very high | 89 | Confident | 11 Ų | 11 | 42.3 Ų | 42.3 | 7% | 0.074 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -55.4 | -52.3 | 177.7 | -179.8 | 0 | 0 | 0 | 0 | 111.2 | C171 M260 I267 F268 | C171-C264 VanDerWaalsContact SG-SG 3.64Å; M260-C264 HydrophobicContact CE-CB 4.32Å; M260-C264 WeakPolarHBondContact O-CB 3.49Å; M260-C264 PolarHBondContact O-N 3.03Å; M260-C264 HydrophobicContact SD-CB 4.44Å; C264-I267 PolarHBondContact O-N 2.97Å; C264-F268 WeakPolarHBondContact O-CD2 3.46Å; C264-F268 PolarHBondContact O-N 2.8Å; C264-F268 VanDerWaalsContact SG-CE2 3.57Å |
| 265 | T | 86.8 | Confident | 88.2 | Confident | 11 Ų | 11 | 41.7 Ų | 41.7 | 7% | 0.067 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.9 | -42.2 | -179.9 | 55.2 | 0 | 0 | 0 | 0 | 112.1 | S174 P261 L262 A263 I267 F268 Y269 V306 | S174-T265 WeakPolarHBondContact OG-CG2 3.32Å; P261-T265 VanDerWaalsContact O-CB 3.29Å; P261-T265 WeakPolarHBondContact O-CB 3.48Å; P261-T265 WeakPolarHBondContact O-CG2 3.33Å; P261-T265 PolarHBondContact O-N 3.44Å; P261-T265 PolarHBondContact O-OG1 2.86Å; L262-T265 WeakPolarHBondContact CA-OG1 3.22Å; L262-T265 PolarHBondContact O-OG1 3.43Å; A263-T265 PolarHBondContact O-N 2.99Å; T265-I267 PolarHBondContact O-N 2.92Å; T265-F268 PolarHBondContact O-N 3.46Å; T265-Y269 WeakPolarHBondContact O-CB 3.37Å; T265-Y269 PolarHBondContact O-N 3.19Å; T265-V306 HydrophobicContact CG2-CB 4.37Å; T265-V306 HydrophobicContact CG2-CG1 4.16Å; T265-V306 HydrophobicContact CG2-CG2 3.29Å; T265-V306 VanDerWaalsContact OG1-CG1 3.24Å; T265-V306 WeakPolarHBondContact OG1-CG1 3.42Å |
| 266 | A | 88.2 | Confident | 87 | Confident | 52 Ų | 52 | 41.8 Ų | 41.8 | 43% | 0.43 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60.9 | -43.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | L262 A263 T270 | L262-A266 WeakPolarHBondContact O-CB 3.36Å; L262-A266 PolarHBondContact O-N 3.47Å; A263-A266 PolarHBondContact O-N 3.38Å; A266-T270 VanDerWaalsContact O-CB 3.29Å; A266-T270 WeakPolarHBondContact O-CB 3.41Å; A266-T270 PolarHBondContact O-N 2.87Å; A266-T270 PolarHBondContact O-OG1 3.41Å |
| 267 | I | 90.1 | Very high | 86 | Confident | 93 Ų | 93 | 45 Ų | 45 | 48% | 0.477 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.8 | -54.9 | 177.2 | -69 | 164 | 0 | 0 | 0 | 110.1 | A263 C264 T265 Y269 T270 L271 | A263-I267 WeakPolarHBondContact O-CB 3.4Å; A263-I267 WeakPolarHBondContact O-CD1 3.49Å; A263-I267 WeakPolarHBondContact O-CG1 3.49Å; A263-I267 PolarHBondContact O-N 3.33Å; C264-I267 PolarHBondContact O-N 2.97Å; T265-I267 PolarHBondContact O-N 2.92Å; I267-Y269 VanDerWaalsContact C-N 3.32Å; I267-Y269 PolarHBondContact O-N 3.49Å; I267-T270 PolarHBondContact O-N 3.5Å; I267-L271 HydrophobicContact CG2-CD1 3.94Å; I267-L271 HydrophobicContact CG2-CG 4.37Å; I267-L271 VanDerWaalsContact O-CG 3.32Å; I267-L271 WeakPolarHBondContact O-CG 3.26Å; I267-L271 PolarHBondContact O-N 3.29Å |
| 268 | F | 86.5 | Confident | 85 | Confident | 31 Ų | 31 | 50.3 Ų | 50.3 | 14% | 0.136 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -66.1 | -33.3 | -177.5 | -75.3 | -64.5 | 0 | 0 | 0 | 113.1 | V175 Y178 C264 T265 L271 M272 | V175-F268 HydrophobicContact CG2-CD2 3.76Å; V175-F268 HydrophobicContact CG2-CE1 4.16Å; V175-F268 HydrophobicContact CG2-CE2 3.36Å; V175-F268 HydrophobicContact CG2-CG 4.36Å; V175-F268 HydrophobicContact CG2-CZ 3.59Å; Y178-F268 AromaticContact CD1-CD1 3.71Å; Y178-F268 HydrophobicContact CD1-CD1 3.71Å; Y178-F268 HydrophobicContact CD1-CE1 4.03Å; Y178-F268 HydrophobicContact CE1-CD1 4.43Å; Y178-F268 AromaticContact CG-CD1 3.84Å; Y178-F268 HydrophobicContact CG-CD1 3.84Å; C264-F268 WeakPolarHBondContact O-CD2 3.46Å; C264-F268 PolarHBondContact O-N 2.8Å; C264-F268 VanDerWaalsContact SG-CE2 3.57Å; T265-F268 PolarHBondContact O-N 3.46Å; F268-L271 HydrophobicContact CD1-CD1 4.35Å; F268-M272 WeakPolarHBondContact O-CB 3.26Å; F268-M272 PolarHBondContact O-N 2.83Å |
| 269 | Y | 83.8 | Confident | 83.6 | Confident | 76 Ų | 76 | 54.9 Ų | 54.9 | 30% | 0.298 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -68.7 | -39.8 | 174.1 | -174.5 | -99 | 0 | 0 | 0 | 112.1 | T265 I267 M272 T273 A299 F303 | T265-Y269 WeakPolarHBondContact O-CB 3.37Å; T265-Y269 PolarHBondContact O-N 3.19Å; I267-Y269 VanDerWaalsContact C-N 3.32Å; I267-Y269 PolarHBondContact O-N 3.49Å; Y269-M272 PolarHBondContact O-N 3.28Å; Y269-T273 WeakPolarHBondContact O-CB 3.24Å; Y269-T273 PolarHBondContact O-N 3.35Å; Y269-T273 PolarHBondContact O-OG1 3.28Å; Y269-A299 HydrophobicContact CE2-CB 4.35Å; Y269-F303 HydrophobicContact CD1-CD2 4.21Å; Y269-F303 HydrophobicContact CD2-CB 4.2Å; Y269-F303 HydrophobicContact CE1-CD2 4.26Å; Y269-F303 HydrophobicContact CE2-CB 3.98Å; Y269-F303 HydrophobicContact CE2-CG 4.45Å; Y269-F303 HydrophobicContact CG-CD2 4.33Å |
| 270 | T | 84.6 | Confident | 82 | Confident | 82 Ų | 82 | 62.5 Ų | 62.5 | 50% | 0.503 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64 | -50 | 174.4 | -57.5 | 0 | 0 | 0 | 0 | 110.4 | A266 I267 M272 T273 C274 | A266-T270 VanDerWaalsContact O-CB 3.29Å; A266-T270 WeakPolarHBondContact O-CB 3.41Å; A266-T270 PolarHBondContact O-N 2.87Å; A266-T270 PolarHBondContact O-OG1 3.41Å; I267-T270 PolarHBondContact O-N 3.5Å; T270-M272 VanDerWaalsContact C-N 3.31Å; T270-M272 PolarHBondContact O-N 3.35Å; T270-T273 PolarHBondContact O-N 2.88Å; T270-T273 VanDerWaalsContact O-N 3.12Å; T270-C274 WeakPolarHBondContact O-CB 3.31Å; T270-C274 PolarHBondContact O-N 2.93Å; T270-C274 PolarHBondContact O-SG 3.03Å |
| 271 | L | 85.1 | Confident | 80.2 | Confident | 75 Ų | 75 | 67.2 Ų | 67.2 | 39% | 0.393 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -57.9 | -43.4 | 176.3 | -69 | 176 | 0 | 0 | 0 | 111.9 | Y178 I267 F268 T273 C274 E275 | Y178-L271 HydrophobicContact CD2-CB 3.93Å; Y178-L271 HydrophobicContact CE2-CB 3.55Å; I267-L271 HydrophobicContact CG2-CD1 3.94Å; I267-L271 HydrophobicContact CG2-CG 4.37Å; I267-L271 VanDerWaalsContact O-CG 3.32Å; I267-L271 WeakPolarHBondContact O-CG 3.26Å; I267-L271 PolarHBondContact O-N 3.29Å; F268-L271 HydrophobicContact CD1-CD1 4.35Å; L271-T273 PolarHBondContact O-N 3.47Å; L271-C274 PolarHBondContact O-N 3.14Å; L271-E275 WeakPolarHBondContact O-CB 3.18Å; L271-E275 PolarHBondContact O-N 3.29Å |
| 272 | M | 79.9 | Confident | 78.6 | Confident | 7 Ų | 7 | 71.1 Ų | 71.1 | 3% | 0.034 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -60.2 | -46.3 | 175.4 | 178.1 | 174.6 | 166.5 | 0 | 0 | 111.6 | Y178 V181 F268 Y269 T270 E275 M276 A299 | Y178-M272 HydrophobicContact CD2-CB 4.08Å; V181-M272 HydrophobicContact CB-CE 4.27Å; V181-M272 HydrophobicContact CB-CG 4.13Å; V181-M272 HydrophobicContact CB-SD 4.46Å; V181-M272 HydrophobicContact CG1-CE 4.38Å; V181-M272 HydrophobicContact CG1-CG 4.03Å; V181-M272 HydrophobicContact CG2-CE 3.27Å; V181-M272 HydrophobicContact CG2-CG 4.06Å; V181-M272 HydrophobicContact CG2-SD 3.8Å; F268-M272 WeakPolarHBondContact O-CB 3.26Å; F268-M272 PolarHBondContact O-N 2.83Å; Y269-M272 PolarHBondContact O-N 3.28Å; T270-M272 VanDerWaalsContact C-N 3.31Å; T270-M272 PolarHBondContact O-N 3.35Å; M272-E275 PolarHBondContact O-N 3.26Å; M272-M276 HydrophobicContact CE-SD 3.66Å; M272-M276 HydrophobicContact CG-SD 4.31Å; M272-M276 VanDerWaalsContact O-CG 3.28Å; M272-M276 WeakPolarHBondContact O-CG 3.31Å; M272-M276 PolarHBondContact O-N 2.89Å; M272-A299 HydrophobicContact CE-CB 3.19Å; M272-A299 HydrophobicContact SD-CB 3.37Å; M272-A299 WeakPolarHBondContact SD-CB 3.13Å |
| 273 | T | 78.6 | Confident | 76.7 | Confident | 54 Ų | 54 | 75.3 Ų | 75.3 | 33% | 0.331 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -66 | -43 | -179.6 | -57.9 | 0 | 0 | 0 | 0 | 111.2 | Y269 T270 L271 M276 L277 | Y269-T273 WeakPolarHBondContact O-CB 3.24Å; Y269-T273 PolarHBondContact O-N 3.35Å; Y269-T273 PolarHBondContact O-OG1 3.28Å; T270-T273 PolarHBondContact O-N 2.88Å; T270-T273 VanDerWaalsContact O-N 3.12Å; L271-T273 PolarHBondContact O-N 3.47Å; T273-M276 PolarHBondContact O-N 3.12Å; T273-L277 HydrophobicContact CG2-CD1 4.11Å; T273-L277 HydrophobicContact CG2-CG 4.5Å; T273-L277 VanDerWaalsContact O-CG 3.32Å; T273-L277 WeakPolarHBondContact O-CG 3.28Å; T273-L277 PolarHBondContact O-N 2.92Å |
| 274 | C | 81.8 | Confident | 75 | Confident | 69 Ų | 69 | 78.4 Ų | 78.4 | 47% | 0.466 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.7 | -46.8 | 175.5 | -69.6 | 0 | 0 | 0 | 0 | 111.8 | T270 L271 M276 L277 N278 | T270-C274 WeakPolarHBondContact O-CB 3.31Å; T270-C274 PolarHBondContact O-N 2.93Å; T270-C274 PolarHBondContact O-SG 3.03Å; L271-C274 PolarHBondContact O-N 3.14Å; C274-M276 VanDerWaalsContact C-N 3.3Å; C274-M276 PolarHBondContact O-N 3.41Å; C274-L277 PolarHBondContact O-N 3.44Å; C274-N278 WeakPolarHBondContact O-CB 3.45Å; C274-N278 PolarHBondContact O-N 3.42Å |
| 275 | E | 78.4 | Confident | 73.4 | Confident | 46 Ų | 46 | 87.1 Ų | 87.1 | 22% | 0.215 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -60.6 | -41 | 178 | -176.5 | 61.5 | -162.4 | 0 | 0 | 111.6 | L271 M272 R279 | L271-E275 WeakPolarHBondContact O-CB 3.18Å; L271-E275 PolarHBondContact O-N 3.29Å; M272-E275 PolarHBondContact O-N 3.26Å; E275-R279 WeakPolarHBondContact O-CG 3.3Å; E275-R279 PolarHBondContact O-N 2.93Å; E275-R279 VanDerWaalsContact O-N 3.15Å; E275-R279 IonicContact OE1-CZ 3.95Å; E275-R279 IonicContact OE1-NE 2.74Å; E275-R279 PolarHBondContact OE1-NE 3.45Å; E275-R279 IonicContact OE1-NH2 2.86Å; E275-R279 PolarHBondContact OE1-NH2 2.88Å |
| 276 | M | 70 | Confident | 71.9 | Confident | 36 Ų | 36 | 93.3 Ų | 93.3 | 18% | 0.177 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -66.6 | -39 | 175.8 | -71.6 | -176.6 | 68.6 | 0 | 0 | 112.9 | V181 M272 T273 C274 R280 L292 R296 | V181-M276 HydrophobicContact CG1-CG 3.66Å; V181-M276 HydrophobicContact CG1-SD 4.22Å; M272-M276 HydrophobicContact CE-SD 3.66Å; M272-M276 HydrophobicContact CG-SD 4.31Å; M272-M276 VanDerWaalsContact O-CG 3.28Å; M272-M276 WeakPolarHBondContact O-CG 3.31Å; M272-M276 PolarHBondContact O-N 2.89Å; T273-M276 PolarHBondContact O-N 3.12Å; C274-M276 VanDerWaalsContact C-N 3.3Å; C274-M276 PolarHBondContact O-N 3.41Å; M276-R280 PolarHBondContact O-N 3.43Å; M276-R280 VanDerWaalsContact O-N 3.17Å; M276-L292 HydrophobicContact CE-CB 4.12Å; M276-L292 HydrophobicContact CE-CD2 4.23Å; M276-R296 HydrophobicContact CE-CB 4.3Å |
| 277 | L | 72.6 | Confident | 70.1 | Confident | 97 Ų | 97 | 94.9 Ų | 94.9 | 51% | 0.508 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -69.5 | -41.3 | 177.5 | -73.3 | 172.6 | 0 | 0 | 0 | 111.8 | T273 C274 R279 R280 | T273-L277 HydrophobicContact CG2-CD1 4.11Å; T273-L277 HydrophobicContact CG2-CG 4.5Å; T273-L277 VanDerWaalsContact O-CG 3.32Å; T273-L277 WeakPolarHBondContact O-CG 3.28Å; T273-L277 PolarHBondContact O-N 2.92Å; C274-L277 PolarHBondContact O-N 3.44Å; L277-R279 VanDerWaalsContact C-N 3.3Å; L277-R279 PolarHBondContact O-N 3.28Å; L277-R280 WeakPolarHBondContact O-CB 3.27Å; L277-R280 PolarHBondContact O-N 2.67Å; L277-R280 VanDerWaalsContact O-N 3.11Å |
| 278 | N | 72.6 | Confident | 68.4 | Low | 114 Ų | 114 | 92.2 Ų | 92.2 | 61% | 0.61 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.4 | -39.8 | 178 | -161.9 | 22.4 | 0 | 0 | 0 | 111.2 | C274 R280 N281 | C274-N278 WeakPolarHBondContact O-CB 3.45Å; C274-N278 PolarHBondContact O-N 3.42Å; N278-R280 VanDerWaalsContact C-N 3.33Å; N278-R280 PolarHBondContact O-N 2.93Å; N278-N281 PolarHBondContact O-N 2.7Å |
| 279 | R | 64.9 | Low | 66.9 | Low | 111 Ų | 111 | 93.6 Ų | 93.6 | 42% | 0.419 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -71.6 | -22.7 | 175.4 | -69.2 | -176.6 | -172.7 | -105.5 | -1.9 | 114 | E275 L277 N281 S282 | E275-R279 WeakPolarHBondContact O-CG 3.3Å; E275-R279 PolarHBondContact O-N 2.93Å; E275-R279 VanDerWaalsContact O-N 3.15Å; E275-R279 IonicContact OE1-CZ 3.95Å; E275-R279 IonicContact OE1-NE 2.74Å; E275-R279 PolarHBondContact OE1-NE 3.45Å; E275-R279 IonicContact OE1-NH2 2.86Å; E275-R279 PolarHBondContact OE1-NH2 2.88Å; L277-R279 VanDerWaalsContact C-N 3.3Å; L277-R279 PolarHBondContact O-N 3.28Å; R279-N281 VanDerWaalsContact C-N 3.27Å; R279-N281 PolarHBondContact O-N 3.21Å; R279-S282 PolarHBondContact O-N 2.83Å |
| 280 | R | 60.2 | Low | 65.6 | Low | 206 Ų | 206 | 95.1 Ų | 95.1 | 78% | 0.777 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -67.7 | -26.3 | 174 | -174.7 | 179.2 | 174.6 | 174.6 | -1.8 | 112.6 | M276 L277 N278 S282 | M276-R280 PolarHBondContact O-N 3.43Å; M276-R280 VanDerWaalsContact O-N 3.17Å; L277-R280 WeakPolarHBondContact O-CB 3.27Å; L277-R280 PolarHBondContact O-N 2.67Å; L277-R280 VanDerWaalsContact O-N 3.11Å; N278-R280 VanDerWaalsContact C-N 3.33Å; N278-R280 PolarHBondContact O-N 2.93Å; R280-S282 VanDerWaalsContact C-N 3.34Å |
| 281 | N | 56 | Low | 64.5 | Low | 147 Ų | 147 | 97 Ų | 97 | 79% | 0.786 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | -10.9 | 175.5 | -81.9 | -12.7 | 0 | 0 | 0 | 113.7 | N278 R279 | N278-N281 PolarHBondContact O-N 2.7Å; R279-N281 VanDerWaalsContact C-N 3.27Å; R279-N281 PolarHBondContact O-N 3.21Å |
| 282 | S | 56.1 | Low | 63.3 | Low | 84 Ų | 84 | 95.2 Ų | 95.2 | 59% | 0.587 | 49% | 0.488 | S | S | * | . | S | Bend | trans | -92.5 | 137.3 | 171.7 | -165.1 | 0 | 0 | 0 | 0 | 110.1 | R279 R280 L284 | R279-S282 PolarHBondContact O-N 2.83Å; R280-S282 VanDerWaalsContact C-N 3.34Å; S282-L284 PolarHBondContact O-N 2.69Å |
| 283 | N | 51.8 | Low | 62.6 | Low | 130 Ų | 130 | 100.2 Ų | 100.2 | 70% | 0.695 | 51% | 0.509 | S | S | * | . | S | Bend | trans | -68.8 | 41.6 | -168.8 | -87.5 | -29.3 | 0 | 0 | 0 | 116.3 | R285 | N283-R285 PolarHBondContact O-N 3.2Å; N283-R285 PolarHBondContact OD1-NE 2.93Å; N283-R285 PolarHBondContact OD1-NH2 3.05Å |
| 284 | L | 56.3 | Low | 61.8 | Low | 114 Ų | 114 | 103.9 Ų | 103.9 | 60% | 0.597 | 52% | 0.523 | S | S | * | . | trans | -98.9 | 69.4 | 175.3 | -162.6 | 58.2 | 0 | 0 | 0 | 110.7 | S282 L288 | S282-L284 PolarHBondContact O-N 2.69Å; L284-L288 HydrophobicContact CB-CD2 4.37Å; L284-L288 HydrophobicContact CD2-CD2 4.08Å; L284-L288 HydrophobicContact CG-CD2 4.34Å | ||
| 285 | R | 58.1 | Low | 61 | Low | 195 Ų | 195 | 103.9 Ų | 103.9 | 74% | 0.736 | 51% | 0.513 | S | S | * | . | trans | -81.1 | 138.8 | -170.9 | -62 | -176.2 | -172.6 | -173.3 | 2.4 | 111.4 | N283 | N283-R285 PolarHBondContact O-N 3.2Å; N283-R285 PolarHBondContact OD1-NE 2.93Å; N283-R285 PolarHBondContact OD1-NH2 3.05Å | ||
| 286 | I | 53.5 | Low | 60.3 | Low | 141 Ų | 141 | 108.6 Ų | 108.6 | 72% | 0.723 | 53% | 0.529 | S | S | * | . | S | Bend | trans | 94.7 | -66.1 | 159.7 | -50.6 | 152.2 | 0 | 0 | 0 | 116.7 | L288 S289 | I286-L288 PolarHBondContact O-N 3.17Å; I286-S289 WeakPolarHBondContact O-CB 3.42Å; I286-S289 PolarHBondContact O-N 2.76Å; I286-S289 PolarHBondContact O-OG 2.96Å |
| 287 | A | 51.3 | Low | 60.2 | Low | 85 Ų | 85 | 111.3 Ų | 111.3 | 70% | 0.702 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -70.8 | -31.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | S289 | A287-S289 PolarHBondContact O-N 2.88Å |
| 288 | L | 53.9 | Low | 59.8 | Low | 36 Ų | 36 | 109.4 Ų | 109.4 | 19% | 0.188 | 53% | 0.533 | C | S | . | . | H | α-helix | trans | -68.1 | -22.4 | 174.7 | -170 | 67.4 | 0 | 0 | 0 | 112.1 | L284 I286 L292 | L284-L288 HydrophobicContact CB-CD2 4.37Å; L284-L288 HydrophobicContact CD2-CD2 4.08Å; L284-L288 HydrophobicContact CG-CD2 4.34Å; I286-L288 PolarHBondContact O-N 3.17Å; L288-L292 HydrophobicContact CD1-CD1 4.47Å; L288-L292 HydrophobicContact CD1-CG 4.3Å; L288-L292 HydrophobicContact CD2-CD1 3.79Å; L288-L292 HydrophobicContact CD2-CG 4.48Å; L288-L292 HydrophobicContact CG-CD1 3.6Å; L288-L292 HydrophobicContact CG-CG 3.87Å; L288-L292 VanDerWaalsContact O-CB 3.28Å; L288-L292 WeakPolarHBondContact O-CB 3.32Å; L288-L292 WeakPolarHBondContact O-CG 3.33Å; L288-L292 PolarHBondContact O-N 2.92Å |
| 289 | S | 56.2 | Low | 59.5 | Low | 61 Ų | 61 | 104.2 Ų | 104.2 | 43% | 0.427 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.2 | -38.7 | -173.2 | 75 | 0 | 0 | 0 | 0 | 113.3 | I286 A287 K293 | I286-S289 WeakPolarHBondContact O-CB 3.42Å; I286-S289 PolarHBondContact O-N 2.76Å; I286-S289 PolarHBondContact O-OG 2.96Å; A287-S289 PolarHBondContact O-N 2.88Å; S289-K293 WeakPolarHBondContact O-CB 3.2Å; S289-K293 PolarHBondContact O-N 2.96Å |
| 290 | E | 56.5 | Low | 59.8 | Low | 108 Ų | 108 | 102.8 Ų | 102.8 | 51% | 0.505 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -73.6 | -38.6 | 179.4 | -79.2 | -64.7 | 139.3 | 0 | 0 | 112.1 | K293 Q294 | E290-K293 PolarHBondContact O-N 3.48Å; E290-K293 IonicContact OE1-NZ 2.89Å; E290-K293 PolarHBondContact OE1-NZ 2.85Å; E290-K293 IonicContact OE2-NZ 3.98Å; E290-Q294 PolarHBondContact O-N 3.29Å |
| 291 | H | 60.2 | Low | 60.2 | Low | 122 Ų | 122 | 93.7 Ų | 93.7 | 57% | 0.565 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -67.8 | -38.6 | 172.2 | -81.4 | -71.8 | 0 | 0 | 0 | 112.6 | R295 | H291-R295 VanDerWaalsContact O-CG 3.26Å; H291-R295 WeakPolarHBondContact O-CG 3.46Å; H291-R295 PolarHBondContact O-N 3.31Å |
| 292 | L | 61.6 | Low | 61 | Low | 36 Ų | 36 | 87.5 Ų | 87.5 | 19% | 0.188 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -68.9 | -33.5 | 173.3 | -72.9 | 177.2 | 0 | 0 | 0 | 112.2 | M276 L288 R295 R296 | M276-L292 HydrophobicContact CE-CB 4.12Å; M276-L292 HydrophobicContact CE-CD2 4.23Å; L288-L292 HydrophobicContact CD1-CD1 4.47Å; L288-L292 HydrophobicContact CD1-CG 4.3Å; L288-L292 HydrophobicContact CD2-CD1 3.79Å; L288-L292 HydrophobicContact CD2-CG 4.48Å; L288-L292 HydrophobicContact CG-CD1 3.6Å; L288-L292 HydrophobicContact CG-CG 3.87Å; L288-L292 VanDerWaalsContact O-CB 3.28Å; L288-L292 WeakPolarHBondContact O-CB 3.32Å; L288-L292 WeakPolarHBondContact O-CG 3.33Å; L288-L292 PolarHBondContact O-N 2.92Å; L292-R295 PolarHBondContact O-N 3.41Å; L292-R296 WeakPolarHBondContact O-CB 3.31Å; L292-R296 PolarHBondContact O-N 2.96Å |
| 293 | K | 64.2 | Low | 61.9 | Low | 113 Ų | 113 | 88.4 Ų | 88.4 | 49% | 0.491 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -66.5 | -45.2 | 174.8 | -174.6 | 178.9 | 174.5 | -171.4 | 0 | 111.3 | S289 E290 R295 R296 E297 | S289-K293 WeakPolarHBondContact O-CB 3.2Å; S289-K293 PolarHBondContact O-N 2.96Å; E290-K293 PolarHBondContact O-N 3.48Å; E290-K293 IonicContact OE1-NZ 2.89Å; E290-K293 PolarHBondContact OE1-NZ 2.85Å; E290-K293 IonicContact OE2-NZ 3.98Å; K293-R295 VanDerWaalsContact C-N 3.33Å; K293-R295 PolarHBondContact O-N 3.45Å; K293-R296 WeakPolarHBondContact O-CB 3.18Å; K293-R296 PolarHBondContact O-N 3.35Å; K293-E297 WeakPolarHBondContact O-CG 3.29Å; K293-E297 PolarHBondContact O-N 3.26Å |
| 294 | Q | 61.8 | Low | 63.2 | Low | 131 Ų | 131 | 85 Ų | 85 | 61% | 0.612 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -57.9 | -43.5 | 169.7 | -90.4 | -174.2 | -28.8 | 0 | 0 | 112.2 | E290 R296 E297 V298 | E290-Q294 PolarHBondContact O-N 3.29Å; Q294-R296 VanDerWaalsContact C-N 3.33Å; Q294-R296 PolarHBondContact O-N 2.9Å; Q294-E297 PolarHBondContact O-N 3.48Å; Q294-V298 VanDerWaalsContact O-CG2 3.29Å; Q294-V298 WeakPolarHBondContact O-CG2 3.41Å; Q294-V298 PolarHBondContact O-N 3.43Å; Q294-V298 VanDerWaalsContact O-N 3.12Å |
| 295 | R | 64.1 | Low | 64.4 | Low | 68 Ų | 68 | 80 Ų | 80 | 26% | 0.257 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -64.4 | -35.4 | 176.6 | -71.5 | 172.7 | -178.1 | -150.6 | -6.2 | 112.5 | A180 V181 H291 L292 K293 V298 A299 | A180-R295 VanDerWaalsContact O-CZ 3.22Å; A180-R295 PolarHBondContact O-NH1 3.3Å; V181-R295 HydrophobicContact CG2-CB 4.18Å; V181-R295 HydrophobicContact CG2-CG 4.5Å; H291-R295 VanDerWaalsContact O-CG 3.26Å; H291-R295 WeakPolarHBondContact O-CG 3.46Å; H291-R295 PolarHBondContact O-N 3.31Å; L292-R295 PolarHBondContact O-N 3.41Å; K293-R295 VanDerWaalsContact C-N 3.33Å; K293-R295 PolarHBondContact O-N 3.45Å; R295-V298 PolarHBondContact O-N 3.01Å; R295-A299 PolarHBondContact O-N 2.93Å |
| 296 | R | 64.6 | Low | 65.5 | Low | 146 Ų | 146 | 71.2 Ų | 71.2 | 55% | 0.551 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -66 | -44.5 | 174.8 | -170.7 | -180 | -177.3 | -173.4 | 0.3 | 112 | M276 L292 K293 Q294 V298 A299 K300 | M276-R296 HydrophobicContact CE-CB 4.3Å; L292-R296 WeakPolarHBondContact O-CB 3.31Å; L292-R296 PolarHBondContact O-N 2.96Å; K293-R296 WeakPolarHBondContact O-CB 3.18Å; K293-R296 PolarHBondContact O-N 3.35Å; Q294-R296 VanDerWaalsContact C-N 3.33Å; Q294-R296 PolarHBondContact O-N 2.9Å; R296-V298 VanDerWaalsContact C-N 3.28Å; R296-V298 PolarHBondContact O-N 3.3Å; R296-A299 PolarHBondContact O-N 3.34Å; R296-K300 WeakPolarHBondContact O-CG 3.32Å; R296-K300 PolarHBondContact O-N 3.1Å |
| 297 | E | 67.4 | Low | 67 | Low | 92 Ų | 92 | 67.3 Ų | 67.3 | 43% | 0.43 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.2 | -40.8 | 176.5 | -68 | -52.8 | 126.5 | 0 | 0 | 111.3 | K293 Q294 A299 K300 T301 | K293-E297 WeakPolarHBondContact O-CG 3.29Å; K293-E297 PolarHBondContact O-N 3.26Å; Q294-E297 PolarHBondContact O-N 3.48Å; E297-A299 VanDerWaalsContact C-N 3.35Å; E297-A299 PolarHBondContact O-N 3.25Å; E297-K300 PolarHBondContact O-N 2.99Å; E297-K300 IonicContact OE1-NZ 2.73Å; E297-K300 PolarHBondContact OE1-NZ 3.29Å; E297-K300 IonicContact OE2-NZ 3.15Å; E297-T301 PolarHBondContact O-N 3.36Å; E297-T301 VanDerWaalsContact O-N 3.08Å; E297-T301 PolarHBondContact O-OG1 2.98Å |
| 298 | V | 64.9 | Low | 68.8 | Low | 58 Ų | 58 | 64.7 Ų | 64.7 | 35% | 0.352 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -68.9 | -29.8 | 176.9 | 176.7 | 0 | 0 | 0 | 0 | 112.8 | R177 Q294 R295 R296 T301 | R177-V298 VanDerWaalsContact NH1-CG1 3.3Å; Q294-V298 VanDerWaalsContact O-CG2 3.29Å; Q294-V298 WeakPolarHBondContact O-CG2 3.41Å; Q294-V298 PolarHBondContact O-N 3.43Å; Q294-V298 VanDerWaalsContact O-N 3.12Å; R295-V298 PolarHBondContact O-N 3.01Å; R296-V298 VanDerWaalsContact C-N 3.28Å; R296-V298 PolarHBondContact O-N 3.3Å; V298-T301 VanDerWaalsContact CA-OG1 3.26Å; V298-T301 WeakPolarHBondContact CA-OG1 3.29Å; V298-T301 WeakPolarHBondContact O-CB 3.48Å; V298-T301 PolarHBondContact O-OG1 3.15Å; V298-T301 VanDerWaalsContact O-OG1 3.04Å |
| 299 | A | 66.6 | Low | 70.4 | Confident | 5 Ų | 5 | 63.1 Ų | 63.1 | 4% | 0.041 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -80.6 | -36.3 | 174 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y269 M272 R295 R296 E297 T301 V302 F303 | Y269-A299 HydrophobicContact CE2-CB 4.35Å; M272-A299 HydrophobicContact CE-CB 3.19Å; M272-A299 HydrophobicContact SD-CB 3.37Å; M272-A299 WeakPolarHBondContact SD-CB 3.13Å; R295-A299 PolarHBondContact O-N 2.93Å; R296-A299 PolarHBondContact O-N 3.34Å; E297-A299 VanDerWaalsContact C-N 3.35Å; E297-A299 PolarHBondContact O-N 3.25Å; A299-T301 PolarHBondContact O-N 3.2Å; A299-V302 PolarHBondContact O-N 3.4Å; A299-V302 VanDerWaalsContact O-N 3.08Å; A299-F303 PolarHBondContact O-N 3.04Å |
| 300 | K | 70.8 | Confident | 72.1 | Confident | 81 Ų | 81 | 61.2 Ų | 61.2 | 35% | 0.352 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -56.3 | -33.9 | 168.2 | -74.6 | 174.3 | 179.7 | 173.6 | 0 | 111.3 | R296 E297 C304 | R296-K300 WeakPolarHBondContact O-CG 3.32Å; R296-K300 PolarHBondContact O-N 3.1Å; E297-K300 PolarHBondContact O-N 2.99Å; E297-K300 IonicContact OE1-NZ 2.73Å; E297-K300 PolarHBondContact OE1-NZ 3.29Å; E297-K300 IonicContact OE2-NZ 3.15Å; K300-C304 VanDerWaalsContact O-CB 3.23Å; K300-C304 WeakPolarHBondContact O-CB 3.42Å; K300-C304 PolarHBondContact O-N 3.2Å |
| 301 | T | 69.5 | Low | 73.8 | Confident | 14 Ų | 14 | 61.6 Ų | 61.6 | 9% | 0.086 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -56.6 | -53.4 | 172.5 | -39.8 | 0 | 0 | 0 | 0 | 111.5 | E297 V298 A299 F303 C304 L305 V366 | E297-T301 PolarHBondContact O-N 3.36Å; E297-T301 VanDerWaalsContact O-N 3.08Å; E297-T301 PolarHBondContact O-OG1 2.98Å; V298-T301 VanDerWaalsContact CA-OG1 3.26Å; V298-T301 WeakPolarHBondContact CA-OG1 3.29Å; V298-T301 WeakPolarHBondContact O-CB 3.48Å; V298-T301 PolarHBondContact O-OG1 3.15Å; V298-T301 VanDerWaalsContact O-OG1 3.04Å; A299-T301 PolarHBondContact O-N 3.2Å; T301-F303 VanDerWaalsContact C-N 3.34Å; T301-C304 WeakPolarHBondContact O-CB 3.42Å; T301-C304 PolarHBondContact O-N 2.98Å; T301-L305 HydrophobicContact CG2-CD1 4.2Å; T301-L305 WeakPolarHBondContact O-CG 3.29Å; T301-L305 PolarHBondContact O-N 3.25Å; T301-V366 VanDerWaalsContact CB-CG1 3.49Å; T301-V366 HydrophobicContact CG2-CB 3.88Å; T301-V366 HydrophobicContact CG2-CG1 3.36Å; T301-V366 HydrophobicContact CG2-CG2 3.95Å; T301-V366 WeakPolarHBondContact OG1-CG1 3.45Å |
| 302 | V | 70.9 | Confident | 75.4 | Confident | 17 Ų | 17 | 56 Ų | 56 | 10% | 0.103 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -68.2 | -40.2 | -174.7 | 176.3 | 0 | 0 | 0 | 0 | 109.6 | S174 R177 A299 C304 L305 V306 | S174-V302 WeakPolarHBondContact OG-CG1 3.1Å; R177-V302 HydrophobicContact CG-CB 4.34Å; R177-V302 HydrophobicContact CG-CG2 3.54Å; A299-V302 PolarHBondContact O-N 3.4Å; A299-V302 VanDerWaalsContact O-N 3.08Å; V302-C304 VanDerWaalsContact C-N 3.35Å; V302-C304 PolarHBondContact O-N 2.79Å; V302-L305 PolarHBondContact O-N 3.41Å; V302-V306 WeakPolarHBondContact O-CG2 3.32Å; V302-V306 PolarHBondContact O-N 3.47Å |
| 303 | F | 75.9 | Confident | 76.9 | Confident | 104 Ų | 104 | 54.6 Ų | 54.6 | 46% | 0.456 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -58.5 | -45.2 | 171.1 | -177 | -97.5 | 0 | 0 | 0 | 112.2 | Y269 A299 T301 V306 V307 | Y269-F303 HydrophobicContact CD1-CD2 4.21Å; Y269-F303 HydrophobicContact CD2-CB 4.2Å; Y269-F303 HydrophobicContact CE1-CD2 4.26Å; Y269-F303 HydrophobicContact CE2-CB 3.98Å; Y269-F303 HydrophobicContact CE2-CG 4.45Å; Y269-F303 HydrophobicContact CG-CD2 4.33Å; A299-F303 PolarHBondContact O-N 3.04Å; T301-F303 VanDerWaalsContact C-N 3.34Å; F303-V306 PolarHBondContact O-N 3.04Å; F303-V307 HydrophobicContact CD1-CG2 4.11Å; F303-V307 HydrophobicContact CE1-CG2 3.67Å; F303-V307 HydrophobicContact CE2-CG2 4.37Å; F303-V307 HydrophobicContact CZ-CG2 3.81Å; F303-V307 WeakPolarHBondContact O-CG2 3.25Å; F303-V307 PolarHBondContact O-N 3.4Å |
| 304 | C | 80.1 | Confident | 78.3 | Confident | 58 Ų | 58 | 53.8 Ų | 53.8 | 39% | 0.392 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.1 | -44.9 | 176.8 | -176.4 | 0 | 0 | 0 | 0 | 112 | K300 T301 V302 V306 V307 I308 | K300-C304 VanDerWaalsContact O-CB 3.23Å; K300-C304 WeakPolarHBondContact O-CB 3.42Å; K300-C304 PolarHBondContact O-N 3.2Å; T301-C304 WeakPolarHBondContact O-CB 3.42Å; T301-C304 PolarHBondContact O-N 2.98Å; V302-C304 VanDerWaalsContact C-N 3.35Å; V302-C304 PolarHBondContact O-N 2.79Å; C304-V306 VanDerWaalsContact C-N 3.27Å; C304-V306 PolarHBondContact O-N 3.34Å; C304-V307 PolarHBondContact O-N 3.49Å; C304-I308 WeakPolarHBondContact O-CB 3.34Å; C304-I308 WeakPolarHBondContact O-CD1 3.29Å; C304-I308 VanDerWaalsContact O-CG1 3.24Å; C304-I308 WeakPolarHBondContact O-CG1 3.27Å; C304-I308 PolarHBondContact O-N 2.99Å |
| 305 | L | 79.6 | Confident | 79.8 | Confident | 10 Ų | 10 | 49.2 Ų | 49.2 | 5% | 0.052 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -57.4 | -40 | 174.9 | -72.7 | 172.5 | 0 | 0 | 0 | 112 | T301 V302 F309 A362 | T301-L305 HydrophobicContact CG2-CD1 4.2Å; T301-L305 WeakPolarHBondContact O-CG 3.29Å; T301-L305 PolarHBondContact O-N 3.25Å; V302-L305 PolarHBondContact O-N 3.41Å; L305-F309 WeakPolarHBondContact O-CB 3.3Å; L305-F309 PolarHBondContact O-N 3.01Å; L305-A362 HydrophobicContact CD2-CB 3.42Å; L305-A362 VanDerWaalsContact CD2-CB 3.42Å; L305-A362 HydrophobicContact CG-CB 4.38Å |
| 306 | V | 81.9 | Confident | 81.2 | Confident | 10 Ų | 10 | 46.1 Ų | 46.1 | 6% | 0.061 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -71.6 | -40.9 | 179 | 172 | 0 | 0 | 0 | 0 | 112.1 | L262 T265 V302 F303 C304 I308 F309 A310 | L262-V306 HydrophobicContact CD2-CG1 3.62Å; T265-V306 HydrophobicContact CG2-CB 4.37Å; T265-V306 HydrophobicContact CG2-CG1 4.16Å; T265-V306 HydrophobicContact CG2-CG2 3.29Å; T265-V306 VanDerWaalsContact OG1-CG1 3.24Å; T265-V306 WeakPolarHBondContact OG1-CG1 3.42Å; V302-V306 WeakPolarHBondContact O-CG2 3.32Å; V302-V306 PolarHBondContact O-N 3.47Å; F303-V306 PolarHBondContact O-N 3.04Å; C304-V306 VanDerWaalsContact C-N 3.27Å; C304-V306 PolarHBondContact O-N 3.34Å; V306-I308 VanDerWaalsContact C-N 3.3Å; V306-F309 WeakPolarHBondContact O-CB 3.48Å; V306-F309 PolarHBondContact O-N 3.49Å; V306-A310 PolarHBondContact O-N 2.86Å |
| 307 | V | 85.9 | Confident | 82.5 | Confident | 58 Ų | 58 | 39.6 Ų | 39.6 | 35% | 0.352 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -62.5 | -43.2 | 174.8 | 169.9 | 0 | 0 | 0 | 0 | 110.1 | F303 C304 F309 A310 L311 | F303-V307 HydrophobicContact CD1-CG2 4.11Å; F303-V307 HydrophobicContact CE1-CG2 3.67Å; F303-V307 HydrophobicContact CE2-CG2 4.37Å; F303-V307 HydrophobicContact CZ-CG2 3.81Å; F303-V307 WeakPolarHBondContact O-CG2 3.25Å; F303-V307 PolarHBondContact O-N 3.4Å; C304-V307 PolarHBondContact O-N 3.49Å; V307-F309 VanDerWaalsContact C-N 3.34Å; V307-A310 WeakPolarHBondContact O-CB 3.15Å; V307-A310 PolarHBondContact O-N 3.17Å; V307-L311 HydrophobicContact CG1-CD1 4.05Å; V307-L311 HydrophobicContact CG1-CG 4.43Å; V307-L311 VanDerWaalsContact O-CG 3.32Å; V307-L311 WeakPolarHBondContact O-CG 3.22Å; V307-L311 PolarHBondContact O-N 3.48Å |
| 308 | I | 87.8 | Confident | 83.6 | Confident | 31 Ų | 31 | 38.7 Ų | 38.7 | 16% | 0.159 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.6 | -45.5 | 175.5 | -70.1 | 165.5 | 0 | 0 | 0 | 110.4 | C304 V306 A310 L311 C312 I358 | C304-I308 WeakPolarHBondContact O-CB 3.34Å; C304-I308 WeakPolarHBondContact O-CD1 3.29Å; C304-I308 VanDerWaalsContact O-CG1 3.24Å; C304-I308 WeakPolarHBondContact O-CG1 3.27Å; C304-I308 PolarHBondContact O-N 2.99Å; V306-I308 VanDerWaalsContact C-N 3.3Å; I308-A310 VanDerWaalsContact C-N 3.32Å; I308-A310 PolarHBondContact O-N 3.15Å; I308-L311 PolarHBondContact O-N 3.25Å; I308-C312 WeakPolarHBondContact O-CB 3.26Å; I308-C312 PolarHBondContact O-N 2.9Å; I308-C312 PolarHBondContact O-SG 3.47Å; I308-I358 HydrophobicContact CD1-CG2 3.78Å; I308-I358 HydrophobicContact CG2-CB 4Å; I308-I358 HydrophobicContact CG2-CD1 3.54Å; I308-I358 HydrophobicContact CG2-CG1 4.37Å; I308-I358 HydrophobicContact CG2-CG2 3.67Å |
| 309 | F | 88.6 | Confident | 84.8 | Confident | 2 Ų | 2 | 36.2 Ų | 36.2 | 1% | 0.009 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -54.9 | -48.2 | 173 | 170.5 | -92 | 0 | 0 | 0 | 111.4 | V167 L170 Y257 F258 P261 L262 L305 V306 V307 L311 C312 W313 N355 | V167-F309 HydrophobicContact CG1-CE2 3.73Å; V167-F309 HydrophobicContact CG1-CZ 3.65Å; L170-F309 HydrophobicContact CD1-CB 4.15Å; L170-F309 HydrophobicContact CD1-CD2 3.79Å; L170-F309 HydrophobicContact CD1-CE2 4.42Å; L170-F309 HydrophobicContact CD1-CG 3.92Å; Y257-F309 VanDerWaalsContact O-CZ 3.31Å; Y257-F309 WeakPolarHBondContact O-CZ 3.41Å; F258-F309 HydrophobicContact CD2-CE1 4.27Å; P261-F309 HydrophobicContact CB-CE1 4.47Å; P261-F309 HydrophobicContact CG-CE1 3.8Å; P261-F309 HydrophobicContact CG-CZ 4.1Å; L262-F309 HydrophobicContact CD2-CD1 4.27Å; L305-F309 WeakPolarHBondContact O-CB 3.3Å; L305-F309 PolarHBondContact O-N 3.01Å; V306-F309 WeakPolarHBondContact O-CB 3.48Å; V306-F309 PolarHBondContact O-N 3.49Å; V307-F309 VanDerWaalsContact C-N 3.34Å; F309-L311 PolarHBondContact O-N 2.8Å; F309-C312 PolarHBondContact O-N 3.44Å; F309-W313 AromaticContact CD2-CD1 3.27Å; F309-W313 HydrophobicContact CD2-CG 4.04Å; F309-W313 AromaticContact CD2-NE1 3.53Å; F309-W313 HydrophobicContact CE2-CB 4.42Å; F309-W313 AromaticContact CE2-CD1 3.27Å; F309-W313 AromaticContact CE2-CD2 3.99Å; F309-W313 HydrophobicContact CE2-CD2 3.99Å; F309-W313 AromaticContact CE2-CE2 3.93Å; F309-W313 AromaticContact CE2-CG 3.63Å; F309-W313 HydrophobicContact CE2-CG 3.63Å; F309-W313 AromaticContact CE2-NE1 3.42Å; F309-W313 HydrophobicContact CZ-CB 4.31Å; F309-W313 AromaticContact CZ-CD1 3.99Å; F309-W313 HydrophobicContact CZ-CD2 4.4Å; F309-W313 AromaticContact CZ-CG 3.95Å; F309-W313 HydrophobicContact CZ-CG 3.95Å; F309-W313 WeakPolarHBondContact O-CB 3.43Å; F309-W313 VanDerWaalsContact O-CD1 3.25Å; F309-W313 PolarHBondContact O-N 3.27Å; F309-N355 VanDerWaalsContact CA-OD1 3.29Å; F309-N355 WeakPolarHBondContact CA-OD1 3.46Å |
| 310 | A | 90.8 | Very high | 85.9 | Confident | 21 Ų | 21 | 38.3 Ų | 38.3 | 17% | 0.174 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -57.8 | -50.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | L262 V306 V307 I308 C312 F314 | L262-A310 HydrophobicContact CD1-CB 4.34Å; L262-A310 HydrophobicContact CD2-CB 3.76Å; V306-A310 PolarHBondContact O-N 2.86Å; V307-A310 WeakPolarHBondContact O-CB 3.15Å; V307-A310 PolarHBondContact O-N 3.17Å; I308-A310 VanDerWaalsContact C-N 3.32Å; I308-A310 PolarHBondContact O-N 3.15Å; A310-C312 VanDerWaalsContact C-N 3.31Å; A310-C312 PolarHBondContact O-N 2.68Å; A310-F314 WeakPolarHBondContact O-CB 3.41Å; A310-F314 PolarHBondContact O-N 3.02Å |
| 311 | L | 92.3 | Very high | 86.9 | Confident | 117 Ų | 117 | 35.7 Ų | 35.7 | 61% | 0.613 | 19% | 0.189 | S | C | * | . | H | α-helix | trans | -64 | -37 | -179 | -67.9 | 174 | 0 | 0 | 0 | 112.3 | V307 I308 F309 P315 L351 | V307-L311 HydrophobicContact CG1-CD1 4.05Å; V307-L311 HydrophobicContact CG1-CG 4.43Å; V307-L311 VanDerWaalsContact O-CG 3.32Å; V307-L311 WeakPolarHBondContact O-CG 3.22Å; V307-L311 PolarHBondContact O-N 3.48Å; I308-L311 PolarHBondContact O-N 3.25Å; F309-L311 PolarHBondContact O-N 2.8Å; L311-P315 VanDerWaalsContact O-CD 3.22Å; L311-P315 WeakPolarHBondContact O-CD 3.45Å; L311-L351 WeakPolarHBondContact O-CD2 3.45Å |
| 312 | C | 93.3 | Very high | 87.7 | Confident | 5 Ų | 5 | 38.6 Ų | 38.6 | 3% | 0.034 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -75.6 | -39.6 | -178.4 | -67.9 | 0 | 0 | 0 | 0 | 112.8 | I308 F309 A310 L351 A352 N355 | I308-C312 WeakPolarHBondContact O-CB 3.26Å; I308-C312 PolarHBondContact O-N 2.9Å; I308-C312 PolarHBondContact O-SG 3.47Å; F309-C312 PolarHBondContact O-N 3.44Å; A310-C312 VanDerWaalsContact C-N 3.31Å; A310-C312 PolarHBondContact O-N 2.68Å; C312-L351 VanDerWaalsContact CB-O 3.32Å; C312-L351 WeakPolarHBondContact CB-O 3.25Å; C312-L351 CarbonylContact O-C 3.56Å; C312-A352 WeakPolarHBondContact O-CA 3.32Å; C312-A352 PolarHBondContact O-N 2.87Å; C312-N355 HydrophobicContact CB-CB 3.8Å |
| 313 | W | 93.3 | Very high | 88.5 | Confident | 5 Ų | 5 | 42.3 Ų | 42.3 | 2% | 0.019 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -90 | -25.9 | -174.8 | -76 | 81.6 | 0 | 0 | 0 | 113.7 | V163 F258 F309 L316 H317 A352 N355 | V163-W313 HydrophobicContact CB-CH2 4.04Å; V163-W313 HydrophobicContact CG1-CE3 4.38Å; V163-W313 HydrophobicContact CG1-CH2 3.4Å; V163-W313 VanDerWaalsContact CG1-CH2 3.4Å; V163-W313 HydrophobicContact CG1-CZ2 3.89Å; V163-W313 HydrophobicContact CG1-CZ3 3.64Å; V163-W313 HydrophobicContact CG2-CH2 3.31Å; V163-W313 HydrophobicContact CG2-CZ2 4.08Å; V163-W313 HydrophobicContact CG2-CZ3 4.04Å; F258-W313 HydrophobicContact CD2-CB 3.94Å; F258-W313 HydrophobicContact CE2-CB 4.21Å; F309-W313 AromaticContact CD2-CD1 3.27Å; F309-W313 HydrophobicContact CD2-CG 4.04Å; F309-W313 AromaticContact CD2-NE1 3.53Å; F309-W313 HydrophobicContact CE2-CB 4.42Å; F309-W313 AromaticContact CE2-CD1 3.27Å; F309-W313 AromaticContact CE2-CD2 3.99Å; F309-W313 HydrophobicContact CE2-CD2 3.99Å; F309-W313 AromaticContact CE2-CE2 3.93Å; F309-W313 AromaticContact CE2-CG 3.63Å; F309-W313 HydrophobicContact CE2-CG 3.63Å; F309-W313 AromaticContact CE2-NE1 3.42Å; F309-W313 HydrophobicContact CZ-CB 4.31Å; F309-W313 AromaticContact CZ-CD1 3.99Å; F309-W313 HydrophobicContact CZ-CD2 4.4Å; F309-W313 AromaticContact CZ-CG 3.95Å; F309-W313 HydrophobicContact CZ-CG 3.95Å; F309-W313 WeakPolarHBondContact O-CB 3.43Å; F309-W313 VanDerWaalsContact O-CD1 3.25Å; F309-W313 PolarHBondContact O-N 3.27Å; W313-L316 HydrophobicContact CE3-CD2 4.23Å; W313-L316 HydrophobicContact CZ3-CD2 4Å; W313-L316 WeakPolarHBondContact O-CB 3.35Å; W313-L316 PolarHBondContact O-N 3.11Å; W313-H317 AromaticContact CE3-NE2 3.82Å; W313-H317 PolarHBondContact O-CD2 2.87Å; W313-H317 VanDerWaalsContact O-CD2 3.27Å; W313-H317 PolarHBondContact O-N 3.2Å; W313-A352 HydrophobicContact CD2-CB 4.09Å; W313-A352 HydrophobicContact CE3-CB 4.19Å; W313-A352 HydrophobicContact CH2-CB 4.2Å; W313-A352 HydrophobicContact CZ2-CB 4.2Å; W313-A352 HydrophobicContact CZ3-CB 4.24Å; W313-N355 PolarHBondContact NE1-ND2 2.88Å |
| 314 | F | 93.7 | Very high | 89 | Confident | 97 Ų | 97 | 40.9 Ų | 40.9 | 43% | 0.425 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -57 | -47.3 | -176.2 | 174.8 | -103.7 | 0 | 0 | 0 | 113.4 | F258 A310 L316 H317 L318 | F258-F314 HydrophobicContact CE1-CD2 4.23Å; F258-F314 HydrophobicContact CE2-CB 3.87Å; F258-F314 HydrophobicContact CZ-CB 3.8Å; F258-F314 AromaticContact CZ-CD2 3.82Å; F258-F314 HydrophobicContact CZ-CD2 3.82Å; F258-F314 HydrophobicContact CZ-CG 4.31Å; A310-F314 WeakPolarHBondContact O-CB 3.41Å; A310-F314 PolarHBondContact O-N 3.02Å; F314-L316 PolarHBondContact O-N 3.37Å; F314-H317 PolarHBondContact O-N 3.11Å; F314-L318 HydrophobicContact CE1-CB 4.47Å; F314-L318 HydrophobicContact CE1-CD2 3.79Å; F314-L318 HydrophobicContact CZ-CB 4.39Å; F314-L318 HydrophobicContact CZ-CD2 3.96Å; F314-L318 VanDerWaalsContact O-CB 3.31Å; F314-L318 WeakPolarHBondContact O-CB 3.5Å; F314-L318 PolarHBondContact O-N 3.22Å |
| 315 | P | 93.6 | Very high | 89.3 | Confident | 35 Ų | 35 | 44.4 Ų | 44.4 | 23% | 0.227 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.9 | -35.2 | -180 | -29.4 | 41.6 | 0 | 0 | 0 | 113 | L311 L318 S319 S348 L351 | L311-P315 VanDerWaalsContact O-CD 3.22Å; L311-P315 WeakPolarHBondContact O-CD 3.45Å; P315-L318 PolarHBondContact O-N 2.8Å; P315-S319 VanDerWaalsContact O-CB 3.25Å; P315-S319 WeakPolarHBondContact O-CB 3.23Å; P315-S319 PolarHBondContact O-N 3.27Å; P315-S319 PolarHBondContact O-OG 2.02Å; P315-S348 WeakPolarHBondContact CB-OG 2.98Å; P315-S348 PolarHBondContact O-OG 2.88Å; P315-L351 HydrophobicContact CB-CD2 4.31Å; P315-L351 HydrophobicContact CG-CD2 3.56Å |
| 316 | L | 92.8 | Very high | 89.5 | Confident | 3 Ų | 3 | 47.7 Ų | 47.7 | 2% | 0.016 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -66.1 | -48.7 | 177.9 | -177.5 | 64 | 0 | 0 | 0 | 111.4 | W313 F314 S319 R320 I349 A352 | W313-L316 HydrophobicContact CE3-CD2 4.23Å; W313-L316 HydrophobicContact CZ3-CD2 4Å; W313-L316 WeakPolarHBondContact O-CB 3.35Å; W313-L316 PolarHBondContact O-N 3.11Å; F314-L316 PolarHBondContact O-N 3.37Å; L316-S319 PolarHBondContact O-N 2.84Å; L316-S319 PolarHBondContact O-OG 3.28Å; L316-R320 WeakPolarHBondContact O-CG 3.33Å; L316-R320 PolarHBondContact O-N 3.42Å; L316-I349 HydrophobicContact CD1-CG1 3.58Å; L316-A352 HydrophobicContact CB-CB 4.43Å; L316-A352 HydrophobicContact CD2-CB 3.85Å |
| 317 | H | 92.8 | Very high | 89.6 | Confident | 8 Ų | 8 | 51.1 Ų | 51.1 | 4% | 0.037 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.5 | -41.6 | 177.9 | -72.6 | -74.2 | 0 | 0 | 0 | 111.8 | L253 F254 F258 W313 F314 S319 R320 I321 | L253-H317 PolarHBondContact O-CE1 3.22Å; F254-H317 HydrophobicContact CD2-CB 3.78Å; F254-H317 HydrophobicContact CE2-CB 4.45Å; F258-H317 AromaticContact CD2-CD2 3.83Å; F258-H317 AromaticContact CG-CD2 3.94Å; W313-H317 AromaticContact CE3-NE2 3.82Å; W313-H317 PolarHBondContact O-CD2 2.87Å; W313-H317 VanDerWaalsContact O-CD2 3.27Å; W313-H317 PolarHBondContact O-N 3.2Å; F314-H317 PolarHBondContact O-N 3.11Å; H317-S319 PolarHBondContact O-N 3.2Å; H317-R320 PolarHBondContact O-N 3.23Å; H317-I321 VanDerWaalsContact O-CG1 3.32Å; H317-I321 WeakPolarHBondContact O-CG1 3.31Å; H317-I321 PolarHBondContact O-N 3.24Å |
| 318 | L | 91.1 | Very high | 89.3 | Confident | 73 Ų | 73 | 52.6 Ų | 52.6 | 38% | 0.382 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60 | -48.1 | 177.1 | -179.3 | 62.6 | 0 | 0 | 0 | 111.2 | F314 P315 R320 I321 L322 | F314-L318 HydrophobicContact CE1-CB 4.47Å; F314-L318 HydrophobicContact CE1-CD2 3.79Å; F314-L318 HydrophobicContact CZ-CB 4.39Å; F314-L318 HydrophobicContact CZ-CD2 3.96Å; F314-L318 VanDerWaalsContact O-CB 3.31Å; F314-L318 WeakPolarHBondContact O-CB 3.5Å; F314-L318 PolarHBondContact O-N 3.22Å; P315-L318 PolarHBondContact O-N 2.8Å; L318-R320 VanDerWaalsContact C-N 3.32Å; L318-R320 PolarHBondContact O-N 2.9Å; L318-I321 PolarHBondContact O-N 3.24Å; L318-L322 HydrophobicContact CD1-CD1 3.99Å; L318-L322 HydrophobicContact CD1-CG 3.98Å; L318-L322 HydrophobicContact CD2-CD1 4.42Å; L318-L322 HydrophobicContact CG-CD1 3.79Å; L318-L322 HydrophobicContact CG-CG 4.22Å; L318-L322 WeakPolarHBondContact O-CB 3.34Å; L318-L322 VanDerWaalsContact O-CG 3.27Å; L318-L322 WeakPolarHBondContact O-CG 3.31Å; L318-L322 PolarHBondContact O-N 3.21Å |
| 319 | S | 89.6 | Confident | 88.8 | Confident | 6 Ų | 6 | 57.5 Ų | 57.5 | 4% | 0.042 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.1 | -40.7 | -179.7 | 71.5 | 0 | 0 | 0 | 0 | 112.9 | P315 L316 H317 K323 | P315-S319 VanDerWaalsContact O-CB 3.25Å; P315-S319 WeakPolarHBondContact O-CB 3.23Å; P315-S319 PolarHBondContact O-N 3.27Å; P315-S319 PolarHBondContact O-OG 2.02Å; L316-S319 PolarHBondContact O-N 2.84Å; L316-S319 PolarHBondContact O-OG 3.28Å; H317-S319 PolarHBondContact O-N 3.2Å; S319-K323 VanDerWaalsContact O-CB 3.31Å; S319-K323 WeakPolarHBondContact O-CB 3.38Å; S319-K323 PolarHBondContact O-N 3.1Å |
| 320 | R | 90.3 | Very high | 88.2 | Confident | 50 Ų | 50 | 67.5 Ų | 67.5 | 19% | 0.189 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -70.2 | -43.6 | 178.6 | -70.2 | -176.1 | 179.5 | 161.8 | 3.3 | 112.3 | L316 H317 L318 K323 K324 | L316-R320 WeakPolarHBondContact O-CG 3.33Å; L316-R320 PolarHBondContact O-N 3.42Å; H317-R320 PolarHBondContact O-N 3.23Å; L318-R320 VanDerWaalsContact C-N 3.32Å; L318-R320 PolarHBondContact O-N 2.9Å; R320-K323 PolarHBondContact O-N 2.94Å; R320-K324 WeakPolarHBondContact O-CB 3.49Å; R320-K324 PolarHBondContact O-N 2.93Å |
| 321 | I | 90.9 | Very high | 87.7 | Confident | 26 Ų | 26 | 69.8 Ų | 69.8 | 13% | 0.133 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 176.2 | -65.1 | -65.6 | 0 | 0 | 0 | 110.4 | D250 W251 H317 L318 K323 K324 M325 | D250-I321 HydrophobicContact CB-CD1 3.93Å; W251-I321 HydrophobicContact CD2-CD1 3.89Å; W251-I321 HydrophobicContact CE3-CD1 3.87Å; W251-I321 HydrophobicContact CG-CD1 4.48Å; W251-I321 HydrophobicContact CH2-CD1 4.34Å; W251-I321 HydrophobicContact CH2-CG2 4.13Å; W251-I321 HydrophobicContact CZ2-CD1 4.37Å; W251-I321 HydrophobicContact CZ2-CG2 4.47Å; W251-I321 HydrophobicContact CZ3-CD1 4.1Å; H317-I321 VanDerWaalsContact O-CG1 3.32Å; H317-I321 WeakPolarHBondContact O-CG1 3.31Å; H317-I321 PolarHBondContact O-N 3.24Å; L318-I321 PolarHBondContact O-N 3.24Å; I321-K323 PolarHBondContact O-N 2.88Å; I321-K324 PolarHBondContact O-N 2.85Å; I321-K324 VanDerWaalsContact O-N 3.15Å; I321-M325 HydrophobicContact CG2-CG 4.13Å; I321-M325 VanDerWaalsContact O-CG 3.26Å; I321-M325 WeakPolarHBondContact O-CG 3.21Å; I321-M325 PolarHBondContact O-N 3.47Å |
| 322 | L | 87.6 | Confident | 86.8 | Confident | 75 Ų | 75 | 67.8 Ų | 67.8 | 39% | 0.393 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -58.8 | -47.3 | 175.2 | -75.1 | 174.8 | 0 | 0 | 0 | 111.5 | L318 K324 M325 V326 | L318-L322 HydrophobicContact CD1-CD1 3.99Å; L318-L322 HydrophobicContact CD1-CG 3.98Å; L318-L322 HydrophobicContact CD2-CD1 4.42Å; L318-L322 HydrophobicContact CG-CD1 3.79Å; L318-L322 HydrophobicContact CG-CG 4.22Å; L318-L322 WeakPolarHBondContact O-CB 3.34Å; L318-L322 VanDerWaalsContact O-CG 3.27Å; L318-L322 WeakPolarHBondContact O-CG 3.31Å; L318-L322 PolarHBondContact O-N 3.21Å; L322-K324 VanDerWaalsContact C-N 3.27Å; L322-K324 PolarHBondContact O-N 3.35Å; L322-M325 PolarHBondContact O-N 3.03Å; L322-V326 WeakPolarHBondContact O-CB 3.19Å; L322-V326 WeakPolarHBondContact O-CG2 3.44Å; L322-V326 PolarHBondContact O-N 3.05Å |
| 323 | K | 86.6 | Confident | 86 | Confident | 95 Ų | 95 | 69 Ų | 69 | 41% | 0.413 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -54.9 | -46.1 | 175 | -177.1 | 179.1 | 178.8 | 179.4 | 0 | 110.8 | S319 R320 I321 Y327 L341 | S319-K323 VanDerWaalsContact O-CB 3.31Å; S319-K323 WeakPolarHBondContact O-CB 3.38Å; S319-K323 PolarHBondContact O-N 3.1Å; R320-K323 PolarHBondContact O-N 2.94Å; I321-K323 PolarHBondContact O-N 2.88Å; K323-Y327 WeakPolarHBondContact O-CB 3.29Å; K323-Y327 PolarHBondContact O-N 3.5Å; K323-L341 HydrophobicContact CB-CD1 4.01Å; K323-L341 HydrophobicContact CG-CD1 4.17Å |
| 324 | K | 86.6 | Confident | 85.4 | Confident | 73 Ų | 73 | 71.2 Ų | 71.2 | 32% | 0.317 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -67.3 | -37.6 | -179.3 | -174.4 | 177.7 | 176.7 | -171.2 | 0 | 113.8 | D247 D250 R320 I321 L322 | D247-K324 PolarHBondContact O-NZ 3.4Å; D250-K324 HydrophobicContact CB-CD 4.49Å; R320-K324 WeakPolarHBondContact O-CB 3.49Å; R320-K324 PolarHBondContact O-N 2.93Å; I321-K324 PolarHBondContact O-N 2.85Å; I321-K324 VanDerWaalsContact O-N 3.15Å; L322-K324 VanDerWaalsContact C-N 3.27Å; L322-K324 PolarHBondContact O-N 3.35Å |
| 325 | M | 86.1 | Confident | 84.7 | Confident | 132 Ų | 132 | 67.4 Ų | 67.4 | 65% | 0.65 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -79.6 | -33 | -176.9 | -66.3 | -61.6 | -62.5 | 0 | 0 | 113 | W251 I321 L322 | W251-M325 HydrophobicContact CZ2-SD 4.2Å; I321-M325 HydrophobicContact CG2-CG 4.13Å; I321-M325 VanDerWaalsContact O-CG 3.26Å; I321-M325 WeakPolarHBondContact O-CG 3.21Å; I321-M325 PolarHBondContact O-N 3.47Å; L322-M325 PolarHBondContact O-N 3.03Å |
| 326 | V | 84.6 | Confident | 84.1 | Confident | 79 Ų | 79 | 72.2 Ų | 72.2 | 48% | 0.479 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -101.3 | -27.2 | -171.6 | -173.9 | 0 | 0 | 0 | 0 | 112.3 | L322 N328 L337 | L322-V326 WeakPolarHBondContact O-CB 3.19Å; L322-V326 WeakPolarHBondContact O-CG2 3.44Å; L322-V326 PolarHBondContact O-N 3.05Å; V326-N328 PolarHBondContact O-N 3.45Å; V326-N328 VanDerWaalsContact O-N 3.15Å; V326-L337 HydrophobicContact CB-CD2 4.18Å; V326-L337 HydrophobicContact CG1-CD1 4.25Å; V326-L337 HydrophobicContact CG1-CD2 3.62Å |
| 327 | Y | 83.1 | Confident | 83.6 | Confident | 83 Ų | 83 | 74.3 Ų | 74.3 | 33% | 0.325 | 36% | 0.363 | S | S | . | . | trans | -69.4 | 114.1 | -178.3 | -179.9 | -98.7 | 0 | 0 | 0 | 111.5 | K323 E329 R334 | K323-Y327 WeakPolarHBondContact O-CB 3.29Å; K323-Y327 PolarHBondContact O-N 3.5Å; Y327-E329 HydrophobicContact CD1-CG 4.45Å; Y327-E329 HydrophobicContact CE1-CG 3.57Å; Y327-R334 HydrophobicContact CE2-CB 4.25Å | ||
| 328 | N | 80.6 | Confident | 83.1 | Confident | 88 Ų | 88 | 75.8 Ų | 75.8 | 47% | 0.471 | 37% | 0.371 | S | S | . | . | trans | -114.6 | 124 | 171.2 | -173.9 | -7.8 | 0 | 0 | 0 | 109.8 | V326 R330 D331 | V326-N328 PolarHBondContact O-N 3.45Å; V326-N328 VanDerWaalsContact O-N 3.15Å; N328-R330 PolarHBondContact O-N 2.67Å; N328-R330 PolarHBondContact OD1-N 2.86Å; N328-R330 VanDerWaalsContact OD1-N 3.1Å; N328-D331 HydrophobicContact CB-CB 4.16Å; N328-D331 PolarHBondContact O-N 3.06Å | ||
| 329 | E | 76.8 | Confident | 82.8 | Confident | 135 Ų | 135 | 73.8 Ų | 73.8 | 63% | 0.631 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -24.7 | -179.2 | -68.5 | -173.9 | 172.4 | 0 | 0 | 113.3 | Y327 R334 | Y327-E329 HydrophobicContact CD1-CG 4.45Å; Y327-E329 HydrophobicContact CE1-CG 3.57Å; E329-R334 PolarHBondContact O-NH1 3.19Å |
| 330 | R | 76.1 | Confident | 82.6 | Confident | 212 Ų | 212 | 80 Ų | 80 | 80% | 0.8 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.8 | -7.3 | -177.7 | -59.8 | -178.2 | -174.7 | 164.4 | 2 | 113.6 | N328 | N328-R330 PolarHBondContact O-N 2.67Å; N328-R330 PolarHBondContact OD1-N 2.86Å; N328-R330 VanDerWaalsContact OD1-N 3.1Å |
| 331 | D | 79.3 | Confident | 82.3 | Confident | 69 Ų | 69 | 78.3 Ų | 78.3 | 37% | 0.369 | 38% | 0.384 | S | S | . | . | trans | -82.6 | 122.3 | -178.3 | -178.2 | 5.1 | 0 | 0 | 0 | 111.2 | N328 G333 R334 | N328-D331 HydrophobicContact CB-CB 4.16Å; N328-D331 PolarHBondContact O-N 3.06Å; D331-G333 PolarHBondContact O-N 2.84Å; D331-G333 PolarHBondContact OD1-N 3.36Å; D331-R334 VanDerWaalsContact O-CB 3.27Å; D331-R334 WeakPolarHBondContact O-CB 3.18Å; D331-R334 VanDerWaalsContact O-CD 3.26Å; D331-R334 WeakPolarHBondContact O-CD 3.27Å; D331-R334 WeakPolarHBondContact O-CG 3.48Å; D331-R334 PolarHBondContact O-N 2.9Å | ||
| 332 | P | 74.1 | Confident | 82.1 | Confident | 75 Ų | 75 | 79.3 Ų | 79.3 | 49% | 0.487 | 39% | 0.389 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.4 | -23.8 | 174 | 24.4 | -33.2 | 0 | 0 | 0 | 114 | V61 R334 | V61-P332 HydrophobicContact CG1-CB 4.12Å; P332-R334 VanDerWaalsContact C-N 3.3Å; P332-R334 PolarHBondContact O-N 2.8Å |
| 333 | G | 77.4 | Confident | 82.1 | Confident | 30 Ų | 30 | 77.1 Ų | 77.1 | 31% | 0.309 | 38% | 0.379 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | D331 C335 E336 L337 | D331-G333 PolarHBondContact O-N 2.84Å; D331-G333 PolarHBondContact OD1-N 3.36Å; G333-C335 PolarHBondContact O-N 3.48Å; G333-E336 PolarHBondContact O-N 3.35Å; G333-L337 PolarHBondContact O-N 2.62Å |
| 334 | R | 79.5 | Confident | 82.3 | Confident | 52 Ų | 52 | 75 Ų | 75 | 20% | 0.196 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -54.5 | -30.7 | -175.2 | 68.7 | -171.4 | 174.7 | 157.8 | -2.1 | 114.9 | V61 Y327 E329 D331 P332 L338 | V61-R334 PolarHBondContact O-NH2 3.4Å; Y327-R334 HydrophobicContact CE2-CB 4.25Å; E329-R334 PolarHBondContact O-NH1 3.19Å; D331-R334 VanDerWaalsContact O-CB 3.27Å; D331-R334 WeakPolarHBondContact O-CB 3.18Å; D331-R334 VanDerWaalsContact O-CD 3.26Å; D331-R334 WeakPolarHBondContact O-CD 3.27Å; D331-R334 WeakPolarHBondContact O-CG 3.48Å; D331-R334 PolarHBondContact O-N 2.9Å; P332-R334 VanDerWaalsContact C-N 3.3Å; P332-R334 PolarHBondContact O-N 2.8Å; R334-L338 VanDerWaalsContact O-CB 3.26Å; R334-L338 WeakPolarHBondContact O-CB 3.27Å; R334-L338 PolarHBondContact O-N 2.86Å |
| 335 | C | 79.2 | Confident | 82.4 | Confident | 16 Ų | 16 | 73.6 Ų | 73.6 | 11% | 0.108 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -77.4 | -27.8 | -179.8 | -80.4 | 0 | 0 | 0 | 0 | 113.3 | C63 Q65 T67 G333 S339 | C63-C335 HydrophobicContact CB-CB 3.48Å; C63-C335 VanDerWaalsContact CB-CB 3.48Å; C63-C335 WeakPolarHBondContact CB-SG 3.49Å; C63-C335 WeakPolarHBondContact SG-CB 3.31Å; C63-C335 CovalentContact SG-SG 2.02Å; C63-C335 PolarHBondContact SG-SG 3.37Å; Q65-C335 VanDerWaalsContact O-CB 3.27Å; Q65-C335 WeakPolarHBondContact O-CB 3.18Å; T67-C335 HydrophobicContact CG2-CB 4.09Å; T67-C335 WeakPolarHBondContact CG2-O 3.01Å; G333-C335 PolarHBondContact O-N 3.48Å; C335-S339 WeakPolarHBondContact O-CB 3.34Å; C335-S339 PolarHBondContact O-N 2.86Å; C335-S339 PolarHBondContact O-OG 3.5Å |
| 336 | E | 81.6 | Confident | 82.7 | Confident | 136 Ų | 136 | 68.6 Ų | 68.6 | 64% | 0.636 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -70 | -47.7 | 172.3 | -174.2 | 179.1 | 174.6 | 0 | 0 | 109.9 | G333 L338 S339 F340 | G333-E336 PolarHBondContact O-N 3.35Å; E336-L338 VanDerWaalsContact C-N 3.31Å; E336-L338 PolarHBondContact O-N 3.48Å; E336-S339 WeakPolarHBondContact O-CB 3.26Å; E336-S339 PolarHBondContact O-N 3.5Å; E336-F340 PolarHBondContact O-N 2.85Å; E336-F340 VanDerWaalsContact O-N 3.08Å |
| 337 | L | 83 | Confident | 83.1 | Confident | 48 Ų | 48 | 69.3 Ų | 69.3 | 25% | 0.251 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -54.9 | -46.9 | 172.2 | 178.7 | 67.3 | 0 | 0 | 0 | 111.5 | V326 G333 S339 F340 L341 | V326-L337 HydrophobicContact CB-CD2 4.18Å; V326-L337 HydrophobicContact CG1-CD1 4.25Å; V326-L337 HydrophobicContact CG1-CD2 3.62Å; G333-L337 PolarHBondContact O-N 2.62Å; L337-S339 VanDerWaalsContact C-N 3.31Å; L337-S339 PolarHBondContact O-N 3.48Å; L337-F340 PolarHBondContact O-N 3.38Å; L337-L341 HydrophobicContact CD1-CD1 3.98Å; L337-L341 HydrophobicContact CD1-CG 4.15Å; L337-L341 HydrophobicContact CD2-CD1 4.3Å; L337-L341 HydrophobicContact CG-CD1 3.78Å; L337-L341 HydrophobicContact CG-CG 4.29Å; L337-L341 WeakPolarHBondContact O-CB 3.47Å; L337-L341 WeakPolarHBondContact O-CG 3.02Å; L337-L341 PolarHBondContact O-N 3.22Å |
| 338 | L | 81.8 | Confident | 83.6 | Confident | 39 Ų | 39 | 65.5 Ų | 65.5 | 20% | 0.204 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -66.8 | -32.7 | 178.7 | -170.5 | 59.6 | 0 | 0 | 0 | 112.2 | T67 R334 E336 F340 L341 L342 | T67-L338 HydrophobicContact CG2-CB 3.89Å; T67-L338 HydrophobicContact CG2-CD2 4Å; T67-L338 HydrophobicContact CG2-CG 3.98Å; R334-L338 VanDerWaalsContact O-CB 3.26Å; R334-L338 WeakPolarHBondContact O-CB 3.27Å; R334-L338 PolarHBondContact O-N 2.86Å; E336-L338 VanDerWaalsContact C-N 3.31Å; E336-L338 PolarHBondContact O-N 3.48Å; L338-F340 VanDerWaalsContact C-N 3.26Å; L338-F340 PolarHBondContact O-N 3.24Å; L338-L341 PolarHBondContact O-N 3.27Å; L338-L342 HydrophobicContact CD1-CD1 4.36Å; L338-L342 HydrophobicContact CD1-CD2 4.4Å; L338-L342 HydrophobicContact CD1-CG 3.97Å; L338-L342 HydrophobicContact CG-CD1 3.92Å; L338-L342 HydrophobicContact CG-CG 4.06Å; L338-L342 VanDerWaalsContact O-CB 3.3Å; L338-L342 WeakPolarHBondContact O-CB 2.99Å; L338-L342 WeakPolarHBondContact O-CD1 3.22Å; L338-L342 WeakPolarHBondContact O-CG 3.24Å; L338-L342 PolarHBondContact O-N 2.8Å |
| 339 | S | 83.6 | Confident | 84.2 | Confident | 30 Ų | 30 | 62 Ų | 62 | 21% | 0.21 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.1 | -30.3 | 174.1 | -59.6 | 0 | 0 | 0 | 0 | 112.6 | T67 C335 E336 L337 P343 | T67-S339 WeakPolarHBondContact CA-OG 3.47Å; C335-S339 WeakPolarHBondContact O-CB 3.34Å; C335-S339 PolarHBondContact O-N 2.86Å; C335-S339 PolarHBondContact O-OG 3.5Å; E336-S339 WeakPolarHBondContact O-CB 3.26Å; E336-S339 PolarHBondContact O-N 3.5Å; L337-S339 VanDerWaalsContact C-N 3.31Å; L337-S339 PolarHBondContact O-N 3.48Å; S339-P343 WeakPolarHBondContact O-CD 3.39Å; S339-P343 WeakPolarHBondContact O-CG 3.36Å |
| 340 | F | 85.2 | Confident | 85 | Confident | 137 Ų | 137 | 55.9 Ų | 55.9 | 60% | 0.601 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -80.2 | -44.1 | 172.8 | 176.4 | -100.5 | 0 | 0 | 0 | 112.5 | E336 L337 L338 L342 P343 L344 | E336-F340 PolarHBondContact O-N 2.85Å; E336-F340 VanDerWaalsContact O-N 3.08Å; L337-F340 PolarHBondContact O-N 3.38Å; L338-F340 VanDerWaalsContact C-N 3.26Å; L338-F340 PolarHBondContact O-N 3.24Å; F340-L342 PolarHBondContact O-N 3.03Å; F340-P343 WeakPolarHBondContact O-CD 3.4Å; F340-L344 HydrophobicContact CE1-CD1 3.97Å; F340-L344 HydrophobicContact CZ-CD1 4.08Å |
| 341 | L | 85.8 | Confident | 85.9 | Confident | 15 Ų | 15 | 48.3 Ų | 48.3 | 8% | 0.079 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -69.9 | -31.4 | -176.7 | -70.4 | 177.1 | 0 | 0 | 0 | 113.3 | K323 L337 L338 L344 D345 | K323-L341 HydrophobicContact CB-CD1 4.01Å; K323-L341 HydrophobicContact CG-CD1 4.17Å; L337-L341 HydrophobicContact CD1-CD1 3.98Å; L337-L341 HydrophobicContact CD1-CG 4.15Å; L337-L341 HydrophobicContact CD2-CD1 4.3Å; L337-L341 HydrophobicContact CG-CD1 3.78Å; L337-L341 HydrophobicContact CG-CG 4.29Å; L337-L341 WeakPolarHBondContact O-CB 3.47Å; L337-L341 WeakPolarHBondContact O-CG 3.02Å; L337-L341 PolarHBondContact O-N 3.22Å; L338-L341 PolarHBondContact O-N 3.27Å; L341-L344 PolarHBondContact O-N 2.94Å; L341-D345 WeakPolarHBondContact O-CB 3.35Å; L341-D345 PolarHBondContact O-N 3.36Å |
| 342 | L | 85.6 | Confident | 86.6 | Confident | 47 Ų | 47 | 45 Ų | 45 | 25% | 0.246 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.6 | -55.2 | -179.5 | -79.6 | 168.7 | 0 | 0 | 0 | 112.7 | I69 L338 F340 L344 D345 Y346 | I69-L342 HydrophobicContact CD1-CB 4.39Å; I69-L342 HydrophobicContact CG1-CB 4.47Å; L338-L342 HydrophobicContact CD1-CD1 4.36Å; L338-L342 HydrophobicContact CD1-CD2 4.4Å; L338-L342 HydrophobicContact CD1-CG 3.97Å; L338-L342 HydrophobicContact CG-CD1 3.92Å; L338-L342 HydrophobicContact CG-CG 4.06Å; L338-L342 VanDerWaalsContact O-CB 3.3Å; L338-L342 WeakPolarHBondContact O-CB 2.99Å; L338-L342 WeakPolarHBondContact O-CD1 3.22Å; L338-L342 WeakPolarHBondContact O-CG 3.24Å; L338-L342 PolarHBondContact O-N 2.8Å; F340-L342 PolarHBondContact O-N 3.03Å; L342-L344 VanDerWaalsContact C-N 3.26Å; L342-L344 PolarHBondContact O-N 3.27Å; L342-D345 PolarHBondContact O-N 2.85Å; L342-Y346 VanDerWaalsContact O-CD2 3.27Å; L342-Y346 WeakPolarHBondContact O-CD2 3.48Å; L342-Y346 PolarHBondContact O-N 3.35Å; L342-Y346 VanDerWaalsContact O-N 3.11Å |
| 343 | P | 88.4 | Confident | 87.5 | Confident | 28 Ų | 28 | 41.4 Ų | 41.4 | 18% | 0.182 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -56.2 | -39.9 | 172.9 | -26.1 | 34.3 | 0 | 0 | 0 | 113 | F73 S339 F340 D345 Y346 I347 | F73-P343 HydrophobicContact CD1-CB 4.39Å; F73-P343 HydrophobicContact CD2-CB 4.11Å; F73-P343 HydrophobicContact CE1-CB 4.04Å; F73-P343 HydrophobicContact CE2-CB 3.76Å; F73-P343 HydrophobicContact CG-CB 4.41Å; F73-P343 HydrophobicContact CZ-CB 3.71Å; F73-P343 WeakPolarHBondContact CZ-O 3.16Å; S339-P343 WeakPolarHBondContact O-CD 3.39Å; S339-P343 WeakPolarHBondContact O-CG 3.36Å; F340-P343 WeakPolarHBondContact O-CD 3.4Å; P343-D345 VanDerWaalsContact C-N 3.35Å; P343-D345 PolarHBondContact O-N 3.43Å; P343-Y346 PolarHBondContact O-N 3.13Å; P343-I347 VanDerWaalsContact O-CG1 3.31Å; P343-I347 WeakPolarHBondContact O-CG1 3.37Å; P343-I347 PolarHBondContact O-N 2.87Å |
| 344 | L | 89.5 | Confident | 88.3 | Confident | 50 Ų | 50 | 43.2 Ų | 43.2 | 26% | 0.262 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64 | -39.1 | 178.8 | -169.9 | 151.3 | 0 | 0 | 0 | 111.8 | F340 L341 L342 I347 S348 | F340-L344 HydrophobicContact CE1-CD1 3.97Å; F340-L344 HydrophobicContact CZ-CD1 4.08Å; L341-L344 PolarHBondContact O-N 2.94Å; L342-L344 VanDerWaalsContact C-N 3.26Å; L342-L344 PolarHBondContact O-N 3.27Å; L344-I347 PolarHBondContact O-N 3.33Å; L344-S348 WeakPolarHBondContact O-CB 2.91Å; L344-S348 PolarHBondContact O-N 3.22Å; L344-S348 PolarHBondContact O-OG 2.82Å |
| 345 | D | 89.9 | Confident | 88.8 | Confident | 45 Ų | 45 | 40.7 Ų | 40.7 | 24% | 0.241 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63 | -46.6 | 173.4 | -169.9 | 50.3 | 0 | 0 | 0 | 110.7 | L341 L342 P343 I347 S348 I349 | L341-D345 WeakPolarHBondContact O-CB 3.35Å; L341-D345 PolarHBondContact O-N 3.36Å; L342-D345 PolarHBondContact O-N 2.85Å; P343-D345 VanDerWaalsContact C-N 3.35Å; P343-D345 PolarHBondContact O-N 3.43Å; D345-I347 PolarHBondContact O-N 3.23Å; D345-S348 PolarHBondContact O-N 3.47Å; D345-I349 WeakPolarHBondContact O-CB 3.46Å; D345-I349 WeakPolarHBondContact O-CG1 3.45Å; D345-I349 PolarHBondContact O-N 3.44Å |
| 346 | Y | 91.4 | Very high | 89.5 | Confident | 27 Ų | 27 | 40 Ų | 40 | 11% | 0.106 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.5 | -43.6 | 175.6 | -81.3 | -75.5 | 0 | 0 | 0 | 113.2 | I69 F73 I131 L135 L342 P343 S348 I349 N350 | I69-Y346 HydrophobicContact CD1-CD2 4.25Å; I69-Y346 HydrophobicContact CD1-CE2 3.83Å; F73-Y346 HydrophobicContact CE1-CD2 4.48Å; F73-Y346 HydrophobicContact CE1-CG 4.42Å; I131-Y346 HydrophobicContact CG2-CD1 3.67Å; I131-Y346 HydrophobicContact CG2-CE1 3.78Å; L135-Y346 HydrophobicContact CB-CD1 4.37Å; L135-Y346 HydrophobicContact CB-CE1 3.72Å; L135-Y346 HydrophobicContact CD1-CD1 4.16Å; L135-Y346 HydrophobicContact CD1-CD2 4.02Å; L135-Y346 HydrophobicContact CD1-CE1 3.94Å; L135-Y346 HydrophobicContact CD1-CE2 3.81Å; L135-Y346 HydrophobicContact CD1-CG 4.21Å; L135-Y346 HydrophobicContact CD2-CD1 4.42Å; L135-Y346 HydrophobicContact CG-CE1 4.29Å; L342-Y346 VanDerWaalsContact O-CD2 3.27Å; L342-Y346 WeakPolarHBondContact O-CD2 3.48Å; L342-Y346 PolarHBondContact O-N 3.35Å; L342-Y346 VanDerWaalsContact O-N 3.11Å; P343-Y346 PolarHBondContact O-N 3.13Å; Y346-S348 VanDerWaalsContact C-N 3.33Å; Y346-I349 PolarHBondContact O-N 3.47Å; Y346-N350 PolarHBondContact O-N 3.24Å |
| 347 | I | 92.5 | Very high | 89.9 | Confident | 93 Ų | 93 | 33.8 Ų | 33.8 | 48% | 0.477 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -60.7 | -46.3 | 174 | -68.4 | 165.8 | 0 | 0 | 0 | 110 | F73 P343 L344 D345 I349 N350 L351 | F73-I347 HydrophobicContact CE2-CD1 3.83Å; F73-I347 HydrophobicContact CE2-CG1 3.71Å; F73-I347 HydrophobicContact CZ-CD1 4.47Å; F73-I347 HydrophobicContact CZ-CG1 3.99Å; P343-I347 VanDerWaalsContact O-CG1 3.31Å; P343-I347 WeakPolarHBondContact O-CG1 3.37Å; P343-I347 PolarHBondContact O-N 2.87Å; L344-I347 PolarHBondContact O-N 3.33Å; D345-I347 PolarHBondContact O-N 3.23Å; I347-I349 PolarHBondContact O-N 2.75Å; I347-N350 PolarHBondContact O-N 3.34Å; I347-L351 WeakPolarHBondContact O-CB 3.06Å; I347-L351 PolarHBondContact O-N 2.83Å |
| 348 | S | 94.2 | Very high | 90.2 | Very high | 3 Ų | 3 | 33.1 Ų | 33.1 | 2% | 0.021 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -67.5 | -36.4 | -176.3 | -62.2 | 0 | 0 | 0 | 0 | 112.4 | P315 L344 D345 Y346 L351 A352 | P315-S348 WeakPolarHBondContact CB-OG 2.98Å; P315-S348 PolarHBondContact O-OG 2.88Å; L344-S348 WeakPolarHBondContact O-CB 2.91Å; L344-S348 PolarHBondContact O-N 3.22Å; L344-S348 PolarHBondContact O-OG 2.82Å; D345-S348 PolarHBondContact O-N 3.47Å; Y346-S348 VanDerWaalsContact C-N 3.33Å; S348-L351 PolarHBondContact O-N 3.46Å; S348-A352 WeakPolarHBondContact O-CB 3.35Å; S348-A352 PolarHBondContact O-N 3.21Å |
| 349 | I | 93.4 | Very high | 90.4 | Very high | 16 Ų | 16 | 31.4 Ų | 31.4 | 8% | 0.082 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -66 | -47.5 | 173.2 | -64.3 | 162.3 | 0 | 0 | 0 | 109.7 | I131 L316 D345 Y346 I347 L351 A352 T353 | I131-I349 HydrophobicContact CD1-CB 4.41Å; I131-I349 HydrophobicContact CD1-CG2 3.19Å; I131-I349 HydrophobicContact CG1-CG2 4.11Å; L316-I349 HydrophobicContact CD1-CG1 3.58Å; D345-I349 WeakPolarHBondContact O-CB 3.46Å; D345-I349 WeakPolarHBondContact O-CG1 3.45Å; D345-I349 PolarHBondContact O-N 3.44Å; Y346-I349 PolarHBondContact O-N 3.47Å; I347-I349 PolarHBondContact O-N 2.75Å; I349-L351 PolarHBondContact O-N 2.89Å; I349-A352 WeakPolarHBondContact O-CB 3.41Å; I349-A352 PolarHBondContact O-N 3.2Å; I349-A352 VanDerWaalsContact O-N 3.12Å; I349-T353 PolarHBondContact O-N 2.66Å; I349-T353 PolarHBondContact O-OG1 3.08Å |
| 350 | N | 93.9 | Very high | 90.6 | Very high | 6 Ų | 6 | 30.2 Ų | 30.2 | 3% | 0.032 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.9 | -40.3 | 175 | -91.3 | -29.2 | 0 | 0 | 0 | 112.1 | N77 S81 I84 Y346 I347 T353 M354 | N77-N350 PolarHBondContact ND2-ND2 3.47Å; N77-N350 VanDerWaalsContact ND2-ND2 3.19Å; N77-N350 PolarHBondContact OD1-ND2 2.86Å; S81-N350 VanDerWaalsContact OG-CG 3.27Å; S81-N350 PolarHBondContact OG-ND2 2.96Å; S81-N350 PolarHBondContact OG-OD1 3.49Å; I84-N350 HydrophobicContact CD1-CB 4.14Å; I84-N350 WeakPolarHBondContact CD1-O 3.35Å; Y346-N350 PolarHBondContact O-N 3.24Å; I347-N350 PolarHBondContact O-N 3.34Å; N350-T353 PolarHBondContact O-N 3Å; N350-M354 WeakPolarHBondContact O-CB 3.41Å; N350-M354 PolarHBondContact O-N 3.44Å |
| 351 | L | 94.3 | Very high | 90.7 | Very high | 52 Ų | 52 | 27.1 Ų | 27.1 | 27% | 0.272 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -65.9 | -42.6 | 176.5 | -161.2 | 78.2 | 0 | 0 | 0 | 112 | L311 C312 P315 I347 S348 I349 T353 M354 N355 | L311-L351 WeakPolarHBondContact O-CD2 3.45Å; C312-L351 VanDerWaalsContact CB-O 3.32Å; C312-L351 WeakPolarHBondContact CB-O 3.25Å; C312-L351 CarbonylContact O-C 3.56Å; P315-L351 HydrophobicContact CB-CD2 4.31Å; P315-L351 HydrophobicContact CG-CD2 3.56Å; I347-L351 WeakPolarHBondContact O-CB 3.06Å; I347-L351 PolarHBondContact O-N 2.83Å; S348-L351 PolarHBondContact O-N 3.46Å; I349-L351 PolarHBondContact O-N 2.89Å; L351-T353 VanDerWaalsContact C-N 3.31Å; L351-T353 PolarHBondContact O-N 3.42Å; L351-M354 HydrophobicContact CD1-CE 3.34Å; L351-M354 HydrophobicContact CG-CE 4.26Å; L351-M354 VanDerWaalsContact O-CB 3.31Å; L351-M354 WeakPolarHBondContact O-CB 3.47Å; L351-M354 PolarHBondContact O-N 3.07Å; L351-N355 PolarHBondContact O-N 2.93Å |
| 352 | A | 93.9 | Very high | 90.6 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61.2 | -40.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | C312 W313 L316 S348 I349 M354 N355 | C312-A352 WeakPolarHBondContact O-CA 3.32Å; C312-A352 PolarHBondContact O-N 2.87Å; W313-A352 HydrophobicContact CD2-CB 4.09Å; W313-A352 HydrophobicContact CE3-CB 4.19Å; W313-A352 HydrophobicContact CH2-CB 4.2Å; W313-A352 HydrophobicContact CZ2-CB 4.2Å; W313-A352 HydrophobicContact CZ3-CB 4.24Å; L316-A352 HydrophobicContact CB-CB 4.43Å; L316-A352 HydrophobicContact CD2-CB 3.85Å; S348-A352 WeakPolarHBondContact O-CB 3.35Å; S348-A352 PolarHBondContact O-N 3.21Å; I349-A352 WeakPolarHBondContact O-CB 3.41Å; I349-A352 PolarHBondContact O-N 3.2Å; I349-A352 VanDerWaalsContact O-N 3.12Å; A352-M354 VanDerWaalsContact C-N 3.33Å; A352-N355 WeakPolarHBondContact O-CB 3.32Å; A352-N355 PolarHBondContact O-N 2.95Å |
| 353 | T | 93.3 | Very high | 90.5 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -71.9 | -27.4 | 177.5 | -48.6 | 0 | 0 | 0 | 0 | 112.8 | I84 Y123 I124 D127 I128 I349 N350 L351 N355 S356 | I84-T353 HydrophobicContact CG2-CG2 4.04Å; Y123-T353 HydrophobicContact CD1-CG2 4.11Å; Y123-T353 HydrophobicContact CE1-CG2 3.8Å; Y123-T353 WeakPolarHBondContact CE1-OG1 3.35Å; I124-T353 HydrophobicContact CG1-CG2 4.17Å; D127-T353 PolarHBondContact OD2-OG1 3.19Å; I128-T353 HydrophobicContact CD1-CG2 3.78Å; I128-T353 HydrophobicContact CG1-CG2 3.77Å; I349-T353 PolarHBondContact O-N 2.66Å; I349-T353 PolarHBondContact O-OG1 3.08Å; N350-T353 PolarHBondContact O-N 3Å; L351-T353 VanDerWaalsContact C-N 3.31Å; L351-T353 PolarHBondContact O-N 3.42Å; T353-N355 PolarHBondContact O-N 3.41Å; T353-S356 WeakPolarHBondContact O-CB 3.1Å; T353-S356 PolarHBondContact O-N 3.01Å |
| 354 | M | 93.3 | Very high | 90.3 | Very high | 67 Ų | 67 | 27.2 Ų | 27.2 | 33% | 0.33 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -62 | -29.3 | 171.6 | -167.4 | 175 | 66.4 | 0 | 0 | 112.2 | I84 N350 L351 A352 S356 C357 I358 | I84-M354 HydrophobicContact CD1-CB 4.29Å; N350-M354 WeakPolarHBondContact O-CB 3.41Å; N350-M354 PolarHBondContact O-N 3.44Å; L351-M354 HydrophobicContact CD1-CE 3.34Å; L351-M354 HydrophobicContact CG-CE 4.26Å; L351-M354 VanDerWaalsContact O-CB 3.31Å; L351-M354 WeakPolarHBondContact O-CB 3.47Å; L351-M354 PolarHBondContact O-N 3.07Å; A352-M354 VanDerWaalsContact C-N 3.33Å; M354-S356 PolarHBondContact O-N 3.38Å; M354-C357 WeakPolarHBondContact O-CA 3.36Å; M354-C357 WeakPolarHBondContact O-CB 3.37Å; M354-C357 PolarHBondContact O-N 3.18Å; M354-I358 HydrophobicContact CE-CD1 4.11Å; M354-I358 HydrophobicContact CG-CD1 4Å; M354-I358 HydrophobicContact CG-CG1 4.24Å; M354-I358 WeakPolarHBondContact O-CG1 3.33Å; M354-I358 PolarHBondContact O-N 2.82Å |
| 355 | N | 91.9 | Very high | 89.8 | Confident | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -52.1 | -44.6 | 174.2 | -177.6 | 67.6 | 0 | 0 | 0 | 112.1 | F309 C312 W313 L351 A352 T353 C357 I358 N359 | F309-N355 VanDerWaalsContact CA-OD1 3.29Å; F309-N355 WeakPolarHBondContact CA-OD1 3.46Å; C312-N355 HydrophobicContact CB-CB 3.8Å; W313-N355 PolarHBondContact NE1-ND2 2.88Å; L351-N355 PolarHBondContact O-N 2.93Å; A352-N355 WeakPolarHBondContact O-CB 3.32Å; A352-N355 PolarHBondContact O-N 2.95Å; T353-N355 PolarHBondContact O-N 3.41Å; N355-C357 PolarHBondContact O-N 2.91Å; N355-I358 PolarHBondContact O-N 3.32Å; N355-I358 VanDerWaalsContact O-N 3.17Å; N355-N359 PolarHBondContact O-N 3.35Å |
| 356 | S | 92 | Very high | 88.9 | Confident | 1 Ų | 1 | 32.7 Ų | 32.7 | 1% | 0.007 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.4 | -23.7 | 178.3 | -64.6 | 0 | 0 | 0 | 0 | 113.1 | N92 D120 T353 M354 | N92-S356 PolarHBondContact ND2-O 2.86Å; D120-S356 WeakPolarHBondContact OD1-CA 3.46Å; D120-S356 WeakPolarHBondContact OD1-CB 3.36Å; D120-S356 PolarHBondContact OD1-OG 2.91Å; T353-S356 WeakPolarHBondContact O-CB 3.1Å; T353-S356 PolarHBondContact O-N 3.01Å; M354-S356 PolarHBondContact O-N 3.38Å |
| 357 | C | 91.2 | Very high | 88.1 | Confident | 6 Ų | 6 | 33 Ų | 33 | 4% | 0.041 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -85.2 | -29.6 | 176.6 | -56.3 | 0 | 0 | 0 | 0 | 112.4 | I84 V87 G88 M354 N355 N359 I361 | I84-C357 WeakPolarHBondContact CG2-SG 3.18Å; I84-C357 PolarHBondContact O-SG 2.98Å; V87-C357 HydrophobicContact CG1-CB 4.27Å; G88-C357 WeakPolarHBondContact CA-SG 3.3Å; M354-C357 WeakPolarHBondContact O-CA 3.36Å; M354-C357 WeakPolarHBondContact O-CB 3.37Å; M354-C357 PolarHBondContact O-N 3.18Å; N355-C357 PolarHBondContact O-N 2.91Å; C357-N359 VanDerWaalsContact C-N 3.34Å; C357-I361 WeakPolarHBondContact O-CD1 3.31Å; C357-I361 WeakPolarHBondContact O-CG1 3.33Å |
| 358 | I | 89.4 | Confident | 87.3 | Confident | 33 Ų | 33 | 37 Ų | 37 | 17% | 0.169 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -75.6 | -26.9 | -176.7 | -62.4 | 163.3 | 0 | 0 | 0 | 111.2 | I308 M354 N355 I361 A362 | I308-I358 HydrophobicContact CD1-CG2 3.78Å; I308-I358 HydrophobicContact CG2-CB 4Å; I308-I358 HydrophobicContact CG2-CD1 3.54Å; I308-I358 HydrophobicContact CG2-CG1 4.37Å; I308-I358 HydrophobicContact CG2-CG2 3.67Å; M354-I358 HydrophobicContact CE-CD1 4.11Å; M354-I358 HydrophobicContact CG-CD1 4Å; M354-I358 HydrophobicContact CG-CG1 4.24Å; M354-I358 WeakPolarHBondContact O-CG1 3.33Å; M354-I358 PolarHBondContact O-N 2.82Å; N355-I358 PolarHBondContact O-N 3.32Å; N355-I358 VanDerWaalsContact O-N 3.17Å; I358-I361 CarbonylContact O-C 3.49Å; I358-I361 WeakPolarHBondContact O-CB 3.27Å; I358-I361 PolarHBondContact O-N 2.98Å; I358-A362 HydrophobicContact CG2-CB 4.41Å; I358-A362 WeakPolarHBondContact O-CB 3.47Å; I358-A362 PolarHBondContact O-N 2.9Å |
| 359 | N | 85.6 | Confident | 86.5 | Confident | 4 Ų | 4 | 41.7 Ų | 41.7 | 2% | 0.021 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -52.4 | -54.8 | -179 | -71.1 | -21.4 | 0 | 0 | 0 | 113.4 | D120 N355 C357 I361 A362 L363 | D120-N359 PolarHBondContact OD2-ND2 3.33Å; N355-N359 PolarHBondContact O-N 3.35Å; C357-N359 VanDerWaalsContact C-N 3.34Å; N359-I361 VanDerWaalsContact C-N 3.35Å; N359-I361 PolarHBondContact O-N 3.46Å; N359-A362 PolarHBondContact O-N 2.55Å; N359-L363 WeakPolarHBondContact O-CG 3.48Å; N359-L363 PolarHBondContact O-N 2.97Å; N359-L363 VanDerWaalsContact O-N 3.11Å |
| 360 | P | 87.3 | Confident | 86 | Confident | 5 Ų | 5 | 41.3 Ų | 41.3 | 3% | 0.032 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59.5 | -39.1 | 172.6 | -25 | 32.7 | 0 | 0 | 0 | 114.3 | N92 L95 L363 Y364 F374 | N92-P360 HydrophobicContact CB-CG 4.49Å; N92-P360 VanDerWaalsContact OD1-CG 3.32Å; N92-P360 WeakPolarHBondContact OD1-CG 3.26Å; L95-P360 HydrophobicContact CD2-CG 4.25Å; P360-L363 PolarHBondContact O-N 3.15Å; P360-Y364 WeakPolarHBondContact O-CB 3.44Å; P360-Y364 PolarHBondContact O-N 3.11Å; P360-F374 HydrophobicContact CB-CZ 4.13Å |
| 361 | I | 87.9 | Confident | 85.5 | Confident | 71 Ų | 71 | 45 Ų | 45 | 36% | 0.364 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -65.8 | -46 | -178.3 | -60.5 | 173.5 | 0 | 0 | 0 | 110.3 | V87 C357 I358 N359 L363 Y364 F365 | V87-I361 HydrophobicContact CG1-CD1 4.23Å; C357-I361 WeakPolarHBondContact O-CD1 3.31Å; C357-I361 WeakPolarHBondContact O-CG1 3.33Å; I358-I361 CarbonylContact O-C 3.49Å; I358-I361 WeakPolarHBondContact O-CB 3.27Å; I358-I361 PolarHBondContact O-N 2.98Å; N359-I361 VanDerWaalsContact C-N 3.35Å; N359-I361 PolarHBondContact O-N 3.46Å; I361-L363 VanDerWaalsContact C-N 3.35Å; I361-L363 PolarHBondContact O-N 3.42Å; I361-Y364 WeakPolarHBondContact O-CB 3.44Å; I361-Y364 PolarHBondContact O-N 2.79Å; I361-F365 HydrophobicContact CG2-CD2 3.81Å; I361-F365 HydrophobicContact CG2-CE2 3.62Å; I361-F365 WeakPolarHBondContact O-CD2 3.42Å; I361-F365 PolarHBondContact O-N 3.3Å; I361-F365 VanDerWaalsContact O-N 3.07Å |
| 362 | A | 83.9 | Confident | 85 | Confident | 10 Ų | 10 | 47 Ų | 47 | 8% | 0.083 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.7 | -44.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L305 I358 N359 Y364 F365 V366 | L305-A362 HydrophobicContact CD2-CB 3.42Å; L305-A362 VanDerWaalsContact CD2-CB 3.42Å; L305-A362 HydrophobicContact CG-CB 4.38Å; I358-A362 HydrophobicContact CG2-CB 4.41Å; I358-A362 WeakPolarHBondContact O-CB 3.47Å; I358-A362 PolarHBondContact O-N 2.9Å; N359-A362 PolarHBondContact O-N 2.55Å; A362-Y364 VanDerWaalsContact C-N 3.29Å; A362-Y364 PolarHBondContact O-N 2.99Å; A362-F365 PolarHBondContact O-N 3.38Å; A362-V366 VanDerWaalsContact O-CB 3.23Å; A362-V366 WeakPolarHBondContact O-CB 3.41Å; A362-V366 WeakPolarHBondContact O-CG2 3.26Å; A362-V366 PolarHBondContact O-N 3.2Å |
| 363 | L | 82.6 | Confident | 84.5 | Confident | 15 Ų | 15 | 48 Ų | 48 | 8% | 0.079 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.5 | -35.5 | 175.9 | -70.2 | 173.6 | 0 | 0 | 0 | 112.9 | L95 I113 N359 P360 I361 S367 | L95-L363 HydrophobicContact CD1-CD1 4.13Å; L95-L363 HydrophobicContact CD2-CD1 3.79Å; I113-L363 HydrophobicContact CD1-CD1 4.36Å; I113-L363 HydrophobicContact CD1-CD2 4.16Å; I113-L363 HydrophobicContact CG2-CD1 3.55Å; N359-L363 WeakPolarHBondContact O-CG 3.48Å; N359-L363 PolarHBondContact O-N 2.97Å; N359-L363 VanDerWaalsContact O-N 3.11Å; P360-L363 PolarHBondContact O-N 3.15Å; I361-L363 VanDerWaalsContact C-N 3.35Å; I361-L363 PolarHBondContact O-N 3.42Å; L363-S367 PolarHBondContact O-N 2.84Å |
| 364 | Y | 85 | Confident | 84.1 | Confident | 67 Ų | 67 | 48.3 Ų | 48.3 | 26% | 0.263 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.8 | -47.6 | 174.8 | 174.8 | -93.8 | 0 | 0 | 0 | 112.5 | P360 I361 A362 V366 K371 F374 Q375 | P360-Y364 WeakPolarHBondContact O-CB 3.44Å; P360-Y364 PolarHBondContact O-N 3.11Å; I361-Y364 WeakPolarHBondContact O-CB 3.44Å; I361-Y364 PolarHBondContact O-N 2.79Å; A362-Y364 VanDerWaalsContact C-N 3.29Å; A362-Y364 PolarHBondContact O-N 2.99Å; Y364-V366 VanDerWaalsContact C-N 3.34Å; Y364-K371 HydrophobicContact CD2-CB 4.37Å; Y364-K371 HydrophobicContact CD2-CG 4.08Å; Y364-K371 HydrophobicContact CE1-CG 4.38Å; Y364-K371 HydrophobicContact CE2-CB 4.38Å; Y364-K371 HydrophobicContact CE2-CG 3.65Å; Y364-K371 WeakPolarHBondContact O-CB 2.9Å; Y364-F374 HydrophobicContact CD2-CB 3.56Å; Y364-F374 AromaticContact CD2-CD2 3.98Å; Y364-F374 HydrophobicContact CD2-CD2 3.98Å; Y364-F374 AromaticContact CD2-CG 3.98Å; Y364-F374 HydrophobicContact CD2-CG 3.98Å; Y364-F374 HydrophobicContact CE2-CB 3.93Å; Y364-Q375 HydrophobicContact CE2-CG 4.05Å; Y364-Q375 PolarHBondContact OH-NE2 3.49Å |
| 365 | F | 78.3 | Confident | 83.7 | Confident | 154 Ų | 154 | 48.7 Ų | 48.7 | 68% | 0.675 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -72.2 | -31.8 | -178.6 | -78.1 | -68.9 | 0 | 0 | 0 | 113 | I361 A362 | I361-F365 HydrophobicContact CG2-CD2 3.81Å; I361-F365 HydrophobicContact CG2-CE2 3.62Å; I361-F365 WeakPolarHBondContact O-CD2 3.42Å; I361-F365 PolarHBondContact O-N 3.3Å; I361-F365 VanDerWaalsContact O-N 3.07Å; A362-F365 PolarHBondContact O-N 3.38Å |
| 366 | V | 71.3 | Confident | 83.3 | Confident | 56 Ų | 56 | 52.1 Ų | 52.1 | 34% | 0.339 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -86.8 | -48.4 | -171.8 | 169.6 | 0 | 0 | 0 | 0 | 112 | T301 A362 Y364 | T301-V366 VanDerWaalsContact CB-CG1 3.49Å; T301-V366 HydrophobicContact CG2-CB 3.88Å; T301-V366 HydrophobicContact CG2-CG1 3.36Å; T301-V366 HydrophobicContact CG2-CG2 3.95Å; T301-V366 WeakPolarHBondContact OG1-CG1 3.45Å; A362-V366 VanDerWaalsContact O-CB 3.23Å; A362-V366 WeakPolarHBondContact O-CB 3.41Å; A362-V366 WeakPolarHBondContact O-CG2 3.26Å; A362-V366 PolarHBondContact O-N 3.2Å; Y364-V366 VanDerWaalsContact C-N 3.34Å |
| 367 | S | 75.3 | Confident | 82.7 | Confident | 33 Ų | 33 | 53.9 Ų | 53.9 | 23% | 0.231 | 27% | 0.271 | C | S | . | . | trans | -99.7 | 111.7 | -171.3 | 173.1 | 0 | 0 | 0 | 0 | 110.8 | L363 K369 F370 K371 | L363-S367 PolarHBondContact O-N 2.84Å; S367-K369 PolarHBondContact O-N 3.04Å; S367-K369 VanDerWaalsContact O-N 3.1Å; S367-K369 PolarHBondContact OG-N 3.2Å; S367-F370 PolarHBondContact O-N 3.38Å; S367-F370 WeakPolarHBondContact OG-CD2 3.27Å; S367-F370 PolarHBondContact OG-N 3.02Å; S367-K371 WeakPolarHBondContact O-CB 3.06Å; S367-K371 PolarHBondContact O-N 3.33Å | ||
| 368 | K | 75.8 | Confident | 82.1 | Confident | 177 Ų | 177 | 58.1 Ų | 58.1 | 77% | 0.77 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -51.4 | -36.4 | 173.1 | -67.5 | -175.4 | -179.9 | -178.2 | 0 | 112.2 | N372 | K368-N372 PolarHBondContact O-N 3Å; K368-N372 PolarHBondContact O-OD1 2.93Å |
| 369 | K | 77.9 | Confident | 81.2 | Confident | 102 Ų | 102 | 59.8 Ų | 59.8 | 44% | 0.443 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -67.9 | -45.8 | 178.9 | -165.3 | 178 | -175.3 | -164.9 | 0 | 111.8 | C104 M105 S367 C373 | C104-K369 PolarHBondContact O-NZ 3.24Å; M105-K369 HydrophobicContact CE-CD 4.39Å; M105-K369 HydrophobicContact CE-CG 4.4Å; M105-K369 HydrophobicContact SD-CD 3.42Å; M105-K369 WeakPolarHBondContact SD-CD 3.14Å; M105-K369 WeakPolarHBondContact SD-CE 3.09Å; M105-K369 HydrophobicContact SD-CG 3.85Å; M105-K369 PolarHBondContact SD-NZ 3.04Å; S367-K369 PolarHBondContact O-N 3.04Å; S367-K369 VanDerWaalsContact O-N 3.1Å; S367-K369 PolarHBondContact OG-N 3.2Å; K369-C373 PolarHBondContact O-N 3.01Å; K369-C373 PolarHBondContact O-SG 3.25Å |
| 370 | F | 81.7 | Confident | 79.8 | Confident | 9 Ų | 9 | 63.7 Ų | 63.7 | 4% | 0.039 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -67.6 | -43.4 | 174.9 | -79.5 | -72 | 0 | 0 | 0 | 111.2 | L95 I98 I99 M105 N110 I113 S367 N372 C373 F374 | L95-F370 HydrophobicContact CD1-CD1 3.98Å; L95-F370 HydrophobicContact CD1-CE1 3.72Å; I98-F370 HydrophobicContact CG2-CD1 4.47Å; I99-F370 HydrophobicContact CD1-CE1 4.41Å; I99-F370 HydrophobicContact CG1-CE1 4.18Å; M105-F370 HydrophobicContact CE-CD1 3.52Å; M105-F370 HydrophobicContact CE-CD2 4.11Å; M105-F370 HydrophobicContact CE-CE1 3.2Å; M105-F370 HydrophobicContact CE-CE2 3.82Å; M105-F370 HydrophobicContact CE-CG 3.97Å; M105-F370 HydrophobicContact CE-CZ 3.36Å; N110-F370 WeakPolarHBondContact OD1-CZ 3.36Å; I113-F370 HydrophobicContact CD1-CE2 4.17Å; I113-F370 HydrophobicContact CD1-CZ 4.14Å; S367-F370 PolarHBondContact O-N 3.38Å; S367-F370 WeakPolarHBondContact OG-CD2 3.27Å; S367-F370 PolarHBondContact OG-N 3.02Å; F370-N372 VanDerWaalsContact C-N 3.35Å; F370-N372 PolarHBondContact O-N 2.02Å; F370-C373 PolarHBondContact O-N 2.94Å; F370-C373 VanDerWaalsContact O-N 3.1Å; F370-F374 HydrophobicContact CB-CD2 4.16Å; F370-F374 HydrophobicContact CB-CE2 4.18Å; F370-F374 HydrophobicContact CD1-CE2 4.44Å; F370-F374 WeakPolarHBondContact O-CD2 3.28Å; F370-F374 PolarHBondContact O-N 3.09Å |
| 371 | K | 84.4 | Confident | 77.8 | Confident | 83 Ų | 83 | 69.4 Ų | 69.4 | 36% | 0.361 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -49.4 | -53.4 | 175.2 | -171.3 | -179.1 | 175.6 | 178.1 | 0 | 112 | Y364 S367 C373 F374 Q375 | Y364-K371 HydrophobicContact CD2-CB 4.37Å; Y364-K371 HydrophobicContact CD2-CG 4.08Å; Y364-K371 HydrophobicContact CE1-CG 4.38Å; Y364-K371 HydrophobicContact CE2-CB 4.38Å; Y364-K371 HydrophobicContact CE2-CG 3.65Å; Y364-K371 WeakPolarHBondContact O-CB 2.9Å; S367-K371 WeakPolarHBondContact O-CB 3.06Å; S367-K371 PolarHBondContact O-N 3.33Å; K371-C373 VanDerWaalsContact C-N 3.32Å; K371-C373 PolarHBondContact O-N 3.35Å; K371-F374 PolarHBondContact O-N 3.48Å; K371-Q375 WeakPolarHBondContact O-CG 3.11Å; K371-Q375 PolarHBondContact O-N 3.04Å |
| 372 | N | 83.5 | Confident | 75.6 | Confident | 93 Ų | 93 | 71.4 Ų | 71.4 | 50% | 0.497 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.8 | -41.3 | -179.4 | -66.8 | -2.2 | 0 | 0 | 0 | 111.4 | K368 F370 Q375 S376 | K368-N372 PolarHBondContact O-N 3Å; K368-N372 PolarHBondContact O-OD1 2.93Å; F370-N372 VanDerWaalsContact C-N 3.35Å; F370-N372 PolarHBondContact O-N 2.02Å; N372-Q375 PolarHBondContact O-N 2.99Å; N372-S376 PolarHBondContact O-N 3.21Å; N372-S376 PolarHBondContact O-OG 3.3Å |
| 373 | C | 83.4 | Confident | 73.2 | Confident | 21 Ų | 21 | 74.8 Ų | 74.8 | 14% | 0.142 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -66.8 | -40.5 | 177.1 | -62.6 | 0 | 0 | 0 | 0 | 112.5 | I98 K369 F370 K371 S376 C377 | I98-C373 HydrophobicContact CB-CB 4.46Å; I98-C373 HydrophobicContact CD1-CB 4.01Å; I98-C373 HydrophobicContact CG1-CB 4.1Å; I98-C373 HydrophobicContact CG2-CB 3.52Å; K369-C373 PolarHBondContact O-N 3.01Å; K369-C373 PolarHBondContact O-SG 3.25Å; F370-C373 PolarHBondContact O-N 2.94Å; F370-C373 VanDerWaalsContact O-N 3.1Å; K371-C373 VanDerWaalsContact C-N 3.32Å; K371-C373 PolarHBondContact O-N 3.35Å; C373-S376 PolarHBondContact O-N 2.89Å; C373-C377 WeakPolarHBondContact O-CB 3.27Å; C373-C377 PolarHBondContact O-N 2.78Å; C373-C377 PolarHBondContact O-SG 3.23Å |
| 374 | F | 84.5 | Confident | 71 | Confident | 7 Ų | 7 | 83.9 Ų | 83.9 | 3% | 0.031 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 174.8 | -85.7 | -68.6 | 0 | 0 | 0 | 111.5 | T94 L95 I98 P360 Y364 F370 K371 C377 L378 | T94-F374 HydrophobicContact CG2-CD1 3.71Å; T94-F374 HydrophobicContact CG2-CE1 3.79Å; L95-F374 HydrophobicContact CB-CE1 4.49Å; L95-F374 HydrophobicContact CB-CZ 4.02Å; L95-F374 HydrophobicContact CD1-CE2 4.29Å; L95-F374 HydrophobicContact CD1-CZ 3.96Å; I98-F374 HydrophobicContact CD1-CB 4.31Å; I98-F374 HydrophobicContact CD1-CD1 3.55Å; I98-F374 HydrophobicContact CD1-CD2 4.05Å; I98-F374 HydrophobicContact CD1-CE1 3.79Å; I98-F374 HydrophobicContact CD1-CE2 4.26Å; I98-F374 HydrophobicContact CD1-CG 3.68Å; I98-F374 HydrophobicContact CD1-CZ 4.13Å; P360-F374 HydrophobicContact CB-CZ 4.13Å; Y364-F374 HydrophobicContact CD2-CB 3.56Å; Y364-F374 AromaticContact CD2-CD2 3.98Å; Y364-F374 HydrophobicContact CD2-CD2 3.98Å; Y364-F374 AromaticContact CD2-CG 3.98Å; Y364-F374 HydrophobicContact CD2-CG 3.98Å; Y364-F374 HydrophobicContact CE2-CB 3.93Å; F370-F374 HydrophobicContact CB-CD2 4.16Å; F370-F374 HydrophobicContact CB-CE2 4.18Å; F370-F374 HydrophobicContact CD1-CE2 4.44Å; F370-F374 WeakPolarHBondContact O-CD2 3.28Å; F370-F374 PolarHBondContact O-N 3.09Å; K371-F374 PolarHBondContact O-N 3.48Å; F374-C377 PolarHBondContact O-N 2.94Å; F374-L378 HydrophobicContact CD1-CD1 4.3Å; F374-L378 VanDerWaalsContact O-CB 3.3Å; F374-L378 WeakPolarHBondContact O-CB 3.38Å; F374-L378 WeakPolarHBondContact O-CG 3.35Å; F374-L378 PolarHBondContact O-N 3.1Å |
| 375 | Q | 85.3 | Confident | 68.6 | Low | 75 Ų | 75 | 85.3 Ų | 85.3 | 35% | 0.35 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.6 | -43 | 174.8 | -71.6 | 179.1 | -33.3 | 0 | 0 | 111.3 | Y364 K371 N372 C379 | Y364-Q375 HydrophobicContact CE2-CG 4.05Å; Y364-Q375 PolarHBondContact OH-NE2 3.49Å; K371-Q375 WeakPolarHBondContact O-CG 3.11Å; K371-Q375 PolarHBondContact O-N 3.04Å; N372-Q375 PolarHBondContact O-N 2.99Å; Q375-C379 VanDerWaalsContact O-CA 3.3Å; Q375-C379 WeakPolarHBondContact O-CA 2.92Å; Q375-C379 WeakPolarHBondContact O-CB 3.26Å; Q375-C379 PolarHBondContact O-N 3.2Å |
| 376 | S | 82.5 | Confident | 66.8 | Low | 72 Ų | 72 | 87.9 Ų | 87.9 | 50% | 0.503 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 172.1 | -63.9 | 0 | 0 | 0 | 0 | 111.9 | N372 C373 C380 | N372-S376 PolarHBondContact O-N 3.21Å; N372-S376 PolarHBondContact O-OG 3.3Å; C373-S376 PolarHBondContact O-N 2.89Å; S376-C380 WeakPolarHBondContact O-CB 3.31Å; S376-C380 PolarHBondContact O-N 3.15Å; S376-C380 VanDerWaalsContact O-N 3.12Å; S376-C380 PolarHBondContact O-SG 3.25Å |
| 377 | C | 79.3 | Confident | 64.9 | Low | 38 Ų | 38 | 90.4 Ų | 90.4 | 26% | 0.257 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70.5 | -37.9 | -176.4 | -73.7 | 0 | 0 | 0 | 0 | 114.1 | T94 I98 C373 F374 | T94-C377 HydrophobicContact CG2-CB 4.05Å; I98-C377 HydrophobicContact CG1-CB 4.4Å; C373-C377 WeakPolarHBondContact O-CB 3.27Å; C373-C377 PolarHBondContact O-N 2.78Å; C373-C377 PolarHBondContact O-SG 3.23Å; F374-C377 PolarHBondContact O-N 2.94Å |
| 378 | L | 78.1 | Confident | 62.9 | Low | 96 Ų | 96 | 96.2 Ų | 96.2 | 50% | 0.503 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -90.4 | -33.1 | -176.3 | -63.7 | 172 | 0 | 0 | 0 | 112.6 | V90 T94 F374 | V90-L378 HydrophobicContact CG1-CD2 4.49Å; T94-L378 HydrophobicContact CG2-CD2 4.24Å; T94-L378 HydrophobicContact CG2-CG 4.33Å; F374-L378 HydrophobicContact CD1-CD1 4.3Å; F374-L378 VanDerWaalsContact O-CB 3.3Å; F374-L378 WeakPolarHBondContact O-CB 3.38Å; F374-L378 WeakPolarHBondContact O-CG 3.35Å; F374-L378 PolarHBondContact O-N 3.1Å |
| 379 | C | 72.2 | Confident | 60.9 | Low | 67 Ų | 67 | 93.8 Ų | 93.8 | 45% | 0.453 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -100.3 | 4.7 | -178.3 | -49.4 | 0 | 0 | 0 | 0 | 113.5 | Q375 C381 C382 S383 | Q375-C379 VanDerWaalsContact O-CA 3.3Å; Q375-C379 WeakPolarHBondContact O-CA 2.92Å; Q375-C379 WeakPolarHBondContact O-CB 3.26Å; Q375-C379 PolarHBondContact O-N 3.2Å; C379-C381 PolarHBondContact O-N 2.86Å; C379-C381 VanDerWaalsContact O-N 3.16Å; C379-C382 CarbonylContact O-C 3.59Å; C379-C382 WeakPolarHBondContact O-CA 3.43Å; C379-C382 PolarHBondContact O-N 3.06Å; C379-S383 PolarHBondContact O-N 3.02Å |
| 380 | C | 55.8 | Low | 58.7 | Low | 87 Ų | 87 | 93.6 Ų | 93.6 | 59% | 0.588 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -13.3 | 171.6 | -99.1 | 0 | 0 | 0 | 0 | 113.6 | S376 C382 | S376-C380 WeakPolarHBondContact O-CB 3.31Å; S376-C380 PolarHBondContact O-N 3.15Å; S376-C380 VanDerWaalsContact O-N 3.12Å; S376-C380 PolarHBondContact O-SG 3.25Å; C380-C382 PolarHBondContact O-N 3.11Å |
| 381 | C | 44.2 | Very low | 56.2 | Low | 125 Ų | 125 | 98.2 Ų | 98.2 | 85% | 0.845 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | -9.7 | 165.7 | -60.9 | 0 | 0 | 0 | 0 | 113 | C379 | C379-C381 PolarHBondContact O-N 2.86Å; C379-C381 VanDerWaalsContact O-N 3.16Å |
| 382 | C | 41.8 | Very low | 53.6 | Low | 112 Ų | 112 | 102 Ų | 102 | 76% | 0.757 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.4 | -1.5 | -173.6 | -61.4 | 0 | 0 | 0 | 0 | 115.5 | C379 C380 | C379-C382 CarbonylContact O-C 3.59Å; C379-C382 WeakPolarHBondContact O-CA 3.43Å; C379-C382 PolarHBondContact O-N 3.06Å; C380-C382 PolarHBondContact O-N 3.11Å |
| 383 | S | 35.2 | Very low | 51.1 | Low | 81 Ų | 81 | 103.6 Ų | 103.6 | 57% | 0.566 | 61% | 0.612 | S | S | * | * | trans | -161.4 | 96.2 | 174.5 | -142.1 | 0 | 0 | 0 | 0 | 114.1 | C379 S385 | C379-S383 PolarHBondContact O-N 3.02Å; S383-S385 PolarHBondContact O-N 2.88Å | ||
| 384 | Q | 36.5 | Very low | 48.7 | Very low | 206 Ų | 206 | 111.6 Ų | 111.6 | 96% | 0.963 | 65% | 0.649 | S | S | * | * | trans | -72.5 | 98.4 | 146.6 | -84.2 | -179.3 | -0.9 | 0 | 0 | 107.3 | ||||
| 385 | S | 33.7 | Very low | 46.1 | Very low | 98 Ų | 98 | 119.1 Ų | 119.1 | 69% | 0.685 | 69% | 0.69 | S | S | * | * | trans | -140.9 | 102 | 160.6 | -161.2 | 0 | 0 | 0 | 0 | 111 | S383 | S383-S385 PolarHBondContact O-N 2.88Š| ||
| 386 | K | 40.2 | Very low | 43.5 | Very low | 208 Ų | 208 | 118.7 Ų | 118.7 | 90% | 0.904 | 71% | 0.706 | S | S | * | * | trans | 12.6 | 110 | 155.7 | -62.4 | 175.2 | 180 | 176.4 | 0 | 117.5 | ||||
| 387 | S | 31.1 | Very low | 41.1 | Very low | 109 Ų | 109 | 121.8 Ų | 121.8 | 76% | 0.762 | 72% | 0.721 | S | S | * | * | trans | -148.4 | 90.9 | 138.6 | 174.3 | 0 | 0 | 0 | 0 | 109.4 | V389 | S387-V389 PolarHBondContact O-N 3.22Š| ||
| 388 | L | 34.6 | Very low | 38.7 | Very low | 154 Ų | 154 | 124.8 Ų | 124.8 | 81% | 0.806 | 74% | 0.743 | S | S | * | * | trans | -64.6 | 105 | 166.8 | -163.1 | 84.5 | 0 | 0 | 0 | 107.8 | T390 | L388-T390 PolarHBondContact O-N 3.07Š| ||
| 389 | V | 33.4 | Very low | 36.6 | Very low | 126 Ų | 126 | 127 Ų | 127 | 76% | 0.764 | 75% | 0.754 | S | S | * | * | trans | -79.4 | 94.5 | 164.7 | 177.8 | 0 | 0 | 0 | 0 | 106.4 | S387 S391 | S387-V389 PolarHBondContact O-N 3.22Å; V389-S391 PolarHBondContact O-N 2.92Å; V389-S391 VanDerWaalsContact O-N 3.09Å | ||
| 390 | T | 31 | Very low | 34.7 | Very low | 98 Ų | 98 | 132.6 Ų | 132.6 | 60% | 0.601 | 77% | 0.773 | S | S | * | * | trans | -63.4 | 104.7 | 170.2 | -53.4 | 0 | 0 | 0 | 0 | 108.8 | L388 M392 | L388-T390 PolarHBondContact O-N 3.07Å; T390-M392 HydrophobicContact CG2-CG 4.23Å; T390-M392 PolarHBondContact O-N 2.99Å | ||
| 391 | S | 29.5 | Very low | 33.2 | Very low | 107 Ų | 107 | 139.8 Ų | 139.8 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | -81 | 102.1 | 164.1 | 55.1 | 0 | 0 | 0 | 0 | 108.7 | V389 | V389-S391 PolarHBondContact O-N 2.92Å; V389-S391 VanDerWaalsContact O-N 3.09Å | ||
| 392 | M | 30 | Very low | 32.4 | Very low | 163 Ų | 163 | 142.4 Ų | 142.4 | 80% | 0.803 | 79% | 0.785 | S | S | * | * | trans | -83 | 135.9 | 162.9 | -78.8 | -162 | 158.1 | 0 | 0 | 110.1 | T390 | T390-M392 HydrophobicContact CG2-CG 4.23Å; T390-M392 PolarHBondContact O-N 2.99Å | ||
| 393 | P | 31.5 | Very low | 31.7 | Very low | 125 Ų | 125 | 145.1 Ų | 145.1 | 81% | 0.812 | 79% | 0.792 | S | S | * | * | trans | -83.8 | 131.7 | 168 | 32.5 | -27.6 | 0 | 0 | 0 | 109.6 | ||||
| 394 | M | 32.2 | Very low | 31.4 | Very low | 189 Ų | 189 | 148.7 Ų | 148.7 | 93% | 0.931 | 80% | 0.8 | S | S | * | * | trans | -112.4 | 111.5 | 168.1 | -93.5 | -118.4 | 178.6 | 0 | 0 | 109.1 | ||||
| 395 | N | 29 | Very low | 31.1 | Very low | 166 Ų | 166 | 148 Ų | 148 | 89% | 0.888 | 80% | 0.797 | S | S | * | * | trans | -102.6 | 131.8 | 160.2 | -112.1 | 1 | 0 | 0 | 0 | 107.4 | ||||
| 396 | G | 31.2 | Very low | 30.8 | Very low | 66 Ų | 66 | 150.4 Ų | 150.4 | 68% | 0.68 | 80% | 0.801 | S | S | * | * | trans | 73.5 | 120.6 | 143 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 397 | T | 32 | Very low | 30.2 | Very low | 136 Ų | 136 | 147.6 Ų | 147.6 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | 74.3 | 109.2 | 146 | 40.3 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 398 | S | 30.3 | Very low | 30.1 | Very low | 101 Ų | 101 | 151.3 Ų | 151.3 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | trans | 36.2 | 123.1 | 138.1 | 60.3 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 399 | I | 32.4 | Very low | 29.8 | Very low | 142 Ų | 142 | 150.6 Ų | 150.6 | 73% | 0.728 | 80% | 0.798 | S | S | * | * | -172.2 | 133.8 | 111.7 | -86.4 | 147.9 | 0 | 0 | 0 | 108.3 | |||||
| 400 | Q | 33 | Very low | 29.8 | Very low | 186 Ų | 186 | 151 Ų | 151 | 87% | 0.869 | 80% | 0.801 | S | S | * | * | trans | -57.4 | 121.7 | 172.1 | -175.2 | 176 | 7.2 | 0 | 0 | 110.9 | ||||
| 401 | W | 25.4 | Very low | 29.7 | Very low | 237 Ų | 237 | 153.5 Ų | 153.5 | 90% | 0.898 | 81% | 0.81 | S | S | * | * | trans | -113.7 | 107.3 | 169.9 | -82.2 | 76.3 | 0 | 0 | 0 | 110.7 | ||||
| 402 | K | 26.2 | Very low | 29.8 | Very low | 181 Ų | 181 | 160 Ų | 160 | 79% | 0.787 | 82% | 0.819 | S | S | * | * | trans | -69.3 | 126.7 | 169.6 | -174.4 | 176.5 | -178.2 | 180 | 0 | 107.8 | Q404 | K402-Q404 PolarHBondContact O-N 3.11Å; K402-Q404 VanDerWaalsContact O-N 3.1Å | ||
| 403 | N | 28.2 | Very low | 29.7 | Very low | 168 Ų | 168 | 157.6 Ų | 157.6 | 90% | 0.898 | 82% | 0.818 | S | S | * | * | trans | -61.3 | 112.1 | 168.8 | -84.8 | -17 | 0 | 0 | 0 | 108.7 | ||||
| 404 | Q | 27.1 | Very low | 29.8 | Very low | 157 Ų | 157 | 157.4 Ų | 157.4 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | trans | -118.5 | 100.4 | 164.6 | -169.3 | 166 | -4.3 | 0 | 0 | 106.1 | K402 L406 | K402-Q404 PolarHBondContact O-N 3.11Å; K402-Q404 VanDerWaalsContact O-N 3.1Å; Q404-L406 PolarHBondContact O-N 3.36Å | ||
| 405 | E | 31.9 | Very low | 29.8 | Very low | 191 Ų | 191 | 156.6 Ų | 156.6 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | trans | -60.9 | 118.3 | 162.9 | -73.8 | -176.1 | 148.9 | 0 | 0 | 107.6 | ||||
| 406 | L | 27.3 | Very low | 30 | Very low | 148 Ų | 148 | 157.9 Ų | 157.9 | 78% | 0.775 | 81% | 0.811 | S | S | * | * | trans | -134.8 | 117.6 | 161.6 | -140.3 | 92.6 | 0 | 0 | 0 | 109.6 | Q404 | Q404-L406 PolarHBondContact O-N 3.36Š| ||
| 407 | N | 27.8 | Very low | 30 | Very low | 149 Ų | 149 | 160.6 Ų | 160.6 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -29.6 | 138.1 | 164.9 | -71.2 | -33.8 | 0 | 0 | 0 | 114.8 | ||||
| 408 | H | 28.5 | Very low | 30.2 | Very low | 187 Ų | 187 | 159.8 Ų | 159.8 | 87% | 0.866 | 81% | 0.809 | S | S | * | * | trans | -132.3 | 110.3 | 141.5 | -133.5 | -59.5 | 0 | 0 | 0 | 110 | ||||
| 409 | N | 28.4 | Very low | 30.6 | Very low | 139 Ų | 139 | 163 Ų | 163 | 74% | 0.743 | 82% | 0.817 | S | S | * | * | trans | -57 | 145.1 | 161.9 | -80.5 | -20.9 | 0 | 0 | 0 | 109.8 | ||||
| 410 | T | 32.4 | Very low | 30.9 | Very low | 135 Ų | 135 | 167.3 Ų | 167.3 | 83% | 0.828 | 84% | 0.841 | S | S | * | * | trans | -132 | 131.4 | 151.2 | -35.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 411 | D | 29.3 | Very low | 30.8 | Very low | 150 Ų | 150 | 166.4 Ų | 166.4 | 80% | 0.802 | 84% | 0.84 | S | S | * | * | trans | -55.7 | 142.1 | -168.3 | -61.7 | -64.4 | 0 | 0 | 0 | 115.3 | ||||
| 412 | R | 31 | Very low | 31.1 | Very low | 245 Ų | 245 | 162.6 Ų | 162.6 | 93% | 0.925 | 84% | 0.837 | S | S | * | * | trans | -149.2 | 122.9 | 133.9 | -132.1 | 174.5 | 179.7 | 177.5 | -0.6 | 111.8 | ||||
| 413 | S | 29.6 | Very low | 31.3 | Very low | 111 Ų | 111 | 161.6 Ų | 161.6 | 78% | 0.776 | 84% | 0.84 | S | S | * | * | trans | -54.8 | 137.2 | 178.3 | 56.5 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 414 | S | 32.8 | Very low | 31.5 | Very low | 122 Ų | 122 | 161.2 Ų | 161.2 | 85% | 0.853 | 84% | 0.836 | S | S | * | * | trans | -161.5 | 102.2 | 139.2 | 32 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 415 | H | 31.3 | Very low | 31.8 | Very low | 171 Ų | 171 | 161.5 Ų | 161.5 | 79% | 0.792 | 84% | 0.843 | S | S | * | * | trans | -60.7 | 130.5 | 162.4 | -105.1 | -83.4 | 0 | 0 | 0 | 110.6 | ||||
| 416 | K | 33.1 | Very low | 31.8 | Very low | 194 Ų | 194 | 159.5 Ų | 159.5 | 84% | 0.843 | 84% | 0.839 | S | S | * | * | -177.8 | 98.4 | 122.2 | -110.5 | 178.3 | 172.1 | 179 | 0 | 111.7 | |||||
| 417 | D | 32.8 | Very low | 32.1 | Very low | 123 Ų | 123 | 160.4 Ų | 160.4 | 66% | 0.658 | 84% | 0.844 | S | S | * | * | 38.1 | 134.1 | 127.6 | -53.1 | -32.3 | 0 | 0 | 0 | 122.7 | |||||
| 418 | S | 35.2 | Very low | 32.4 | Very low | 118 Ų | 118 | 161.2 Ų | 161.2 | 83% | 0.825 | 85% | 0.848 | S | S | * | * | trans | 84.7 | 105 | 138.3 | 47.2 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 419 | I | 39.7 | Very low | 32.8 | Very low | 168 Ų | 168 | 159.1 Ų | 159.1 | 86% | 0.862 | 85% | 0.846 | S | S | * | * | trans | -82.6 | 126 | 145.7 | -68.3 | 169.6 | 0 | 0 | 0 | 107.4 | ||||
| 420 | N | 37.7 | Very low | 33.2 | Very low | 233 Ų | 233 | 160.9 Ų | 160.9 | 100% | 1.246 | 86% | 0.855 | S | S | * | * | trans | -156.5 | 0 | 134.2 | -109 | 4.4 | 0 | 0 | 0 | 109 |
Retrieved 420 of 420 residues in 95.1 ms
(Link to these results)