| 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 | 45.2 | Very low | 58.9 | Low | 236 Ų | 236 | 136.7 Ų | 136.7 | 100% | 1.163 | 77% | 0.765 | S | S | * | * | 0 | 113.1 | 0 | -67.4 | 171.5 | 73.9 | 0 | 0 | 107.1 | |||||
| 2 | N | 52.5 | Low | 58.2 | Low | 144 Ų | 144 | 132.9 Ų | 132.9 | 77% | 0.77 | 75% | 0.751 | S | S | * | * | trans | -86.9 | 117.7 | -179.1 | -69.9 | -22.3 | 0 | 0 | 0 | 108.9 | L4 D5 | N2-L4 PolarHBondContact O-N 3.26Å; N2-D5 PolarHBondContact O-N 3.28Å | ||
| 3 | A | 60.3 | Low | 58.2 | Low | 103 Ų | 103 | 140 Ų | 140 | 85% | 0.851 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | 16 | -169.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 4 | L | 64.7 | Low | 58.1 | Low | 134 Ų | 134 | 134.9 Ų | 134.9 | 70% | 0.702 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.7 | 3.8 | -177.7 | -62.6 | 176.8 | 0 | 0 | 0 | 113 | N2 G6 | N2-L4 PolarHBondContact O-N 3.26Å; L4-G6 PolarHBondContact O-N 2.95Å; L4-G6 VanDerWaalsContact O-N 3.09Å |
| 5 | D | 54.5 | Low | 57.5 | Low | 157 Ų | 157 | 135.9 Ų | 135.9 | 84% | 0.84 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | 95.3 | 178.8 | -144.7 | -0.2 | 0 | 0 | 0 | 109.3 | N2 | N2-D5 PolarHBondContact O-N 3.28Š|
| 6 | G | 62.9 | Low | 57.4 | Low | 71 Ų | 71 | 135.6 Ų | 135.6 | 73% | 0.732 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 125.8 | 7.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 117.3 | L4 P8 | L4-G6 PolarHBondContact O-N 2.95Å; L4-G6 VanDerWaalsContact O-N 3.09Å; G6-P8 VanDerWaalsContact O-CD 3.3Å; G6-P8 WeakPolarHBondContact O-CD 3.3Å |
| 7 | V | 60.8 | Low | 57.3 | Low | 83 Ų | 83 | 135.4 Ų | 135.4 | 50% | 0.503 | 75% | 0.754 | S | S | . | * | trans | -85.9 | 113.9 | 171.5 | -177.3 | 0 | 0 | 0 | 0 | 109.9 | F9 | V7-F9 HydrophobicContact CB-CD1 4.33Å; V7-F9 HydrophobicContact CB-CE1 4.35Å; V7-F9 HydrophobicContact CG1-CD1 4.3Å; V7-F9 WeakPolarHBondContact O-CD1 3.16Å; V7-F9 WeakPolarHBondContact O-CE1 3.16Å; V7-F9 PolarHBondContact O-N 3.13Å | ||
| 8 | P | 63 | Low | 57 | Low | 119 Ų | 119 | 130.9 Ų | 130.9 | 77% | 0.773 | 74% | 0.743 | S | S | * | * | trans | -79.2 | 84.6 | 179.3 | 31.9 | -34.8 | 0 | 0 | 0 | 111.3 | G6 K10 | G6-P8 VanDerWaalsContact O-CD 3.3Å; G6-P8 WeakPolarHBondContact O-CD 3.3Å; P8-K10 PolarHBondContact O-N 2.93Å | ||
| 9 | F | 60.4 | Low | 57 | Low | 152 Ų | 152 | 131.7 Ų | 131.7 | 67% | 0.667 | 75% | 0.751 | S | S | * | * | trans | -68.6 | 112 | 171.6 | 17.2 | -96.9 | 0 | 0 | 0 | 110.7 | V7 L11 | V7-F9 HydrophobicContact CB-CD1 4.33Å; V7-F9 HydrophobicContact CB-CE1 4.35Å; V7-F9 HydrophobicContact CG1-CD1 4.3Å; V7-F9 WeakPolarHBondContact O-CD1 3.16Å; V7-F9 WeakPolarHBondContact O-CE1 3.16Å; V7-F9 PolarHBondContact O-N 3.13Å; F9-L11 HydrophobicContact CB-CD1 4.38Å; F9-L11 HydrophobicContact CD2-CD1 4.44Å; F9-L11 PolarHBondContact O-N 2.78Å; F9-L11 VanDerWaalsContact O-N 3.07Å | ||
| 10 | K | 63.2 | Low | 57.2 | Low | 203 Ų | 203 | 133.5 Ų | 133.5 | 88% | 0.883 | 75% | 0.753 | S | S | * | * | trans | -76.9 | 89.4 | 171 | -71.6 | -162 | 177 | -174.7 | 0 | 110.3 | P8 | P8-K10 PolarHBondContact O-N 2.93Š| ||
| 11 | L | 60 | Low | 57.2 | Low | 102 Ų | 102 | 132.6 Ų | 132.6 | 53% | 0.534 | 75% | 0.753 | S | S | . | * | trans | -63.2 | 135.6 | 164.5 | -96.2 | 70.3 | 0 | 0 | 0 | 110 | F9 K13 F15 | F9-L11 HydrophobicContact CB-CD1 4.38Å; F9-L11 HydrophobicContact CD2-CD1 4.44Å; F9-L11 PolarHBondContact O-N 2.78Å; F9-L11 VanDerWaalsContact O-N 3.07Å; L11-K13 PolarHBondContact O-N 3.5Å; L11-F15 HydrophobicContact CD2-CB 4.16Å | ||
| 12 | P | 51.3 | Low | 58 | Low | 91 Ų | 91 | 129.1 Ų | 129.1 | 59% | 0.591 | 74% | 0.738 | S | S | * | * | trans | -57.4 | 137.5 | 166.3 | -22.4 | 33.6 | 0 | 0 | 0 | 110.3 | G14 F15 | P12-G14 PolarHBondContact O-N 3.09Å; P12-F15 HydrophobicContact CB-CD2 4.37Å; P12-F15 HydrophobicContact CG-CD2 4.41Å; P12-F15 PolarHBondContact O-N 2.97Å; P12-F15 VanDerWaalsContact O-N 3.13Å | ||
| 13 | K | 57.8 | Low | 58.3 | Low | 225 Ų | 225 | 128 Ų | 128 | 98% | 0.978 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | 18 | -165.9 | -137.7 | 172.9 | -174.3 | -179.6 | 0 | 115.8 | L11 | L11-K13 PolarHBondContact O-N 3.5Š|
| 14 | G | 57.2 | Low | 58.3 | Low | 68 Ų | 68 | 125.6 Ų | 125.6 | 70% | 0.701 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.1 | -2.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | P12 V16 | P12-G14 PolarHBondContact O-N 3.09Å; G14-V16 VanDerWaalsContact C-N 3.26Å; G14-V16 PolarHBondContact O-N 3.23Å |
| 15 | F | 49.7 | Very low | 58 | Low | 151 Ų | 151 | 124.9 Ų | 124.9 | 66% | 0.662 | 73% | 0.727 | S | S | * | * | trans | -77.3 | 77.6 | 172.2 | -89.9 | -87.9 | 0 | 0 | 0 | 110.9 | L11 P12 I17 | L11-F15 HydrophobicContact CD2-CB 4.16Å; P12-F15 HydrophobicContact CB-CD2 4.37Å; P12-F15 HydrophobicContact CG-CD2 4.41Å; P12-F15 PolarHBondContact O-N 2.97Å; P12-F15 VanDerWaalsContact O-N 3.13Å; F15-I17 PolarHBondContact O-N 3.09Å | ||
| 16 | V | 54.8 | Low | 58 | Low | 130 Ų | 130 | 126.4 Ų | 126.4 | 79% | 0.788 | 73% | 0.73 | S | S | * | * | trans | -71.3 | 106.6 | 155.3 | 178.3 | 0 | 0 | 0 | 0 | 106.2 | G14 G18 | G14-V16 VanDerWaalsContact C-N 3.26Å; G14-V16 PolarHBondContact O-N 3.23Å; V16-G18 PolarHBondContact O-N 3.07Å | ||
| 17 | I | 57 | Low | 57.9 | Low | 133 Ų | 133 | 130.2 Ų | 130.2 | 68% | 0.682 | 73% | 0.732 | S | S | * | * | trans | -71.6 | 92 | 166 | -59.3 | 173.3 | 0 | 0 | 0 | 105.7 | F15 T19 | F15-I17 PolarHBondContact O-N 3.09Å; I17-T19 PolarHBondContact O-N 2.91Å | ||
| 18 | G | 51.2 | Low | 58 | Low | 54 Ų | 54 | 131.5 Ų | 131.5 | 56% | 0.557 | 75% | 0.745 | S | S | * | * | trans | -61.9 | 120.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | V16 E20 | V16-G18 PolarHBondContact O-N 3.07Å; G18-E20 PolarHBondContact O-N 3.39Å | ||
| 19 | T | 57.7 | Low | 58.1 | Low | 147 Ų | 147 | 131.6 Ų | 131.6 | 90% | 0.902 | 74% | 0.743 | S | S | * | * | trans | -76 | 33 | -179.9 | -20.4 | 0 | 0 | 0 | 0 | 112.5 | I17 | I17-T19 PolarHBondContact O-N 2.91Š| ||
| 20 | E | 60.6 | Low | 58.5 | Low | 166 Ų | 166 | 128.1 Ų | 128.1 | 78% | 0.776 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -101.6 | 124.7 | 175.3 | -159.7 | -177.6 | -162.5 | 0 | 0 | 109 | G18 L22 | G18-E20 PolarHBondContact O-N 3.39Å; E20-L22 PolarHBondContact O-N 2.93Å; E20-L22 VanDerWaalsContact O-N 3.09Å |
| 21 | P | 56.8 | Low | 58.8 | Low | 116 Ų | 116 | 122.2 Ų | 122.2 | 75% | 0.753 | 72% | 0.718 | S | S | * | * | trans | -68 | 110.1 | 175.4 | 27.8 | -32.6 | 0 | 0 | 0 | 109.5 | ||||
| 22 | L | 61.6 | Low | 59 | Low | 163 Ų | 163 | 120.5 Ų | 120.5 | 85% | 0.853 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 128 | 165.5 | -92 | 148.4 | 0 | 0 | 0 | 109.1 | E20 G24 | E20-L22 PolarHBondContact O-N 2.93Å; E20-L22 VanDerWaalsContact O-N 3.09Å; L22-G24 PolarHBondContact O-N 3.1Å |
| 23 | P | 58.4 | Low | 59.8 | Low | 119 Ų | 119 | 118.4 Ų | 118.4 | 77% | 0.773 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 127.4 | 176 | 24.1 | -32.5 | 0 | 0 | 0 | 109 | ||
| 24 | G | 61.1 | Low | 60.4 | Low | 54 Ų | 54 | 114.8 Ų | 114.8 | 56% | 0.557 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -61 | 149 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | L22 E26 | L22-G24 PolarHBondContact O-N 3.1Å; G24-E26 PolarHBondContact O-N 3.23Å; G24-E26 VanDerWaalsContact O-N 3.1Å |
| 25 | P | 58.3 | Low | 60.8 | Low | 119 Ų | 119 | 117.1 Ų | 117.1 | 77% | 0.773 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 119.1 | 178.8 | 24.6 | -33.2 | 0 | 0 | 0 | 110 | L27 | P25-L27 PolarHBondContact O-N 2.9Š|
| 26 | E | 54.1 | Low | 61.7 | Low | 189 Ų | 189 | 115.8 Ų | 115.8 | 88% | 0.883 | 69% | 0.69 | S | S | * | * | trans | -68.1 | 93.1 | 177.2 | -67.8 | -171.3 | 162 | 0 | 0 | 109.7 | G24 S28 | G24-E26 PolarHBondContact O-N 3.23Å; G24-E26 VanDerWaalsContact O-N 3.1Å; E26-S28 VanDerWaalsContact C-N 3.32Å; E26-S28 PolarHBondContact O-N 3Å | ||
| 27 | L | 61.5 | Low | 62.4 | Low | 151 Ų | 151 | 117 Ų | 117 | 79% | 0.791 | 69% | 0.692 | S | S | * | * | trans | -74.4 | 87.5 | 171.5 | -67.6 | 174.9 | 0 | 0 | 0 | 109 | P25 V29 | P25-L27 PolarHBondContact O-N 2.9Å; L27-V29 PolarHBondContact O-N 2.94Å | ||
| 28 | S | 63.3 | Low | 62.8 | Low | 110 Ų | 110 | 113.6 Ų | 113.6 | 77% | 0.769 | 69% | 0.689 | S | S | * | * | trans | -66.6 | 92.8 | 169.2 | 50.7 | 0 | 0 | 0 | 0 | 110.1 | E26 P30 | E26-S28 VanDerWaalsContact C-N 3.32Å; E26-S28 PolarHBondContact O-N 3Å; S28-P30 VanDerWaalsContact O-CD 3.29Å; S28-P30 WeakPolarHBondContact O-CD 3.29Å | ||
| 29 | V | 65.6 | Low | 63.7 | Low | 121 Ų | 121 | 114.4 Ų | 114.4 | 73% | 0.733 | 69% | 0.686 | S | S | * | * | trans | -68.7 | 118.7 | 167.4 | -176.9 | 0 | 0 | 0 | 0 | 107.2 | L27 | L27-V29 PolarHBondContact O-N 2.94Š| ||
| 30 | P | 67.5 | Low | 64.7 | Low | 78 Ų | 78 | 115.8 Ų | 115.8 | 51% | 0.506 | 68% | 0.684 | S | S | . | * | trans | -59.6 | 158.2 | 176.4 | -22.5 | 34.5 | 0 | 0 | 0 | 111 | S28 C32 L35 | S28-P30 VanDerWaalsContact O-CD 3.29Å; S28-P30 WeakPolarHBondContact O-CD 3.29Å; P30-C32 PolarHBondContact O-N 2.73Å; P30-C32 PolarHBondContact O-SG 3.37Å; P30-C32 VanDerWaalsContact O-SG 3.37Å; P30-L35 HydrophobicContact CB-CD1 4.35Å | ||
| 31 | P | 70.5 | Confident | 65.6 | Low | 80 Ų | 80 | 113.5 Ų | 113.5 | 52% | 0.519 | 67% | 0.674 | S | S | . | * | trans | -69.1 | 80.2 | 174.3 | 29.6 | -34.6 | 0 | 0 | 0 | 110.4 | G33 E34 L35 | P31-G33 PolarHBondContact O-N 3.19Å; P31-E34 HydrophobicContact CB-CG 4.41Å; P31-E34 PolarHBondContact O-N 3.19Å; P31-L35 PolarHBondContact O-N 3.17Å | ||
| 32 | C | 64.1 | Low | 66.7 | Low | 66 Ų | 66 | 113.1 Ų | 113.1 | 45% | 0.446 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -57.2 | -24.3 | -176.9 | -63.3 | 0 | 0 | 0 | 0 | 113 | P30 L35 L36 | P30-C32 PolarHBondContact O-N 2.73Å; P30-C32 PolarHBondContact O-SG 3.37Å; P30-C32 VanDerWaalsContact O-SG 3.37Å; C32-L35 PolarHBondContact O-N 3.03Å; C32-L36 WeakPolarHBondContact O-CB 3.24Å; C32-L36 VanDerWaalsContact O-CG 3.24Å; C32-L36 WeakPolarHBondContact O-CG 3.39Å; C32-L36 PolarHBondContact O-N 3.49Å |
| 33 | G | 67.9 | Low | 68 | Low | 47 Ų | 47 | 111.3 Ų | 111.3 | 49% | 0.485 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -60.1 | -45.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | P31 L36 L37 | P31-G33 PolarHBondContact O-N 3.19Å; G33-L36 PolarHBondContact O-N 3.41Å; G33-L37 WeakPolarHBondContact O-CD1 3.5Å; G33-L37 PolarHBondContact O-N 3.45Å |
| 34 | E | 69.8 | Low | 69.2 | Low | 149 Ų | 149 | 107.5 Ų | 107.5 | 70% | 0.696 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -69.2 | -37.8 | 179.6 | -65.7 | 178.9 | -173.1 | 0 | 0 | 111.5 | P31 L36 L37 G38 | P31-E34 HydrophobicContact CB-CG 4.41Å; P31-E34 PolarHBondContact O-N 3.19Å; E34-L36 VanDerWaalsContact C-N 3.35Å; E34-L36 PolarHBondContact O-N 3.12Å; E34-L37 PolarHBondContact O-N 2.94Å; E34-G38 PolarHBondContact O-N 3.09Å |
| 35 | L | 66.3 | Low | 70.4 | Confident | 116 Ų | 116 | 111.3 Ų | 111.3 | 61% | 0.607 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -62.6 | -38.9 | 173.3 | -78.7 | 164.4 | 0 | 0 | 0 | 112.6 | P30 P31 C32 S39 | P30-L35 HydrophobicContact CB-CD1 4.35Å; P31-L35 PolarHBondContact O-N 3.17Å; C32-L35 PolarHBondContact O-N 3.03Å; L35-S39 WeakPolarHBondContact O-CB 3.28Å; L35-S39 PolarHBondContact O-N 2.98Å; L35-S39 PolarHBondContact O-OG 3.46Å |
| 36 | L | 67.1 | Low | 72 | Confident | 123 Ų | 123 | 108.9 Ų | 108.9 | 64% | 0.644 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -77 | -32 | 178.5 | -71.9 | 169 | 0 | 0 | 0 | 113.1 | C32 G33 E34 G38 S39 | C32-L36 WeakPolarHBondContact O-CB 3.24Å; C32-L36 VanDerWaalsContact O-CG 3.24Å; C32-L36 WeakPolarHBondContact O-CG 3.39Å; C32-L36 PolarHBondContact O-N 3.49Å; G33-L36 PolarHBondContact O-N 3.41Å; E34-L36 VanDerWaalsContact C-N 3.35Å; E34-L36 PolarHBondContact O-N 3.12Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-S39 WeakPolarHBondContact CA-OG 3.14Å; L36-S39 PolarHBondContact O-OG 2.97Å |
| 37 | L | 69.9 | Low | 73.5 | Confident | 157 Ų | 157 | 107.2 Ų | 107.2 | 82% | 0.822 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -72.5 | -29.2 | 171.6 | -90.9 | 77.9 | 0 | 0 | 0 | 112 | G33 E34 | G33-L37 WeakPolarHBondContact O-CD1 3.5Å; G33-L37 PolarHBondContact O-N 3.45Å; E34-L37 PolarHBondContact O-N 2.94Å |
| 38 | G | 65 | Low | 74.6 | Confident | 61 Ų | 61 | 108.2 Ų | 108.2 | 63% | 0.629 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -82 | -20.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | E34 L36 M40 | E34-G38 PolarHBondContact O-N 3.09Å; L36-G38 VanDerWaalsContact C-N 3.34Å; G38-M40 PolarHBondContact O-N 3.49Å |
| 39 | S | 71.8 | Confident | 75.8 | Confident | 71 Ų | 71 | 105.1 Ų | 105.1 | 50% | 0.497 | 57% | 0.572 | S | S | . | * | trans | -77.8 | 90.1 | 177 | 63.4 | 0 | 0 | 0 | 0 | 111.1 | L35 L36 H41 | L35-S39 WeakPolarHBondContact O-CB 3.28Å; L35-S39 PolarHBondContact O-N 2.98Å; L35-S39 PolarHBondContact O-OG 3.46Å; L36-S39 WeakPolarHBondContact CA-OG 3.14Å; L36-S39 PolarHBondContact O-OG 2.97Å; S39-H41 PolarHBondContact O-N 3.32Å | ||
| 40 | M | 78 | Confident | 76.6 | Confident | 175 Ų | 175 | 105 Ų | 105 | 86% | 0.862 | 57% | 0.567 | S | S | * | * | trans | -66.4 | 122.1 | 160.4 | -64.7 | -157.3 | -57.6 | 0 | 0 | 108.6 | G38 D42 | G38-M40 PolarHBondContact O-N 3.49Å; M40-D42 PolarHBondContact O-N 3.48Å; M40-D42 VanDerWaalsContact O-N 3.11Å | ||
| 41 | H | 79.6 | Confident | 77.3 | Confident | 118 Ų | 118 | 108.1 Ų | 108.1 | 55% | 0.546 | 57% | 0.573 | S | S | . | * | trans | -69 | 106.2 | 173.3 | -172.6 | 82.8 | 0 | 0 | 0 | 108.9 | S39 F43 E46 | S39-H41 PolarHBondContact O-N 3.32Å; H41-F43 AromaticContact CD2-CD1 3.64Å; H41-F43 AromaticContact CD2-CE1 3.6Å; H41-F43 AromaticContact CD2-CE2 3.99Å; H41-F43 AromaticContact CD2-CG 3.86Å; H41-F43 AromaticContact CD2-CZ 3.78Å; H41-F43 AromaticContact NE2-CD1 3.93Å; H41-F43 WeakPolarHBondContact O-CD2 3.47Å; H41-F43 PolarHBondContact O-N 3.02Å; H41-E46 IonicContact CD2-OE1 2.78Å; H41-E46 IonicContact CE1-OE1 3.52Å; H41-E46 IonicContact NE2-OE1 3.77Å; H41-E46 PolarHBondContact NE2-OE1 2.95Å; H41-E46 IonicContact NE2-OE2 3.65Å | ||
| 42 | D | 79.5 | Confident | 77.6 | Confident | 108 Ų | 108 | 112.6 Ų | 112.6 | 58% | 0.578 | 58% | 0.579 | S | S | * | * | trans | -80.1 | 113.6 | 172.7 | 77 | -58.9 | 0 | 0 | 0 | 108.4 | M40 S44 | M40-D42 PolarHBondContact O-N 3.48Å; M40-D42 VanDerWaalsContact O-N 3.11Å; D42-S44 PolarHBondContact O-N 3.05Å; D42-S44 WeakPolarHBondContact OD2-CB 3.44Å; D42-S44 PolarHBondContact OD2-OG 3.23Å | ||
| 43 | F | 87.8 | Confident | 78.4 | Confident | 126 Ų | 126 | 111.9 Ų | 111.9 | 55% | 0.553 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | 37 | -178.7 | -68.1 | -89.1 | 0 | 0 | 0 | 112.9 | H41 E46 R47 | H41-F43 AromaticContact CD2-CD1 3.64Å; H41-F43 AromaticContact CD2-CE1 3.6Å; H41-F43 AromaticContact CD2-CE2 3.99Å; H41-F43 AromaticContact CD2-CG 3.86Å; H41-F43 AromaticContact CD2-CZ 3.78Å; H41-F43 AromaticContact NE2-CD1 3.93Å; H41-F43 WeakPolarHBondContact O-CD2 3.47Å; H41-F43 PolarHBondContact O-N 3.02Å; F43-E46 WeakPolarHBondContact CA-OE2 3.14Å; F43-E46 HydrophobicContact CB-CB 4.48Å; F43-E46 HydrophobicContact CD1-CG 4.2Å; F43-R47 VanDerWaalsContact O-CB 3.3Å; F43-R47 WeakPolarHBondContact O-CB 3.29Å; F43-R47 WeakPolarHBondContact O-CG 3.42Å; F43-R47 PolarHBondContact O-N 3.22Å; F43-R47 PolarHBondContact O-NE 3Å |
| 44 | S | 85.1 | Confident | 78.8 | Confident | 38 Ų | 38 | 115.5 Ų | 115.5 | 27% | 0.266 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -79.5 | -26.5 | -174.6 | -57.6 | 0 | 0 | 0 | 0 | 112 | D42 R47 R48 | D42-S44 PolarHBondContact O-N 3.05Å; D42-S44 WeakPolarHBondContact OD2-CB 3.44Å; D42-S44 PolarHBondContact OD2-OG 3.23Å; S44-R47 PolarHBondContact OG-NH2 3.46Å; S44-R48 WeakPolarHBondContact O-CB 3.21Å; S44-R48 WeakPolarHBondContact O-CD 3.3Å; S44-R48 WeakPolarHBondContact O-CG 3.32Å; S44-R48 PolarHBondContact O-N 3.03Å; S44-R48 VanDerWaalsContact O-N 3.13Å |
| 45 | L | 85.7 | Confident | 78.9 | Confident | 134 Ų | 134 | 111.2 Ų | 111.2 | 70% | 0.702 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -72 | -43.8 | 172.3 | -169.3 | 155.9 | 0 | 0 | 0 | 110.1 | R48 A49 | L45-R48 PolarHBondContact O-N 2.96Å; L45-A49 WeakPolarHBondContact O-CB 3.48Å; L45-A49 PolarHBondContact O-N 3.34Å |
| 46 | E | 92 | Very high | 79.1 | Confident | 69 Ų | 69 | 109.8 Ų | 109.8 | 32% | 0.322 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.1 | -47.3 | 178.4 | -61.4 | 86 | 159.9 | 0 | 0 | 110.9 | H41 F43 R48 A49 L50 | H41-E46 IonicContact CD2-OE1 2.78Å; H41-E46 IonicContact CE1-OE1 3.52Å; H41-E46 IonicContact NE2-OE1 3.77Å; H41-E46 PolarHBondContact NE2-OE1 2.95Å; H41-E46 IonicContact NE2-OE2 3.65Å; F43-E46 WeakPolarHBondContact CA-OE2 3.14Å; F43-E46 HydrophobicContact CB-CB 4.48Å; F43-E46 HydrophobicContact CD1-CG 4.2Å; E46-R48 VanDerWaalsContact C-N 3.3Å; E46-R48 PolarHBondContact O-N 3.22Å; E46-A49 WeakPolarHBondContact O-CB 3.45Å; E46-A49 PolarHBondContact O-N 3.09Å; E46-A49 VanDerWaalsContact O-N 3.11Å; E46-L50 WeakPolarHBondContact O-CG 3.47Å; E46-L50 PolarHBondContact O-N 3.04Å |
| 47 | R | 85.7 | Confident | 78.9 | Confident | 154 Ų | 154 | 107 Ų | 107 | 58% | 0.581 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -58.9 | -40 | 173.2 | -76.7 | 177.9 | -67.5 | -179 | 3.7 | 112.2 | F43 S44 F51 | F43-R47 VanDerWaalsContact O-CB 3.3Å; F43-R47 WeakPolarHBondContact O-CB 3.29Å; F43-R47 WeakPolarHBondContact O-CG 3.42Å; F43-R47 PolarHBondContact O-N 3.22Å; F43-R47 PolarHBondContact O-NE 3Å; S44-R47 PolarHBondContact OG-NH2 3.46Å; R47-F51 PolarHBondContact O-N 3.44Å; R47-F51 VanDerWaalsContact O-N 3.15Å |
| 48 | R | 84.9 | Confident | 78.4 | Confident | 171 Ų | 171 | 106.8 Ų | 106.8 | 65% | 0.645 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -66 | -43.4 | 172.8 | -74.5 | 173.4 | 73.5 | -175.3 | 2.3 | 111.5 | S44 L45 E46 L50 F51 W52 | S44-R48 WeakPolarHBondContact O-CB 3.21Å; S44-R48 WeakPolarHBondContact O-CD 3.3Å; S44-R48 WeakPolarHBondContact O-CG 3.32Å; S44-R48 PolarHBondContact O-N 3.03Å; S44-R48 VanDerWaalsContact O-N 3.13Å; L45-R48 PolarHBondContact O-N 2.96Å; E46-R48 VanDerWaalsContact C-N 3.3Å; E46-R48 PolarHBondContact O-N 3.22Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 3.3Å; R48-F51 WeakPolarHBondContact O-CB 3.49Å; R48-F51 PolarHBondContact O-N 3.36Å; R48-W52 PolarHBondContact O-N 2.83Å |
| 49 | A | 87.4 | Confident | 77.9 | Confident | 46 Ų | 46 | 106.1 Ų | 106.1 | 38% | 0.38 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.3 | -42.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | L45 E46 W52 V53 | L45-A49 WeakPolarHBondContact O-CB 3.48Å; L45-A49 PolarHBondContact O-N 3.34Å; E46-A49 WeakPolarHBondContact O-CB 3.45Å; E46-A49 PolarHBondContact O-N 3.09Å; E46-A49 VanDerWaalsContact O-N 3.11Å; A49-W52 PolarHBondContact O-N 3.11Å; A49-V53 WeakPolarHBondContact O-CG2 3.18Å; A49-V53 PolarHBondContact O-N 3.34Å |
| 50 | L | 82.5 | Confident | 76.7 | Confident | 117 Ų | 117 | 108.8 Ų | 108.8 | 61% | 0.613 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -59.6 | -46.9 | 173.1 | -69.4 | 171.9 | 0 | 0 | 0 | 111.6 | E46 R48 W52 V53 E54 | E46-L50 WeakPolarHBondContact O-CG 3.47Å; E46-L50 PolarHBondContact O-N 3.04Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 3.3Å; L50-W52 VanDerWaalsContact C-N 3.32Å; L50-W52 PolarHBondContact O-N 3.33Å; L50-V53 PolarHBondContact O-N 3.17Å; L50-V53 VanDerWaalsContact O-N 3.1Å; L50-E54 WeakPolarHBondContact O-CB 3.42Å; L50-E54 PolarHBondContact O-N 3.42Å |
| 51 | F | 83.7 | Confident | 75.6 | Confident | 145 Ų | 145 | 104.7 Ų | 104.7 | 64% | 0.636 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -57.5 | -41 | 174.8 | 176.8 | -91.6 | 0 | 0 | 0 | 112.9 | R47 R48 A55 | R47-F51 PolarHBondContact O-N 3.44Å; R47-F51 VanDerWaalsContact O-N 3.15Å; R48-F51 WeakPolarHBondContact O-CB 3.49Å; R48-F51 PolarHBondContact O-N 3.36Å; F51-A55 VanDerWaalsContact O-CB 3.23Å; F51-A55 WeakPolarHBondContact O-CB 3.5Å; F51-A55 PolarHBondContact O-N 3.1Å |
| 52 | W | 75.4 | Confident | 73.9 | Confident | 174 Ų | 174 | 104.8 Ų | 104.8 | 66% | 0.659 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65.8 | -37.5 | 174.9 | -71.8 | 106.2 | 0 | 0 | 0 | 112.8 | R48 A49 L50 A56 | R48-W52 PolarHBondContact O-N 2.83Å; A49-W52 PolarHBondContact O-N 3.11Å; L50-W52 VanDerWaalsContact C-N 3.32Å; L50-W52 PolarHBondContact O-N 3.33Å; W52-A56 VanDerWaalsContact O-CB 3.24Å; W52-A56 WeakPolarHBondContact O-CB 3.34Å; W52-A56 PolarHBondContact O-N 3.48Å |
| 53 | V | 80.6 | Confident | 72.4 | Confident | 51 Ų | 51 | 105 Ų | 105 | 31% | 0.309 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -69.1 | -44 | 178.1 | 171 | 0 | 0 | 0 | 0 | 111 | A49 L50 A56 G57 W77 V81 | A49-V53 WeakPolarHBondContact O-CG2 3.18Å; A49-V53 PolarHBondContact O-N 3.34Å; L50-V53 PolarHBondContact O-N 3.17Å; L50-V53 VanDerWaalsContact O-N 3.1Å; V53-A56 PolarHBondContact O-N 2.94Å; V53-G57 PolarHBondContact O-N 2.87Å; V53-W77 HydrophobicContact CG2-CZ3 4.33Å; V53-V81 HydrophobicContact CG1-CG1 4.34Å |
| 54 | E | 76.5 | Confident | 70.6 | Confident | 122 Ų | 122 | 108.1 Ų | 108.1 | 57% | 0.57 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -63.4 | -48.4 | 176.9 | -172 | 170 | -164.8 | 0 | 0 | 111.3 | L50 A56 G57 Q58 | L50-E54 WeakPolarHBondContact O-CB 3.42Å; L50-E54 PolarHBondContact O-N 3.42Å; E54-A56 VanDerWaalsContact C-N 3.27Å; E54-A56 PolarHBondContact O-N 3.36Å; E54-G57 PolarHBondContact O-N 2.67Å; E54-Q58 PolarHBondContact O-N 2.88Å; E54-Q58 VanDerWaalsContact O-N 3.08Å |
| 55 | A | 71.9 | Confident | 68.6 | Low | 60 Ų | 60 | 111.2 Ų | 111.2 | 50% | 0.496 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -61.8 | -31.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | F51 | F51-A55 VanDerWaalsContact O-CB 3.23Å; F51-A55 WeakPolarHBondContact O-CB 3.5Å; F51-A55 PolarHBondContact O-N 3.1Å |
| 56 | A | 70.8 | Confident | 66.9 | Low | 86 Ų | 86 | 108.5 Ų | 108.5 | 71% | 0.711 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -75.3 | -27.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | W52 V53 E54 | W52-A56 VanDerWaalsContact O-CB 3.24Å; W52-A56 WeakPolarHBondContact O-CB 3.34Å; W52-A56 PolarHBondContact O-N 3.48Å; V53-A56 PolarHBondContact O-N 2.94Å; E54-A56 VanDerWaalsContact C-N 3.27Å; E54-A56 PolarHBondContact O-N 3.36Å |
| 57 | G | 63.8 | Low | 64.9 | Low | 63 Ų | 63 | 111.3 Ų | 111.3 | 65% | 0.649 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -83.4 | -24.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | V53 E54 G59 | V53-G57 PolarHBondContact O-N 2.87Å; E54-G57 PolarHBondContact O-N 2.67Å; G57-G59 VanDerWaalsContact C-N 3.32Å; G57-G59 PolarHBondContact O-N 3.42Å |
| 58 | Q | 59.3 | Low | 63.4 | Low | 153 Ų | 153 | 110.6 Ų | 110.6 | 72% | 0.715 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -85.4 | 7.8 | -169.7 | -132.5 | 171.5 | 43.8 | 0 | 0 | 115.5 | E54 | E54-Q58 PolarHBondContact O-N 2.88Å; E54-Q58 VanDerWaalsContact O-N 3.08Å |
| 59 | G | 53.6 | Low | 62 | Low | 47 Ų | 47 | 105.9 Ų | 105.9 | 49% | 0.485 | 66% | 0.663 | S | S | . | * | S | Bend | trans | -95.8 | 128.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113 | G57 S61 | G57-G59 VanDerWaalsContact C-N 3.32Å; G57-G59 PolarHBondContact O-N 3.42Å; G59-S61 VanDerWaalsContact C-N 3.34Å; G59-S61 PolarHBondContact O-N 2.9Å |
| 60 | P | 47.4 | Very low | 60.1 | Low | 127 Ų | 127 | 109.2 Ų | 109.2 | 83% | 0.825 | 68% | 0.679 | S | S | * | * | trans | -68.9 | 92.3 | 168.6 | 28.7 | -33.2 | 0 | 0 | 0 | 109.7 | P62 | P60-P62 VanDerWaalsContact O-CD 3.27Å; P60-P62 WeakPolarHBondContact O-CD 3.13Å | ||
| 61 | S | 53.9 | Low | 58.6 | Low | 89 Ų | 89 | 108.4 Ų | 108.4 | 62% | 0.622 | 69% | 0.689 | S | S | * | * | trans | -67.7 | 118.9 | 178.9 | 53.8 | 0 | 0 | 0 | 0 | 111.1 | G59 C63 | G59-S61 VanDerWaalsContact C-N 3.34Å; G59-S61 PolarHBondContact O-N 2.9Å; S61-C63 PolarHBondContact O-N 3.36Å | ||
| 62 | P | 45.3 | Very low | 57.5 | Low | 121 Ų | 121 | 106.3 Ų | 106.3 | 79% | 0.786 | 69% | 0.692 | S | S | * | * | trans | -78.5 | 82.4 | 168.7 | 0.4 | 18.5 | 0 | 0 | 0 | 107.6 | P60 Q64 | P60-P62 VanDerWaalsContact O-CD 3.27Å; P60-P62 WeakPolarHBondContact O-CD 3.13Å; P62-Q64 PolarHBondContact O-N 2.89Å | ||
| 63 | C | 48.3 | Very low | 56.8 | Low | 111 Ų | 111 | 101.8 Ų | 101.8 | 75% | 0.75 | 69% | 0.692 | S | S | * | * | trans | -68.5 | 72.6 | 174.9 | -75.4 | 0 | 0 | 0 | 0 | 111.5 | S61 C65 | S61-C63 PolarHBondContact O-N 3.36Å; C63-C65 VanDerWaalsContact C-N 3.34Å; C63-C65 PolarHBondContact O-N 2.99Å | ||
| 64 | Q | 48.4 | Very low | 55.8 | Low | 192 Ų | 192 | 102.6 Ų | 102.6 | 90% | 0.897 | 70% | 0.698 | S | S | * | * | trans | -88.6 | 74.7 | 163.3 | -70.1 | -151.8 | 92.4 | 0 | 0 | 109.8 | P62 | P62-Q64 PolarHBondContact O-N 2.89Š| ||
| 65 | C | 43.4 | Very low | 55.2 | Low | 104 Ų | 104 | 100.1 Ų | 100.1 | 70% | 0.703 | 69% | 0.693 | S | S | * | * | trans | -95.4 | 87.8 | 163.1 | -167.9 | 0 | 0 | 0 | 0 | 108.6 | C63 D67 | C63-C65 VanDerWaalsContact C-N 3.34Å; C63-C65 PolarHBondContact O-N 2.99Å; C65-D67 VanDerWaalsContact C-N 3.32Å; C65-D67 PolarHBondContact O-N 3.39Å | ||
| 66 | G | 50.3 | Low | 54.4 | Low | 76 Ų | 76 | 100.9 Ų | 100.9 | 78% | 0.784 | 70% | 0.699 | S | S | * | * | trans | -86.3 | 67.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 67 | D | 49.2 | Very low | 53.8 | Low | 128 Ų | 128 | 103.9 Ų | 103.9 | 68% | 0.684 | 69% | 0.692 | S | S | * | * | trans | -156.9 | 119.3 | 164.6 | -101.7 | -35.9 | 0 | 0 | 0 | 111.4 | C65 G69 | C65-D67 VanDerWaalsContact C-N 3.32Å; C65-D67 PolarHBondContact O-N 3.39Å; D67-G69 PolarHBondContact O-N 2.7Å | ||
| 68 | P | 53.9 | Low | 53.5 | Low | 139 Ų | 139 | 104.2 Ų | 104.2 | 90% | 0.903 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | 79.4 | -177.5 | 33.9 | -34.7 | 0 | 0 | 0 | 111.3 | ||
| 69 | G | 56.7 | Low | 53.6 | Low | 72 Ų | 72 | 102.8 Ų | 102.8 | 74% | 0.742 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -162.7 | -30.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 116.8 | D67 A71 | D67-G69 PolarHBondContact O-N 2.7Å; G69-A71 PolarHBondContact O-N 2.78Å |
| 70 | T | 47.7 | Very low | 53.8 | Low | 116 Ų | 116 | 107.8 Ų | 107.8 | 71% | 0.712 | 69% | 0.69 | S | S | * | * | trans | -97.3 | 96.8 | -174 | -51.3 | 0 | 0 | 0 | 0 | 111.3 | S72 | T70-S72 PolarHBondContact O-N 2.54Š| ||
| 71 | A | 50.4 | Low | 54.3 | Low | 100 Ų | 100 | 105.9 Ų | 105.9 | 83% | 0.826 | 68% | 0.676 | S | S | * | * | trans | -68.6 | 78.9 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | G69 A73 | G69-A71 PolarHBondContact O-N 2.78Å; A71-A73 PolarHBondContact O-N 2.91Å | ||
| 72 | S | 61.3 | Low | 53.8 | Low | 102 Ų | 102 | 104.5 Ų | 104.5 | 71% | 0.713 | 67% | 0.667 | S | S | * | * | trans | -72.5 | 77.1 | 171.6 | -179.9 | 0 | 0 | 0 | 0 | 109.3 | T70 | T70-S72 PolarHBondContact O-N 2.54Š| ||
| 73 | A | 59.2 | Low | 53.9 | Low | 79 Ų | 79 | 104 Ų | 104 | 65% | 0.653 | 66% | 0.663 | S | S | * | * | trans | -55.4 | 127.9 | 166.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | A71 | A71-A73 PolarHBondContact O-N 2.91Š| ||
| 74 | P | 60.9 | Low | 53.8 | Low | 68 Ų | 68 | 106 Ų | 106 | 44% | 0.442 | 66% | 0.661 | S | S | . | * | trans | -56.7 | 145.4 | 174.4 | 22.9 | -31.9 | 0 | 0 | 0 | 109.4 | A76 L78 | P74-A76 PolarHBondContact O-N 2.99Å; P74-L78 HydrophobicContact CB-CB 4.29Å; P74-L78 HydrophobicContact CB-CD1 3.75Å | ||
| 75 | P | 63.6 | Low | 53.5 | Low | 69 Ų | 69 | 105.7 Ų | 105.7 | 45% | 0.448 | 65% | 0.653 | S | S | . | * | trans | -44.9 | 133.6 | 174.1 | -31 | 33.9 | 0 | 0 | 0 | 111.8 | W77 L78 | P75-W77 HydrophobicContact CB-CD2 4.31Å; P75-W77 HydrophobicContact CB-CG 4.28Å; P75-W77 HydrophobicContact CB-CZ2 4.19Å; P75-W77 HydrophobicContact CG-CZ2 4.39Å; P75-W77 PolarHBondContact O-N 3.08Å; P75-L78 WeakPolarHBondContact O-CB 3.49Å; P75-L78 PolarHBondContact O-N 3.12Å | ||
| 76 | A | 56 | Low | 53.2 | Low | 77 Ų | 77 | 110.2 Ų | 110.2 | 64% | 0.636 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -16.7 | -168.2 | 0 | 0 | 0 | 0 | 0 | 115 | P74 L79 | P74-A76 PolarHBondContact O-N 2.99Å; A76-L79 PolarHBondContact O-N 3.33Å |
| 77 | W | 56.8 | Low | 52.6 | Low | 148 Ų | 148 | 113.7 Ų | 113.7 | 56% | 0.561 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -23.8 | 173.2 | 56 | -99.5 | 0 | 0 | 0 | 114.1 | V53 P75 L79 L80 | V53-W77 HydrophobicContact CG2-CZ3 4.33Å; P75-W77 HydrophobicContact CB-CD2 4.31Å; P75-W77 HydrophobicContact CB-CG 4.28Å; P75-W77 HydrophobicContact CB-CZ2 4.19Å; P75-W77 HydrophobicContact CG-CZ2 4.39Å; P75-W77 PolarHBondContact O-N 3.08Å; W77-L79 VanDerWaalsContact C-N 3.29Å; W77-L79 PolarHBondContact O-N 3.32Å; W77-L80 WeakPolarHBondContact O-CB 3.11Å; W77-L80 PolarHBondContact O-N 3.06Å |
| 78 | L | 58.2 | Low | 51.7 | Low | 70 Ų | 70 | 112 Ų | 112 | 37% | 0.366 | 67% | 0.668 | S | S | . | * | G | 310 helix | trans | -68.6 | -28.8 | 173 | -76.1 | 168.5 | 0 | 0 | 0 | 112.3 | P74 P75 L80 V81 | P74-L78 HydrophobicContact CB-CB 4.29Å; P74-L78 HydrophobicContact CB-CD1 3.75Å; P75-L78 WeakPolarHBondContact O-CB 3.49Å; P75-L78 PolarHBondContact O-N 3.12Å; L78-L80 PolarHBondContact O-N 3.24Å; L78-V81 PolarHBondContact O-N 2.65Å |
| 79 | L | 60.2 | Low | 50.5 | Low | 124 Ų | 124 | 111.8 Ų | 111.8 | 65% | 0.649 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -68.6 | -14.1 | 175.5 | -59.3 | 175.5 | 0 | 0 | 0 | 113.1 | A76 W77 | A76-L79 PolarHBondContact O-N 3.33Å; W77-L79 VanDerWaalsContact C-N 3.29Å; W77-L79 PolarHBondContact O-N 3.32Å |
| 80 | L | 59.3 | Low | 49.2 | Very low | 151 Ų | 151 | 112.6 Ų | 112.6 | 79% | 0.791 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -89.1 | -7.7 | 176.7 | -61.3 | 168.2 | 0 | 0 | 0 | 112.9 | W77 L78 | W77-L80 WeakPolarHBondContact O-CB 3.11Å; W77-L80 PolarHBondContact O-N 3.06Å; L78-L80 PolarHBondContact O-N 3.24Å |
| 81 | V | 56.7 | Low | 48.4 | Very low | 87 Ų | 87 | 113.5 Ų | 113.5 | 53% | 0.527 | 67% | 0.67 | S | S | . | * | S | Bend | trans | -112.2 | 0.9 | -175 | -170.7 | 0 | 0 | 0 | 0 | 111.7 | V53 L78 | V53-V81 HydrophobicContact CG1-CG1 4.34Å; L78-V81 PolarHBondContact O-N 2.65Å |
| 82 | S | 43.4 | Very low | 47.5 | Very low | 61 Ų | 61 | 115.5 Ų | 115.5 | 43% | 0.427 | 67% | 0.665 | S | S | . | * | trans | -63.5 | 126.5 | 175.7 | -127.9 | 0 | 0 | 0 | 0 | 110.6 | E84 | S82-E84 WeakPolarHBondContact CB-OE2 3.41Å; S82-E84 PolarHBondContact O-N 2.72Å; S82-E84 PolarHBondContact OG-OE2 2.91Å | ||
| 83 | P | 48 | Very low | 46.1 | Very low | 110 Ų | 110 | 120.8 Ų | 120.8 | 71% | 0.714 | 67% | 0.669 | S | S | * | * | trans | -78.2 | 2.7 | -176.5 | 33 | -36.1 | 0 | 0 | 0 | 113.5 | Y85 | P83-Y85 PolarHBondContact O-N 3.35Š| ||
| 84 | E | 46.1 | Very low | 44.6 | Very low | 152 Ų | 152 | 124.2 Ų | 124.2 | 71% | 0.71 | 68% | 0.677 | S | S | * | * | trans | -74.1 | 58.7 | 177.1 | -60.8 | 96.7 | 161.5 | 0 | 0 | 113.9 | S82 | S82-E84 WeakPolarHBondContact CB-OE2 3.41Å; S82-E84 PolarHBondContact O-N 2.72Å; S82-E84 PolarHBondContact OG-OE2 2.91Å | ||
| 85 | Y | 42.4 | Very low | 43.2 | Very low | 186 Ų | 186 | 129.1 Ų | 129.1 | 73% | 0.729 | 69% | 0.693 | S | S | * | * | trans | -128.9 | 76.5 | 150.3 | 68.9 | -79.9 | 0 | 0 | 0 | 109.7 | P83 L87 | P83-Y85 PolarHBondContact O-N 3.35Å; Y85-L87 PolarHBondContact O-N 3.42Å | ||
| 86 | E | 36.4 | Very low | 41.6 | Very low | 200 Ų | 200 | 135 Ų | 135 | 94% | 0.935 | 72% | 0.715 | S | S | * | * | trans | -62.9 | 88.8 | 156 | -77.2 | -164.8 | 154.8 | 0 | 0 | 108.1 | A88 | E86-A88 VanDerWaalsContact C-N 3.3Å; E86-A88 PolarHBondContact O-N 2.92Å | ||
| 87 | L | 37.7 | Very low | 40.3 | Very low | 148 Ų | 148 | 135.4 Ų | 135.4 | 78% | 0.775 | 72% | 0.718 | S | S | * | * | trans | -72 | 92.7 | 172.3 | -164.4 | 80.4 | 0 | 0 | 0 | 107.6 | Y85 T89 | Y85-L87 PolarHBondContact O-N 3.42Å; L87-T89 PolarHBondContact O-N 3.22Å | ||
| 88 | A | 30.3 | Very low | 38.9 | Very low | 93 Ų | 93 | 131.7 Ų | 131.7 | 77% | 0.769 | 73% | 0.726 | S | S | * | * | trans | -47.5 | 113.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | E86 A90 | E86-A88 VanDerWaalsContact C-N 3.3Å; E86-A88 PolarHBondContact O-N 2.92Å; A88-A90 PolarHBondContact O-N 3Å | ||
| 89 | T | 29.2 | Very low | 37.5 | Very low | 135 Ų | 135 | 137.4 Ų | 137.4 | 83% | 0.828 | 75% | 0.75 | S | S | * | * | trans | -65.8 | 103.4 | 176.3 | 31.6 | 0 | 0 | 0 | 0 | 108.8 | L87 T91 | L87-T89 PolarHBondContact O-N 3.22Å; T89-T91 PolarHBondContact O-N 2.95Å; T89-T91 VanDerWaalsContact O-N 3.12Å | ||
| 90 | A | 29.7 | Very low | 35.9 | Very low | 88 Ų | 88 | 140.3 Ų | 140.3 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -58.2 | 118.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | A88 I92 | A88-A90 PolarHBondContact O-N 3Å; A90-I92 PolarHBondContact O-N 3Å | ||
| 91 | T | 29.8 | Very low | 34.5 | Very low | 136 Ų | 136 | 142.5 Ų | 142.5 | 83% | 0.834 | 77% | 0.767 | S | S | * | * | trans | -69.5 | 93.1 | 176.6 | 32.1 | 0 | 0 | 0 | 0 | 110 | T89 R93 | T89-T91 PolarHBondContact O-N 2.95Å; T89-T91 VanDerWaalsContact O-N 3.12Å; T91-R93 PolarHBondContact O-N 3.05Å; T91-R93 VanDerWaalsContact O-N 3.08Å | ||
| 92 | I | 33.1 | Very low | 33.1 | Very low | 142 Ų | 142 | 147 Ų | 147 | 73% | 0.728 | 78% | 0.775 | S | S | * | * | trans | -70.6 | 101.9 | 161.6 | -61.1 | 179.8 | 0 | 0 | 0 | 106.6 | A90 D94 | A90-I92 PolarHBondContact O-N 3Å; I92-D94 PolarHBondContact O-N 2.93Å | ||
| 93 | R | 31.4 | Very low | 32.8 | Very low | 213 Ų | 213 | 149.6 Ų | 149.6 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | -73.9 | 102.6 | 164.5 | -79.1 | 178.8 | 167 | -179.1 | -3.6 | 108.1 | T91 | T91-R93 PolarHBondContact O-N 3.05Å; T91-R93 VanDerWaalsContact O-N 3.08Å | ||
| 94 | D | 27.6 | Very low | 32 | Very low | 151 Ų | 151 | 150 Ų | 150 | 81% | 0.807 | 78% | 0.782 | S | S | * | * | trans | -93.2 | 115.9 | 151.7 | -74.3 | -41.1 | 0 | 0 | 0 | 108.5 | I92 | I92-D94 PolarHBondContact O-N 2.93Š| ||
| 95 | Q | 31.3 | Very low | 31.4 | Very low | 170 Ų | 170 | 151.1 Ų | 151.1 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | -90.9 | 119.6 | 166.3 | -71.9 | 178.5 | -18.1 | 0 | 0 | 107.2 | ||||
| 96 | E | 29.4 | Very low | 30.9 | Very low | 194 Ų | 194 | 151 Ų | 151 | 91% | 0.907 | 79% | 0.793 | S | S | * | * | trans | -139.2 | 154.9 | 156.3 | -150.9 | 155.9 | 158.8 | 0 | 0 | 111 | ||||
| 97 | A | 29.7 | Very low | 30.5 | Very low | 84 Ų | 84 | 144.6 Ų | 144.6 | 69% | 0.694 | 78% | 0.781 | S | S | * | * | trans | -61.3 | 148.8 | -168.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 98 | G | 26.6 | Very low | 30.3 | Very low | 71 Ų | 71 | 146.4 Ų | 146.4 | 73% | 0.732 | 79% | 0.785 | S | S | * | * | cis | 93 | 51.7 | 27.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 99 | H | 29.6 | Very low | 30.6 | Very low | 189 Ų | 189 | 149 Ų | 149 | 88% | 0.875 | 79% | 0.786 | S | S | * | * | trans | -127.6 | 128.4 | 163.7 | -86.8 | -78.8 | 0 | 0 | 0 | 110.8 | ||||
| 100 | Q | 26.6 | Very low | 31.1 | Very low | 186 Ų | 186 | 151.2 Ų | 151.2 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | trans | -109.3 | 125.6 | -175.3 | 161 | -172.7 | 73 | 0 | 0 | 106.4 | ||||
| 101 | E | 28.7 | Very low | 31.4 | Very low | 197 Ų | 197 | 151.1 Ų | 151.1 | 92% | 0.921 | 79% | 0.787 | S | S | * | * | trans | -161.4 | 134.2 | 154.7 | -117.2 | 160.8 | -165.5 | 0 | 0 | 112.2 | ||||
| 102 | R | 27.4 | Very low | 31.7 | Very low | 182 Ų | 182 | 153 Ų | 153 | 69% | 0.687 | 79% | 0.786 | S | S | * | * | trans | -137.8 | 138.9 | 174.8 | 177.7 | -169.2 | -174.6 | -137 | -3 | 105.8 | E104 | R102-E104 IonicContact CZ-OE1 3.5Å; R102-E104 IonicContact CZ-OE2 3.4Å; R102-E104 IonicContact NH1-OE1 2.74Å; R102-E104 PolarHBondContact NH1-OE1 3.14Å; R102-E104 IonicContact NH1-OE2 2.96Å; R102-E104 PolarHBondContact NH1-OE2 2.87Å; R102-E104 VanDerWaalsContact NH2-CG 3.26Å; R102-E104 IonicContact NH2-OE1 2.66Å; R102-E104 PolarHBondContact NH2-OE1 3.27Å | ||
| 103 | P | 38.3 | Very low | 31.7 | Very low | 114 Ų | 114 | 149.6 Ų | 149.6 | 74% | 0.74 | 78% | 0.779 | S | S | * | * | trans | -136.9 | 141.3 | 131.4 | 39.1 | -26.9 | 0 | 0 | 0 | 109.1 | ||||
| 104 | E | 30.7 | Very low | 31.9 | Very low | 119 Ų | 119 | 145.1 Ų | 145.1 | 56% | 0.556 | 78% | 0.78 | S | S | * | * | 50.9 | 104.5 | 54.1 | -64.5 | -168.1 | 142.6 | 0 | 0 | 112 | R102 | R102-E104 IonicContact CZ-OE1 3.5Å; R102-E104 IonicContact CZ-OE2 3.4Å; R102-E104 IonicContact NH1-OE1 2.74Å; R102-E104 PolarHBondContact NH1-OE1 3.14Å; R102-E104 IonicContact NH1-OE2 2.96Å; R102-E104 PolarHBondContact NH1-OE2 2.87Å; R102-E104 VanDerWaalsContact NH2-CG 3.26Å; R102-E104 IonicContact NH2-OE1 2.66Å; R102-E104 PolarHBondContact NH2-OE1 3.27Å | |||
| 105 | E | 34.1 | Very low | 32.3 | Very low | 175 Ų | 175 | 143.3 Ų | 143.3 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | 159.4 | 155 | 105.9 | -83.2 | 152.8 | -150.3 | 0 | 0 | 105.6 | |||||
| 106 | E | 30.4 | Very low | 32.1 | Very low | 184 Ų | 184 | 138.6 Ų | 138.6 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | cis | -163.4 | 171.7 | -14 | -114.9 | -179.4 | 179.3 | 0 | 0 | 108.2 | ||||
| 107 | G | 29.2 | Very low | 32.1 | Very low | 65 Ų | 65 | 134.4 Ų | 134.4 | 67% | 0.67 | 77% | 0.768 | S | S | * | * | trans | 101.1 | 113.7 | 163.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 108 | E | 33.5 | Very low | 32.4 | Very low | 187 Ų | 187 | 139.2 Ų | 139.2 | 87% | 0.874 | 78% | 0.777 | S | S | * | * | cis | 100 | 152.7 | 34 | -65.2 | -167.7 | 150.6 | 0 | 0 | 115.1 | ||||
| 109 | D | 35.8 | Very low | 32.7 | Very low | 147 Ų | 147 | 144.6 Ų | 144.6 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | trans | 69.8 | 123.7 | -179.7 | -57.6 | -28.1 | 0 | 0 | 0 | 118.5 | ||||
| 110 | E | 39.3 | Very low | 33.1 | Very low | 181 Ų | 181 | 144 Ų | 144 | 85% | 0.846 | 78% | 0.78 | S | S | * | * | cis | 102.4 | 143.4 | 30.5 | -79.3 | -89.9 | 137.9 | 0 | 0 | 114.2 | ||||
| 111 | A | 36.1 | Very low | 33.8 | Very low | 87 Ų | 87 | 140.4 Ų | 140.4 | 72% | 0.719 | 77% | 0.773 | S | S | * | * | trans | 67.5 | 149.8 | 162.9 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 112 | E | 36.9 | Very low | 34.1 | Very low | 176 Ų | 176 | 134.4 Ų | 134.4 | 82% | 0.822 | 76% | 0.764 | S | S | * | * | cis | -162.7 | 156.3 | -11.5 | -111.6 | -75.4 | 111.6 | 0 | 0 | 111.5 | ||||
| 113 | A | 32.8 | Very low | 34.7 | Very low | 70 Ų | 70 | 132.2 Ų | 132.2 | 58% | 0.579 | 77% | 0.773 | S | S | * | * | trans | 1.8 | 154.9 | 162.2 | 0 | 0 | 0 | 0 | 0 | 127.5 | ||||
| 114 | S | 35.5 | Very low | 34.3 | Very low | 118 Ų | 118 | 138.1 Ų | 138.1 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | trans | 80.8 | 154.8 | 136.9 | -103.3 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 115 | S | 35.6 | Very low | 34.4 | Very low | 114 Ų | 114 | 137.6 Ų | 137.6 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | cis | -164.4 | 158.3 | -1 | -164.4 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 116 | G | 27.1 | Very low | 34.1 | Very low | 70 Ų | 70 | 137.1 Ų | 137.1 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | trans | 74.8 | 159.5 | 152.9 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 117 | S | 30.8 | Very low | 34.2 | Very low | 106 Ų | 106 | 137.5 Ų | 137.5 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | cis | -170.7 | 134.8 | -13.8 | 50.7 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 118 | E | 36.2 | Very low | 34.8 | Very low | 186 Ų | 186 | 140.1 Ų | 140.1 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | 51.9 | 146.2 | 142.1 | -56.4 | -174.4 | 116.3 | 0 | 0 | 125 | ||||
| 119 | E | 32.5 | Very low | 34.5 | Very low | 183 Ų | 183 | 135 Ų | 135 | 86% | 0.855 | 80% | 0.796 | S | S | * | * | trans | 99.4 | 122.8 | 143.2 | -138.1 | 172.8 | 124.7 | 0 | 0 | 122.3 | ||||
| 120 | E | 37.6 | Very low | 34.5 | Very low | 178 Ų | 178 | 133.8 Ų | 133.8 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | -108.5 | 133.3 | 167.7 | 159 | -178.8 | 123.2 | 0 | 0 | 106.9 | ||||
| 121 | P | 41.7 | Very low | 35.4 | Very low | 110 Ų | 110 | 131.2 Ų | 131.2 | 71% | 0.714 | 80% | 0.798 | S | S | * | * | -153 | 154.4 | 97 | 36.2 | -15.8 | 0 | 0 | 0 | 117.5 | |||||
| 122 | G | 34.5 | Very low | 35.1 | Very low | 71 Ų | 71 | 131.8 Ų | 131.8 | 73% | 0.732 | 80% | 0.804 | S | S | * | * | trans | -86.9 | 175.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 123 | P | 41 | Very low | 35 | Very low | 136 Ų | 136 | 129 Ų | 129 | 88% | 0.883 | 80% | 0.803 | S | S | * | * | trans | -124.6 | 166 | 164.8 | 35.7 | -22.3 | 0 | 0 | 0 | 115 | ||||
| 124 | R | 28.7 | Very low | 35.8 | Very low | 238 Ų | 238 | 131.9 Ų | 131.9 | 90% | 0.898 | 82% | 0.816 | S | S | * | * | trans | -87.3 | 157 | -175.2 | -69.3 | 172.1 | 170.3 | 163.9 | -3.5 | 114 | ||||
| 125 | S | 32.3 | Very low | 35.6 | Very low | 108 Ų | 108 | 129.6 Ų | 129.6 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | trans | -0.8 | 145.5 | 148.4 | -45.8 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 126 | L | 29.4 | Very low | 36.1 | Very low | 165 Ų | 165 | 130.8 Ų | 130.8 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | 179.3 | 132.2 | 116.3 | -96.8 | 169.1 | 0 | 0 | 0 | 111.1 | |||||
| 127 | Q | 31.3 | Very low | 36.3 | Very low | 192 Ų | 192 | 131.1 Ų | 131.1 | 90% | 0.897 | 82% | 0.819 | S | S | * | * | trans | -167.9 | 130.8 | 146.6 | -87.9 | -124.5 | -16.8 | 0 | 0 | 111.3 | ||||
| 128 | P | 42.9 | Very low | 36.4 | Very low | 120 Ų | 120 | 135.9 Ų | 135.9 | 78% | 0.779 | 82% | 0.821 | S | S | * | * | trans | -116.4 | 145.8 | 161.4 | 36.8 | -26.4 | 0 | 0 | 0 | 111.8 | ||||
| 129 | G | 27.2 | Very low | 36.3 | Very low | 78 Ų | 78 | 135.7 Ų | 135.7 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | 163.6 | 106.5 | 169.5 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 130 | S | 35.3 | Very low | 36.5 | Very low | 122 Ų | 122 | 133.5 Ų | 133.5 | 85% | 0.853 | 81% | 0.806 | S | S | * | * | trans | -125.7 | 173.6 | 151.7 | -68.8 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 131 | P | 57.4 | Low | 36.2 | Very low | 127 Ų | 127 | 131 Ų | 131 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | cis | -136.4 | -178.8 | 4.9 | 42.5 | -25.9 | 0 | 0 | 0 | 114.7 | ||||
| 132 | A | 29.7 | Very low | 36 | Very low | 100 Ų | 100 | 130.9 Ų | 130.9 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | trans | 178.1 | 142.8 | 134.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 133 | S | 36.6 | Very low | 36.4 | Very low | 117 Ų | 117 | 135.4 Ų | 135.4 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -116.5 | 160.1 | 164.6 | -52.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 134 | P | 48.6 | Very low | 36.5 | Very low | 130 Ų | 130 | 136.4 Ų | 136.4 | 84% | 0.844 | 81% | 0.813 | S | S | * | * | -148.2 | 172.1 | 81.5 | 35.1 | -14.6 | 0 | 0 | 0 | 116.2 | |||||
| 135 | G | 30.6 | Very low | 37.4 | Very low | 71 Ų | 71 | 131.6 Ų | 131.6 | 73% | 0.732 | 81% | 0.81 | S | S | * | * | trans | -83.5 | -148.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 136 | P | 47.4 | Very low | 38.1 | Very low | 139 Ų | 139 | 134.3 Ų | 134.3 | 90% | 0.903 | 82% | 0.815 | S | S | * | * | cis | -139.4 | 176.3 | 14.4 | 42.5 | -24.7 | 0 | 0 | 0 | 116.7 | ||||
| 137 | G | 31.4 | Very low | 38.8 | Very low | 76 Ų | 76 | 138.4 Ų | 138.4 | 78% | 0.784 | 82% | 0.819 | S | S | * | * | trans | 179.9 | 93.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 138 | R | 33.3 | Very low | 39.1 | Very low | 207 Ų | 207 | 132.8 Ų | 132.8 | 78% | 0.781 | 81% | 0.813 | S | S | * | * | trans | -3.6 | 143.3 | 147.9 | -80.9 | 178.6 | 178.8 | -89.2 | 7.4 | 117.8 | ||||
| 139 | R | 33.9 | Very low | 38.9 | Very low | 182 Ų | 182 | 134.2 Ų | 134.2 | 69% | 0.687 | 82% | 0.819 | S | S | * | * | cis | -169.6 | 143.2 | 26.9 | -111.5 | 172 | -154.5 | -108.9 | 13.3 | 111.5 | ||||
| 140 | L | 35.2 | Very low | 39.8 | Very low | 137 Ų | 137 | 142.4 Ų | 142.4 | 72% | 0.717 | 83% | 0.825 | S | S | * | * | trans | 68 | 139.8 | 138.8 | -61 | 169.1 | 0 | 0 | 0 | 123.5 | ||||
| 141 | C | 32.6 | Very low | 40 | Very low | 125 Ų | 125 | 142.2 Ų | 142.2 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | 71.6 | 140.9 | 162.5 | -57.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 142 | S | 37.4 | Very low | 39 | Very low | 108 Ų | 108 | 145.6 Ų | 145.6 | 76% | 0.755 | 83% | 0.829 | S | S | * | * | cis | -165.1 | 164 | -23 | -163.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 143 | L | 41.8 | Very low | 40 | Very low | 165 Ų | 165 | 149.3 Ų | 149.3 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | trans | 73.2 | 100.6 | 174 | -60.2 | 173 | 0 | 0 | 0 | 117.4 | ||||
| 144 | D | 43.2 | Very low | 40.1 | Very low | 157 Ų | 157 | 148.5 Ų | 148.5 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | trans | -60.2 | 176.7 | 158.7 | -64.7 | -85.4 | 0 | 0 | 0 | 114.3 | ||||
| 145 | V | 48.8 | Very low | 39.7 | Very low | 138 Ų | 138 | 146.3 Ų | 146.3 | 84% | 0.836 | 84% | 0.836 | S | S | * | * | trans | 96.5 | 134.4 | 177 | -171.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 146 | L | 45.8 | Very low | 39.8 | Very low | 165 Ų | 165 | 148 Ų | 148 | 86% | 0.864 | 84% | 0.842 | S | S | * | * | S | Bend | trans | 88.4 | 40.8 | -175.2 | -51.7 | -176.5 | 0 | 0 | 0 | 119.2 | ||
| 147 | R | 44 | Very low | 39.6 | Very low | 251 Ų | 251 | 152.7 Ų | 152.7 | 95% | 0.947 | 84% | 0.842 | S | S | * | * | trans | -160.2 | 97.1 | 147.5 | -160.9 | 164.3 | -66.6 | -127.5 | 0.2 | 113.3 | ||||
| 148 | G | 37.7 | Very low | 39.9 | Very low | 74 Ų | 74 | 158.7 Ų | 158.7 | 76% | 0.763 | 84% | 0.841 | S | S | * | * | trans | -176.1 | 23 | -175.4 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 149 | V | 39.2 | Very low | 40.4 | Very low | 150 Ų | 150 | 158.1 Ų | 158.1 | 91% | 0.909 | 84% | 0.839 | S | S | * | * | trans | -144.3 | 78.9 | 165.4 | -159.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 150 | R | 45.3 | Very low | 40.7 | Very low | 249 Ų | 249 | 157.5 Ų | 157.5 | 94% | 0.94 | 85% | 0.848 | S | S | * | * | trans | -151.2 | 30.3 | 172.3 | -140.9 | -179.8 | -173.7 | -118.8 | -0.8 | 115.8 | ||||
| 151 | S | 40.1 | Very low | 40.7 | Very low | 118 Ų | 118 | 155.2 Ų | 155.2 | 83% | 0.825 | 84% | 0.844 | S | S | * | * | trans | -152.8 | 96.2 | 176.2 | -58.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 152 | E | 37.6 | Very low | 40.7 | Very low | 199 Ų | 199 | 159 Ų | 159 | 93% | 0.93 | 85% | 0.849 | S | S | * | * | trans | -169.8 | 71.6 | 149.1 | -88.9 | -122.7 | 126.3 | 0 | 0 | 108.7 | ||||
| 153 | L | 48.9 | Very low | 40.3 | Very low | 178 Ų | 178 | 157.8 Ų | 157.8 | 93% | 0.932 | 85% | 0.854 | S | S | * | * | trans | -118.5 | 71.5 | 165 | -179 | 66.6 | 0 | 0 | 0 | 108.8 | ||||
| 154 | A | 39.5 | Very low | 40.2 | Very low | 99 Ų | 99 | 159.1 Ų | 159.1 | 82% | 0.818 | 85% | 0.853 | S | S | * | * | trans | -164.7 | 100.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 155 | G | 39.3 | Very low | 39.8 | Very low | 85 Ų | 85 | 159.4 Ų | 159.4 | 88% | 0.876 | 85% | 0.853 | S | S | * | * | trans | 139.4 | 64.1 | 159.1 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 156 | A | 34.3 | Very low | 39.1 | Very low | 106 Ų | 106 | 157.4 Ų | 157.4 | 88% | 0.876 | 85% | 0.851 | S | S | * | * | trans | -156.8 | 77 | 154.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 157 | R | 41.8 | Very low | 38.6 | Very low | 238 Ų | 238 | 154.2 Ų | 154.2 | 90% | 0.898 | 85% | 0.849 | S | S | * | * | trans | -102.3 | 114.9 | 163.5 | -90 | -175.3 | 170 | -107.5 | 3.3 | 109.6 | ||||
| 158 | R | 39.3 | Very low | 38.1 | Very low | 202 Ų | 202 | 153.6 Ų | 153.6 | 76% | 0.762 | 85% | 0.846 | S | S | * | * | 146.2 | 135.3 | 125 | -92.8 | -158.4 | -99.5 | -144.1 | 3.1 | 116.5 | |||||
| 159 | R | 42.7 | Very low | 38.3 | Very low | 195 Ų | 195 | 156 Ų | 156 | 74% | 0.736 | 85% | 0.848 | S | S | * | * | trans | 76.4 | 107.1 | 140.4 | -71.8 | 178.2 | -171.3 | -63.9 | 3.1 | 120.1 | ||||
| 160 | L | 40 | Very low | 38.4 | Very low | 169 Ų | 169 | 160.8 Ų | 160.8 | 89% | 0.885 | 85% | 0.85 | S | S | * | * | -136.9 | 109.7 | 114.9 | -73.3 | -176.4 | 0 | 0 | 0 | 107 | |||||
| 161 | S | 35.5 | Very low | 37.9 | Very low | 89 Ų | 89 | 153 Ų | 153 | 62% | 0.622 | 84% | 0.839 | S | S | * | * | 59 | 94.3 | 110.4 | 64.7 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 162 | E | 33.5 | Very low | 37.8 | Very low | 203 Ų | 203 | 154.5 Ų | 154.5 | 95% | 0.949 | 84% | 0.837 | S | S | * | * | 62 | 96.6 | 92.3 | -75.2 | -170.1 | 130.9 | 0 | 0 | 114.7 | |||||
| 163 | G | 29 | Very low | 37.8 | Very low | 83 Ų | 83 | 153.7 Ų | 153.7 | 86% | 0.856 | 84% | 0.838 | S | S | * | * | trans | -138.3 | 102.2 | 165.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 164 | K | 39.6 | Very low | 37.3 | Very low | 193 Ų | 193 | 153.1 Ų | 153.1 | 84% | 0.839 | 83% | 0.831 | S | S | * | * | trans | -99.6 | 130.2 | -172.7 | 179.2 | -176.7 | -177.9 | 177.1 | 0 | 109.6 | ||||
| 165 | L | 35.1 | Very low | 37.2 | Very low | 164 Ų | 164 | 152.2 Ų | 152.2 | 86% | 0.859 | 83% | 0.831 | S | S | * | * | trans | 161.7 | 162.8 | 134.7 | -88.4 | 167.9 | 0 | 0 | 0 | 114.3 | ||||
| 166 | A | 32.6 | Very low | 37 | Very low | 96 Ų | 96 | 157.4 Ų | 157.4 | 79% | 0.793 | 83% | 0.829 | S | S | * | * | trans | 76.4 | 90.2 | 161 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 167 | A | 35.2 | Very low | 37.2 | Very low | 98 Ų | 98 | 164.6 Ų | 164.6 | 81% | 0.81 | 83% | 0.834 | S | S | * | * | trans | -73.4 | 135.5 | 153.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 168 | R | 33.5 | Very low | 36.8 | Very low | 238 Ų | 238 | 156.4 Ų | 156.4 | 90% | 0.898 | 82% | 0.823 | S | S | * | * | trans | -175 | 140.6 | 138.5 | -110.4 | 174.6 | 167.6 | 153.9 | -2.2 | 111.5 | ||||
| 169 | P | 42.5 | Very low | 36.6 | Very low | 123 Ų | 123 | 158.7 Ų | 158.7 | 80% | 0.799 | 83% | 0.832 | S | S | * | * | trans | -80 | 145.5 | 175.4 | 33.1 | -33.8 | 0 | 0 | 0 | 111.2 | ||||
| 170 | R | 40.9 | Very low | 36.3 | Very low | 251 Ų | 251 | 161.5 Ų | 161.5 | 95% | 0.947 | 84% | 0.843 | S | S | * | * | trans | -108.1 | 101.5 | 165.5 | -85.5 | -174.1 | 168.6 | 165.9 | -3 | 110 | ||||
| 171 | A | 36.1 | Very low | 36 | Very low | 86 Ų | 86 | 157.6 Ų | 157.6 | 71% | 0.711 | 84% | 0.835 | S | S | * | * | trans | -78.9 | 174.9 | 158.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 172 | L | 36.5 | Very low | 36.1 | Very low | 150 Ų | 150 | 161.5 Ų | 161.5 | 79% | 0.785 | 85% | 0.847 | S | S | * | * | trans | 78.9 | 100 | 171.9 | -52.2 | 174.6 | 0 | 0 | 0 | 117.1 | ||||
| 173 | L | 38.7 | Very low | 36 | Very low | 182 Ų | 182 | 157 Ų | 157 | 95% | 0.953 | 84% | 0.838 | S | S | * | * | -140.2 | 90.5 | 116.4 | -79.2 | -172.7 | 0 | 0 | 0 | 109.7 | |||||
| 174 | H | 38.1 | Very low | 36.1 | Very low | 166 Ų | 166 | 160.6 Ų | 160.6 | 77% | 0.769 | 84% | 0.837 | S | S | * | * | trans | -78.2 | 121.9 | 163.8 | -103.5 | -87.1 | 0 | 0 | 0 | 109.1 | F176 | H174-F176 PolarHBondContact O-N 2.85Š| ||
| 175 | G | 36.3 | Very low | 35.9 | Very low | 80 Ų | 80 | 157.1 Ų | 157.1 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | trans | -73.8 | 109.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 176 | F | 35.1 | Very low | 36.3 | Very low | 193 Ų | 193 | 155.1 Ų | 155.1 | 85% | 0.846 | 83% | 0.833 | S | S | * | * | trans | -84.7 | 117.6 | 170.4 | -88 | -91.2 | 0 | 0 | 0 | 111.7 | H174 | H174-F176 PolarHBondContact O-N 2.85Š| ||
| 177 | R | 39.1 | Very low | 36.3 | Very low | 258 Ų | 258 | 155.4 Ų | 155.4 | 97% | 0.974 | 83% | 0.829 | S | S | * | * | trans | -141 | 86.8 | 147.6 | -92.5 | -164.6 | 176.2 | -172.9 | 0.9 | 110.3 | ||||
| 178 | G | 32.8 | Very low | 36.7 | Very low | 65 Ų | 65 | 156.5 Ų | 156.5 | 67% | 0.67 | 83% | 0.828 | S | S | * | * | trans | -155.1 | 88.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 179 | R | 36.9 | Very low | 36.9 | Very low | 250 Ų | 250 | 149.2 Ų | 149.2 | 94% | 0.943 | 82% | 0.818 | S | S | * | * | trans | -148.8 | 101.1 | 165.7 | -80.4 | -161.9 | 178.3 | -133.8 | 0.1 | 111.8 | ||||
| 180 | R | 35.7 | Very low | 36.6 | Very low | 255 Ų | 255 | 149.2 Ų | 149.2 | 96% | 0.962 | 82% | 0.819 | S | S | * | * | -159.1 | 145.5 | 124.2 | -123.1 | 175.9 | -80.4 | -142 | 2.1 | 109.6 | |||||
| 181 | A | 33.9 | Very low | 36.3 | Very low | 87 Ų | 87 | 142.7 Ų | 142.7 | 72% | 0.719 | 81% | 0.812 | S | S | * | * | trans | -150.9 | 161.3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 182 | L | 37.1 | Very low | 36.6 | Very low | 170 Ų | 170 | 144 Ų | 144 | 89% | 0.89 | 81% | 0.812 | S | S | * | * | trans | 74.9 | 112.9 | 163.5 | -48.4 | -176.9 | 0 | 0 | 0 | 119.2 | ||||
| 183 | S | 31.1 | Very low | 36.2 | Very low | 108 Ų | 108 | 148.2 Ų | 148.2 | 76% | 0.755 | 82% | 0.818 | S | S | * | * | -176.1 | 105.3 | 126.5 | -173 | 0 | 0 | 0 | 0 | 107.2 | |||||
| 184 | L | 32.3 | Very low | 35.8 | Very low | 159 Ų | 159 | 144.9 Ų | 144.9 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | 59.7 | 123.2 | 87 | -66.3 | 176.1 | 0 | 0 | 0 | 115.3 | |||||
| 185 | C | 34.6 | Very low | 35.5 | Very low | 121 Ų | 121 | 142 Ų | 142 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -43.6 | 165.8 | 175.6 | -59.5 | 0 | 0 | 0 | 0 | 116 | ||||
| 186 | P | 43.2 | Very low | 35.3 | Very low | 121 Ų | 121 | 143.6 Ų | 143.6 | 79% | 0.786 | 81% | 0.814 | S | S | * | * | cis | -148.6 | -177.5 | 38.2 | 42.2 | -20.3 | 0 | 0 | 0 | 119.5 | ||||
| 187 | S | 32.9 | Very low | 36.6 | Very low | 103 Ų | 103 | 140.1 Ų | 140.1 | 72% | 0.72 | 81% | 0.81 | S | S | * | * | trans | -63.3 | 163.1 | 170.5 | -176.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 188 | P | 43.4 | Very low | 37.1 | Very low | 120 Ų | 120 | 132.6 Ų | 132.6 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | -138.7 | 162.5 | 109.4 | 38 | -27.2 | 0 | 0 | 0 | 115.4 | |||||
| 189 | A | 36.8 | Very low | 36.8 | Very low | 85 Ų | 85 | 141 Ų | 141 | 70% | 0.702 | 81% | 0.806 | S | S | * | * | trans | -71.6 | 170.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 190 | P | 37.4 | Very low | 36.6 | Very low | 124 Ų | 124 | 134.1 Ų | 134.1 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | -144.5 | 161.5 | 90.4 | 37.9 | -22.9 | 0 | 0 | 0 | 116.5 | |||||
| 191 | S | 34.1 | Very low | 36.8 | Very low | 114 Ų | 114 | 126.1 Ų | 126.1 | 80% | 0.797 | 79% | 0.785 | S | S | * | * | trans | -130.2 | 147.4 | 153.9 | -75.3 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 192 | P | 42.8 | Very low | 37.2 | Very low | 112 Ų | 112 | 128.5 Ų | 128.5 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | -154.6 | 157.9 | 74.9 | 39.3 | -19 | 0 | 0 | 0 | 118.8 | |||||
| 193 | R | 28.1 | Very low | 36.9 | Very low | 239 Ų | 239 | 128.7 Ų | 128.7 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | trans | 51 | 116.7 | 139.8 | -68.6 | 176.7 | 164.5 | -159.2 | -4.8 | 121.2 | ||||
| 194 | S | 29.8 | Very low | 37.1 | Very low | 112 Ų | 112 | 128.7 Ų | 128.7 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | -172.2 | 116.9 | 107.5 | 31.5 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 195 | A | 31.7 | Very low | 37.6 | Very low | 106 Ų | 106 | 127 Ų | 127 | 88% | 0.876 | 79% | 0.788 | S | S | * | * | 82.3 | 127.4 | 88.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 196 | S | 33 | Very low | 37.5 | Very low | 114 Ų | 114 | 125.9 Ų | 125.9 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | -154.5 | 176.8 | -175.9 | 65 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 197 | P | 62 | Low | 37.4 | Very low | 119 Ų | 119 | 124.8 Ų | 124.8 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | cis | -108.5 | -92 | -30.9 | 27.9 | -8.5 | 0 | 0 | 0 | 109.7 | ||||
| 198 | P | 49.7 | Very low | 37.8 | Very low | 101 Ų | 101 | 125.6 Ų | 125.6 | 66% | 0.656 | 79% | 0.792 | S | S | * | * | cis | -124.6 | 158.7 | -27.1 | 39.2 | -23.6 | 0 | 0 | 0 | 116.2 | ||||
| 199 | R | 26.6 | Very low | 37.6 | Very low | 241 Ų | 241 | 124.7 Ų | 124.7 | 91% | 0.909 | 79% | 0.794 | S | S | * | * | trans | 70.1 | 147.8 | 149.9 | -107.5 | 174.9 | 176.2 | -174.2 | -3.7 | 118.5 | ||||
| 200 | S | 32.7 | Very low | 37.9 | Very low | 105 Ų | 105 | 125.9 Ų | 125.9 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | cis | -151.3 | 159.8 | 19.3 | -59 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 201 | A | 38.7 | Very low | 38.8 | Very low | 88 Ų | 88 | 125.7 Ų | 125.7 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | trans | -85.4 | 170.3 | 161.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 202 | P | 42.6 | Very low | 39.5 | Very low | 136 Ų | 136 | 126.2 Ų | 126.2 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | -143.1 | -173.5 | 97.5 | 37.9 | -21.4 | 0 | 0 | 0 | 115.1 | |||||
| 203 | Q | 30.5 | Very low | 39.7 | Very low | 174 Ų | 174 | 132 Ų | 132 | 81% | 0.813 | 80% | 0.804 | S | S | * | * | trans | -109.2 | 148.4 | -158.1 | -56 | 160.1 | -23.1 | 0 | 0 | 114.5 | ||||
| 204 | S | 36 | Very low | 40.6 | Very low | 109 Ų | 109 | 126.3 Ų | 126.3 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | trans | 59.8 | 163.5 | 143.6 | 65.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 205 | P | 43.2 | Very low | 41.1 | Very low | 123 Ų | 123 | 125.8 Ų | 125.8 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | cis | -137.4 | -163.7 | 14.1 | 44.2 | -25 | 0 | 0 | 0 | 116.2 | ||||
| 206 | A | 33 | Very low | 41.4 | Very low | 98 Ų | 98 | 127.1 Ų | 127.1 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | 87.8 | 121.1 | 163.9 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 207 | A | 41.3 | Very low | 41.5 | Very low | 97 Ų | 97 | 126.8 Ų | 126.8 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | -82.2 | 154.4 | 164 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 208 | P | 40.3 | Very low | 40.2 | Very low | 121 Ų | 121 | 124.6 Ų | 124.6 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | -147.5 | 161.2 | 106.3 | 38.2 | -23.8 | 0 | 0 | 0 | 116.1 | |||||
| 209 | A | 39.8 | Very low | 39.6 | Very low | 101 Ų | 101 | 124.9 Ų | 124.9 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | trans | 60.4 | 134.7 | 152.4 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 210 | S | 42.5 | Very low | 40.4 | Very low | 110 Ų | 110 | 121.3 Ų | 121.3 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -80.4 | 149.1 | 174.8 | 42.2 | 0 | 0 | 0 | 0 | 113.3 | ||
| 211 | P | 57.4 | Low | 41.1 | Very low | 119 Ų | 119 | 122 Ų | 122 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 146.8 | 169.4 | 32.1 | -33.8 | 0 | 0 | 0 | 111.7 | ||
| 212 | P | 47.9 | Very low | 41 | Very low | 125 Ų | 125 | 127.2 Ų | 127.2 | 81% | 0.812 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 143.9 | -176.6 | 31 | -35.1 | 0 | 0 | 0 | 113.9 | ||
| 213 | R | 48 | Very low | 41.1 | Very low | 233 Ų | 233 | 129.1 Ų | 129.1 | 88% | 0.879 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -70 | 141.3 | 162.4 | -91.5 | -178.3 | 173.8 | 172.2 | -1.6 | 110.7 | ||
| 214 | P | 46.8 | Very low | 42.2 | Very low | 121 Ų | 121 | 132.6 Ų | 132.6 | 79% | 0.786 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -87 | 139.8 | 157.2 | 32.5 | -30.5 | 0 | 0 | 0 | 111.4 | ||
| 215 | S | 38.8 | Very low | 42.6 | Very low | 101 Ų | 101 | 132.2 Ų | 132.2 | 71% | 0.706 | 82% | 0.819 | S | S | * | * | trans | -152.6 | 156.7 | 169 | -82.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 216 | T | 38 | Very low | 42.6 | Very low | 134 Ų | 134 | 135.5 Ų | 135.5 | 82% | 0.822 | 82% | 0.824 | S | S | * | * | trans | 87.3 | 98.4 | 158.1 | -53.1 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 217 | A | 36.4 | Very low | 43.2 | Very low | 106 Ų | 106 | 140.1 Ų | 140.1 | 88% | 0.876 | 83% | 0.826 | S | S | * | * | 63.8 | 145.7 | 124.3 | 0 | 0 | 0 | 0 | 0 | 124.9 | |||||
| 218 | G | 34 | Very low | 43.7 | Very low | 74 Ų | 74 | 141.5 Ų | 141.5 | 76% | 0.763 | 83% | 0.826 | S | S | * | * | trans | 140.1 | 91.2 | 164.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 219 | A | 36.9 | Very low | 44 | Very low | 106 Ų | 106 | 142.5 Ų | 142.5 | 88% | 0.876 | 83% | 0.83 | S | S | * | * | 102.9 | 129.2 | 77.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 220 | I | 44.1 | Very low | 44.6 | Very low | 167 Ų | 167 | 144.4 Ų | 144.4 | 86% | 0.856 | 83% | 0.831 | S | S | * | * | trans | -130 | 147.5 | -175.3 | -66.9 | 179.3 | 0 | 0 | 0 | 110.1 | ||||
| 221 | P | 46.6 | Very low | 44.3 | Very low | 120 Ų | 120 | 143.7 Ų | 143.7 | 78% | 0.779 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 163.3 | -160.5 | -6.8 | 26.4 | 0 | 0 | 0 | 116.6 | ||
| 222 | Q | 37.9 | Very low | 44 | Very low | 196 Ų | 196 | 142.9 Ų | 142.9 | 92% | 0.916 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 141.8 | 173.4 | -62.1 | -176.8 | -0.9 | 0 | 0 | 112.6 | ||
| 223 | L | 43.4 | Very low | 43.9 | Very low | 176 Ų | 176 | 144.8 Ų | 144.8 | 92% | 0.921 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 150.7 | 174.9 | -108.6 | 85.9 | 0 | 0 | 0 | 113.2 | ||
| 224 | R | 53.5 | Low | 44.2 | Very low | 247 Ų | 247 | 139.1 Ų | 139.1 | 93% | 0.932 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -83.4 | 157.8 | 178.6 | -85.8 | 179.8 | 167.3 | 155.9 | -4 | 113.6 | ||
| 225 | S | 44.2 | Very low | 44.3 | Very low | 101 Ų | 101 | 138.1 Ų | 138.1 | 71% | 0.706 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 158.3 | -173.2 | 97.5 | 0 | 0 | 0 | 0 | 114.9 | ||
| 226 | H | 44.8 | Very low | 44.4 | Very low | 193 Ų | 193 | 143.1 Ų | 143.1 | 89% | 0.894 | 83% | 0.826 | S | S | * | * | trans | -141.7 | 154.2 | 153.4 | -79.8 | -76 | 0 | 0 | 0 | 110.9 | ||||
| 227 | K | 45.2 | Very low | 45.1 | Very low | 195 Ų | 195 | 142.7 Ų | 142.7 | 85% | 0.848 | 82% | 0.823 | S | S | * | * | trans | -89.5 | 154.8 | -165.8 | -66.9 | 168.8 | 171.2 | 175.3 | 0 | 114.4 | ||||
| 228 | P | 50.3 | Low | 45.8 | Very low | 125 Ų | 125 | 142.7 Ų | 142.7 | 81% | 0.812 | 82% | 0.816 | S | S | * | * | trans | -93.8 | 149.7 | 158.5 | 35.9 | -30.3 | 0 | 0 | 0 | 112.9 | ||||
| 229 | T | 47.6 | Very low | 46.7 | Very low | 142 Ų | 142 | 147.3 Ų | 147.3 | 87% | 0.871 | 82% | 0.822 | S | S | * | * | trans | -126.1 | 155.1 | 168.7 | -63.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 230 | V | 51.7 | Low | 47.6 | Very low | 141 Ų | 141 | 147.4 Ų | 147.4 | 86% | 0.855 | 81% | 0.814 | S | S | * | * | trans | -82.6 | 165.5 | -155.3 | 177.9 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 231 | A | 37.8 | Very low | 48.2 | Very low | 95 Ų | 95 | 145.1 Ų | 145.1 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | trans | 98.4 | 143.5 | 160.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 232 | S | 50.3 | Low | 48.3 | Very low | 103 Ų | 103 | 145.7 Ų | 145.7 | 72% | 0.72 | 81% | 0.813 | S | S | * | * | cis | -169.8 | 173 | -16.9 | -173.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 233 | L | 45.3 | Very low | 48.8 | Very low | 164 Ų | 164 | 140 Ų | 140 | 86% | 0.859 | 81% | 0.808 | S | S | * | * | trans | 76.2 | 122.5 | 164 | -50.5 | -178 | 0 | 0 | 0 | 119.4 | ||||
| 234 | S | 54.5 | Low | 49.2 | Very low | 114 Ų | 114 | 135 Ų | 135 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | -83.1 | 142.6 | 162.5 | 168.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 235 | P | 48.3 | Very low | 49.2 | Very low | 100 Ų | 100 | 127.9 Ų | 127.9 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | -145.1 | 164.5 | 113.1 | 35.1 | -18.9 | 0 | 0 | 0 | 115.2 | |||||
| 236 | Y | 41.8 | Very low | 49.4 | Very low | 207 Ų | 207 | 129.1 Ų | 129.1 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | trans | 82.6 | 100.1 | 176 | -59 | -76.9 | 0 | 0 | 0 | 118.1 | ||||
| 237 | T | 51.8 | Low | 49.9 | Very low | 124 Ų | 124 | 128 Ų | 128 | 76% | 0.761 | 79% | 0.794 | S | S | * | * | 5 | 128.4 | 114.8 | -18 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 238 | C | 51.7 | Low | 49.9 | Very low | 107 Ų | 107 | 124.4 Ų | 124.4 | 72% | 0.723 | 79% | 0.79 | S | S | * | * | cis | -155.7 | 123.3 | 49.3 | -59.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 239 | L | 53.6 | Low | 49.5 | Very low | 170 Ų | 170 | 126.3 Ų | 126.3 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -143.7 | 144.2 | 153 | -74.8 | -179.4 | 0 | 0 | 0 | 109.3 | ||||
| 240 | P | 54.5 | Low | 49.4 | Very low | 109 Ų | 109 | 126.1 Ų | 126.1 | 71% | 0.708 | 79% | 0.786 | S | S | * | * | trans | -72.7 | 157.6 | -178.1 | 30.9 | -35.5 | 0 | 0 | 0 | 112 | ||||
| 241 | P | 56.8 | Low | 49.1 | Very low | 119 Ų | 119 | 124.6 Ų | 124.6 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | trans | -66.6 | 135.6 | 178.4 | -16.9 | 30.5 | 0 | 0 | 0 | 111.8 | G243 | P241-G243 PolarHBondContact O-N 3.24Å; P241-G243 VanDerWaalsContact O-N 3.09Å | ||
| 242 | P | 49.9 | Very low | 49.3 | Very low | 131 Ų | 131 | 130.4 Ų | 130.4 | 85% | 0.851 | 78% | 0.782 | S | S | * | * | trans | -69.7 | 104.1 | 164.5 | 28.7 | -31.6 | 0 | 0 | 0 | 108.9 | ||||
| 243 | G | 47.1 | Very low | 49.1 | Very low | 77 Ų | 77 | 134.3 Ų | 134.3 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | -75 | 133.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | P241 | P241-G243 PolarHBondContact O-N 3.24Å; P241-G243 VanDerWaalsContact O-N 3.09Å | ||
| 244 | G | 51.4 | Low | 49.3 | Very low | 72 Ų | 72 | 131.5 Ų | 131.5 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | trans | 84.2 | 101.4 | 163.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 245 | A | 54.6 | Low | 49.2 | Very low | 97 Ų | 97 | 132.1 Ų | 132.1 | 80% | 0.802 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 136.2 | 158.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | Q247 | A245-Q247 PolarHBondContact O-N 3.38Š|
| 246 | P | 47.7 | Very low | 49.5 | Very low | 127 Ų | 127 | 131 Ų | 131 | 83% | 0.825 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 117 | 172.6 | 27.3 | -32.1 | 0 | 0 | 0 | 109.2 | ||
| 247 | Q | 55.3 | Low | 50.4 | Low | 170 Ų | 170 | 127.2 Ų | 127.2 | 79% | 0.794 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 145.6 | 168.4 | -99.9 | -176.2 | -9.8 | 0 | 0 | 110 | A245 L249 | A245-Q247 PolarHBondContact O-N 3.38Å; Q247-L249 PolarHBondContact O-N 2.94Å |
| 248 | P | 44.8 | Very low | 51.6 | Low | 118 Ų | 118 | 124 Ų | 124 | 77% | 0.766 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 122.8 | 171.5 | 23.7 | -30.2 | 0 | 0 | 0 | 109.7 | N250 | P248-N250 PolarHBondContact O-N 3.37Š|
| 249 | L | 43.6 | Very low | 52.9 | Low | 166 Ų | 166 | 120.6 Ų | 120.6 | 87% | 0.869 | 72% | 0.717 | S | S | * | * | trans | -66.1 | 112.5 | -177.7 | -66.8 | 168 | 0 | 0 | 0 | 109.8 | Q247 P251 | Q247-L249 PolarHBondContact O-N 2.94Å; L249-P251 VanDerWaalsContact O-CD 3.28Å; L249-P251 WeakPolarHBondContact O-CD 3.42Å | ||
| 250 | N | 44.9 | Very low | 54.2 | Low | 138 Ų | 138 | 115 Ų | 115 | 74% | 0.738 | 70% | 0.695 | S | S | * | * | trans | -64.2 | 120.6 | 166.9 | -81.4 | -64.2 | 0 | 0 | 0 | 109.4 | P248 Y252 | P248-N250 PolarHBondContact O-N 3.37Å; N250-Y252 PolarHBondContact O-N 3.4Å; N250-Y252 VanDerWaalsContact O-N 3.12Å | ||
| 251 | P | 45.5 | Very low | 55.8 | Low | 109 Ų | 109 | 115.1 Ų | 115.1 | 71% | 0.708 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -70 | -5.9 | -178.9 | -22.1 | 35.6 | 0 | 0 | 0 | 115.1 | L249 K253 | L249-P251 VanDerWaalsContact O-CD 3.28Å; L249-P251 WeakPolarHBondContact O-CD 3.42Å; P251-K253 PolarHBondContact O-N 3.41Å |
| 252 | Y | 42.6 | Very low | 57.2 | Low | 216 Ų | 216 | 113.3 Ų | 113.3 | 85% | 0.847 | 67% | 0.673 | S | S | * | * | trans | -99 | 49.1 | -172.4 | -67 | -76.5 | 0 | 0 | 0 | 113.7 | N250 | N250-Y252 PolarHBondContact O-N 3.4Å; N250-Y252 VanDerWaalsContact O-N 3.12Å | ||
| 253 | K | 45.9 | Very low | 59 | Low | 185 Ų | 185 | 109.7 Ų | 109.7 | 80% | 0.804 | 65% | 0.646 | S | S | * | * | trans | -140.4 | 32.7 | 173.5 | -141.2 | -176.4 | -174.5 | -173.6 | 0 | 116.2 | P251 | P251-K253 PolarHBondContact O-N 3.41Š| ||
| 254 | S | 48 | Very low | 60.9 | Low | 106 Ų | 106 | 110.4 Ų | 110.4 | 74% | 0.741 | 64% | 0.64 | S | S | * | * | trans | -73.4 | 133.9 | 147.2 | 55.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 255 | H | 52.8 | Low | 62.7 | Low | 126 Ų | 126 | 111.1 Ų | 111.1 | 58% | 0.583 | 64% | 0.638 | S | S | * | * | cis | -168.3 | 66.2 | 29.9 | -179.4 | 75.4 | 0 | 0 | 0 | 111.5 | T258 | H255-T258 WeakPolarHBondContact CE1-CB 3.39Å; H255-T258 PolarHBondContact CE1-OG1 3.36Å; H255-T258 PolarHBondContact ND1-OG1 2.95Å; H255-T258 WeakPolarHBondContact NE2-CB 3.46Å | ||
| 256 | P | 54.1 | Low | 64.3 | Low | 76 Ų | 76 | 107.6 Ų | 107.6 | 49% | 0.494 | 61% | 0.606 | S | S | . | * | S | Bend | trans | -77.6 | -38.3 | 176.1 | 30.2 | -32.1 | 0 | 0 | 0 | 112.3 | T258 A259 A260 | P256-T258 PolarHBondContact O-N 2.89Å; P256-A259 PolarHBondContact O-N 3.19Å; P256-A260 PolarHBondContact O-N 2.98Å |
| 257 | D | 61.2 | Low | 66.3 | Low | 128 Ų | 128 | 103.4 Ų | 103.4 | 68% | 0.684 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.7 | -38.4 | -167 | -58.6 | -33.2 | 0 | 0 | 0 | 112.7 | A260 D261 | D257-A260 PolarHBondContact O-N 3.33Å; D257-D261 VanDerWaalsContact O-CB 3.29Å; D257-D261 WeakPolarHBondContact O-CB 3.24Å; D257-D261 PolarHBondContact O-N 3.28Å |
| 258 | T | 77.1 | Confident | 68 | Low | 56 Ų | 56 | 100.9 Ų | 100.9 | 34% | 0.344 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -72.7 | -29.3 | 179.3 | -50.3 | 0 | 0 | 0 | 0 | 113.1 | H255 P256 L262 | H255-T258 WeakPolarHBondContact CE1-CB 3.39Å; H255-T258 PolarHBondContact CE1-OG1 3.36Å; H255-T258 PolarHBondContact ND1-OG1 2.95Å; H255-T258 WeakPolarHBondContact NE2-CB 3.46Å; P256-T258 PolarHBondContact O-N 2.89Å; T258-L262 HydrophobicContact CG2-CD1 4.33Å; T258-L262 HydrophobicContact CG2-CG 4.41Å; T258-L262 WeakPolarHBondContact O-CB 3.11Å; T258-L262 WeakPolarHBondContact O-CG 3.49Å; T258-L262 PolarHBondContact O-N 3.26Å |
| 259 | A | 79.3 | Confident | 70.2 | Confident | 36 Ų | 36 | 101.1 Ų | 101.1 | 30% | 0.298 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -69.1 | -38.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111 | P256 L263 L284 | P256-A259 PolarHBondContact O-N 3.19Å; A259-L263 WeakPolarHBondContact O-CG 3.3Å; A259-L263 PolarHBondContact O-N 2.82Å; A259-L284 HydrophobicContact CB-CD2 3.88Å |
| 260 | A | 80.9 | Confident | 72.6 | Confident | 52 Ų | 52 | 94.6 Ų | 94.6 | 43% | 0.43 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68.2 | -40.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | P256 D257 L263 S264 | P256-A260 PolarHBondContact O-N 2.98Å; D257-A260 PolarHBondContact O-N 3.33Å; A260-L263 PolarHBondContact O-N 2.86Å; A260-S264 VanDerWaalsContact O-CB 3.3Å; A260-S264 WeakPolarHBondContact O-CB 3.43Å; A260-S264 PolarHBondContact O-N 2.96Å; A260-S264 PolarHBondContact O-OG 2.71Å |
| 261 | D | 87.3 | Confident | 74.8 | Confident | 112 Ų | 112 | 90.8 Ų | 90.8 | 60% | 0.599 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.5 | -48.1 | 175.8 | -169.9 | 39.3 | 0 | 0 | 0 | 111.5 | D257 L263 S264 A265 | D257-D261 VanDerWaalsContact O-CB 3.29Å; D257-D261 WeakPolarHBondContact O-CB 3.24Å; D257-D261 PolarHBondContact O-N 3.28Å; D261-L263 VanDerWaalsContact C-N 3.31Å; D261-L263 PolarHBondContact O-N 3.28Å; D261-S264 PolarHBondContact O-N 3.05Å; D261-S264 VanDerWaalsContact O-N 3.08Å; D261-A265 PolarHBondContact O-N 2.83Å |
| 262 | L | 86.8 | Confident | 77 | Confident | 81 Ų | 81 | 90.3 Ų | 90.3 | 42% | 0.424 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.1 | -37.9 | 175.3 | -75.8 | 172.6 | 0 | 0 | 0 | 113.1 | T258 L266 I288 | T258-L262 HydrophobicContact CG2-CD1 4.33Å; T258-L262 HydrophobicContact CG2-CG 4.41Å; T258-L262 WeakPolarHBondContact O-CB 3.11Å; T258-L262 WeakPolarHBondContact O-CG 3.49Å; T258-L262 PolarHBondContact O-N 3.26Å; L262-L266 WeakPolarHBondContact O-CG 3.33Å; L262-I288 HydrophobicContact CB-CD1 4.09Å |
| 263 | L | 87.4 | Confident | 79.4 | Confident | 55 Ų | 55 | 81.5 Ų | 81.5 | 29% | 0.288 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -71.9 | -39 | 173.9 | -75.4 | 168.9 | 0 | 0 | 0 | 111.8 | A259 A260 D261 A265 L266 Q271 I274 L284 | A259-L263 WeakPolarHBondContact O-CG 3.3Å; A259-L263 PolarHBondContact O-N 2.82Å; A260-L263 PolarHBondContact O-N 2.86Å; D261-L263 VanDerWaalsContact C-N 3.31Å; D261-L263 PolarHBondContact O-N 3.28Å; L263-A265 PolarHBondContact O-N 3.28Å; L263-L266 WeakPolarHBondContact O-CB 3.44Å; L263-L266 PolarHBondContact O-N 3.04Å; L263-Q271 HydrophobicContact CD2-CG 4.44Å; L263-Q271 PolarHBondContact O-NE2 2.95Å; L263-I274 HydrophobicContact CD2-CG2 4.13Å; L263-L284 HydrophobicContact CD1-CD2 4.42Å; L263-L284 HydrophobicContact CD2-CD1 3.75Å; L263-L284 HydrophobicContact CG-CD1 4.1Å; L263-L284 HydrophobicContact CG-CD2 4.21Å |
| 264 | S | 86.8 | Confident | 81.7 | Confident | 93 Ų | 93 | 72.8 Ų | 72.8 | 65% | 0.65 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -68 | -23.4 | -179.3 | -58.2 | 0 | 0 | 0 | 0 | 113.4 | A260 D261 L266 | A260-S264 VanDerWaalsContact O-CB 3.3Å; A260-S264 WeakPolarHBondContact O-CB 3.43Å; A260-S264 PolarHBondContact O-N 2.96Å; A260-S264 PolarHBondContact O-OG 2.71Å; D261-S264 PolarHBondContact O-N 3.05Å; D261-S264 VanDerWaalsContact O-N 3.08Å; S264-L266 VanDerWaalsContact C-N 3.26Å |
| 265 | A | 89.1 | Confident | 83.9 | Confident | 86 Ų | 86 | 69.6 Ų | 69.6 | 71% | 0.711 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | -12.5 | 171.9 | 0 | 0 | 0 | 0 | 0 | 114 | D261 L263 | D261-A265 PolarHBondContact O-N 2.83Å; L263-A265 PolarHBondContact O-N 3.28Å |
| 266 | L | 88.8 | Confident | 85.9 | Confident | 24 Ų | 24 | 66.1 Ų | 66.1 | 13% | 0.126 | 40% | 0.395 | C | S | . | . | S | Bend | trans | -100.2 | 153.5 | -178 | -60.5 | 169.1 | 0 | 0 | 0 | 111.3 | L262 L263 S264 E270 Q271 I274 I288 | L262-L266 WeakPolarHBondContact O-CG 3.33Å; L263-L266 WeakPolarHBondContact O-CB 3.44Å; L263-L266 PolarHBondContact O-N 3.04Å; S264-L266 VanDerWaalsContact C-N 3.26Å; L266-E270 WeakPolarHBondContact CA-OE2 3.43Å; L266-E270 HydrophobicContact CB-CB 4.06Å; L266-Q271 HydrophobicContact CB-CG 4.28Å; L266-Q271 PolarHBondContact O-NE2 3.13Å; L266-I274 HydrophobicContact CD1-CD1 3.53Å; L266-I288 HydrophobicContact CD1-CD1 3.93Å; L266-I288 HydrophobicContact CD1-CG1 3.76Å; L266-I288 HydrophobicContact CD1-CG2 4.31Å; L266-I288 HydrophobicContact CD2-CG2 4.42Å |
| 267 | S | 90.8 | Very high | 87.8 | Confident | 38 Ų | 38 | 62.5 Ų | 62.5 | 27% | 0.266 | 37% | 0.372 | S | S | . | . | trans | -67.2 | 157.7 | 175.6 | 84.7 | 0 | 0 | 0 | 0 | 111.5 | E269 E270 Q271 | S267-E269 PolarHBondContact O-N 3.35Å; S267-E269 PolarHBondContact OG-N 2.9Å; S267-E270 PolarHBondContact N-OE2 3Å; S267-E270 WeakPolarHBondContact O-CB 3.25Å; S267-E270 PolarHBondContact O-N 3.49Å; S267-E270 WeakPolarHBondContact OG-CG 3.46Å; S267-E270 PolarHBondContact OG-N 2.89Å; S267-Q271 WeakPolarHBondContact O-CG 3.33Å; S267-Q271 PolarHBondContact O-N 3.33Å | ||
| 268 | Q | 90.8 | Very high | 89.4 | Confident | 117 Ų | 117 | 59.2 Ų | 59.2 | 55% | 0.547 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -57 | -39.4 | 175.8 | -171.6 | 62.9 | 57.1 | 0 | 0 | 111.8 | E270 Q271 D272 | Q268-E270 VanDerWaalsContact C-N 3.28Å; Q268-E270 PolarHBondContact O-N 3.22Å; Q268-Q271 PolarHBondContact O-N 2.82Å; Q268-D272 PolarHBondContact NE2-OD1 3.27Å; Q268-D272 WeakPolarHBondContact O-CB 3.42Å; Q268-D272 PolarHBondContact O-N 3.05Å |
| 269 | E | 91.4 | Very high | 90.2 | Very high | 123 Ų | 123 | 60.8 Ų | 60.8 | 58% | 0.575 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -59.8 | -38 | 176.2 | -57.7 | 172.6 | 170.7 | 0 | 0 | 112 | S267 L273 | S267-E269 PolarHBondContact O-N 3.35Å; S267-E269 PolarHBondContact OG-N 2.9Å; E269-L273 WeakPolarHBondContact O-CG 3.5Å; E269-L273 PolarHBondContact O-N 2.89Å |
| 270 | E | 92.2 | Very high | 90.9 | Very high | 30 Ų | 30 | 64.4 Ų | 64.4 | 14% | 0.14 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -73.2 | -41.5 | 177.9 | -69.5 | 158.9 | -178.5 | 0 | 0 | 111.3 | L266 S267 Q268 L273 I274 L291 R296 | L266-E270 WeakPolarHBondContact CA-OE2 3.43Å; L266-E270 HydrophobicContact CB-CB 4.06Å; S267-E270 PolarHBondContact N-OE2 3Å; S267-E270 WeakPolarHBondContact O-CB 3.25Å; S267-E270 PolarHBondContact O-N 3.49Å; S267-E270 WeakPolarHBondContact OG-CG 3.46Å; S267-E270 PolarHBondContact OG-N 2.89Å; Q268-E270 VanDerWaalsContact C-N 3.28Å; Q268-E270 PolarHBondContact O-N 3.22Å; E270-L273 PolarHBondContact O-N 3.38Å; E270-I274 WeakPolarHBondContact O-CB 3.4Å; E270-I274 WeakPolarHBondContact O-CD1 3.47Å; E270-I274 WeakPolarHBondContact O-CG1 3.43Å; E270-I274 PolarHBondContact O-N 3.47Å; E270-L291 HydrophobicContact CB-CD2 3.67Å; E270-L291 HydrophobicContact CG-CD2 3.88Å; E270-R296 HydrophobicContact CG-CG 4.18Å; E270-R296 IonicContact OE1-CZ 2.71Å; E270-R296 IonicContact OE1-NE 3.37Å; E270-R296 PolarHBondContact OE1-NE 3.15Å; E270-R296 IonicContact OE1-NH2 3.28Å; E270-R296 PolarHBondContact OE1-NH2 2.98Å |
| 271 | Q | 92.3 | Very high | 91.5 | Very high | 57 Ų | 57 | 65.1 Ų | 65.1 | 27% | 0.266 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.6 | -42.3 | 174.8 | -65.5 | 174.8 | 30.6 | 0 | 0 | 111.9 | L263 L266 S267 Q268 L273 I274 G275 | L263-Q271 HydrophobicContact CD2-CG 4.44Å; L263-Q271 PolarHBondContact O-NE2 2.95Å; L266-Q271 HydrophobicContact CB-CG 4.28Å; L266-Q271 PolarHBondContact O-NE2 3.13Å; S267-Q271 WeakPolarHBondContact O-CG 3.33Å; S267-Q271 PolarHBondContact O-N 3.33Å; Q268-Q271 PolarHBondContact O-N 2.82Å; Q271-L273 PolarHBondContact O-N 3.03Å; Q271-I274 PolarHBondContact O-N 2.87Å; Q271-G275 PolarHBondContact O-N 2.95Å |
| 272 | D | 91.9 | Very high | 91.9 | Very high | 100 Ų | 100 | 61.9 Ų | 61.9 | 54% | 0.535 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.3 | -30.1 | 178.7 | -68.8 | -10.5 | 0 | 0 | 0 | 112.2 | Q268 P276 | Q268-D272 PolarHBondContact NE2-OD1 3.27Å; Q268-D272 WeakPolarHBondContact O-CB 3.42Å; Q268-D272 PolarHBondContact O-N 3.05Å; D272-P276 WeakPolarHBondContact O-CD 3.19Å |
| 273 | L | 93.1 | Very high | 92.2 | Very high | 30 Ų | 30 | 61.9 Ų | 61.9 | 16% | 0.157 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -80.3 | -37 | 173.7 | -67.6 | 171.5 | 0 | 0 | 0 | 112.6 | E269 E270 Q271 L291 Q297 L299 F302 | E269-L273 WeakPolarHBondContact O-CG 3.5Å; E269-L273 PolarHBondContact O-N 2.89Å; E270-L273 PolarHBondContact O-N 3.38Å; Q271-L273 PolarHBondContact O-N 3.03Å; L273-L291 HydrophobicContact CB-CD1 4.24Å; L273-L291 HydrophobicContact CB-CD2 4.39Å; L273-L291 HydrophobicContact CD1-CD1 3.78Å; L273-Q297 WeakPolarHBondContact CD1-O 3.44Å; L273-L299 HydrophobicContact CD2-CB 3.79Å; L273-F302 HydrophobicContact CB-CD1 4.36Å; L273-F302 HydrophobicContact CB-CE1 4.5Å; L273-F302 WeakPolarHBondContact O-CE1 3.36Å |
| 274 | I | 94.1 | Very high | 92.5 | Very high | 2 Ų | 2 | 60.9 Ų | 60.9 | 1% | 0.01 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -73.1 | -38.8 | -179.4 | -74.1 | 160.9 | 0 | 0 | 0 | 112.3 | L263 L266 E270 Q271 V277 V278 L284 A287 I288 L291 | L263-I274 HydrophobicContact CD2-CG2 4.13Å; L266-I274 HydrophobicContact CD1-CD1 3.53Å; E270-I274 WeakPolarHBondContact O-CB 3.4Å; E270-I274 WeakPolarHBondContact O-CD1 3.47Å; E270-I274 WeakPolarHBondContact O-CG1 3.43Å; E270-I274 PolarHBondContact O-N 3.47Å; Q271-I274 PolarHBondContact O-N 2.87Å; I274-V277 WeakPolarHBondContact O-CB 3.26Å; I274-V277 PolarHBondContact O-N 2.98Å; I274-V278 HydrophobicContact CG2-CG2 3.67Å; I274-V278 PolarHBondContact O-N 3.18Å; I274-L284 HydrophobicContact CG2-CD1 3.67Å; I274-A287 HydrophobicContact CG2-CB 4.24Å; I274-I288 HydrophobicContact CD1-CG1 3.82Å; I274-L291 HydrophobicContact CD1-CD2 3.76Å; I274-L291 HydrophobicContact CG1-CD2 3.87Å |
| 275 | G | 93.4 | Very high | 92.8 | Very high | 40 Ų | 40 | 65.3 Ų | 65.3 | 41% | 0.412 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -50.5 | -53.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q271 V277 V278 A279 | Q271-G275 PolarHBondContact O-N 2.95Å; G275-V277 VanDerWaalsContact C-N 3.29Å; G275-V277 PolarHBondContact O-N 2.7Å; G275-V278 PolarHBondContact O-N 3.48Å; G275-A279 WeakPolarHBondContact O-CB 3.32Å; G275-A279 PolarHBondContact O-N 2.9Å |
| 276 | P | 94.3 | Very high | 92.9 | Very high | 53 Ų | 53 | 63.7 Ų | 63.7 | 34% | 0.344 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -59.8 | -35.4 | 175.2 | -25.8 | 35.2 | 0 | 0 | 0 | 113.8 | D272 A279 L280 L299 | D272-P276 WeakPolarHBondContact O-CD 3.19Å; P276-A279 PolarHBondContact O-N 3.21Å; P276-L280 WeakPolarHBondContact O-CG 3.17Å; P276-L280 PolarHBondContact O-N 3.42Å; P276-L280 VanDerWaalsContact O-N 3.09Å; P276-L299 HydrophobicContact CB-CD1 4.32Å; P276-L299 HydrophobicContact CB-CD2 4.08Å; P276-L299 HydrophobicContact CG-CD2 4.11Å |
| 277 | V | 94.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -73.4 | -39.9 | -178.8 | 171 | 0 | 0 | 0 | 0 | 111.8 | I274 G275 A279 L280 Y282 A287 L299 F302 L303 L306 | I274-V277 WeakPolarHBondContact O-CB 3.26Å; I274-V277 PolarHBondContact O-N 2.98Å; G275-V277 VanDerWaalsContact C-N 3.29Å; G275-V277 PolarHBondContact O-N 2.7Å; V277-A279 VanDerWaalsContact C-N 3.33Å; V277-L280 WeakPolarHBondContact O-CB 3.28Å; V277-L280 PolarHBondContact O-N 2.92Å; V277-Y282 HydrophobicContact CG1-CD2 3.8Å; V277-Y282 HydrophobicContact CG1-CG 3.96Å; V277-Y282 WeakPolarHBondContact O-CD2 3.42Å; V277-Y282 PolarHBondContact O-N 3.49Å; V277-A287 HydrophobicContact CG1-CB 3.78Å; V277-L299 HydrophobicContact CG2-CD1 3.94Å; V277-F302 HydrophobicContact CB-CE1 3.93Å; V277-F302 HydrophobicContact CB-CZ 4.28Å; V277-F302 HydrophobicContact CG1-CE1 4.26Å; V277-F302 HydrophobicContact CG1-CZ 4.13Å; V277-F302 HydrophobicContact CG2-CD1 3.73Å; V277-F302 HydrophobicContact CG2-CE1 3.34Å; V277-F302 HydrophobicContact CG2-CZ 4.02Å; V277-L303 HydrophobicContact CG2-CD2 3.76Å; V277-L303 HydrophobicContact CG2-CG 4.31Å; V277-L306 HydrophobicContact CG1-CD1 3.49Å; V277-L306 VanDerWaalsContact CG1-CD1 3.49Å; V277-L306 HydrophobicContact CG2-CD1 4.29Å |
| 278 | V | 95.1 | Very high | 93.3 | Very high | 58 Ų | 58 | 61.5 Ų | 61.5 | 35% | 0.352 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -67.2 | -36.5 | 172.5 | 176.4 | 0 | 0 | 0 | 0 | 110.9 | I274 G275 L280 G281 L284 A287 | I274-V278 HydrophobicContact CG2-CG2 3.67Å; I274-V278 PolarHBondContact O-N 3.18Å; G275-V278 PolarHBondContact O-N 3.48Å; V278-L280 PolarHBondContact O-N 3.28Å; V278-G281 PolarHBondContact O-N 2.83Å; V278-L284 HydrophobicContact CG2-CB 4.36Å; V278-L284 HydrophobicContact CG2-CD1 3.98Å; V278-A287 HydrophobicContact CG2-CB 4.3Å |
| 279 | A | 94.3 | Very high | 93.3 | Very high | 90 Ų | 90 | 58 Ų | 58 | 74% | 0.744 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -65.1 | -25.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | G275 P276 V277 G281 | G275-A279 WeakPolarHBondContact O-CB 3.32Å; G275-A279 PolarHBondContact O-N 2.9Å; P276-A279 PolarHBondContact O-N 3.21Å; V277-A279 VanDerWaalsContact C-N 3.33Å; A279-G281 PolarHBondContact O-N 2.95Å |
| 280 | L | 94.4 | Very high | 93.4 | Very high | 112 Ų | 112 | 52.3 Ų | 52.3 | 59% | 0.586 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -1.9 | 170.4 | -71.5 | 167.2 | 0 | 0 | 0 | 113.5 | P276 V277 V278 Y282 L303 | P276-L280 WeakPolarHBondContact O-CG 3.17Å; P276-L280 PolarHBondContact O-N 3.42Å; P276-L280 VanDerWaalsContact O-N 3.09Å; V277-L280 WeakPolarHBondContact O-CB 3.28Å; V277-L280 PolarHBondContact O-N 2.92Å; V278-L280 PolarHBondContact O-N 3.28Å; L280-Y282 HydrophobicContact CB-CD2 4.14Å; L280-Y282 HydrophobicContact CB-CE2 4.3Å; L280-L303 HydrophobicContact CD1-CD2 3.74Å |
| 281 | G | 93.9 | Very high | 93.4 | Very high | 66 Ų | 66 | 51.2 Ų | 51.2 | 68% | 0.68 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 95.3 | 3.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | V278 A279 | V278-G281 PolarHBondContact O-N 2.83Å; A279-G281 PolarHBondContact O-N 2.95Å |
| 282 | Y | 93.8 | Very high | 93.3 | Very high | 44 Ų | 44 | 54.7 Ų | 54.7 | 17% | 0.173 | 31% | 0.313 | C | S | . | . | trans | -70.5 | 137 | 172.6 | -68.8 | -89.7 | 0 | 0 | 0 | 110.5 | V277 L280 L284 L306 | V277-Y282 HydrophobicContact CG1-CD2 3.8Å; V277-Y282 HydrophobicContact CG1-CG 3.96Å; V277-Y282 WeakPolarHBondContact O-CD2 3.42Å; V277-Y282 PolarHBondContact O-N 3.49Å; L280-Y282 HydrophobicContact CB-CD2 4.14Å; L280-Y282 HydrophobicContact CB-CE2 4.3Å; Y282-L284 PolarHBondContact O-N 3.31Å; Y282-L306 HydrophobicContact CD1-CD2 4.27Å; Y282-L306 HydrophobicContact CE1-CB 4.16Å; Y282-L306 HydrophobicContact CE1-CD2 4.34Å | ||
| 283 | P | 93.4 | Very high | 93.1 | Very high | 82 Ų | 82 | 52.3 Ų | 52.3 | 53% | 0.532 | 30% | 0.298 | S | S | . | . | trans | -66.8 | 136.4 | 179.4 | 24.5 | -30.3 | 0 | 0 | 0 | 110.8 | R285 R286 A287 | P283-R285 VanDerWaalsContact C-N 3.29Å; P283-R285 PolarHBondContact O-N 2.93Å; P283-R285 VanDerWaalsContact O-N 3.12Å; P283-R286 HydrophobicContact CG-CB 3.87Å; P283-R286 WeakPolarHBondContact O-CB 3.19Å; P283-R286 PolarHBondContact O-N 2.99Å; P283-A287 PolarHBondContact O-N 3.15Å; P283-A287 VanDerWaalsContact O-N 3.1Å | ||
| 284 | L | 94.2 | Very high | 92.9 | Very high | 34 Ų | 34 | 51.6 Ų | 51.6 | 18% | 0.178 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -47.6 | -46.6 | -173.7 | 176.1 | 61.8 | 0 | 0 | 0 | 113.2 | A259 L263 I274 V278 Y282 R286 A287 I288 | A259-L284 HydrophobicContact CB-CD2 3.88Å; L263-L284 HydrophobicContact CD1-CD2 4.42Å; L263-L284 HydrophobicContact CD2-CD1 3.75Å; L263-L284 HydrophobicContact CG-CD1 4.1Å; L263-L284 HydrophobicContact CG-CD2 4.21Å; I274-L284 HydrophobicContact CG2-CD1 3.67Å; V278-L284 HydrophobicContact CG2-CB 4.36Å; V278-L284 HydrophobicContact CG2-CD1 3.98Å; Y282-L284 PolarHBondContact O-N 3.31Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-R286 PolarHBondContact O-N 3.35Å; L284-A287 WeakPolarHBondContact O-CB 3.3Å; L284-A287 PolarHBondContact O-N 3.46Å; L284-I288 HydrophobicContact CD1-CD1 3.85Å; L284-I288 HydrophobicContact CD1-CG1 4.08Å; L284-I288 HydrophobicContact CG-CD1 3.83Å; L284-I288 HydrophobicContact CG-CG1 4.44Å; L284-I288 VanDerWaalsContact O-CG1 3.3Å; L284-I288 WeakPolarHBondContact O-CG1 3.44Å; L284-I288 PolarHBondContact O-N 3.27Å |
| 285 | R | 92.4 | Very high | 92.2 | Very high | 185 Ų | 185 | 52.8 Ų | 52.8 | 70% | 0.698 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -57 | -43 | 177.6 | -177.2 | -176.9 | 179.4 | -88 | -2.4 | 112.7 | P283 I288 I289 | P283-R285 VanDerWaalsContact C-N 3.29Å; P283-R285 PolarHBondContact O-N 2.93Å; P283-R285 VanDerWaalsContact O-N 3.12Å; R285-I288 PolarHBondContact O-N 3.01Å; R285-I289 HydrophobicContact CG-CD1 3.84Å; R285-I289 VanDerWaalsContact CZ-CD1 3.44Å; R285-I289 VanDerWaalsContact O-CG1 3.3Å; R285-I289 WeakPolarHBondContact O-CG1 3.32Å; R285-I289 PolarHBondContact O-N 2.93Å |
| 286 | R | 92.8 | Very high | 91.1 | Very high | 53 Ų | 53 | 58.5 Ų | 58.5 | 20% | 0.2 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -70 | -38.3 | 179.9 | -175.8 | 168.4 | 164.6 | 135.5 | -14.3 | 110.9 | P283 L284 A290 L306 D310 E319 | P283-R286 HydrophobicContact CG-CB 3.87Å; P283-R286 WeakPolarHBondContact O-CB 3.19Å; P283-R286 PolarHBondContact O-N 2.99Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-R286 PolarHBondContact O-N 3.35Å; R286-A290 WeakPolarHBondContact O-CB 3.16Å; R286-A290 PolarHBondContact O-N 3.22Å; R286-L306 HydrophobicContact CG-CD2 4.4Å; R286-D310 IonicContact CZ-OD1 3.83Å; R286-D310 IonicContact NH2-OD1 3.72Å; R286-D310 PolarHBondContact NH2-OD1 3.02Å; R286-E319 IonicContact CZ-OE1 3.42Å; R286-E319 IonicContact NH1-OE1 2.71Å; R286-E319 PolarHBondContact NH1-OE1 3.33Å |
| 287 | A | 94.2 | Very high | 90.3 | Very high | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.6 | -44.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | I274 V277 V278 P283 L284 L291 F302 | I274-A287 HydrophobicContact CG2-CB 4.24Å; V277-A287 HydrophobicContact CG1-CB 3.78Å; V278-A287 HydrophobicContact CG2-CB 4.3Å; P283-A287 PolarHBondContact O-N 3.15Å; P283-A287 VanDerWaalsContact O-N 3.1Å; L284-A287 WeakPolarHBondContact O-CB 3.3Å; L284-A287 PolarHBondContact O-N 3.46Å; A287-L291 WeakPolarHBondContact O-CB 3.41Å; A287-L291 PolarHBondContact O-N 2.82Å; A287-F302 HydrophobicContact CB-CZ 4.21Å; A287-F302 WeakPolarHBondContact O-CE2 3.48Å; A287-F302 VanDerWaalsContact O-CZ 3.25Å; A287-F302 WeakPolarHBondContact O-CZ 3.35Å |
| 288 | I | 93.1 | Very high | 90.1 | Very high | 15 Ų | 15 | 62.8 Ų | 62.8 | 8% | 0.077 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -61.9 | -50.6 | 177.1 | -66.1 | 170.5 | 0 | 0 | 0 | 111.2 | L262 L266 I274 L284 R285 A290 L291 Q292 | L262-I288 HydrophobicContact CB-CD1 4.09Å; L266-I288 HydrophobicContact CD1-CD1 3.93Å; L266-I288 HydrophobicContact CD1-CG1 3.76Å; L266-I288 HydrophobicContact CD1-CG2 4.31Å; L266-I288 HydrophobicContact CD2-CG2 4.42Å; I274-I288 HydrophobicContact CD1-CG1 3.82Å; L284-I288 HydrophobicContact CD1-CD1 3.85Å; L284-I288 HydrophobicContact CD1-CG1 4.08Å; L284-I288 HydrophobicContact CG-CD1 3.83Å; L284-I288 HydrophobicContact CG-CG1 4.44Å; L284-I288 VanDerWaalsContact O-CG1 3.3Å; L284-I288 WeakPolarHBondContact O-CG1 3.44Å; L284-I288 PolarHBondContact O-N 3.27Å; R285-I288 PolarHBondContact O-N 3.01Å; I288-A290 PolarHBondContact O-N 3.12Å; I288-L291 PolarHBondContact O-N 2.95Å; I288-Q292 HydrophobicContact CG2-CG 4.49Å; I288-Q292 WeakPolarHBondContact O-CB 3.35Å; I288-Q292 VanDerWaalsContact O-CG 3.3Å; I288-Q292 WeakPolarHBondContact O-CG 3.25Å; I288-Q292 PolarHBondContact O-N 3.08Å |
| 289 | I | 91.6 | Very high | 89.9 | Confident | 45 Ų | 45 | 62.7 Ų | 62.7 | 23% | 0.231 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.1 | -46.7 | 179.8 | -69.6 | 167.3 | 0 | 0 | 0 | 110.7 | R285 L291 Q292 K293 | R285-I289 HydrophobicContact CG-CD1 3.84Å; R285-I289 VanDerWaalsContact CZ-CD1 3.44Å; R285-I289 VanDerWaalsContact O-CG1 3.3Å; R285-I289 WeakPolarHBondContact O-CG1 3.32Å; R285-I289 PolarHBondContact O-N 2.93Å; I289-L291 VanDerWaalsContact C-N 3.33Å; I289-L291 PolarHBondContact O-N 2.87Å; I289-Q292 PolarHBondContact O-N 3.12Å; I289-K293 HydrophobicContact CG2-CD 4.24Å; I289-K293 HydrophobicContact CG2-CG 4.49Å; I289-K293 WeakPolarHBondContact O-CG 3.3Å; I289-K293 PolarHBondContact O-N 2.93Å |
| 290 | A | 92.6 | Very high | 89.8 | Confident | 3 Ų | 3 | 62.2 Ų | 62.2 | 3% | 0.025 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | R286 I288 K293 T294 F302 Y305 L306 | R286-A290 WeakPolarHBondContact O-CB 3.16Å; R286-A290 PolarHBondContact O-N 3.22Å; I288-A290 PolarHBondContact O-N 3.12Å; A290-K293 PolarHBondContact O-N 2.68Å; A290-T294 WeakPolarHBondContact O-CG2 3.35Å; A290-T294 PolarHBondContact O-N 2.86Å; A290-T294 PolarHBondContact O-OG1 2.89Å; A290-F302 HydrophobicContact CB-CD2 4.35Å; A290-F302 HydrophobicContact CB-CE2 3.68Å; A290-Y305 HydrophobicContact CB-CD1 3.78Å; A290-Y305 HydrophobicContact CB-CE1 3.49Å; A290-Y305 VanDerWaalsContact CB-CE1 3.49Å; A290-L306 HydrophobicContact CB-CD2 3.49Å; A290-L306 VanDerWaalsContact CB-CD2 3.49Å; A290-L306 HydrophobicContact CB-CG 3.97Å |
| 291 | L | 92.5 | Very high | 89.6 | Confident | 6 Ų | 6 | 61.7 Ų | 61.7 | 3% | 0.031 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -66.2 | -39.6 | 175.8 | -176.9 | 66.6 | 0 | 0 | 0 | 111.6 | E270 L273 I274 A287 I288 I289 T294 G295 F302 | E270-L291 HydrophobicContact CB-CD2 3.67Å; E270-L291 HydrophobicContact CG-CD2 3.88Å; L273-L291 HydrophobicContact CB-CD1 4.24Å; L273-L291 HydrophobicContact CB-CD2 4.39Å; L273-L291 HydrophobicContact CD1-CD1 3.78Å; I274-L291 HydrophobicContact CD1-CD2 3.76Å; I274-L291 HydrophobicContact CG1-CD2 3.87Å; A287-L291 WeakPolarHBondContact O-CB 3.41Å; A287-L291 PolarHBondContact O-N 2.82Å; I288-L291 PolarHBondContact O-N 2.95Å; I289-L291 VanDerWaalsContact C-N 3.33Å; I289-L291 PolarHBondContact O-N 2.87Å; L291-T294 PolarHBondContact O-OG1 3.45Å; L291-G295 WeakPolarHBondContact CD1-O 3.3Å; L291-G295 CarbonylContact O-C 3.37Å; L291-G295 VanDerWaalsContact O-CA 3.28Å; L291-G295 WeakPolarHBondContact O-CA 3.38Å; L291-G295 PolarHBondContact O-N 3.38Å; L291-G295 VanDerWaalsContact O-O 3.11Å; L291-F302 HydrophobicContact CB-CD2 4.3Å; L291-F302 HydrophobicContact CB-CE1 4.46Å; L291-F302 HydrophobicContact CB-CE2 3.78Å; L291-F302 HydrophobicContact CB-CZ 3.88Å; L291-F302 HydrophobicContact CD1-CD1 4.28Å; L291-F302 HydrophobicContact CD1-CD2 4.37Å; L291-F302 HydrophobicContact CD1-CE1 4.44Å; L291-F302 HydrophobicContact CD1-CG 4.25Å; L291-F302 VanDerWaalsContact N-CE2 3.32Å |
| 292 | Q | 89.9 | Confident | 89.5 | Confident | 130 Ų | 130 | 58.5 Ų | 58.5 | 61% | 0.607 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -63 | -41 | 175.4 | -73.7 | 171.8 | -12.5 | 0 | 0 | 111.7 | I288 I289 G295 | I288-Q292 HydrophobicContact CG2-CG 4.49Å; I288-Q292 WeakPolarHBondContact O-CB 3.35Å; I288-Q292 VanDerWaalsContact O-CG 3.3Å; I288-Q292 WeakPolarHBondContact O-CG 3.25Å; I288-Q292 PolarHBondContact O-N 3.08Å; I289-Q292 PolarHBondContact O-N 3.12Å; Q292-G295 PolarHBondContact O-N 3.11Å |
| 293 | K | 88.6 | Confident | 89.5 | Confident | 51 Ų | 51 | 58.8 Ų | 58.8 | 22% | 0.222 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66.7 | -48.2 | 175.8 | -71.4 | -175.3 | 179.6 | -156.1 | 0 | 112.5 | I289 A290 G295 Y305 D323 E327 F331 | I289-K293 HydrophobicContact CG2-CD 4.24Å; I289-K293 HydrophobicContact CG2-CG 4.49Å; I289-K293 WeakPolarHBondContact O-CG 3.3Å; I289-K293 PolarHBondContact O-N 2.93Å; A290-K293 PolarHBondContact O-N 2.68Å; K293-G295 PolarHBondContact O-N 3.02Å; K293-Y305 WeakPolarHBondContact CD-OH 3.45Å; K293-D323 IonicContact NZ-OD1 2.79Å; K293-D323 IonicContact NZ-OD2 2.7Å; K293-D323 PolarHBondContact NZ-OD2 3.3Å; K293-E327 WeakPolarHBondContact CD-OE1 3.39Å; K293-E327 WeakPolarHBondContact CE-OE1 3.21Å; K293-E327 IonicContact NZ-OE1 3.62Å; K293-E327 PolarHBondContact NZ-OE1 2.9Å; K293-F331 HydrophobicContact CB-CE1 4.15Å; K293-F331 HydrophobicContact CB-CZ 4.13Å; K293-F331 WeakPolarHBondContact O-CE2 3.5Å; K293-F331 WeakPolarHBondContact O-CZ 3.23Å |
| 294 | T | 87.5 | Confident | 89.4 | Confident | 14 Ų | 14 | 58.1 Ų | 58.1 | 9% | 0.086 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -69.4 | -25.7 | 177.7 | 57.8 | 0 | 0 | 0 | 0 | 112.8 | A290 L291 Q297 Y305 | A290-T294 WeakPolarHBondContact O-CG2 3.35Å; A290-T294 PolarHBondContact O-N 2.86Å; A290-T294 PolarHBondContact O-OG1 2.89Å; L291-T294 PolarHBondContact O-OG1 3.45Å; T294-Q297 WeakPolarHBondContact O-CG 3.39Å; T294-Q297 PolarHBondContact O-NE2 3.36Å; T294-Y305 HydrophobicContact CG2-CD1 3.9Å; T294-Y305 HydrophobicContact CG2-CD2 4.16Å; T294-Y305 HydrophobicContact CG2-CG 3.58Å |
| 295 | G | 80.8 | Confident | 89.4 | Confident | 28 Ų | 28 | 57 Ų | 57 | 29% | 0.289 | 28% | 0.284 | S | S | . | . | trans | 78.5 | -175.5 | -163.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L291 Q292 K293 Q297 | L291-G295 WeakPolarHBondContact CD1-O 3.3Å; L291-G295 CarbonylContact O-C 3.37Å; L291-G295 VanDerWaalsContact O-CA 3.28Å; L291-G295 WeakPolarHBondContact O-CA 3.38Å; L291-G295 PolarHBondContact O-N 3.38Å; L291-G295 VanDerWaalsContact O-O 3.11Å; Q292-G295 PolarHBondContact O-N 3.11Å; K293-G295 PolarHBondContact O-N 3.02Å; G295-Q297 PolarHBondContact O-N 3.26Å | ||
| 296 | R | 70.2 | Confident | 89.5 | Confident | 159 Ų | 159 | 48.2 Ų | 48.2 | 60% | 0.6 | 25% | 0.251 | S | S | * | . | S | Bend | trans | -71.7 | 55.9 | 176.8 | -62.4 | -177.1 | -172.2 | 145.7 | 7.3 | 112.6 | E270 | E270-R296 HydrophobicContact CG-CG 4.18Å; E270-R296 IonicContact OE1-CZ 2.71Å; E270-R296 IonicContact OE1-NE 3.37Å; E270-R296 PolarHBondContact OE1-NE 3.15Å; E270-R296 IonicContact OE1-NH2 3.28Å; E270-R296 PolarHBondContact OE1-NH2 2.98Å |
| 297 | Q | 76.7 | Confident | 89.6 | Confident | 88 Ų | 88 | 47.2 Ų | 47.2 | 41% | 0.411 | 25% | 0.252 | S | S | . | . | trans | -81.5 | 174.3 | 177.7 | -57.6 | -67.2 | 1.1 | 0 | 0 | 111 | L273 T294 G295 Q301 | L273-Q297 WeakPolarHBondContact CD1-O 3.44Å; T294-Q297 WeakPolarHBondContact O-CG 3.39Å; T294-Q297 PolarHBondContact O-NE2 3.36Å; G295-Q297 PolarHBondContact O-N 3.26Å; Q297-Q301 HydrophobicContact CB-CB 3.97Å | ||
| 298 | S | 89.5 | Confident | 89.6 | Confident | 55 Ų | 55 | 47.3 Ų | 47.3 | 39% | 0.385 | 25% | 0.253 | S | S | . | . | trans | -62.4 | 146.9 | 171.7 | 62.4 | 0 | 0 | 0 | 0 | 111.6 | S300 Q301 F302 | S298-S300 PolarHBondContact O-N 3.2Å; S298-S300 PolarHBondContact OG-OG 3.37Å; S298-Q301 PolarHBondContact O-N 3.37Å; S298-F302 PolarHBondContact O-N 3.25Å; S298-F302 VanDerWaalsContact O-N 3.12Å | ||
| 299 | L | 91.4 | Very high | 89.7 | Confident | 56 Ų | 56 | 46.8 Ų | 46.8 | 29% | 0.293 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -48.7 | -34.4 | 175.1 | -179.9 | 60 | 0 | 0 | 0 | 112.7 | L273 P276 V277 F302 L303 | L273-L299 HydrophobicContact CD2-CB 3.79Å; P276-L299 HydrophobicContact CB-CD1 4.32Å; P276-L299 HydrophobicContact CB-CD2 4.08Å; P276-L299 HydrophobicContact CG-CD2 4.11Å; V277-L299 HydrophobicContact CG2-CD1 3.94Å; L299-F302 HydrophobicContact CD1-CD1 4.11Å; L299-L303 HydrophobicContact CD1-CD1 4.09Å; L299-L303 HydrophobicContact CD1-CG 4.11Å; L299-L303 HydrophobicContact CG-CD1 3.92Å; L299-L303 HydrophobicContact CG-CG 4.39Å; L299-L303 VanDerWaalsContact O-CB 3.28Å; L299-L303 WeakPolarHBondContact O-CB 3.45Å; L299-L303 VanDerWaalsContact O-CG 3.26Å; L299-L303 WeakPolarHBondContact O-CG 3.41Å; L299-L303 PolarHBondContact O-N 3.08Å |
| 300 | S | 91.9 | Very high | 89.9 | Confident | 81 Ų | 81 | 46 Ų | 46 | 57% | 0.566 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -63.9 | -39.7 | 175.2 | 51.5 | 0 | 0 | 0 | 0 | 114.2 | S298 S304 | S298-S300 PolarHBondContact O-N 3.2Å; S298-S300 PolarHBondContact OG-OG 3.37Å; S300-S304 VanDerWaalsContact O-CB 3.26Å; S300-S304 WeakPolarHBondContact O-CB 3.46Å; S300-S304 PolarHBondContact O-N 2.93Å |
| 301 | Q | 90.4 | Very high | 90.1 | Very high | 100 Ų | 100 | 50.2 Ų | 50.2 | 47% | 0.467 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -74 | -41.4 | 176.9 | -69.7 | -177.4 | 22 | 0 | 0 | 110.8 | Q297 S298 L303 S304 Y305 | Q297-Q301 HydrophobicContact CB-CB 3.97Å; S298-Q301 PolarHBondContact O-N 3.37Å; Q301-L303 PolarHBondContact O-N 3.24Å; Q301-S304 WeakPolarHBondContact O-CB 3.5Å; Q301-S304 PolarHBondContact O-N 2.9Å; Q301-S304 VanDerWaalsContact O-N 3.12Å; Q301-Y305 PolarHBondContact O-N 3.3Å |
| 302 | F | 92.3 | Very high | 90.3 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.3 | -46.8 | 174.9 | 177 | -144.5 | 0 | 0 | 0 | 112 | L273 V277 A287 A290 L291 S298 L299 L306 | L273-F302 HydrophobicContact CB-CD1 4.36Å; L273-F302 HydrophobicContact CB-CE1 4.5Å; L273-F302 WeakPolarHBondContact O-CE1 3.36Å; V277-F302 HydrophobicContact CB-CE1 3.93Å; V277-F302 HydrophobicContact CB-CZ 4.28Å; V277-F302 HydrophobicContact CG1-CE1 4.26Å; V277-F302 HydrophobicContact CG1-CZ 4.13Å; V277-F302 HydrophobicContact CG2-CD1 3.73Å; V277-F302 HydrophobicContact CG2-CE1 3.34Å; V277-F302 HydrophobicContact CG2-CZ 4.02Å; A287-F302 HydrophobicContact CB-CZ 4.21Å; A287-F302 WeakPolarHBondContact O-CE2 3.48Å; A287-F302 VanDerWaalsContact O-CZ 3.25Å; A287-F302 WeakPolarHBondContact O-CZ 3.35Å; A290-F302 HydrophobicContact CB-CD2 4.35Å; A290-F302 HydrophobicContact CB-CE2 3.68Å; L291-F302 HydrophobicContact CB-CD2 4.3Å; L291-F302 HydrophobicContact CB-CE1 4.46Å; L291-F302 HydrophobicContact CB-CE2 3.78Å; L291-F302 HydrophobicContact CB-CZ 3.88Å; L291-F302 HydrophobicContact CD1-CD1 4.28Å; L291-F302 HydrophobicContact CD1-CD2 4.37Å; L291-F302 HydrophobicContact CD1-CE1 4.44Å; L291-F302 HydrophobicContact CD1-CG 4.25Å; L291-F302 VanDerWaalsContact N-CE2 3.32Å; S298-F302 PolarHBondContact O-N 3.25Å; S298-F302 VanDerWaalsContact O-N 3.12Å; L299-F302 HydrophobicContact CD1-CD1 4.11Å; F302-L306 HydrophobicContact CD2-CD1 4.1Å; F302-L306 HydrophobicContact CD2-CG 4.48Å; F302-L306 HydrophobicContact CE2-CD1 3.72Å; F302-L306 HydrophobicContact CE2-CG 4.27Å; F302-L306 HydrophobicContact CZ-CD1 4.01Å; F302-L306 PolarHBondContact O-N 3.47Å; F302-L306 VanDerWaalsContact O-N 3.08Å |
| 303 | L | 92.6 | Very high | 90.6 | Very high | 49 Ų | 49 | 46 Ų | 46 | 26% | 0.257 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -65.7 | -37 | 171.7 | -74.6 | 172 | 0 | 0 | 0 | 112.8 | V277 L280 L299 Q301 S307 | V277-L303 HydrophobicContact CG2-CD2 3.76Å; V277-L303 HydrophobicContact CG2-CG 4.31Å; L280-L303 HydrophobicContact CD1-CD2 3.74Å; L299-L303 HydrophobicContact CD1-CD1 4.09Å; L299-L303 HydrophobicContact CD1-CG 4.11Å; L299-L303 HydrophobicContact CG-CD1 3.92Å; L299-L303 HydrophobicContact CG-CG 4.39Å; L299-L303 VanDerWaalsContact O-CB 3.28Å; L299-L303 WeakPolarHBondContact O-CB 3.45Å; L299-L303 VanDerWaalsContact O-CG 3.26Å; L299-L303 WeakPolarHBondContact O-CG 3.41Å; L299-L303 PolarHBondContact O-N 3.08Å; Q301-L303 PolarHBondContact O-N 3.24Å; L303-S307 WeakPolarHBondContact O-CB 3.37Å; L303-S307 PolarHBondContact O-N 3.03Å; L303-S307 PolarHBondContact O-OG 3.31Å |
| 304 | S | 92.6 | Very high | 90.9 | Very high | 68 Ų | 68 | 52.8 Ų | 52.8 | 48% | 0.476 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.6 | -49.1 | 176.2 | -170.3 | 0 | 0 | 0 | 0 | 110.9 | S300 Q301 S307 A308 | S300-S304 VanDerWaalsContact O-CB 3.26Å; S300-S304 WeakPolarHBondContact O-CB 3.46Å; S300-S304 PolarHBondContact O-N 2.93Å; Q301-S304 WeakPolarHBondContact O-CB 3.5Å; Q301-S304 PolarHBondContact O-N 2.9Å; Q301-S304 VanDerWaalsContact O-N 3.12Å; S304-S307 PolarHBondContact O-N 3.42Å; S304-S307 PolarHBondContact O-OG 3.12Å; S304-A308 WeakPolarHBondContact O-CB 3.34Å; S304-A308 PolarHBondContact O-N 3.49Å |
| 305 | Y | 93.3 | Very high | 91.2 | Very high | 10 Ų | 10 | 57.5 Ų | 57.5 | 4% | 0.039 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -55.8 | -56.3 | 174.8 | 169.1 | -97.2 | 0 | 0 | 0 | 111.7 | A290 K293 T294 Q301 S307 A308 C309 D323 M326 F331 | A290-Y305 HydrophobicContact CB-CD1 3.78Å; A290-Y305 HydrophobicContact CB-CE1 3.49Å; A290-Y305 VanDerWaalsContact CB-CE1 3.49Å; K293-Y305 WeakPolarHBondContact CD-OH 3.45Å; T294-Y305 HydrophobicContact CG2-CD1 3.9Å; T294-Y305 HydrophobicContact CG2-CD2 4.16Å; T294-Y305 HydrophobicContact CG2-CG 3.58Å; Q301-Y305 PolarHBondContact O-N 3.3Å; Y305-S307 VanDerWaalsContact C-N 3.27Å; Y305-S307 PolarHBondContact O-N 2.63Å; Y305-A308 WeakPolarHBondContact O-CB 3.34Å; Y305-A308 PolarHBondContact O-N 2.92Å; Y305-C309 PolarHBondContact O-N 3.48Å; Y305-C309 PolarHBondContact O-SG 3.38Å; Y305-D323 PolarHBondContact OH-OD1 3.02Å; Y305-M326 HydrophobicContact CD2-CE 3.54Å; Y305-M326 HydrophobicContact CE2-CB 4.09Å; Y305-M326 HydrophobicContact CE2-CE 3.84Å; Y305-F331 HydrophobicContact CD2-CB 4.05Å; Y305-F331 AromaticContact CD2-CD1 3.54Å; Y305-F331 HydrophobicContact CD2-CD1 3.54Å; Y305-F331 HydrophobicContact CD2-CE1 4.3Å; Y305-F331 HydrophobicContact CD2-CG 4Å; Y305-F331 AromaticContact CE2-CD1 3.41Å; Y305-F331 HydrophobicContact CE2-CD1 3.41Å; Y305-F331 VanDerWaalsContact CE2-CD1 3.41Å; Y305-F331 AromaticContact CE2-CE1 3.86Å; Y305-F331 HydrophobicContact CE2-CE1 3.86Å; Y305-F331 HydrophobicContact CE2-CG 4.33Å |
| 306 | L | 94.5 | Very high | 91.9 | Very high | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.005 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -55.3 | -44.5 | 179 | -78.1 | 169.1 | 0 | 0 | 0 | 111.8 | V277 Y282 R286 A290 F302 A308 C309 D310 | V277-L306 HydrophobicContact CG1-CD1 3.49Å; V277-L306 VanDerWaalsContact CG1-CD1 3.49Å; V277-L306 HydrophobicContact CG2-CD1 4.29Å; Y282-L306 HydrophobicContact CD1-CD2 4.27Å; Y282-L306 HydrophobicContact CE1-CB 4.16Å; Y282-L306 HydrophobicContact CE1-CD2 4.34Å; R286-L306 HydrophobicContact CG-CD2 4.4Å; A290-L306 HydrophobicContact CB-CD2 3.49Å; A290-L306 VanDerWaalsContact CB-CD2 3.49Å; A290-L306 HydrophobicContact CB-CG 3.97Å; F302-L306 HydrophobicContact CD2-CD1 4.1Å; F302-L306 HydrophobicContact CD2-CG 4.48Å; F302-L306 HydrophobicContact CE2-CD1 3.72Å; F302-L306 HydrophobicContact CE2-CG 4.27Å; F302-L306 HydrophobicContact CZ-CD1 4.01Å; F302-L306 PolarHBondContact O-N 3.47Å; F302-L306 VanDerWaalsContact O-N 3.08Å; L306-A308 VanDerWaalsContact C-N 3.3Å; L306-A308 PolarHBondContact O-N 3.49Å; L306-C309 PolarHBondContact O-N 2.9Å; L306-D310 WeakPolarHBondContact O-CB 3.26Å; L306-D310 PolarHBondContact O-N 3.49Å |
| 307 | S | 94.8 | Very high | 93.1 | Very high | 32 Ų | 32 | 53.8 Ų | 53.8 | 22% | 0.224 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -67.6 | -29 | 179.5 | 80.7 | 0 | 0 | 0 | 0 | 113.2 | L303 S304 Y305 R311 | L303-S307 WeakPolarHBondContact O-CB 3.37Å; L303-S307 PolarHBondContact O-N 3.03Å; L303-S307 PolarHBondContact O-OG 3.31Å; S304-S307 PolarHBondContact O-N 3.42Å; S304-S307 PolarHBondContact O-OG 3.12Å; Y305-S307 VanDerWaalsContact C-N 3.27Å; Y305-S307 PolarHBondContact O-N 2.63Å; S307-R311 VanDerWaalsContact C-NH1 3.27Å; S307-R311 WeakPolarHBondContact O-CG 3.42Å; S307-R311 VanDerWaalsContact O-CZ 3.25Å; S307-R311 PolarHBondContact O-N 2.72Å; S307-R311 PolarHBondContact O-NH1 3.42Å; S307-R311 PolarHBondContact OG-NH1 3.07Å; S307-R311 PolarHBondContact OG-NH2 3.37Å |
| 308 | A | 95.8 | Very high | 94 | Very high | 2 Ų | 2 | 54.8 Ų | 54.8 | 2% | 0.017 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -72.5 | -47.7 | 175 | 0 | 0 | 0 | 0 | 0 | 110.8 | S304 Y305 L306 D310 R311 L312 M326 E333 | S304-A308 WeakPolarHBondContact O-CB 3.34Å; S304-A308 PolarHBondContact O-N 3.49Å; Y305-A308 WeakPolarHBondContact O-CB 3.34Å; Y305-A308 PolarHBondContact O-N 2.92Å; L306-A308 VanDerWaalsContact C-N 3.3Å; L306-A308 PolarHBondContact O-N 3.49Å; A308-D310 VanDerWaalsContact C-N 3.29Å; A308-D310 PolarHBondContact O-N 2.85Å; A308-R311 PolarHBondContact O-N 2.71Å; A308-L312 WeakPolarHBondContact O-CG 3.39Å; A308-L312 PolarHBondContact O-N 3.45Å; A308-M326 HydrophobicContact CB-CE 3.79Å; A308-M326 HydrophobicContact CB-SD 4.46Å; A308-E333 HydrophobicContact CB-CB 3.8Å; A308-E333 HydrophobicContact CB-CG 3.92Å |
| 309 | C | 94.8 | Very high | 94.2 | Very high | 4 Ų | 4 | 56.7 Ų | 56.7 | 3% | 0.027 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -56.1 | -45.4 | 172.5 | -61.2 | 0 | 0 | 0 | 0 | 111 | Y305 L306 R311 L312 L313 V322 | Y305-C309 PolarHBondContact O-N 3.48Å; Y305-C309 PolarHBondContact O-SG 3.38Å; L306-C309 PolarHBondContact O-N 2.9Å; C309-R311 VanDerWaalsContact C-N 3.33Å; C309-R311 PolarHBondContact O-N 3.46Å; C309-L312 PolarHBondContact O-N 2.95Å; C309-L313 WeakPolarHBondContact O-CB 3.43Å; C309-L313 WeakPolarHBondContact O-CD1 3.23Å; C309-L313 VanDerWaalsContact O-CG 3.24Å; C309-L313 WeakPolarHBondContact O-CG 3.4Å; C309-L313 PolarHBondContact O-N 3.49Å; C309-V322 HydrophobicContact CB-CG1 4.18Å |
| 310 | D | 95.6 | Very high | 94.2 | Very high | 29 Ų | 29 | 55.7 Ų | 55.7 | 16% | 0.155 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58.6 | -38.7 | 174.1 | -90.5 | 35.6 | 0 | 0 | 0 | 113.4 | R286 L306 A308 R314 | R286-D310 IonicContact CZ-OD1 3.83Å; R286-D310 IonicContact NH2-OD1 3.72Å; R286-D310 PolarHBondContact NH2-OD1 3.02Å; L306-D310 WeakPolarHBondContact O-CB 3.26Å; L306-D310 PolarHBondContact O-N 3.49Å; A308-D310 VanDerWaalsContact C-N 3.29Å; A308-D310 PolarHBondContact O-N 2.85Å; D310-R314 WeakPolarHBondContact O-CB 3.44Å; D310-R314 WeakPolarHBondContact O-CD 3.34Å; D310-R314 WeakPolarHBondContact O-CG 2.96Å; D310-R314 PolarHBondContact O-N 3.48Å; D310-R314 VanDerWaalsContact O-N 3.14Å; D310-R314 IonicContact OD2-NH2 2.69Å |
| 311 | R | 96.5 | Very high | 94.4 | Very high | 91 Ų | 91 | 53.4 Ų | 53.4 | 34% | 0.343 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -70.5 | -35.3 | 177.1 | -79.7 | -174 | -62.4 | -80.9 | 5.1 | 112.4 | S307 A308 C309 Q315 E333 | S307-R311 VanDerWaalsContact C-NH1 3.27Å; S307-R311 WeakPolarHBondContact O-CG 3.42Å; S307-R311 VanDerWaalsContact O-CZ 3.25Å; S307-R311 PolarHBondContact O-N 2.72Å; S307-R311 PolarHBondContact O-NH1 3.42Å; S307-R311 PolarHBondContact OG-NH1 3.07Å; S307-R311 PolarHBondContact OG-NH2 3.37Å; A308-R311 PolarHBondContact O-N 2.71Å; C309-R311 VanDerWaalsContact C-N 3.33Å; C309-R311 PolarHBondContact O-N 3.46Å; R311-Q315 PolarHBondContact O-NE2 3.5Å; R311-E333 WeakPolarHBondContact CD-OE1 3.48Å; R311-E333 IonicContact CZ-OE1 2.73Å; R311-E333 IonicContact CZ-OE2 2.72Å; R311-E333 VanDerWaalsContact NE-CD 3.31Å; R311-E333 IonicContact NE-OE1 2.65Å; R311-E333 PolarHBondContact NE-OE1 2.66Å; R311-E333 IonicContact NE-OE2 3.81Å; R311-E333 PolarHBondContact NE-OE2 2.69Å; R311-E333 IonicContact NH2-OE1 3.79Å; R311-E333 IonicContact NH2-OE2 3.72Å; R311-E333 PolarHBondContact NH2-OE2 3.13Å |
| 312 | L | 96.2 | Very high | 94.7 | Very high | 3 Ų | 3 | 48.7 Ų | 48.7 | 2% | 0.016 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -72.8 | -46.2 | 175.6 | -65.2 | 172.3 | 0 | 0 | 0 | 111.1 | A308 C309 R314 Q315 Y317 V322 M326 A336 L340 | A308-L312 WeakPolarHBondContact O-CG 3.39Å; A308-L312 PolarHBondContact O-N 3.45Å; C309-L312 PolarHBondContact O-N 2.95Å; L312-R314 VanDerWaalsContact C-N 3.27Å; L312-R314 PolarHBondContact O-N 2.9Å; L312-Q315 WeakPolarHBondContact O-CB 3.44Å; L312-Q315 PolarHBondContact O-N 3.24Å; L312-Y317 HydrophobicContact CB-CD2 4.48Å; L312-Y317 WeakPolarHBondContact O-CD2 3.2Å; L312-V322 HydrophobicContact CB-CG1 3.87Å; L312-V322 HydrophobicContact CB-CG2 3.86Å; L312-V322 HydrophobicContact CD1-CG1 3.99Å; L312-M326 HydrophobicContact CD1-CG 4.2Å; L312-M326 HydrophobicContact CD1-SD 3.99Å; L312-A336 HydrophobicContact CD1-CB 4.05Å; L312-L340 HydrophobicContact CB-CD1 4.42Å; L312-L340 HydrophobicContact CD1-CD1 4.15Å; L312-L340 HydrophobicContact CD2-CD1 4.18Å; L312-L340 HydrophobicContact CG-CD1 4.48Å |
| 313 | L | 95.7 | Very high | 94.7 | Very high | 45 Ų | 45 | 50.5 Ų | 50.5 | 24% | 0.236 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -58.8 | -36.8 | 176.3 | -72.2 | 164.2 | 0 | 0 | 0 | 112.7 | C309 Q315 G316 Y317 E319 V322 | C309-L313 WeakPolarHBondContact O-CB 3.43Å; C309-L313 WeakPolarHBondContact O-CD1 3.23Å; C309-L313 VanDerWaalsContact O-CG 3.24Å; C309-L313 WeakPolarHBondContact O-CG 3.4Å; C309-L313 PolarHBondContact O-N 3.49Å; L313-Q315 PolarHBondContact O-N 2.87Å; L313-G316 PolarHBondContact O-N 3.43Å; L313-Y317 WeakPolarHBondContact CD2-O 3.43Å; L313-E319 HydrophobicContact CD2-CB 3.9Å; L313-E319 HydrophobicContact CD2-CG 4.28Å; L313-V322 HydrophobicContact CD2-CG2 4.24Å; L313-V322 HydrophobicContact CG-CG2 4.43Å |
| 314 | R | 95.9 | Very high | 94.8 | Very high | 193 Ų | 193 | 51.3 Ų | 51.3 | 73% | 0.728 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | -15.1 | 174.6 | -75.3 | 172.3 | -159.2 | 178.8 | 9.7 | 114.4 | D310 L312 G316 | D310-R314 WeakPolarHBondContact O-CB 3.44Å; D310-R314 WeakPolarHBondContact O-CD 3.34Å; D310-R314 WeakPolarHBondContact O-CG 2.96Å; D310-R314 PolarHBondContact O-N 3.48Å; D310-R314 VanDerWaalsContact O-N 3.14Å; D310-R314 IonicContact OD2-NH2 2.69Å; L312-R314 VanDerWaalsContact C-N 3.27Å; L312-R314 PolarHBondContact O-N 2.9Å; R314-G316 VanDerWaalsContact C-N 3.3Å |
| 315 | Q | 94.7 | Very high | 94.9 | Very high | 113 Ų | 113 | 48.1 Ų | 48.1 | 53% | 0.528 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -8.5 | 173.4 | -66.4 | 164.1 | 63.6 | 0 | 0 | 112.3 | R311 L312 L313 Y317 | R311-Q315 PolarHBondContact O-NE2 3.5Å; L312-Q315 WeakPolarHBondContact O-CB 3.44Å; L312-Q315 PolarHBondContact O-N 3.24Å; L313-Q315 PolarHBondContact O-N 2.87Å; Q315-Y317 HydrophobicContact CB-CD2 3.9Å; Q315-Y317 HydrophobicContact CB-CE2 3.72Å |
| 316 | G | 94.4 | Very high | 95 | Very high | 67 Ų | 67 | 47.6 Ų | 47.6 | 69% | 0.691 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 104.5 | -2.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | L313 R314 | L313-G316 PolarHBondContact O-N 3.43Å; R314-G316 VanDerWaalsContact C-N 3.3Å |
| 317 | Y | 95.8 | Very high | 94.9 | Very high | 42 Ų | 42 | 52.2 Ų | 52.2 | 17% | 0.165 | 27% | 0.266 | C | S | . | . | trans | -67.9 | 148.2 | 177 | -55.8 | -60.6 | 0 | 0 | 0 | 112.2 | L312 L313 Q315 L340 | L312-Y317 HydrophobicContact CB-CD2 4.48Å; L312-Y317 WeakPolarHBondContact O-CD2 3.2Å; L313-Y317 WeakPolarHBondContact CD2-O 3.43Å; Q315-Y317 HydrophobicContact CB-CD2 3.9Å; Q315-Y317 HydrophobicContact CB-CE2 3.72Å; Y317-L340 HydrophobicContact CD1-CB 4.12Å; Y317-L340 HydrophobicContact CD2-CB 4.3Å; Y317-L340 HydrophobicContact CD2-CD1 3.83Å; Y317-L340 HydrophobicContact CE1-CB 3.94Å; Y317-L340 HydrophobicContact CE2-CB 4.12Å; Y317-L340 HydrophobicContact CE2-CD1 4.29Å; Y317-L340 HydrophobicContact CG-CB 4.3Å; Y317-L340 HydrophobicContact CG-CD1 4.04Å | ||
| 318 | E | 94.7 | Very high | 94.9 | Very high | 109 Ų | 109 | 52.8 Ų | 52.8 | 51% | 0.509 | 27% | 0.266 | S | S | . | . | trans | -73 | 146.9 | -178.6 | -169.7 | -80.7 | 133.2 | 0 | 0 | 111.9 | G320 L321 V322 | E318-G320 PolarHBondContact O-N 2.77Å; E318-G320 PolarHBondContact OE1-N 2.86Å; E318-G320 VanDerWaalsContact OE2-CA 3.25Å; E318-G320 WeakPolarHBondContact OE2-CA 3.5Å; E318-G320 PolarHBondContact OE2-N 3.47Å; E318-L321 HydrophobicContact CB-CB 4.48Å; E318-L321 HydrophobicContact CB-CD1 4.24Å; E318-L321 HydrophobicContact CB-CG 4.43Å; E318-L321 PolarHBondContact O-N 2.86Å; E318-L321 PolarHBondContact OE2-N 3.29Å; E318-V322 WeakPolarHBondContact O-CG2 3.34Å; E318-V322 PolarHBondContact O-N 3.29Å | ||
| 319 | E | 93.6 | Very high | 94.8 | Very high | 95 Ų | 95 | 53.9 Ų | 53.9 | 44% | 0.444 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -66.2 | -39.1 | -171 | -169.1 | 171.3 | -168.8 | 0 | 0 | 112.7 | R286 L313 D323 | R286-E319 IonicContact CZ-OE1 3.42Å; R286-E319 IonicContact NH1-OE1 2.71Å; R286-E319 PolarHBondContact NH1-OE1 3.33Å; L313-E319 HydrophobicContact CD2-CB 3.9Å; L313-E319 HydrophobicContact CD2-CG 4.28Å; E319-D323 WeakPolarHBondContact O-CB 3.24Å; E319-D323 PolarHBondContact O-N 3.04Å |
| 320 | G | 92.9 | Very high | 94.6 | Very high | 36 Ų | 36 | 62 Ų | 62 | 37% | 0.371 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -61.6 | -49.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113 | E318 V322 D323 E324 | E318-G320 PolarHBondContact O-N 2.77Å; E318-G320 PolarHBondContact OE1-N 2.86Å; E318-G320 VanDerWaalsContact OE2-CA 3.25Å; E318-G320 WeakPolarHBondContact OE2-CA 3.5Å; E318-G320 PolarHBondContact OE2-N 3.47Å; G320-V322 PolarHBondContact O-N 2.9Å; G320-D323 PolarHBondContact O-N 3.01Å; G320-E324 WeakPolarHBondContact O-CB 3.48Å; G320-E324 PolarHBondContact O-N 3.32Å |
| 321 | L | 94.6 | Very high | 94.4 | Very high | 33 Ų | 33 | 64.1 Ų | 64.1 | 17% | 0.173 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.9 | -40.3 | 176.7 | -69.4 | 177.4 | 0 | 0 | 0 | 112.8 | E318 E324 A325 L340 W343 | E318-L321 HydrophobicContact CB-CB 4.48Å; E318-L321 HydrophobicContact CB-CD1 4.24Å; E318-L321 HydrophobicContact CB-CG 4.43Å; E318-L321 PolarHBondContact O-N 2.86Å; E318-L321 PolarHBondContact OE2-N 3.29Å; L321-E324 PolarHBondContact O-N 2.96Å; L321-A325 VanDerWaalsContact O-CB 3.23Å; L321-A325 WeakPolarHBondContact O-CB 3.49Å; L321-A325 PolarHBondContact O-N 3.31Å; L321-L340 HydrophobicContact CB-CD2 4Å; L321-W343 HydrophobicContact CD1-CE3 4.25Å; L321-W343 HydrophobicContact CD1-CH2 3.66Å; L321-W343 HydrophobicContact CD1-CZ2 4.37Å; L321-W343 HydrophobicContact CD1-CZ3 3.59Å; L321-W343 HydrophobicContact CD2-CH2 3.99Å; L321-W343 HydrophobicContact CD2-CZ2 3.89Å; L321-W343 HydrophobicContact CD2-CZ3 4.49Å |
| 322 | V | 96.6 | Very high | 94.2 | Very high | 1 Ų | 1 | 61.9 Ų | 61.9 | 1% | 0.006 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64.1 | -44.5 | 175.8 | 169.2 | 0 | 0 | 0 | 0 | 111 | C309 L312 L313 E318 G320 M326 L340 | C309-V322 HydrophobicContact CB-CG1 4.18Å; L312-V322 HydrophobicContact CB-CG1 3.87Å; L312-V322 HydrophobicContact CB-CG2 3.86Å; L312-V322 HydrophobicContact CD1-CG1 3.99Å; L313-V322 HydrophobicContact CD2-CG2 4.24Å; L313-V322 HydrophobicContact CG-CG2 4.43Å; E318-V322 WeakPolarHBondContact O-CG2 3.34Å; E318-V322 PolarHBondContact O-N 3.29Å; G320-V322 PolarHBondContact O-N 2.9Å; V322-M326 HydrophobicContact CG1-CG 4.43Å; V322-M326 WeakPolarHBondContact O-CB 3.41Å; V322-M326 WeakPolarHBondContact O-CG 3.19Å; V322-M326 PolarHBondContact O-N 2.71Å; V322-L340 HydrophobicContact CG2-CD1 3.94Å |
| 323 | D | 93.6 | Very high | 94.2 | Very high | 37 Ų | 37 | 65.1 Ų | 65.1 | 20% | 0.198 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 177.2 | -97.8 | 3.7 | 0 | 0 | 0 | 111.6 | K293 Y305 E319 G320 M326 E327 | K293-D323 IonicContact NZ-OD1 2.79Å; K293-D323 IonicContact NZ-OD2 2.7Å; K293-D323 PolarHBondContact NZ-OD2 3.3Å; Y305-D323 PolarHBondContact OH-OD1 3.02Å; E319-D323 WeakPolarHBondContact O-CB 3.24Å; E319-D323 PolarHBondContact O-N 3.04Å; G320-D323 PolarHBondContact O-N 3.01Å; D323-M326 PolarHBondContact O-N 3.32Å; D323-E327 WeakPolarHBondContact O-CG 3.16Å; D323-E327 PolarHBondContact O-N 3.1Å |
| 324 | E | 93.9 | Very high | 94.1 | Very high | 67 Ų | 67 | 66.7 Ų | 66.7 | 31% | 0.313 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.5 | -45.5 | 177.4 | -167.5 | -176.6 | -179.6 | 0 | 0 | 111.8 | G320 L321 M326 E327 M328 K357 | G320-E324 WeakPolarHBondContact O-CB 3.48Å; G320-E324 PolarHBondContact O-N 3.32Å; L321-E324 PolarHBondContact O-N 2.96Å; E324-M326 VanDerWaalsContact C-N 3.34Å; E324-M326 PolarHBondContact O-N 2.91Å; E324-E327 PolarHBondContact O-N 3.44Å; E324-M328 HydrophobicContact CG-CE 4.01Å; E324-M328 WeakPolarHBondContact O-CG 3.43Å; E324-M328 PolarHBondContact O-N 3.3Å; E324-K357 WeakPolarHBondContact OE1-CD 3.47Å; E324-K357 VanDerWaalsContact OE1-CE 3.24Å; E324-K357 WeakPolarHBondContact OE1-CE 3.43Å; E324-K357 IonicContact OE1-NZ 2.72Å; E324-K357 PolarHBondContact OE1-NZ 2.77Å; E324-K357 WeakPolarHBondContact OE2-CE 3.31Å; E324-K357 IonicContact OE2-NZ 3.15Å; E324-K357 PolarHBondContact OE2-NZ 3.46Å |
| 325 | A | 96 | Very high | 94.2 | Very high | 0 Ų | 0 | 61.1 Ų | 61.1 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.5 | -41.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L321 E327 F329 A336 F339 L340 | L321-A325 VanDerWaalsContact O-CB 3.23Å; L321-A325 WeakPolarHBondContact O-CB 3.49Å; L321-A325 PolarHBondContact O-N 3.31Å; A325-E327 VanDerWaalsContact C-N 3.33Å; A325-E327 PolarHBondContact O-N 3.46Å; A325-F329 WeakPolarHBondContact O-CD2 3.05Å; A325-F329 PolarHBondContact O-N 2.88Å; A325-A336 HydrophobicContact CB-CB 4.01Å; A325-F339 HydrophobicContact CB-CD1 3.55Å; A325-F339 HydrophobicContact CB-CE1 4.03Å; A325-L340 HydrophobicContact CB-CD1 4.23Å; A325-L340 HydrophobicContact CB-CD2 4.05Å; A325-L340 HydrophobicContact CB-CG 3.9Å |
| 326 | M | 95.3 | Very high | 94.3 | Very high | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.8 | -35.4 | 176 | -73.4 | -70.6 | -72.4 | 0 | 0 | 111.8 | Y305 A308 L312 V322 D323 E324 Q330 F331 A336 | Y305-M326 HydrophobicContact CD2-CE 3.54Å; Y305-M326 HydrophobicContact CE2-CB 4.09Å; Y305-M326 HydrophobicContact CE2-CE 3.84Å; A308-M326 HydrophobicContact CB-CE 3.79Å; A308-M326 HydrophobicContact CB-SD 4.46Å; L312-M326 HydrophobicContact CD1-CG 4.2Å; L312-M326 HydrophobicContact CD1-SD 3.99Å; V322-M326 HydrophobicContact CG1-CG 4.43Å; V322-M326 WeakPolarHBondContact O-CB 3.41Å; V322-M326 WeakPolarHBondContact O-CG 3.19Å; V322-M326 PolarHBondContact O-N 2.71Å; D323-M326 PolarHBondContact O-N 3.32Å; E324-M326 VanDerWaalsContact C-N 3.34Å; E324-M326 PolarHBondContact O-N 2.91Å; M326-Q330 PolarHBondContact O-N 2.71Å; M326-F331 HydrophobicContact CB-CD1 4.29Å; M326-F331 HydrophobicContact CE-CB 4.2Å; M326-F331 VanDerWaalsContact O-CA 3.31Å; M326-F331 WeakPolarHBondContact O-CA 3.28Å; M326-F331 WeakPolarHBondContact O-CD1 3.5Å; M326-F331 PolarHBondContact O-N 2.7Å; M326-A336 HydrophobicContact CG-CB 4.12Å; M326-A336 HydrophobicContact SD-CB 3.66Å |
| 327 | E | 92.6 | Very high | 94.3 | Very high | 97 Ų | 97 | 53.1 Ų | 53.1 | 45% | 0.453 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -69.8 | -47.5 | 174.5 | -75.4 | 173.1 | -152.5 | 0 | 0 | 112.6 | K293 D323 E324 A325 F329 Q330 F331 | K293-E327 WeakPolarHBondContact CD-OE1 3.39Å; K293-E327 WeakPolarHBondContact CE-OE1 3.21Å; K293-E327 IonicContact NZ-OE1 3.62Å; K293-E327 PolarHBondContact NZ-OE1 2.9Å; D323-E327 WeakPolarHBondContact O-CG 3.16Å; D323-E327 PolarHBondContact O-N 3.1Å; E324-E327 PolarHBondContact O-N 3.44Å; A325-E327 VanDerWaalsContact C-N 3.33Å; A325-E327 PolarHBondContact O-N 3.46Å; E327-F329 PolarHBondContact O-N 3.47Å; E327-Q330 PolarHBondContact O-N 2.88Å; E327-F331 HydrophobicContact CG-CE1 4.07Å |
| 328 | M | 92.9 | Very high | 94.4 | Very high | 44 Ų | 44 | 54.9 Ų | 54.9 | 22% | 0.217 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -56.3 | -37.5 | 179 | -75.5 | -173.1 | -69.2 | 0 | 0 | 112.9 | E324 F339 L361 | E324-M328 HydrophobicContact CG-CE 4.01Å; E324-M328 WeakPolarHBondContact O-CG 3.43Å; E324-M328 PolarHBondContact O-N 3.3Å; M328-F339 HydrophobicContact CE-CD1 4.05Å; M328-F339 HydrophobicContact CE-CD2 4.36Å; M328-F339 HydrophobicContact CE-CE1 3.45Å; M328-F339 VanDerWaalsContact CE-CE1 3.45Å; M328-F339 HydrophobicContact CE-CE2 3.79Å; M328-F339 HydrophobicContact CE-CG 4.49Å; M328-F339 HydrophobicContact CE-CZ 3.31Å; M328-F339 HydrophobicContact SD-CE2 4.48Å; M328-F339 HydrophobicContact SD-CZ 4.41Å; M328-L361 HydrophobicContact CB-CD1 4.46Å |
| 329 | F | 93.6 | Very high | 94.5 | Very high | 25 Ų | 25 | 49.8 Ų | 49.8 | 11% | 0.11 | 26% | 0.261 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106 | 29.3 | -176.9 | -63.9 | -79.1 | 0 | 0 | 0 | 114.2 | A325 E327 F331 S332 Q335 F339 L361 N365 | A325-F329 WeakPolarHBondContact O-CD2 3.05Å; A325-F329 PolarHBondContact O-N 2.88Å; E327-F329 PolarHBondContact O-N 3.47Å; F329-F331 VanDerWaalsContact C-N 3.27Å; F329-F331 PolarHBondContact O-N 3.45Å; F329-S332 WeakPolarHBondContact O-CB 3.24Å; F329-S332 PolarHBondContact O-N 2.91Å; F329-Q335 HydrophobicContact CB-CB 3.64Å; F329-Q335 HydrophobicContact CD1-CB 3.76Å; F329-Q335 HydrophobicContact CD1-CG 4.48Å; F329-Q335 HydrophobicContact CG-CB 3.74Å; F329-F339 HydrophobicContact CD2-CB 4.03Å; F329-F339 HydrophobicContact CD2-CG 4.32Å; F329-F339 HydrophobicContact CE2-CB 3.49Å; F329-F339 VanDerWaalsContact CE2-CB 3.49Å; F329-F339 HydrophobicContact CE2-CD1 4.45Å; F329-F339 AromaticContact CE2-CD2 3.54Å; F329-F339 HydrophobicContact CE2-CD2 3.54Å; F329-F339 HydrophobicContact CE2-CE2 4.44Å; F329-F339 AromaticContact CE2-CG 3.55Å; F329-F339 HydrophobicContact CE2-CG 3.55Å; F329-F339 HydrophobicContact CZ-CB 4.16Å; F329-F339 AromaticContact CZ-CD2 4Å; F329-F339 HydrophobicContact CZ-CD2 4Å; F329-F339 HydrophobicContact CZ-CG 4.34Å; F329-L361 HydrophobicContact CE1-CD1 4.42Å; F329-L361 HydrophobicContact CZ-CD1 4.37Å; F329-N365 WeakPolarHBondContact CE1-ND2 3.47Å; F329-N365 VanDerWaalsContact CZ-ND2 3.26Å; F329-N365 WeakPolarHBondContact CZ-ND2 3.49Å; F329-N365 VanDerWaalsContact CZ-OD1 3.31Å; F329-N365 WeakPolarHBondContact CZ-OD1 3.48Å |
| 330 | Q | 91.9 | Very high | 94.7 | Very high | 174 Ų | 174 | 45.3 Ų | 45.3 | 81% | 0.813 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 42.8 | 172.3 | -56.3 | 177.5 | 27 | 0 | 0 | 113.2 | M326 E327 S332 | M326-Q330 PolarHBondContact O-N 2.71Å; E327-Q330 PolarHBondContact O-N 2.88Å; Q330-S332 PolarHBondContact O-N 3.19Å |
| 331 | F | 91.5 | Very high | 94.9 | Very high | 74 Ų | 74 | 48 Ų | 48 | 33% | 0.325 | 24% | 0.239 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 63.8 | 21.7 | 179.6 | -46.4 | -60.5 | 0 | 0 | 0 | 114.9 | K293 Y305 M326 E327 F329 E333 | K293-F331 HydrophobicContact CB-CE1 4.15Å; K293-F331 HydrophobicContact CB-CZ 4.13Å; K293-F331 WeakPolarHBondContact O-CE2 3.5Å; K293-F331 WeakPolarHBondContact O-CZ 3.23Å; Y305-F331 HydrophobicContact CD2-CB 4.05Å; Y305-F331 AromaticContact CD2-CD1 3.54Å; Y305-F331 HydrophobicContact CD2-CD1 3.54Å; Y305-F331 HydrophobicContact CD2-CE1 4.3Å; Y305-F331 HydrophobicContact CD2-CG 4Å; Y305-F331 AromaticContact CE2-CD1 3.41Å; Y305-F331 HydrophobicContact CE2-CD1 3.41Å; Y305-F331 VanDerWaalsContact CE2-CD1 3.41Å; Y305-F331 AromaticContact CE2-CE1 3.86Å; Y305-F331 HydrophobicContact CE2-CE1 3.86Å; Y305-F331 HydrophobicContact CE2-CG 4.33Å; M326-F331 HydrophobicContact CB-CD1 4.29Å; M326-F331 HydrophobicContact CE-CB 4.2Å; M326-F331 VanDerWaalsContact O-CA 3.31Å; M326-F331 WeakPolarHBondContact O-CA 3.28Å; M326-F331 WeakPolarHBondContact O-CD1 3.5Å; M326-F331 PolarHBondContact O-N 2.7Å; E327-F331 HydrophobicContact CG-CE1 4.07Å; F329-F331 VanDerWaalsContact C-N 3.27Å; F329-F331 PolarHBondContact O-N 3.45Å; F331-E333 PolarHBondContact O-N 3.05Å |
| 332 | S | 92.8 | Very high | 95 | Very high | 45 Ų | 45 | 46.5 Ų | 46.5 | 32% | 0.315 | 23% | 0.231 | S | C | . | . | trans | -82.3 | 106.5 | 174.8 | -173.5 | 0 | 0 | 0 | 0 | 111.9 | F329 Q330 S334 Q335 A336 | F329-S332 WeakPolarHBondContact O-CB 3.24Å; F329-S332 PolarHBondContact O-N 2.91Å; Q330-S332 PolarHBondContact O-N 3.19Å; S332-S334 VanDerWaalsContact C-N 3.33Å; S332-S334 PolarHBondContact O-N 2.76Å; S332-Q335 PolarHBondContact O-N 2.87Å; S332-A336 WeakPolarHBondContact O-CB 3.26Å; S332-A336 PolarHBondContact O-N 3.21Å | ||
| 333 | E | 94.9 | Very high | 95 | Very high | 70 Ų | 70 | 47.7 Ų | 47.7 | 33% | 0.327 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -51.7 | -46.1 | 179 | -178.2 | -174.5 | 176.3 | 0 | 0 | 113.6 | A308 R311 F331 A336 G337 | A308-E333 HydrophobicContact CB-CB 3.8Å; A308-E333 HydrophobicContact CB-CG 3.92Å; R311-E333 WeakPolarHBondContact CD-OE1 3.48Å; R311-E333 IonicContact CZ-OE1 2.73Å; R311-E333 IonicContact CZ-OE2 2.72Å; R311-E333 VanDerWaalsContact NE-CD 3.31Å; R311-E333 IonicContact NE-OE1 2.65Å; R311-E333 PolarHBondContact NE-OE1 2.66Å; R311-E333 IonicContact NE-OE2 3.81Å; R311-E333 PolarHBondContact NE-OE2 2.69Å; R311-E333 IonicContact NH2-OE1 3.79Å; R311-E333 IonicContact NH2-OE2 3.72Å; R311-E333 PolarHBondContact NH2-OE2 3.13Å; F331-E333 PolarHBondContact O-N 3.05Å; E333-A336 PolarHBondContact O-N 3.49Å; E333-G337 PolarHBondContact O-N 3.26Å |
| 334 | S | 95 | Very high | 95.1 | Very high | 79 Ų | 79 | 50.4 Ų | 50.4 | 55% | 0.552 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -67.8 | -38.2 | -175.9 | 52.5 | 0 | 0 | 0 | 0 | 111.9 | S332 E338 | S332-S334 VanDerWaalsContact C-N 3.33Å; S332-S334 PolarHBondContact O-N 2.76Å; S334-E338 WeakPolarHBondContact O-CB 3.47Å; S334-E338 WeakPolarHBondContact O-CG 3.24Å; S334-E338 PolarHBondContact O-N 3.43Å |
| 335 | Q | 96.2 | Very high | 95.3 | Very high | 75 Ų | 75 | 50 Ų | 50 | 35% | 0.35 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -73.9 | -41.1 | 176.9 | -67.8 | -65.2 | -20.4 | 0 | 0 | 111.7 | F329 S332 G337 E338 F339 N365 | F329-Q335 HydrophobicContact CB-CB 3.64Å; F329-Q335 HydrophobicContact CD1-CB 3.76Å; F329-Q335 HydrophobicContact CD1-CG 4.48Å; F329-Q335 HydrophobicContact CG-CB 3.74Å; S332-Q335 PolarHBondContact O-N 2.87Å; Q335-G337 PolarHBondContact O-N 2.75Å; Q335-E338 PolarHBondContact O-N 2.92Å; Q335-F339 VanDerWaalsContact O-CB 3.29Å; Q335-F339 WeakPolarHBondContact O-CB 3.35Å; Q335-F339 PolarHBondContact O-N 3.08Å; Q335-N365 PolarHBondContact O-ND2 2.73Å; Q335-N365 VanDerWaalsContact O-ND2 3.08Å; Q335-N365 PolarHBondContact OE1-ND2 3.22Å |
| 336 | A | 96.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.9 | -40.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L312 A325 M326 S332 E333 F339 L340 | L312-A336 HydrophobicContact CD1-CB 4.05Å; A325-A336 HydrophobicContact CB-CB 4.01Å; M326-A336 HydrophobicContact CG-CB 4.12Å; M326-A336 HydrophobicContact SD-CB 3.66Å; S332-A336 WeakPolarHBondContact O-CB 3.26Å; S332-A336 PolarHBondContact O-N 3.21Å; E333-A336 PolarHBondContact O-N 3.49Å; A336-F339 WeakPolarHBondContact O-CB 3.32Å; A336-F339 PolarHBondContact O-N 3.23Å; A336-L340 WeakPolarHBondContact O-CB 3.45Å; A336-L340 VanDerWaalsContact O-CG 3.24Å; A336-L340 WeakPolarHBondContact O-CG 3.21Å; A336-L340 PolarHBondContact O-N 3.21Å |
| 337 | G | 96.2 | Very high | 95.3 | Very high | 13 Ų | 13 | 51.6 Ų | 51.6 | 13% | 0.134 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.9 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | E333 Q335 L340 R341 | E333-G337 PolarHBondContact O-N 3.26Å; Q335-G337 PolarHBondContact O-N 2.75Å; G337-L340 PolarHBondContact O-N 3.24Å; G337-R341 PolarHBondContact O-N 2.87Å; G337-R341 VanDerWaalsContact O-N 3.12Å |
| 338 | E | 96.8 | Very high | 95.5 | Very high | 79 Ų | 79 | 53.4 Ų | 53.4 | 37% | 0.369 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.9 | -40.8 | 173.3 | -71.8 | -72.1 | 128.2 | 0 | 0 | 111.5 | S334 Q335 R341 L342 N365 | S334-E338 WeakPolarHBondContact O-CB 3.47Å; S334-E338 WeakPolarHBondContact O-CG 3.24Å; S334-E338 PolarHBondContact O-N 3.43Å; Q335-E338 PolarHBondContact O-N 2.92Å; E338-R341 IonicContact OE1-CZ 2.7Å; E338-R341 IonicContact OE1-NH1 2.68Å; E338-R341 PolarHBondContact OE1-NH1 3.19Å; E338-R341 IonicContact OE1-NH2 3.67Å; E338-R341 PolarHBondContact OE1-NH2 3.06Å; E338-R341 IonicContact OE2-CZ 3.67Å; E338-R341 IonicContact OE2-NH1 2.63Å; E338-R341 PolarHBondContact OE2-NH1 3.08Å; E338-R341 IonicContact OE2-NH2 3.6Å; E338-R341 PolarHBondContact OE2-NH2 3.32Å; E338-L342 VanDerWaalsContact O-CG 3.31Å; E338-L342 WeakPolarHBondContact O-CG 3.31Å; E338-L342 PolarHBondContact O-N 3.21Å; E338-N365 HydrophobicContact CB-CB 4.4Å |
| 339 | F | 97.6 | Very high | 95.6 | Very high | 1 Ų | 1 | 56.5 Ų | 56.5 | 0% | 0.004 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -57.3 | -54.6 | 172.4 | 170.4 | -93.5 | 0 | 0 | 0 | 111.5 | A325 M328 F329 Q335 A336 R341 L342 W343 K357 L360 N365 | A325-F339 HydrophobicContact CB-CD1 3.55Å; A325-F339 HydrophobicContact CB-CE1 4.03Å; M328-F339 HydrophobicContact CE-CD1 4.05Å; M328-F339 HydrophobicContact CE-CD2 4.36Å; M328-F339 HydrophobicContact CE-CE1 3.45Å; M328-F339 VanDerWaalsContact CE-CE1 3.45Å; M328-F339 HydrophobicContact CE-CE2 3.79Å; M328-F339 HydrophobicContact CE-CG 4.49Å; M328-F339 HydrophobicContact CE-CZ 3.31Å; M328-F339 HydrophobicContact SD-CE2 4.48Å; M328-F339 HydrophobicContact SD-CZ 4.41Å; F329-F339 HydrophobicContact CD2-CB 4.03Å; F329-F339 HydrophobicContact CD2-CG 4.32Å; F329-F339 HydrophobicContact CE2-CB 3.49Å; F329-F339 VanDerWaalsContact CE2-CB 3.49Å; F329-F339 HydrophobicContact CE2-CD1 4.45Å; F329-F339 AromaticContact CE2-CD2 3.54Å; F329-F339 HydrophobicContact CE2-CD2 3.54Å; F329-F339 HydrophobicContact CE2-CE2 4.44Å; F329-F339 AromaticContact CE2-CG 3.55Å; F329-F339 HydrophobicContact CE2-CG 3.55Å; F329-F339 HydrophobicContact CZ-CB 4.16Å; F329-F339 AromaticContact CZ-CD2 4Å; F329-F339 HydrophobicContact CZ-CD2 4Å; F329-F339 HydrophobicContact CZ-CG 4.34Å; Q335-F339 VanDerWaalsContact O-CB 3.29Å; Q335-F339 WeakPolarHBondContact O-CB 3.35Å; Q335-F339 PolarHBondContact O-N 3.08Å; A336-F339 WeakPolarHBondContact O-CB 3.32Å; A336-F339 PolarHBondContact O-N 3.23Å; F339-R341 VanDerWaalsContact C-N 3.3Å; F339-R341 PolarHBondContact O-N 2.83Å; F339-L342 PolarHBondContact O-N 2.91Å; F339-L342 VanDerWaalsContact O-N 3.13Å; F339-W343 HydrophobicContact CE1-CB 4.07Å; F339-W343 HydrophobicContact CE1-CG 4.15Å; F339-W343 HydrophobicContact CE2-CB 4.47Å; F339-W343 HydrophobicContact CZ-CB 4.04Å; F339-W343 AromaticContact CZ-CD1 3.48Å; F339-W343 VanDerWaalsContact CZ-CD1 3.48Å; F339-W343 AromaticContact CZ-CG 3.96Å; F339-W343 HydrophobicContact CZ-CG 3.96Å; F339-W343 WeakPolarHBondContact O-CB 3.29Å; F339-W343 PolarHBondContact O-N 3.06Å; F339-K357 HydrophobicContact CE2-CG 4.49Å; F339-K357 HydrophobicContact CZ-CG 3.97Å; F339-L360 HydrophobicContact CD2-CB 3.85Å; F339-L360 HydrophobicContact CD2-CD1 3.64Å; F339-L360 HydrophobicContact CD2-CG 4.38Å; F339-L360 HydrophobicContact CE2-CB 3.92Å; F339-L360 HydrophobicContact CE2-CD1 3.63Å; F339-L360 HydrophobicContact CE2-CG 4.43Å; F339-N365 WeakPolarHBondContact CA-OD1 3.47Å; F339-N365 WeakPolarHBondContact CB-OD1 3.36Å |
| 340 | L | 97 | Very high | 95.7 | Very high | 2 Ų | 2 | 58.3 Ų | 58.3 | 1% | 0.01 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -57.6 | -43.1 | -177.7 | -73.4 | 164.6 | 0 | 0 | 0 | 111.6 | L312 Y317 L321 V322 A325 A336 G337 L342 W343 E344 | L312-L340 HydrophobicContact CB-CD1 4.42Å; L312-L340 HydrophobicContact CD1-CD1 4.15Å; L312-L340 HydrophobicContact CD2-CD1 4.18Å; L312-L340 HydrophobicContact CG-CD1 4.48Å; Y317-L340 HydrophobicContact CD1-CB 4.12Å; Y317-L340 HydrophobicContact CD2-CB 4.3Å; Y317-L340 HydrophobicContact CD2-CD1 3.83Å; Y317-L340 HydrophobicContact CE1-CB 3.94Å; Y317-L340 HydrophobicContact CE2-CB 4.12Å; Y317-L340 HydrophobicContact CE2-CD1 4.29Å; Y317-L340 HydrophobicContact CG-CB 4.3Å; Y317-L340 HydrophobicContact CG-CD1 4.04Å; L321-L340 HydrophobicContact CB-CD2 4Å; V322-L340 HydrophobicContact CG2-CD1 3.94Å; A325-L340 HydrophobicContact CB-CD1 4.23Å; A325-L340 HydrophobicContact CB-CD2 4.05Å; A325-L340 HydrophobicContact CB-CG 3.9Å; A336-L340 WeakPolarHBondContact O-CB 3.45Å; A336-L340 VanDerWaalsContact O-CG 3.24Å; A336-L340 WeakPolarHBondContact O-CG 3.21Å; A336-L340 PolarHBondContact O-N 3.21Å; G337-L340 PolarHBondContact O-N 3.24Å; L340-L342 PolarHBondContact O-N 3.26Å; L340-W343 PolarHBondContact O-N 3.47Å; L340-E344 WeakPolarHBondContact O-CB 3.44Å; L340-E344 PolarHBondContact O-N 3.26Å |
| 341 | R | 96.8 | Very high | 95.9 | Very high | 93 Ų | 93 | 51.9 Ų | 51.9 | 35% | 0.351 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.5 | -38.1 | 177.9 | -166.1 | -167.9 | 69.7 | -137.9 | -10.3 | 112.9 | G337 E338 F339 Q345 | G337-R341 PolarHBondContact O-N 2.87Å; G337-R341 VanDerWaalsContact O-N 3.12Å; E338-R341 IonicContact OE1-CZ 2.7Å; E338-R341 IonicContact OE1-NH1 2.68Å; E338-R341 PolarHBondContact OE1-NH1 3.19Å; E338-R341 IonicContact OE1-NH2 3.67Å; E338-R341 PolarHBondContact OE1-NH2 3.06Å; E338-R341 IonicContact OE2-CZ 3.67Å; E338-R341 IonicContact OE2-NH1 2.63Å; E338-R341 PolarHBondContact OE2-NH1 3.08Å; E338-R341 IonicContact OE2-NH2 3.6Å; E338-R341 PolarHBondContact OE2-NH2 3.32Å; F339-R341 VanDerWaalsContact C-N 3.3Å; F339-R341 PolarHBondContact O-N 2.83Å; R341-Q345 WeakPolarHBondContact O-CB 3.43Å; R341-Q345 WeakPolarHBondContact O-CG 3.39Å; R341-Q345 PolarHBondContact O-N 2.98Å |
| 342 | L | 96.9 | Very high | 96 | Very high | 1 Ų | 1 | 55.4 Ų | 55.4 | 1% | 0.005 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -75.9 | -35.3 | 176.6 | -69.2 | 172.2 | 0 | 0 | 0 | 111.8 | E338 F339 L340 Q345 F346 L360 N365 R367 | E338-L342 VanDerWaalsContact O-CG 3.31Å; E338-L342 WeakPolarHBondContact O-CG 3.31Å; E338-L342 PolarHBondContact O-N 3.21Å; F339-L342 PolarHBondContact O-N 2.91Å; F339-L342 VanDerWaalsContact O-N 3.13Å; L340-L342 PolarHBondContact O-N 3.26Å; L342-Q345 PolarHBondContact O-N 3.39Å; L342-F346 WeakPolarHBondContact O-CB 3.31Å; L342-F346 VanDerWaalsContact O-CG 3.28Å; L342-F346 WeakPolarHBondContact O-CG 3.18Å; L342-F346 PolarHBondContact O-N 3.5Å; L342-L360 HydrophobicContact CB-CD1 3.99Å; L342-L360 HydrophobicContact CB-CD2 3.85Å; L342-L360 HydrophobicContact CD1-CD2 3.84Å; L342-L360 HydrophobicContact CG-CD2 4.48Å; L342-N365 HydrophobicContact CD1-CB 4.11Å; L342-N365 WeakPolarHBondContact CD1-O 3.41Å; L342-R367 HydrophobicContact CD1-CB 4.44Å; L342-R367 HydrophobicContact CD2-CB 3.69Å; L342-R367 HydrophobicContact CD2-CG 3.77Å |
| 343 | W | 96.3 | Very high | 96.1 | Very high | 26 Ų | 26 | 58 Ų | 58 | 10% | 0.098 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65 | -43.3 | 177.4 | -176.6 | 98 | 0 | 0 | 0 | 111.4 | L321 F339 L340 F346 S347 Q353 I356 L360 | L321-W343 HydrophobicContact CD1-CE3 4.25Å; L321-W343 HydrophobicContact CD1-CH2 3.66Å; L321-W343 HydrophobicContact CD1-CZ2 4.37Å; L321-W343 HydrophobicContact CD1-CZ3 3.59Å; L321-W343 HydrophobicContact CD2-CH2 3.99Å; L321-W343 HydrophobicContact CD2-CZ2 3.89Å; L321-W343 HydrophobicContact CD2-CZ3 4.49Å; F339-W343 HydrophobicContact CE1-CB 4.07Å; F339-W343 HydrophobicContact CE1-CG 4.15Å; F339-W343 HydrophobicContact CE2-CB 4.47Å; F339-W343 HydrophobicContact CZ-CB 4.04Å; F339-W343 AromaticContact CZ-CD1 3.48Å; F339-W343 VanDerWaalsContact CZ-CD1 3.48Å; F339-W343 AromaticContact CZ-CG 3.96Å; F339-W343 HydrophobicContact CZ-CG 3.96Å; F339-W343 WeakPolarHBondContact O-CB 3.29Å; F339-W343 PolarHBondContact O-N 3.06Å; L340-W343 PolarHBondContact O-N 3.47Å; W343-F346 PolarHBondContact O-N 3.47Å; W343-S347 VanDerWaalsContact O-CB 3.26Å; W343-S347 WeakPolarHBondContact O-CB 3.19Å; W343-S347 PolarHBondContact O-N 3.03Å; W343-S347 PolarHBondContact O-OG 3.5Å; W343-Q353 HydrophobicContact CH2-CG 4.32Å; W343-Q353 HydrophobicContact CZ2-CB 4.02Å; W343-Q353 VanDerWaalsContact CZ2-CD 3.46Å; W343-Q353 HydrophobicContact CZ2-CG 3.61Å; W343-I356 HydrophobicContact CB-CG2 4.18Å; W343-I356 VanDerWaalsContact CD1-CG2 3.42Å; W343-I356 HydrophobicContact CG-CG2 3.98Å; W343-L360 HydrophobicContact CB-CD1 4.17Å |
| 344 | E | 96.6 | Very high | 96.1 | Very high | 93 Ų | 93 | 59.9 Ų | 59.9 | 44% | 0.435 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.5 | -52.3 | 171.5 | -175.1 | 175.9 | -138.3 | 0 | 0 | 110.4 | L340 F346 S347 D348 | L340-E344 WeakPolarHBondContact O-CB 3.44Å; L340-E344 PolarHBondContact O-N 3.26Å; E344-F346 VanDerWaalsContact C-N 3.31Å; E344-F346 PolarHBondContact O-N 2.96Å; E344-S347 PolarHBondContact O-N 3.28Å; E344-S347 VanDerWaalsContact O-N 3.08Å; E344-D348 PolarHBondContact O-N 3.46Å |
| 345 | Q | 96.8 | Very high | 96.1 | Very high | 58 Ų | 58 | 59.7 Ų | 59.7 | 27% | 0.271 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -57.6 | -37.6 | 178.9 | -74.8 | 171.3 | 18.2 | 0 | 0 | 114.1 | R341 L342 M349 | R341-Q345 WeakPolarHBondContact O-CB 3.43Å; R341-Q345 WeakPolarHBondContact O-CG 3.39Å; R341-Q345 PolarHBondContact O-N 2.98Å; L342-Q345 PolarHBondContact O-N 3.39Å; Q345-M349 WeakPolarHBondContact O-CG 3.37Å; Q345-M349 PolarHBondContact O-N 2.95Å |
| 346 | F | 96.4 | Very high | 96.1 | Very high | 1 Ų | 1 | 56.1 Ų | 56.1 | 0% | 0.004 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -82.1 | -27.5 | 177.8 | -64.1 | -19.4 | 0 | 0 | 0 | 112.5 | L342 W343 E344 M349 G350 F351 I356 L360 R367 A370 L371 L374 | L342-F346 WeakPolarHBondContact O-CB 3.31Å; L342-F346 VanDerWaalsContact O-CG 3.28Å; L342-F346 WeakPolarHBondContact O-CG 3.18Å; L342-F346 PolarHBondContact O-N 3.5Å; W343-F346 PolarHBondContact O-N 3.47Å; E344-F346 VanDerWaalsContact C-N 3.31Å; E344-F346 PolarHBondContact O-N 2.96Å; F346-M349 HydrophobicContact CD1-SD 4.28Å; F346-M349 PolarHBondContact O-N 3.45Å; F346-G350 PolarHBondContact O-N 2.95Å; F346-F351 HydrophobicContact CB-CD2 4.02Å; F346-F351 WeakPolarHBondContact O-CD2 3.19Å; F346-F351 PolarHBondContact O-N 3.23Å; F346-I356 HydrophobicContact CB-CD1 3.74Å; F346-I356 HydrophobicContact CB-CG1 3.84Å; F346-I356 HydrophobicContact CB-CG2 4.15Å; F346-I356 HydrophobicContact CD2-CG2 4.17Å; F346-L360 HydrophobicContact CD2-CD1 4.46Å; F346-L360 HydrophobicContact CD2-CD2 4.37Å; F346-L360 HydrophobicContact CD2-CG 4.45Å; F346-L360 HydrophobicContact CE2-CD2 3.84Å; F346-L360 HydrophobicContact CE2-CG 4.35Å; F346-R367 HydrophobicContact CZ-CG 4.24Å; F346-A370 HydrophobicContact CE2-CB 3.86Å; F346-A370 HydrophobicContact CZ-CB 4.31Å; F346-L371 HydrophobicContact CD1-CD1 4.28Å; F346-L371 HydrophobicContact CE1-CB 3.98Å; F346-L371 HydrophobicContact CE1-CD1 3.94Å; F346-L371 HydrophobicContact CE1-CG 4.37Å; F346-L371 HydrophobicContact CZ-CB 3.89Å; F346-L374 HydrophobicContact CB-CD1 4.25Å; F346-L374 HydrophobicContact CD2-CD1 3.45Å; F346-L374 VanDerWaalsContact CD2-CD1 3.45Å; F346-L374 HydrophobicContact CE2-CD1 3.83Å; F346-L374 HydrophobicContact CG-CD1 3.89Å |
| 347 | S | 95.1 | Very high | 96.1 | Very high | 34 Ų | 34 | 57.6 Ų | 57.6 | 24% | 0.238 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.6 | -39.5 | 171.8 | -60.6 | 0 | 0 | 0 | 0 | 111.2 | W343 E344 M349 G350 | W343-S347 VanDerWaalsContact O-CB 3.26Å; W343-S347 WeakPolarHBondContact O-CB 3.19Å; W343-S347 PolarHBondContact O-N 3.03Å; W343-S347 PolarHBondContact O-OG 3.5Å; E344-S347 PolarHBondContact O-N 3.28Å; E344-S347 VanDerWaalsContact O-N 3.08Å; S347-M349 PolarHBondContact O-N 3.24Å; S347-G350 WeakPolarHBondContact O-CA 3.45Å; S347-G350 PolarHBondContact O-N 2.99Å |
| 348 | D | 96.5 | Very high | 96 | Very high | 134 Ų | 134 | 61.9 Ų | 61.9 | 72% | 0.717 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -61.9 | -27.9 | 172.6 | -73.8 | -17.3 | 0 | 0 | 0 | 112.8 | E344 G350 | E344-D348 PolarHBondContact O-N 3.46Å; D348-G350 VanDerWaalsContact C-N 3.26Å |
| 349 | M | 95.8 | Very high | 96 | Very high | 110 Ų | 110 | 58.1 Ų | 58.1 | 54% | 0.542 | 29% | 0.292 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | -4.6 | 172.7 | -67.5 | 179.9 | 71.1 | 0 | 0 | 113.4 | Q345 F346 S347 F351 L371 | Q345-M349 WeakPolarHBondContact O-CG 3.37Å; Q345-M349 PolarHBondContact O-N 2.95Å; F346-M349 HydrophobicContact CD1-SD 4.28Å; F346-M349 PolarHBondContact O-N 3.45Å; S347-M349 PolarHBondContact O-N 3.24Å; M349-F351 HydrophobicContact CB-CD2 3.78Å; M349-F351 HydrophobicContact CB-CE2 3.71Å; M349-F351 HydrophobicContact CE-CE2 3.86Å; M349-F351 HydrophobicContact CE-CZ 4.32Å; M349-F351 HydrophobicContact CG-CE2 4.48Å; M349-F351 HydrophobicContact SD-CE2 4.04Å; M349-L371 HydrophobicContact CE-CD1 3.89Å; M349-L371 HydrophobicContact SD-CD1 4.1Å |
| 350 | G | 95 | Very high | 96 | Very high | 63 Ų | 63 | 58.1 Ų | 58.1 | 65% | 0.649 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 83.9 | 13.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | F346 S347 D348 | F346-G350 PolarHBondContact O-N 2.95Å; S347-G350 WeakPolarHBondContact O-CA 3.45Å; S347-G350 PolarHBondContact O-N 2.99Å; D348-G350 VanDerWaalsContact C-N 3.26Å |
| 351 | F | 96.1 | Very high | 95.9 | Very high | 38 Ų | 38 | 62.3 Ų | 62.3 | 17% | 0.167 | 31% | 0.314 | C | S | . | . | trans | -71.8 | 151.2 | 174.6 | -63 | -68.4 | 0 | 0 | 0 | 111.7 | F346 M349 I356 L371 L374 V375 A378 | F346-F351 HydrophobicContact CB-CD2 4.02Å; F346-F351 WeakPolarHBondContact O-CD2 3.19Å; F346-F351 PolarHBondContact O-N 3.23Å; M349-F351 HydrophobicContact CB-CD2 3.78Å; M349-F351 HydrophobicContact CB-CE2 3.71Å; M349-F351 HydrophobicContact CE-CE2 3.86Å; M349-F351 HydrophobicContact CE-CZ 4.32Å; M349-F351 HydrophobicContact CG-CE2 4.48Å; M349-F351 HydrophobicContact SD-CE2 4.04Å; F351-I356 HydrophobicContact CB-CD1 3.85Å; F351-I356 HydrophobicContact CB-CG1 3.73Å; F351-I356 WeakPolarHBondContact O-CD1 3.43Å; F351-L371 HydrophobicContact CE2-CD1 3.74Å; F351-L371 HydrophobicContact CZ-CD1 4.02Å; F351-L374 HydrophobicContact CB-CD2 4.39Å; F351-L374 HydrophobicContact CD1-CB 4.06Å; F351-L374 HydrophobicContact CD1-CD2 4.44Å; F351-L374 HydrophobicContact CD2-CD1 4.16Å; F351-L374 HydrophobicContact CE1-CB 3.92Å; F351-L374 HydrophobicContact CE2-CB 4.37Å; F351-L374 HydrophobicContact CG-CB 4.36Å; F351-L374 HydrophobicContact CG-CD1 4.32Å; F351-L374 HydrophobicContact CG-CD2 4.41Å; F351-L374 HydrophobicContact CZ-CB 4.09Å; F351-V375 HydrophobicContact CE1-CG2 4.43Å; F351-V375 HydrophobicContact CZ-CG2 3.86Å; F351-A378 HydrophobicContact CE1-CB 4.43Å | ||
| 352 | Q | 95.1 | Very high | 95.8 | Very high | 149 Ų | 149 | 63 Ų | 63 | 70% | 0.696 | 33% | 0.328 | S | S | * | . | trans | -68.7 | 131.8 | 179.9 | -69.3 | -65.4 | -12.7 | 0 | 0 | 111.9 | D354 R355 I356 | Q352-D354 VanDerWaalsContact C-N 3.33Å; Q352-D354 PolarHBondContact O-N 3.23Å; Q352-R355 HydrophobicContact CB-CB 4.24Å; Q352-R355 PolarHBondContact O-N 3.37Å; Q352-I356 WeakPolarHBondContact O-CG1 3.45Å; Q352-I356 PolarHBondContact O-N 3.26Å | ||
| 353 | Q | 94.6 | Very high | 95.8 | Very high | 98 Ų | 98 | 64.9 Ų | 64.9 | 46% | 0.458 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -57.2 | -42 | -172.4 | -63.8 | -176 | 6.9 | 0 | 0 | 113.4 | W343 I356 K357 | W343-Q353 HydrophobicContact CH2-CG 4.32Å; W343-Q353 HydrophobicContact CZ2-CB 4.02Å; W343-Q353 VanDerWaalsContact CZ2-CD 3.46Å; W343-Q353 HydrophobicContact CZ2-CG 3.61Å; Q353-I356 PolarHBondContact O-N 2.79Å; Q353-K357 VanDerWaalsContact O-CG 3.26Å; Q353-K357 WeakPolarHBondContact O-CG 3.26Å; Q353-K357 PolarHBondContact O-N 2.82Å |
| 354 | D | 94.8 | Very high | 95.6 | Very high | 111 Ų | 111 | 65.5 Ų | 65.5 | 59% | 0.594 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -66.5 | -39.7 | 178.9 | -59.2 | -34.2 | 0 | 0 | 0 | 111.5 | Q352 K357 E358 | Q352-D354 VanDerWaalsContact C-N 3.33Å; Q352-D354 PolarHBondContact O-N 3.23Å; D354-K357 WeakPolarHBondContact O-CB 3.28Å; D354-K357 PolarHBondContact O-N 3.42Å; D354-E358 WeakPolarHBondContact O-CG 3.28Å; D354-E358 PolarHBondContact O-N 3.01Å |
| 355 | R | 95.6 | Very high | 95.5 | Very high | 75 Ų | 75 | 61.7 Ų | 61.7 | 28% | 0.283 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -68.3 | -39.3 | 176.5 | -166.6 | 68.9 | -176.7 | 127.8 | 10.9 | 111.7 | Q352 K357 E358 V359 E373 L374 C377 | Q352-R355 HydrophobicContact CB-CB 4.24Å; Q352-R355 PolarHBondContact O-N 3.37Å; R355-K357 VanDerWaalsContact C-N 3.33Å; R355-K357 PolarHBondContact O-N 3.31Å; R355-E358 WeakPolarHBondContact CD-OE2 3.32Å; R355-E358 IonicContact CZ-OE2 3.77Å; R355-E358 IonicContact NH1-OE2 2.7Å; R355-E358 PolarHBondContact NH1-OE2 2.95Å; R355-E358 PolarHBondContact O-N 3.48Å; R355-V359 HydrophobicContact CG-CG2 4.34Å; R355-V359 WeakPolarHBondContact O-CB 3.26Å; R355-V359 WeakPolarHBondContact O-CG2 3.16Å; R355-V359 PolarHBondContact O-N 3.38Å; R355-E373 IonicContact CZ-OE1 3.62Å; R355-E373 IonicContact NH1-OE1 3.03Å; R355-E373 IonicContact NH2-OE1 3.61Å; R355-E373 PolarHBondContact NH2-OE1 3.48Å; R355-L374 HydrophobicContact CB-CD2 4.29Å; R355-L374 HydrophobicContact CG-CD2 3.74Å; R355-C377 PolarHBondContact NH2-SG 2.71Å |
| 356 | I | 96.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.7 | -48 | 171.9 | -66.1 | 167.3 | 0 | 0 | 0 | 110.1 | W343 F346 F351 Q352 Q353 V359 L360 L374 | W343-I356 HydrophobicContact CB-CG2 4.18Å; W343-I356 VanDerWaalsContact CD1-CG2 3.42Å; W343-I356 HydrophobicContact CG-CG2 3.98Å; F346-I356 HydrophobicContact CB-CD1 3.74Å; F346-I356 HydrophobicContact CB-CG1 3.84Å; F346-I356 HydrophobicContact CB-CG2 4.15Å; F346-I356 HydrophobicContact CD2-CG2 4.17Å; F351-I356 HydrophobicContact CB-CD1 3.85Å; F351-I356 HydrophobicContact CB-CG1 3.73Å; F351-I356 WeakPolarHBondContact O-CD1 3.43Å; Q352-I356 WeakPolarHBondContact O-CG1 3.45Å; Q352-I356 PolarHBondContact O-N 3.26Å; Q353-I356 PolarHBondContact O-N 2.79Å; I356-V359 PolarHBondContact O-N 3.25Å; I356-L360 HydrophobicContact CG2-CD1 3.63Å; I356-L360 HydrophobicContact CG2-CG 4.27Å; I356-L360 WeakPolarHBondContact O-CB 3.35Å; I356-L360 WeakPolarHBondContact O-CG 3.3Å; I356-L360 PolarHBondContact O-N 2.59Å; I356-L374 HydrophobicContact CG1-CD1 4.31Å; I356-L374 HydrophobicContact CG1-CD2 4.46Å |
| 357 | K | 95.8 | Very high | 95.5 | Very high | 31 Ų | 31 | 72.3 Ų | 72.3 | 14% | 0.135 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -58.7 | -52.1 | 179 | -73.3 | 165.5 | 178.4 | -167.5 | 0 | 111.9 | E324 F339 Q353 D354 R355 V359 L361 | E324-K357 WeakPolarHBondContact OE1-CD 3.47Å; E324-K357 VanDerWaalsContact OE1-CE 3.24Å; E324-K357 WeakPolarHBondContact OE1-CE 3.43Å; E324-K357 IonicContact OE1-NZ 2.72Å; E324-K357 PolarHBondContact OE1-NZ 2.77Å; E324-K357 WeakPolarHBondContact OE2-CE 3.31Å; E324-K357 IonicContact OE2-NZ 3.15Å; E324-K357 PolarHBondContact OE2-NZ 3.46Å; F339-K357 HydrophobicContact CE2-CG 4.49Å; F339-K357 HydrophobicContact CZ-CG 3.97Å; Q353-K357 VanDerWaalsContact O-CG 3.26Å; Q353-K357 WeakPolarHBondContact O-CG 3.26Å; Q353-K357 PolarHBondContact O-N 2.82Å; D354-K357 WeakPolarHBondContact O-CB 3.28Å; D354-K357 PolarHBondContact O-N 3.42Å; R355-K357 VanDerWaalsContact C-N 3.33Å; R355-K357 PolarHBondContact O-N 3.31Å; K357-V359 PolarHBondContact O-N 2.94Å; K357-L361 VanDerWaalsContact O-CB 3.28Å; K357-L361 WeakPolarHBondContact O-CB 3.34Å; K357-L361 PolarHBondContact O-N 2.87Å |
| 358 | E | 95.2 | Very high | 95.5 | Very high | 103 Ų | 103 | 78.4 Ų | 78.4 | 48% | 0.481 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -53.6 | -54.1 | 176.7 | -74.9 | -179.7 | 167.6 | 0 | 0 | 111.9 | D354 R355 L361 V362 | D354-E358 WeakPolarHBondContact O-CG 3.28Å; D354-E358 PolarHBondContact O-N 3.01Å; R355-E358 WeakPolarHBondContact CD-OE2 3.32Å; R355-E358 IonicContact CZ-OE2 3.77Å; R355-E358 IonicContact NH1-OE2 2.7Å; R355-E358 PolarHBondContact NH1-OE2 2.95Å; R355-E358 PolarHBondContact O-N 3.48Å; E358-L361 PolarHBondContact O-N 3.14Å; E358-V362 WeakPolarHBondContact O-CG2 3.38Å; E358-V362 PolarHBondContact O-N 2.91Å |
| 359 | V | 96.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 75.8 Ų | 75.8 | 0% | 0 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -70.1 | -39.9 | -171.4 | 177 | 0 | 0 | 0 | 0 | 111.1 | R355 I356 K357 L361 V362 H363 A370 E373 L374 | R355-V359 HydrophobicContact CG-CG2 4.34Å; R355-V359 WeakPolarHBondContact O-CB 3.26Å; R355-V359 WeakPolarHBondContact O-CG2 3.16Å; R355-V359 PolarHBondContact O-N 3.38Å; I356-V359 PolarHBondContact O-N 3.25Å; K357-V359 PolarHBondContact O-N 2.94Å; V359-L361 VanDerWaalsContact C-N 3.32Å; V359-L361 PolarHBondContact O-N 2.93Å; V359-V362 PolarHBondContact O-N 2.98Å; V359-H363 PolarHBondContact O-CD2 3.44Å; V359-H363 VanDerWaalsContact O-CD2 3.22Å; V359-H363 PolarHBondContact O-N 2.98Å; V359-A370 VanDerWaalsContact CG1-CA 3.49Å; V359-A370 HydrophobicContact CG1-CB 3.78Å; V359-A370 WeakPolarHBondContact CG1-O 3.26Å; V359-E373 HydrophobicContact CG1-CB 3.97Å; V359-E373 HydrophobicContact CG1-CG 4.35Å; V359-E373 HydrophobicContact CG2-CG 4.26Å; V359-L374 HydrophobicContact CB-CD2 4.44Å; V359-L374 HydrophobicContact CB-CG 4.37Å; V359-L374 HydrophobicContact CG1-CG 4.24Å; V359-L374 HydrophobicContact CG2-CD2 4.19Å; V359-L374 HydrophobicContact CG2-CG 4.44Å |
| 360 | L | 96.5 | Very high | 95.6 | Very high | 0 Ų | 0 | 70.6 Ų | 70.6 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.5 | -35.2 | 173.5 | -74.3 | 175.8 | 0 | 0 | 0 | 112.6 | F339 L342 W343 F346 I356 G364 N365 A370 | F339-L360 HydrophobicContact CD2-CB 3.85Å; F339-L360 HydrophobicContact CD2-CD1 3.64Å; F339-L360 HydrophobicContact CD2-CG 4.38Å; F339-L360 HydrophobicContact CE2-CB 3.92Å; F339-L360 HydrophobicContact CE2-CD1 3.63Å; F339-L360 HydrophobicContact CE2-CG 4.43Å; L342-L360 HydrophobicContact CB-CD1 3.99Å; L342-L360 HydrophobicContact CB-CD2 3.85Å; L342-L360 HydrophobicContact CD1-CD2 3.84Å; L342-L360 HydrophobicContact CG-CD2 4.48Å; W343-L360 HydrophobicContact CB-CD1 4.17Å; F346-L360 HydrophobicContact CD2-CD1 4.46Å; F346-L360 HydrophobicContact CD2-CD2 4.37Å; F346-L360 HydrophobicContact CD2-CG 4.45Å; F346-L360 HydrophobicContact CE2-CD2 3.84Å; F346-L360 HydrophobicContact CE2-CG 4.35Å; I356-L360 HydrophobicContact CG2-CD1 3.63Å; I356-L360 HydrophobicContact CG2-CG 4.27Å; I356-L360 WeakPolarHBondContact O-CB 3.35Å; I356-L360 WeakPolarHBondContact O-CG 3.3Å; I356-L360 PolarHBondContact O-N 2.59Å; L360-G364 WeakPolarHBondContact O-CA 3.27Å; L360-G364 PolarHBondContact O-N 3.03Å; L360-N365 PolarHBondContact O-N 2.79Å; L360-A370 HydrophobicContact CD2-CB 3.92Å |
| 361 | L | 95.6 | Very high | 95.7 | Very high | 91 Ų | 91 | 69.6 Ų | 69.6 | 48% | 0.476 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -70.3 | -42.9 | 176.2 | -174.5 | 63.3 | 0 | 0 | 0 | 111.8 | M328 F329 K357 E358 V359 G364 | M328-L361 HydrophobicContact CB-CD1 4.46Å; F329-L361 HydrophobicContact CE1-CD1 4.42Å; F329-L361 HydrophobicContact CZ-CD1 4.37Å; K357-L361 VanDerWaalsContact O-CB 3.28Å; K357-L361 WeakPolarHBondContact O-CB 3.34Å; K357-L361 PolarHBondContact O-N 2.87Å; E358-L361 PolarHBondContact O-N 3.14Å; V359-L361 VanDerWaalsContact C-N 3.32Å; V359-L361 PolarHBondContact O-N 2.93Å; L361-G364 PolarHBondContact O-N 3.3Å |
| 362 | V | 95.6 | Very high | 95.6 | Very high | 107 Ų | 107 | 74.7 Ų | 74.7 | 65% | 0.648 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -62.4 | -45.5 | 177.1 | 168 | 0 | 0 | 0 | 0 | 111.7 | E358 V359 | E358-V362 WeakPolarHBondContact O-CG2 3.38Å; E358-V362 PolarHBondContact O-N 2.91Å; V359-V362 PolarHBondContact O-N 2.98Å |
| 363 | H | 95.3 | Very high | 95.7 | Very high | 41 Ų | 41 | 70.2 Ų | 70.2 | 19% | 0.19 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -87.8 | -4.2 | -178.2 | -66.6 | -64 | 0 | 0 | 0 | 114.3 | V359 R366 Q369 E373 | V359-H363 PolarHBondContact O-CD2 3.44Å; V359-H363 VanDerWaalsContact O-CD2 3.22Å; V359-H363 PolarHBondContact O-N 2.98Å; H363-R366 HydrophobicContact CB-CB 4.27Å; H363-R366 VanDerWaalsContact O-CD 3.29Å; H363-R366 WeakPolarHBondContact O-CD 3.32Å; H363-R366 VanDerWaalsContact O-CG 3.23Å; H363-R366 WeakPolarHBondContact O-CG 3.49Å; H363-Q369 HydrophobicContact CB-CB 4.33Å; H363-E373 IonicContact CD2-OE2 3.44Å; H363-E373 IonicContact CE1-OE2 2.71Å; H363-E373 IonicContact NE2-OE2 2.71Å; H363-E373 PolarHBondContact NE2-OE2 3.5Å |
| 364 | G | 93.3 | Very high | 95.7 | Very high | 38 Ų | 38 | 65.8 Ų | 65.8 | 39% | 0.392 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60.3 | 54.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L360 L361 R366 | L360-G364 WeakPolarHBondContact O-CA 3.27Å; L360-G364 PolarHBondContact O-N 3.03Å; L361-G364 PolarHBondContact O-N 3.3Å; G364-R366 VanDerWaalsContact C-N 3.27Å; G364-R366 PolarHBondContact O-N 3.42Å |
| 365 | N | 95 | Very high | 95.7 | Very high | 14 Ų | 14 | 64.3 Ų | 64.3 | 8% | 0.075 | 31% | 0.311 | C | S | . | . | S | Bend | trans | 60.4 | 23.9 | 179.4 | -59.3 | -40.7 | 0 | 0 | 0 | 115.8 | F329 Q335 E338 F339 L342 L360 R367 | F329-N365 WeakPolarHBondContact CE1-ND2 3.47Å; F329-N365 VanDerWaalsContact CZ-ND2 3.26Å; F329-N365 WeakPolarHBondContact CZ-ND2 3.49Å; F329-N365 VanDerWaalsContact CZ-OD1 3.31Å; F329-N365 WeakPolarHBondContact CZ-OD1 3.48Å; Q335-N365 PolarHBondContact O-ND2 2.73Å; Q335-N365 VanDerWaalsContact O-ND2 3.08Å; Q335-N365 PolarHBondContact OE1-ND2 3.22Å; E338-N365 HydrophobicContact CB-CB 4.4Å; F339-N365 WeakPolarHBondContact CA-OD1 3.47Å; F339-N365 WeakPolarHBondContact CB-OD1 3.36Å; L342-N365 HydrophobicContact CD1-CB 4.11Å; L342-N365 WeakPolarHBondContact CD1-O 3.41Å; L360-N365 PolarHBondContact O-N 2.79Å; N365-R367 PolarHBondContact O-N 3.02Å |
| 366 | R | 96.2 | Very high | 95.7 | Very high | 149 Ų | 149 | 64 Ų | 64 | 56% | 0.562 | 33% | 0.325 | S | S | * | . | trans | -81.7 | 99.1 | 172.5 | -65.3 | 172.4 | -173.4 | 169.8 | 4.4 | 111.1 | H363 G364 E368 Q369 A370 | H363-R366 HydrophobicContact CB-CB 4.27Å; H363-R366 VanDerWaalsContact O-CD 3.29Å; H363-R366 WeakPolarHBondContact O-CD 3.32Å; H363-R366 VanDerWaalsContact O-CG 3.23Å; H363-R366 WeakPolarHBondContact O-CG 3.49Å; G364-R366 VanDerWaalsContact C-N 3.27Å; G364-R366 PolarHBondContact O-N 3.42Å; R366-E368 PolarHBondContact O-N 3.46Å; R366-Q369 HydrophobicContact CB-CB 4.31Å; R366-Q369 PolarHBondContact O-N 2.9Å; R366-A370 WeakPolarHBondContact O-CB 3.4Å; R366-A370 PolarHBondContact O-N 3.3Å | ||
| 367 | R | 95.8 | Very high | 95.2 | Very high | 133 Ų | 133 | 67.5 Ų | 67.5 | 50% | 0.502 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -43.2 | -53.4 | -178.7 | -178.8 | 175.3 | 168.6 | 147.2 | -3.1 | 114.7 | L342 F346 N365 A370 L371 | L342-R367 HydrophobicContact CD1-CB 4.44Å; L342-R367 HydrophobicContact CD2-CB 3.69Å; L342-R367 HydrophobicContact CD2-CG 3.77Å; F346-R367 HydrophobicContact CZ-CG 4.24Å; N365-R367 PolarHBondContact O-N 3.02Å; R367-A370 PolarHBondContact O-N 3.08Å; R367-L371 VanDerWaalsContact O-CB 3.3Å; R367-L371 WeakPolarHBondContact O-CB 3.22Å; R367-L371 PolarHBondContact O-N 3.12Å |
| 368 | E | 96.4 | Very high | 94.3 | Very high | 162 Ų | 162 | 69.3 Ų | 69.3 | 76% | 0.757 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -65.8 | -49.8 | -171.8 | -67.2 | 170.3 | 179.6 | 0 | 0 | 111.5 | R366 A370 L371 E372 | R366-E368 PolarHBondContact O-N 3.46Å; E368-A370 VanDerWaalsContact C-N 3.33Å; E368-A370 PolarHBondContact O-N 2.93Å; E368-L371 PolarHBondContact O-N 2.97Å; E368-E372 WeakPolarHBondContact O-CB 3.38Å; E368-E372 PolarHBondContact O-N 3Å |
| 369 | Q | 96.6 | Very high | 92.3 | Very high | 79 Ų | 79 | 75.9 Ų | 75.9 | 37% | 0.369 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.2 | -38.9 | 179 | -66.3 | 173 | 3.4 | 0 | 0 | 111.5 | H363 R366 E373 | H363-Q369 HydrophobicContact CB-CB 4.33Å; R366-Q369 HydrophobicContact CB-CB 4.31Å; R366-Q369 PolarHBondContact O-N 2.9Å; Q369-E373 PolarHBondContact O-N 2.93Å; Q369-E373 VanDerWaalsContact O-N 3.14Å |
| 370 | A | 96.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 79.7 Ų | 79.7 | 0% | 0 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -68.3 | -41.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | F346 V359 L360 R366 R367 E368 L374 | F346-A370 HydrophobicContact CE2-CB 3.86Å; F346-A370 HydrophobicContact CZ-CB 4.31Å; V359-A370 VanDerWaalsContact CG1-CA 3.49Å; V359-A370 HydrophobicContact CG1-CB 3.78Å; V359-A370 WeakPolarHBondContact CG1-O 3.26Å; L360-A370 HydrophobicContact CD2-CB 3.92Å; R366-A370 WeakPolarHBondContact O-CB 3.4Å; R366-A370 PolarHBondContact O-N 3.3Å; R367-A370 PolarHBondContact O-N 3.08Å; E368-A370 VanDerWaalsContact C-N 3.33Å; E368-A370 PolarHBondContact O-N 2.93Å; A370-L374 WeakPolarHBondContact O-CB 3.37Å; A370-L374 VanDerWaalsContact O-CG 3.26Å; A370-L374 WeakPolarHBondContact O-CG 3.33Å; A370-L374 PolarHBondContact O-N 3.31Å |
| 371 | L | 96.2 | Very high | 91.9 | Very high | 43 Ų | 43 | 83.9 Ų | 83.9 | 23% | 0.225 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -68.5 | -38.7 | 177.2 | -176.9 | 59.9 | 0 | 0 | 0 | 111.8 | F346 M349 F351 R367 E368 L374 V375 | F346-L371 HydrophobicContact CD1-CD1 4.28Å; F346-L371 HydrophobicContact CE1-CB 3.98Å; F346-L371 HydrophobicContact CE1-CD1 3.94Å; F346-L371 HydrophobicContact CE1-CG 4.37Å; F346-L371 HydrophobicContact CZ-CB 3.89Å; M349-L371 HydrophobicContact CE-CD1 3.89Å; M349-L371 HydrophobicContact SD-CD1 4.1Å; F351-L371 HydrophobicContact CE2-CD1 3.74Å; F351-L371 HydrophobicContact CZ-CD1 4.02Å; R367-L371 VanDerWaalsContact O-CB 3.3Å; R367-L371 WeakPolarHBondContact O-CB 3.22Å; R367-L371 PolarHBondContact O-N 3.12Å; E368-L371 PolarHBondContact O-N 2.97Å; L371-L374 PolarHBondContact O-N 3.34Å; L371-V375 HydrophobicContact CD1-CG2 4.09Å; L371-V375 HydrophobicContact CG-CG2 4.43Å; L371-V375 WeakPolarHBondContact O-CB 3.29Å; L371-V375 VanDerWaalsContact O-CG2 3.32Å; L371-V375 WeakPolarHBondContact O-CG2 3.23Å; L371-V375 PolarHBondContact O-N 3.39Å |
| 372 | E | 95.8 | Very high | 91.7 | Very high | 144 Ų | 144 | 83.5 Ų | 83.5 | 67% | 0.673 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -59.2 | -47.9 | 175.2 | -174.5 | 176 | -167.3 | 0 | 0 | 111.4 | E368 V375 A376 | E368-E372 WeakPolarHBondContact O-CB 3.38Å; E368-E372 PolarHBondContact O-N 3Å; E372-V375 PolarHBondContact O-N 2.97Å; E372-A376 VanDerWaalsContact O-CB 3.25Å; E372-A376 WeakPolarHBondContact O-CB 3.25Å; E372-A376 PolarHBondContact O-N 2.92Å |
| 373 | E | 96.3 | Very high | 91.5 | Very high | 56 Ų | 56 | 82.1 Ų | 82.1 | 26% | 0.262 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -67.3 | -39.9 | 176.4 | -173.4 | 176.3 | 154.8 | 0 | 0 | 112.6 | R355 V359 H363 Q369 V375 A376 C377 | R355-E373 IonicContact CZ-OE1 3.62Å; R355-E373 IonicContact NH1-OE1 3.03Å; R355-E373 IonicContact NH2-OE1 3.61Å; R355-E373 PolarHBondContact NH2-OE1 3.48Å; V359-E373 HydrophobicContact CG1-CB 3.97Å; V359-E373 HydrophobicContact CG1-CG 4.35Å; V359-E373 HydrophobicContact CG2-CG 4.26Å; H363-E373 IonicContact CD2-OE2 3.44Å; H363-E373 IonicContact CE1-OE2 2.71Å; H363-E373 IonicContact NE2-OE2 2.71Å; H363-E373 PolarHBondContact NE2-OE2 3.5Å; Q369-E373 PolarHBondContact O-N 2.93Å; Q369-E373 VanDerWaalsContact O-N 3.14Å; E373-V375 PolarHBondContact O-N 3.34Å; E373-A376 PolarHBondContact O-N 3.39Å; E373-C377 WeakPolarHBondContact O-CB 3.4Å; E373-C377 PolarHBondContact O-N 3.31Å; E373-C377 PolarHBondContact O-SG 3.25Å; E373-C377 VanDerWaalsContact O-SG 3.39Å |
| 374 | L | 95.6 | Very high | 91.2 | Very high | 4 Ų | 4 | 84.7 Ų | 84.7 | 2% | 0.021 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 176.6 | -77.7 | 170.1 | 0 | 0 | 0 | 112 | F346 F351 R355 I356 V359 A370 L371 A378 | F346-L374 HydrophobicContact CB-CD1 4.25Å; F346-L374 HydrophobicContact CD2-CD1 3.45Å; F346-L374 VanDerWaalsContact CD2-CD1 3.45Å; F346-L374 HydrophobicContact CE2-CD1 3.83Å; F346-L374 HydrophobicContact CG-CD1 3.89Å; F351-L374 HydrophobicContact CB-CD2 4.39Å; F351-L374 HydrophobicContact CD1-CB 4.06Å; F351-L374 HydrophobicContact CD1-CD2 4.44Å; F351-L374 HydrophobicContact CD2-CD1 4.16Å; F351-L374 HydrophobicContact CE1-CB 3.92Å; F351-L374 HydrophobicContact CE2-CB 4.37Å; F351-L374 HydrophobicContact CG-CB 4.36Å; F351-L374 HydrophobicContact CG-CD1 4.32Å; F351-L374 HydrophobicContact CG-CD2 4.41Å; F351-L374 HydrophobicContact CZ-CB 4.09Å; R355-L374 HydrophobicContact CB-CD2 4.29Å; R355-L374 HydrophobicContact CG-CD2 3.74Å; I356-L374 HydrophobicContact CG1-CD1 4.31Å; I356-L374 HydrophobicContact CG1-CD2 4.46Å; V359-L374 HydrophobicContact CB-CD2 4.44Å; V359-L374 HydrophobicContact CB-CG 4.37Å; V359-L374 HydrophobicContact CG1-CG 4.24Å; V359-L374 HydrophobicContact CG2-CD2 4.19Å; V359-L374 HydrophobicContact CG2-CG 4.44Å; A370-L374 WeakPolarHBondContact O-CB 3.37Å; A370-L374 VanDerWaalsContact O-CG 3.26Å; A370-L374 WeakPolarHBondContact O-CG 3.33Å; A370-L374 PolarHBondContact O-N 3.31Å; L371-L374 PolarHBondContact O-N 3.34Å; L374-A378 WeakPolarHBondContact O-CB 3.41Å; L374-A378 PolarHBondContact O-N 3.29Å |
| 375 | V | 94.8 | Very high | 91.1 | Very high | 80 Ų | 80 | 87.8 Ų | 87.8 | 49% | 0.485 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -70.8 | -39.3 | 176.9 | 173.4 | 0 | 0 | 0 | 0 | 111.5 | F351 L371 E372 E373 C377 A378 | F351-V375 HydrophobicContact CE1-CG2 4.43Å; F351-V375 HydrophobicContact CZ-CG2 3.86Å; L371-V375 HydrophobicContact CD1-CG2 4.09Å; L371-V375 HydrophobicContact CG-CG2 4.43Å; L371-V375 WeakPolarHBondContact O-CB 3.29Å; L371-V375 VanDerWaalsContact O-CG2 3.32Å; L371-V375 WeakPolarHBondContact O-CG2 3.23Å; L371-V375 PolarHBondContact O-N 3.39Å; E372-V375 PolarHBondContact O-N 2.97Å; E373-V375 PolarHBondContact O-N 3.34Å; V375-C377 VanDerWaalsContact C-N 3.29Å; V375-C377 PolarHBondContact O-N 2.7Å; V375-A378 PolarHBondContact O-N 2.96Å |
| 376 | A | 93.9 | Very high | 90.8 | Very high | 70 Ų | 70 | 93.1 Ų | 93.1 | 58% | 0.579 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -65.1 | -30.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | E372 E373 | E372-A376 VanDerWaalsContact O-CB 3.25Å; E372-A376 WeakPolarHBondContact O-CB 3.25Å; E372-A376 PolarHBondContact O-N 2.92Å; E373-A376 PolarHBondContact O-N 3.39Å |
| 377 | C | 85.6 | Confident | 90.4 | Very high | 73 Ų | 73 | 88.8 Ų | 88.8 | 49% | 0.493 | 47% | 0.466 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.7 | 3.5 | 178 | -64.9 | 0 | 0 | 0 | 0 | 114.7 | R355 E373 V375 Q379 | R355-C377 PolarHBondContact NH2-SG 2.71Å; E373-C377 WeakPolarHBondContact O-CB 3.4Å; E373-C377 PolarHBondContact O-N 3.31Å; E373-C377 PolarHBondContact O-SG 3.25Å; E373-C377 VanDerWaalsContact O-SG 3.39Å; V375-C377 VanDerWaalsContact C-N 3.29Å; V375-C377 PolarHBondContact O-N 2.7Å; C377-Q379 VanDerWaalsContact C-N 3.34Å; C377-Q379 PolarHBondContact O-N 2.74Å |
| 378 | A | 77.3 | Confident | 90 | Very high | 68 Ų | 68 | 85.1 Ų | 85.1 | 56% | 0.562 | 46% | 0.463 | S | S | * | . | trans | -92.4 | 21.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | F351 L374 V375 | F351-A378 HydrophobicContact CE1-CB 4.43Å; L374-A378 WeakPolarHBondContact O-CB 3.41Å; L374-A378 PolarHBondContact O-N 3.29Å; V375-A378 PolarHBondContact O-N 2.96Å | ||
| 379 | Q | 54.4 | Low | 89.4 | Confident | 242 Ų | 242 | 78.1 Ų | 78.1 | 100% | 1.131 | 44% | 0.436 | S | S | * | . | trans | -110.3 | 0 | -179.2 | -65.8 | -175.6 | 30.8 | 0 | 0 | 112.3 | C377 | C377-Q379 VanDerWaalsContact C-N 3.34Å; C377-Q379 PolarHBondContact O-N 2.74Å |
Retrieved 379 of 379 residues in 117.3 ms
(Link to these results)