| 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 | 43.7 | Very low | 43.2 | Very low | 254 Ų | 254 | 148.5 Ų | 148.5 | 100% | 1.251 | 82% | 0.818 | S | S | * | * | 0 | 114.9 | 0 | -73.3 | 174.4 | 172.7 | 0 | 0 | 106.6 | |||||
| 2 | A | 39.3 | Very low | 42.5 | Very low | 95 Ų | 95 | 147.1 Ų | 147.1 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | -118.7 | 135.4 | -154.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 3 | S | 56.9 | Low | 42.7 | Very low | 131 Ų | 131 | 151.7 Ų | 151.7 | 92% | 0.916 | 82% | 0.816 | S | S | * | * | trans | -157.6 | 112.6 | 143 | -88.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 4 | V | 42.2 | Very low | 42.5 | Very low | 127 Ų | 127 | 152.9 Ų | 152.9 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | trans | -126 | 140.2 | -175.3 | 161 | 0 | 0 | 0 | 0 | 106 | ||||
| 5 | S | 44.4 | Very low | 42.4 | Very low | 99 Ų | 99 | 155.5 Ų | 155.5 | 69% | 0.692 | 82% | 0.819 | S | S | * | * | trans | 72.4 | 145.8 | 158 | -71.6 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 6 | Q | 45.2 | Very low | 42.1 | Very low | 171 Ų | 171 | 150.4 Ų | 150.4 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | cis | -166.7 | 136.6 | 23.7 | -128.2 | 166.5 | -1.5 | 0 | 0 | 105.9 | ||||
| 7 | S | 40.9 | Very low | 42 | Very low | 80 Ų | 80 | 150.8 Ų | 150.8 | 56% | 0.559 | 82% | 0.817 | S | S | * | * | 78.1 | 102.1 | 99.2 | -174.6 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 8 | E | 40.2 | Very low | 42.4 | Very low | 173 Ų | 173 | 148.6 Ų | 148.6 | 81% | 0.808 | 81% | 0.812 | S | S | * | * | 76.6 | 104.3 | 105.4 | -70.9 | 167.5 | 97.8 | 0 | 0 | 114.4 | |||||
| 9 | S | 38.4 | Very low | 43 | Very low | 117 Ų | 117 | 150 Ų | 150 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -162.5 | 92.3 | 131.6 | -109 | 0 | 0 | 0 | 0 | 111.3 | R11 | S9-R11 PolarHBondContact O-N 3.06Š| ||
| 10 | H | 37.3 | Very low | 43.5 | Very low | 168 Ų | 168 | 149 Ų | 149 | 78% | 0.778 | 81% | 0.811 | S | S | * | * | trans | -65.5 | 103.6 | 153.3 | 177.6 | -67.4 | 0 | 0 | 0 | 108.6 | ||||
| 11 | R | 46.3 | Very low | 43.7 | Very low | 218 Ų | 218 | 148.6 Ų | 148.6 | 82% | 0.823 | 81% | 0.807 | S | S | * | * | trans | -146 | 119.7 | 157 | -75.6 | -160.3 | 179.4 | 165.5 | 1.7 | 111.4 | S9 F13 | S9-R11 PolarHBondContact O-N 3.06Å; R11-F13 PolarHBondContact O-N 2.71Å | ||
| 12 | D | 35.8 | Very low | 44.1 | Very low | 132 Ų | 132 | 138.9 Ų | 138.9 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | trans | -34.5 | 118.3 | 165.4 | -55.2 | -88.8 | 0 | 0 | 0 | 113.7 | ||||
| 13 | F | 44.8 | Very low | 44.8 | Very low | 207 Ų | 207 | 143.4 Ų | 143.4 | 91% | 0.908 | 78% | 0.779 | S | S | * | * | trans | -114.3 | 79.5 | 162.3 | -117.3 | -91.9 | 0 | 0 | 0 | 107.6 | R11 | R11-F13 PolarHBondContact O-N 2.71Š| ||
| 14 | Q | 39.5 | Very low | 44.6 | Very low | 169 Ų | 169 | 146.1 Ų | 146.1 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | trans | -74.7 | 146 | 160.2 | -81.8 | -165.8 | 59.3 | 0 | 0 | 109.2 | ||||
| 15 | H | 40.7 | Very low | 44.7 | Very low | 192 Ų | 192 | 142.7 Ų | 142.7 | 89% | 0.889 | 77% | 0.765 | S | S | * | * | S | Bend | trans | 85.9 | 88.4 | 167.4 | -108.9 | 60.9 | 0 | 0 | 0 | 118 | ||
| 16 | G | 37.9 | Very low | 44.8 | Very low | 73 Ų | 73 | 141 Ų | 141 | 75% | 0.753 | 76% | 0.757 | S | S | * | * | trans | 101.7 | 69.1 | 147.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 17 | D | 40.4 | Very low | 45.1 | Very low | 158 Ų | 158 | 138.4 Ų | 138.4 | 85% | 0.845 | 76% | 0.755 | S | S | * | * | trans | -44 | 122.3 | -176.3 | -73.6 | -52.7 | 0 | 0 | 0 | 114.2 | K19 | D17-K19 PolarHBondContact O-N 3.06Š| ||
| 18 | P | 49.5 | Very low | 45.6 | Very low | 111 Ų | 111 | 138.5 Ų | 138.5 | 72% | 0.721 | 76% | 0.761 | S | S | * | * | trans | -71.6 | 121.8 | 175.1 | 28.8 | -30.7 | 0 | 0 | 0 | 109.1 | ||||
| 19 | K | 54.3 | Low | 46.2 | Very low | 175 Ų | 175 | 134.1 Ų | 134.1 | 76% | 0.761 | 75% | 0.749 | S | S | * | * | trans | -47.6 | 132.8 | 172.7 | -77.8 | 167.2 | 179.7 | 159.4 | 0 | 109.7 | D17 L21 | D17-K19 PolarHBondContact O-N 3.06Å; K19-L21 PolarHBondContact O-N 3.03Å | ||
| 20 | P | 52.3 | Low | 47 | Very low | 130 Ų | 130 | 135.4 Ų | 135.4 | 84% | 0.844 | 74% | 0.741 | S | S | * | * | trans | -58.6 | 115.8 | -179.5 | 23 | -32.2 | 0 | 0 | 0 | 109.8 | G22 | P20-G22 PolarHBondContact O-N 2.84Š| ||
| 21 | L | 47.3 | Very low | 48.3 | Very low | 140 Ų | 140 | 131.6 Ų | 131.6 | 73% | 0.733 | 73% | 0.733 | S | S | * | * | trans | -64.1 | 128.4 | 175.9 | -71.4 | 122.5 | 0 | 0 | 0 | 109 | K19 | K19-L21 PolarHBondContact O-N 3.03Š| ||
| 22 | G | 51.8 | Low | 49.5 | Very low | 50 Ų | 50 | 124.8 Ų | 124.8 | 52% | 0.515 | 72% | 0.715 | S | S | . | * | trans | -62.5 | 160.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | P20 F24 G25 | P20-G22 PolarHBondContact O-N 2.84Å; G22-F24 PolarHBondContact O-N 3.43Å; G22-G25 PolarHBondContact O-N 3.27Å | ||
| 23 | M | 55.2 | Low | 51.3 | Low | 191 Ų | 191 | 120.8 Ų | 120.8 | 94% | 0.941 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | -7.7 | -175.6 | -145.8 | 170.6 | 80.8 | 0 | 0 | 115.2 | ||
| 24 | F | 52.5 | Low | 52.9 | Low | 188 Ų | 188 | 113.9 Ų | 113.9 | 83% | 0.825 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.7 | 4.4 | 179.6 | -86.7 | -82.8 | 0 | 0 | 0 | 115.2 | G22 A26 | G22-F24 PolarHBondContact O-N 3.43Å; F24-A26 PolarHBondContact O-N 3.45Å |
| 25 | G | 44.2 | Very low | 55.1 | Low | 55 Ų | 55 | 109.5 Ų | 109.5 | 57% | 0.567 | 65% | 0.654 | S | S | * | * | trans | 61.4 | 6.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | G22 | G22-G25 PolarHBondContact O-N 3.27Š| ||
| 26 | A | 46.9 | Very low | 57.1 | Low | 63 Ų | 63 | 105.7 Ų | 105.7 | 52% | 0.521 | 64% | 0.64 | S | S | . | * | trans | -87.8 | 143.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | F24 A28 | F24-A26 PolarHBondContact O-N 3.45Å; A26-A28 PolarHBondContact O-N 3.41Å | ||
| 27 | P | 50.2 | Low | 59.2 | Low | 116 Ų | 116 | 102.7 Ų | 102.7 | 75% | 0.753 | 61% | 0.608 | S | S | * | * | trans | -54.8 | 134.2 | 173.6 | 23.9 | -32.7 | 0 | 0 | 0 | 108.9 | C29 | P27-C29 VanDerWaalsContact C-N 3.33Å; P27-C29 PolarHBondContact O-N 3.47Å | ||
| 28 | A | 51.8 | Low | 61.3 | Low | 83 Ų | 83 | 99.4 Ų | 99.4 | 69% | 0.686 | 59% | 0.59 | S | S | * | * | trans | -54.8 | 97.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | A26 H30 | A26-A28 PolarHBondContact O-N 3.41Å; A28-H30 PolarHBondContact O-N 3.07Å | ||
| 29 | C | 52.6 | Low | 63.2 | Low | 81 Ų | 81 | 97.5 Ų | 97.5 | 55% | 0.547 | 58% | 0.578 | S | S | . | * | trans | -59.7 | 111 | 170.5 | -83.4 | 0 | 0 | 0 | 0 | 105.7 | P27 C31 T32 | P27-C29 VanDerWaalsContact C-N 3.33Å; P27-C29 PolarHBondContact O-N 3.47Å; C29-C31 PolarHBondContact O-N 3.27Å; C29-T32 HydrophobicContact CB-CG2 3.84Å; C29-T32 WeakPolarHBondContact O-CB 3.19Å; C29-T32 WeakPolarHBondContact O-CG2 3.44Å; C29-T32 PolarHBondContact O-N 3.33Å; C29-T32 PolarHBondContact O-OG1 3.3Å | ||
| 30 | H | 56.8 | Low | 64.7 | Low | 144 Ų | 144 | 91.8 Ų | 91.8 | 67% | 0.667 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.3 | -16.1 | -176.8 | -81.8 | -74.4 | 0 | 0 | 0 | 114.1 | A28 | A28-H30 PolarHBondContact O-N 3.07Š|
| 31 | C | 63 | Low | 66.4 | Low | 88 Ų | 88 | 87.1 Ų | 87.1 | 60% | 0.595 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -74.2 | -24 | 173.9 | -50.4 | 0 | 0 | 0 | 0 | 113.5 | C29 S33 I34 V35 | C29-C31 PolarHBondContact O-N 3.27Å; C31-S33 PolarHBondContact O-N 3.11Å; C31-I34 PolarHBondContact O-N 3.44Å; C31-V35 WeakPolarHBondContact O-CB 3.36Å; C31-V35 WeakPolarHBondContact O-CG2 3.39Å; C31-V35 PolarHBondContact O-N 3.43Å |
| 32 | T | 71.6 | Confident | 68.4 | Low | 74 Ų | 74 | 85.3 Ų | 85.3 | 45% | 0.454 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.9 | -42.8 | -172.2 | 56.9 | 0 | 0 | 0 | 0 | 112.1 | C29 I34 V35 L36 | C29-T32 HydrophobicContact CB-CG2 3.84Å; C29-T32 WeakPolarHBondContact O-CB 3.19Å; C29-T32 WeakPolarHBondContact O-CG2 3.44Å; C29-T32 PolarHBondContact O-N 3.33Å; C29-T32 PolarHBondContact O-OG1 3.3Å; T32-I34 VanDerWaalsContact C-N 3.34Å; T32-I34 PolarHBondContact O-N 3.08Å; T32-V35 PolarHBondContact O-N 3.48Å; T32-L36 VanDerWaalsContact O-CB 3.27Å; T32-L36 WeakPolarHBondContact O-CB 3.42Å; T32-L36 WeakPolarHBondContact O-CG 3.44Å; T32-L36 PolarHBondContact O-N 3.13Å |
| 33 | S | 73.9 | Confident | 70.2 | Confident | 48 Ų | 48 | 85.6 Ų | 85.6 | 34% | 0.336 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.7 | -44.6 | 179 | 176.7 | 0 | 0 | 0 | 0 | 112 | C31 L36 A37 D89 | C31-S33 PolarHBondContact O-N 3.11Å; S33-L36 PolarHBondContact O-N 3.13Å; S33-A37 WeakPolarHBondContact O-CB 3.29Å; S33-A37 PolarHBondContact O-N 3.46Å; S33-D89 WeakPolarHBondContact CB-OD2 3.28Å; S33-D89 PolarHBondContact OG-OD2 3.24Å |
| 34 | I | 78.8 | Confident | 71.8 | Confident | 62 Ų | 62 | 76.5 Ų | 76.5 | 32% | 0.318 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.4 | -46.1 | 178.2 | -67.1 | 169.4 | 0 | 0 | 0 | 110.7 | C31 T32 L36 A37 L38 F86 | C31-I34 PolarHBondContact O-N 3.44Å; T32-I34 VanDerWaalsContact C-N 3.34Å; T32-I34 PolarHBondContact O-N 3.08Å; I34-L36 VanDerWaalsContact C-N 3.32Å; I34-L36 PolarHBondContact O-N 3.31Å; I34-A37 PolarHBondContact O-N 3.12Å; I34-L38 HydrophobicContact CG2-CD1 3.95Å; I34-L38 HydrophobicContact CG2-CG 4.38Å; I34-L38 WeakPolarHBondContact O-CB 3.5Å; I34-L38 WeakPolarHBondContact O-CG 3.48Å; I34-L38 PolarHBondContact O-N 3.14Å; I34-F86 HydrophobicContact CB-CE2 4.25Å; I34-F86 HydrophobicContact CG1-CD2 4.3Å; I34-F86 HydrophobicContact CG1-CE2 3.91Å; I34-F86 HydrophobicContact CG2-CD2 4.34Å; I34-F86 HydrophobicContact CG2-CE2 3.73Å |
| 35 | V | 84.9 | Confident | 73.6 | Confident | 78 Ų | 78 | 72.4 Ų | 72.4 | 47% | 0.473 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.9 | -42.5 | 179.1 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | C31 T32 L38 C39 | C31-V35 WeakPolarHBondContact O-CB 3.36Å; C31-V35 WeakPolarHBondContact O-CG2 3.39Å; C31-V35 PolarHBondContact O-N 3.43Å; T32-V35 PolarHBondContact O-N 3.48Å; V35-L38 PolarHBondContact O-N 3.1Å; V35-C39 WeakPolarHBondContact O-CB 3.5Å; V35-C39 PolarHBondContact O-N 3.33Å; V35-C39 PolarHBondContact O-SG 3.49Å |
| 36 | L | 83.1 | Confident | 75.9 | Confident | 111 Ų | 111 | 75.9 Ų | 75.9 | 58% | 0.581 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -63.7 | -45 | 176.4 | -72.2 | 172.6 | 0 | 0 | 0 | 111.4 | T32 S33 I34 L38 C39 V40 | T32-L36 VanDerWaalsContact O-CB 3.27Å; T32-L36 WeakPolarHBondContact O-CB 3.42Å; T32-L36 WeakPolarHBondContact O-CG 3.44Å; T32-L36 PolarHBondContact O-N 3.13Å; S33-L36 PolarHBondContact O-N 3.13Å; I34-L36 VanDerWaalsContact C-N 3.32Å; I34-L36 PolarHBondContact O-N 3.31Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.32Å; L36-C39 PolarHBondContact O-N 2.96Å; L36-V40 WeakPolarHBondContact O-CB 3.2Å; L36-V40 VanDerWaalsContact O-CG2 3.25Å; L36-V40 WeakPolarHBondContact O-CG2 3.15Å; L36-V40 PolarHBondContact O-N 3.29Å |
| 37 | A | 82.7 | Confident | 78 | Confident | 11 Ų | 11 | 75.7 Ų | 75.7 | 9% | 0.091 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -61.3 | -41.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | S33 I34 V40 S41 F86 | S33-A37 WeakPolarHBondContact O-CB 3.29Å; S33-A37 PolarHBondContact O-N 3.46Å; I34-A37 PolarHBondContact O-N 3.12Å; A37-V40 PolarHBondContact O-N 3.3Å; A37-S41 WeakPolarHBondContact O-CB 3.08Å; A37-S41 PolarHBondContact O-N 3.41Å; A37-S41 PolarHBondContact O-OG 3.01Å; A37-F86 HydrophobicContact CB-CB 3.95Å; A37-F86 HydrophobicContact CB-CD2 4.26Å |
| 38 | L | 85.2 | Confident | 79.9 | Confident | 89 Ų | 89 | 70.9 Ų | 70.9 | 47% | 0.466 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.6 | -47.4 | 174.9 | -72.9 | 174.2 | 0 | 0 | 0 | 111.6 | I34 V35 L36 V40 S41 L42 | I34-L38 HydrophobicContact CG2-CD1 3.95Å; I34-L38 HydrophobicContact CG2-CG 4.38Å; I34-L38 WeakPolarHBondContact O-CB 3.5Å; I34-L38 WeakPolarHBondContact O-CG 3.48Å; I34-L38 PolarHBondContact O-N 3.14Å; V35-L38 PolarHBondContact O-N 3.1Å; L36-L38 VanDerWaalsContact C-N 3.32Å; L36-L38 PolarHBondContact O-N 3.32Å; L38-V40 VanDerWaalsContact C-N 3.31Å; L38-V40 PolarHBondContact O-N 3.43Å; L38-S41 WeakPolarHBondContact CA-OG 3.49Å; L38-S41 PolarHBondContact O-N 3.13Å; L38-S41 VanDerWaalsContact O-N 3.16Å; L38-S41 PolarHBondContact O-OG 2.62Å; L38-L42 WeakPolarHBondContact O-CB 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.4Å; L38-L42 PolarHBondContact O-N 3.4Å |
| 39 | C | 87.8 | Confident | 81.7 | Confident | 70 Ų | 70 | 68.6 Ų | 68.6 | 47% | 0.473 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.3 | -42.8 | 176.8 | -73.1 | 0 | 0 | 0 | 0 | 112 | V35 L36 L42 S43 | V35-C39 WeakPolarHBondContact O-CB 3.5Å; V35-C39 PolarHBondContact O-N 3.33Å; V35-C39 PolarHBondContact O-SG 3.49Å; L36-C39 PolarHBondContact O-N 2.96Å; C39-L42 PolarHBondContact O-N 2.88Å; C39-S43 WeakPolarHBondContact O-CB 3.03Å; C39-S43 PolarHBondContact O-N 3.3Å; C39-S43 PolarHBondContact O-OG 3.13Å |
| 40 | V | 87.1 | Confident | 83.4 | Confident | 56 Ų | 56 | 68.4 Ų | 68.4 | 34% | 0.339 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -67.2 | -39.2 | 176.5 | 173.1 | 0 | 0 | 0 | 0 | 111.4 | L36 A37 L38 S43 G44 M78 | L36-V40 WeakPolarHBondContact O-CB 3.2Å; L36-V40 VanDerWaalsContact O-CG2 3.25Å; L36-V40 WeakPolarHBondContact O-CG2 3.15Å; L36-V40 PolarHBondContact O-N 3.29Å; A37-V40 PolarHBondContact O-N 3.3Å; L38-V40 VanDerWaalsContact C-N 3.31Å; L38-V40 PolarHBondContact O-N 3.43Å; V40-S43 WeakPolarHBondContact CA-OG 3.43Å; V40-S43 PolarHBondContact O-OG 3.04Å; V40-G44 PolarHBondContact O-N 3.1Å; V40-M78 HydrophobicContact CG1-CE 4.32Å |
| 41 | S | 86.5 | Confident | 84.9 | Confident | 32 Ų | 32 | 61.6 Ų | 61.6 | 22% | 0.224 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -67 | -40 | 176.5 | 72.4 | 0 | 0 | 0 | 0 | 112.4 | A37 L38 G44 L45 | A37-S41 WeakPolarHBondContact O-CB 3.08Å; A37-S41 PolarHBondContact O-N 3.41Å; A37-S41 PolarHBondContact O-OG 3.01Å; L38-S41 WeakPolarHBondContact CA-OG 3.49Å; L38-S41 PolarHBondContact O-N 3.13Å; L38-S41 VanDerWaalsContact O-N 3.16Å; L38-S41 PolarHBondContact O-OG 2.62Å; S41-G44 PolarHBondContact O-N 3.37Å; S41-L45 PolarHBondContact O-N 3.02Å |
| 42 | L | 89.6 | Confident | 86 | Confident | 101 Ų | 101 | 59.7 Ų | 59.7 | 53% | 0.529 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -68.8 | -40.7 | 177.6 | -72.1 | 172.7 | 0 | 0 | 0 | 111.5 | L38 C39 L45 M46 | L38-L42 WeakPolarHBondContact O-CB 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.4Å; L38-L42 PolarHBondContact O-N 3.4Å; C39-L42 PolarHBondContact O-N 2.88Å; L42-L45 PolarHBondContact O-N 2.87Å; L42-M46 WeakPolarHBondContact O-CG 3.44Å; L42-M46 PolarHBondContact O-N 3.21Å |
| 43 | S | 90 | Very high | 86.9 | Confident | 57 Ų | 57 | 59.8 Ų | 59.8 | 40% | 0.399 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -65.5 | -40.1 | 174.7 | 66.3 | 0 | 0 | 0 | 0 | 111.5 | C39 V40 L45 M46 L47 | C39-S43 WeakPolarHBondContact O-CB 3.03Å; C39-S43 PolarHBondContact O-N 3.3Å; C39-S43 PolarHBondContact O-OG 3.13Å; V40-S43 WeakPolarHBondContact CA-OG 3.43Å; V40-S43 PolarHBondContact O-OG 3.04Å; S43-L45 PolarHBondContact O-N 3.13Å; S43-M46 PolarHBondContact O-N 2.87Å; S43-L47 WeakPolarHBondContact O-CB 3.19Å; S43-L47 PolarHBondContact O-N 2.79Å |
| 44 | G | 89.3 | Confident | 87.4 | Confident | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -60.9 | -40.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113 | V40 S41 L47 A48 G75 | V40-G44 PolarHBondContact O-N 3.1Å; S41-G44 PolarHBondContact O-N 3.37Å; G44-L47 PolarHBondContact O-N 3.46Å; G44-A48 WeakPolarHBondContact O-CB 3.26Å; G44-A48 PolarHBondContact O-N 2.91Å; G44-G75 WeakPolarHBondContact O-CA 3.3Å |
| 45 | L | 90 | Very high | 87.7 | Confident | 101 Ų | 101 | 58 Ų | 58 | 53% | 0.529 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.9 | -44.2 | 175.9 | -167.1 | 95.4 | 0 | 0 | 0 | 111.8 | S41 L42 S43 L47 A48 G49 I79 | S41-L45 PolarHBondContact O-N 3.02Å; L42-L45 PolarHBondContact O-N 2.87Å; S43-L45 PolarHBondContact O-N 3.13Å; L45-L47 VanDerWaalsContact C-N 3.3Å; L45-L47 PolarHBondContact O-N 3.11Å; L45-A48 PolarHBondContact O-N 3.38Å; L45-G49 PolarHBondContact O-N 2.93Å; L45-I79 HydrophobicContact CB-CD1 4.4Å; L45-I79 HydrophobicContact CD1-CD1 4.43Å |
| 46 | M | 92.4 | Very high | 87.6 | Confident | 129 Ų | 129 | 56.7 Ų | 56.7 | 64% | 0.635 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -62.6 | -39.9 | 176.1 | -69.4 | -65.9 | 162.4 | 0 | 0 | 111.3 | L42 S43 T50 | L42-M46 WeakPolarHBondContact O-CG 3.44Å; L42-M46 PolarHBondContact O-N 3.21Å; S43-M46 PolarHBondContact O-N 2.87Å; M46-T50 WeakPolarHBondContact O-CB 3.2Å; M46-T50 PolarHBondContact O-N 3.43Å; M46-T50 PolarHBondContact O-OG1 3.29Å |
| 47 | L | 90 | Very high | 87.5 | Confident | 59 Ų | 59 | 60.2 Ų | 60.2 | 31% | 0.309 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66.6 | -44.3 | 176.5 | -154.7 | 81.3 | 0 | 0 | 0 | 111.6 | S43 G44 L45 T50 G51 L71 I74 | S43-L47 WeakPolarHBondContact O-CB 3.19Å; S43-L47 PolarHBondContact O-N 2.79Å; G44-L47 PolarHBondContact O-N 3.46Å; L45-L47 VanDerWaalsContact C-N 3.3Å; L45-L47 PolarHBondContact O-N 3.11Å; L47-T50 PolarHBondContact O-N 3.44Å; L47-G51 PolarHBondContact O-N 3.42Å; L47-L71 HydrophobicContact CD2-CD2 4.47Å; L47-L71 HydrophobicContact CG-CD2 4.41Å; L47-I74 HydrophobicContact CD2-CB 4.29Å; L47-I74 HydrophobicContact CD2-CG2 3.85Å |
| 48 | A | 90 | Very high | 87.2 | Confident | 15 Ų | 15 | 63.1 Ų | 63.1 | 12% | 0.124 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.3 | -42.2 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | G44 L45 G51 A52 | G44-A48 WeakPolarHBondContact O-CB 3.26Å; G44-A48 PolarHBondContact O-N 2.91Å; L45-A48 PolarHBondContact O-N 3.38Å; A48-G51 PolarHBondContact O-N 3.5Å; A48-A52 WeakPolarHBondContact O-CB 3.49Å; A48-A52 PolarHBondContact O-N 2.77Å |
| 49 | G | 90.6 | Very high | 86.7 | Confident | 35 Ų | 35 | 68 Ų | 68 | 36% | 0.361 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.2 | -43.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L45 G51 A52 C53 | L45-G49 PolarHBondContact O-N 2.93Å; G49-G51 PolarHBondContact O-N 3.44Å; G49-A52 PolarHBondContact O-N 3.3Å; G49-C53 WeakPolarHBondContact O-CB 3.44Å; G49-C53 PolarHBondContact O-N 2.79Å; G49-C53 PolarHBondContact O-SG 3.01Å |
| 50 | T | 89.2 | Confident | 86.1 | Confident | 77 Ų | 77 | 73.6 Ų | 73.6 | 47% | 0.472 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.3 | -44.5 | 175.3 | -54.4 | 0 | 0 | 0 | 0 | 111.2 | M46 L47 A52 C53 I54 | M46-T50 WeakPolarHBondContact O-CB 3.2Å; M46-T50 PolarHBondContact O-N 3.43Å; M46-T50 PolarHBondContact O-OG1 3.29Å; L47-T50 PolarHBondContact O-N 3.44Å; T50-A52 PolarHBondContact O-N 3.03Å; T50-C53 PolarHBondContact O-N 3.1Å; T50-I54 HydrophobicContact CG2-CD1 3.97Å; T50-I54 VanDerWaalsContact O-CG1 3.24Å; T50-I54 WeakPolarHBondContact O-CG1 3.41Å; T50-I54 PolarHBondContact O-N 2.93Å |
| 51 | G | 87 | Confident | 85.5 | Confident | 0 Ų | 0 | 75.8 Ų | 75.8 | 0% | 0 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -59.4 | -43.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L47 A48 G49 I54 C55 | L47-G51 PolarHBondContact O-N 3.42Å; A48-G51 PolarHBondContact O-N 3.5Å; G49-G51 PolarHBondContact O-N 3.44Å; G51-I54 PolarHBondContact O-N 3.32Å; G51-C55 PolarHBondContact O-N 3.42Å; G51-C55 PolarHBondContact O-SG 2.82Å; G51-C55 VanDerWaalsContact O-SG 3.34Å |
| 52 | A | 87.5 | Confident | 84.6 | Confident | 49 Ų | 49 | 81 Ų | 81 | 41% | 0.405 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A48 G49 T50 C55 G56 | A48-A52 WeakPolarHBondContact O-CB 3.49Å; A48-A52 PolarHBondContact O-N 2.77Å; G49-A52 PolarHBondContact O-N 3.3Å; T50-A52 PolarHBondContact O-N 3.03Å; A52-C55 PolarHBondContact O-N 2.87Å; A52-G56 PolarHBondContact O-N 2.95Å |
| 53 | C | 88.6 | Confident | 83.9 | Confident | 75 Ų | 75 | 81.3 Ų | 81.3 | 51% | 0.507 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -60.8 | -45.5 | 174.5 | -70.6 | 0 | 0 | 0 | 0 | 111.4 | G49 T50 C55 G56 F57 | G49-C53 WeakPolarHBondContact O-CB 3.44Å; G49-C53 PolarHBondContact O-N 2.79Å; G49-C53 PolarHBondContact O-SG 3.01Å; T50-C53 PolarHBondContact O-N 3.1Å; C53-C55 PolarHBondContact O-N 3.27Å; C53-G56 PolarHBondContact O-N 2.92Å; C53-F57 WeakPolarHBondContact O-CD2 3.36Å; C53-F57 PolarHBondContact O-N 3.33Å |
| 54 | I | 85.3 | Confident | 83.4 | Confident | 45 Ų | 45 | 79.4 Ų | 79.4 | 23% | 0.231 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -61.2 | -44.3 | 177 | -67.5 | 165.8 | 0 | 0 | 0 | 110.5 | T50 G51 G56 L58 L71 | T50-I54 HydrophobicContact CG2-CD1 3.97Å; T50-I54 VanDerWaalsContact O-CG1 3.24Å; T50-I54 WeakPolarHBondContact O-CG1 3.41Å; T50-I54 PolarHBondContact O-N 2.93Å; G51-I54 PolarHBondContact O-N 3.32Å; I54-G56 VanDerWaalsContact C-N 3.32Å; I54-G56 PolarHBondContact O-N 2.74Å; I54-L58 HydrophobicContact CG2-CD1 3.95Å; I54-L58 WeakPolarHBondContact O-CD1 3.37Å; I54-L58 PolarHBondContact O-N 3.32Å; I54-L71 HydrophobicContact CD1-CD1 3.86Å |
| 55 | C | 84.7 | Confident | 82.9 | Confident | 29 Ų | 29 | 82 Ų | 82 | 20% | 0.196 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -61.2 | -37.9 | 175.7 | -73.9 | 0 | 0 | 0 | 0 | 113.2 | G51 A52 C53 G68 | G51-C55 PolarHBondContact O-N 3.42Å; G51-C55 PolarHBondContact O-SG 2.82Å; G51-C55 VanDerWaalsContact O-SG 3.34Å; A52-C55 PolarHBondContact O-N 2.87Å; C53-C55 PolarHBondContact O-N 3.27Å; C55-G68 WeakPolarHBondContact SG-CA 3.48Å |
| 56 | G | 83.6 | Confident | 82.6 | Confident | 50 Ų | 50 | 83.3 Ų | 83.3 | 52% | 0.515 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -74.2 | -45 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | A52 C53 I54 | A52-G56 PolarHBondContact O-N 2.95Å; C53-G56 PolarHBondContact O-N 2.92Å; I54-G56 VanDerWaalsContact C-N 3.32Å; I54-G56 PolarHBondContact O-N 2.74Å |
| 57 | F | 80.9 | Confident | 82.3 | Confident | 184 Ų | 184 | 82.2 Ų | 82.2 | 81% | 0.807 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -71.7 | -37.2 | -179.3 | -87.1 | -78.3 | 0 | 0 | 0 | 112.8 | C53 W59 | C53-F57 WeakPolarHBondContact O-CD2 3.36Å; C53-F57 PolarHBondContact O-N 3.33Å; F57-W59 VanDerWaalsContact C-N 3.32Å; F57-W59 PolarHBondContact O-N 3.03Å |
| 58 | L | 76.9 | Confident | 82.1 | Confident | 73 Ų | 73 | 79.4 Ų | 79.4 | 38% | 0.382 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | 40.3 | -177.9 | -62.9 | 94.6 | 0 | 0 | 0 | 112.8 | I54 H60 D61 P64 | I54-L58 HydrophobicContact CG2-CD1 3.95Å; I54-L58 WeakPolarHBondContact O-CD1 3.37Å; I54-L58 PolarHBondContact O-N 3.32Å; L58-H60 PolarHBondContact O-N 2.78Å; L58-D61 PolarHBondContact O-N 2.96Å; L58-P64 HydrophobicContact CB-CB 3.77Å; L58-P64 HydrophobicContact CB-CG 3.31Å; L58-P64 HydrophobicContact CD1-CB 4.47Å; L58-P64 HydrophobicContact CD2-CB 3.53Å; L58-P64 HydrophobicContact CD2-CG 3.46Å; L58-P64 VanDerWaalsContact CD2-CG 3.46Å; L58-P64 HydrophobicContact CG-CB 4.11Å; L58-P64 HydrophobicContact CG-CG 3.96Å |
| 59 | W | 73.5 | Confident | 82 | Confident | 191 Ų | 191 | 83.9 Ų | 83.9 | 72% | 0.723 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.5 | -29.7 | 178.1 | -170 | -91.3 | 0 | 0 | 0 | 113.3 | F57 K65 | F57-W59 VanDerWaalsContact C-N 3.32Å; F57-W59 PolarHBondContact O-N 3.03Å; W59-K65 WeakPolarHBondContact O-CE 3.45Å; W59-K65 PolarHBondContact O-NZ 3.19Å |
| 60 | H | 75.8 | Confident | 81.9 | Confident | 187 Ų | 187 | 84.5 Ų | 84.5 | 87% | 0.866 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | -24.6 | -175.3 | -105.4 | -82.4 | 0 | 0 | 0 | 114.7 | L58 | L58-H60 PolarHBondContact O-N 2.78Š|
| 61 | D | 75 | Confident | 81.9 | Confident | 102 Ų | 102 | 82.9 Ų | 82.9 | 55% | 0.545 | 44% | 0.443 | S | S | . | . | trans | -110.8 | 138 | -175.3 | -112.2 | -47.4 | 0 | 0 | 0 | 111.2 | L58 P64 K65 | L58-D61 PolarHBondContact O-N 2.96Å; D61-P64 HydrophobicContact CB-CG 3.89Å; D61-P64 WeakPolarHBondContact O-CD 3.29Å; D61-K65 WeakPolarHBondContact O-CE 3.26Å | ||
| 62 | M | 67.7 | Low | 82 | Confident | 141 Ų | 141 | 86.6 Ų | 86.6 | 70% | 0.695 | 46% | 0.461 | S | S | * | . | S | Bend | trans | -79.5 | -30.1 | -175.6 | -70.6 | -65.3 | -167.5 | 0 | 0 | 113.3 | K65 | M62-K65 HydrophobicContact SD-CD 4.11Š|
| 63 | T | 74.3 | Confident | 82.2 | Confident | 109 Ų | 109 | 86.2 Ų | 86.2 | 67% | 0.669 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.2 | -44.6 | -178.3 | 40.8 | 0 | 0 | 0 | 0 | 115 | K65 | T63-K65 VanDerWaalsContact C-N 3.31Å; T63-K65 PolarHBondContact O-N 2.86Å |
| 64 | P | 78.6 | Confident | 82.3 | Confident | 17 Ų | 17 | 86.7 Ų | 86.7 | 11% | 0.11 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -75.5 | -16.7 | -179.5 | 30 | -37.2 | 0 | 0 | 0 | 113.7 | L58 D61 I66 L67 G68 | L58-P64 HydrophobicContact CB-CB 3.77Å; L58-P64 HydrophobicContact CB-CG 3.31Å; L58-P64 HydrophobicContact CD1-CB 4.47Å; L58-P64 HydrophobicContact CD2-CB 3.53Å; L58-P64 HydrophobicContact CD2-CG 3.46Å; L58-P64 VanDerWaalsContact CD2-CG 3.46Å; L58-P64 HydrophobicContact CG-CB 4.11Å; L58-P64 HydrophobicContact CG-CG 3.96Å; D61-P64 HydrophobicContact CB-CG 3.89Å; D61-P64 WeakPolarHBondContact O-CD 3.29Å; P64-I66 VanDerWaalsContact C-N 3.31Å; P64-I66 PolarHBondContact O-N 3.3Å; P64-L67 PolarHBondContact O-N 3.31Å; P64-G68 PolarHBondContact O-N 3.28Å |
| 65 | K | 79.1 | Confident | 82.6 | Confident | 54 Ų | 54 | 84.5 Ų | 84.5 | 24% | 0.235 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -61.5 | -42.3 | 176.3 | -68.3 | 178.1 | -177.6 | 172 | 0 | 111.4 | W59 D61 M62 T63 L67 G68 L69 | W59-K65 WeakPolarHBondContact O-CE 3.45Å; W59-K65 PolarHBondContact O-NZ 3.19Å; D61-K65 WeakPolarHBondContact O-CE 3.26Å; M62-K65 HydrophobicContact SD-CD 4.11Å; T63-K65 VanDerWaalsContact C-N 3.31Å; T63-K65 PolarHBondContact O-N 2.86Å; K65-L67 VanDerWaalsContact C-N 3.33Å; K65-G68 PolarHBondContact O-N 3.17Å; K65-L69 WeakPolarHBondContact O-CB 3.42Å; K65-L69 VanDerWaalsContact O-CG 3.26Å; K65-L69 WeakPolarHBondContact O-CG 3.33Å; K65-L69 PolarHBondContact O-N 2.96Å |
| 66 | I | 84.1 | Confident | 82.9 | Confident | 128 Ų | 128 | 87 Ų | 87 | 66% | 0.656 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -65.1 | -42.8 | 179.1 | -60.7 | 161 | 0 | 0 | 0 | 109.8 | P64 L69 A70 | P64-I66 VanDerWaalsContact C-N 3.31Å; P64-I66 PolarHBondContact O-N 3.3Å; I66-L69 PolarHBondContact O-N 3.42Å; I66-A70 VanDerWaalsContact O-CB 3.3Å; I66-A70 WeakPolarHBondContact O-CB 3.38Å; I66-A70 PolarHBondContact O-N 3.5Å |
| 67 | L | 85.7 | Confident | 83.2 | Confident | 106 Ų | 106 | 87.3 Ų | 87.3 | 56% | 0.555 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -64.4 | -45.7 | 178.7 | -174 | 66.5 | 0 | 0 | 0 | 111.6 | P64 K65 A70 L71 | P64-L67 PolarHBondContact O-N 3.31Å; K65-L67 VanDerWaalsContact C-N 3.33Å; L67-A70 PolarHBondContact O-N 2.75Å; L67-L71 HydrophobicContact CG-CD1 4.47Å; L67-L71 WeakPolarHBondContact O-CG 3.34Å; L67-L71 PolarHBondContact O-N 3.45Å |
| 68 | G | 87 | Confident | 83.6 | Confident | 0 Ų | 0 | 81.8 Ų | 81.8 | 0% | 0 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -65.3 | -40.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | C55 P64 K65 L71 M72 | C55-G68 WeakPolarHBondContact SG-CA 3.48Å; P64-G68 PolarHBondContact O-N 3.28Å; K65-G68 PolarHBondContact O-N 3.17Å; G68-L71 PolarHBondContact O-N 3.17Å; G68-M72 WeakPolarHBondContact O-CB 3.46Å; G68-M72 PolarHBondContact O-N 3.1Å |
| 69 | L | 86.5 | Confident | 84.2 | Confident | 109 Ų | 109 | 80.4 Ų | 80.4 | 57% | 0.571 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -64.6 | -39.8 | 173.6 | -74.1 | 174.3 | 0 | 0 | 0 | 112.2 | K65 I66 M72 G73 | K65-L69 WeakPolarHBondContact O-CB 3.42Å; K65-L69 VanDerWaalsContact O-CG 3.26Å; K65-L69 WeakPolarHBondContact O-CG 3.33Å; K65-L69 PolarHBondContact O-N 2.96Å; I66-L69 PolarHBondContact O-N 3.42Å; L69-M72 PolarHBondContact O-N 3.46Å; L69-G73 PolarHBondContact O-N 3.47Å |
| 70 | A | 89.9 | Confident | 85.1 | Confident | 49 Ų | 49 | 76.7 Ų | 76.7 | 41% | 0.405 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.8 | -45.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | I66 L67 M72 G73 I74 | I66-A70 VanDerWaalsContact O-CB 3.3Å; I66-A70 WeakPolarHBondContact O-CB 3.38Å; I66-A70 PolarHBondContact O-N 3.5Å; L67-A70 PolarHBondContact O-N 2.75Å; A70-M72 VanDerWaalsContact C-N 3.35Å; A70-M72 PolarHBondContact O-N 3.06Å; A70-G73 PolarHBondContact O-N 2.94Å; A70-I74 WeakPolarHBondContact O-CD1 3.49Å; A70-I74 VanDerWaalsContact O-CG1 3.24Å; A70-I74 WeakPolarHBondContact O-CG1 3.21Å; A70-I74 PolarHBondContact O-N 3.28Å |
| 71 | L | 88.8 | Confident | 85.7 | Confident | 43 Ų | 43 | 71.7 Ų | 71.7 | 23% | 0.225 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -63.4 | -40.1 | 176.1 | -72.7 | 173.9 | 0 | 0 | 0 | 112.3 | L47 I54 L67 G68 I74 G75 | L47-L71 HydrophobicContact CD2-CD2 4.47Å; L47-L71 HydrophobicContact CG-CD2 4.41Å; I54-L71 HydrophobicContact CD1-CD1 3.86Å; L67-L71 HydrophobicContact CG-CD1 4.47Å; L67-L71 WeakPolarHBondContact O-CG 3.34Å; L67-L71 PolarHBondContact O-N 3.45Å; G68-L71 PolarHBondContact O-N 3.17Å; L71-I74 PolarHBondContact O-N 3.45Å; L71-G75 PolarHBondContact O-N 3.41Å |
| 72 | M | 89.3 | Confident | 86.2 | Confident | 77 Ų | 77 | 67.1 Ų | 67.1 | 38% | 0.379 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.6 | -44.3 | 174.9 | -173 | -180 | 176 | 0 | 0 | 111.3 | G68 L69 A70 G75 L76 | G68-M72 WeakPolarHBondContact O-CB 3.46Å; G68-M72 PolarHBondContact O-N 3.1Å; L69-M72 PolarHBondContact O-N 3.46Å; A70-M72 VanDerWaalsContact C-N 3.35Å; A70-M72 PolarHBondContact O-N 3.06Å; M72-G75 PolarHBondContact O-N 3.32Å; M72-L76 HydrophobicContact CE-CD1 4.3Å; M72-L76 HydrophobicContact CG-CD1 4.29Å; M72-L76 WeakPolarHBondContact O-CB 3.37Å; M72-L76 WeakPolarHBondContact O-CG 3.15Å; M72-L76 PolarHBondContact O-N 2.77Å |
| 73 | G | 91.2 | Very high | 87.1 | Confident | 41 Ų | 41 | 65.9 Ų | 65.9 | 42% | 0.423 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.4 | -42.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L69 A70 S77 | L69-G73 PolarHBondContact O-N 3.47Å; A70-G73 PolarHBondContact O-N 2.94Å; G73-S77 WeakPolarHBondContact O-CB 3.41Å; G73-S77 PolarHBondContact O-N 3.2Å; G73-S77 PolarHBondContact O-OG 3.31Å |
| 74 | I | 91.4 | Very high | 87.7 | Confident | 85 Ų | 85 | 65 Ų | 65 | 44% | 0.436 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66.5 | -43.4 | 175.6 | -64.9 | 163.3 | 0 | 0 | 0 | 110.7 | L47 A70 L71 L76 S77 M78 | L47-I74 HydrophobicContact CD2-CB 4.29Å; L47-I74 HydrophobicContact CD2-CG2 3.85Å; A70-I74 WeakPolarHBondContact O-CD1 3.49Å; A70-I74 VanDerWaalsContact O-CG1 3.24Å; A70-I74 WeakPolarHBondContact O-CG1 3.21Å; A70-I74 PolarHBondContact O-N 3.28Å; L71-I74 PolarHBondContact O-N 3.45Å; I74-L76 VanDerWaalsContact C-N 3.35Å; I74-L76 PolarHBondContact O-N 2.72Å; I74-S77 PolarHBondContact O-N 2.79Å; I74-S77 PolarHBondContact O-OG 2.88Å; I74-M78 HydrophobicContact CG2-CG 4.46Å; I74-M78 HydrophobicContact CG2-SD 4.3Å; I74-M78 WeakPolarHBondContact O-CB 3.26Å; I74-M78 VanDerWaalsContact O-CG 3.31Å; I74-M78 WeakPolarHBondContact O-CG 3.5Å; I74-M78 PolarHBondContact O-N 3.4Å |
| 75 | G | 89.8 | Confident | 87.9 | Confident | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | G44 L71 M72 M78 I79 | G44-G75 WeakPolarHBondContact O-CA 3.3Å; L71-G75 PolarHBondContact O-N 3.41Å; M72-G75 PolarHBondContact O-N 3.32Å; G75-M78 PolarHBondContact O-N 2.95Å; G75-I79 WeakPolarHBondContact O-CD1 3.3Å; G75-I79 VanDerWaalsContact O-CG1 3.24Å; G75-I79 WeakPolarHBondContact O-CG1 3.35Å; G75-I79 PolarHBondContact O-N 3.48Å |
| 76 | L | 91.2 | Very high | 88.2 | Confident | 81 Ų | 81 | 71.1 Ų | 71.1 | 42% | 0.424 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66 | -41.2 | 176.5 | -72.1 | 174.7 | 0 | 0 | 0 | 112.7 | M72 I74 M78 I79 L80 | M72-L76 HydrophobicContact CE-CD1 4.3Å; M72-L76 HydrophobicContact CG-CD1 4.29Å; M72-L76 WeakPolarHBondContact O-CB 3.37Å; M72-L76 WeakPolarHBondContact O-CG 3.15Å; M72-L76 PolarHBondContact O-N 2.77Å; I74-L76 VanDerWaalsContact C-N 3.35Å; I74-L76 PolarHBondContact O-N 2.72Å; L76-M78 VanDerWaalsContact C-N 3.31Å; L76-M78 PolarHBondContact O-N 3.31Å; L76-I79 HydrophobicContact CD2-CD1 4.47Å; L76-I79 PolarHBondContact O-N 3.42Å; L76-L80 WeakPolarHBondContact O-CB 3.37Å; L76-L80 WeakPolarHBondContact O-CG 3.28Å; L76-L80 PolarHBondContact O-N 3.29Å |
| 77 | S | 91.3 | Very high | 88.2 | Confident | 57 Ų | 57 | 68.8 Ų | 68.8 | 40% | 0.399 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -65.2 | -36.7 | 177.2 | 72.6 | 0 | 0 | 0 | 0 | 111.6 | G73 I74 T81 | G73-S77 WeakPolarHBondContact O-CB 3.41Å; G73-S77 PolarHBondContact O-N 3.2Å; G73-S77 PolarHBondContact O-OG 3.31Å; I74-S77 PolarHBondContact O-N 2.79Å; I74-S77 PolarHBondContact O-OG 2.88Å; S77-T81 VanDerWaalsContact O-CB 3.31Å; S77-T81 WeakPolarHBondContact O-CB 3.27Å; S77-T81 PolarHBondContact O-N 3.47Å; S77-T81 PolarHBondContact O-OG1 3.44Å |
| 78 | M | 89.4 | Confident | 88.1 | Confident | 68 Ų | 68 | 70.7 Ų | 70.7 | 34% | 0.335 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -65.5 | -43.7 | 172.9 | -72.1 | -173.1 | 78.3 | 0 | 0 | 112.1 | V40 I74 G75 L76 T81 G82 | V40-M78 HydrophobicContact CG1-CE 4.32Å; I74-M78 HydrophobicContact CG2-CG 4.46Å; I74-M78 HydrophobicContact CG2-SD 4.3Å; I74-M78 WeakPolarHBondContact O-CB 3.26Å; I74-M78 VanDerWaalsContact O-CG 3.31Å; I74-M78 WeakPolarHBondContact O-CG 3.5Å; I74-M78 PolarHBondContact O-N 3.4Å; G75-M78 PolarHBondContact O-N 2.95Å; L76-M78 VanDerWaalsContact C-N 3.31Å; L76-M78 PolarHBondContact O-N 3.31Å; M78-T81 PolarHBondContact O-N 2.89Å; M78-G82 PolarHBondContact O-N 2.77Å |
| 79 | I | 89.6 | Confident | 87.8 | Confident | 43 Ų | 43 | 72.4 Ų | 72.4 | 22% | 0.221 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61.3 | -48.3 | 176 | -67.5 | 162 | 0 | 0 | 0 | 110.5 | L45 G75 L76 T81 G82 F83 | L45-I79 HydrophobicContact CB-CD1 4.4Å; L45-I79 HydrophobicContact CD1-CD1 4.43Å; G75-I79 WeakPolarHBondContact O-CD1 3.3Å; G75-I79 VanDerWaalsContact O-CG1 3.24Å; G75-I79 WeakPolarHBondContact O-CG1 3.35Å; G75-I79 PolarHBondContact O-N 3.48Å; L76-I79 HydrophobicContact CD2-CD1 4.47Å; L76-I79 PolarHBondContact O-N 3.42Å; I79-T81 PolarHBondContact O-N 2.84Å; I79-G82 PolarHBondContact O-N 2.84Å; I79-F83 VanDerWaalsContact O-CB 3.28Å; I79-F83 WeakPolarHBondContact O-CB 3.44Å; I79-F83 PolarHBondContact O-N 3.43Å |
| 80 | L | 90.6 | Very high | 87.2 | Confident | 113 Ų | 113 | 68.8 Ų | 68.8 | 59% | 0.592 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -60.1 | -45.6 | 178.2 | -77.5 | 165.1 | 0 | 0 | 0 | 111.3 | L76 F83 V84 | L76-L80 WeakPolarHBondContact O-CB 3.37Å; L76-L80 WeakPolarHBondContact O-CG 3.28Å; L76-L80 PolarHBondContact O-N 3.29Å; L80-F83 PolarHBondContact O-N 2.85Å; L80-V84 WeakPolarHBondContact O-CB 3.48Å; L80-V84 VanDerWaalsContact O-CG2 3.24Å; L80-V84 WeakPolarHBondContact O-CG2 3.45Å; L80-V84 PolarHBondContact O-N 3.16Å |
| 81 | T | 88.3 | Confident | 86.4 | Confident | 83 Ų | 83 | 71.9 Ų | 71.9 | 51% | 0.509 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.5 | -45.4 | 178.6 | -55.8 | 0 | 0 | 0 | 0 | 111.3 | S77 M78 I79 F83 V84 M85 | S77-T81 VanDerWaalsContact O-CB 3.31Å; S77-T81 WeakPolarHBondContact O-CB 3.27Å; S77-T81 PolarHBondContact O-N 3.47Å; S77-T81 PolarHBondContact O-OG1 3.44Å; M78-T81 PolarHBondContact O-N 2.89Å; I79-T81 PolarHBondContact O-N 2.84Å; T81-F83 VanDerWaalsContact C-N 3.34Å; T81-F83 PolarHBondContact O-N 2.72Å; T81-V84 PolarHBondContact O-N 2.89Å; T81-M85 WeakPolarHBondContact O-CB 3.34Å; T81-M85 VanDerWaalsContact O-CG 3.29Å; T81-M85 WeakPolarHBondContact O-CG 3.33Å; T81-M85 PolarHBondContact O-N 2.98Å |
| 82 | G | 85.7 | Confident | 85.3 | Confident | 6 Ų | 6 | 73.5 Ų | 73.5 | 6% | 0.062 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.3 | -40.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | M78 I79 M85 F86 | M78-G82 PolarHBondContact O-N 2.77Å; I79-G82 PolarHBondContact O-N 2.84Å; G82-M85 PolarHBondContact O-N 3.47Å; G82-F86 WeakPolarHBondContact O-CB 3.25Å; G82-F86 PolarHBondContact O-N 3.31Å |
| 83 | F | 86.5 | Confident | 84.1 | Confident | 115 Ų | 115 | 72.7 Ų | 72.7 | 50% | 0.504 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -69.4 | -41.9 | 178.3 | -170 | -106.1 | 0 | 0 | 0 | 112.5 | I79 L80 T81 M85 F86 L87 | I79-F83 VanDerWaalsContact O-CB 3.28Å; I79-F83 WeakPolarHBondContact O-CB 3.44Å; I79-F83 PolarHBondContact O-N 3.43Å; L80-F83 PolarHBondContact O-N 2.85Å; T81-F83 VanDerWaalsContact C-N 3.34Å; T81-F83 PolarHBondContact O-N 2.72Å; F83-M85 VanDerWaalsContact C-N 3.34Å; F83-F86 WeakPolarHBondContact O-CB 3.46Å; F83-F86 PolarHBondContact O-N 3.38Å; F83-L87 HydrophobicContact CD1-CD1 3.76Å; F83-L87 HydrophobicContact CD1-CG 4.15Å; F83-L87 HydrophobicContact CE1-CD1 3.33Å; F83-L87 HydrophobicContact CE1-CD2 4.38Å; F83-L87 HydrophobicContact CE1-CG 3.86Å; F83-L87 HydrophobicContact CZ-CD1 3.95Å; F83-L87 HydrophobicContact CZ-CD2 4.17Å; F83-L87 HydrophobicContact CZ-CG 4.08Å; F83-L87 WeakPolarHBondContact O-CB 3.41Å; F83-L87 WeakPolarHBondContact O-CG 3.38Å; F83-L87 PolarHBondContact O-N 2.82Å |
| 84 | V | 87.6 | Confident | 82.6 | Confident | 91 Ų | 91 | 79.7 Ų | 79.7 | 55% | 0.552 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -62.5 | -43 | 174.5 | 170.6 | 0 | 0 | 0 | 0 | 110.5 | L80 T81 L87 Y88 | L80-V84 WeakPolarHBondContact O-CB 3.48Å; L80-V84 VanDerWaalsContact O-CG2 3.24Å; L80-V84 WeakPolarHBondContact O-CG2 3.45Å; L80-V84 PolarHBondContact O-N 3.16Å; T81-V84 PolarHBondContact O-N 2.89Å; V84-L87 PolarHBondContact O-N 3.38Å; V84-Y88 VanDerWaalsContact O-CB 3.22Å; V84-Y88 WeakPolarHBondContact O-CB 3.45Å; V84-Y88 PolarHBondContact O-N 3.34Å |
| 85 | M | 83.1 | Confident | 81 | Confident | 121 Ų | 121 | 83.1 Ų | 83.1 | 60% | 0.596 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -63.1 | -41.4 | 174.7 | -73.1 | -67.2 | -177.1 | 0 | 0 | 112 | T81 G82 F83 Y88 D89 | T81-M85 WeakPolarHBondContact O-CB 3.34Å; T81-M85 VanDerWaalsContact O-CG 3.29Å; T81-M85 WeakPolarHBondContact O-CG 3.33Å; T81-M85 PolarHBondContact O-N 2.98Å; G82-M85 PolarHBondContact O-N 3.47Å; F83-M85 VanDerWaalsContact C-N 3.34Å; M85-Y88 PolarHBondContact O-N 3.47Å; M85-D89 WeakPolarHBondContact O-CB 3.47Å; M85-D89 PolarHBondContact O-N 2.96Å |
| 86 | F | 84.8 | Confident | 79.3 | Confident | 78 Ų | 78 | 89.6 Ų | 89.6 | 34% | 0.342 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 176.1 | 179.2 | -102.5 | 0 | 0 | 0 | 112.2 | I34 A37 G82 F83 G90 | I34-F86 HydrophobicContact CB-CE2 4.25Å; I34-F86 HydrophobicContact CG1-CD2 4.3Å; I34-F86 HydrophobicContact CG1-CE2 3.91Å; I34-F86 HydrophobicContact CG2-CD2 4.34Å; I34-F86 HydrophobicContact CG2-CE2 3.73Å; A37-F86 HydrophobicContact CB-CB 3.95Å; A37-F86 HydrophobicContact CB-CD2 4.26Å; G82-F86 WeakPolarHBondContact O-CB 3.25Å; G82-F86 PolarHBondContact O-N 3.31Å; F83-F86 WeakPolarHBondContact O-CB 3.46Å; F83-F86 PolarHBondContact O-N 3.38Å; F86-G90 PolarHBondContact O-N 2.9Å |
| 87 | L | 84.6 | Confident | 77.5 | Confident | 79 Ų | 79 | 90.9 Ų | 90.9 | 41% | 0.414 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 175.7 | -73.1 | -177 | 0 | 0 | 0 | 111.5 | F83 V84 G90 M91 | F83-L87 HydrophobicContact CD1-CD1 3.76Å; F83-L87 HydrophobicContact CD1-CG 4.15Å; F83-L87 HydrophobicContact CE1-CD1 3.33Å; F83-L87 HydrophobicContact CE1-CD2 4.38Å; F83-L87 HydrophobicContact CE1-CG 3.86Å; F83-L87 HydrophobicContact CZ-CD1 3.95Å; F83-L87 HydrophobicContact CZ-CD2 4.17Å; F83-L87 HydrophobicContact CZ-CG 4.08Å; F83-L87 WeakPolarHBondContact O-CB 3.41Å; F83-L87 WeakPolarHBondContact O-CG 3.38Å; F83-L87 PolarHBondContact O-N 2.82Å; V84-L87 PolarHBondContact O-N 3.38Å; L87-G90 PolarHBondContact O-N 2.85Å; L87-M91 VanDerWaalsContact O-CB 3.3Å; L87-M91 WeakPolarHBondContact O-CB 3.47Å; L87-M91 VanDerWaalsContact O-CG 3.26Å; L87-M91 WeakPolarHBondContact O-CG 3.49Å; L87-M91 PolarHBondContact O-N 3.43Å |
| 88 | Y | 84 | Confident | 75.4 | Confident | 145 Ų | 145 | 93.9 Ų | 93.9 | 57% | 0.569 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -62.8 | -45.8 | 179.2 | -171.4 | -95 | 0 | 0 | 0 | 111.3 | V84 M85 M91 M92 | V84-Y88 VanDerWaalsContact O-CB 3.22Å; V84-Y88 WeakPolarHBondContact O-CB 3.45Å; V84-Y88 PolarHBondContact O-N 3.34Å; M85-Y88 PolarHBondContact O-N 3.47Å; Y88-M91 PolarHBondContact O-N 3.45Å; Y88-M92 HydrophobicContact CD1-CG 4.32Å; Y88-M92 HydrophobicContact CE1-CE 4.21Å; Y88-M92 HydrophobicContact CE1-CG 3.95Å; Y88-M92 VanDerWaalsContact O-CB 3.28Å; Y88-M92 WeakPolarHBondContact O-CB 3.4Å; Y88-M92 PolarHBondContact O-N 3.25Å; Y88-M92 WeakPolarHBondContact OH-CE 3.24Å |
| 89 | D | 79.7 | Confident | 73.6 | Confident | 36 Ų | 36 | 97.2 Ų | 97.2 | 19% | 0.193 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -66.5 | -39.9 | 175.2 | -173 | 31.1 | 0 | 0 | 0 | 111.6 | S33 M85 M91 M92 K93 | S33-D89 WeakPolarHBondContact CB-OD2 3.28Å; S33-D89 PolarHBondContact OG-OD2 3.24Å; M85-D89 WeakPolarHBondContact O-CB 3.47Å; M85-D89 PolarHBondContact O-N 2.96Å; D89-M91 PolarHBondContact O-N 2.89Å; D89-M92 PolarHBondContact O-N 2.94Å; D89-K93 WeakPolarHBondContact O-CB 3.46Å; D89-K93 WeakPolarHBondContact O-CD 3.29Å; D89-K93 VanDerWaalsContact O-CG 3.26Å; D89-K93 WeakPolarHBondContact O-CG 3.34Å; D89-K93 PolarHBondContact O-N 2.82Å; D89-K93 WeakPolarHBondContact OD1-CE 3.44Å; D89-K93 IonicContact OD1-NZ 3.6Å; D89-K93 WeakPolarHBondContact OD2-CE 3.38Å; D89-K93 IonicContact OD2-NZ 2.77Å; D89-K93 PolarHBondContact OD2-NZ 2.91Å |
| 90 | G | 74.7 | Confident | 71.6 | Confident | 33 Ų | 33 | 98.7 Ų | 98.7 | 34% | 0.34 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.7 | -42.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | F86 L87 R94 | F86-G90 PolarHBondContact O-N 2.9Å; L87-G90 PolarHBondContact O-N 2.85Å; G90-R94 WeakPolarHBondContact O-CG 3.43Å; G90-R94 PolarHBondContact O-N 2.72Å; G90-R94 VanDerWaalsContact O-N 3.17Å |
| 91 | M | 72 | Confident | 69.5 | Low | 114 Ų | 114 | 98.1 Ų | 98.1 | 56% | 0.562 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -74 | -38.8 | 177.5 | -72.8 | -175.3 | 67.7 | 0 | 0 | 112.2 | L87 Y88 D89 K93 R94 R95 | L87-M91 VanDerWaalsContact O-CB 3.3Å; L87-M91 WeakPolarHBondContact O-CB 3.47Å; L87-M91 VanDerWaalsContact O-CG 3.26Å; L87-M91 WeakPolarHBondContact O-CG 3.49Å; L87-M91 PolarHBondContact O-N 3.43Å; Y88-M91 PolarHBondContact O-N 3.45Å; D89-M91 PolarHBondContact O-N 2.89Å; M91-K93 VanDerWaalsContact C-N 3.27Å; M91-K93 PolarHBondContact O-N 3.39Å; M91-R94 WeakPolarHBondContact O-CB 3.22Å; M91-R94 PolarHBondContact O-N 3.35Å; M91-R94 VanDerWaalsContact O-N 3.17Å; M91-R95 PolarHBondContact O-N 3.35Å |
| 92 | M | 66.9 | Low | 67.4 | Low | 78 Ų | 78 | 98 Ų | 98 | 38% | 0.384 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59 | -40.1 | 171.8 | -96 | -84.8 | -178.9 | 0 | 0 | 111.4 | Y88 D89 R95 K96 | Y88-M92 HydrophobicContact CD1-CG 4.32Å; Y88-M92 HydrophobicContact CE1-CE 4.21Å; Y88-M92 HydrophobicContact CE1-CG 3.95Å; Y88-M92 VanDerWaalsContact O-CB 3.28Å; Y88-M92 WeakPolarHBondContact O-CB 3.4Å; Y88-M92 PolarHBondContact O-N 3.25Å; Y88-M92 WeakPolarHBondContact OH-CE 3.24Å; D89-M92 PolarHBondContact O-N 2.94Å; M92-R95 PolarHBondContact O-N 3.46Å; M92-K96 PolarHBondContact O-N 2.92Å |
| 93 | K | 63.7 | Low | 65.5 | Low | 59 Ų | 59 | 101.1 Ų | 101.1 | 26% | 0.257 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 175 | -76.3 | 165.1 | 177.3 | 162.8 | 0 | 112.2 | D89 M91 K96 L97 | D89-K93 WeakPolarHBondContact O-CB 3.46Å; D89-K93 WeakPolarHBondContact O-CD 3.29Å; D89-K93 VanDerWaalsContact O-CG 3.26Å; D89-K93 WeakPolarHBondContact O-CG 3.34Å; D89-K93 PolarHBondContact O-N 2.82Å; D89-K93 WeakPolarHBondContact OD1-CE 3.44Å; D89-K93 IonicContact OD1-NZ 3.6Å; D89-K93 WeakPolarHBondContact OD2-CE 3.38Å; D89-K93 IonicContact OD2-NZ 2.77Å; D89-K93 PolarHBondContact OD2-NZ 2.91Å; M91-K93 VanDerWaalsContact C-N 3.27Å; M91-K93 PolarHBondContact O-N 3.39Å; K93-K96 PolarHBondContact O-N 3.48Å; K93-L97 PolarHBondContact O-N 3.41Å; K93-L97 VanDerWaalsContact O-N 3.1Å |
| 94 | R | 59.3 | Low | 63.4 | Low | 189 Ų | 189 | 103 Ų | 103 | 71% | 0.713 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65 | -40.5 | 174.5 | -68.3 | -83 | -176 | -176.4 | -0.1 | 111.6 | G90 M91 L97 Q98 | G90-R94 WeakPolarHBondContact O-CG 3.43Å; G90-R94 PolarHBondContact O-N 2.72Å; G90-R94 VanDerWaalsContact O-N 3.17Å; M91-R94 WeakPolarHBondContact O-CB 3.22Å; M91-R94 PolarHBondContact O-N 3.35Å; M91-R94 VanDerWaalsContact O-N 3.17Å; R94-L97 PolarHBondContact O-N 2.82Å; R94-Q98 WeakPolarHBondContact O-CB 3.45Å; R94-Q98 PolarHBondContact O-N 2.87Å |
| 95 | R | 57.7 | Low | 61.4 | Low | 157 Ų | 157 | 103 Ų | 103 | 59% | 0.592 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.8 | -41.3 | 176.5 | -71.2 | -172.9 | -176.2 | -165.6 | 1.2 | 112.2 | M91 M92 L97 Q98 E99 | M91-R95 PolarHBondContact O-N 3.35Å; M92-R95 PolarHBondContact O-N 3.46Å; R95-L97 VanDerWaalsContact C-N 3.35Å; R95-L97 PolarHBondContact O-N 3.47Å; R95-Q98 CarbonylContact O-C 3.58Å; R95-Q98 PolarHBondContact O-N 3.47Å; R95-E99 WeakPolarHBondContact O-CB 3.46Å; R95-E99 WeakPolarHBondContact O-CG 3.33Å; R95-E99 PolarHBondContact O-N 3.47Å |
| 96 | K | 55 | Low | 59.4 | Low | 136 Ų | 136 | 103.9 Ų | 103.9 | 59% | 0.591 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.5 | -33.2 | 175.6 | -68.8 | -171.9 | 178.5 | -176.4 | 0 | 113.5 | M92 K93 S100 | M92-K96 PolarHBondContact O-N 2.92Å; K93-K96 PolarHBondContact O-N 3.48Å; K96-S100 VanDerWaalsContact O-CB 3.3Å; K96-S100 WeakPolarHBondContact O-CB 3.39Å; K96-S100 PolarHBondContact O-N 2.86Å; K96-S100 PolarHBondContact O-OG 3.36Å |
| 97 | L | 52.5 | Low | 57.4 | Low | 107 Ų | 107 | 105.8 Ų | 105.8 | 56% | 0.56 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -69.5 | -39.2 | 172.1 | -81 | 156.4 | 0 | 0 | 0 | 111.2 | K93 R94 R95 S100 V101 | K93-L97 PolarHBondContact O-N 3.41Å; K93-L97 VanDerWaalsContact O-N 3.1Å; R94-L97 PolarHBondContact O-N 2.82Å; R95-L97 VanDerWaalsContact C-N 3.35Å; R95-L97 PolarHBondContact O-N 3.47Å; L97-S100 WeakPolarHBondContact CA-OG 3.24Å; L97-S100 PolarHBondContact O-N 2.84Å; L97-S100 PolarHBondContact O-OG 3.35Å; L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.37Å; L97-V101 PolarHBondContact O-N 3.41Å |
| 98 | Q | 48.4 | Very low | 55.5 | Low | 121 Ų | 121 | 111.1 Ų | 111.1 | 57% | 0.565 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -68.9 | -43.2 | 176.7 | -160.5 | 169.6 | 0.1 | 0 | 0 | 111.4 | R94 R95 S100 V101 D102 | R94-Q98 WeakPolarHBondContact O-CB 3.45Å; R94-Q98 PolarHBondContact O-N 2.87Å; R95-Q98 CarbonylContact O-C 3.58Å; R95-Q98 PolarHBondContact O-N 3.47Å; Q98-S100 PolarHBondContact O-N 3.33Å; Q98-V101 CarbonylContact O-C 3.59Å; Q98-V101 PolarHBondContact O-N 2.97Å; Q98-V101 VanDerWaalsContact O-N 3.1Å; Q98-D102 WeakPolarHBondContact CG-OD2 3.31Å; Q98-D102 VanDerWaalsContact O-CB 3.29Å; Q98-D102 WeakPolarHBondContact O-CB 3.42Å; Q98-D102 PolarHBondContact O-N 2.96Å |
| 99 | E | 51.5 | Low | 53.4 | Low | 137 Ų | 137 | 106.5 Ų | 106.5 | 64% | 0.64 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.2 | -21.2 | 172.2 | -71.4 | 173.8 | 136.3 | 0 | 0 | 113.4 | R95 P103 | R95-E99 WeakPolarHBondContact O-CB 3.46Å; R95-E99 WeakPolarHBondContact O-CG 3.33Å; R95-E99 PolarHBondContact O-N 3.47Å; E99-P103 VanDerWaalsContact O-CD 3.26Å; E99-P103 WeakPolarHBondContact O-CD 3.42Å |
| 100 | S | 47.3 | Very low | 51.7 | Low | 75 Ų | 75 | 107.5 Ų | 107.5 | 52% | 0.524 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -86.4 | -20.2 | 172.1 | 72.3 | 0 | 0 | 0 | 0 | 113.9 | K96 L97 Q98 P103 | K96-S100 VanDerWaalsContact O-CB 3.3Å; K96-S100 WeakPolarHBondContact O-CB 3.39Å; K96-S100 PolarHBondContact O-N 2.86Å; K96-S100 PolarHBondContact O-OG 3.36Å; L97-S100 WeakPolarHBondContact CA-OG 3.24Å; L97-S100 PolarHBondContact O-N 2.84Å; L97-S100 PolarHBondContact O-OG 3.35Å; Q98-S100 PolarHBondContact O-N 3.33Å; S100-P103 WeakPolarHBondContact O-CD 3.46Å |
| 101 | V | 47.3 | Very low | 50.3 | Low | 100 Ų | 100 | 109.8 Ų | 109.8 | 61% | 0.606 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -92.6 | -25.3 | 174.6 | 173.1 | 0 | 0 | 0 | 0 | 110.9 | L97 Q98 | L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.37Å; L97-V101 PolarHBondContact O-N 3.41Å; Q98-V101 CarbonylContact O-C 3.59Å; Q98-V101 PolarHBondContact O-N 2.97Å; Q98-V101 VanDerWaalsContact O-N 3.1Å |
| 102 | D | 43.3 | Very low | 49.1 | Very low | 80 Ų | 80 | 107.6 Ų | 107.6 | 43% | 0.428 | 55% | 0.55 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.1 | 18.5 | 178.1 | -71.7 | -42.2 | 0 | 0 | 0 | 117.9 | Q98 F104 | Q98-D102 WeakPolarHBondContact CG-OD2 3.31Å; Q98-D102 VanDerWaalsContact O-CB 3.29Å; Q98-D102 WeakPolarHBondContact O-CB 3.42Å; Q98-D102 PolarHBondContact O-N 2.96Å; D102-F104 VanDerWaalsContact C-N 3.31Å |
| 103 | P | 45.4 | Very low | 48.1 | Very low | 73 Ų | 73 | 110.5 Ų | 110.5 | 47% | 0.474 | 57% | 0.567 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.3 | -4.6 | 158.6 | 25.4 | -13.2 | 0 | 0 | 0 | 112.4 | E99 S100 | E99-P103 VanDerWaalsContact O-CD 3.26Å; E99-P103 WeakPolarHBondContact O-CD 3.42Å; S100-P103 WeakPolarHBondContact O-CD 3.46Å |
| 104 | F | 43.7 | Very low | 47.4 | Very low | 155 Ų | 155 | 112 Ų | 112 | 68% | 0.68 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.7 | -4.7 | -177.7 | -114.6 | -86.2 | 0 | 0 | 0 | 115.3 | D102 | D102-F104 VanDerWaalsContact C-N 3.31Š|
| 105 | T | 43.6 | Very low | 46.7 | Very low | 91 Ų | 91 | 112.7 Ų | 112.7 | 56% | 0.558 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.4 | -26.8 | -176.9 | -34.8 | 0 | 0 | 0 | 0 | 112.8 | ||
| 106 | D | 41.3 | Very low | 46 | Very low | 138 Ų | 138 | 108.4 Ų | 108.4 | 74% | 0.738 | 59% | 0.585 | S | S | * | * | S | Bend | trans | -87.3 | -20.9 | 174.8 | -115.8 | -26 | 0 | 0 | 0 | 113.8 | R108 G109 A110 | D106-R108 VanDerWaalsContact C-N 3.3Å; D106-G109 PolarHBondContact O-N 3.19Å; D106-A110 PolarHBondContact O-N 2.96Å |
| 107 | Q | 44.2 | Very low | 45.5 | Very low | 119 Ų | 119 | 110.3 Ų | 110.3 | 56% | 0.556 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -70.9 | -26.5 | 165.1 | -105.9 | 176.3 | 17.4 | 0 | 0 | 112.1 | G109 A110 D111 | Q107-G109 VanDerWaalsContact C-N 3.31Å; Q107-G109 PolarHBondContact O-N 2.87Å; Q107-A110 PolarHBondContact O-N 2.95Å; Q107-D111 WeakPolarHBondContact O-CA 3.24Å; Q107-D111 WeakPolarHBondContact O-CB 3.31Å; Q107-D111 PolarHBondContact O-N 3.31Å |
| 108 | R | 43.3 | Very low | 45.2 | Very low | 190 Ų | 190 | 114 Ų | 114 | 72% | 0.717 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -73.3 | -20.5 | 174.2 | -86.5 | -178.2 | 173.2 | -177 | -0.2 | 113.8 | D106 A112 | D106-R108 VanDerWaalsContact C-N 3.3Å; R108-A112 WeakPolarHBondContact O-CB 3.48Å; R108-A112 PolarHBondContact O-N 3.28Å |
| 109 | G | 40.3 | Very low | 45.1 | Very low | 49 Ų | 49 | 117.3 Ų | 117.3 | 51% | 0.505 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -83.3 | -35.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | D106 Q107 | D106-G109 PolarHBondContact O-N 3.19Å; Q107-G109 VanDerWaalsContact C-N 3.31Å; Q107-G109 PolarHBondContact O-N 2.87Å |
| 110 | A | 44.3 | Very low | 44.8 | Very low | 57 Ų | 57 | 115.7 Ų | 115.7 | 47% | 0.471 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -80.5 | -32.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | D106 Q107 I114 | D106-A110 PolarHBondContact O-N 2.96Å; Q107-A110 PolarHBondContact O-N 2.95Å; A110-I114 PolarHBondContact O-N 3.47Å |
| 111 | D | 45.2 | Very low | 44.8 | Very low | 80 Ų | 80 | 114.6 Ų | 114.6 | 43% | 0.428 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -79.5 | -18.9 | 174.9 | -72 | -36 | 0 | 0 | 0 | 113.1 | Q107 N113 R115 | Q107-D111 WeakPolarHBondContact O-CA 3.24Å; Q107-D111 WeakPolarHBondContact O-CB 3.31Å; Q107-D111 PolarHBondContact O-N 3.31Å; D111-N113 VanDerWaalsContact C-N 3.33Å; D111-R115 WeakPolarHBondContact O-CB 3.19Å; D111-R115 WeakPolarHBondContact O-CG 3.47Å; D111-R115 PolarHBondContact O-N 2.88Å |
| 112 | A | 46.7 | Very low | 44.6 | Very low | 68 Ų | 68 | 119.2 Ų | 119.2 | 56% | 0.562 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -72.7 | -26 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | R108 | R108-A112 WeakPolarHBondContact O-CB 3.48Å; R108-A112 PolarHBondContact O-N 3.28Å |
| 113 | N | 45 | Very low | 45.1 | Very low | 139 Ų | 139 | 124.6 Ų | 124.6 | 74% | 0.743 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -89.3 | -17.3 | 175.9 | -149.5 | 8.6 | 0 | 0 | 0 | 112.8 | D111 | D111-N113 VanDerWaalsContact C-N 3.33Å |
| 114 | I | 49.6 | Very low | 46 | Very low | 91 Ų | 91 | 125.1 Ų | 125.1 | 47% | 0.467 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -94.7 | -21.9 | 173.9 | -60.5 | -176.2 | 0 | 0 | 0 | 112 | A110 G116 Q117 | A110-I114 PolarHBondContact O-N 3.47Å; I114-G116 VanDerWaalsContact C-N 3.31Å; I114-G116 PolarHBondContact O-N 3.5Å; I114-Q117 PolarHBondContact O-N 2.87Å |
| 115 | R | 45.5 | Very low | 46.7 | Very low | 204 Ų | 204 | 123 Ų | 123 | 77% | 0.77 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | -17.7 | 173.3 | -94.5 | 179.6 | 163 | -176.3 | -4.4 | 115 | D111 Q117 | D111-R115 WeakPolarHBondContact O-CB 3.19Å; D111-R115 WeakPolarHBondContact O-CG 3.47Å; D111-R115 PolarHBondContact O-N 2.88Å; R115-Q117 VanDerWaalsContact C-N 3.32Å |
| 116 | G | 43.2 | Very low | 47.5 | Very low | 67 Ų | 67 | 123.6 Ų | 123.6 | 69% | 0.691 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -16.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | I114 | I114-G116 VanDerWaalsContact C-N 3.31Å; I114-G116 PolarHBondContact O-N 3.5Å |
| 117 | Q | 44.5 | Very low | 48.3 | Very low | 175 Ų | 175 | 119.7 Ų | 119.7 | 82% | 0.818 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.5 | -8.2 | -177.6 | -96 | -172.7 | -22.5 | 0 | 0 | 114.7 | I114 R115 | I114-Q117 PolarHBondContact O-N 2.87Å; R115-Q117 VanDerWaalsContact C-N 3.32Å |
| 118 | R | 44.6 | Very low | 48.6 | Very low | 184 Ų | 184 | 123.5 Ų | 123.5 | 69% | 0.694 | 68% | 0.677 | S | S | * | * | trans | -103 | 21.5 | -176.9 | -75.3 | -166.3 | 174.8 | -166.1 | 0.9 | 115.3 | A120 | R118-A120 PolarHBondContact O-N 3.34Å; R118-A120 VanDerWaalsContact O-N 3.11Å | ||
| 119 | Q | 48.1 | Very low | 49.3 | Very low | 192 Ų | 192 | 120.1 Ų | 120.1 | 90% | 0.897 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | 16.8 | 168.9 | -79.4 | -171 | -2.3 | 0 | 0 | 114.1 | ||
| 120 | A | 45 | Very low | 50.1 | Low | 103 Ų | 103 | 121.8 Ų | 121.8 | 85% | 0.851 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.7 | 19.1 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | R118 | R118-A120 PolarHBondContact O-N 3.34Å; R118-A120 VanDerWaalsContact O-N 3.11Å |
| 121 | G | 45.8 | Very low | 50.7 | Low | 51 Ų | 51 | 122.5 Ų | 122.5 | 53% | 0.526 | 67% | 0.669 | S | S | . | * | trans | -149.6 | 100.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | F123 | G121-F123 PolarHBondContact O-N 2.93Å; G121-F123 VanDerWaalsContact O-N 3.1Å | ||
| 122 | M | 44.6 | Very low | 51.2 | Low | 198 Ų | 198 | 123 Ų | 123 | 98% | 0.975 | 67% | 0.671 | S | S | * | * | trans | -60 | 107.8 | 172.3 | -71.2 | -171.9 | -89 | 0 | 0 | 110.1 | A124 | M122-A124 PolarHBondContact O-N 3.33Š| ||
| 123 | F | 53.4 | Low | 51.7 | Low | 193 Ų | 193 | 126.4 Ų | 126.4 | 85% | 0.846 | 68% | 0.675 | S | S | * | * | trans | -84.6 | 103.9 | 164.2 | -103.3 | -93.6 | 0 | 0 | 0 | 108 | G121 | G121-F123 PolarHBondContact O-N 2.93Å; G121-F123 VanDerWaalsContact O-N 3.1Å | ||
| 124 | A | 64 | Low | 52.1 | Low | 83 Ų | 83 | 126.2 Ų | 126.2 | 69% | 0.686 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 144.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | M122 | M122-A124 PolarHBondContact O-N 3.33Š|
| 125 | P | 58.9 | Low | 52.1 | Low | 112 Ų | 112 | 126.4 Ų | 126.4 | 73% | 0.727 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 148.8 | 171.9 | 26.6 | -33.1 | 0 | 0 | 0 | 110.5 | S127 | P125-S127 PolarHBondContact O-N 3.44Š|
| 126 | P | 60 | Low | 52.6 | Low | 103 Ų | 103 | 120.5 Ų | 120.5 | 67% | 0.669 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 140.8 | 177.7 | 24 | -32.9 | 0 | 0 | 0 | 110.2 | ||
| 127 | S | 57.9 | Low | 53.2 | Low | 56 Ų | 56 | 123.1 Ų | 123.1 | 39% | 0.392 | 65% | 0.652 | S | S | . | * | P | Polyproline II helix | trans | -70.7 | 152.1 | -179.6 | 70.9 | 0 | 0 | 0 | 0 | 109.7 | P125 D129 D130 | P125-S127 PolarHBondContact O-N 3.44Å; S127-D129 PolarHBondContact O-N 3.29Å; S127-D130 PolarHBondContact N-OD2 2.97Å; S127-D130 PolarHBondContact O-N 3.38Å; S127-D130 VanDerWaalsContact OG-CG 3.31Å; S127-D130 PolarHBondContact OG-OD2 2.88Å |
| 128 | Y | 50.8 | Low | 53.5 | Low | 198 Ų | 198 | 122.3 Ų | 122.3 | 78% | 0.776 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -58.4 | -23.3 | -179.6 | -156.6 | -97.1 | 0 | 0 | 0 | 112.2 | L132 | Y128-L132 HydrophobicContact CD1-CD1 3.75Å; Y128-L132 HydrophobicContact CE1-CD1 3.85Å; Y128-L132 PolarHBondContact O-N 2.95Å |
| 129 | D | 58 | Low | 53.8 | Low | 119 Ų | 119 | 123.2 Ų | 123.2 | 64% | 0.636 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -71.9 | -33.6 | 177.8 | -67.7 | -35.1 | 0 | 0 | 0 | 112.9 | S127 V131 L132 Q133 | S127-D129 PolarHBondContact O-N 3.29Å; D129-V131 VanDerWaalsContact C-N 3.31Å; D129-V131 PolarHBondContact O-N 2.9Å; D129-L132 PolarHBondContact O-N 2.86Å; D129-Q133 PolarHBondContact O-N 3.46Å; D129-Q133 VanDerWaalsContact O-N 3.07Å |
| 130 | D | 57.2 | Low | 54 | Low | 85 Ų | 85 | 121 Ų | 121 | 46% | 0.455 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -65.5 | -37 | 179.2 | -60.1 | -51 | 0 | 0 | 0 | 111.2 | S127 Q133 E134 | S127-D130 PolarHBondContact N-OD2 2.97Å; S127-D130 PolarHBondContact O-N 3.38Å; S127-D130 VanDerWaalsContact OG-CG 3.31Å; S127-D130 PolarHBondContact OG-OD2 2.88Å; D130-Q133 PolarHBondContact O-N 2.94Å; D130-E134 PolarHBondContact O-N 2.7Å |
| 131 | V | 56.5 | Low | 54.4 | Low | 72 Ų | 72 | 122.6 Ų | 122.6 | 44% | 0.436 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -74 | -29.7 | 179.4 | -169.9 | 0 | 0 | 0 | 0 | 111.7 | D129 N135 | D129-V131 VanDerWaalsContact C-N 3.31Å; D129-V131 PolarHBondContact O-N 2.9Å; V131-N135 PolarHBondContact O-N 3.32Å; V131-N135 PolarHBondContact O-ND2 2.95Å |
| 132 | L | 56.2 | Low | 54.8 | Low | 91 Ų | 91 | 123.9 Ų | 123.9 | 48% | 0.476 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -73.4 | -37.6 | 175.3 | -103.1 | 141.5 | 0 | 0 | 0 | 111.4 | Y128 D129 N135 V136 | Y128-L132 HydrophobicContact CD1-CD1 3.75Å; Y128-L132 HydrophobicContact CE1-CD1 3.85Å; Y128-L132 PolarHBondContact O-N 2.95Å; D129-L132 PolarHBondContact O-N 2.86Å; L132-N135 PolarHBondContact O-N 2.92Å; L132-V136 WeakPolarHBondContact O-CG2 3.35Å; L132-V136 PolarHBondContact O-N 3.48Å; L132-V136 VanDerWaalsContact O-N 3.11Å |
| 133 | Q | 56.8 | Low | 55.3 | Low | 138 Ų | 138 | 119.6 Ų | 119.6 | 65% | 0.645 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67.5 | -39.6 | 179.8 | -156.1 | 169.1 | 20.7 | 0 | 0 | 112.1 | D129 D130 N135 V136 Q137 | D129-Q133 PolarHBondContact O-N 3.46Å; D129-Q133 VanDerWaalsContact O-N 3.07Å; D130-Q133 PolarHBondContact O-N 2.94Å; Q133-N135 VanDerWaalsContact C-N 3.33Å; Q133-N135 PolarHBondContact O-N 3.42Å; Q133-V136 PolarHBondContact O-N 3.34Å; Q133-Q137 PolarHBondContact O-N 2.92Å; Q133-Q137 VanDerWaalsContact O-N 3.08Å |
| 134 | E | 53.7 | Low | 55.2 | Low | 135 Ų | 135 | 113.9 Ų | 113.9 | 63% | 0.631 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -62.8 | -38 | 174.7 | -167.4 | 177.5 | -176.1 | 0 | 0 | 112 | D130 Q137 Y138 | D130-E134 PolarHBondContact O-N 2.7Å; E134-Q137 PolarHBondContact O-N 3.37Å; E134-Y138 PolarHBondContact O-N 3.06Å; E134-Y138 VanDerWaalsContact O-N 3.13Å |
| 135 | N | 50.2 | Low | 54.1 | Low | 96 Ų | 96 | 112.8 Ų | 112.8 | 51% | 0.513 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -73 | -26.8 | 177.7 | -80.6 | -59.8 | 0 | 0 | 0 | 113.9 | V131 L132 Q133 R139 | V131-N135 PolarHBondContact O-N 3.32Å; V131-N135 PolarHBondContact O-ND2 2.95Å; L132-N135 PolarHBondContact O-N 2.92Å; Q133-N135 VanDerWaalsContact C-N 3.33Å; Q133-N135 PolarHBondContact O-N 3.42Å; N135-R139 PolarHBondContact O-N 3.22Å |
| 136 | V | 56.1 | Low | 53.5 | Low | 79 Ų | 79 | 111 Ų | 111 | 48% | 0.479 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -75.6 | -40 | 174.1 | 174.7 | 0 | 0 | 0 | 0 | 110.3 | L132 Q133 Y138 R139 E140 | L132-V136 WeakPolarHBondContact O-CG2 3.35Å; L132-V136 PolarHBondContact O-N 3.48Å; L132-V136 VanDerWaalsContact O-N 3.11Å; Q133-V136 PolarHBondContact O-N 3.34Å; V136-Y138 PolarHBondContact O-N 2.95Å; V136-R139 WeakPolarHBondContact O-CB 3.5Å; V136-R139 PolarHBondContact O-N 2.88Å; V136-R139 VanDerWaalsContact O-N 3.12Å; V136-E140 PolarHBondContact O-N 3.33Å; V136-E140 VanDerWaalsContact O-N 3.1Å |
| 137 | Q | 55.6 | Low | 52.6 | Low | 122 Ų | 122 | 117.7 Ų | 117.7 | 57% | 0.57 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -65.2 | -40.4 | 179.2 | -151.5 | 166.1 | 6.4 | 0 | 0 | 111.7 | Q133 E134 R139 E140 E141 | Q133-Q137 PolarHBondContact O-N 2.92Å; Q133-Q137 VanDerWaalsContact O-N 3.08Å; E134-Q137 PolarHBondContact O-N 3.37Å; Q137-R139 PolarHBondContact O-N 3.48Å; Q137-E140 PolarHBondContact O-N 2.97Å; Q137-E141 WeakPolarHBondContact O-CG 3.45Å; Q137-E141 PolarHBondContact O-N 3.36Å; Q137-E141 VanDerWaalsContact O-N 3.13Å |
| 138 | Y | 50.7 | Low | 52.4 | Low | 158 Ų | 158 | 120 Ų | 120 | 62% | 0.62 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -65.3 | -27.8 | 174.2 | -136.7 | -92.6 | 0 | 0 | 0 | 113.3 | E134 V136 A142 | E134-Y138 PolarHBondContact O-N 3.06Å; E134-Y138 VanDerWaalsContact O-N 3.13Å; V136-Y138 PolarHBondContact O-N 2.95Å; Y138-A142 VanDerWaalsContact O-CB 3.29Å; Y138-A142 WeakPolarHBondContact O-CB 3.37Å; Y138-A142 PolarHBondContact O-N 3.39Å; Y138-A142 VanDerWaalsContact O-N 3.14Å |
| 139 | R | 49.8 | Very low | 52.5 | Low | 203 Ų | 203 | 118.1 Ų | 118.1 | 77% | 0.766 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -78.5 | -31.5 | 178.6 | -168.3 | 176.7 | -176.8 | 164.1 | 0.2 | 112.3 | N135 V136 Q137 S143 | N135-R139 PolarHBondContact O-N 3.22Å; V136-R139 WeakPolarHBondContact O-CB 3.5Å; V136-R139 PolarHBondContact O-N 2.88Å; V136-R139 VanDerWaalsContact O-N 3.12Å; Q137-R139 PolarHBondContact O-N 3.48Å; R139-S143 WeakPolarHBondContact O-CB 3.24Å; R139-S143 PolarHBondContact O-N 2.85Å |
| 140 | E | 52.7 | Low | 52.1 | Low | 145 Ų | 145 | 124.2 Ų | 124.2 | 68% | 0.678 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -74.6 | -37.2 | 174 | -72.8 | -173.5 | 155.6 | 0 | 0 | 111.8 | V136 Q137 S143 | V136-E140 PolarHBondContact O-N 3.33Å; V136-E140 VanDerWaalsContact O-N 3.1Å; Q137-E140 PolarHBondContact O-N 2.97Å; E140-S143 PolarHBondContact O-N 3.37Å |
| 141 | E | 54.1 | Low | 51.8 | Low | 137 Ų | 137 | 127.3 Ų | 127.3 | 64% | 0.64 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -68.6 | -36 | 174.6 | -68.8 | -178 | 174.3 | 0 | 0 | 112.5 | Q137 S143 | Q137-E141 WeakPolarHBondContact O-CG 3.45Å; Q137-E141 PolarHBondContact O-N 3.36Å; Q137-E141 VanDerWaalsContact O-N 3.13Å; E141-S143 VanDerWaalsContact C-N 3.3Å; E141-S143 PolarHBondContact O-N 3.43Å |
| 142 | A | 54.2 | Low | 51.6 | Low | 78 Ų | 78 | 126.3 Ų | 126.3 | 65% | 0.645 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | -15.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y138 | Y138-A142 VanDerWaalsContact O-CB 3.29Å; Y138-A142 WeakPolarHBondContact O-CB 3.37Å; Y138-A142 PolarHBondContact O-N 3.39Å; Y138-A142 VanDerWaalsContact O-N 3.14Å |
| 143 | S | 54.2 | Low | 51.2 | Low | 108 Ų | 108 | 130.9 Ų | 130.9 | 76% | 0.755 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | -5.4 | -178 | -161.2 | 0 | 0 | 0 | 0 | 113.7 | R139 E140 E141 | R139-S143 WeakPolarHBondContact O-CB 3.24Å; R139-S143 PolarHBondContact O-N 2.85Å; E140-S143 PolarHBondContact O-N 3.37Å; E141-S143 VanDerWaalsContact C-N 3.3Å; E141-S143 PolarHBondContact O-N 3.43Å |
| 144 | G | 50.8 | Low | 50.9 | Low | 73 Ų | 73 | 132.7 Ų | 132.7 | 75% | 0.753 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -105.1 | -8.3 | -174 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 145 | G | 42.5 | Very low | 50.9 | Low | 60 Ų | 60 | 130.2 Ų | 130.2 | 62% | 0.619 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -139.2 | 114.2 | -170.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 146 | G | 46.1 | Very low | 50.9 | Low | 75 Ų | 75 | 128.5 Ų | 128.5 | 77% | 0.773 | 69% | 0.685 | S | S | * | * | trans | -63.9 | 143.7 | -171.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 147 | R | 41.2 | Very low | 50.8 | Low | 243 Ų | 243 | 129.5 Ų | 129.5 | 92% | 0.917 | 69% | 0.691 | S | S | * | * | S | Bend | trans | 50.4 | 84.3 | 149 | -66.1 | 170.7 | 98 | 168.5 | 4.7 | 115.8 | ||
| 148 | S | 53.4 | Low | 50.6 | Low | 106 Ų | 106 | 133.4 Ų | 133.4 | 74% | 0.741 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -172.9 | -18.4 | 131.4 | -87 | 0 | 0 | 0 | 0 | 116.5 | R150 | S148-R150 VanDerWaalsContact C-N 3.27Å; S148-R150 PolarHBondContact O-N 3.28Å |
| 149 | D | 51.6 | Low | 50.5 | Low | 157 Ų | 157 | 130.5 Ų | 130.5 | 84% | 0.84 | 70% | 0.703 | S | S | * | * | trans | -89.4 | 33.4 | -169.9 | -62.5 | -32.7 | 0 | 0 | 0 | 115.7 | L151 | D149-L151 PolarHBondContact O-N 3.36Š| ||
| 150 | R | 49.3 | Very low | 50.4 | Low | 248 Ų | 248 | 124.1 Ų | 124.1 | 94% | 0.936 | 69% | 0.694 | S | S | * | * | trans | -78.2 | 2.9 | 175.7 | -117.2 | -173.3 | 177.7 | -166.1 | -0.2 | 114.3 | S148 | S148-R150 VanDerWaalsContact C-N 3.27Å; S148-R150 PolarHBondContact O-N 3.28Å | ||
| 151 | L | 51.4 | Low | 49.9 | Very low | 150 Ų | 150 | 125.8 Ų | 125.8 | 79% | 0.785 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -102.6 | 104.2 | 159.1 | -78.9 | 82.6 | 0 | 0 | 0 | 105.6 | D149 | D149-L151 PolarHBondContact O-N 3.36Š|
| 152 | S | 51.9 | Low | 49.5 | Very low | 51 Ų | 51 | 125.1 Ų | 125.1 | 36% | 0.357 | 70% | 0.704 | S | S | . | * | 174.7 | 35.7 | 85.4 | -108.8 | 0 | 0 | 0 | 0 | 112.5 | F154 T155 A156 | S152-F154 PolarHBondContact O-N 2.95Å; S152-T155 WeakPolarHBondContact CB-OG1 3.43Å; S152-T155 WeakPolarHBondContact O-CA 3.26Å; S152-T155 PolarHBondContact O-N 3.34Å; S152-T155 WeakPolarHBondContact OG-CB 3.34Å; S152-T155 PolarHBondContact OG-OG1 2.91Å; S152-A156 PolarHBondContact O-N 3.18Å | |||
| 153 | Y | 49.6 | Very low | 49 | Very low | 187 Ų | 187 | 128.5 Ų | 128.5 | 73% | 0.733 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -56.1 | -34.6 | 168 | -115.7 | -89.7 | 0 | 0 | 0 | 110.9 | T155 V157 | Y153-T155 VanDerWaalsContact C-N 3.29Å; Y153-T155 PolarHBondContact O-N 3.47Å; Y153-V157 WeakPolarHBondContact O-CB 3.3Å; Y153-V157 WeakPolarHBondContact O-CG2 3.12Å; Y153-V157 PolarHBondContact O-N 2.91Å; Y153-V157 VanDerWaalsContact O-N 3.13Å |
| 154 | F | 49.9 | Very low | 48.6 | Very low | 176 Ų | 176 | 127.3 Ų | 127.3 | 77% | 0.772 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -71 | -19.3 | 173.1 | -119.5 | -87.3 | 0 | 0 | 0 | 114.6 | S152 R158 | S152-F154 PolarHBondContact O-N 2.95Å; F154-R158 WeakPolarHBondContact O-CB 3.46Å; F154-R158 PolarHBondContact O-N 3.45Å |
| 155 | T | 53.6 | Low | 48.7 | Very low | 82 Ų | 82 | 130.4 Ų | 130.4 | 50% | 0.503 | 71% | 0.713 | S | S | . | * | H | α-helix | trans | -93.5 | -35.6 | 179 | -46.2 | 0 | 0 | 0 | 0 | 111.1 | S152 Y153 V157 R158 S159 | S152-T155 WeakPolarHBondContact CB-OG1 3.43Å; S152-T155 WeakPolarHBondContact O-CA 3.26Å; S152-T155 PolarHBondContact O-N 3.34Å; S152-T155 WeakPolarHBondContact OG-CB 3.34Å; S152-T155 PolarHBondContact OG-OG1 2.91Å; Y153-T155 VanDerWaalsContact C-N 3.29Å; Y153-T155 PolarHBondContact O-N 3.47Å; T155-V157 VanDerWaalsContact C-N 3.34Å; T155-R158 PolarHBondContact O-N 2.89Å; T155-S159 PolarHBondContact O-N 3.45Å; T155-S159 PolarHBondContact O-OG 3.41Å; T155-S159 VanDerWaalsContact O-OG 3.13Å |
| 156 | A | 50.8 | Low | 49.2 | Very low | 60 Ų | 60 | 133.3 Ų | 133.3 | 50% | 0.496 | 72% | 0.719 | S | S | . | * | H | α-helix | trans | -65.3 | -36.3 | 171 | 0 | 0 | 0 | 0 | 0 | 112.1 | S152 S159 A160 | S152-A156 PolarHBondContact O-N 3.18Å; A156-S159 PolarHBondContact O-OG 3.35Å; A156-A160 PolarHBondContact O-N 3.47Å |
| 157 | V | 52.9 | Low | 49.1 | Very low | 100 Ų | 100 | 134.6 Ų | 134.6 | 61% | 0.606 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -78.1 | -21.8 | 175.6 | 178.5 | 0 | 0 | 0 | 0 | 112.3 | Y153 T155 | Y153-V157 WeakPolarHBondContact O-CB 3.3Å; Y153-V157 WeakPolarHBondContact O-CG2 3.12Å; Y153-V157 PolarHBondContact O-N 2.91Å; Y153-V157 VanDerWaalsContact O-N 3.13Å; T155-V157 VanDerWaalsContact C-N 3.34Å |
| 158 | R | 51.3 | Low | 49.2 | Very low | 204 Ų | 204 | 132.9 Ų | 132.9 | 77% | 0.77 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -83.1 | -25.3 | 172.6 | -98.7 | -172.6 | 175 | 170.6 | 0.5 | 114.1 | F154 T155 A160 | F154-R158 WeakPolarHBondContact O-CB 3.46Å; F154-R158 PolarHBondContact O-N 3.45Å; T155-R158 PolarHBondContact O-N 2.89Å; R158-A160 VanDerWaalsContact C-N 3.35Å |
| 159 | S | 49.1 | Very low | 49 | Very low | 97 Ų | 97 | 134.2 Ų | 134.2 | 68% | 0.678 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -79.6 | -19 | 172 | 50.8 | 0 | 0 | 0 | 0 | 112.6 | T155 A156 K161 | T155-S159 PolarHBondContact O-N 3.45Å; T155-S159 PolarHBondContact O-OG 3.41Å; T155-S159 VanDerWaalsContact O-OG 3.13Å; A156-S159 PolarHBondContact O-OG 3.35Å; S159-K161 PolarHBondContact O-N 3.29Å |
| 160 | A | 47.5 | Very low | 48.9 | Very low | 70 Ų | 70 | 133 Ų | 133 | 58% | 0.579 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -75 | 60.8 | 164.2 | 0 | 0 | 0 | 0 | 0 | 111 | A156 R158 V162 | A156-A160 PolarHBondContact O-N 3.47Å; R158-A160 VanDerWaalsContact C-N 3.35Å; A160-V162 PolarHBondContact O-N 2.88Å |
| 161 | K | 42.7 | Very low | 48.9 | Very low | 179 Ų | 179 | 126.6 Ų | 126.6 | 78% | 0.778 | 72% | 0.721 | S | S | * | * | trans | -70.8 | 94.7 | 172.9 | -173.2 | 171.9 | 179.4 | 173.4 | 0 | 109.1 | S159 T163 | S159-K161 PolarHBondContact O-N 3.29Å; K161-T163 PolarHBondContact O-N 2.88Å; K161-T163 VanDerWaalsContact O-N 3.13Å | ||
| 162 | V | 44.4 | Very low | 48.7 | Very low | 123 Ų | 123 | 125.2 Ų | 125.2 | 75% | 0.745 | 72% | 0.718 | S | S | * | * | trans | 14.6 | 86.8 | 142.3 | -170.4 | 0 | 0 | 0 | 0 | 114.1 | A160 | A160-V162 PolarHBondContact O-N 2.88Š| ||
| 163 | T | 45 | Very low | 48.5 | Very low | 149 Ų | 149 | 129.9 Ų | 129.9 | 91% | 0.914 | 74% | 0.74 | S | S | * | * | trans | -96.8 | 75.6 | 155.9 | -45.6 | 0 | 0 | 0 | 0 | 106.9 | K161 | K161-T163 PolarHBondContact O-N 2.88Å; K161-T163 VanDerWaalsContact O-N 3.13Å | ||
| 164 | S | 45.6 | Very low | 48.5 | Very low | 83 Ų | 83 | 126.1 Ų | 126.1 | 58% | 0.58 | 74% | 0.741 | S | S | * | * | trans | -118.6 | 103.6 | 168.5 | 178.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 165 | T | 52.6 | Low | 48.3 | Very low | 139 Ų | 139 | 122.5 Ų | 122.5 | 85% | 0.853 | 74% | 0.738 | S | S | * | * | trans | -140.9 | 101.3 | 147.4 | 34.7 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 166 | T | 53.1 | Low | 47.9 | Very low | 120 Ų | 120 | 125.6 Ų | 125.6 | 74% | 0.736 | 76% | 0.756 | S | S | * | * | trans | -53.3 | 126 | 168.1 | 40.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 167 | A | 43.4 | Very low | 47.7 | Very low | 102 Ų | 102 | 131.1 Ų | 131.1 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | trans | -70.7 | 125.4 | 154.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 168 | V | 44.7 | Very low | 47.2 | Very low | 207 Ų | 207 | 133.9 Ų | 133.9 | 100% | 1.255 | 79% | 0.794 | S | S | * | * | trans | -83.4 | 0 | 162.9 | -174.7 | 0 | 0 | 0 | 0 | 107.7 |
Retrieved 168 of 168 residues in 56 ms
(Link to these results)