| 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 | 50.8 | Low | 54.8 | Low | 246 Ų | 246 | 149.8 Ų | 149.8 | 100% | 1.212 | 83% | 0.826 | S | S | * | * | 0 | 105 | 0 | -86.8 | 168.1 | 169.9 | 0 | 0 | 108.3 | |||||
| 2 | A | 46.6 | Very low | 55.2 | Low | 106 Ų | 106 | 153.3 Ų | 153.3 | 88% | 0.876 | 82% | 0.82 | S | S | * | * | trans | -90.1 | 127.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | S4 | A2-S4 PolarHBondContact O-N 2.73Š| ||
| 3 | M | 53 | Low | 56.3 | Low | 188 Ų | 188 | 151.1 Ų | 151.1 | 93% | 0.926 | 82% | 0.815 | S | S | * | * | trans | -80.6 | 102.1 | 175.5 | -61.2 | -171.7 | 93.5 | 0 | 0 | 108.6 | S5 | M3-S5 PolarHBondContact O-N 2.65Š| ||
| 4 | S | 49.1 | Very low | 57.2 | Low | 93 Ų | 93 | 148.7 Ų | 148.7 | 65% | 0.65 | 80% | 0.802 | S | S | * | * | trans | -69.2 | 112.5 | 170.2 | -173.5 | 0 | 0 | 0 | 0 | 108.8 | A2 | A2-S4 PolarHBondContact O-N 2.73Š| ||
| 5 | S | 54.8 | Low | 57.6 | Low | 103 Ų | 103 | 143.3 Ų | 143.3 | 72% | 0.72 | 78% | 0.778 | S | S | * | * | trans | -87.8 | 111 | 174 | 48.5 | 0 | 0 | 0 | 0 | 109.9 | M3 L7 | M3-S5 PolarHBondContact O-N 2.65Å; S5-L7 PolarHBondContact O-N 3.49Å | ||
| 6 | Y | 52.7 | Low | 58.9 | Low | 197 Ų | 197 | 147 Ų | 147 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | -65.5 | 95.3 | 171.6 | -47 | -89.7 | 0 | 0 | 0 | 109.7 | I8 | Y6-I8 VanDerWaalsContact C-N 3.28Å; Y6-I8 PolarHBondContact O-N 3.32Å; Y6-I8 VanDerWaalsContact O-N 3.12Å | ||
| 7 | L | 67.1 | Low | 59 | Low | 161 Ų | 161 | 148.3 Ų | 148.3 | 84% | 0.843 | 78% | 0.782 | S | S | * | * | trans | -77 | 91.1 | 157.9 | -77.5 | 173.3 | 0 | 0 | 0 | 107.3 | S5 N9 | S5-L7 PolarHBondContact O-N 3.49Å; L7-N9 PolarHBondContact O-N 3.39Å | ||
| 8 | I | 61 | Low | 59.8 | Low | 136 Ų | 136 | 144.6 Ų | 144.6 | 70% | 0.697 | 77% | 0.768 | S | S | * | * | trans | -51.2 | 126.3 | 166.4 | -120.6 | 80.5 | 0 | 0 | 0 | 107.6 | Y6 S10 | Y6-I8 VanDerWaalsContact C-N 3.28Å; Y6-I8 PolarHBondContact O-N 3.32Å; Y6-I8 VanDerWaalsContact O-N 3.12Å; I8-S10 PolarHBondContact O-N 3.46Å | ||
| 9 | N | 52.8 | Low | 60.2 | Low | 160 Ų | 160 | 142.1 Ų | 142.1 | 86% | 0.856 | 76% | 0.76 | S | S | * | * | trans | -51.3 | 97.6 | 177 | -60.8 | 13 | 0 | 0 | 0 | 110.2 | L7 | L7-N9 PolarHBondContact O-N 3.39Š| ||
| 10 | S | 53.7 | Low | 59.9 | Low | 96 Ų | 96 | 140.7 Ų | 140.7 | 67% | 0.671 | 76% | 0.761 | S | S | * | * | trans | -99.4 | 115.6 | 162.4 | -68 | 0 | 0 | 0 | 0 | 105.9 | I8 Y12 | I8-S10 PolarHBondContact O-N 3.46Å; S10-Y12 PolarHBondContact O-N 2.79Å | ||
| 11 | N | 61.1 | Low | 59.9 | Low | 162 Ų | 162 | 141.8 Ų | 141.8 | 87% | 0.866 | 76% | 0.761 | S | S | * | * | trans | -62 | 83 | 166.8 | -81 | -63.7 | 0 | 0 | 0 | 108.1 | V13 | N11-V13 VanDerWaalsContact C-N 3.35Å; N11-V13 PolarHBondContact O-N 3.11Å | ||
| 12 | Y | 60.3 | Low | 60.1 | Low | 191 Ų | 191 | 136.7 Ų | 136.7 | 75% | 0.749 | 73% | 0.734 | S | S | * | * | trans | -76.2 | 92.2 | 174.6 | -168.7 | -90.2 | 0 | 0 | 0 | 106.9 | S10 D14 | S10-Y12 PolarHBondContact O-N 2.79Å; Y12-D14 PolarHBondContact O-N 3.39Å; Y12-D14 VanDerWaalsContact O-N 3.16Å | ||
| 13 | V | 68.6 | Low | 60.4 | Low | 125 Ų | 125 | 140.7 Ų | 140.7 | 76% | 0.758 | 73% | 0.728 | S | S | * | * | trans | -73.1 | 104.8 | 168.5 | -179.5 | 0 | 0 | 0 | 0 | 106.3 | N11 P15 | N11-V13 VanDerWaalsContact C-N 3.35Å; N11-V13 PolarHBondContact O-N 3.11Å; V13-P15 WeakPolarHBondContact O-CD 3.36Å | ||
| 14 | D | 69.3 | Low | 60.5 | Low | 118 Ų | 118 | 136.9 Ų | 136.9 | 63% | 0.631 | 72% | 0.72 | S | S | * | * | trans | -58.7 | 119 | 173.4 | -169.2 | 26.2 | 0 | 0 | 0 | 108.5 | Y12 K16 | Y12-D14 PolarHBondContact O-N 3.39Å; Y12-D14 VanDerWaalsContact O-N 3.16Å; D14-K16 PolarHBondContact O-N 3.39Å | ||
| 15 | P | 63.3 | Low | 60.8 | Low | 68 Ų | 68 | 140 Ų | 140 | 44% | 0.442 | 72% | 0.724 | S | S | . | * | trans | -61.9 | 108.7 | 179.9 | 22.8 | -31 | 0 | 0 | 0 | 109.2 | V13 F17 | V13-P15 WeakPolarHBondContact O-CD 3.36Å; P15-F17 HydrophobicContact CB-CE2 4.39Å; P15-F17 HydrophobicContact CG-CE2 4.08Å; P15-F17 WeakPolarHBondContact O-CD2 3.17Å; P15-F17 PolarHBondContact O-N 3.11Å | ||
| 16 | K | 77.9 | Confident | 60.3 | Low | 202 Ų | 202 | 139.8 Ų | 139.8 | 88% | 0.878 | 72% | 0.715 | S | S | * | * | trans | -67.1 | 96.6 | 175.7 | -169.4 | 89.7 | 177 | -175.3 | 0 | 108.6 | D14 | D14-K16 PolarHBondContact O-N 3.39Š| ||
| 17 | F | 60.9 | Low | 60.3 | Low | 169 Ų | 169 | 138.2 Ų | 138.2 | 74% | 0.741 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 133.5 | 171.1 | -71.1 | -83.8 | 0 | 0 | 0 | 109.5 | P15 | P15-F17 HydrophobicContact CB-CE2 4.39Å; P15-F17 HydrophobicContact CG-CE2 4.08Å; P15-F17 WeakPolarHBondContact O-CD2 3.17Å; P15-F17 PolarHBondContact O-N 3.11Å |
| 18 | P | 73.1 | Confident | 59.6 | Low | 81 Ų | 81 | 139.7 Ų | 139.7 | 53% | 0.526 | 72% | 0.716 | S | S | . | * | P | Polyproline II helix | trans | -55.9 | 141.9 | 175.3 | -22.2 | 31.5 | 0 | 0 | 0 | 110.7 | C20 | P18-C20 PolarHBondContact O-N 3.27Š|
| 19 | P | 67.3 | Low | 59.2 | Low | 97 Ų | 97 | 140.6 Ų | 140.6 | 63% | 0.63 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -55 | 131.3 | 172.8 | -19.4 | 30.3 | 0 | 0 | 0 | 110.2 | E21 E22 | P19-E21 PolarHBondContact O-N 2.96Å; P19-E22 PolarHBondContact O-N 3.28Å |
| 20 | C | 55.6 | Low | 59 | Low | 114 Ų | 114 | 137.7 Ų | 137.7 | 77% | 0.77 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -60.7 | -12.3 | -177 | -70.5 | 0 | 0 | 0 | 0 | 114.6 | P18 E22 Y23 | P18-C20 PolarHBondContact O-N 3.27Å; C20-E22 PolarHBondContact O-N 3.42Å; C20-Y23 PolarHBondContact O-N 3.16Å |
| 21 | E | 59.6 | Low | 58.8 | Low | 164 Ų | 164 | 138.8 Ų | 138.8 | 77% | 0.766 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -65 | -25.9 | -177.3 | -72.4 | -171.7 | 150.8 | 0 | 0 | 113.2 | P19 Y23 S24 | P19-E21 PolarHBondContact O-N 2.96Å; E21-Y23 VanDerWaalsContact C-N 3.28Å; E21-Y23 PolarHBondContact O-N 3.31Å; E21-S24 PolarHBondContact O-OG 3.08Å |
| 22 | E | 54 | Low | 58.2 | Low | 139 Ų | 139 | 138.7 Ų | 138.7 | 65% | 0.65 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -78.4 | -12.5 | -178.1 | -139.1 | 174.3 | -174.3 | 0 | 0 | 113.4 | P19 C20 N26 | P19-E22 PolarHBondContact O-N 3.28Å; C20-E22 PolarHBondContact O-N 3.42Å; E22-N26 PolarHBondContact O-ND2 3.24Å |
| 23 | Y | 54.1 | Low | 57.5 | Low | 190 Ų | 190 | 132.4 Ų | 132.4 | 75% | 0.745 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -85 | -18.5 | 179.5 | -85.3 | -79.6 | 0 | 0 | 0 | 114.1 | C20 E21 Q25 | C20-Y23 PolarHBondContact O-N 3.16Å; E21-Y23 VanDerWaalsContact C-N 3.28Å; E21-Y23 PolarHBondContact O-N 3.31Å; Y23-Q25 VanDerWaalsContact C-N 3.33Å |
| 24 | S | 55.2 | Low | 56.8 | Low | 108 Ų | 108 | 131.9 Ų | 131.9 | 76% | 0.755 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -85.6 | -7.2 | 177.9 | 67.4 | 0 | 0 | 0 | 0 | 113.8 | E21 | E21-S24 PolarHBondContact O-OG 3.08Š|
| 25 | Q | 54.1 | Low | 55.8 | Low | 158 Ų | 158 | 130.9 Ų | 130.9 | 74% | 0.738 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -101.6 | 2 | -169.7 | -150.3 | 154.4 | -2.4 | 0 | 0 | 113.8 | Y23 | Y23-Q25 VanDerWaalsContact C-N 3.33Š|
| 26 | N | 45.2 | Very low | 55.3 | Low | 99 Ų | 99 | 136.4 Ų | 136.4 | 53% | 0.529 | 70% | 0.704 | S | S | . | * | trans | -109 | 98.2 | 179.9 | -83.3 | -60.4 | 0 | 0 | 0 | 109.3 | E22 Y28 | E22-N26 PolarHBondContact O-ND2 3.24Å; N26-Y28 HydrophobicContact CB-CD2 3.85Å; N26-Y28 PolarHBondContact O-N 3.12Å | ||
| 27 | D | 52.5 | Low | 53.9 | Low | 165 Ų | 165 | 136.9 Ų | 136.9 | 88% | 0.882 | 70% | 0.702 | S | S | * | * | trans | -63.9 | 49.3 | 165.2 | -74 | -57.1 | 0 | 0 | 0 | 111.7 | L29 | D27-L29 VanDerWaalsContact C-N 3.27Å; D27-L29 PolarHBondContact O-N 2.68Å | ||
| 28 | Y | 52.1 | Low | 53.3 | Low | 192 Ų | 192 | 131.8 Ų | 131.8 | 75% | 0.753 | 69% | 0.687 | S | S | * | * | trans | -93 | 24.2 | 177.7 | -90.9 | -87.2 | 0 | 0 | 0 | 112.6 | N26 | N26-Y28 HydrophobicContact CB-CD2 3.85Å; N26-Y28 PolarHBondContact O-N 3.12Å | ||
| 29 | L | 51.9 | Low | 51.8 | Low | 154 Ų | 154 | 131.5 Ų | 131.5 | 81% | 0.806 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -107.1 | 105.7 | 157.4 | -74.3 | 172.5 | 0 | 0 | 0 | 106.7 | D27 S31 | D27-L29 VanDerWaalsContact C-N 3.27Å; D27-L29 PolarHBondContact O-N 2.68Å; L29-S31 PolarHBondContact O-N 2.85Å |
| 30 | P | 49.1 | Very low | 50.8 | Low | 99 Ų | 99 | 135.6 Ų | 135.6 | 64% | 0.643 | 70% | 0.703 | S | S | * | * | trans | -46.5 | 122.3 | 159.9 | -25.3 | 34.4 | 0 | 0 | 0 | 107.2 | H32 | P30-H32 PolarHBondContact O-N 2.81Š| ||
| 31 | S | 49.2 | Very low | 50.6 | Low | 120 Ų | 120 | 140.8 Ų | 140.8 | 84% | 0.839 | 71% | 0.706 | S | S | * | * | trans | -56.8 | 88.8 | 177.7 | 33 | 0 | 0 | 0 | 0 | 108.8 | L29 S33 | L29-S31 PolarHBondContact O-N 2.85Å; S31-S33 VanDerWaalsContact C-N 3.33Å; S31-S33 PolarHBondContact O-N 3.41Å | ||
| 32 | H | 49.9 | Very low | 50.3 | Low | 159 Ų | 159 | 143.6 Ų | 143.6 | 74% | 0.736 | 71% | 0.71 | S | S | * | * | trans | -65.5 | 103.6 | 164.7 | -76.9 | -52.5 | 0 | 0 | 0 | 105.7 | P30 | P30-H32 PolarHBondContact O-N 2.81Š| ||
| 33 | S | 45.3 | Very low | 49.5 | Very low | 60 Ų | 60 | 145.5 Ų | 145.5 | 42% | 0.42 | 72% | 0.719 | S | S | . | * | trans | -41.9 | 136.2 | 173.3 | -179.9 | 0 | 0 | 0 | 0 | 109.4 | S31 D35 Y36 | S31-S33 VanDerWaalsContact C-N 3.33Å; S31-S33 PolarHBondContact O-N 3.41Å; S33-D35 PolarHBondContact O-N 3.1Å; S33-D35 PolarHBondContact OG-N 2.96Å; S33-D35 PolarHBondContact OG-OD2 3.28Å; S33-D35 VanDerWaalsContact OG-OD2 3.04Å; S33-Y36 PolarHBondContact O-N 3.38Å; S33-Y36 VanDerWaalsContact O-N 3.12Å | ||
| 34 | P | 52.9 | Low | 49.1 | Very low | 113 Ų | 113 | 140.7 Ų | 140.7 | 73% | 0.734 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.8 | -16.6 | 173.7 | -24 | 33.1 | 0 | 0 | 0 | 113.4 | Y36 | P34-Y36 VanDerWaalsContact C-N 3.32Å; P34-Y36 PolarHBondContact O-N 3.13Å |
| 35 | D | 49.4 | Very low | 48.5 | Very low | 98 Ų | 98 | 140.2 Ų | 140.2 | 52% | 0.524 | 71% | 0.713 | S | S | . | * | H | α-helix | trans | -72.5 | -17 | -179.1 | -58.5 | -44.6 | 0 | 0 | 0 | 115.2 | S33 Y37 S38 A39 | S33-D35 PolarHBondContact O-N 3.1Å; S33-D35 PolarHBondContact OG-N 2.96Å; S33-D35 PolarHBondContact OG-OD2 3.28Å; S33-D35 VanDerWaalsContact OG-OD2 3.04Å; D35-Y37 VanDerWaalsContact C-N 3.27Å; D35-Y37 PolarHBondContact O-N 3.37Å; D35-S38 VanDerWaalsContact CA-OG 3.3Å; D35-S38 WeakPolarHBondContact CA-OG 3.48Å; D35-S38 PolarHBondContact O-N 3.05Å; D35-S38 PolarHBondContact OD1-OG 3.02Å; D35-A39 VanDerWaalsContact O-CB 3.24Å; D35-A39 WeakPolarHBondContact O-CB 3.32Å; D35-A39 PolarHBondContact O-N 3.21Å |
| 36 | Y | 51.7 | Low | 47.6 | Very low | 183 Ų | 183 | 142.2 Ų | 142.2 | 72% | 0.718 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -64.7 | -32.4 | 178.9 | -167.8 | -95.4 | 0 | 0 | 0 | 112.6 | S33 P34 | S33-Y36 PolarHBondContact O-N 3.38Å; S33-Y36 VanDerWaalsContact O-N 3.12Å; P34-Y36 VanDerWaalsContact C-N 3.32Å; P34-Y36 PolarHBondContact O-N 3.13Å |
| 37 | Y | 48.7 | Very low | 47.7 | Very low | 212 Ų | 212 | 147 Ų | 147 | 83% | 0.831 | 74% | 0.739 | S | S | * | * | H | α-helix | trans | -93.7 | -17.8 | 173.9 | -79.1 | -83.9 | 0 | 0 | 0 | 113.4 | D35 | D35-Y37 VanDerWaalsContact C-N 3.27Å; D35-Y37 PolarHBondContact O-N 3.37Å |
| 38 | S | 49.1 | Very low | 46.6 | Very low | 63 Ų | 63 | 146.8 Ų | 146.8 | 44% | 0.441 | 74% | 0.737 | S | S | . | * | H | α-helix | trans | -88.4 | -29.9 | -178.2 | 85.3 | 0 | 0 | 0 | 0 | 112.9 | D35 Q40 R41 | D35-S38 VanDerWaalsContact CA-OG 3.3Å; D35-S38 WeakPolarHBondContact CA-OG 3.48Å; D35-S38 PolarHBondContact O-N 3.05Å; D35-S38 PolarHBondContact OD1-OG 3.02Å; S38-Q40 PolarHBondContact O-N 2.99Å; S38-Q40 VanDerWaalsContact O-N 3.14Å; S38-R41 PolarHBondContact O-N 3.06Å; S38-R41 VanDerWaalsContact O-N 3.14Å |
| 39 | A | 42.1 | Very low | 45.6 | Very low | 75 Ų | 75 | 145.1 Ų | 145.1 | 62% | 0.62 | 74% | 0.737 | S | S | * | * | G | 310 helix | trans | -68.2 | -11.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | D35 R41 | D35-A39 VanDerWaalsContact O-CB 3.24Å; D35-A39 WeakPolarHBondContact O-CB 3.32Å; D35-A39 PolarHBondContact O-N 3.21Å; A39-R41 PolarHBondContact O-N 3.01Å |
| 40 | Q | 45.5 | Very low | 45.2 | Very low | 183 Ų | 183 | 141.8 Ų | 141.8 | 86% | 0.855 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -83.3 | 2.9 | 174.3 | -148.4 | 127 | 24.4 | 0 | 0 | 113.5 | S38 | S38-Q40 PolarHBondContact O-N 2.99Å; S38-Q40 VanDerWaalsContact O-N 3.14Å |
| 41 | R | 52.1 | Low | 44.9 | Very low | 222 Ų | 222 | 143.5 Ų | 143.5 | 84% | 0.838 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -114.5 | 6.4 | -173.6 | -112.6 | -75.1 | -163.3 | -164.8 | 1.3 | 115.5 | S38 A39 | S38-R41 PolarHBondContact O-N 3.06Å; S38-R41 VanDerWaalsContact O-N 3.14Å; A39-R41 PolarHBondContact O-N 3.01Å |
| 42 | R | 53.4 | Low | 44.3 | Very low | 224 Ų | 224 | 148.4 Ų | 148.4 | 85% | 0.845 | 73% | 0.73 | S | S | * | * | trans | -153.7 | 107.1 | 164.3 | -80.9 | -160 | 174.9 | 131.7 | -1.9 | 111.5 | ||||
| 43 | E | 35.9 | Very low | 43.8 | Very low | 179 Ų | 179 | 148.5 Ų | 148.5 | 84% | 0.836 | 73% | 0.731 | S | S | * | * | trans | -132.3 | 147.5 | 137.7 | -94.4 | -65.8 | 105.4 | 0 | 0 | 108.5 | ||||
| 44 | P | 46.2 | Very low | 43.4 | Very low | 89 Ų | 89 | 152.5 Ų | 152.5 | 58% | 0.578 | 74% | 0.743 | S | S | * | * | trans | -93.5 | 165.3 | -168.7 | 37.9 | -30 | 0 | 0 | 0 | 112.6 | F46 | P44-F46 PolarHBondContact O-N 3.23Š| ||
| 45 | A | 42.8 | Very low | 42.4 | Very low | 97 Ų | 97 | 159.1 Ų | 159.1 | 80% | 0.802 | 75% | 0.753 | S | S | * | * | trans | 10.7 | 98.4 | 158.8 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 46 | F | 35 | Very low | 41.9 | Very low | 200 Ų | 200 | 159.1 Ų | 159.1 | 88% | 0.877 | 76% | 0.76 | S | S | * | * | trans | -119.4 | 119.4 | 142.3 | -87.2 | -85.7 | 0 | 0 | 0 | 108.5 | P44 N48 | P44-F46 PolarHBondContact O-N 3.23Å; F46-N48 PolarHBondContact O-N 3.05Å | ||
| 47 | Q | 46.8 | Very low | 41.1 | Very low | 201 Ų | 201 | 153.6 Ų | 153.6 | 94% | 0.939 | 76% | 0.76 | S | S | * | * | trans | -48.2 | 122.5 | 169.1 | -67.8 | 159.3 | -18.5 | 0 | 0 | 109 | ||||
| 48 | N | 29.7 | Very low | 40.2 | Very low | 159 Ų | 159 | 150.1 Ų | 150.1 | 85% | 0.85 | 76% | 0.764 | S | S | * | * | trans | -126.5 | 113.1 | 155.3 | -156.7 | 11.5 | 0 | 0 | 0 | 107.7 | F46 S50 | F46-N48 PolarHBondContact O-N 3.05Å; N48-S50 PolarHBondContact O-N 3.26Å | ||
| 49 | E | 30.8 | Very low | 39.6 | Very low | 158 Ų | 158 | 151.7 Ų | 151.7 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | trans | -51.4 | 126.7 | 179.1 | -72 | -153.5 | 96.9 | 0 | 0 | 112 | I51 | E49-I51 PolarHBondContact O-N 3.22Š| ||
| 50 | S | 43.6 | Very low | 39.4 | Very low | 84 Ų | 84 | 155.5 Ų | 155.5 | 59% | 0.587 | 79% | 0.792 | S | S | * | * | 28.5 | 67.3 | 114.1 | -47.7 | 0 | 0 | 0 | 0 | 117.5 | N48 | N48-S50 PolarHBondContact O-N 3.26Š| |||
| 51 | I | 42.8 | Very low | 39.5 | Very low | 134 Ų | 134 | 152.3 Ų | 152.3 | 69% | 0.687 | 79% | 0.787 | S | S | * | * | trans | -118.8 | 2.7 | 164.6 | -130.1 | 71.8 | 0 | 0 | 0 | 115.8 | E49 | E49-I51 PolarHBondContact O-N 3.22Š| ||
| 52 | Y | 36.6 | Very low | 39.4 | Very low | 223 Ų | 223 | 147.1 Ų | 147.1 | 88% | 0.875 | 78% | 0.782 | S | S | * | * | trans | -124 | 69.5 | 168.3 | -63.1 | -73 | 0 | 0 | 0 | 111.1 | Q54 | Y52-Q54 PolarHBondContact O-N 3.3Š| ||
| 53 | H | 39.8 | Very low | 38.7 | Very low | 162 Ų | 162 | 145.4 Ų | 145.4 | 75% | 0.75 | 78% | 0.777 | S | S | * | * | trans | -64.9 | 110.4 | 155.4 | -82.9 | 84.6 | 0 | 0 | 0 | 109 | ||||
| 54 | Q | 37.2 | Very low | 38.8 | Very low | 144 Ų | 144 | 142.4 Ų | 142.4 | 67% | 0.673 | 77% | 0.77 | S | S | * | * | 40.7 | 103.8 | 122.4 | -156.8 | 84 | 59.3 | 0 | 0 | 116.9 | Y52 S56 | Y52-Q54 PolarHBondContact O-N 3.3Å; Q54-S56 PolarHBondContact NE2-OG 3.33Å | |||
| 55 | R | 30.8 | Very low | 38.3 | Very low | 252 Ų | 252 | 142.5 Ų | 142.5 | 95% | 0.951 | 77% | 0.769 | S | S | * | * | -126.9 | 97.9 | 127.4 | -84.4 | -162 | -165.1 | -93.6 | 0.9 | 109.2 | |||||
| 56 | S | 39.7 | Very low | 38 | Very low | 97 Ų | 97 | 144.2 Ų | 144.2 | 68% | 0.678 | 77% | 0.774 | S | S | * | * | trans | -70.9 | 148.6 | 149.2 | -72.5 | 0 | 0 | 0 | 0 | 108.8 | Q54 | Q54-S56 PolarHBondContact NE2-OG 3.33Š| ||
| 57 | G | 34.8 | Very low | 38.1 | Very low | 68 Ų | 68 | 143.5 Ų | 143.5 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | trans | 134.6 | 97.6 | 158.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 58 | C | 30.1 | Very low | 37.5 | Very low | 138 Ų | 138 | 137.5 Ų | 137.5 | 93% | 0.932 | 77% | 0.766 | S | S | * | * | -168.2 | 138.7 | 105.3 | -92.7 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 59 | A | 36 | Very low | 37.7 | Very low | 97 Ų | 97 | 136.2 Ų | 136.2 | 80% | 0.802 | 77% | 0.769 | S | S | * | * | trans | -79.5 | 155.8 | -173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 60 | D | 38.3 | Very low | 37.9 | Very low | 155 Ų | 155 | 132.5 Ų | 132.5 | 83% | 0.829 | 77% | 0.773 | S | S | * | * | trans | -55.4 | 156.4 | 147.4 | -69.2 | -51.1 | 0 | 0 | 0 | 109.3 | ||||
| 61 | P | 47.8 | Very low | 37.6 | Very low | 116 Ų | 116 | 136.7 Ų | 136.7 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | cis | -151.1 | -139.8 | 40.7 | 35.6 | -8.4 | 0 | 0 | 0 | 112.6 | ||||
| 62 | P | 48.2 | Very low | 37.8 | Very low | 112 Ų | 112 | 136 Ų | 136 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | -117 | 173 | -71.1 | 29.8 | -10.8 | 0 | 0 | 0 | 113.8 | |||||
| 63 | Y | 40.1 | Very low | 37.6 | Very low | 189 Ų | 189 | 129 Ų | 129 | 74% | 0.741 | 78% | 0.776 | S | S | * | * | trans | 30.9 | 133.6 | 153.2 | 142.6 | -84.9 | 0 | 0 | 0 | 120.9 | ||||
| 64 | T | 36.9 | Very low | 37.5 | Very low | 115 Ų | 115 | 128.2 Ų | 128.2 | 71% | 0.706 | 78% | 0.782 | S | S | * | * | -165.8 | 133.5 | 127.1 | -68.7 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 65 | T | 36.1 | Very low | 37.7 | Very low | 91 Ų | 91 | 127.2 Ų | 127.2 | 56% | 0.558 | 79% | 0.786 | S | S | * | * | trans | -59.9 | 147.6 | 170.3 | -65.9 | 0 | 0 | 0 | 0 | 114.6 | Q67 | T65-Q67 HydrophobicContact CG2-CG 4.11Š| ||
| 66 | C | 36.5 | Very low | 38.2 | Very low | 133 Ų | 133 | 123.9 Ų | 123.9 | 90% | 0.899 | 78% | 0.783 | S | S | * | * | trans | -136.8 | 115.8 | 146.5 | 27.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 67 | Q | 38.3 | Very low | 38.3 | Very low | 185 Ų | 185 | 124.5 Ų | 124.5 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | trans | -75.3 | 145.7 | 170.3 | -75.7 | 168.2 | -17.2 | 0 | 0 | 111.2 | T65 | T65-Q67 HydrophobicContact CG2-CG 4.11Š| ||
| 68 | G | 33.7 | Very low | 38.9 | Very low | 76 Ų | 76 | 126.4 Ų | 126.4 | 78% | 0.784 | 79% | 0.788 | S | S | * | * | 118.8 | 143.7 | 121.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 69 | S | 33.9 | Very low | 39.1 | Very low | 131 Ų | 131 | 131 Ų | 131 | 92% | 0.916 | 79% | 0.786 | S | S | * | * | cis | -166.8 | 155.3 | 9.8 | 47.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 70 | G | 33.9 | Very low | 38.8 | Very low | 80 Ų | 80 | 130.1 Ų | 130.1 | 83% | 0.825 | 79% | 0.786 | S | S | * | * | trans | 145.5 | 79.2 | 165.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 71 | Q | 37.9 | Very low | 39.1 | Very low | 173 Ų | 173 | 131 Ų | 131 | 81% | 0.808 | 78% | 0.784 | S | S | * | * | trans | -76.7 | 179 | 164.8 | -72.7 | -78 | -3.1 | 0 | 0 | 110.9 | ||||
| 72 | P | 46.9 | Very low | 38.5 | Very low | 118 Ų | 118 | 132.6 Ų | 132.6 | 77% | 0.766 | 79% | 0.792 | S | S | * | * | cis | -135.8 | 159.8 | 6.5 | 27.8 | -3.9 | 0 | 0 | 0 | 118.4 | ||||
| 73 | A | 33.7 | Very low | 38.3 | Very low | 77 Ų | 77 | 135 Ų | 135 | 64% | 0.636 | 80% | 0.797 | S | S | * | * | trans | 12.1 | 130.3 | 141.6 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 74 | V | 37.4 | Very low | 38.7 | Very low | 145 Ų | 145 | 131 Ų | 131 | 88% | 0.879 | 80% | 0.795 | S | S | * | * | -136.7 | 120.4 | 126.4 | -172.5 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 75 | V | 40.6 | Very low | 39.3 | Very low | 123 Ų | 123 | 132 Ų | 132 | 75% | 0.745 | 80% | 0.803 | S | S | * | * | trans | -68.5 | 131.1 | 170.4 | 163.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 76 | M | 40.9 | Very low | 39.3 | Very low | 183 Ų | 183 | 132.7 Ų | 132.7 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | trans | -156.1 | 112.3 | 144.6 | -75.2 | -144.7 | 88.5 | 0 | 0 | 112 | ||||
| 77 | S | 41.8 | Very low | 39.1 | Very low | 110 Ų | 110 | 129.6 Ų | 129.6 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -143.4 | 149.3 | 145.1 | -116.8 | 0 | 0 | 0 | 0 | 104.2 | ||||
| 78 | P | 47.9 | Very low | 38.8 | Very low | 108 Ų | 108 | 128.6 Ų | 128.6 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | -154.1 | -179.4 | 55.1 | 37.3 | -14.6 | 0 | 0 | 0 | 116.8 | |||||
| 79 | R | 34.1 | Very low | 38.9 | Very low | 235 Ų | 235 | 129.3 Ų | 129.3 | 89% | 0.887 | 80% | 0.802 | S | S | * | * | trans | 75.7 | 128.1 | 143.2 | -105.2 | 174 | 162.1 | 160 | -5.9 | 120.3 | ||||
| 80 | G | 30.4 | Very low | 38.9 | Very low | 78 Ų | 78 | 129.4 Ų | 129.4 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -179 | 95.3 | 157.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 81 | H | 43.8 | Very low | 39.3 | Very low | 173 Ų | 173 | 130.9 Ų | 130.9 | 80% | 0.801 | 79% | 0.792 | S | S | * | * | trans | -69.3 | 137.9 | 162.5 | -75.5 | -95.6 | 0 | 0 | 0 | 110.2 | ||||
| 82 | V | 36.3 | Very low | 39.1 | Very low | 150 Ų | 150 | 130.5 Ų | 130.5 | 91% | 0.909 | 80% | 0.795 | S | S | * | * | trans | -145.9 | 128 | 147.2 | -174.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 83 | L | 43.9 | Very low | 39.2 | Very low | 161 Ų | 161 | 130.2 Ų | 130.2 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 169.3 | 174.8 | -89.1 | 144.5 | 0 | 0 | 0 | 112.9 | ||
| 84 | P | 48.2 | Very low | 39.2 | Very low | 107 Ų | 107 | 133.6 Ų | 133.6 | 70% | 0.695 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -82 | 164.5 | 179.6 | 36.4 | -33.5 | 0 | 0 | 0 | 111.3 | ||
| 85 | P | 49.2 | Very low | 39.5 | Very low | 134 Ų | 134 | 132.1 Ų | 132.1 | 87% | 0.87 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -94.8 | 127.5 | 163.8 | 32.9 | -24.8 | 0 | 0 | 0 | 110.8 | ||
| 86 | A | 35.6 | Very low | 39.2 | Very low | 106 Ų | 106 | 129.6 Ų | 129.6 | 88% | 0.876 | 78% | 0.777 | S | S | * | * | trans | -105.7 | 149.2 | 157.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 87 | G | 32.6 | Very low | 39.2 | Very low | 69 Ų | 69 | 130 Ų | 130 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | trans | 134.2 | 119.7 | 147.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 88 | L | 32.2 | Very low | 39.2 | Very low | 164 Ų | 164 | 132.3 Ų | 132.3 | 86% | 0.859 | 77% | 0.774 | S | S | * | * | trans | 146 | 96.3 | 132.9 | -75.4 | 164.8 | 0 | 0 | 0 | 109.6 | ||||
| 89 | S | 36 | Very low | 38.6 | Very low | 91 Ų | 91 | 132.6 Ų | 132.6 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | 54.6 | 126.7 | 91.7 | 63.1 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 90 | T | 33.4 | Very low | 38.6 | Very low | 132 Ų | 132 | 127.1 Ų | 127.1 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | -177.3 | -170.9 | 58.3 | -19.5 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 91 | P | 43.5 | Very low | 38.8 | Very low | 111 Ų | 111 | 129 Ų | 129 | 72% | 0.721 | 77% | 0.767 | S | S | * | * | -124.2 | 175.7 | -129.3 | 38.9 | -17.1 | 0 | 0 | 0 | 118.3 | |||||
| 92 | L | 31.9 | Very low | 38.8 | Very low | 166 Ų | 166 | 127 Ų | 127 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | trans | 78.7 | 154.1 | 147.6 | -157.9 | 70.1 | 0 | 0 | 0 | 119.7 | ||||
| 93 | P | 49 | Very low | 39.5 | Very low | 112 Ų | 112 | 125.2 Ų | 125.2 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | cis | -122.4 | 172.4 | -16.1 | 17.2 | 7.3 | 0 | 0 | 0 | 116.7 | ||||
| 94 | E | 34.3 | Very low | 39.6 | Very low | 148 Ų | 148 | 123.1 Ų | 123.1 | 69% | 0.692 | 75% | 0.752 | S | S | * | * | trans | -48 | 164.1 | 161.9 | -139.2 | -161.6 | 100.4 | 0 | 0 | 115.9 | S96 | E94-S96 WeakPolarHBondContact OE1-CA 3.45Å; E94-S96 WeakPolarHBondContact OE1-CB 3.25Å; E94-S96 PolarHBondContact OE1-N 3.04Å; E94-S96 PolarHBondContact OE1-OG 3.08Å | ||
| 95 | P | 43.6 | Very low | 39.8 | Very low | 113 Ų | 113 | 122.9 Ų | 122.9 | 73% | 0.734 | 75% | 0.753 | S | S | * | * | -141.3 | 129.4 | 84.6 | 33.9 | -15.8 | 0 | 0 | 0 | 116.3 | |||||
| 96 | S | 34.7 | Very low | 40.6 | Very low | 71 Ų | 71 | 121.9 Ų | 121.9 | 50% | 0.497 | 75% | 0.746 | S | S | . | * | 59.7 | 84.5 | 118.3 | -31.5 | 0 | 0 | 0 | 0 | 119.1 | E94 | E94-S96 WeakPolarHBondContact OE1-CA 3.45Å; E94-S96 WeakPolarHBondContact OE1-CB 3.25Å; E94-S96 PolarHBondContact OE1-N 3.04Å; E94-S96 PolarHBondContact OE1-OG 3.08Å | |||
| 97 | H | 40.1 | Very low | 41.8 | Very low | 192 Ų | 192 | 122.2 Ų | 122.2 | 89% | 0.889 | 74% | 0.74 | S | S | * | * | trans | -133.4 | 95.2 | 140.8 | -75.3 | -65.8 | 0 | 0 | 0 | 110.4 | C99 | H97-C99 PolarHBondContact O-N 3.28Š| ||
| 98 | H | 42.2 | Very low | 42.7 | Very low | 157 Ų | 157 | 124.8 Ų | 124.8 | 73% | 0.727 | 74% | 0.744 | S | S | * | * | trans | -52.8 | 121.2 | 163.4 | 176.6 | 67.8 | 0 | 0 | 0 | 110.7 | D100 | H98-D100 IonicContact CE1-OD1 3.11Å; H98-D100 PolarHBondContact CE1-OD1 3.28Å; H98-D100 IonicContact CE1-OD2 3.46Å; H98-D100 PolarHBondContact CE1-OD2 3.41Å; H98-D100 IonicContact ND1-OD1 3.89Å; H98-D100 IonicContact NE2-OD1 3.81Å; H98-D100 IonicContact NE2-OD2 3.32Å; H98-D100 PolarHBondContact NE2-OD2 3.42Å | ||
| 99 | C | 34.7 | Very low | 43.5 | Very low | 115 Ų | 115 | 121.6 Ų | 121.6 | 78% | 0.777 | 74% | 0.741 | S | S | * | * | trans | -139.2 | 116.5 | 154 | 61.8 | 0 | 0 | 0 | 0 | 108.1 | H97 S101 | H97-C99 PolarHBondContact O-N 3.28Å; C99-S101 PolarHBondContact O-N 2.93Å | ||
| 100 | D | 35.1 | Very low | 43.7 | Very low | 120 Ų | 120 | 123.4 Ų | 123.4 | 64% | 0.642 | 75% | 0.753 | S | S | * | * | trans | -58.4 | 127.6 | -176.9 | -66.8 | -62.9 | 0 | 0 | 0 | 112.2 | H98 V102 | H98-D100 IonicContact CE1-OD1 3.11Å; H98-D100 PolarHBondContact CE1-OD1 3.28Å; H98-D100 IonicContact CE1-OD2 3.46Å; H98-D100 PolarHBondContact CE1-OD2 3.41Å; H98-D100 IonicContact ND1-OD1 3.89Å; H98-D100 IonicContact NE2-OD1 3.81Å; H98-D100 IonicContact NE2-OD2 3.32Å; H98-D100 PolarHBondContact NE2-OD2 3.42Å; D100-V102 PolarHBondContact O-N 2.86Å; D100-V102 VanDerWaalsContact O-N 3.11Å | ||
| 101 | S | 34.9 | Very low | 44.3 | Very low | 118 Ų | 118 | 120.4 Ų | 120.4 | 83% | 0.825 | 75% | 0.747 | S | S | * | * | trans | -67.1 | 101.4 | 167 | -71 | 0 | 0 | 0 | 0 | 109.3 | C99 T103 | C99-S101 PolarHBondContact O-N 2.93Å; S101-T103 PolarHBondContact O-N 3.37Å | ||
| 102 | V | 44.3 | Very low | 44.5 | Very low | 131 Ų | 131 | 124 Ų | 124 | 79% | 0.794 | 76% | 0.755 | S | S | * | * | trans | -80.6 | 100.6 | 163.9 | -170.6 | 0 | 0 | 0 | 0 | 107.7 | D100 P104 | D100-V102 PolarHBondContact O-N 2.86Å; D100-V102 VanDerWaalsContact O-N 3.11Å; V102-P104 VanDerWaalsContact O-CD 3.3Å; V102-P104 WeakPolarHBondContact O-CD 3.32Å | ||
| 103 | T | 50.8 | Low | 44.9 | Very low | 111 Ų | 111 | 122.7 Ų | 122.7 | 68% | 0.681 | 75% | 0.749 | S | S | * | * | trans | -53.8 | 117.5 | 164.4 | -57.1 | 0 | 0 | 0 | 0 | 109.6 | S101 S105 | S101-T103 PolarHBondContact O-N 3.37Å; T103-S105 PolarHBondContact O-N 2.7Å | ||
| 104 | P | 45.6 | Very low | 44.8 | Very low | 117 Ų | 117 | 123.4 Ų | 123.4 | 76% | 0.76 | 75% | 0.753 | S | S | * | * | trans | -76.8 | 114.2 | 163.7 | 29.6 | -27 | 0 | 0 | 0 | 107.7 | V102 | V102-P104 VanDerWaalsContact O-CD 3.3Å; V102-P104 WeakPolarHBondContact O-CD 3.32Å | ||
| 105 | S | 52.4 | Low | 45.2 | Very low | 102 Ų | 102 | 122.5 Ų | 122.5 | 71% | 0.713 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -46.3 | 145.1 | 171.2 | -54.1 | 0 | 0 | 0 | 0 | 111.9 | T103 | T103-S105 PolarHBondContact O-N 2.7Š|
| 106 | P | 65.3 | Low | 45.5 | Very low | 113 Ų | 113 | 124.7 Ų | 124.7 | 73% | 0.734 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 146.5 | 167.7 | 28.5 | -32.1 | 0 | 0 | 0 | 109.2 | ||
| 107 | P | 60.8 | Low | 46.1 | Very low | 114 Ų | 114 | 128.9 Ų | 128.9 | 74% | 0.74 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 148.6 | 173.6 | 28 | -33.3 | 0 | 0 | 0 | 109.1 | A109 | P107-A109 PolarHBondContact O-N 2.99Å; P107-A109 VanDerWaalsContact O-N 3.15Å |
| 108 | P | 52.3 | Low | 46.2 | Very low | 122 Ų | 122 | 124.9 Ų | 124.9 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 126.4 | 177.9 | 24.4 | -31.8 | 0 | 0 | 0 | 108.8 | C110 | P108-C110 PolarHBondContact O-N 3.12Š|
| 109 | A | 48.7 | Very low | 46.4 | Very low | 97 Ų | 97 | 122.5 Ų | 122.5 | 80% | 0.802 | 76% | 0.762 | S | S | * | * | trans | -57 | 113.8 | 163.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | P107 G111 | P107-A109 PolarHBondContact O-N 2.99Å; P107-A109 VanDerWaalsContact O-N 3.15Å; A109-G111 VanDerWaalsContact C-N 3.26Å; A109-G111 PolarHBondContact O-N 3.47Å | ||
| 110 | C | 39.5 | Very low | 47.1 | Very low | 130 Ų | 130 | 122.8 Ų | 122.8 | 88% | 0.878 | 77% | 0.765 | S | S | * | * | trans | -59.4 | 98 | 167.3 | -88.7 | 0 | 0 | 0 | 0 | 107.5 | P108 Q112 | P108-C110 PolarHBondContact O-N 3.12Å; C110-Q112 PolarHBondContact O-N 3.3Å | ||
| 111 | G | 45.9 | Very low | 47.5 | Very low | 68 Ų | 68 | 122.7 Ų | 122.7 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | trans | -56.1 | 129.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | A109 N113 | A109-G111 VanDerWaalsContact C-N 3.26Å; A109-G111 PolarHBondContact O-N 3.47Å; G111-N113 PolarHBondContact O-N 2.88Å | ||
| 112 | Q | 48.7 | Very low | 48.3 | Very low | 188 Ų | 188 | 122.6 Ų | 122.6 | 88% | 0.879 | 78% | 0.775 | S | S | * | * | trans | -62.3 | 114.9 | 170.6 | -62.7 | 171.4 | 8.6 | 0 | 0 | 108.2 | C110 | C110-Q112 PolarHBondContact O-N 3.3Š| ||
| 113 | N | 40.1 | Very low | 48.6 | Very low | 138 Ų | 138 | 120.9 Ų | 120.9 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | trans | -109.2 | 120.3 | 153.6 | -86.5 | -14.8 | 0 | 0 | 0 | 106.8 | G111 L115 | G111-N113 PolarHBondContact O-N 2.88Å; N113-L115 VanDerWaalsContact C-N 3.25Å; N113-L115 HydrophobicContact CB-CD1 4.28Å; N113-L115 PolarHBondContact O-N 3.33Å | ||
| 114 | P | 47.4 | Very low | 48.8 | Very low | 126 Ų | 126 | 120.2 Ų | 120.2 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -79 | 82.7 | 168.4 | 32.3 | -27.9 | 0 | 0 | 0 | 107.3 | N116 | P114-N116 PolarHBondContact O-N 3.06Š| ||
| 115 | L | 41.3 | Very low | 49.4 | Very low | 129 Ų | 129 | 125.9 Ų | 125.9 | 68% | 0.675 | 78% | 0.775 | S | S | * | * | trans | -77 | 105.4 | 164.8 | -112.2 | 78.8 | 0 | 0 | 0 | 108.1 | N113 H117 | N113-L115 VanDerWaalsContact C-N 3.25Å; N113-L115 HydrophobicContact CB-CD1 4.28Å; N113-L115 PolarHBondContact O-N 3.33Å; L115-H117 PolarHBondContact O-N 3.07Å | ||
| 116 | N | 49.8 | Very low | 50 | Low | 159 Ų | 159 | 129.7 Ų | 129.7 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | trans | -48.9 | 99.6 | 160.1 | -94 | -14.9 | 0 | 0 | 0 | 109.7 | P114 | P114-N116 PolarHBondContact O-N 3.06Š| ||
| 117 | H | 47.5 | Very low | 50.5 | Low | 159 Ų | 159 | 131.2 Ų | 131.2 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | trans | -121.4 | 96.8 | 155.1 | -83.2 | -76.8 | 0 | 0 | 0 | 107.6 | L115 P119 | L115-H117 PolarHBondContact O-N 3.07Å; H117-P119 VanDerWaalsContact O-CD 3.31Å; H117-P119 WeakPolarHBondContact O-CD 3.49Å | ||
| 118 | S | 43.2 | Very low | 51.3 | Low | 108 Ų | 108 | 131.1 Ų | 131.1 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | trans | -70 | 127.4 | 157.5 | -67 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 119 | P | 46 | Very low | 53 | Low | 108 Ų | 108 | 130.2 Ų | 130.2 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | trans | -100.3 | 109.1 | 144 | 29.6 | -17.6 | 0 | 0 | 0 | 107.4 | H117 T121 | H117-P119 VanDerWaalsContact O-CD 3.31Å; H117-P119 WeakPolarHBondContact O-CD 3.49Å; P119-T121 VanDerWaalsContact C-N 3.3Å; P119-T121 PolarHBondContact O-N 2.86Å | ||
| 120 | S | 48.6 | Very low | 54.8 | Low | 121 Ų | 121 | 129.4 Ų | 129.4 | 85% | 0.846 | 76% | 0.757 | S | S | * | * | trans | -63.7 | 92.8 | 162.2 | -61.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 121 | T | 45.2 | Very low | 57.2 | Low | 117 Ų | 117 | 129.2 Ų | 129.2 | 72% | 0.718 | 74% | 0.739 | S | S | * | * | trans | -142.2 | 101.3 | 153.7 | 52.9 | 0 | 0 | 0 | 0 | 107.7 | P119 S123 | P119-T121 VanDerWaalsContact C-N 3.3Å; P119-T121 PolarHBondContact O-N 2.86Å; T121-S123 PolarHBondContact O-N 2.84Å | ||
| 122 | A | 51.7 | Low | 59.2 | Low | 117 Ų | 117 | 130.8 Ų | 130.8 | 97% | 0.967 | 74% | 0.737 | S | S | * | * | trans | -63.4 | 102.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 123 | S | 49.8 | Very low | 61 | Low | 94 Ų | 94 | 131.6 Ų | 131.6 | 66% | 0.657 | 73% | 0.732 | S | S | * | * | trans | -140.9 | 110.7 | 168.7 | 159.5 | 0 | 0 | 0 | 0 | 106.7 | T121 R125 | T121-S123 PolarHBondContact O-N 2.84Å; S123-R125 PolarHBondContact O-N 2.97Å | ||
| 124 | S | 55.8 | Low | 63.3 | Low | 97 Ų | 97 | 129.5 Ų | 129.5 | 68% | 0.678 | 72% | 0.718 | S | S | * | * | trans | -20.9 | 99.9 | 169.8 | 177.9 | 0 | 0 | 0 | 0 | 112.7 | K126 | S124-K126 VanDerWaalsContact C-N 3.27Å; S124-K126 PolarHBondContact O-N 3.43Å | ||
| 125 | R | 57 | Low | 64.9 | Low | 236 Ų | 236 | 129.6 Ų | 129.6 | 89% | 0.891 | 71% | 0.706 | S | S | * | * | trans | -73.5 | 89 | 171.3 | -66.5 | -112.7 | -173.5 | 171.1 | 2.1 | 106.3 | S123 D127 | S123-R125 PolarHBondContact O-N 2.97Å; R125-D127 PolarHBondContact O-N 3.33Å | ||
| 126 | K | 66.3 | Low | 66.7 | Low | 183 Ų | 183 | 130.4 Ų | 130.4 | 80% | 0.796 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 116.9 | 171.4 | -60.2 | -178.1 | -176.2 | -175.4 | 0 | 106.9 | S124 | S124-K126 VanDerWaalsContact C-N 3.27Å; S124-K126 PolarHBondContact O-N 3.43Å |
| 127 | D | 74.2 | Confident | 67.9 | Low | 144 Ų | 144 | 127.2 Ų | 127.2 | 77% | 0.77 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 138.3 | 172.6 | -72.6 | -42.1 | 0 | 0 | 0 | 109.3 | R125 V129 | R125-D127 PolarHBondContact O-N 3.33Å; D127-V129 PolarHBondContact O-N 3.11Å; D127-V129 VanDerWaalsContact O-N 3.15Å |
| 128 | P | 79.2 | Confident | 68.7 | Low | 113 Ų | 113 | 126.6 Ų | 126.6 | 73% | 0.734 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 122.4 | -178.4 | 22.6 | -31.7 | 0 | 0 | 0 | 110.3 | V130 | P128-V130 PolarHBondContact O-N 2.93Å; P128-V130 VanDerWaalsContact O-N 3.13Å |
| 129 | V | 86.6 | Confident | 69.3 | Low | 102 Ų | 102 | 125 Ų | 125 | 62% | 0.618 | 67% | 0.673 | S | S | * | * | trans | -67.5 | 111 | 178.9 | 179.8 | 0 | 0 | 0 | 0 | 109.3 | D127 Y131 | D127-V129 PolarHBondContact O-N 3.11Å; D127-V129 VanDerWaalsContact O-N 3.15Å; V129-Y131 HydrophobicContact CG1-CD1 4.42Å; V129-Y131 HydrophobicContact CG1-CE1 4.05Å; V129-Y131 HydrophobicContact CG1-CE2 4.41Å; V129-Y131 PolarHBondContact O-N 3.07Å | ||
| 130 | V | 87.8 | Confident | 69.6 | Low | 81 Ų | 81 | 125.7 Ų | 125.7 | 49% | 0.491 | 67% | 0.671 | S | S | . | * | trans | -87.7 | 103.5 | 176.2 | -177.3 | 0 | 0 | 0 | 0 | 109.9 | P128 M134 K135 | P128-V130 PolarHBondContact O-N 2.93Å; P128-V130 VanDerWaalsContact O-N 3.13Å; V130-M134 HydrophobicContact CG1-CB 3.99Å; V130-K135 HydrophobicContact CG1-CG 4Å | ||
| 131 | Y | 88.9 | Confident | 70.1 | Confident | 126 Ų | 126 | 126.7 Ų | 126.7 | 49% | 0.494 | 67% | 0.665 | S | S | . | * | trans | -68.4 | 152.9 | 177.7 | -63.1 | -77.9 | 0 | 0 | 0 | 112.3 | V129 W133 M134 | V129-Y131 HydrophobicContact CG1-CD1 4.42Å; V129-Y131 HydrophobicContact CG1-CE1 4.05Å; V129-Y131 HydrophobicContact CG1-CE2 4.41Å; V129-Y131 PolarHBondContact O-N 3.07Å; Y131-W133 VanDerWaalsContact C-N 3.25Å; Y131-W133 VanDerWaalsContact CB-NE1 3.3Å; Y131-W133 AromaticContact CG-NE1 3.86Å; Y131-W133 PolarHBondContact O-N 2.81Å; Y131-W133 VanDerWaalsContact O-N 3.12Å; Y131-M134 HydrophobicContact CD2-SD 3.68Å; Y131-M134 HydrophobicContact CG-SD 4.35Å; Y131-M134 VanDerWaalsContact O-CB 3.32Å; Y131-M134 WeakPolarHBondContact O-CB 3.45Å; Y131-M134 PolarHBondContact O-N 3.33Å | ||
| 132 | P | 87.6 | Confident | 70.6 | Confident | 101 Ų | 101 | 125.2 Ų | 125.2 | 66% | 0.656 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -53.9 | -35.1 | -177.9 | -29.1 | 36.1 | 0 | 0 | 0 | 115.2 | M134 K135 | P132-M134 VanDerWaalsContact C-N 3.29Å; P132-M134 PolarHBondContact O-N 3.35Å; P132-K135 WeakPolarHBondContact O-CB 3.4Å; P132-K135 PolarHBondContact O-N 3.27Å |
| 133 | W | 87.9 | Confident | 70.6 | Confident | 204 Ų | 204 | 123.7 Ų | 123.7 | 77% | 0.773 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -71.6 | -22.5 | 177.8 | 65.5 | -95.2 | 0 | 0 | 0 | 113.5 | Y131 | Y131-W133 VanDerWaalsContact C-N 3.25Å; Y131-W133 VanDerWaalsContact CB-NE1 3.3Å; Y131-W133 AromaticContact CG-NE1 3.86Å; Y131-W133 PolarHBondContact O-N 2.81Å; Y131-W133 VanDerWaalsContact O-N 3.12Å |
| 134 | M | 86.9 | Confident | 71 | Confident | 94 Ų | 94 | 124.5 Ų | 124.5 | 46% | 0.463 | 63% | 0.634 | S | S | . | * | G | 310 helix | trans | -77.1 | -15.2 | 175.3 | -58.7 | 173.2 | 72.2 | 0 | 0 | 111.6 | V130 Y131 P132 | V130-M134 HydrophobicContact CG1-CB 3.99Å; Y131-M134 HydrophobicContact CD2-SD 3.68Å; Y131-M134 HydrophobicContact CG-SD 4.35Å; Y131-M134 VanDerWaalsContact O-CB 3.32Å; Y131-M134 WeakPolarHBondContact O-CB 3.45Å; Y131-M134 PolarHBondContact O-N 3.33Å; P132-M134 VanDerWaalsContact C-N 3.29Å; P132-M134 PolarHBondContact O-N 3.35Å |
| 135 | K | 82.3 | Confident | 71 | Confident | 129 Ų | 129 | 126 Ų | 126 | 56% | 0.561 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -79.3 | 136.9 | 177.5 | -58.6 | -178.4 | 178.3 | 178.2 | 0 | 109.9 | V130 P132 V137 | V130-K135 HydrophobicContact CG1-CG 4Å; P132-K135 WeakPolarHBondContact O-CB 3.4Å; P132-K135 PolarHBondContact O-N 3.27Å; K135-V137 PolarHBondContact O-N 3.13Å |
| 136 | K | 78.9 | Confident | 70.7 | Confident | 145 Ų | 145 | 122.8 Ų | 122.8 | 63% | 0.63 | 62% | 0.624 | S | S | * | * | trans | -76.4 | 82.3 | -178.2 | -61.5 | 173.9 | 83.1 | -172.7 | 0 | 110.8 | H138 V139 | K136-H138 PolarHBondContact O-N 3.5Å; K136-H138 VanDerWaalsContact O-N 3.14Å; K136-V139 HydrophobicContact CB-CB 4.35Å; K136-V139 HydrophobicContact CB-CG2 3.87Å; K136-V139 PolarHBondContact O-N 3.39Å; K136-V139 VanDerWaalsContact O-N 3.12Å | ||
| 137 | V | 73.7 | Confident | 70.1 | Confident | 92 Ų | 92 | 120.2 Ų | 120.2 | 56% | 0.558 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -52.8 | -37.5 | -176.6 | -178.6 | 0 | 0 | 0 | 0 | 113.4 | K135 V139 | K135-V137 PolarHBondContact O-N 3.13Å; V137-V139 PolarHBondContact O-N 2.63Å |
| 138 | H | 64.6 | Low | 69.2 | Low | 147 Ų | 147 | 117.3 Ų | 117.3 | 68% | 0.681 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -72.5 | -9.3 | -175.7 | -62.1 | 94 | 0 | 0 | 0 | 115 | K136 | K136-H138 PolarHBondContact O-N 3.5Å; K136-H138 VanDerWaalsContact O-N 3.14Å |
| 139 | V | 56.5 | Low | 67.8 | Low | 74 Ų | 74 | 119 Ų | 119 | 45% | 0.448 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -96.7 | -40 | -173.8 | -177.3 | 0 | 0 | 0 | 0 | 111 | K136 V137 I141 V142 | K136-V139 HydrophobicContact CB-CB 4.35Å; K136-V139 HydrophobicContact CB-CG2 3.87Å; K136-V139 PolarHBondContact O-N 3.39Å; K136-V139 VanDerWaalsContact O-N 3.12Å; V137-V139 PolarHBondContact O-N 2.63Å; V139-I141 VanDerWaalsContact C-N 3.32Å; V139-I141 PolarHBondContact O-N 2.85Å; V139-V142 PolarHBondContact O-N 2.95Å |
| 140 | N | 52.6 | Low | 66.5 | Low | 123 Ų | 123 | 117.7 Ų | 117.7 | 66% | 0.658 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -69 | -23 | -177.6 | -84.8 | 37.4 | 0 | 0 | 0 | 115 | V142 | N140-V142 VanDerWaalsContact C-N 3.3Å; N140-V142 PolarHBondContact O-N 3.48Å |
| 141 | I | 57.8 | Low | 65 | Low | 142 Ų | 142 | 120.4 Ų | 120.4 | 73% | 0.728 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -21.4 | -176.2 | -67 | 164.7 | 0 | 0 | 0 | 112.2 | V139 | V139-I141 VanDerWaalsContact C-N 3.32Å; V139-I141 PolarHBondContact O-N 2.85Å |
| 142 | V | 56.4 | Low | 63.6 | Low | 85 Ų | 85 | 119 Ų | 119 | 52% | 0.515 | 66% | 0.657 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -107.9 | -19 | -171.5 | -142.3 | 0 | 0 | 0 | 0 | 112.7 | V139 N140 R154 | V139-V142 PolarHBondContact O-N 2.95Å; N140-V142 VanDerWaalsContact C-N 3.3Å; N140-V142 PolarHBondContact O-N 3.48Å; V142-R154 VanDerWaalsContact CG2-NH2 3.27Å |
| 143 | N | 51.1 | Low | 62.7 | Low | 86 Ų | 86 | 122.9 Ų | 122.9 | 46% | 0.46 | 66% | 0.663 | S | S | . | * | trans | -158.8 | 100.7 | 173.9 | -120.3 | 2.7 | 0 | 0 | 0 | 109.9 | N145 | N143-N145 PolarHBondContact O-N 3.36Š| ||
| 144 | P | 58.8 | Low | 62 | Low | 111 Ų | 111 | 121.9 Ų | 121.9 | 72% | 0.721 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | -3.5 | -179.9 | 20 | -22.5 | 0 | 0 | 0 | 114.5 | ||
| 145 | N | 55.3 | Low | 61.8 | Low | 128 Ų | 128 | 122.7 Ų | 122.7 | 68% | 0.684 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.3 | -1.3 | -166 | -37 | 35.9 | 0 | 0 | 0 | 114.3 | N143 | N143-N145 PolarHBondContact O-N 3.36Š|
| 146 | Y | 51.1 | Low | 62.2 | Low | 168 Ų | 168 | 127.9 Ų | 127.9 | 66% | 0.659 | 69% | 0.69 | S | S | * | * | trans | -102.5 | 107 | -171.5 | -105.6 | -95 | 0 | 0 | 0 | 112.7 | G148 E151 | Y146-G148 PolarHBondContact O-N 3.11Å; Y146-E151 HydrophobicContact CD1-CG 4.25Å | ||
| 147 | T | 53.4 | Low | 62.8 | Low | 130 Ų | 130 | 126.6 Ų | 126.6 | 80% | 0.798 | 70% | 0.695 | S | S | * | * | trans | -78.5 | 98.6 | 177 | 43.9 | 0 | 0 | 0 | 0 | 111.2 | V149 | T147-V149 VanDerWaalsContact C-N 3.28Å; T147-V149 PolarHBondContact O-N 3.48Å | ||
| 148 | G | 56.6 | Low | 63.9 | Low | 82 Ų | 82 | 126.3 Ų | 126.3 | 85% | 0.845 | 70% | 0.702 | S | S | * | * | S | Bend | trans | 63.5 | -15.3 | 134.2 | 0 | 0 | 0 | 0 | 0 | 122.2 | Y146 | Y146-G148 PolarHBondContact O-N 3.11Š|
| 149 | V | 50.1 | Low | 65.5 | Low | 148 Ų | 148 | 122.8 Ų | 122.8 | 90% | 0.897 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -125.3 | 94.8 | -171.2 | -171.7 | 0 | 0 | 0 | 0 | 110.1 | T147 | T147-V149 VanDerWaalsContact C-N 3.28Å; T147-V149 PolarHBondContact O-N 3.48Å |
| 150 | G | 59.1 | Low | 67.5 | Low | 75 Ų | 75 | 122.8 Ų | 122.8 | 77% | 0.773 | 68% | 0.683 | S | S | * | * | S | Bend | trans | 115 | -4.8 | 160.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||
| 151 | E | 55.9 | Low | 69.7 | Low | 139 Ų | 139 | 126.4 Ų | 126.4 | 65% | 0.65 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 139 | -170.9 | -98.6 | -77.7 | 123.7 | 0 | 0 | 114.9 | Y146 | Y146-E151 HydrophobicContact CD1-CG 4.25Š|
| 152 | P | 58.4 | Low | 71.6 | Confident | 97 Ų | 97 | 126.3 Ų | 126.3 | 63% | 0.63 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 133.9 | -171.8 | -19.5 | 32.8 | 0 | 0 | 0 | 112.2 | R154 | P152-R154 PolarHBondContact O-N 3Å; P152-R154 VanDerWaalsContact O-N 3.1Å |
| 153 | K | 69.7 | Low | 73.6 | Confident | 182 Ų | 182 | 123.6 Ų | 123.6 | 79% | 0.791 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 123.1 | 163.1 | -68.3 | 82.5 | 169 | -175.9 | 0 | 106.1 | S155 | K153-S155 PolarHBondContact O-N 3.46Š|
| 154 | R | 72.9 | Confident | 75.9 | Confident | 182 Ų | 182 | 121.8 Ų | 121.8 | 69% | 0.687 | 66% | 0.658 | S | S | * | * | trans | -44.4 | 106.7 | 173.8 | -91.7 | -177.3 | 173.1 | 157.7 | -5.1 | 108.3 | V142 P152 R156 | V142-R154 VanDerWaalsContact CG2-NH2 3.27Å; P152-R154 PolarHBondContact O-N 3Å; P152-R154 VanDerWaalsContact O-N 3.1Å; R154-R156 PolarHBondContact O-N 3.41Å | ||
| 155 | S | 83.3 | Confident | 77.8 | Confident | 112 Ų | 112 | 120.2 Ų | 120.2 | 78% | 0.783 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 131.7 | -176.1 | -175.6 | 0 | 0 | 0 | 0 | 108.3 | K153 T157 | K153-S155 PolarHBondContact O-N 3.46Å; S155-T157 PolarHBondContact O-N 2.79Å |
| 156 | R | 89.6 | Confident | 79.8 | Confident | 238 Ų | 238 | 117.2 Ų | 117.2 | 90% | 0.898 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 117 | 175.8 | -73.5 | -179.2 | 176.1 | -96.2 | 2.4 | 108.2 | R154 | R154-R156 PolarHBondContact O-N 3.41Š|
| 157 | T | 92.9 | Very high | 82.1 | Confident | 118 Ų | 118 | 109.3 Ų | 109.3 | 72% | 0.724 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -74 | 126.3 | 168.4 | -43.8 | 0 | 0 | 0 | 0 | 109.5 | S155 | S155-T157 PolarHBondContact O-N 2.79Š|
| 158 | A | 95.6 | Very high | 84.2 | Confident | 86 Ų | 86 | 106.4 Ų | 106.4 | 71% | 0.711 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -83.3 | 145.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 159 | Y | 98.2 | Very high | 86.2 | Confident | 73 Ų | 73 | 108.2 Ų | 108.2 | 29% | 0.286 | 56% | 0.556 | S | S | . | * | P | Polyproline II helix | trans | -80.4 | 145.9 | 170.8 | -60.4 | -46.7 | 0 | 0 | 0 | 110.3 | L191 W199 | Y159-L191 HydrophobicContact CD1-CD1 4.13Å; Y159-L191 HydrophobicContact CD1-CD2 3.89Å; Y159-L191 HydrophobicContact CE1-CD1 4.02Å; Y159-L191 HydrophobicContact CE1-CD2 3.66Å; Y159-W199 AromaticContact CD2-CD1 3.91Å; Y159-W199 AromaticContact CE2-CD1 3.67Å |
| 160 | T | 98.6 | Very high | 88.5 | Confident | 74 Ų | 74 | 101.9 Ų | 101.9 | 45% | 0.454 | 52% | 0.517 | S | S | . | . | P | Polyproline II helix | trans | -69.1 | 159.2 | 174.9 | 74.7 | 0 | 0 | 0 | 0 | 110.4 | Q162 Q163 V164 | T160-Q162 VanDerWaalsContact C-N 3.27Å; T160-Q162 PolarHBondContact O-N 3.05Å; T160-Q163 PolarHBondContact O-N 3.45Å; T160-Q163 VanDerWaalsContact O-N 3.16Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.49Å; T160-Q163 PolarHBondContact OG1-N 3.33Å; T160-V164 WeakPolarHBondContact O-CG2 3.46Å; T160-V164 PolarHBondContact O-N 2.85Å |
| 161 | R | 98.3 | Very high | 90.4 | Very high | 198 Ų | 198 | 98.5 Ų | 98.5 | 75% | 0.747 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -56.3 | -42.7 | 177.2 | -174.7 | 173.2 | -178 | -86.2 | -1.1 | 111.9 | V164 L165 | R161-V164 PolarHBondContact O-N 3Å; R161-L165 HydrophobicContact CG-CD1 4.22Å; R161-L165 WeakPolarHBondContact O-CG 3.36Å; R161-L165 PolarHBondContact O-N 3.02Å |
| 162 | Q | 98.3 | Very high | 92.4 | Very high | 140 Ų | 140 | 97.6 Ų | 97.6 | 65% | 0.654 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -61.2 | -45.3 | 177.3 | -178.2 | -175.6 | -17.6 | 0 | 0 | 112 | T160 V164 L165 E166 | T160-Q162 VanDerWaalsContact C-N 3.27Å; T160-Q162 PolarHBondContact O-N 3.05Å; Q162-V164 VanDerWaalsContact C-N 3.32Å; Q162-V164 PolarHBondContact O-N 2.91Å; Q162-L165 PolarHBondContact O-N 3.42Å; Q162-E166 PolarHBondContact O-N 3.32Å; Q162-E166 VanDerWaalsContact O-N 3.08Å |
| 163 | Q | 98.5 | Very high | 94.3 | Very high | 29 Ų | 29 | 102.2 Ų | 102.2 | 14% | 0.136 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -59.3 | -44.6 | 177.4 | -73.3 | 171.8 | -26.6 | 0 | 0 | 111.4 | T160 L167 L189 | T160-Q163 PolarHBondContact O-N 3.45Å; T160-Q163 VanDerWaalsContact O-N 3.16Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.49Å; T160-Q163 PolarHBondContact OG1-N 3.33Å; Q163-L167 WeakPolarHBondContact O-CB 3.44Å; Q163-L167 WeakPolarHBondContact O-CD1 3.33Å; Q163-L167 WeakPolarHBondContact O-CG 3.3Å; Q163-L167 PolarHBondContact O-N 3.28Å; Q163-L189 HydrophobicContact CG-CB 4.33Å; Q163-L189 PolarHBondContact NE2-O 3.17Å |
| 164 | V | 98.5 | Very high | 95.6 | Very high | 47 Ų | 47 | 97 Ų | 97 | 29% | 0.285 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.5 | -44.5 | 178.5 | 177.3 | 0 | 0 | 0 | 0 | 111.3 | T160 R161 Q162 L167 E168 | T160-V164 WeakPolarHBondContact O-CG2 3.46Å; T160-V164 PolarHBondContact O-N 2.85Å; R161-V164 PolarHBondContact O-N 3Å; Q162-V164 VanDerWaalsContact C-N 3.32Å; Q162-V164 PolarHBondContact O-N 2.91Å; V164-L167 PolarHBondContact O-N 3.23Å; V164-E168 HydrophobicContact CG1-CG 4.38Å; V164-E168 WeakPolarHBondContact O-CG 3.36Å; V164-E168 PolarHBondContact O-N 3.28Å |
| 165 | L | 98.5 | Very high | 96.8 | Very high | 79 Ų | 79 | 93.1 Ų | 93.1 | 41% | 0.414 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | -179.3 | -71.4 | 173.2 | 0 | 0 | 0 | 112.6 | R161 Q162 L167 E168 K169 | R161-L165 HydrophobicContact CG-CD1 4.22Å; R161-L165 WeakPolarHBondContact O-CG 3.36Å; R161-L165 PolarHBondContact O-N 3.02Å; Q162-L165 PolarHBondContact O-N 3.42Å; L165-L167 VanDerWaalsContact C-N 3.35Å; L165-E168 PolarHBondContact O-N 3.3Å; L165-K169 WeakPolarHBondContact O-CB 3.4Å; L165-K169 PolarHBondContact O-N 3.47Å |
| 166 | E | 98.6 | Very high | 97.5 | Very high | 65 Ų | 65 | 94.5 Ų | 94.5 | 30% | 0.304 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 177.3 | -72.3 | -62.6 | 149.1 | 0 | 0 | 111.7 | Q162 E168 K169 E170 L189 | Q162-E166 PolarHBondContact O-N 3.32Å; Q162-E166 VanDerWaalsContact O-N 3.08Å; E166-E168 VanDerWaalsContact C-N 3.34Å; E166-E168 PolarHBondContact O-N 3.45Å; E166-K169 PolarHBondContact O-N 3.36Å; E166-K169 IonicContact OE1-NZ 3.56Å; E166-K169 IonicContact OE2-NZ 2.96Å; E166-K169 PolarHBondContact OE2-NZ 3.44Å; E166-E170 WeakPolarHBondContact O-CB 3.48Å; E166-E170 WeakPolarHBondContact O-CG 3.4Å; E166-E170 PolarHBondContact O-N 3.23Å; E166-L189 HydrophobicContact CB-CD1 4.12Å; E166-L189 HydrophobicContact CB-CD2 3.71Å; E166-L189 HydrophobicContact CB-CG 4.49Å; E166-L189 HydrophobicContact CG-CD2 3.99Å |
| 167 | L | 98.6 | Very high | 97.9 | Very high | 1 Ų | 1 | 84.7 Ų | 84.7 | 1% | 0.005 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63 | -40.7 | 174.4 | -71.5 | 167.2 | 0 | 0 | 0 | 112.1 | Q163 V164 L165 F171 I185 L189 L191 I196 W199 F200 | Q163-L167 WeakPolarHBondContact O-CB 3.44Å; Q163-L167 WeakPolarHBondContact O-CD1 3.33Å; Q163-L167 WeakPolarHBondContact O-CG 3.3Å; Q163-L167 PolarHBondContact O-N 3.28Å; V164-L167 PolarHBondContact O-N 3.23Å; L165-L167 VanDerWaalsContact C-N 3.35Å; L167-F171 WeakPolarHBondContact O-CB 3.46Å; L167-F171 PolarHBondContact O-N 2.9Å; L167-I185 HydrophobicContact CD2-CG2 4.19Å; L167-L189 HydrophobicContact CD1-CD1 4.41Å; L167-L189 HydrophobicContact CD2-CD1 3.85Å; L167-L189 HydrophobicContact CG-CD1 3.68Å; L167-L191 HydrophobicContact CD1-CD1 4.32Å; L167-I196 HydrophobicContact CD2-CD1 3.78Å; L167-W199 VanDerWaalsContact C-CH2 3.48Å; L167-W199 HydrophobicContact CB-CD2 3.93Å; L167-W199 HydrophobicContact CB-CE3 3.94Å; L167-W199 HydrophobicContact CB-CH2 3.62Å; L167-W199 HydrophobicContact CB-CZ2 3.58Å; L167-W199 HydrophobicContact CB-CZ3 3.79Å; L167-W199 HydrophobicContact CD1-CD2 3.88Å; L167-W199 HydrophobicContact CD1-CG 3.85Å; L167-W199 HydrophobicContact CD2-CD2 4.35Å; L167-W199 HydrophobicContact CD2-CE3 4.27Å; L167-W199 HydrophobicContact CG-CD2 4.28Å; L167-W199 HydrophobicContact CG-CE3 4.49Å; L167-W199 WeakPolarHBondContact O-CH2 3.47Å; L167-W199 WeakPolarHBondContact O-CZ3 3.36Å; L167-F200 HydrophobicContact CD2-CE2 4.1Å |
| 168 | E | 98.6 | Very high | 98.2 | Very high | 70 Ų | 70 | 83.2 Ų | 83.2 | 33% | 0.327 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66 | -46 | 175.2 | -75.4 | -168.7 | 171.5 | 0 | 0 | 111.6 | V164 L165 E166 E170 F171 H172 W199 | V164-E168 HydrophobicContact CG1-CG 4.38Å; V164-E168 WeakPolarHBondContact O-CG 3.36Å; V164-E168 PolarHBondContact O-N 3.28Å; L165-E168 PolarHBondContact O-N 3.3Å; E166-E168 VanDerWaalsContact C-N 3.34Å; E166-E168 PolarHBondContact O-N 3.45Å; E168-E170 VanDerWaalsContact C-N 3.33Å; E168-E170 PolarHBondContact O-N 2.9Å; E168-F171 WeakPolarHBondContact O-CB 3.15Å; E168-F171 PolarHBondContact O-N 3.15Å; E168-F171 VanDerWaalsContact O-N 3.12Å; E168-H172 PolarHBondContact O-N 2.86Å; E168-H172 PolarHBondContact O-ND1 3.39Å; E168-W199 HydrophobicContact CG-CH2 3.99Å; E168-W199 HydrophobicContact CG-CZ2 4.02Å |
| 169 | K | 98.6 | Very high | 98.3 | Very high | 120 Ų | 120 | 86 Ų | 86 | 52% | 0.522 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -54.6 | -49.1 | 175.2 | 174.1 | -178.3 | 157.3 | -155.2 | 0 | 111.4 | L165 E166 F171 H172 Y173 | L165-K169 WeakPolarHBondContact O-CB 3.4Å; L165-K169 PolarHBondContact O-N 3.47Å; E166-K169 PolarHBondContact O-N 3.36Å; E166-K169 IonicContact OE1-NZ 3.56Å; E166-K169 IonicContact OE2-NZ 2.96Å; E166-K169 PolarHBondContact OE2-NZ 3.44Å; K169-F171 VanDerWaalsContact C-N 3.32Å; K169-F171 PolarHBondContact O-N 3.07Å; K169-H172 PolarHBondContact O-N 2.8Å; K169-Y173 PolarHBondContact O-N 3.22Å; K169-Y173 VanDerWaalsContact O-N 3.08Å |
| 170 | E | 98.4 | Very high | 98.3 | Very high | 15 Ų | 15 | 91.5 Ų | 91.5 | 7% | 0.07 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -62.8 | -37.8 | 176.5 | -73 | -64.2 | 132.1 | 0 | 0 | 112.6 | E166 E168 H172 Y173 N174 R181 I185 F200 | E166-E170 WeakPolarHBondContact O-CB 3.48Å; E166-E170 WeakPolarHBondContact O-CG 3.4Å; E166-E170 PolarHBondContact O-N 3.23Å; E168-E170 VanDerWaalsContact C-N 3.33Å; E168-E170 PolarHBondContact O-N 2.9Å; E170-H172 VanDerWaalsContact C-N 3.34Å; E170-H172 PolarHBondContact O-N 3.49Å; E170-Y173 WeakPolarHBondContact O-CB 3.5Å; E170-Y173 PolarHBondContact O-N 3.02Å; E170-N174 PolarHBondContact O-N 3.36Å; E170-R181 IonicContact OE1-CZ 3.92Å; E170-R181 IonicContact OE1-NE 3.8Å; E170-R181 IonicContact OE1-NH2 2.68Å; E170-R181 PolarHBondContact OE1-NH2 3.32Å; E170-R181 IonicContact OE2-CZ 2.84Å; E170-R181 IonicContact OE2-NE 3.71Å; E170-R181 PolarHBondContact OE2-NE 3.37Å; E170-R181 IonicContact OE2-NH2 3.12Å; E170-R181 PolarHBondContact OE2-NH2 2.91Å; E170-R181 VanDerWaalsContact OE2-NH2 3.12Å; E170-I185 HydrophobicContact CB-CD1 4.07Å; E170-I185 HydrophobicContact CG-CD1 3.69Å; E170-I185 HydrophobicContact CG-CG1 4.11Å; E170-F200 HydrophobicContact CB-CZ 4.06Å |
| 171 | F | 98.6 | Very high | 98.3 | Very high | 3 Ų | 3 | 92.1 Ų | 92.1 | 1% | 0.013 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -65.5 | -36.6 | 177.5 | -177.1 | -98.7 | 0 | 0 | 0 | 113.2 | L167 E168 K169 N174 R175 W199 F200 R203 R204 W207 | L167-F171 WeakPolarHBondContact O-CB 3.46Å; L167-F171 PolarHBondContact O-N 2.9Å; E168-F171 WeakPolarHBondContact O-CB 3.15Å; E168-F171 PolarHBondContact O-N 3.15Å; E168-F171 VanDerWaalsContact O-N 3.12Å; K169-F171 VanDerWaalsContact C-N 3.32Å; K169-F171 PolarHBondContact O-N 3.07Å; F171-N174 CarbonylContact O-C 3.26Å; F171-N174 VanDerWaalsContact O-C 3.26Å; F171-R175 HydrophobicContact CE1-CG 4.2Å; F171-R175 HydrophobicContact CE2-CB 4.03Å; F171-R175 HydrophobicContact CE2-CG 4.11Å; F171-R175 HydrophobicContact CZ-CB 4.23Å; F171-R175 HydrophobicContact CZ-CG 3.86Å; F171-R175 PolarHBondContact O-N 2.97Å; F171-W199 HydrophobicContact CB-CH2 4.32Å; F171-W199 HydrophobicContact CB-CZ3 4.06Å; F171-F200 HydrophobicContact CB-CE1 4.2Å; F171-F200 HydrophobicContact CB-CZ 4.31Å; F171-F200 AromaticContact CD2-CD1 3.96Å; F171-F200 HydrophobicContact CD2-CD1 3.96Å; F171-F200 AromaticContact CD2-CE1 3.9Å; F171-F200 HydrophobicContact CD2-CE1 3.9Å; F171-R203 HydrophobicContact CB-CG 4.41Å; F171-R203 HydrophobicContact CD1-CG 3.73Å; F171-R203 HydrophobicContact CD2-CB 4.21Å; F171-R203 HydrophobicContact CD2-CG 3.57Å; F171-R203 HydrophobicContact CE1-CG 3.79Å; F171-R203 HydrophobicContact CE2-CB 4.19Å; F171-R203 HydrophobicContact CE2-CG 3.65Å; F171-R203 HydrophobicContact CG-CG 3.61Å; F171-R203 HydrophobicContact CZ-CG 3.76Å; F171-R204 HydrophobicContact CE2-CG 3.74Å; F171-R204 HydrophobicContact CZ-CG 4.26Å; F171-W207 HydrophobicContact CE1-CB 4.3Å; F171-W207 HydrophobicContact CE1-CG 4.25Å; F171-W207 HydrophobicContact CZ-CB 4.03Å; F171-W207 HydrophobicContact CZ-CG 4.17Å |
| 172 | H | 98 | Very high | 98.3 | Very high | 120 Ų | 120 | 85.4 Ų | 85.4 | 56% | 0.556 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -68.4 | -39.4 | 174.3 | -69.8 | 91.9 | 0 | 0 | 0 | 111.2 | E168 K169 E170 | E168-H172 PolarHBondContact O-N 2.86Å; E168-H172 PolarHBondContact O-ND1 3.39Å; K169-H172 PolarHBondContact O-N 2.8Å; E170-H172 VanDerWaalsContact C-N 3.34Å; E170-H172 PolarHBondContact O-N 3.49Å |
| 173 | Y | 98.3 | Very high | 98.3 | Very high | 194 Ų | 194 | 80.6 Ų | 80.6 | 76% | 0.761 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.5 | -49.9 | 174.4 | 179 | -106.5 | 0 | 0 | 0 | 111.7 | K169 E170 | K169-Y173 PolarHBondContact O-N 3.22Å; K169-Y173 VanDerWaalsContact O-N 3.08Å; E170-Y173 WeakPolarHBondContact O-CB 3.5Å; E170-Y173 PolarHBondContact O-N 3.02Å |
| 174 | N | 97.2 | Very high | 98.3 | Very high | 72 Ų | 72 | 82.4 Ų | 82.4 | 39% | 0.385 | 36% | 0.363 | S | S | . | . | trans | -147.5 | 123.1 | 174.2 | -168.7 | -12.4 | 0 | 0 | 0 | 111.4 | E170 F171 Y176 | E170-N174 PolarHBondContact O-N 3.36Å; F171-N174 CarbonylContact O-C 3.26Å; F171-N174 VanDerWaalsContact O-C 3.26Å; N174-Y176 PolarHBondContact ND2-O 2.92Å; N174-Y176 PolarHBondContact O-N 3.1Å; N174-Y176 VanDerWaalsContact O-N 3.11Å; N174-Y176 PolarHBondContact OD1-N 3Å; N174-Y176 PolarHBondContact OD1-O 3.5Å | ||
| 175 | R | 97.6 | Very high | 98.3 | Very high | 101 Ų | 101 | 80.5 Ų | 80.5 | 38% | 0.381 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -65.8 | -14.8 | 179.7 | -69.2 | 174.7 | 169 | 71.8 | 0.2 | 113.2 | F171 R204 | F171-R175 HydrophobicContact CE1-CG 4.2Å; F171-R175 HydrophobicContact CE2-CB 4.03Å; F171-R175 HydrophobicContact CE2-CG 4.11Å; F171-R175 HydrophobicContact CZ-CB 4.23Å; F171-R175 HydrophobicContact CZ-CG 3.86Å; F171-R175 PolarHBondContact O-N 2.97Å; R175-R204 WeakPolarHBondContact O-CD 3.24Å |
| 176 | Y | 98.3 | Very high | 98.3 | Very high | 142 Ų | 142 | 77 Ų | 77 | 56% | 0.557 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -132.6 | 133.1 | -178.7 | -64.1 | -106.9 | 0 | 0 | 0 | 109.9 | N174 | N174-Y176 PolarHBondContact ND2-O 2.92Å; N174-Y176 PolarHBondContact O-N 3.1Å; N174-Y176 VanDerWaalsContact O-N 3.11Å; N174-Y176 PolarHBondContact OD1-N 3Å; N174-Y176 PolarHBondContact OD1-O 3.5Å |
| 177 | L | 98.3 | Very high | 98.3 | Very high | 31 Ų | 31 | 80.7 Ų | 80.7 | 16% | 0.162 | 35% | 0.351 | C | S | . | . | trans | -94.8 | 139.4 | 178.2 | -63.5 | 179.2 | 0 | 0 | 0 | 112 | R181 R182 I185 I196 F200 | L177-R181 HydrophobicContact CD2-CG 3.94Å; L177-R182 HydrophobicContact CD1-CB 4.49Å; L177-I185 HydrophobicContact CD1-CD1 3.88Å; L177-I185 HydrophobicContact CD2-CD1 3.74Å; L177-I185 HydrophobicContact CG-CD1 4.48Å; L177-I196 HydrophobicContact CD1-CG2 3.49Å; L177-I196 VanDerWaalsContact CD1-CG2 3.49Å; L177-F200 HydrophobicContact CD1-CD1 4.15Å; L177-F200 HydrophobicContact CD1-CD2 3.59Å; L177-F200 HydrophobicContact CD1-CE1 3.98Å; L177-F200 HydrophobicContact CD1-CE2 3.43Å; L177-F200 VanDerWaalsContact CD1-CE2 3.43Å; L177-F200 HydrophobicContact CD1-CG 3.97Å; L177-F200 HydrophobicContact CD1-CZ 3.63Å; L177-F200 HydrophobicContact CD2-CE1 3.76Å; L177-F200 HydrophobicContact CD2-CE2 4.34Å; L177-F200 HydrophobicContact CD2-CZ 3.67Å; L177-F200 HydrophobicContact CG-CD1 3.8Å; L177-F200 HydrophobicContact CG-CD2 4.17Å; L177-F200 HydrophobicContact CG-CE1 3.53Å; L177-F200 HydrophobicContact CG-CE2 3.96Å; L177-F200 HydrophobicContact CG-CG 4.11Å; L177-F200 HydrophobicContact CG-CZ 3.63Å | ||
| 178 | T | 98.5 | Very high | 98.3 | Very high | 88 Ų | 88 | 85.7 Ų | 85.7 | 54% | 0.54 | 38% | 0.381 | S | S | . | . | trans | -72.7 | 166.8 | 162.6 | 65.8 | 0 | 0 | 0 | 0 | 110.7 | R181 R182 | T178-R181 WeakPolarHBondContact OG1-CB 3.43Å; T178-R181 PolarHBondContact OG1-N 3.05Å; T178-R182 WeakPolarHBondContact O-CB 3.35Å; T178-R182 PolarHBondContact O-N 3.41Å; T178-R182 VanDerWaalsContact O-N 3.13Å | ||
| 179 | R | 98.3 | Very high | 98.3 | Very high | 143 Ų | 143 | 82.8 Ų | 82.8 | 54% | 0.54 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -59.9 | -50.7 | 177.6 | -178.3 | 66 | 177.1 | 82.4 | -2.7 | 111.4 | R181 R182 V183 E193 | R179-R181 PolarHBondContact O-N 3.21Å; R179-R182 WeakPolarHBondContact O-CB 3.41Å; R179-R182 PolarHBondContact O-N 2.8Å; R179-V183 PolarHBondContact O-N 3.3Å; R179-E193 IonicContact CZ-OE1 3.26Å; R179-E193 VanDerWaalsContact CZ-OE1 3.26Å; R179-E193 IonicContact CZ-OE2 3.03Å; R179-E193 IonicContact NE-OE2 3.69Å; R179-E193 IonicContact NH1-OE1 2.95Å; R179-E193 PolarHBondContact NH1-OE1 3.31Å; R179-E193 IonicContact NH1-OE2 2.63Å; R179-E193 PolarHBondContact NH1-OE2 3.14Å; R179-E193 IonicContact NH2-OE1 2.85Å; R179-E193 PolarHBondContact NH2-OE1 3.23Å; R179-E193 IonicContact NH2-OE2 3.39Å; R179-E193 PolarHBondContact NH2-OE2 3.21Å |
| 180 | R | 98.3 | Very high | 98.3 | Very high | 189 Ų | 189 | 83.2 Ų | 83.2 | 71% | 0.713 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -57.8 | -50.5 | 179.4 | 178.4 | 178.4 | 167.6 | 168.2 | 2.1 | 111.7 | R182 V183 E184 | R180-R182 VanDerWaalsContact C-N 3.25Å; R180-R182 PolarHBondContact O-N 2.93Å; R180-V183 WeakPolarHBondContact O-CB 3.44Å; R180-V183 PolarHBondContact O-N 3.01Å; R180-E184 WeakPolarHBondContact CG-OE1 3.39Å; R180-E184 IonicContact CZ-OE1 3.01Å; R180-E184 IonicContact NE-OE1 3.39Å; R180-E184 PolarHBondContact NE-OE1 3.42Å; R180-E184 IonicContact NH2-OE1 3.9Å; R180-E184 PolarHBondContact O-N 2.86Å |
| 181 | R | 98.4 | Very high | 98.2 | Very high | 87 Ų | 87 | 83.3 Ų | 83.3 | 33% | 0.328 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.7 | -35 | -178.6 | -172.2 | 56.7 | 177.2 | 174 | -1 | 112.4 | E170 L177 T178 R179 V183 E184 I185 | E170-R181 IonicContact OE1-CZ 3.92Å; E170-R181 IonicContact OE1-NE 3.8Å; E170-R181 IonicContact OE1-NH2 2.68Å; E170-R181 PolarHBondContact OE1-NH2 3.32Å; E170-R181 IonicContact OE2-CZ 2.84Å; E170-R181 IonicContact OE2-NE 3.71Å; E170-R181 PolarHBondContact OE2-NE 3.37Å; E170-R181 IonicContact OE2-NH2 3.12Å; E170-R181 PolarHBondContact OE2-NH2 2.91Å; E170-R181 VanDerWaalsContact OE2-NH2 3.12Å; L177-R181 HydrophobicContact CD2-CG 3.94Å; T178-R181 WeakPolarHBondContact OG1-CB 3.43Å; T178-R181 PolarHBondContact OG1-N 3.05Å; R179-R181 PolarHBondContact O-N 3.21Å; R181-V183 VanDerWaalsContact C-N 3.32Å; R181-V183 PolarHBondContact O-N 3.45Å; R181-E184 VanDerWaalsContact CD-OE2 3.25Å; R181-E184 WeakPolarHBondContact CD-OE2 3.49Å; R181-E184 IonicContact CZ-OE2 2.81Å; R181-E184 IonicContact NE-OE2 3.89Å; R181-E184 IonicContact NH1-OE2 3.98Å; R181-E184 PolarHBondContact NH1-OE2 3.39Å; R181-E184 PolarHBondContact O-N 2.96Å; R181-I185 HydrophobicContact CG-CD1 3.89Å; R181-I185 HydrophobicContact CG-CG1 4.44Å; R181-I185 WeakPolarHBondContact O-CG1 3.21Å; R181-I185 PolarHBondContact O-N 3.4Å; R181-I185 VanDerWaalsContact O-N 3.1Å |
| 182 | R | 98.6 | Very high | 98.2 | Very high | 57 Ų | 57 | 85.9 Ų | 85.9 | 22% | 0.215 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -60 | -40.7 | 175 | -171.4 | -172.2 | -57 | 170.8 | 6.6 | 112.5 | L177 T178 R179 R180 A186 E193 I196 | L177-R182 HydrophobicContact CD1-CB 4.49Å; T178-R182 WeakPolarHBondContact O-CB 3.35Å; T178-R182 PolarHBondContact O-N 3.41Å; T178-R182 VanDerWaalsContact O-N 3.13Å; R179-R182 WeakPolarHBondContact O-CB 3.41Å; R179-R182 PolarHBondContact O-N 2.8Å; R180-R182 VanDerWaalsContact C-N 3.25Å; R180-R182 PolarHBondContact O-N 2.93Å; R182-A186 WeakPolarHBondContact O-CB 3.44Å; R182-A186 PolarHBondContact O-N 2.95Å; R182-E193 HydrophobicContact CG-CB 4.34Å; R182-E193 HydrophobicContact CG-CG 4.5Å; R182-I196 HydrophobicContact CG-CB 4.11Å; R182-I196 HydrophobicContact CG-CG2 3.92Å |
| 183 | V | 98.6 | Very high | 98.2 | Very high | 40 Ų | 40 | 82.9 Ų | 82.9 | 24% | 0.242 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64 | -47.6 | 177.2 | -177.7 | 0 | 0 | 0 | 0 | 110.5 | R179 R180 R181 I185 A186 H187 | R179-V183 PolarHBondContact O-N 3.3Å; R180-V183 WeakPolarHBondContact O-CB 3.44Å; R180-V183 PolarHBondContact O-N 3.01Å; R181-V183 VanDerWaalsContact C-N 3.32Å; R181-V183 PolarHBondContact O-N 3.45Å; V183-I185 VanDerWaalsContact C-N 3.34Å; V183-I185 PolarHBondContact O-N 3.01Å; V183-A186 WeakPolarHBondContact O-CB 3.18Å; V183-A186 PolarHBondContact O-N 3.07Å; V183-H187 WeakPolarHBondContact CG1-NE2 3.45Å; V183-H187 PolarHBondContact O-CD2 3.21Å; V183-H187 VanDerWaalsContact O-CD2 3.22Å; V183-H187 PolarHBondContact O-N 3.21Å |
| 184 | E | 98.5 | Very high | 98.2 | Very high | 66 Ų | 66 | 82.2 Ų | 82.2 | 31% | 0.308 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -57.6 | -46.7 | -178.8 | -65.2 | 169.4 | -175.1 | 0 | 0 | 111.7 | R180 R181 T188 | R180-E184 WeakPolarHBondContact CG-OE1 3.39Å; R180-E184 IonicContact CZ-OE1 3.01Å; R180-E184 IonicContact NE-OE1 3.39Å; R180-E184 PolarHBondContact NE-OE1 3.42Å; R180-E184 IonicContact NH2-OE1 3.9Å; R180-E184 PolarHBondContact O-N 2.86Å; R181-E184 VanDerWaalsContact CD-OE2 3.25Å; R181-E184 WeakPolarHBondContact CD-OE2 3.49Å; R181-E184 IonicContact CZ-OE2 2.81Å; R181-E184 IonicContact NE-OE2 3.89Å; R181-E184 IonicContact NH1-OE2 3.98Å; R181-E184 PolarHBondContact NH1-OE2 3.39Å; R181-E184 PolarHBondContact O-N 2.96Å; E184-T188 PolarHBondContact O-N 3.12Å; E184-T188 VanDerWaalsContact O-N 3.13Å; E184-T188 PolarHBondContact O-OG1 3.27Å |
| 185 | I | 98.4 | Very high | 98.3 | Very high | 8 Ų | 8 | 81.6 Ų | 81.6 | 4% | 0.041 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -67.9 | -42 | 178.6 | -61.8 | 165.4 | 0 | 0 | 0 | 111.1 | L167 E170 L177 R181 V183 H187 T188 L189 I196 | L167-I185 HydrophobicContact CD2-CG2 4.19Å; E170-I185 HydrophobicContact CB-CD1 4.07Å; E170-I185 HydrophobicContact CG-CD1 3.69Å; E170-I185 HydrophobicContact CG-CG1 4.11Å; L177-I185 HydrophobicContact CD1-CD1 3.88Å; L177-I185 HydrophobicContact CD2-CD1 3.74Å; L177-I185 HydrophobicContact CG-CD1 4.48Å; R181-I185 HydrophobicContact CG-CD1 3.89Å; R181-I185 HydrophobicContact CG-CG1 4.44Å; R181-I185 WeakPolarHBondContact O-CG1 3.21Å; R181-I185 PolarHBondContact O-N 3.4Å; R181-I185 VanDerWaalsContact O-N 3.1Å; V183-I185 VanDerWaalsContact C-N 3.34Å; V183-I185 PolarHBondContact O-N 3.01Å; I185-H187 VanDerWaalsContact C-N 3.29Å; I185-H187 PolarHBondContact O-N 3.07Å; I185-T188 PolarHBondContact O-N 2.73Å; I185-L189 HydrophobicContact CG2-CD1 3.66Å; I185-L189 HydrophobicContact CG2-CG 4.13Å; I185-L189 WeakPolarHBondContact O-CB 3.38Å; I185-L189 WeakPolarHBondContact O-CG 3.3Å; I185-L189 PolarHBondContact O-N 3.45Å; I185-I196 HydrophobicContact CG2-CD1 3.89Å |
| 186 | A | 98.5 | Very high | 98.3 | Very high | 5 Ų | 5 | 76.8 Ų | 76.8 | 4% | 0.041 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -56 | -45.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | R182 V183 V190 L191 E193 I196 | R182-A186 WeakPolarHBondContact O-CB 3.44Å; R182-A186 PolarHBondContact O-N 2.95Å; V183-A186 WeakPolarHBondContact O-CB 3.18Å; V183-A186 PolarHBondContact O-N 3.07Å; A186-V190 WeakPolarHBondContact O-CA 3.49Å; A186-V190 PolarHBondContact O-N 3.19Å; A186-L191 CarbonylContact C-O 3.45Å; A186-L191 VanDerWaalsContact CA-O 3.32Å; A186-L191 WeakPolarHBondContact CA-O 3.37Å; A186-L191 WeakPolarHBondContact CB-O 3.29Å; A186-L191 PolarHBondContact O-N 3.12Å; A186-L191 VanDerWaalsContact O-O 3.09Å; A186-E193 HydrophobicContact CB-CG 4.27Å; A186-I196 HydrophobicContact CB-CG1 4.07Å |
| 187 | H | 98.4 | Very high | 98.3 | Very high | 142 Ų | 142 | 75.9 Ų | 75.9 | 66% | 0.657 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -67.9 | -44.7 | 179.3 | -69.2 | -157.2 | 0 | 0 | 0 | 111.4 | V183 I185 L189 V190 | V183-H187 WeakPolarHBondContact CG1-NE2 3.45Å; V183-H187 PolarHBondContact O-CD2 3.21Å; V183-H187 VanDerWaalsContact O-CD2 3.22Å; V183-H187 PolarHBondContact O-N 3.21Å; I185-H187 VanDerWaalsContact C-N 3.29Å; I185-H187 PolarHBondContact O-N 3.07Å; H187-L189 VanDerWaalsContact C-N 3.32Å; H187-L189 PolarHBondContact O-N 3.47Å; H187-V190 PolarHBondContact O-N 3.3Å |
| 188 | T | 98 | Very high | 98.3 | Very high | 106 Ų | 106 | 77.3 Ų | 77.3 | 65% | 0.65 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -63.2 | -37.5 | -178.7 | -53.1 | 0 | 0 | 0 | 0 | 112.4 | E184 I185 | E184-T188 PolarHBondContact O-N 3.12Å; E184-T188 VanDerWaalsContact O-N 3.13Å; E184-T188 PolarHBondContact O-OG1 3.27Å; I185-T188 PolarHBondContact O-N 2.73Å |
| 189 | L | 98.1 | Very high | 98.3 | Very high | 9 Ų | 9 | 74.6 Ų | 74.6 | 5% | 0.047 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -96.8 | -1.3 | -176 | -59.9 | -173.4 | 0 | 0 | 0 | 113.9 | Q163 E166 L167 I185 H187 L191 | Q163-L189 HydrophobicContact CG-CB 4.33Å; Q163-L189 PolarHBondContact NE2-O 3.17Å; E166-L189 HydrophobicContact CB-CD1 4.12Å; E166-L189 HydrophobicContact CB-CD2 3.71Å; E166-L189 HydrophobicContact CB-CG 4.49Å; E166-L189 HydrophobicContact CG-CD2 3.99Å; L167-L189 HydrophobicContact CD1-CD1 4.41Å; L167-L189 HydrophobicContact CD2-CD1 3.85Å; L167-L189 HydrophobicContact CG-CD1 3.68Å; I185-L189 HydrophobicContact CG2-CD1 3.66Å; I185-L189 HydrophobicContact CG2-CG 4.13Å; I185-L189 WeakPolarHBondContact O-CB 3.38Å; I185-L189 WeakPolarHBondContact O-CG 3.3Å; I185-L189 PolarHBondContact O-N 3.45Å; H187-L189 VanDerWaalsContact C-N 3.32Å; H187-L189 PolarHBondContact O-N 3.47Å; L189-L191 VanDerWaalsContact C-N 3.28Å; L189-L191 HydrophobicContact CB-CD1 4.17Å; L189-L191 HydrophobicContact CB-CG 4.18Å; L189-L191 PolarHBondContact O-N 2.84Å |
| 190 | V | 98.3 | Very high | 98.3 | Very high | 129 Ų | 129 | 68.1 Ų | 68.1 | 78% | 0.782 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 48.2 | -174.8 | -162.6 | 0 | 0 | 0 | 0 | 110.9 | A186 H187 | A186-V190 WeakPolarHBondContact O-CA 3.49Å; A186-V190 PolarHBondContact O-N 3.19Å; H187-V190 PolarHBondContact O-N 3.3Å |
| 191 | L | 97.8 | Very high | 98.3 | Very high | 18 Ų | 18 | 63 Ų | 63 | 9% | 0.094 | 31% | 0.305 | C | S | . | . | trans | -123.8 | 148.5 | 176.8 | -66.7 | 178.6 | 0 | 0 | 0 | 109.4 | Y159 L167 A186 L189 Q195 I196 | Y159-L191 HydrophobicContact CD1-CD1 4.13Å; Y159-L191 HydrophobicContact CD1-CD2 3.89Å; Y159-L191 HydrophobicContact CE1-CD1 4.02Å; Y159-L191 HydrophobicContact CE1-CD2 3.66Å; L167-L191 HydrophobicContact CD1-CD1 4.32Å; A186-L191 CarbonylContact C-O 3.45Å; A186-L191 VanDerWaalsContact CA-O 3.32Å; A186-L191 WeakPolarHBondContact CA-O 3.37Å; A186-L191 WeakPolarHBondContact CB-O 3.29Å; A186-L191 PolarHBondContact O-N 3.12Å; A186-L191 VanDerWaalsContact O-O 3.09Å; L189-L191 VanDerWaalsContact C-N 3.28Å; L189-L191 HydrophobicContact CB-CD1 4.17Å; L189-L191 HydrophobicContact CB-CG 4.18Å; L189-L191 PolarHBondContact O-N 2.84Å; L191-Q195 HydrophobicContact CB-CB 4.36Å; L191-I196 HydrophobicContact CB-CD1 3.88Å; L191-I196 HydrophobicContact CB-CG1 4.39Å; L191-I196 HydrophobicContact CD1-CD1 3.88Å | ||
| 192 | S | 98.4 | Very high | 98.3 | Very high | 56 Ų | 56 | 63.7 Ų | 63.7 | 39% | 0.392 | 32% | 0.315 | S | S | . | . | trans | -67 | 149.6 | 172.5 | 64.3 | 0 | 0 | 0 | 0 | 111.4 | R194 Q195 I196 | S192-R194 PolarHBondContact O-N 3.28Å; S192-Q195 WeakPolarHBondContact O-CB 3.39Å; S192-Q195 PolarHBondContact O-N 3.06Å; S192-Q195 VanDerWaalsContact OG-CG 3.29Å; S192-Q195 WeakPolarHBondContact OG-CG 3.34Å; S192-Q195 PolarHBondContact OG-N 3.01Å; S192-Q195 PolarHBondContact OG-OE1 2.9Å; S192-I196 PolarHBondContact O-N 3.39Å; S192-I196 VanDerWaalsContact O-N 3.11Å | ||
| 193 | E | 98.4 | Very high | 98.3 | Very high | 58 Ų | 58 | 63 Ų | 63 | 27% | 0.271 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -51.9 | -34.5 | 172.9 | -68.3 | -162.5 | -129.2 | 0 | 0 | 113 | R179 R182 A186 I196 K197 | R179-E193 IonicContact CZ-OE1 3.26Å; R179-E193 VanDerWaalsContact CZ-OE1 3.26Å; R179-E193 IonicContact CZ-OE2 3.03Å; R179-E193 IonicContact NE-OE2 3.69Å; R179-E193 IonicContact NH1-OE1 2.95Å; R179-E193 PolarHBondContact NH1-OE1 3.31Å; R179-E193 IonicContact NH1-OE2 2.63Å; R179-E193 PolarHBondContact NH1-OE2 3.14Å; R179-E193 IonicContact NH2-OE1 2.85Å; R179-E193 PolarHBondContact NH2-OE1 3.23Å; R179-E193 IonicContact NH2-OE2 3.39Å; R179-E193 PolarHBondContact NH2-OE2 3.21Å; R182-E193 HydrophobicContact CG-CB 4.34Å; R182-E193 HydrophobicContact CG-CG 4.5Å; A186-E193 HydrophobicContact CB-CG 4.27Å; E193-I196 PolarHBondContact O-N 3.23Å; E193-K197 WeakPolarHBondContact O-CB 3.32Å; E193-K197 PolarHBondContact O-N 2.74Å |
| 194 | R | 97.9 | Very high | 98.3 | Very high | 180 Ų | 180 | 64 Ų | 64 | 68% | 0.679 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -64.5 | -43.5 | 176.7 | -175.7 | 177.9 | -176.5 | -83.2 | -1.5 | 111.5 | S192 K197 I198 | S192-R194 PolarHBondContact O-N 3.28Å; R194-K197 PolarHBondContact O-N 3.06Å; R194-I198 HydrophobicContact CG-CD1 3.88Å; R194-I198 WeakPolarHBondContact O-CB 3.37Å; R194-I198 VanDerWaalsContact O-CG1 3.3Å; R194-I198 WeakPolarHBondContact O-CG1 3.42Å; R194-I198 PolarHBondContact O-N 2.82Å |
| 195 | Q | 98.2 | Very high | 98.3 | Very high | 59 Ų | 59 | 65.6 Ų | 65.6 | 28% | 0.276 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 176.2 | -76.7 | 163.4 | -51.7 | 0 | 0 | 110.9 | L191 S192 K197 I198 W199 | L191-Q195 HydrophobicContact CB-CB 4.36Å; S192-Q195 WeakPolarHBondContact O-CB 3.39Å; S192-Q195 PolarHBondContact O-N 3.06Å; S192-Q195 VanDerWaalsContact OG-CG 3.29Å; S192-Q195 WeakPolarHBondContact OG-CG 3.34Å; S192-Q195 PolarHBondContact OG-N 3.01Å; S192-Q195 PolarHBondContact OG-OE1 2.9Å; Q195-K197 VanDerWaalsContact C-N 3.33Å; Q195-K197 PolarHBondContact O-N 3.16Å; Q195-I198 PolarHBondContact O-N 3.23Å; Q195-W199 WeakPolarHBondContact O-CB 3.47Å; Q195-W199 PolarHBondContact O-N 2.95Å |
| 196 | I | 98.5 | Very high | 98.2 | Very high | 0 Ų | 0 | 71 Ų | 71 | 0% | 0 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -57.9 | -47.1 | 174.7 | -55.4 | -58.6 | 0 | 0 | 0 | 110.7 | L167 L177 R182 I185 A186 L191 S192 E193 I198 W199 F200 | L167-I196 HydrophobicContact CD2-CD1 3.78Å; L177-I196 HydrophobicContact CD1-CG2 3.49Å; L177-I196 VanDerWaalsContact CD1-CG2 3.49Å; R182-I196 HydrophobicContact CG-CB 4.11Å; R182-I196 HydrophobicContact CG-CG2 3.92Å; I185-I196 HydrophobicContact CG2-CD1 3.89Å; A186-I196 HydrophobicContact CB-CG1 4.07Å; L191-I196 HydrophobicContact CB-CD1 3.88Å; L191-I196 HydrophobicContact CB-CG1 4.39Å; L191-I196 HydrophobicContact CD1-CD1 3.88Å; S192-I196 PolarHBondContact O-N 3.39Å; S192-I196 VanDerWaalsContact O-N 3.11Å; E193-I196 PolarHBondContact O-N 3.23Å; I196-I198 PolarHBondContact O-N 3.44Å; I196-W199 PolarHBondContact O-N 2.92Å; I196-F200 HydrophobicContact CG2-CD2 4.1Å; I196-F200 HydrophobicContact CG2-CE2 4.3Å; I196-F200 WeakPolarHBondContact O-CD2 3.35Å; I196-F200 PolarHBondContact O-N 3.43Å |
| 197 | K | 98.3 | Very high | 98 | Very high | 123 Ų | 123 | 74.6 Ų | 74.6 | 54% | 0.535 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -58.8 | -47.2 | 177.7 | -177.6 | -176.6 | 177 | -177.6 | 0 | 112.1 | E193 R194 Q195 Q201 | E193-K197 WeakPolarHBondContact O-CB 3.32Å; E193-K197 PolarHBondContact O-N 2.74Å; R194-K197 PolarHBondContact O-N 3.06Å; Q195-K197 VanDerWaalsContact C-N 3.33Å; Q195-K197 PolarHBondContact O-N 3.16Å; K197-Q201 WeakPolarHBondContact O-CB 3.36Å; K197-Q201 PolarHBondContact O-N 2.93Å |
| 198 | I | 98.4 | Very high | 97.8 | Very high | 60 Ų | 60 | 72.7 Ų | 72.7 | 31% | 0.308 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 179.8 | -71 | 169.2 | 0 | 0 | 0 | 110.5 | R194 Q195 I196 F200 Q201 N202 | R194-I198 HydrophobicContact CG-CD1 3.88Å; R194-I198 WeakPolarHBondContact O-CB 3.37Å; R194-I198 VanDerWaalsContact O-CG1 3.3Å; R194-I198 WeakPolarHBondContact O-CG1 3.42Å; R194-I198 PolarHBondContact O-N 2.82Å; Q195-I198 PolarHBondContact O-N 3.23Å; I196-I198 PolarHBondContact O-N 3.44Å; I198-F200 PolarHBondContact O-N 3.13Å; I198-Q201 WeakPolarHBondContact O-CB 3.34Å; I198-Q201 PolarHBondContact O-N 2.95Å; I198-N202 VanDerWaalsContact O-CG 3.31Å; I198-N202 PolarHBondContact O-N 3.15Å; I198-N202 PolarHBondContact O-ND2 3.39Å |
| 199 | W | 98.5 | Very high | 97.6 | Very high | 31 Ų | 31 | 74.9 Ų | 74.9 | 12% | 0.117 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.3 | -47.8 | 178.5 | -170.1 | 100.4 | 0 | 0 | 0 | 111.1 | Y159 L167 E168 F171 Q195 I196 Q201 N202 R203 | Y159-W199 AromaticContact CD2-CD1 3.91Å; Y159-W199 AromaticContact CE2-CD1 3.67Å; L167-W199 VanDerWaalsContact C-CH2 3.48Å; L167-W199 HydrophobicContact CB-CD2 3.93Å; L167-W199 HydrophobicContact CB-CE3 3.94Å; L167-W199 HydrophobicContact CB-CH2 3.62Å; L167-W199 HydrophobicContact CB-CZ2 3.58Å; L167-W199 HydrophobicContact CB-CZ3 3.79Å; L167-W199 HydrophobicContact CD1-CD2 3.88Å; L167-W199 HydrophobicContact CD1-CG 3.85Å; L167-W199 HydrophobicContact CD2-CD2 4.35Å; L167-W199 HydrophobicContact CD2-CE3 4.27Å; L167-W199 HydrophobicContact CG-CD2 4.28Å; L167-W199 HydrophobicContact CG-CE3 4.49Å; L167-W199 WeakPolarHBondContact O-CH2 3.47Å; L167-W199 WeakPolarHBondContact O-CZ3 3.36Å; E168-W199 HydrophobicContact CG-CH2 3.99Å; E168-W199 HydrophobicContact CG-CZ2 4.02Å; F171-W199 HydrophobicContact CB-CH2 4.32Å; F171-W199 HydrophobicContact CB-CZ3 4.06Å; Q195-W199 WeakPolarHBondContact O-CB 3.47Å; Q195-W199 PolarHBondContact O-N 2.95Å; I196-W199 PolarHBondContact O-N 2.92Å; W199-Q201 VanDerWaalsContact C-N 3.31Å; W199-Q201 PolarHBondContact O-N 3.12Å; W199-N202 PolarHBondContact O-N 3.19Å; W199-R203 HydrophobicContact CE3-CB 3.95Å; W199-R203 HydrophobicContact CE3-CG 4.49Å; W199-R203 HydrophobicContact CH2-CB 4.05Å; W199-R203 HydrophobicContact CH2-CG 3.76Å; W199-R203 HydrophobicContact CZ3-CB 3.7Å; W199-R203 HydrophobicContact CZ3-CG 3.74Å; W199-R203 WeakPolarHBondContact O-CB 3.43Å; W199-R203 PolarHBondContact O-N 3.31Å |
| 200 | F | 98.7 | Very high | 97.2 | Very high | 7 Ų | 7 | 78.9 Ų | 78.9 | 3% | 0.031 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.5 | -33.1 | 176.9 | -91.6 | -102.9 | 0 | 0 | 0 | 112.9 | L167 E170 F171 L177 I196 I198 R204 | L167-F200 HydrophobicContact CD2-CE2 4.1Å; E170-F200 HydrophobicContact CB-CZ 4.06Å; F171-F200 HydrophobicContact CB-CE1 4.2Å; F171-F200 HydrophobicContact CB-CZ 4.31Å; F171-F200 AromaticContact CD2-CD1 3.96Å; F171-F200 HydrophobicContact CD2-CD1 3.96Å; F171-F200 AromaticContact CD2-CE1 3.9Å; F171-F200 HydrophobicContact CD2-CE1 3.9Å; L177-F200 HydrophobicContact CD1-CD1 4.15Å; L177-F200 HydrophobicContact CD1-CD2 3.59Å; L177-F200 HydrophobicContact CD1-CE1 3.98Å; L177-F200 HydrophobicContact CD1-CE2 3.43Å; L177-F200 VanDerWaalsContact CD1-CE2 3.43Å; L177-F200 HydrophobicContact CD1-CG 3.97Å; L177-F200 HydrophobicContact CD1-CZ 3.63Å; L177-F200 HydrophobicContact CD2-CE1 3.76Å; L177-F200 HydrophobicContact CD2-CE2 4.34Å; L177-F200 HydrophobicContact CD2-CZ 3.67Å; L177-F200 HydrophobicContact CG-CD1 3.8Å; L177-F200 HydrophobicContact CG-CD2 4.17Å; L177-F200 HydrophobicContact CG-CE1 3.53Å; L177-F200 HydrophobicContact CG-CE2 3.96Å; L177-F200 HydrophobicContact CG-CG 4.11Å; L177-F200 HydrophobicContact CG-CZ 3.63Å; I196-F200 HydrophobicContact CG2-CD2 4.1Å; I196-F200 HydrophobicContact CG2-CE2 4.3Å; I196-F200 WeakPolarHBondContact O-CD2 3.35Å; I196-F200 PolarHBondContact O-N 3.43Å; I198-F200 PolarHBondContact O-N 3.13Å; F200-R204 WeakPolarHBondContact O-CB 3.49Å; F200-R204 WeakPolarHBondContact O-CG 3.34Å; F200-R204 PolarHBondContact O-N 2.97Å; F200-R204 VanDerWaalsContact O-N 3.07Å; F200-R204 PolarHBondContact O-NE 3.02Å |
| 201 | Q | 98.6 | Very high | 96.6 | Very high | 82 Ų | 82 | 78.6 Ų | 78.6 | 38% | 0.383 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -64.7 | -50.4 | 172.7 | -173 | 64.4 | 49.5 | 0 | 0 | 111 | K197 I198 W199 R203 R204 M205 | K197-Q201 WeakPolarHBondContact O-CB 3.36Å; K197-Q201 PolarHBondContact O-N 2.93Å; I198-Q201 WeakPolarHBondContact O-CB 3.34Å; I198-Q201 PolarHBondContact O-N 2.95Å; W199-Q201 VanDerWaalsContact C-N 3.31Å; W199-Q201 PolarHBondContact O-N 3.12Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 3.34Å; Q201-R204 PolarHBondContact O-N 3.05Å; Q201-M205 WeakPolarHBondContact O-CG 3.4Å; Q201-M205 PolarHBondContact O-N 3.4Å |
| 202 | N | 98.1 | Very high | 95.2 | Very high | 102 Ų | 102 | 85.5 Ų | 85.5 | 55% | 0.545 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.5 | -42.5 | 178.4 | -69 | -17.2 | 0 | 0 | 0 | 111.4 | I198 W199 R204 M205 K206 | I198-N202 VanDerWaalsContact O-CG 3.31Å; I198-N202 PolarHBondContact O-N 3.15Å; I198-N202 PolarHBondContact O-ND2 3.39Å; W199-N202 PolarHBondContact O-N 3.19Å; N202-R204 PolarHBondContact O-N 3.21Å; N202-M205 PolarHBondContact O-N 3.14Å; N202-K206 PolarHBondContact O-N 3.36Å |
| 203 | R | 98.3 | Very high | 93.2 | Very high | 41 Ų | 41 | 88.5 Ų | 88.5 | 16% | 0.155 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.9 | -42.1 | 179.5 | -175.2 | 64.7 | -171.2 | 107.8 | -8.5 | 112 | F171 W199 Q201 K206 W207 | F171-R203 HydrophobicContact CB-CG 4.41Å; F171-R203 HydrophobicContact CD1-CG 3.73Å; F171-R203 HydrophobicContact CD2-CB 4.21Å; F171-R203 HydrophobicContact CD2-CG 3.57Å; F171-R203 HydrophobicContact CE1-CG 3.79Å; F171-R203 HydrophobicContact CE2-CB 4.19Å; F171-R203 HydrophobicContact CE2-CG 3.65Å; F171-R203 HydrophobicContact CG-CG 3.61Å; F171-R203 HydrophobicContact CZ-CG 3.76Å; W199-R203 HydrophobicContact CE3-CB 3.95Å; W199-R203 HydrophobicContact CE3-CG 4.49Å; W199-R203 HydrophobicContact CH2-CB 4.05Å; W199-R203 HydrophobicContact CH2-CG 3.76Å; W199-R203 HydrophobicContact CZ3-CB 3.7Å; W199-R203 HydrophobicContact CZ3-CG 3.74Å; W199-R203 WeakPolarHBondContact O-CB 3.43Å; W199-R203 PolarHBondContact O-N 3.31Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 3.34Å; R203-K206 PolarHBondContact O-N 2.95Å; R203-W207 WeakPolarHBondContact O-CB 3.35Å; R203-W207 PolarHBondContact O-N 2.94Å |
| 204 | R | 97.9 | Very high | 91.6 | Very high | 63 Ų | 63 | 92.1 Ų | 92.1 | 24% | 0.238 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -63.9 | -40 | 173.5 | -75.8 | -175.3 | -69.2 | 150.9 | 0.6 | 112.5 | F171 R175 F200 Q201 N202 W207 K208 | F171-R204 HydrophobicContact CE2-CG 3.74Å; F171-R204 HydrophobicContact CZ-CG 4.26Å; R175-R204 WeakPolarHBondContact O-CD 3.24Å; F200-R204 WeakPolarHBondContact O-CB 3.49Å; F200-R204 WeakPolarHBondContact O-CG 3.34Å; F200-R204 PolarHBondContact O-N 2.97Å; F200-R204 VanDerWaalsContact O-N 3.07Å; F200-R204 PolarHBondContact O-NE 3.02Å; Q201-R204 PolarHBondContact O-N 3.05Å; N202-R204 PolarHBondContact O-N 3.21Å; R204-W207 PolarHBondContact O-N 3.32Å; R204-K208 WeakPolarHBondContact O-CB 3.41Å; R204-K208 PolarHBondContact O-N 3.45Å |
| 205 | M | 97.8 | Very high | 88.8 | Confident | 98 Ų | 98 | 89.1 Ų | 89.1 | 48% | 0.483 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.1 | -43.5 | 176.1 | -66.4 | -62.5 | -90.4 | 0 | 0 | 111.6 | Q201 N202 K208 K209 | Q201-M205 WeakPolarHBondContact O-CG 3.4Å; Q201-M205 PolarHBondContact O-N 3.4Å; N202-M205 PolarHBondContact O-N 3.14Å; M205-K208 PolarHBondContact O-N 2.97Å; M205-K209 PolarHBondContact O-N 3.14Å; M205-K209 VanDerWaalsContact O-N 3.07Å |
| 206 | K | 96.3 | Very high | 86.6 | Confident | 122 Ų | 122 | 91.7 Ų | 91.7 | 53% | 0.53 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.6 | -50.3 | 173.6 | -177.5 | 177.5 | 178.4 | -172.4 | 0 | 111.4 | N202 R203 K208 K209 D210 | N202-K206 PolarHBondContact O-N 3.36Å; R203-K206 PolarHBondContact O-N 2.95Å; K206-K208 VanDerWaalsContact C-N 3.3Å; K206-K208 PolarHBondContact O-N 3.41Å; K206-K209 WeakPolarHBondContact O-CB 3.32Å; K206-K209 PolarHBondContact O-N 3.33Å; K206-D210 WeakPolarHBondContact CG-OD2 3.2Å; K206-D210 PolarHBondContact O-N 2.86Å |
| 207 | W | 95.4 | Very high | 84.3 | Confident | 80 Ų | 80 | 101.3 Ų | 101.3 | 30% | 0.303 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -55.7 | -44.3 | 177 | -176.6 | 82.8 | 0 | 0 | 0 | 111.9 | F171 R203 R204 K209 D210 H211 | F171-W207 HydrophobicContact CE1-CB 4.3Å; F171-W207 HydrophobicContact CE1-CG 4.25Å; F171-W207 HydrophobicContact CZ-CB 4.03Å; F171-W207 HydrophobicContact CZ-CG 4.17Å; R203-W207 WeakPolarHBondContact O-CB 3.35Å; R203-W207 PolarHBondContact O-N 2.94Å; R204-W207 PolarHBondContact O-N 3.32Å; W207-K209 VanDerWaalsContact C-N 3.32Å; W207-K209 PolarHBondContact O-N 3.47Å; W207-D210 PolarHBondContact O-N 3.12Å; W207-H211 AromaticContact CD1-CD2 3.22Å; W207-H211 AromaticContact CD1-NE2 3.3Å; W207-H211 VanDerWaalsContact CD1-NE2 3.3Å; W207-H211 AromaticContact CD2-CD2 3.84Å; W207-H211 AromaticContact CE2-CD2 3.44Å; W207-H211 VanDerWaalsContact CE2-CD2 3.44Å; W207-H211 AromaticContact CE2-CG 3.87Å; W207-H211 AromaticContact CE2-NE2 3.77Å; W207-H211 AromaticContact CG-CD2 3.7Å; W207-H211 HydrophobicContact CZ2-CB 4.46Å; W207-H211 AromaticContact NE1-CD2 3.01Å; W207-H211 PolarHBondContact NE1-CD2 3.39Å; W207-H211 AromaticContact NE1-CE1 3.74Å; W207-H211 AromaticContact NE1-CG 3.81Å; W207-H211 AromaticContact NE1-NE2 2.93Å; W207-H211 PolarHBondContact NE1-NE2 3.49Å; W207-H211 WeakPolarHBondContact O-CB 3.31Å; W207-H211 PolarHBondContact O-CD2 3.3Å; W207-H211 PolarHBondContact O-N 2.92Å |
| 208 | K | 94.5 | Very high | 81.9 | Confident | 103 Ų | 103 | 103.1 Ų | 103.1 | 45% | 0.448 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60 | -40.8 | 175.7 | -174.2 | -177 | 68.6 | 173.1 | 0 | 112.1 | R204 M205 K206 K212 | R204-K208 WeakPolarHBondContact O-CB 3.41Å; R204-K208 PolarHBondContact O-N 3.45Å; M205-K208 PolarHBondContact O-N 2.97Å; K206-K208 VanDerWaalsContact C-N 3.3Å; K206-K208 PolarHBondContact O-N 3.41Å; K208-K212 HydrophobicContact CG-CD 3.77Å; K208-K212 HydrophobicContact CG-CG 4.43Å; K208-K212 VanDerWaalsContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CG 3.3Å; K208-K212 PolarHBondContact O-N 3.46Å |
| 209 | K | 93.6 | Very high | 79.7 | Confident | 152 Ų | 152 | 111.2 Ų | 111.2 | 66% | 0.661 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.6 | -45.8 | 177.7 | -175.2 | 178.2 | 178.2 | 179.5 | 0 | 111.2 | M205 K206 W207 H211 | M205-K209 PolarHBondContact O-N 3.14Å; M205-K209 VanDerWaalsContact O-N 3.07Å; K206-K209 WeakPolarHBondContact O-CB 3.32Å; K206-K209 PolarHBondContact O-N 3.33Å; W207-K209 VanDerWaalsContact C-N 3.32Å; W207-K209 PolarHBondContact O-N 3.47Å; K209-H211 VanDerWaalsContact C-N 3.33Å; K209-H211 PolarHBondContact O-N 3.31Å |
| 210 | D | 90.2 | Very high | 77.2 | Confident | 92 Ų | 92 | 115 Ų | 115 | 49% | 0.492 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -69.5 | -30.2 | -176.5 | -58.1 | -15.2 | 0 | 0 | 0 | 111.9 | K206 W207 | K206-D210 WeakPolarHBondContact CG-OD2 3.2Å; K206-D210 PolarHBondContact O-N 2.86Å; W207-D210 PolarHBondContact O-N 3.12Å |
| 211 | H | 84.7 | Confident | 74.8 | Confident | 124 Ų | 124 | 121.4 Ų | 121.4 | 57% | 0.574 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.4 | 4.9 | -176.3 | -73.1 | -87.6 | 0 | 0 | 0 | 115.6 | W207 K209 | W207-H211 AromaticContact CD1-CD2 3.22Å; W207-H211 AromaticContact CD1-NE2 3.3Å; W207-H211 VanDerWaalsContact CD1-NE2 3.3Å; W207-H211 AromaticContact CD2-CD2 3.84Å; W207-H211 AromaticContact CE2-CD2 3.44Å; W207-H211 VanDerWaalsContact CE2-CD2 3.44Å; W207-H211 AromaticContact CE2-CG 3.87Å; W207-H211 AromaticContact CE2-NE2 3.77Å; W207-H211 AromaticContact CG-CD2 3.7Å; W207-H211 HydrophobicContact CZ2-CB 4.46Å; W207-H211 AromaticContact NE1-CD2 3.01Å; W207-H211 PolarHBondContact NE1-CD2 3.39Å; W207-H211 AromaticContact NE1-CE1 3.74Å; W207-H211 AromaticContact NE1-CG 3.81Å; W207-H211 AromaticContact NE1-NE2 2.93Å; W207-H211 PolarHBondContact NE1-NE2 3.49Å; W207-H211 WeakPolarHBondContact O-CB 3.31Å; W207-H211 PolarHBondContact O-CD2 3.3Å; W207-H211 PolarHBondContact O-N 2.92Å; K209-H211 VanDerWaalsContact C-N 3.33Å; K209-H211 PolarHBondContact O-N 3.31Å |
| 212 | K | 67.8 | Low | 72.4 | Confident | 162 Ų | 162 | 122.1 Ų | 122.1 | 70% | 0.704 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -118.7 | 21.4 | -178.2 | -71.9 | -168.7 | 160.2 | -79.9 | 0 | 115.6 | K208 | K208-K212 HydrophobicContact CG-CD 3.77Å; K208-K212 HydrophobicContact CG-CG 4.43Å; K208-K212 VanDerWaalsContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CB 3.24Å; K208-K212 WeakPolarHBondContact O-CG 3.3Å; K208-K212 PolarHBondContact O-N 3.46Å |
| 213 | L | 57.4 | Low | 69.8 | Low | 120 Ų | 120 | 123.7 Ų | 123.7 | 63% | 0.628 | 62% | 0.615 | S | S | * | * | trans | -123.9 | 108.6 | 170 | -77.3 | 145.3 | 0 | 0 | 0 | 109.6 | N215 | L213-N215 VanDerWaalsContact C-N 3.3Å; L213-N215 HydrophobicContact CB-CB 4.47Å; L213-N215 HydrophobicContact CD2-CB 3.96Å; L213-N215 PolarHBondContact O-N 2.77Å | ||
| 214 | P | 63.8 | Low | 67.3 | Low | 134 Ų | 134 | 126.9 Ų | 126.9 | 87% | 0.87 | 64% | 0.643 | S | S | * | * | trans | -80 | 87.5 | 142.6 | 32.2 | -23.3 | 0 | 0 | 0 | 106.2 | ||||
| 215 | N | 41.1 | Very low | 64.7 | Low | 116 Ų | 116 | 130.9 Ų | 130.9 | 62% | 0.62 | 67% | 0.669 | S | S | * | * | trans | -140.2 | 92.5 | 170.3 | -157.8 | 29.7 | 0 | 0 | 0 | 111.6 | L213 | L213-N215 VanDerWaalsContact C-N 3.3Å; L213-N215 HydrophobicContact CB-CB 4.47Å; L213-N215 HydrophobicContact CD2-CB 3.96Å; L213-N215 PolarHBondContact O-N 2.77Å | ||
| 216 | T | 51.1 | Low | 61.9 | Low | 114 Ų | 114 | 133.7 Ų | 133.7 | 70% | 0.699 | 69% | 0.686 | S | S | * | * | trans | 51.6 | 118.7 | 131.6 | 70 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 217 | K | 49.2 | Very low | 59.5 | Low | 202 Ų | 202 | 133.5 Ų | 133.5 | 88% | 0.878 | 70% | 0.695 | S | S | * | * | trans | 68.1 | 75.2 | 143.4 | -153.1 | 177.7 | -173.4 | -177.2 | 0 | 117.4 | ||||
| 218 | I | 49.7 | Very low | 56.8 | Low | 161 Ų | 161 | 136.9 Ų | 136.9 | 83% | 0.826 | 72% | 0.719 | S | S | * | * | trans | -125.4 | 92.7 | 135.3 | -49.1 | 179.3 | 0 | 0 | 0 | 108.3 | S220 | I218-S220 PolarHBondContact O-N 3.05Š| ||
| 219 | R | 52.2 | Low | 54.2 | Low | 230 Ų | 230 | 136.4 Ų | 136.4 | 87% | 0.868 | 73% | 0.729 | S | S | * | * | trans | 28.1 | 72.9 | 139.4 | -160.9 | 170.1 | -175.9 | -175.1 | -0.6 | 115.4 | N221 | R219-N221 PolarHBondContact O-N 2.7Š| ||
| 220 | S | 44.7 | Very low | 51.6 | Low | 110 Ų | 110 | 138.2 Ų | 138.2 | 77% | 0.769 | 74% | 0.74 | S | S | * | * | trans | -89 | 93.9 | 154.1 | -43.8 | 0 | 0 | 0 | 0 | 106.9 | I218 S222 | I218-S220 PolarHBondContact O-N 3.05Å; S220-S222 PolarHBondContact O-N 2.93Å | ||
| 221 | N | 49.5 | Very low | 49.1 | Very low | 142 Ų | 142 | 139.6 Ų | 139.6 | 76% | 0.759 | 76% | 0.756 | S | S | * | * | trans | -70.5 | 80.3 | 164.1 | -171 | 78.6 | 0 | 0 | 0 | 107.5 | R219 | R219-N221 PolarHBondContact O-N 2.7Š| ||
| 222 | S | 46.3 | Very low | 47.1 | Very low | 96 Ų | 96 | 139.3 Ų | 139.3 | 67% | 0.671 | 77% | 0.769 | S | S | * | * | trans | -117.1 | 94.1 | 165.1 | -67.4 | 0 | 0 | 0 | 0 | 106.3 | S220 S224 | S220-S222 PolarHBondContact O-N 2.93Å; S222-S224 VanDerWaalsContact C-N 3.34Å; S222-S224 PolarHBondContact O-N 3.04Å | ||
| 223 | N | 44.5 | Very low | 45.6 | Very low | 136 Ų | 136 | 135 Ų | 135 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | -54.3 | 102.1 | 160.1 | -106.3 | 16.8 | 0 | 0 | 0 | 107.7 | ||||
| 224 | S | 46.1 | Very low | 44.8 | Very low | 108 Ų | 108 | 138.1 Ų | 138.1 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | -124.6 | 87.6 | 159.2 | -67.3 | 0 | 0 | 0 | 0 | 106.4 | S222 N226 | S222-S224 VanDerWaalsContact C-N 3.34Å; S222-S224 PolarHBondContact O-N 3.04Å; S224-N226 PolarHBondContact O-N 3.39Å | ||
| 225 | N | 42.9 | Very low | 43.8 | Very low | 146 Ų | 146 | 135.8 Ų | 135.8 | 78% | 0.781 | 78% | 0.779 | S | S | * | * | trans | -55.6 | 116.1 | 163.1 | -72.6 | -16.9 | 0 | 0 | 0 | 107.6 | ||||
| 226 | N | 39.5 | Very low | 43.6 | Very low | 157 Ų | 157 | 138.8 Ų | 138.8 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -143.7 | 115.9 | 149.8 | -148.9 | -5.8 | 0 | 0 | 0 | 110.9 | S224 | S224-N226 PolarHBondContact O-N 3.39Š| ||
| 227 | T | 45.8 | Very low | 42.8 | Very low | 118 Ų | 118 | 136.8 Ų | 136.8 | 72% | 0.724 | 80% | 0.795 | S | S | * | * | trans | -80.6 | 124.9 | 179.1 | 44.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 228 | N | 37.9 | Very low | 42.5 | Very low | 152 Ų | 152 | 133 Ų | 133 | 81% | 0.813 | 79% | 0.794 | S | S | * | * | trans | -169 | 103.7 | 144.5 | -122.3 | 5.3 | 0 | 0 | 0 | 107.9 | ||||
| 229 | S | 39.8 | Very low | 42.2 | Very low | 92 Ų | 92 | 131.3 Ų | 131.3 | 64% | 0.643 | 80% | 0.797 | S | S | * | * | 62.6 | 96.9 | 75.4 | -51.1 | 0 | 0 | 0 | 0 | 113 | |||||
| 230 | Q | 39.2 | Very low | 41.9 | Very low | 190 Ų | 190 | 128.8 Ų | 128.8 | 89% | 0.888 | 80% | 0.795 | S | S | * | * | trans | 38.9 | 124.7 | 132.3 | -58.7 | 176.4 | 5.9 | 0 | 0 | 118.9 | ||||
| 231 | S | 37.9 | Very low | 42.1 | Very low | 121 Ų | 121 | 131.6 Ų | 131.6 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | 179.2 | 143.9 | 106.7 | 58.2 | 0 | 0 | 0 | 0 | 113 | |||||
| 232 | S | 43.5 | Very low | 41.8 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -64.1 | 167.8 | 179.2 | -32 | 0 | 0 | 0 | 0 | 114 | ||||
| 233 | G | 36.3 | Very low | 42.3 | Very low | 71 Ų | 71 | 137.9 Ų | 137.9 | 73% | 0.732 | 82% | 0.815 | S | S | * | * | trans | -74.5 | -170.2 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 234 | L | 39.6 | Very low | 42.5 | Very low | 185 Ų | 185 | 137.3 Ų | 137.3 | 97% | 0.969 | 82% | 0.822 | S | S | * | * | trans | 176.2 | 147.4 | 139.9 | -91.6 | 174.6 | 0 | 0 | 0 | 109.7 | ||||
| 235 | A | 42.1 | Very low | 42.8 | Very low | 86 Ų | 86 | 135.6 Ų | 135.6 | 71% | 0.711 | 82% | 0.821 | S | S | * | * | trans | -81.3 | 149.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 236 | L | 37.6 | Very low | 44.3 | Very low | 179 Ų | 179 | 134.6 Ų | 134.6 | 94% | 0.937 | 82% | 0.823 | S | S | * | * | trans | 175.7 | 148.2 | 131.3 | -125 | 81.2 | 0 | 0 | 0 | 111.3 | ||||
| 237 | G | 35.4 | Very low | 45.7 | Very low | 71 Ų | 71 | 132.6 Ų | 132.6 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | trans | 108.3 | 93.2 | 133.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 238 | S | 41.2 | Very low | 46.6 | Very low | 123 Ų | 123 | 133.2 Ų | 133.2 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | trans | -28.8 | 143.6 | 154.5 | -40 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 239 | S | 44 | Very low | 47.9 | Very low | 125 Ų | 125 | 131.4 Ų | 131.4 | 87% | 0.874 | 82% | 0.823 | S | S | * | * | -168.2 | 148.3 | 120.8 | -145.6 | 0 | 0 | 0 | 0 | 113 | |||||
| 240 | Q | 47.1 | Very low | 48.7 | Very low | 177 Ų | 177 | 139 Ų | 139 | 83% | 0.827 | 86% | 0.856 | S | S | * | * | trans | -71.4 | 149.1 | -172 | -60 | 164.4 | -1.2 | 0 | 0 | 112.1 | ||||
| 241 | N | 47.1 | Very low | 49.1 | Very low | 169 Ų | 169 | 136.5 Ų | 136.5 | 90% | 0.904 | 85% | 0.854 | S | S | * | * | trans | -154.9 | 122.8 | 133.1 | -121.9 | -16.2 | 0 | 0 | 0 | 112.2 | ||||
| 242 | R | 44.3 | Very low | 49.7 | Very low | 232 Ų | 232 | 137.3 Ų | 137.3 | 88% | 0.875 | 86% | 0.855 | S | S | * | * | trans | -89.2 | 131.4 | 171.9 | -67.4 | 173.5 | 168.7 | -125.7 | -0.7 | 107.8 | ||||
| 243 | T | 55.7 | Low | 50.1 | Low | 139 Ų | 139 | 138.3 Ų | 138.3 | 85% | 0.853 | 86% | 0.856 | S | S | * | * | trans | -149.4 | 116.3 | 146.5 | 53.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 244 | S | 48.8 | Very low | 50.9 | Low | 124 Ų | 124 | 142.3 Ų | 142.3 | 87% | 0.867 | 86% | 0.863 | S | S | * | * | trans | -66.8 | 132.6 | 171.9 | 43.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 245 | G | 53.6 | Low | 51.6 | Low | 72 Ų | 72 | 139.6 Ų | 139.6 | 74% | 0.742 | 86% | 0.857 | S | S | * | * | trans | -109.2 | 141.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 246 | P | 74.6 | Confident | 52.2 | Low | 125 Ų | 125 | 143.2 Ų | 143.2 | 81% | 0.812 | 87% | 0.866 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 165.9 | -178 | 35 | -33 | 0 | 0 | 0 | 112.7 | ||
| 247 | P | 68.2 | Low | 53.3 | Low | 114 Ų | 114 | 140.6 Ų | 140.6 | 74% | 0.74 | 86% | 0.861 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 164 | -170 | 35.1 | -35.3 | 0 | 0 | 0 | 113.6 | ||
| 248 | P | 65.6 | Low | 54.6 | Low | 131 Ų | 131 | 146 Ų | 146 | 85% | 0.851 | 87% | 0.871 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 147.7 | 179.5 | 32.3 | -33.6 | 0 | 0 | 0 | 112.2 | ||
| 249 | S | 63.3 | Low | 55.8 | Low | 114 Ų | 114 | 147.9 Ų | 147.9 | 80% | 0.797 | 87% | 0.872 | S | S | * | * | trans | -112.8 | 136.2 | 168.3 | -64.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 250 | L | 56.8 | Low | 56.8 | Low | 253 Ų | 253 | 150 Ų | 150 | 100% | 1.325 | 87% | 0.872 | S | S | * | * | trans | 79.8 | 0 | 171.1 | -56.5 | 176 | 0 | 0 | 0 | 117.4 |
Retrieved 250 of 250 residues in 859.8 ms
(Link to these results)