| 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 | 55.3 | Low | 55 | Low | 242 Ų | 242 | 152.9 Ų | 152.9 | 100% | 1.192 | 82% | 0.823 | S | S | * | * | 0 | 119.3 | 0 | -69.6 | 166 | 173.2 | 0 | 0 | 107.9 | |||||
| 2 | T | 51.9 | Low | 55.1 | Low | 140 Ų | 140 | 155.9 Ų | 155.9 | 86% | 0.859 | 82% | 0.816 | S | S | * | * | trans | -91.3 | 136.6 | 173.3 | 40.1 | 0 | 0 | 0 | 0 | 109.4 | S4 | T2-S4 PolarHBondContact O-N 3.11Š| ||
| 3 | M | 53.1 | Low | 56 | Low | 179 Ų | 179 | 153.6 Ų | 153.6 | 88% | 0.882 | 81% | 0.812 | S | S | * | * | trans | -86.7 | 105.6 | 176.6 | -69.5 | -88 | 72.3 | 0 | 0 | 109.2 | S5 | M3-S5 PolarHBondContact O-N 3.46Š| ||
| 4 | S | 49.4 | Very low | 56.9 | Low | 98 Ų | 98 | 151 Ų | 151 | 69% | 0.685 | 80% | 0.799 | S | S | * | * | trans | -68.7 | 109.3 | 174.7 | -170.2 | 0 | 0 | 0 | 0 | 109.9 | T2 Y6 | T2-S4 PolarHBondContact O-N 3.11Å; S4-Y6 PolarHBondContact O-N 3.38Å | ||
| 5 | S | 53.5 | Low | 57.3 | Low | 102 Ų | 102 | 145.3 Ų | 145.3 | 71% | 0.713 | 77% | 0.774 | S | S | * | * | trans | -82.2 | 102.4 | 176.6 | 56.5 | 0 | 0 | 0 | 0 | 110.1 | M3 L7 | M3-S5 PolarHBondContact O-N 3.46Å; S5-L7 PolarHBondContact O-N 2.98Å | ||
| 6 | Y | 53 | Low | 58.5 | Low | 215 Ų | 215 | 148.6 Ų | 148.6 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | trans | -63.8 | 96.3 | 169.2 | -72.5 | -94 | 0 | 0 | 0 | 110.1 | S4 I8 | S4-Y6 PolarHBondContact O-N 3.38Å; Y6-I8 PolarHBondContact O-N 2.8Å; Y6-I8 VanDerWaalsContact O-N 3.17Å | ||
| 7 | L | 67.4 | Low | 58.7 | Low | 152 Ų | 152 | 149.5 Ų | 149.5 | 80% | 0.796 | 78% | 0.776 | S | S | * | * | trans | -69.9 | 104.3 | 158.4 | -71.9 | 177.2 | 0 | 0 | 0 | 107.1 | S5 | S5-L7 PolarHBondContact O-N 2.98Š| ||
| 8 | I | 58 | Low | 59.5 | Low | 142 Ų | 142 | 144.9 Ų | 144.9 | 73% | 0.728 | 76% | 0.757 | S | S | * | * | trans | -62.2 | 136 | 173.6 | -153.2 | 75.1 | 0 | 0 | 0 | 108.4 | Y6 S10 | Y6-I8 PolarHBondContact O-N 2.8Å; Y6-I8 VanDerWaalsContact O-N 3.17Å; I8-S10 PolarHBondContact O-N 3.03Å | ||
| 9 | N | 51.9 | Low | 59.8 | Low | 160 Ų | 160 | 142.1 Ų | 142.1 | 86% | 0.856 | 75% | 0.748 | S | S | * | * | trans | -71.5 | 72.7 | -177.9 | -70.8 | 49.1 | 0 | 0 | 0 | 111.8 | ||||
| 10 | S | 53.7 | Low | 59.6 | Low | 91 Ų | 91 | 140.4 Ų | 140.4 | 64% | 0.636 | 75% | 0.747 | S | S | * | * | trans | -77.7 | 119.1 | 164.5 | -65 | 0 | 0 | 0 | 0 | 109.2 | I8 Y12 | I8-S10 PolarHBondContact O-N 3.03Å; S10-Y12 PolarHBondContact O-N 3.47Å | ||
| 11 | N | 58 | Low | 59.6 | Low | 161 Ų | 161 | 141.3 Ų | 141.3 | 86% | 0.861 | 75% | 0.747 | S | S | * | * | trans | -66.9 | 84.1 | 166 | -75.3 | -55.2 | 0 | 0 | 0 | 109 | V13 | N11-V13 VanDerWaalsContact C-N 3.29Å; N11-V13 PolarHBondContact O-N 3.39Å | ||
| 12 | Y | 56.1 | Low | 59.6 | Low | 189 Ų | 189 | 136.3 Ų | 136.3 | 74% | 0.741 | 72% | 0.721 | S | S | * | * | trans | -74.9 | 85.6 | 176.2 | -165.1 | -86.5 | 0 | 0 | 0 | 108.9 | S10 D14 | S10-Y12 PolarHBondContact O-N 3.47Å; Y12-D14 PolarHBondContact O-N 3.03Å | ||
| 13 | V | 66.8 | Low | 59.7 | Low | 126 Ų | 126 | 139 Ų | 139 | 76% | 0.764 | 72% | 0.717 | S | S | * | * | trans | -67.5 | 103.1 | 167.2 | -179.3 | 0 | 0 | 0 | 0 | 106.8 | N11 | N11-V13 VanDerWaalsContact C-N 3.29Å; N11-V13 PolarHBondContact O-N 3.39Å | ||
| 14 | D | 68.1 | Low | 59.8 | Low | 117 Ų | 117 | 134.7 Ų | 134.7 | 63% | 0.626 | 70% | 0.704 | S | S | * | * | trans | -56.7 | 122.9 | 173.9 | -173.4 | 43.2 | 0 | 0 | 0 | 108.9 | Y12 K16 | Y12-D14 PolarHBondContact O-N 3.03Å; D14-K16 PolarHBondContact O-N 3.42Å | ||
| 15 | P | 62.7 | Low | 60.1 | Low | 66 Ų | 66 | 136 Ų | 136 | 43% | 0.429 | 70% | 0.7 | S | S | . | * | trans | -65.3 | 102.7 | -176.6 | 24.8 | -33.7 | 0 | 0 | 0 | 109.7 | F17 | P15-F17 VanDerWaalsContact C-N 3.29Å; P15-F17 HydrophobicContact CB-CE2 4.4Å; P15-F17 HydrophobicContact CG-CE2 4.01Å; P15-F17 HydrophobicContact CG-CZ 4.46Å; P15-F17 WeakPolarHBondContact O-CD2 3.02Å; P15-F17 PolarHBondContact O-N 3.21Å | ||
| 16 | K | 77.7 | Confident | 59.9 | Low | 197 Ų | 197 | 136.1 Ų | 136.1 | 86% | 0.857 | 70% | 0.7 | S | S | * | * | trans | -62.9 | 86.2 | 177.1 | -172.2 | 81.6 | 178.7 | -172.7 | 0 | 110.1 | D14 | D14-K16 PolarHBondContact O-N 3.42Š| ||
| 17 | F | 61.5 | Low | 59.9 | Low | 164 Ų | 164 | 132.1 Ų | 132.1 | 72% | 0.719 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 136 | 171.4 | -69.9 | -83.1 | 0 | 0 | 0 | 109.6 | P15 | P15-F17 VanDerWaalsContact C-N 3.29Å; P15-F17 HydrophobicContact CB-CE2 4.4Å; P15-F17 HydrophobicContact CG-CE2 4.01Å; P15-F17 HydrophobicContact CG-CZ 4.46Å; P15-F17 WeakPolarHBondContact O-CD2 3.02Å; P15-F17 PolarHBondContact O-N 3.21Å |
| 18 | P | 72.2 | Confident | 59.2 | Low | 68 Ų | 68 | 135.3 Ų | 135.3 | 44% | 0.442 | 70% | 0.696 | S | S | . | * | P | Polyproline II helix | trans | -56.4 | 148.9 | 174.5 | -25.9 | 35 | 0 | 0 | 0 | 111.8 | C20 | P18-C20 PolarHBondContact O-N 3.31Š|
| 19 | P | 66.6 | Low | 58.9 | Low | 90 Ų | 90 | 135.3 Ų | 135.3 | 58% | 0.584 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -58 | 133.2 | 172.2 | -19 | 31.5 | 0 | 0 | 0 | 110.4 | E21 E22 | P19-E21 PolarHBondContact O-N 3.11Å; P19-E22 PolarHBondContact O-N 2.78Å |
| 20 | C | 55.7 | Low | 58.7 | Low | 108 Ų | 108 | 132.3 Ų | 132.3 | 73% | 0.73 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -63 | -11.1 | -175.9 | -62.8 | 0 | 0 | 0 | 0 | 114.6 | P18 E22 Y23 | P18-C20 PolarHBondContact O-N 3.31Å; C20-E22 VanDerWaalsContact C-N 3.31Å; C20-E22 PolarHBondContact O-N 2.9Å; C20-Y23 PolarHBondContact O-N 3.32Å |
| 21 | E | 59.9 | Low | 58.6 | Low | 160 Ų | 160 | 134 Ų | 134 | 75% | 0.748 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -62.7 | -36.3 | 178.2 | -62.4 | -179 | 134.9 | 0 | 0 | 112 | P19 Y23 S24 | P19-E21 PolarHBondContact O-N 3.11Å; E21-Y23 PolarHBondContact O-N 3.44Å; E21-S24 WeakPolarHBondContact O-CB 3.35Å; E21-S24 PolarHBondContact O-N 3.43Å; E21-S24 PolarHBondContact O-OG 3.37Å |
| 22 | E | 53.9 | Low | 58.3 | Low | 137 Ų | 137 | 134 Ų | 134 | 64% | 0.64 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -69.7 | -20.7 | 179.2 | -159.8 | 169.2 | -148.9 | 0 | 0 | 112.5 | P19 C20 S24 | P19-E22 PolarHBondContact O-N 2.78Å; C20-E22 VanDerWaalsContact C-N 3.31Å; C20-E22 PolarHBondContact O-N 2.9Å; E22-S24 VanDerWaalsContact C-N 3.26Å; E22-S24 PolarHBondContact O-N 3.17Å |
| 23 | Y | 54.7 | Low | 57.7 | Low | 196 Ų | 196 | 128.5 Ų | 128.5 | 77% | 0.769 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -80.2 | -0.7 | 171.5 | -81.8 | -77.5 | 0 | 0 | 0 | 114.1 | C20 E21 | C20-Y23 PolarHBondContact O-N 3.32Å; E21-Y23 PolarHBondContact O-N 3.44Å |
| 24 | S | 55.3 | Low | 57 | Low | 89 Ų | 89 | 128 Ų | 128 | 62% | 0.622 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -86.7 | -4.7 | 175.1 | 73.2 | 0 | 0 | 0 | 0 | 114.3 | E21 E22 S26 | E21-S24 WeakPolarHBondContact O-CB 3.35Å; E21-S24 PolarHBondContact O-N 3.43Å; E21-S24 PolarHBondContact O-OG 3.37Å; E22-S24 VanDerWaalsContact C-N 3.26Å; E22-S24 PolarHBondContact O-N 3.17Å; S24-S26 PolarHBondContact O-N 2.97Å; S24-S26 VanDerWaalsContact O-N 3.07Å |
| 25 | Q | 54.9 | Low | 56.2 | Low | 127 Ų | 127 | 127.4 Ų | 127.4 | 59% | 0.593 | 68% | 0.678 | S | S | * | * | trans | -71.3 | 102.8 | 176.4 | -99.3 | 168.1 | -59.5 | 0 | 0 | 111.6 | D27 | Q25-D27 PolarHBondContact O-N 3.38Š| ||
| 26 | S | 50.4 | Low | 55.7 | Low | 104 Ų | 104 | 133.5 Ų | 133.5 | 73% | 0.727 | 69% | 0.694 | S | S | * | * | G | 310 helix | trans | -61.2 | -4.7 | -173.6 | -53.9 | 0 | 0 | 0 | 0 | 116 | S24 Y28 | S24-S26 PolarHBondContact O-N 2.97Å; S24-S26 VanDerWaalsContact O-N 3.07Å; S26-Y28 VanDerWaalsContact C-N 3.34Å; S26-Y28 PolarHBondContact O-N 3.26Å |
| 27 | D | 52.9 | Low | 54.3 | Low | 130 Ų | 130 | 134 Ų | 134 | 70% | 0.695 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -83.4 | -6.4 | -165.2 | -50.4 | -64.4 | 0 | 0 | 0 | 114.1 | Q25 L29 | Q25-D27 PolarHBondContact O-N 3.38Å; D27-L29 VanDerWaalsContact C-N 3.27Å; D27-L29 PolarHBondContact O-N 2.68Å |
| 28 | Y | 51.3 | Low | 53.6 | Low | 219 Ų | 219 | 128.8 Ų | 128.8 | 86% | 0.859 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -81.8 | 3.5 | 177.9 | -95.9 | -77.3 | 0 | 0 | 0 | 115.1 | S26 P30 | S26-Y28 VanDerWaalsContact C-N 3.34Å; S26-Y28 PolarHBondContact O-N 3.26Å; Y28-P30 WeakPolarHBondContact O-CD 3.42Å |
| 29 | L | 52 | Low | 52.1 | Low | 143 Ų | 143 | 131.3 Ų | 131.3 | 75% | 0.749 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -99.1 | 109.3 | 160.1 | -69.2 | 179.3 | 0 | 0 | 0 | 108.8 | D27 S31 | D27-L29 VanDerWaalsContact C-N 3.27Å; D27-L29 PolarHBondContact O-N 2.68Å; L29-S31 PolarHBondContact O-N 3.31Å |
| 30 | P | 49.4 | Very low | 51.2 | Low | 97 Ų | 97 | 135.1 Ų | 135.1 | 63% | 0.63 | 71% | 0.713 | S | S | * | * | trans | -50.9 | 136.7 | 163.2 | -24.9 | 34.7 | 0 | 0 | 0 | 109.5 | Y28 H32 | Y28-P30 WeakPolarHBondContact O-CD 3.42Å; P30-H32 VanDerWaalsContact C-N 3.26Å; P30-H32 PolarHBondContact O-CD2 2.72Å; P30-H32 PolarHBondContact O-N 2.74Å | ||
| 31 | S | 50 | Low | 51.1 | Low | 126 Ų | 126 | 140.7 Ų | 140.7 | 88% | 0.881 | 72% | 0.719 | S | S | * | * | trans | -67.9 | 80.9 | -175.9 | 40.1 | 0 | 0 | 0 | 0 | 111.7 | L29 S33 | L29-S31 PolarHBondContact O-N 3.31Å; S31-S33 PolarHBondContact O-N 2.78Å; S31-S33 VanDerWaalsContact O-N 3.12Å | ||
| 32 | H | 51.4 | Low | 50.3 | Low | 160 Ų | 160 | 142.5 Ų | 142.5 | 74% | 0.741 | 73% | 0.727 | S | S | * | * | trans | -57 | 116.1 | 167.4 | -73.2 | -74.2 | 0 | 0 | 0 | 108.7 | P30 | P30-H32 VanDerWaalsContact C-N 3.26Å; P30-H32 PolarHBondContact O-CD2 2.72Å; P30-H32 PolarHBondContact O-N 2.74Å | ||
| 33 | S | 45.2 | Very low | 49.5 | Very low | 74 Ų | 74 | 142.7 Ų | 142.7 | 52% | 0.517 | 73% | 0.733 | S | S | . | * | trans | -53.3 | 137.5 | -175 | -153 | 0 | 0 | 0 | 0 | 110.9 | S31 D35 Y36 | S31-S33 PolarHBondContact O-N 2.78Å; S31-S33 VanDerWaalsContact O-N 3.12Å; S33-D35 VanDerWaalsContact CB-OD2 3.27Å; S33-D35 WeakPolarHBondContact CB-OD2 3.44Å; S33-D35 PolarHBondContact O-N 3.02Å; S33-D35 PolarHBondContact OG-OD2 2.84Å; S33-Y36 PolarHBondContact O-N 3.4Å | ||
| 34 | P | 51.7 | Low | 49.3 | Very low | 115 Ų | 115 | 139.8 Ų | 139.8 | 75% | 0.747 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.1 | -25.2 | -176 | -28.2 | 35.9 | 0 | 0 | 0 | 114.4 | Y36 | P34-Y36 VanDerWaalsContact C-N 3.3Å; P34-Y36 PolarHBondContact O-N 3.21Å |
| 35 | D | 50.9 | Low | 49 | Very low | 106 Ų | 106 | 139 Ų | 139 | 57% | 0.567 | 74% | 0.737 | S | S | * | * | H | α-helix | trans | -62.1 | -30.2 | -175.1 | -41 | -82.8 | 0 | 0 | 0 | 113.5 | S33 Y37 G38 | S33-D35 VanDerWaalsContact CB-OD2 3.27Å; S33-D35 WeakPolarHBondContact CB-OD2 3.44Å; S33-D35 PolarHBondContact O-N 3.02Å; S33-D35 PolarHBondContact OG-OD2 2.84Å; D35-Y37 VanDerWaalsContact C-N 3.27Å; D35-Y37 PolarHBondContact O-N 3.42Å; D35-G38 PolarHBondContact O-N 3.19Å; D35-G38 VanDerWaalsContact O-N 3.12Å |
| 36 | Y | 52.1 | Low | 48.7 | Very low | 193 Ų | 193 | 137.4 Ų | 137.4 | 76% | 0.757 | 75% | 0.746 | S | S | * | * | H | α-helix | trans | -65 | -26.5 | -170.1 | -167.4 | -92.7 | 0 | 0 | 0 | 114.2 | S33 P34 | S33-Y36 PolarHBondContact O-N 3.4Å; P34-Y36 VanDerWaalsContact C-N 3.3Å; P34-Y36 PolarHBondContact O-N 3.21Å |
| 37 | Y | 47.6 | Very low | 48.1 | Very low | 209 Ų | 209 | 142.2 Ų | 142.2 | 82% | 0.82 | 75% | 0.754 | S | S | * | * | H | α-helix | trans | -113.2 | -0 | 173.2 | -78.5 | -78.3 | 0 | 0 | 0 | 113.4 | D35 | D35-Y37 VanDerWaalsContact C-N 3.27Å; D35-Y37 PolarHBondContact O-N 3.42Å |
| 38 | G | 47 | Very low | 47.7 | Very low | 53 Ų | 53 | 146.4 Ų | 146.4 | 55% | 0.546 | 76% | 0.76 | S | S | . | * | H | α-helix | trans | -75.6 | -34 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | D35 Q40 | D35-G38 PolarHBondContact O-N 3.19Å; D35-G38 VanDerWaalsContact O-N 3.12Å; G38-Q40 PolarHBondContact O-N 3.23Å |
| 39 | S | 40.5 | Very low | 47.1 | Very low | 121 Ų | 121 | 141.2 Ų | 141.2 | 85% | 0.846 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | 16.7 | -167.8 | -49.8 | 0 | 0 | 0 | 0 | 116.6 | ||
| 40 | Q | 48 | Very low | 46.4 | Very low | 171 Ų | 171 | 140.3 Ų | 140.3 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -144.5 | 45.7 | -179.2 | -150.4 | 173.6 | 40.3 | 0 | 0 | 117.2 | G38 | G38-Q40 PolarHBondContact O-N 3.23Š|
| 41 | R | 53.1 | Low | 45.9 | Very low | 225 Ų | 225 | 139.3 Ų | 139.3 | 85% | 0.849 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -160.1 | 72.6 | 145.6 | -89.2 | -49.6 | 145.8 | 160.3 | -2.4 | 114 | ||
| 42 | Q | 44.8 | Very low | 45.2 | Very low | 197 Ų | 197 | 139.1 Ų | 139.1 | 92% | 0.921 | 74% | 0.741 | S | S | * | * | trans | -168 | 92.9 | 148 | -114.1 | 151.4 | 104.5 | 0 | 0 | 112.6 | ||||
| 43 | D | 36.8 | Very low | 44.4 | Very low | 142 Ų | 142 | 140.4 Ų | 140.4 | 76% | 0.759 | 74% | 0.741 | S | S | * | * | -166.7 | 137.1 | 123.4 | -125.6 | -26.3 | 0 | 0 | 0 | 109.6 | A45 | D43-A45 VanDerWaalsContact C-N 3.26Å; D43-A45 PolarHBondContact O-N 3.1Å | |||
| 44 | P | 50 | Low | 44 | Very low | 134 Ų | 134 | 145.9 Ų | 145.9 | 87% | 0.87 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -92 | 36.1 | 178 | 37 | -33 | 0 | 0 | 0 | 112.4 | ||
| 45 | A | 48.2 | Very low | 43.2 | Very low | 73 Ų | 73 | 145.9 Ų | 145.9 | 60% | 0.603 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -139.2 | 159.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D43 F47 | D43-A45 VanDerWaalsContact C-N 3.26Å; D43-A45 PolarHBondContact O-N 3.1Å; A45-F47 PolarHBondContact O-N 3Å |
| 46 | A | 49.5 | Very low | 42.3 | Very low | 94 Ų | 94 | 147.2 Ų | 147.2 | 78% | 0.777 | 76% | 0.755 | S | S | * | * | trans | 59 | 43.2 | 163.4 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 47 | F | 38.3 | Very low | 41.7 | Very low | 205 Ų | 205 | 146 Ų | 146 | 90% | 0.899 | 76% | 0.756 | S | S | * | * | trans | -125 | 92.6 | 143.2 | -108.5 | -82.4 | 0 | 0 | 0 | 111.7 | A45 P49 | A45-F47 PolarHBondContact O-N 3Å; F47-P49 WeakPolarHBondContact O-CD 3.49Å | ||
| 48 | R | 45.1 | Very low | 41.4 | Very low | 218 Ų | 218 | 143.3 Ų | 143.3 | 82% | 0.823 | 76% | 0.755 | S | S | * | * | trans | -63.8 | 125.7 | 167.3 | -69 | -96.2 | -169.8 | 153.9 | 2.5 | 108.2 | V50 | R48-V50 PolarHBondContact O-N 3.48Š| ||
| 49 | P | 38.3 | Very low | 41.2 | Very low | 109 Ų | 109 | 146 Ų | 146 | 71% | 0.708 | 76% | 0.763 | S | S | * | * | trans | -62.2 | 122.2 | 150.4 | 28.1 | -30.3 | 0 | 0 | 0 | 106.5 | F47 S51 | F47-P49 WeakPolarHBondContact O-CD 3.49Å; P49-S51 PolarHBondContact O-N 2.99Å | ||
| 50 | V | 36.3 | Very low | 40.9 | Very low | 125 Ų | 125 | 143.8 Ų | 143.8 | 76% | 0.758 | 75% | 0.752 | S | S | * | * | trans | -77.3 | 73.6 | 171.6 | -175 | 0 | 0 | 0 | 0 | 107.9 | R48 V52 | R48-V50 PolarHBondContact O-N 3.48Å; V50-V52 VanDerWaalsContact C-N 3.29Å; V50-V52 HydrophobicContact CG1-CG2 3.91Å; V50-V52 PolarHBondContact O-N 2.99Å | ||
| 51 | S | 39.3 | Very low | 40.5 | Very low | 76 Ų | 76 | 144.9 Ų | 144.9 | 53% | 0.531 | 76% | 0.757 | S | S | . | * | trans | -66.5 | 93.1 | 161.6 | 54.6 | 0 | 0 | 0 | 0 | 107.5 | P49 Y53 | P49-S51 PolarHBondContact O-N 2.99Å; S51-Y53 PolarHBondContact O-N 3.01Å | ||
| 52 | V | 35.7 | Very low | 39.8 | Very low | 121 Ų | 121 | 141.4 Ų | 141.4 | 73% | 0.733 | 75% | 0.75 | S | S | * | * | trans | -68.3 | 87.4 | 166.3 | -176.7 | 0 | 0 | 0 | 0 | 107.1 | V50 H54 | V50-V52 VanDerWaalsContact C-N 3.29Å; V50-V52 HydrophobicContact CG1-CG2 3.91Å; V50-V52 PolarHBondContact O-N 2.99Å; V52-H54 PolarHBondContact O-N 2.7Å; V52-H54 VanDerWaalsContact O-N 3.17Å | ||
| 53 | Y | 35 | Very low | 39.4 | Very low | 187 Ų | 187 | 141.2 Ų | 141.2 | 73% | 0.733 | 75% | 0.749 | S | S | * | * | trans | -66.7 | 107.8 | 158.5 | -73.9 | -84.5 | 0 | 0 | 0 | 107.2 | S51 | S51-Y53 PolarHBondContact O-N 3.01Š| ||
| 54 | H | 36.7 | Very low | 39.5 | Very low | 189 Ų | 189 | 142.3 Ų | 142.3 | 88% | 0.875 | 75% | 0.749 | S | S | * | * | trans | -106.9 | 109.3 | 134.6 | -103.9 | 34.2 | 0 | 0 | 0 | 107.3 | V52 | V52-H54 PolarHBondContact O-N 2.7Å; V52-H54 VanDerWaalsContact O-N 3.17Å | ||
| 55 | N | 33.7 | Very low | 38.8 | Very low | 116 Ų | 116 | 147.8 Ų | 147.8 | 62% | 0.62 | 75% | 0.753 | S | S | * | * | trans | -102.4 | 169.5 | 176.8 | -172 | 39.6 | 0 | 0 | 0 | 108.5 | ||||
| 56 | E | 32.8 | Very low | 38.4 | Very low | 133 Ų | 133 | 151.5 Ų | 151.5 | 62% | 0.621 | 76% | 0.762 | S | S | * | * | trans | 74.5 | 156.1 | 171.5 | -49.2 | -63.7 | 84.1 | 0 | 0 | 118.2 | ||||
| 57 | H | 39 | Very low | 37.8 | Very low | 167 Ų | 167 | 154.4 Ų | 154.4 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | trans | 71.7 | 66.8 | 164 | -49.9 | 111 | 0 | 0 | 0 | 119 | ||||
| 58 | N | 42.3 | Very low | 38.2 | Very low | 153 Ų | 153 | 150 Ų | 150 | 82% | 0.818 | 75% | 0.751 | S | S | * | * | trans | -69.6 | 130.1 | 130 | 177.2 | 11.5 | 0 | 0 | 0 | 108 | A60 | N58-A60 PolarHBondContact OD1-N 2.74Š| ||
| 59 | P | 42.9 | Very low | 38.6 | Very low | 110 Ų | 110 | 143.1 Ų | 143.1 | 71% | 0.714 | 74% | 0.735 | S | S | * | * | -137.7 | 126.3 | 122.9 | 34.9 | -23 | 0 | 0 | 0 | 114.3 | |||||
| 60 | A | 34.2 | Very low | 38.2 | Very low | 74 Ų | 74 | 147.9 Ų | 147.9 | 61% | 0.612 | 74% | 0.74 | S | S | * | * | trans | 30.4 | 116.4 | 140.4 | 0 | 0 | 0 | 0 | 0 | 118.9 | N58 | N58-A60 PolarHBondContact OD1-N 2.74Š| ||
| 61 | H | 38.4 | Very low | 38.7 | Very low | 194 Ų | 194 | 147.3 Ų | 147.3 | 90% | 0.898 | 74% | 0.737 | S | S | * | * | trans | -113 | 122.8 | 140.4 | -128.1 | -84.4 | 0 | 0 | 0 | 109.6 | ||||
| 62 | H | 37.7 | Very low | 39.1 | Very low | 153 Ų | 153 | 149.5 Ų | 149.5 | 71% | 0.708 | 75% | 0.749 | S | S | * | * | trans | -63.6 | 142.6 | 173.1 | -72 | -103.2 | 0 | 0 | 0 | 110.6 | ||||
| 63 | Q | 37.6 | Very low | 38.9 | Very low | 192 Ų | 192 | 149.8 Ų | 149.8 | 90% | 0.897 | 76% | 0.755 | S | S | * | * | -141.8 | 146.6 | 118.8 | -78.5 | -144.8 | -19.3 | 0 | 0 | 111.3 | |||||
| 64 | H | 37.8 | Very low | 39.3 | Very low | 165 Ų | 165 | 149.4 Ų | 149.4 | 76% | 0.764 | 76% | 0.76 | S | S | * | * | trans | -69.4 | 141 | -169.5 | -63.9 | -125.1 | 0 | 0 | 0 | 113.4 | ||||
| 65 | R | 36 | Very low | 39 | Very low | 249 Ų | 249 | 151.7 Ų | 151.7 | 94% | 0.94 | 76% | 0.761 | S | S | * | * | -152.3 | 150.6 | 113.2 | -146.1 | 164.2 | -179.4 | 139.7 | 0.1 | 112.4 | |||||
| 66 | L | 39.2 | Very low | 39.2 | Very low | 151 Ų | 151 | 150.2 Ų | 150.2 | 79% | 0.791 | 77% | 0.765 | S | S | * | * | trans | -84.8 | 137.6 | -168.3 | -60.4 | 163 | 0 | 0 | 0 | 112.4 | ||||
| 67 | E | 37.3 | Very low | 39.9 | Very low | 156 Ų | 156 | 149.3 Ų | 149.3 | 73% | 0.729 | 77% | 0.771 | S | S | * | * | trans | -61.4 | 151.6 | 142.9 | -104.5 | -80.3 | 133 | 0 | 0 | 108.6 | ||||
| 68 | P | 47.7 | Very low | 39.9 | Very low | 112 Ų | 112 | 149.2 Ų | 149.2 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | -150 | -161.5 | 82.2 | 49.9 | -31 | 0 | 0 | 0 | 111.9 | |||||
| 69 | P | 53.2 | Low | 40.2 | Very low | 73 Ų | 73 | 147.7 Ų | 147.7 | 47% | 0.474 | 77% | 0.769 | S | S | . | * | -129.2 | -156.6 | -120.1 | 27.7 | 0.2 | 0 | 0 | 0 | 113.7 | |||||
| 70 | Y | 30.2 | Very low | 39.7 | Very low | 209 Ų | 209 | 146.3 Ų | 146.3 | 82% | 0.82 | 77% | 0.767 | S | S | * | * | trans | 73.2 | 155.1 | 177.9 | -39.6 | -72.8 | 0 | 0 | 0 | 114.1 | ||||
| 71 | T | 45.2 | Very low | 39.8 | Very low | 114 Ų | 114 | 147.9 Ų | 147.9 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | cis | -150.6 | 147.2 | 9.2 | -30.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 72 | P | 48.1 | Very low | 39.7 | Very low | 121 Ų | 121 | 147.5 Ų | 147.5 | 79% | 0.786 | 77% | 0.772 | S | S | * | * | trans | -86.5 | 108.9 | 170.4 | 32.4 | -32.3 | 0 | 0 | 0 | 112.4 | Q74 | P72-Q74 PolarHBondContact O-N 3.19Š| ||
| 73 | C | 32.8 | Very low | 39.5 | Very low | 128 Ų | 128 | 146.5 Ų | 146.5 | 87% | 0.865 | 78% | 0.777 | S | S | * | * | trans | -83.6 | 108.1 | 179.9 | -68.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 74 | Q | 42.9 | Very low | 39.4 | Very low | 179 Ų | 179 | 143.4 Ų | 143.4 | 84% | 0.836 | 77% | 0.771 | S | S | * | * | trans | -94.4 | 152.1 | 155.7 | -67 | -176.3 | -3.5 | 0 | 0 | 110.5 | P72 | P72-Q74 PolarHBondContact O-N 3.19Š| ||
| 75 | R | 30.9 | Very low | 39.4 | Very low | 236 Ų | 236 | 140.3 Ų | 140.3 | 89% | 0.891 | 77% | 0.768 | S | S | * | * | trans | 130.6 | 144.9 | 142.8 | -164.3 | 163.4 | -71.3 | -176.9 | -1.1 | 114.9 | ||||
| 76 | A | 36.7 | Very low | 40.4 | Very low | 85 Ų | 85 | 133.5 Ų | 133.5 | 70% | 0.702 | 76% | 0.756 | S | S | * | * | trans | -91.2 | -164.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 77 | P | 47.5 | Very low | 40.5 | Very low | 115 Ų | 115 | 133.8 Ų | 133.8 | 75% | 0.747 | 75% | 0.753 | S | S | * | * | cis | -143.2 | -174.1 | 14.5 | 44.3 | -23.2 | 0 | 0 | 0 | 118.2 | ||||
| 78 | Q | 38.8 | Very low | 40.2 | Very low | 164 Ų | 164 | 129.4 Ų | 129.4 | 77% | 0.766 | 75% | 0.75 | S | S | * | * | trans | 3.3 | 145.6 | 147.4 | -57.4 | -63.8 | 0.1 | 0 | 0 | 119.9 | ||||
| 79 | P | 48.5 | Very low | 40.1 | Very low | 121 Ų | 121 | 131.3 Ų | 131.3 | 79% | 0.786 | 75% | 0.748 | S | S | * | * | -129.5 | 166 | 62.9 | 22.3 | -0.4 | 0 | 0 | 0 | 114.7 | |||||
| 80 | A | 32.6 | Very low | 39.5 | Very low | 81 Ų | 81 | 131.9 Ų | 131.9 | 67% | 0.669 | 76% | 0.76 | S | S | * | * | cis | 97.8 | 98.5 | 20.6 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 81 | S | 37.5 | Very low | 39.9 | Very low | 108 Ų | 108 | 129.7 Ų | 129.7 | 76% | 0.755 | 76% | 0.76 | S | S | * | * | trans | -169.9 | 133.2 | 153.4 | -68.4 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 82 | E | 35 | Very low | 39.7 | Very low | 186 Ų | 186 | 131.7 Ų | 131.7 | 87% | 0.869 | 77% | 0.766 | S | S | * | * | 61.3 | 130.9 | 54.4 | -58.2 | -160.8 | 141.2 | 0 | 0 | 112.2 | |||||
| 83 | V | 34.7 | Very low | 39.9 | Very low | 131 Ų | 131 | 130.5 Ų | 130.5 | 79% | 0.794 | 76% | 0.758 | S | S | * | * | cis | -116.8 | -170.6 | 5.2 | -158.7 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 84 | T | 35.8 | Very low | 40.1 | Very low | 127 Ų | 127 | 131.1 Ų | 131.1 | 78% | 0.779 | 76% | 0.758 | S | S | * | * | cis | -159.9 | 165.5 | 19.6 | -44.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 85 | S | 37.8 | Very low | 39.7 | Very low | 100 Ų | 100 | 125.7 Ų | 125.7 | 70% | 0.699 | 75% | 0.751 | S | S | * | * | trans | -136.5 | 158.7 | 162.4 | -168.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 86 | P | 56.2 | Low | 39.7 | Very low | 106 Ų | 106 | 122.3 Ų | 122.3 | 69% | 0.688 | 75% | 0.749 | S | S | * | * | -151.8 | 147.5 | 93.5 | 38.3 | -19.2 | 0 | 0 | 0 | 117.2 | |||||
| 87 | Q | 40.9 | Very low | 39.6 | Very low | 158 Ų | 158 | 126.2 Ų | 126.2 | 74% | 0.738 | 75% | 0.753 | S | S | * | * | 69.3 | 137.7 | 121.9 | -165 | 172.5 | -7.6 | 0 | 0 | 121.1 | H89 | Q87-H89 PolarHBondContact NE2-NE2 3.35Å; Q87-H89 VanDerWaalsContact NE2-NE2 3.11Å | |||
| 88 | G | 30.8 | Very low | 38.9 | Very low | 63 Ų | 63 | 126 Ų | 126 | 65% | 0.649 | 75% | 0.749 | S | S | * | * | cis | 170.9 | -164.3 | -7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 89 | H | 45.1 | Very low | 38.7 | Very low | 152 Ų | 152 | 124.1 Ų | 124.1 | 70% | 0.704 | 75% | 0.749 | S | S | * | * | trans | 59.5 | 113.7 | 163.5 | -54.3 | -59 | 0 | 0 | 0 | 117.8 | Q87 | Q87-H89 PolarHBondContact NE2-NE2 3.35Å; Q87-H89 VanDerWaalsContact NE2-NE2 3.11Å | ||
| 90 | A | 42.6 | Very low | 39.3 | Very low | 86 Ų | 86 | 123.9 Ų | 123.9 | 71% | 0.711 | 75% | 0.748 | S | S | * | * | 67.4 | 133.5 | 64.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 91 | I | 38.2 | Very low | 39.1 | Very low | 162 Ų | 162 | 126.9 Ų | 126.9 | 83% | 0.831 | 76% | 0.757 | S | S | * | * | -158.4 | 158.1 | 65.1 | -82.3 | 160.6 | 0 | 0 | 0 | 111.8 | |||||
| 92 | L | 40.2 | Very low | 38.8 | Very low | 157 Ų | 157 | 126 Ų | 126 | 82% | 0.822 | 75% | 0.751 | S | S | * | * | trans | -117 | 151.9 | 167 | -160.1 | 97.4 | 0 | 0 | 0 | 108.4 | ||||
| 93 | P | 53.2 | Low | 38.6 | Very low | 96 Ų | 96 | 124.9 Ų | 124.9 | 62% | 0.623 | 75% | 0.746 | S | S | * | * | -160.9 | 160.8 | 99.3 | 40.7 | -21.4 | 0 | 0 | 0 | 118.5 | |||||
| 94 | T | 36.4 | Very low | 38.4 | Very low | 140 Ų | 140 | 126.1 Ų | 126.1 | 86% | 0.859 | 74% | 0.743 | S | S | * | * | trans | 55.3 | 157.2 | 150.9 | 46.1 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 95 | G | 33.7 | Very low | 38.2 | Very low | 66 Ų | 66 | 123.9 Ų | 123.9 | 68% | 0.68 | 73% | 0.733 | S | S | * | * | cis | 169.1 | 141 | -2.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 96 | L | 31.7 | Very low | 38.3 | Very low | 165 Ų | 165 | 128.5 Ų | 128.5 | 86% | 0.864 | 74% | 0.743 | S | S | * | * | 160.5 | 164.8 | 82.9 | -100.2 | 164.6 | 0 | 0 | 0 | 108.8 | |||||
| 97 | H | 34.6 | Very low | 37.3 | Very low | 166 Ų | 166 | 133.3 Ų | 133.3 | 77% | 0.769 | 75% | 0.747 | S | S | * | * | trans | 29 | 147.4 | 144.4 | -111.9 | -129.1 | 0 | 0 | 0 | 121.9 | ||||
| 98 | T | 32.4 | Very low | 37.1 | Very low | 111 Ų | 111 | 131.8 Ų | 131.8 | 68% | 0.681 | 75% | 0.752 | S | S | * | * | cis | -161.7 | 176.9 | 17 | -28.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 99 | T | 35.5 | Very low | 37.4 | Very low | 125 Ų | 125 | 134.3 Ų | 134.3 | 77% | 0.767 | 75% | 0.751 | S | S | * | * | trans | -112.3 | -172.2 | 163 | 56 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 100 | P | 59.8 | Low | 37.1 | Very low | 116 Ų | 116 | 132.4 Ų | 132.4 | 75% | 0.753 | 76% | 0.755 | S | S | * | * | -122.6 | 163.7 | -55.8 | 35.9 | -22.4 | 0 | 0 | 0 | 113.4 | |||||
| 101 | V | 28.7 | Very low | 37 | Very low | 143 Ų | 143 | 134.8 Ų | 134.8 | 87% | 0.867 | 76% | 0.76 | S | S | * | * | trans | -175 | 161 | 160.8 | 132.6 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 102 | S | 32.2 | Very low | 37.6 | Very low | 90 Ų | 90 | 133 Ų | 133 | 63% | 0.629 | 76% | 0.757 | S | S | * | * | cis | 139.5 | 139.9 | -22.7 | -168.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 103 | E | 29.6 | Very low | 38.2 | Very low | 162 Ų | 162 | 131 Ų | 131 | 76% | 0.757 | 75% | 0.754 | S | S | * | * | trans | 61.3 | 152.8 | 177.9 | -64.7 | -167.7 | 77.7 | 0 | 0 | 116.7 | ||||
| 104 | Q | 31.8 | Very low | 38.2 | Very low | 158 Ų | 158 | 131.5 Ų | 131.5 | 74% | 0.738 | 76% | 0.76 | S | S | * | * | cis | -149 | 152.1 | -11.5 | -133.3 | -165.8 | 68.3 | 0 | 0 | 112.4 | ||||
| 105 | S | 30.5 | Very low | 39.5 | Very low | 79 Ų | 79 | 130.4 Ų | 130.4 | 55% | 0.552 | 75% | 0.754 | S | S | * | * | trans | 60.9 | 112.4 | 141.3 | -159.8 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 106 | H | 41.4 | Very low | 41.2 | Very low | 198 Ų | 198 | 132.7 Ų | 132.7 | 92% | 0.917 | 76% | 0.758 | S | S | * | * | -147.3 | 138.5 | 127.3 | -84.7 | -52.7 | 0 | 0 | 0 | 109.9 | |||||
| 107 | R | 34 | Very low | 42.9 | Very low | 206 Ų | 206 | 130.3 Ų | 130.3 | 78% | 0.777 | 75% | 0.752 | S | S | * | * | trans | -89.4 | 144.8 | -176.4 | -64.1 | 166.7 | 75.3 | 160.1 | 6.7 | 111.9 | D109 | R107-D109 IonicContact CZ-OD2 3.19Å; R107-D109 IonicContact NE-OD2 2.78Å; R107-D109 PolarHBondContact NE-OD2 3.08Å; R107-D109 IonicContact NH2-OD2 2.89Å; R107-D109 PolarHBondContact NH2-OD2 2.96Å | ||
| 108 | C | 37.2 | Very low | 44.3 | Very low | 126 Ų | 126 | 128 Ų | 128 | 85% | 0.851 | 75% | 0.752 | S | S | * | * | trans | -145.4 | 101.2 | 145.5 | 57 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 109 | D | 38 | Very low | 45.8 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 63% | 0.626 | 75% | 0.754 | S | S | * | * | trans | -70.1 | 136 | 178.7 | -71.7 | -78.5 | 0 | 0 | 0 | 110.6 | R107 | R107-D109 IonicContact CZ-OD2 3.19Å; R107-D109 IonicContact NE-OD2 2.78Å; R107-D109 PolarHBondContact NE-OD2 3.08Å; R107-D109 IonicContact NH2-OD2 2.89Å; R107-D109 PolarHBondContact NH2-OD2 2.96Å | ||
| 110 | S | 37.1 | Very low | 46.5 | Very low | 111 Ų | 111 | 128.3 Ų | 128.3 | 78% | 0.776 | 76% | 0.758 | S | S | * | * | trans | -151.9 | 97.1 | 174 | -78 | 0 | 0 | 0 | 0 | 110.6 | T112 | S110-T112 PolarHBondContact O-N 3.23Š| ||
| 111 | V | 40.6 | Very low | 45.5 | Very low | 136 Ų | 136 | 129.3 Ų | 129.3 | 82% | 0.824 | 77% | 0.766 | S | S | * | * | trans | -76.4 | 111.5 | -167.3 | -175.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 112 | T | 51.2 | Low | 46.4 | Very low | 125 Ų | 125 | 125 Ų | 125 | 77% | 0.767 | 75% | 0.751 | S | S | * | * | trans | -114.4 | 111.2 | 164.8 | -58.2 | 0 | 0 | 0 | 0 | 108.9 | S110 S114 | S110-T112 PolarHBondContact O-N 3.23Å; T112-S114 PolarHBondContact O-N 3.38Å | ||
| 113 | P | 53.7 | Low | 46.9 | Very low | 115 Ų | 115 | 129.9 Ų | 129.9 | 75% | 0.747 | 76% | 0.764 | S | S | * | * | trans | -76.6 | 111.9 | 179.1 | 29.4 | -32.6 | 0 | 0 | 0 | 110.9 | ||||
| 114 | S | 51.8 | Low | 47.7 | Very low | 107 Ų | 107 | 128.5 Ų | 128.5 | 75% | 0.748 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 142.2 | 168.2 | -67.8 | 0 | 0 | 0 | 0 | 111.1 | T112 | T112-S114 PolarHBondContact O-N 3.38Š|
| 115 | P | 63.6 | Low | 48.2 | Very low | 116 Ų | 116 | 126.4 Ų | 126.4 | 75% | 0.753 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 149.9 | 171.6 | 30.4 | -34.7 | 0 | 0 | 0 | 111.1 | ||
| 116 | P | 71.1 | Confident | 48.9 | Very low | 115 Ų | 115 | 134 Ų | 134 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 155.7 | 177.2 | 30.2 | -35.6 | 0 | 0 | 0 | 112.1 | ||
| 117 | P | 67.6 | Low | 49 | Very low | 115 Ų | 115 | 130 Ų | 130 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 151.4 | 172.2 | 29.9 | -35.2 | 0 | 0 | 0 | 111.4 | ||
| 118 | P | 62.8 | Low | 49.4 | Very low | 117 Ų | 117 | 128.6 Ų | 128.6 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 148.5 | 174.4 | 29.2 | -34.9 | 0 | 0 | 0 | 111.2 | ||
| 119 | P | 63.6 | Low | 49.9 | Very low | 113 Ų | 113 | 128.3 Ų | 128.3 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 151.4 | 179.6 | 28.9 | -35.5 | 0 | 0 | 0 | 111.8 | C121 | P119-C121 PolarHBondContact O-N 3.42Š|
| 120 | P | 50.6 | Low | 50.1 | Low | 130 Ų | 130 | 128.9 Ų | 128.9 | 84% | 0.844 | 79% | 0.786 | S | S | * | * | trans | -67.8 | 107.7 | 173.5 | 28.3 | -33.1 | 0 | 0 | 0 | 109.9 | G122 | P120-G122 PolarHBondContact O-N 2.89Š| ||
| 121 | C | 38.4 | Very low | 50.7 | Low | 137 Ų | 137 | 129.3 Ų | 129.3 | 93% | 0.926 | 79% | 0.789 | S | S | * | * | trans | -73.4 | 76.9 | 174.3 | -167.3 | 0 | 0 | 0 | 0 | 110.5 | P119 | P119-C121 PolarHBondContact O-N 3.42Š| ||
| 122 | G | 47.3 | Very low | 50.8 | Low | 53 Ų | 53 | 127.6 Ų | 127.6 | 55% | 0.546 | 78% | 0.783 | S | S | . | * | trans | -77.6 | 164.4 | 166.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P120 | P120-G122 PolarHBondContact O-N 2.89Š| ||
| 123 | Q | 44.3 | Very low | 50.6 | Low | 192 Ų | 192 | 127.4 Ų | 127.4 | 90% | 0.897 | 78% | 0.784 | S | S | * | * | trans | 70.7 | 68.4 | 175.4 | -50.6 | -174.7 | 95.5 | 0 | 0 | 115.7 | P125 | Q123-P125 WeakPolarHBondContact O-CD 3.5Š| ||
| 124 | T | 44.7 | Very low | 50.4 | Low | 132 Ų | 132 | 127.2 Ų | 127.2 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | -54.1 | 127.8 | 142 | 46.2 | 0 | 0 | 0 | 0 | 109 | R126 | T124-R126 PolarHBondContact O-N 3.06Š| ||
| 125 | P | 42.7 | Very low | 50.4 | Low | 115 Ų | 115 | 127 Ų | 127 | 75% | 0.747 | 79% | 0.791 | S | S | * | * | trans | -57 | 130 | 170.7 | -24.5 | 34.7 | 0 | 0 | 0 | 110.2 | Q123 S127 | Q123-P125 WeakPolarHBondContact O-CD 3.5Å; P125-S127 VanDerWaalsContact C-N 3.32Å; P125-S127 PolarHBondContact O-N 3.26Å | ||
| 126 | R | 45.1 | Very low | 50 | Low | 239 Ų | 239 | 126.9 Ų | 126.9 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | trans | -70.7 | 89.3 | 175.9 | -177.6 | -175.2 | 179.1 | -158.1 | 0.5 | 108.4 | T124 Q128 | T124-R126 PolarHBondContact O-N 3.06Å; R126-Q128 PolarHBondContact O-N 3.32Å; R126-Q128 VanDerWaalsContact O-N 3.07Å | ||
| 127 | S | 43 | Very low | 49.2 | Very low | 114 Ų | 114 | 132.8 Ų | 132.8 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -48.7 | 116.8 | 179.9 | -61.7 | 0 | 0 | 0 | 0 | 110.5 | P125 | P125-S127 VanDerWaalsContact C-N 3.32Å; P125-S127 PolarHBondContact O-N 3.26Å | ||
| 128 | Q | 42.8 | Very low | 49.1 | Very low | 176 Ų | 176 | 133.5 Ų | 133.5 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | trans | -65.9 | 141.7 | -179.9 | -65.1 | 176.4 | 0.9 | 0 | 0 | 109.4 | R126 V130 | R126-Q128 PolarHBondContact O-N 3.32Å; R126-Q128 VanDerWaalsContact O-N 3.07Å; Q128-V130 VanDerWaalsContact C-N 3.28Å; Q128-V130 PolarHBondContact O-N 3.03Å | ||
| 129 | S | 47.7 | Very low | 49.5 | Very low | 119 Ų | 119 | 134.8 Ų | 134.8 | 83% | 0.832 | 80% | 0.803 | S | S | * | * | trans | -74 | 80.2 | 178.9 | 52.4 | 0 | 0 | 0 | 0 | 110.7 | S131 | S129-S131 PolarHBondContact O-N 3.44Š| ||
| 130 | V | 42.5 | Very low | 50.2 | Low | 130 Ų | 130 | 134.5 Ų | 134.5 | 79% | 0.788 | 80% | 0.801 | S | S | * | * | trans | -66.1 | 102.2 | 166.4 | -108.8 | 0 | 0 | 0 | 0 | 108.7 | Q128 S132 | Q128-V130 VanDerWaalsContact C-N 3.28Å; Q128-V130 PolarHBondContact O-N 3.03Å; V130-S132 PolarHBondContact O-N 3.39Å; V130-S132 VanDerWaalsContact O-N 3.13Å | ||
| 131 | S | 50.3 | Low | 51.9 | Low | 119 Ų | 119 | 133.1 Ų | 133.1 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | trans | -74.1 | 95.5 | 174.5 | 51.8 | 0 | 0 | 0 | 0 | 110.1 | S129 | S129-S131 PolarHBondContact O-N 3.44Š| ||
| 132 | S | 41.8 | Very low | 54.2 | Low | 100 Ų | 100 | 130.3 Ų | 130.3 | 70% | 0.699 | 77% | 0.769 | S | S | * | * | trans | -100.7 | 151.2 | 167.1 | -60.9 | 0 | 0 | 0 | 0 | 110.2 | V130 | V130-S132 PolarHBondContact O-N 3.39Å; V130-S132 VanDerWaalsContact O-N 3.13Å | ||
| 133 | P | 47.1 | Very low | 56.3 | Low | 121 Ų | 121 | 134 Ų | 134 | 79% | 0.786 | 77% | 0.767 | S | S | * | * | trans | -70.7 | 166.5 | -161.3 | 27.6 | -36 | 0 | 0 | 0 | 114.4 | S135 | P133-S135 PolarHBondContact O-N 3.01Š| ||
| 134 | A | 50.6 | Low | 58.4 | Low | 111 Ų | 111 | 129.8 Ų | 129.8 | 92% | 0.917 | 76% | 0.756 | S | S | * | * | trans | -71.2 | 85.1 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 135 | S | 50.4 | Low | 60.5 | Low | 104 Ų | 104 | 133.3 Ų | 133.3 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | trans | -72 | 136 | 153.5 | -61.3 | 0 | 0 | 0 | 0 | 109.6 | P133 R137 | P133-S135 PolarHBondContact O-N 3.01Å; S135-R137 PolarHBondContact O-N 3.21Å; S135-R137 VanDerWaalsContact O-N 3.08Å | ||
| 136 | S | 54.9 | Low | 62.6 | Low | 112 Ų | 112 | 132.2 Ų | 132.2 | 78% | 0.783 | 74% | 0.741 | S | S | * | * | trans | -58.2 | 110.1 | 178.2 | 34.4 | 0 | 0 | 0 | 0 | 111 | T138 | S136-T138 PolarHBondContact O-N 3.13Š| ||
| 137 | R | 56.1 | Low | 64.4 | Low | 240 Ų | 240 | 126.7 Ų | 126.7 | 91% | 0.906 | 72% | 0.723 | S | S | * | * | trans | -73.8 | 97.4 | 174.8 | -67.5 | -171.2 | -179 | -130.4 | -1.1 | 109.1 | S135 D139 | S135-R137 PolarHBondContact O-N 3.21Å; S135-R137 VanDerWaalsContact O-N 3.08Å; R137-D139 PolarHBondContact O-N 3.25Å | ||
| 138 | T | 63.7 | Low | 66.2 | Low | 129 Ų | 129 | 127 Ų | 127 | 79% | 0.791 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 118.7 | 162.2 | 41.2 | 0 | 0 | 0 | 0 | 108.5 | S136 | S136-T138 PolarHBondContact O-N 3.13Š|
| 139 | D | 71.4 | Confident | 67.8 | Low | 144 Ų | 144 | 123.5 Ų | 123.5 | 77% | 0.77 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 134.1 | 171.8 | -83.7 | -45.4 | 0 | 0 | 0 | 109.4 | R137 V141 | R137-D139 PolarHBondContact O-N 3.25Å; D139-V141 PolarHBondContact O-N 2.84Å |
| 140 | P | 79.3 | Confident | 68.7 | Low | 107 Ų | 107 | 124.5 Ų | 124.5 | 70% | 0.695 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -64 | 125.4 | -175.1 | 25.1 | -33.7 | 0 | 0 | 0 | 110.6 | V142 | P140-V142 WeakPolarHBondContact O-CG2 3.43Å; P140-V142 PolarHBondContact O-N 3.12Å |
| 141 | V | 86.1 | Confident | 69.4 | Low | 102 Ų | 102 | 121 Ų | 121 | 62% | 0.618 | 67% | 0.67 | S | S | * | * | trans | -65.1 | 98.4 | -174.9 | -179.3 | 0 | 0 | 0 | 0 | 110.8 | D139 Y143 | D139-V141 PolarHBondContact O-N 2.84Å; V141-Y143 HydrophobicContact CB-CE2 4.42Å; V141-Y143 HydrophobicContact CG1-CD1 4.39Å; V141-Y143 HydrophobicContact CG1-CE1 4.04Å; V141-Y143 HydrophobicContact CG1-CE2 4.24Å; V141-Y143 VanDerWaalsContact O-CD2 3.29Å; V141-Y143 WeakPolarHBondContact O-CD2 3.43Å; V141-Y143 PolarHBondContact O-N 3.04Å | ||
| 142 | V | 87.6 | Confident | 69.6 | Low | 78 Ų | 78 | 121.4 Ų | 121.4 | 47% | 0.473 | 66% | 0.663 | S | S | . | * | trans | -78.9 | 90.4 | 178.8 | -172.8 | 0 | 0 | 0 | 0 | 110.3 | P140 M146 K147 | P140-V142 WeakPolarHBondContact O-CG2 3.43Å; P140-V142 PolarHBondContact O-N 3.12Å; V142-M146 HydrophobicContact CG1-CB 3.98Å; V142-K147 HydrophobicContact CG1-CG 3.88Å; V142-K147 WeakPolarHBondContact O-CE 3.39Å | ||
| 143 | Y | 89.7 | Confident | 70.4 | Confident | 131 Ų | 131 | 122.8 Ų | 122.8 | 51% | 0.514 | 66% | 0.661 | S | S | . | * | trans | -56.8 | 151.2 | 176.1 | -63.8 | -79.9 | 0 | 0 | 0 | 112.5 | V141 W145 M146 | V141-Y143 HydrophobicContact CB-CE2 4.42Å; V141-Y143 HydrophobicContact CG1-CD1 4.39Å; V141-Y143 HydrophobicContact CG1-CE1 4.04Å; V141-Y143 HydrophobicContact CG1-CE2 4.24Å; V141-Y143 VanDerWaalsContact O-CD2 3.29Å; V141-Y143 WeakPolarHBondContact O-CD2 3.43Å; V141-Y143 PolarHBondContact O-N 3.04Å; Y143-W145 AromaticContact CG-NE1 3.95Å; Y143-W145 PolarHBondContact O-N 3.5Å; Y143-W145 VanDerWaalsContact O-N 3.09Å; Y143-M146 HydrophobicContact CD2-SD 3.83Å; Y143-M146 HydrophobicContact CG-SD 4.47Å; Y143-M146 WeakPolarHBondContact O-CB 3.43Å; Y143-M146 PolarHBondContact O-N 3.06Å | ||
| 144 | P | 88.4 | Confident | 70.7 | Confident | 102 Ų | 102 | 122 Ų | 122 | 66% | 0.662 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -55.4 | -32.4 | -175.7 | -28.5 | 36 | 0 | 0 | 0 | 115.2 | M146 K147 | P144-M146 VanDerWaalsContact C-N 3.32Å; P144-M146 PolarHBondContact O-N 3.07Å; P144-K147 WeakPolarHBondContact O-CB 3.31Å; P144-K147 PolarHBondContact O-N 3.25Å |
| 145 | W | 88.4 | Confident | 70.6 | Confident | 207 Ų | 207 | 120.8 Ų | 120.8 | 78% | 0.784 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -72.2 | -22.3 | 178.2 | 66.5 | -97.9 | 0 | 0 | 0 | 113.8 | Y143 K147 | Y143-W145 AromaticContact CG-NE1 3.95Å; Y143-W145 PolarHBondContact O-N 3.5Å; Y143-W145 VanDerWaalsContact O-N 3.09Å; W145-K147 VanDerWaalsContact C-N 3.28Å |
| 146 | M | 87.7 | Confident | 70.9 | Confident | 92 Ų | 92 | 121.2 Ų | 121.2 | 45% | 0.453 | 64% | 0.636 | S | S | . | * | G | 310 helix | trans | -77.3 | -18.6 | 175 | -56.4 | 173.3 | 78 | 0 | 0 | 111.6 | V142 Y143 P144 | V142-M146 HydrophobicContact CG1-CB 3.98Å; Y143-M146 HydrophobicContact CD2-SD 3.83Å; Y143-M146 HydrophobicContact CG-SD 4.47Å; Y143-M146 WeakPolarHBondContact O-CB 3.43Å; Y143-M146 PolarHBondContact O-N 3.06Å; P144-M146 VanDerWaalsContact C-N 3.32Å; P144-M146 PolarHBondContact O-N 3.07Å |
| 147 | K | 83.4 | Confident | 70.9 | Confident | 123 Ų | 123 | 120.2 Ų | 120.2 | 54% | 0.535 | 63% | 0.629 | S | S | . | * | S | Bend | trans | -76.9 | 133 | -179.3 | -59.8 | -177.6 | -179.1 | 178.7 | 0 | 110 | V142 P144 W145 V149 | V142-K147 HydrophobicContact CG1-CG 3.88Å; V142-K147 WeakPolarHBondContact O-CE 3.39Å; P144-K147 WeakPolarHBondContact O-CB 3.31Å; P144-K147 PolarHBondContact O-N 3.25Å; W145-K147 VanDerWaalsContact C-N 3.28Å; K147-V149 VanDerWaalsContact C-N 3.35Å; K147-V149 PolarHBondContact O-N 2.95Å |
| 148 | K | 80.3 | Confident | 70.4 | Confident | 120 Ų | 120 | 117.6 Ų | 117.6 | 52% | 0.522 | 62% | 0.62 | S | S | . | * | trans | -82.9 | 76.5 | -167.2 | -62.5 | 171.8 | 68.2 | -174.3 | 0 | 111.3 | H150 V151 E162 | K148-H150 PolarHBondContact O-N 2.96Å; K148-V151 HydrophobicContact CB-CG2 3.82Å; K148-V151 WeakPolarHBondContact O-CB 3.11Å; K148-V151 WeakPolarHBondContact O-CG2 3.14Å; K148-V151 PolarHBondContact O-N 3.33Å; K148-E162 WeakPolarHBondContact CE-OE1 3.45Å; K148-E162 WeakPolarHBondContact CE-OE2 3.49Å; K148-E162 IonicContact NZ-OE1 2.63Å; K148-E162 PolarHBondContact NZ-OE1 2.67Å; K148-E162 IonicContact NZ-OE2 2.67Å; K148-E162 PolarHBondContact NZ-OE2 3.49Å | ||
| 149 | V | 76.5 | Confident | 69.9 | Low | 103 Ų | 103 | 117.8 Ų | 117.8 | 62% | 0.624 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -42.2 | -36.8 | -173.6 | -176.3 | 0 | 0 | 0 | 0 | 114.7 | K147 V151 | K147-V149 VanDerWaalsContact C-N 3.35Å; K147-V149 PolarHBondContact O-N 2.95Å; V149-V151 VanDerWaalsContact C-N 3.27Å; V149-V151 PolarHBondContact O-N 3.44Å |
| 150 | H | 66 | Low | 69 | Low | 139 Ų | 139 | 113 Ų | 113 | 64% | 0.644 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -8.1 | -178.8 | -63.9 | 127.4 | 0 | 0 | 0 | 115.8 | K148 R165 | K148-H150 PolarHBondContact O-N 2.96Å; H150-R165 PolarHBondContact O-NH2 3.26Å |
| 151 | V | 58.2 | Low | 68 | Low | 56 Ų | 56 | 111.6 Ų | 111.6 | 34% | 0.339 | 62% | 0.616 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89.8 | -52.3 | -175.3 | -176.8 | 0 | 0 | 0 | 0 | 111.5 | K148 V149 I153 V154 | K148-V151 HydrophobicContact CB-CG2 3.82Å; K148-V151 WeakPolarHBondContact O-CB 3.11Å; K148-V151 WeakPolarHBondContact O-CG2 3.14Å; K148-V151 PolarHBondContact O-N 3.33Å; V149-V151 VanDerWaalsContact C-N 3.27Å; V149-V151 PolarHBondContact O-N 3.44Å; V151-I153 PolarHBondContact O-N 3.42Å; V151-V154 PolarHBondContact O-N 3.09Å |
| 152 | N | 53.6 | Low | 66.7 | Low | 129 Ų | 129 | 110.2 Ų | 110.2 | 69% | 0.69 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | -17.4 | -175.4 | -93.1 | 62.5 | 0 | 0 | 0 | 115.8 | ||
| 153 | I | 58.3 | Low | 65.4 | Low | 128 Ų | 128 | 112.1 Ų | 112.1 | 66% | 0.656 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -12.2 | -171.3 | -65 | 170.2 | 0 | 0 | 0 | 112.7 | V151 | V151-I153 PolarHBondContact O-N 3.42Š|
| 154 | V | 53.1 | Low | 64.6 | Low | 106 Ų | 106 | 113.8 Ų | 113.8 | 64% | 0.642 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.5 | -19.6 | -172.6 | -131.9 | 0 | 0 | 0 | 0 | 116.4 | V151 | V151-V154 PolarHBondContact O-N 3.09Š|
| 155 | N | 49.4 | Very low | 64 | Low | 85 Ų | 85 | 117 Ų | 117 | 46% | 0.455 | 63% | 0.625 | S | S | . | * | trans | -156.4 | 117.1 | 168.3 | -153.3 | 8 | 0 | 0 | 0 | 110.9 | S157 | N155-S157 PolarHBondContact OD1-OG 2.84Š| ||
| 156 | S | 57.5 | Low | 63.9 | Low | 113 Ų | 113 | 112.5 Ų | 112.5 | 79% | 0.79 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -90.1 | 0.1 | -176.7 | -165.3 | 0 | 0 | 0 | 0 | 113.8 | ||
| 157 | S | 53.3 | Low | 64 | Low | 91 Ų | 91 | 119.4 Ų | 119.4 | 64% | 0.636 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -126.2 | 9.3 | -167.2 | 53 | 0 | 0 | 0 | 0 | 114.8 | N155 | N155-S157 PolarHBondContact OD1-OG 2.84Š|
| 158 | Y | 47.3 | Very low | 64.5 | Low | 185 Ų | 185 | 119.3 Ų | 119.3 | 73% | 0.725 | 66% | 0.657 | S | S | * | * | trans | -105.9 | 83.4 | -178.5 | -124 | -101.7 | 0 | 0 | 0 | 113.2 | G160 | Y158-G160 PolarHBondContact O-N 3.29Š| ||
| 159 | S | 53 | Low | 65.3 | Low | 133 Ų | 133 | 117.7 Ų | 117.7 | 93% | 0.93 | 67% | 0.666 | S | S | * | * | trans | -76.2 | 61 | 168.4 | 47.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 160 | G | 51.3 | Low | 66.3 | Low | 42 Ų | 42 | 116.3 Ų | 116.3 | 43% | 0.433 | 65% | 0.65 | S | S | . | * | S | Bend | trans | -170.6 | 131.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115 | Y158 E162 | Y158-G160 PolarHBondContact O-N 3.29Å; G160-E162 PolarHBondContact O-N 3.46Å |
| 161 | G | 59.2 | Low | 67.9 | Low | 78 Ų | 78 | 113.3 Ų | 113.3 | 80% | 0.804 | 64% | 0.641 | S | S | * | * | trans | 54.8 | 53.3 | 157.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | P163 | G161-P163 WeakPolarHBondContact O-CD 3.23Š| ||
| 162 | E | 57.7 | Low | 69.8 | Low | 74 Ų | 74 | 120.3 Ų | 120.3 | 35% | 0.346 | 66% | 0.662 | S | S | . | * | trans | -42.9 | 118.5 | -174.7 | -109.1 | -168.8 | -117.3 | 0 | 0 | 115.4 | K148 G160 K164 | K148-E162 WeakPolarHBondContact CE-OE1 3.45Å; K148-E162 WeakPolarHBondContact CE-OE2 3.49Å; K148-E162 IonicContact NZ-OE1 2.63Å; K148-E162 PolarHBondContact NZ-OE1 2.67Å; K148-E162 IonicContact NZ-OE2 2.67Å; K148-E162 PolarHBondContact NZ-OE2 3.49Å; G160-E162 PolarHBondContact O-N 3.46Å; E162-K164 WeakPolarHBondContact O-CD 3.41Å; E162-K164 PolarHBondContact O-N 2.84Å; E162-K164 VanDerWaalsContact O-N 3.12Å | ||
| 163 | P | 60.9 | Low | 71.9 | Confident | 118 Ų | 118 | 121 Ų | 121 | 77% | 0.766 | 66% | 0.66 | S | S | * | * | trans | -70.1 | 102.2 | 165.4 | -17.1 | 31.8 | 0 | 0 | 0 | 110.1 | G161 R165 | G161-P163 WeakPolarHBondContact O-CD 3.23Å; P163-R165 PolarHBondContact O-N 2.89Å; P163-R165 VanDerWaalsContact O-N 3.15Å | ||
| 164 | K | 73.3 | Confident | 73.8 | Confident | 166 Ų | 166 | 116.2 Ų | 116.2 | 72% | 0.722 | 64% | 0.635 | S | S | * | * | trans | -61.5 | 120.3 | 168.8 | -71.7 | 70.4 | 170.2 | -179.8 | 0 | 106.5 | E162 S166 | E162-K164 WeakPolarHBondContact O-CD 3.41Å; E162-K164 PolarHBondContact O-N 2.84Å; E162-K164 VanDerWaalsContact O-N 3.12Å; K164-S166 PolarHBondContact O-N 2.97Å | ||
| 165 | R | 75.9 | Confident | 76 | Confident | 168 Ų | 168 | 113.6 Ų | 113.6 | 63% | 0.634 | 62% | 0.62 | S | S | * | * | trans | -56.6 | 102.6 | 177.8 | -71.9 | -175.5 | -177.8 | 172.1 | 2.6 | 109.6 | H150 P163 | H150-R165 PolarHBondContact O-NH2 3.26Å; P163-R165 PolarHBondContact O-N 2.89Å; P163-R165 VanDerWaalsContact O-N 3.15Å | ||
| 166 | S | 85.7 | Confident | 78.3 | Confident | 114 Ų | 114 | 113.7 Ų | 113.7 | 80% | 0.797 | 62% | 0.62 | S | S | * | * | trans | -62 | 141.8 | -176.6 | -171.2 | 0 | 0 | 0 | 0 | 110.7 | K164 | K164-S166 PolarHBondContact O-N 2.97Š| ||
| 167 | R | 91 | Very high | 80.3 | Confident | 237 Ų | 237 | 111.1 Ų | 111.1 | 89% | 0.894 | 60% | 0.595 | S | S | * | * | trans | -94.6 | 100.6 | 179.6 | -72.4 | 179.7 | 174.7 | -96.7 | 4.6 | 109.3 | A169 | R167-A169 PolarHBondContact O-N 3.01Š| ||
| 168 | T | 93.9 | Very high | 82.4 | Confident | 120 Ų | 120 | 106.8 Ų | 106.8 | 74% | 0.736 | 57% | 0.565 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 122.7 | 167.4 | -39.8 | 0 | 0 | 0 | 0 | 109.5 | ||
| 169 | A | 95.9 | Very high | 84.9 | Confident | 86 Ų | 86 | 100.9 Ų | 100.9 | 71% | 0.711 | 54% | 0.544 | S | S | * | . | P | Polyproline II helix | trans | -80.3 | 149.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | R167 | R167-A169 PolarHBondContact O-N 3.01Š|
| 170 | Y | 98.3 | Very high | 87.1 | Confident | 74 Ų | 74 | 100.1 Ų | 100.1 | 29% | 0.29 | 52% | 0.524 | S | S | . | . | P | Polyproline II helix | trans | -84.7 | 146.2 | 170.3 | -59.7 | -56.6 | 0 | 0 | 0 | 110.3 | L202 Q206 W210 | Y170-L202 HydrophobicContact CD1-CD1 3.92Å; Y170-L202 HydrophobicContact CD1-CD2 3.84Å; Y170-L202 HydrophobicContact CE1-CD1 3.89Å; Y170-L202 HydrophobicContact CE1-CD2 3.67Å; Y170-L202 HydrophobicContact CE1-CG 4.45Å; Y170-Q206 HydrophobicContact CE1-CB 4.46Å; Y170-Q206 WeakPolarHBondContact OH-CB 3.44Å; Y170-W210 AromaticContact CE2-CD1 3.81Å |
| 171 | T | 98.6 | Very high | 89.3 | Confident | 76 Ų | 76 | 98.8 Ų | 98.8 | 47% | 0.466 | 51% | 0.506 | S | S | . | . | P | Polyproline II helix | trans | -69.1 | 158.9 | 176.5 | 76.2 | 0 | 0 | 0 | 0 | 111.1 | Q173 Q174 V175 | T171-Q173 PolarHBondContact O-N 3.17Å; T171-Q174 PolarHBondContact O-N 3.28Å; T171-Q174 VanDerWaalsContact O-N 3.13Å; T171-Q174 WeakPolarHBondContact OG1-CG 3.32Å; T171-Q174 PolarHBondContact OG1-N 2.73Å; T171-V175 WeakPolarHBondContact O-CG2 3.49Å; T171-V175 PolarHBondContact O-N 3Å |
| 172 | R | 98.3 | Very high | 91.2 | Very high | 204 Ų | 204 | 95.1 Ų | 95.1 | 77% | 0.77 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -55.2 | -39.9 | 176.7 | -175.4 | 175.1 | 179.3 | -96.4 | 1.1 | 112 | V175 L176 | R172-V175 PolarHBondContact O-N 3.2Å; R172-L176 HydrophobicContact CG-CD1 4.07Å; R172-L176 VanDerWaalsContact O-CG 3.28Å; R172-L176 WeakPolarHBondContact O-CG 3.44Å; R172-L176 PolarHBondContact O-N 3.43Å |
| 173 | Q | 98.4 | Very high | 93.1 | Very high | 142 Ų | 142 | 97 Ų | 97 | 66% | 0.664 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.9 | -46.9 | 176.3 | -178 | -178.1 | -5.8 | 0 | 0 | 112.1 | T171 V175 L176 E177 | T171-Q173 PolarHBondContact O-N 3.17Å; Q173-V175 VanDerWaalsContact C-N 3.31Å; Q173-V175 PolarHBondContact O-N 2.9Å; Q173-L176 PolarHBondContact O-N 3.26Å; Q173-E177 PolarHBondContact O-N 2.97Å |
| 174 | Q | 98.6 | Very high | 94.9 | Very high | 28 Ų | 28 | 100.6 Ų | 100.6 | 13% | 0.131 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -58.2 | -43.6 | 176.4 | -73 | 172.8 | -26.1 | 0 | 0 | 111.5 | T171 L178 L200 L202 | T171-Q174 PolarHBondContact O-N 3.28Å; T171-Q174 VanDerWaalsContact O-N 3.13Å; T171-Q174 WeakPolarHBondContact OG1-CG 3.32Å; T171-Q174 PolarHBondContact OG1-N 2.73Å; Q174-L178 WeakPolarHBondContact O-CB 3.33Å; Q174-L178 VanDerWaalsContact O-CD1 3.32Å; Q174-L178 WeakPolarHBondContact O-CD1 3.38Å; Q174-L178 WeakPolarHBondContact O-CG 3.14Å; Q174-L178 PolarHBondContact O-N 3.49Å; Q174-L200 HydrophobicContact CG-CB 4.32Å; Q174-L200 PolarHBondContact NE2-O 3.07Å; Q174-L202 HydrophobicContact CG-CD1 4.41Å |
| 175 | V | 98.5 | Very high | 96 | Very high | 52 Ų | 52 | 96.2 Ų | 96.2 | 32% | 0.315 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.6 | -44.1 | 177.9 | 177 | 0 | 0 | 0 | 0 | 111.7 | T171 R172 Q173 L178 E179 | T171-V175 WeakPolarHBondContact O-CG2 3.49Å; T171-V175 PolarHBondContact O-N 3Å; R172-V175 PolarHBondContact O-N 3.2Å; Q173-V175 VanDerWaalsContact C-N 3.31Å; Q173-V175 PolarHBondContact O-N 2.9Å; V175-L178 PolarHBondContact O-N 3.37Å; V175-E179 HydrophobicContact CG1-CG 4.41Å; V175-E179 WeakPolarHBondContact O-CG 3.5Å; V175-E179 PolarHBondContact O-N 2.79Å |
| 176 | L | 98.5 | Very high | 97 | Very high | 86 Ų | 86 | 92.1 Ų | 92.1 | 45% | 0.45 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -63.1 | -45.5 | -179.4 | -73.3 | 169.2 | 0 | 0 | 0 | 112.5 | R172 Q173 E179 K180 | R172-L176 HydrophobicContact CG-CD1 4.07Å; R172-L176 VanDerWaalsContact O-CG 3.28Å; R172-L176 WeakPolarHBondContact O-CG 3.44Å; R172-L176 PolarHBondContact O-N 3.43Å; Q173-L176 PolarHBondContact O-N 3.26Å; L176-E179 PolarHBondContact O-N 3.33Å; L176-K180 VanDerWaalsContact O-CB 3.32Å; L176-K180 WeakPolarHBondContact O-CB 3.41Å; L176-K180 PolarHBondContact O-N 3.2Å |
| 177 | E | 98.6 | Very high | 97.6 | Very high | 59 Ų | 59 | 93.8 Ų | 93.8 | 28% | 0.276 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -67.2 | -37.2 | 176.9 | -74.1 | -65.3 | 134.1 | 0 | 0 | 112.2 | Q173 K180 E181 L200 | Q173-E177 PolarHBondContact O-N 2.97Å; E177-K180 PolarHBondContact O-N 2.84Å; E177-K180 WeakPolarHBondContact OE1-CD 3.49Å; E177-K180 IonicContact OE1-NZ 2.68Å; E177-K180 PolarHBondContact OE1-NZ 2.85Å; E177-K180 WeakPolarHBondContact OE2-CD 3.37Å; E177-K180 IonicContact OE2-NZ 3.26Å; E177-K180 PolarHBondContact OE2-NZ 3.29Å; E177-E181 WeakPolarHBondContact O-CG 3.4Å; E177-E181 PolarHBondContact O-N 2.89Å; E177-L200 HydrophobicContact CB-CD1 4.12Å; E177-L200 HydrophobicContact CB-CD2 3.73Å; E177-L200 HydrophobicContact CG-CD2 4.08Å |
| 178 | L | 98.6 | Very high | 98 | Very high | 1 Ų | 1 | 84 Ų | 84 | 1% | 0.005 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -64.7 | -38.5 | 173 | -72.9 | 167 | 0 | 0 | 0 | 112.6 | Q174 V175 F182 I196 L200 L202 I207 W210 F211 | Q174-L178 WeakPolarHBondContact O-CB 3.33Å; Q174-L178 VanDerWaalsContact O-CD1 3.32Å; Q174-L178 WeakPolarHBondContact O-CD1 3.38Å; Q174-L178 WeakPolarHBondContact O-CG 3.14Å; Q174-L178 PolarHBondContact O-N 3.49Å; V175-L178 PolarHBondContact O-N 3.37Å; L178-F182 WeakPolarHBondContact O-CB 3.34Å; L178-F182 PolarHBondContact O-N 2.98Å; L178-I196 HydrophobicContact CD2-CG2 4.18Å; L178-L200 HydrophobicContact CD1-CD1 4.41Å; L178-L200 HydrophobicContact CD2-CD1 3.98Å; L178-L200 HydrophobicContact CG-CD1 3.72Å; L178-L202 HydrophobicContact CD1-CD1 4.23Å; L178-I207 HydrophobicContact CD2-CD1 3.85Å; L178-W210 VanDerWaalsContact C-CH2 3.45Å; L178-W210 HydrophobicContact CB-CD2 3.93Å; L178-W210 HydrophobicContact CB-CE3 3.99Å; L178-W210 HydrophobicContact CB-CH2 3.72Å; L178-W210 HydrophobicContact CB-CZ2 3.62Å; L178-W210 HydrophobicContact CB-CZ3 3.89Å; L178-W210 HydrophobicContact CD1-CD2 3.97Å; L178-W210 HydrophobicContact CD1-CG 3.88Å; L178-W210 HydrophobicContact CD2-CD2 4.35Å; L178-W210 HydrophobicContact CD2-CE3 4.27Å; L178-W210 HydrophobicContact CG-CD2 4.31Å; L178-W210 WeakPolarHBondContact O-CH2 3.33Å; L178-W210 WeakPolarHBondContact O-CZ3 3.32Å; L178-F211 HydrophobicContact CD2-CD2 4.5Å; L178-F211 HydrophobicContact CD2-CE2 3.96Å |
| 179 | E | 98.6 | Very high | 98.2 | Very high | 60 Ų | 60 | 82.4 Ų | 82.4 | 28% | 0.28 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -71 | -40.4 | 174.6 | -69.1 | -143.4 | 117.7 | 0 | 0 | 112.3 | V175 L176 F182 H183 W210 R214 | V175-E179 HydrophobicContact CG1-CG 4.41Å; V175-E179 WeakPolarHBondContact O-CG 3.5Å; V175-E179 PolarHBondContact O-N 2.79Å; L176-E179 PolarHBondContact O-N 3.33Å; E179-F182 PolarHBondContact O-N 3.19Å; E179-H183 PolarHBondContact O-N 3.35Å; E179-H183 PolarHBondContact O-ND1 2.83Å; E179-W210 HydrophobicContact CG-CH2 3.87Å; E179-W210 HydrophobicContact CG-CZ2 3.84Å; E179-R214 IonicContact OE1-CZ 3.29Å; E179-R214 VanDerWaalsContact OE1-CZ 3.29Å; E179-R214 IonicContact OE1-NE 2.82Å; E179-R214 PolarHBondContact OE1-NE 3.03Å; E179-R214 IonicContact OE1-NH2 3.8Å; E179-R214 PolarHBondContact OE1-NH2 3.24Å |
| 180 | K | 98.5 | Very high | 98.3 | Very high | 117 Ų | 117 | 85.3 Ų | 85.3 | 51% | 0.509 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -55.8 | -51.7 | 172.8 | 169.5 | -175.8 | 164.5 | -156.6 | 0 | 111.6 | L176 E177 F182 H183 Y184 | L176-K180 VanDerWaalsContact O-CB 3.32Å; L176-K180 WeakPolarHBondContact O-CB 3.41Å; L176-K180 PolarHBondContact O-N 3.2Å; E177-K180 PolarHBondContact O-N 2.84Å; E177-K180 WeakPolarHBondContact OE1-CD 3.49Å; E177-K180 IonicContact OE1-NZ 2.68Å; E177-K180 PolarHBondContact OE1-NZ 2.85Å; E177-K180 WeakPolarHBondContact OE2-CD 3.37Å; E177-K180 IonicContact OE2-NZ 3.26Å; E177-K180 PolarHBondContact OE2-NZ 3.29Å; K180-F182 VanDerWaalsContact C-N 3.31Å; K180-F182 PolarHBondContact O-N 3.41Å; K180-H183 PolarHBondContact O-N 3.18Å; K180-Y184 PolarHBondContact O-N 3.42Å; K180-Y184 VanDerWaalsContact O-N 3.08Å |
| 181 | E | 98.4 | Very high | 98.3 | Very high | 14 Ų | 14 | 90.9 Ų | 90.9 | 7% | 0.065 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -62.2 | -35.9 | 175.6 | -73.5 | -68.7 | 126.8 | 0 | 0 | 112.5 | E177 H183 Y184 N185 R192 I196 F211 | E177-E181 WeakPolarHBondContact O-CG 3.4Å; E177-E181 PolarHBondContact O-N 2.89Å; E181-H183 PolarHBondContact O-N 2.82Å; E181-Y184 PolarHBondContact O-N 3.5Å; E181-N185 PolarHBondContact O-N 3.2Å; E181-N185 VanDerWaalsContact O-O 3.08Å; E181-R192 VanDerWaalsContact CD-NH2 3.28Å; E181-R192 IonicContact OE1-CZ 3.47Å; E181-R192 IonicContact OE1-NE 2.78Å; E181-R192 IonicContact OE1-NH2 3.31Å; E181-R192 PolarHBondContact OE1-NH2 3.26Å; E181-R192 IonicContact OE2-CZ 2.74Å; E181-R192 IonicContact OE2-NE 2.72Å; E181-R192 PolarHBondContact OE2-NE 2.85Å; E181-R192 IonicContact OE2-NH2 3.71Å; E181-R192 PolarHBondContact OE2-NH2 3.34Å; E181-I196 HydrophobicContact CB-CD1 4.08Å; E181-I196 HydrophobicContact CG-CD1 3.73Å; E181-I196 HydrophobicContact CG-CG1 4.05Å; E181-I196 WeakPolarHBondContact OE2-CD1 3.32Å; E181-F211 HydrophobicContact CB-CZ 4.03Å |
| 182 | F | 98.6 | Very high | 98.3 | Very high | 1 Ų | 1 | 91.4 Ų | 91.4 | 0% | 0.004 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -68 | -31.8 | 176.7 | -178.5 | -101.3 | 0 | 0 | 0 | 113.9 | L178 E179 K180 N185 R186 W210 F211 R214 R215 W218 | L178-F182 WeakPolarHBondContact O-CB 3.34Å; L178-F182 PolarHBondContact O-N 2.98Å; E179-F182 PolarHBondContact O-N 3.19Å; K180-F182 VanDerWaalsContact C-N 3.31Å; K180-F182 PolarHBondContact O-N 3.41Å; F182-N185 CarbonylContact O-C 3.41Å; F182-R186 HydrophobicContact CD2-CB 4.33Å; F182-R186 HydrophobicContact CD2-CG 4.31Å; F182-R186 HydrophobicContact CE1-CG 4.15Å; F182-R186 HydrophobicContact CE2-CB 3.78Å; F182-R186 HydrophobicContact CE2-CG 3.78Å; F182-R186 HydrophobicContact CZ-CB 4.16Å; F182-R186 HydrophobicContact CZ-CG 3.7Å; F182-R186 WeakPolarHBondContact O-CG 3.48Å; F182-R186 PolarHBondContact O-N 3.03Å; F182-W210 HydrophobicContact CB-CH2 4.23Å; F182-W210 HydrophobicContact CB-CZ3 4.01Å; F182-W210 HydrophobicContact CG-CZ3 4.44Å; F182-F211 HydrophobicContact CB-CE1 4.05Å; F182-F211 HydrophobicContact CB-CZ 4.14Å; F182-F211 AromaticContact CD2-CD1 3.99Å; F182-F211 HydrophobicContact CD2-CD1 3.99Å; F182-F211 AromaticContact CD2-CE1 3.87Å; F182-F211 HydrophobicContact CD2-CE1 3.87Å; F182-F211 HydrophobicContact CG-CE1 4.48Å; F182-R214 HydrophobicContact CB-CG 4.39Å; F182-R214 HydrophobicContact CD1-CG 3.6Å; F182-R214 HydrophobicContact CD2-CB 4.2Å; F182-R214 HydrophobicContact CD2-CG 3.74Å; F182-R214 HydrophobicContact CE1-CG 3.72Å; F182-R214 HydrophobicContact CE2-CB 4.23Å; F182-R214 HydrophobicContact CE2-CG 3.87Å; F182-R214 HydrophobicContact CG-CG 3.62Å; F182-R214 HydrophobicContact CZ-CG 3.85Å; F182-R215 HydrophobicContact CE2-CG 3.74Å; F182-R215 HydrophobicContact CZ-CG 4.33Å; F182-W218 HydrophobicContact CE1-CB 4.19Å; F182-W218 HydrophobicContact CE1-CG 4.2Å; F182-W218 HydrophobicContact CZ-CB 3.88Å; F182-W218 HydrophobicContact CZ-CG 4.04Å |
| 183 | H | 97.9 | Very high | 98.3 | Very high | 115 Ų | 115 | 84.2 Ų | 84.2 | 53% | 0.532 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -73.1 | -39.5 | 172.9 | -70.5 | 96.1 | 0 | 0 | 0 | 111.4 | E179 K180 E181 | E179-H183 PolarHBondContact O-N 3.35Å; E179-H183 PolarHBondContact O-ND1 2.83Å; K180-H183 PolarHBondContact O-N 3.18Å; E181-H183 PolarHBondContact O-N 2.82Å |
| 184 | Y | 98.3 | Very high | 98.3 | Very high | 192 Ų | 192 | 79.4 Ų | 79.4 | 75% | 0.753 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -62.8 | -49.7 | 173.6 | 178.4 | -110.4 | 0 | 0 | 0 | 112 | K180 E181 | K180-Y184 PolarHBondContact O-N 3.42Å; K180-Y184 VanDerWaalsContact O-N 3.08Å; E181-Y184 PolarHBondContact O-N 3.5Å |
| 185 | N | 97 | Very high | 98.3 | Very high | 74 Ų | 74 | 80.8 Ų | 80.8 | 40% | 0.396 | 36% | 0.357 | S | S | . | . | trans | -147.6 | 123.7 | 171.4 | -168.3 | -19 | 0 | 0 | 0 | 111.9 | E181 F182 Y187 | E181-N185 PolarHBondContact O-N 3.2Å; E181-N185 VanDerWaalsContact O-O 3.08Å; F182-N185 CarbonylContact O-C 3.41Å; N185-Y187 PolarHBondContact ND2-O 2.9Å; N185-Y187 PolarHBondContact O-N 3.02Å; N185-Y187 VanDerWaalsContact O-N 3.12Å; N185-Y187 PolarHBondContact OD1-N 2.88Å; N185-Y187 PolarHBondContact OD1-O 3.15Å; N185-Y187 VanDerWaalsContact OD1-O 3.07Å | ||
| 186 | R | 97.8 | Very high | 98.3 | Very high | 82 Ų | 82 | 78.7 Ų | 78.7 | 31% | 0.309 | 34% | 0.344 | S | S | . | . | S | Bend | trans | -66.9 | -12.2 | 179.1 | -67.4 | 179.5 | 167.5 | 67.2 | 3.2 | 113.7 | F182 R215 W218 | F182-R186 HydrophobicContact CD2-CB 4.33Å; F182-R186 HydrophobicContact CD2-CG 4.31Å; F182-R186 HydrophobicContact CE1-CG 4.15Å; F182-R186 HydrophobicContact CE2-CB 3.78Å; F182-R186 HydrophobicContact CE2-CG 3.78Å; F182-R186 HydrophobicContact CZ-CB 4.16Å; F182-R186 HydrophobicContact CZ-CG 3.7Å; F182-R186 WeakPolarHBondContact O-CG 3.48Å; F182-R186 PolarHBondContact O-N 3.03Å; R186-R215 VanDerWaalsContact O-CD 3.31Å; R186-R215 WeakPolarHBondContact O-CD 3.45Å; R186-W218 VanDerWaalsContact NE-CE2 3.33Å |
| 187 | Y | 98.3 | Very high | 98.3 | Very high | 150 Ų | 150 | 75 Ų | 75 | 59% | 0.588 | 33% | 0.325 | S | S | * | . | S | Bend | trans | -135 | 122.1 | -177.4 | -65.7 | -108.8 | 0 | 0 | 0 | 110.8 | N185 | N185-Y187 PolarHBondContact ND2-O 2.9Å; N185-Y187 PolarHBondContact O-N 3.02Å; N185-Y187 VanDerWaalsContact O-N 3.12Å; N185-Y187 PolarHBondContact OD1-N 2.88Å; N185-Y187 PolarHBondContact OD1-O 3.15Å; N185-Y187 VanDerWaalsContact OD1-O 3.07Å |
| 188 | L | 98.3 | Very high | 98.3 | Very high | 31 Ų | 31 | 78.9 Ų | 78.9 | 16% | 0.162 | 34% | 0.344 | C | S | . | . | trans | -88.4 | 134.8 | 180 | -62.4 | 179.7 | 0 | 0 | 0 | 113.2 | R192 R193 I196 I207 F211 | L188-R192 HydrophobicContact CD2-CG 4Å; L188-R193 HydrophobicContact CD1-CG 4.39Å; L188-I196 HydrophobicContact CD1-CD1 3.67Å; L188-I196 HydrophobicContact CD2-CD1 3.64Å; L188-I196 HydrophobicContact CG-CD1 4.31Å; L188-I207 HydrophobicContact CD1-CG2 3.46Å; L188-I207 VanDerWaalsContact CD1-CG2 3.46Å; L188-F211 HydrophobicContact CD1-CD1 4.24Å; L188-F211 HydrophobicContact CD1-CD2 3.63Å; L188-F211 HydrophobicContact CD1-CE1 4.12Å; L188-F211 HydrophobicContact CD1-CE2 3.53Å; L188-F211 HydrophobicContact CD1-CG 4.02Å; L188-F211 HydrophobicContact CD1-CZ 3.78Å; L188-F211 HydrophobicContact CD2-CE1 3.87Å; L188-F211 HydrophobicContact CD2-CE2 4.42Å; L188-F211 HydrophobicContact CD2-CZ 3.81Å; L188-F211 HydrophobicContact CG-CD1 3.86Å; L188-F211 HydrophobicContact CG-CD2 4.18Å; L188-F211 HydrophobicContact CG-CE1 3.65Å; L188-F211 HydrophobicContact CG-CE2 4.02Å; L188-F211 HydrophobicContact CG-CG 4.11Å; L188-F211 HydrophobicContact CG-CZ 3.76Å | ||
| 189 | T | 98.5 | Very high | 98.3 | Very high | 87 Ų | 87 | 84 Ų | 84 | 53% | 0.534 | 38% | 0.375 | S | S | . | . | trans | -67.9 | 165.3 | 166.5 | 67.4 | 0 | 0 | 0 | 0 | 111.6 | R191 R192 R193 | T189-R191 VanDerWaalsContact C-N 3.3Å; T189-R191 PolarHBondContact O-N 3.12Å; T189-R192 WeakPolarHBondContact OG1-CB 3.23Å; T189-R192 PolarHBondContact OG1-N 3.3Å; T189-R193 PolarHBondContact O-N 2.97Å | ||
| 190 | R | 98.3 | Very high | 98.3 | Very high | 147 Ų | 147 | 81.6 Ų | 81.6 | 56% | 0.555 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -58.8 | -40.5 | 178.1 | 179.1 | 64.2 | -172.9 | 94.2 | -15.4 | 112.5 | E204 | R190-E204 IonicContact CZ-OE1 2.74Å; R190-E204 IonicContact CZ-OE2 3.52Å; R190-E204 VanDerWaalsContact CZ-OE2 3.3Å; R190-E204 IonicContact NH1-OE1 3.09Å; R190-E204 PolarHBondContact NH1-OE1 2.85Å; R190-E204 IonicContact NH1-OE2 3.93Å; R190-E204 PolarHBondContact NH1-OE2 3.42Å; R190-E204 IonicContact NH2-OE1 3.66Å; R190-E204 PolarHBondContact NH2-OE1 3.28Å; R190-E204 IonicContact NH2-OE2 2.7Å |
| 191 | R | 98.3 | Very high | 98.3 | Very high | 190 Ų | 190 | 81.5 Ų | 81.5 | 72% | 0.717 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -70.1 | -53.7 | 178.6 | 174.2 | 176.1 | 166.2 | 163.6 | 0.3 | 111.7 | T189 R193 V194 E195 | T189-R191 VanDerWaalsContact C-N 3.3Å; T189-R191 PolarHBondContact O-N 3.12Å; R191-R193 PolarHBondContact O-N 3.41Å; R191-R193 VanDerWaalsContact O-N 3.11Å; R191-V194 WeakPolarHBondContact O-CB 3.49Å; R191-V194 PolarHBondContact O-N 2.97Å; R191-E195 WeakPolarHBondContact CG-OE1 3.48Å; R191-E195 IonicContact CZ-OE1 3.58Å; R191-E195 IonicContact NE-OE1 2.99Å; R191-E195 PolarHBondContact NE-OE1 2.67Å; R191-E195 IonicContact NH2-OE1 3.46Å; R191-E195 PolarHBondContact NH2-OE1 2.9Å; R191-E195 PolarHBondContact O-N 3.41Å |
| 192 | R | 98.5 | Very high | 98.2 | Very high | 88 Ų | 88 | 81.6 Ų | 81.6 | 33% | 0.332 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -59.7 | -30 | -176.6 | -171.8 | 54.9 | 175.4 | 177.9 | 0.7 | 112.6 | E181 L188 T189 V194 E195 I196 | E181-R192 VanDerWaalsContact CD-NH2 3.28Å; E181-R192 IonicContact OE1-CZ 3.47Å; E181-R192 IonicContact OE1-NE 2.78Å; E181-R192 IonicContact OE1-NH2 3.31Å; E181-R192 PolarHBondContact OE1-NH2 3.26Å; E181-R192 IonicContact OE2-CZ 2.74Å; E181-R192 IonicContact OE2-NE 2.72Å; E181-R192 PolarHBondContact OE2-NE 2.85Å; E181-R192 IonicContact OE2-NH2 3.71Å; E181-R192 PolarHBondContact OE2-NH2 3.34Å; L188-R192 HydrophobicContact CD2-CG 4Å; T189-R192 WeakPolarHBondContact OG1-CB 3.23Å; T189-R192 PolarHBondContact OG1-N 3.3Å; R192-V194 PolarHBondContact O-N 2.99Å; R192-E195 WeakPolarHBondContact CD-OE2 3.31Å; R192-E195 IonicContact CZ-OE2 3.65Å; R192-E195 IonicContact NE-OE2 3.75Å; R192-E195 IonicContact NH1-OE2 2.8Å; R192-E195 PolarHBondContact NH1-OE2 3Å; R192-E195 PolarHBondContact O-N 2.92Å; R192-I196 HydrophobicContact CG-CD1 3.91Å; R192-I196 HydrophobicContact CG-CG1 4.42Å; R192-I196 WeakPolarHBondContact O-CD1 3.48Å; R192-I196 VanDerWaalsContact O-CG1 3.31Å; R192-I196 WeakPolarHBondContact O-CG1 3.38Å; R192-I196 PolarHBondContact O-N 2.63Å; R192-I196 VanDerWaalsContact O-N 3.1Å |
| 193 | R | 98.6 | Very high | 98.2 | Very high | 52 Ų | 52 | 84.3 Ų | 84.3 | 20% | 0.196 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -62.8 | -36.1 | 173.3 | -159.3 | -168.6 | -54.3 | 139.9 | 0.9 | 113.7 | L188 T189 R191 A197 E204 I207 | L188-R193 HydrophobicContact CD1-CG 4.39Å; T189-R193 PolarHBondContact O-N 2.97Å; R191-R193 PolarHBondContact O-N 3.41Å; R191-R193 VanDerWaalsContact O-N 3.11Å; R193-A197 WeakPolarHBondContact O-CB 3.4Å; R193-A197 PolarHBondContact O-N 3.34Å; R193-E204 WeakPolarHBondContact CD-O 3.45Å; R193-E204 WeakPolarHBondContact CD-OE2 3.34Å; R193-E204 HydrophobicContact CG-CB 4.49Å; R193-E204 HydrophobicContact CG-CG 4.21Å; R193-E204 IonicContact CZ-OE2 3.01Å; R193-E204 IonicContact NH1-OE2 3.3Å; R193-E204 PolarHBondContact NH1-OE2 2.86Å; R193-I207 HydrophobicContact CG-CB 3.93Å; R193-I207 HydrophobicContact CG-CG2 3.7Å |
| 194 | V | 98.6 | Very high | 98.3 | Very high | 41 Ų | 41 | 81.4 Ų | 81.4 | 25% | 0.248 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -68.6 | -47.3 | 176.8 | -177.5 | 0 | 0 | 0 | 0 | 110 | R191 R192 I196 A197 H198 | R191-V194 WeakPolarHBondContact O-CB 3.49Å; R191-V194 PolarHBondContact O-N 2.97Å; R192-V194 PolarHBondContact O-N 2.99Å; V194-I196 PolarHBondContact O-N 3.44Å; V194-A197 WeakPolarHBondContact O-CB 3.28Å; V194-A197 PolarHBondContact O-N 3.46Å; V194-H198 WeakPolarHBondContact CG1-NE2 3.43Å; V194-H198 PolarHBondContact O-CD2 2.89Å; V194-H198 PolarHBondContact O-N 2.85Å |
| 195 | E | 98.5 | Very high | 98.2 | Very high | 58 Ų | 58 | 81 Ų | 81 | 27% | 0.271 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -54.3 | -53.5 | 179 | -62.4 | 169 | -179.3 | 0 | 0 | 110.5 | R191 R192 A197 H198 T199 | R191-E195 WeakPolarHBondContact CG-OE1 3.48Å; R191-E195 IonicContact CZ-OE1 3.58Å; R191-E195 IonicContact NE-OE1 2.99Å; R191-E195 PolarHBondContact NE-OE1 2.67Å; R191-E195 IonicContact NH2-OE1 3.46Å; R191-E195 PolarHBondContact NH2-OE1 2.9Å; R191-E195 PolarHBondContact O-N 3.41Å; R192-E195 WeakPolarHBondContact CD-OE2 3.31Å; R192-E195 IonicContact CZ-OE2 3.65Å; R192-E195 IonicContact NE-OE2 3.75Å; R192-E195 IonicContact NH1-OE2 2.8Å; R192-E195 PolarHBondContact NH1-OE2 3Å; R192-E195 PolarHBondContact O-N 2.92Å; E195-A197 PolarHBondContact O-N 3.21Å; E195-H198 PolarHBondContact O-N 3.11Å; E195-T199 PolarHBondContact O-N 3.47Å; E195-T199 PolarHBondContact O-OG1 2.9Å |
| 196 | I | 98.4 | Very high | 98.3 | Very high | 8 Ų | 8 | 80.1 Ų | 80.1 | 4% | 0.041 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 177.8 | -58.5 | 162.2 | 0 | 0 | 0 | 112.1 | L178 E181 L188 R192 V194 H198 T199 L200 I207 | L178-I196 HydrophobicContact CD2-CG2 4.18Å; E181-I196 HydrophobicContact CB-CD1 4.08Å; E181-I196 HydrophobicContact CG-CD1 3.73Å; E181-I196 HydrophobicContact CG-CG1 4.05Å; E181-I196 WeakPolarHBondContact OE2-CD1 3.32Å; L188-I196 HydrophobicContact CD1-CD1 3.67Å; L188-I196 HydrophobicContact CD2-CD1 3.64Å; L188-I196 HydrophobicContact CG-CD1 4.31Å; R192-I196 HydrophobicContact CG-CD1 3.91Å; R192-I196 HydrophobicContact CG-CG1 4.42Å; R192-I196 WeakPolarHBondContact O-CD1 3.48Å; R192-I196 VanDerWaalsContact O-CG1 3.31Å; R192-I196 WeakPolarHBondContact O-CG1 3.38Å; R192-I196 PolarHBondContact O-N 2.63Å; R192-I196 VanDerWaalsContact O-N 3.1Å; V194-I196 PolarHBondContact O-N 3.44Å; I196-H198 VanDerWaalsContact C-N 3.31Å; I196-H198 PolarHBondContact O-N 2.91Å; I196-T199 PolarHBondContact O-N 3.26Å; I196-L200 HydrophobicContact CG2-CD1 3.63Å; I196-L200 HydrophobicContact CG2-CG 4.1Å; I196-L200 WeakPolarHBondContact O-CB 3.4Å; I196-L200 WeakPolarHBondContact O-CG 3.5Å; I196-L200 PolarHBondContact O-N 3.18Å; I196-I207 HydrophobicContact CG2-CD1 3.91Å |
| 197 | A | 98.6 | Very high | 98.3 | Very high | 7 Ų | 7 | 76.2 Ų | 76.2 | 6% | 0.058 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -58 | -44.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | R193 V194 E195 C201 L202 E204 I207 | R193-A197 WeakPolarHBondContact O-CB 3.4Å; R193-A197 PolarHBondContact O-N 3.34Å; V194-A197 WeakPolarHBondContact O-CB 3.28Å; V194-A197 PolarHBondContact O-N 3.46Å; E195-A197 PolarHBondContact O-N 3.21Å; A197-C201 PolarHBondContact O-N 3.38Å; A197-L202 CarbonylContact C-O 3.46Å; A197-L202 VanDerWaalsContact CA-O 3.23Å; A197-L202 WeakPolarHBondContact CA-O 3.24Å; A197-L202 WeakPolarHBondContact CB-O 3.33Å; A197-L202 PolarHBondContact O-N 2.9Å; A197-L202 VanDerWaalsContact O-O 3.1Å; A197-E204 HydrophobicContact CB-CG 4.33Å; A197-I207 HydrophobicContact CB-CG1 4.1Å |
| 198 | H | 98.5 | Very high | 98.4 | Very high | 142 Ų | 142 | 75.3 Ų | 75.3 | 66% | 0.657 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -69.8 | -48.6 | 178.1 | -65.7 | -169.9 | 0 | 0 | 0 | 111.1 | V194 E195 I196 L200 C201 | V194-H198 WeakPolarHBondContact CG1-NE2 3.43Å; V194-H198 PolarHBondContact O-CD2 2.89Å; V194-H198 PolarHBondContact O-N 2.85Å; E195-H198 PolarHBondContact O-N 3.11Å; I196-H198 VanDerWaalsContact C-N 3.31Å; I196-H198 PolarHBondContact O-N 2.91Å; H198-L200 PolarHBondContact O-N 3.37Å; H198-C201 PolarHBondContact O-N 3.12Å |
| 199 | T | 98.1 | Very high | 98.4 | Very high | 107 Ų | 107 | 77 Ų | 77 | 66% | 0.656 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -60 | -30.4 | -179.8 | -57.4 | 0 | 0 | 0 | 0 | 113.6 | E195 I196 | E195-T199 PolarHBondContact O-N 3.47Å; E195-T199 PolarHBondContact O-OG1 2.9Å; I196-T199 PolarHBondContact O-N 3.26Å |
| 200 | L | 98.1 | Very high | 98.4 | Very high | 10 Ų | 10 | 74.3 Ų | 74.3 | 5% | 0.052 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.3 | 1.2 | -176.5 | -59.6 | -172.3 | 0 | 0 | 0 | 114.5 | Q174 E177 L178 I196 H198 L202 | Q174-L200 HydrophobicContact CG-CB 4.32Å; Q174-L200 PolarHBondContact NE2-O 3.07Å; E177-L200 HydrophobicContact CB-CD1 4.12Å; E177-L200 HydrophobicContact CB-CD2 3.73Å; E177-L200 HydrophobicContact CG-CD2 4.08Å; L178-L200 HydrophobicContact CD1-CD1 4.41Å; L178-L200 HydrophobicContact CD2-CD1 3.98Å; L178-L200 HydrophobicContact CG-CD1 3.72Å; I196-L200 HydrophobicContact CG2-CD1 3.63Å; I196-L200 HydrophobicContact CG2-CG 4.1Å; I196-L200 WeakPolarHBondContact O-CB 3.4Å; I196-L200 WeakPolarHBondContact O-CG 3.5Å; I196-L200 PolarHBondContact O-N 3.18Å; H198-L200 PolarHBondContact O-N 3.37Å; L200-L202 VanDerWaalsContact C-N 3.29Å; L200-L202 HydrophobicContact CB-CD1 4.24Å; L200-L202 HydrophobicContact CB-CG 4.23Å; L200-L202 PolarHBondContact O-N 3.16Å |
| 201 | C | 98.3 | Very high | 98.4 | Very high | 116 Ų | 116 | 67.7 Ų | 67.7 | 78% | 0.784 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52 | 44.9 | -172.3 | -60.7 | 0 | 0 | 0 | 0 | 112.9 | A197 H198 | A197-C201 PolarHBondContact O-N 3.38Å; H198-C201 PolarHBondContact O-N 3.12Å |
| 202 | L | 97.9 | Very high | 98.4 | Very high | 15 Ų | 15 | 62.8 Ų | 62.8 | 8% | 0.079 | 31% | 0.307 | C | S | . | . | trans | -125.5 | 141.1 | -179.6 | -69.4 | -179 | 0 | 0 | 0 | 110.7 | Y170 Q174 L178 A197 L200 Q206 I207 | Y170-L202 HydrophobicContact CD1-CD1 3.92Å; Y170-L202 HydrophobicContact CD1-CD2 3.84Å; Y170-L202 HydrophobicContact CE1-CD1 3.89Å; Y170-L202 HydrophobicContact CE1-CD2 3.67Å; Y170-L202 HydrophobicContact CE1-CG 4.45Å; Q174-L202 HydrophobicContact CG-CD1 4.41Å; L178-L202 HydrophobicContact CD1-CD1 4.23Å; A197-L202 CarbonylContact C-O 3.46Å; A197-L202 VanDerWaalsContact CA-O 3.23Å; A197-L202 WeakPolarHBondContact CA-O 3.24Å; A197-L202 WeakPolarHBondContact CB-O 3.33Å; A197-L202 PolarHBondContact O-N 2.9Å; A197-L202 VanDerWaalsContact O-O 3.1Å; L200-L202 VanDerWaalsContact C-N 3.29Å; L200-L202 HydrophobicContact CB-CD1 4.24Å; L200-L202 HydrophobicContact CB-CG 4.23Å; L200-L202 PolarHBondContact O-N 3.16Å; L202-Q206 HydrophobicContact CB-CB 4.41Å; L202-I207 HydrophobicContact CB-CD1 3.86Å; L202-I207 HydrophobicContact CB-CG1 4.43Å; L202-I207 HydrophobicContact CD1-CD1 4.01Å | ||
| 203 | S | 98.5 | Very high | 98.4 | Very high | 58 Ų | 58 | 63.4 Ų | 63.4 | 41% | 0.406 | 32% | 0.317 | S | S | . | . | trans | -63 | 148 | 174.4 | 67.1 | 0 | 0 | 0 | 0 | 111.8 | R205 Q206 I207 | S203-R205 PolarHBondContact O-N 3.11Å; S203-Q206 WeakPolarHBondContact O-CA 3.4Å; S203-Q206 WeakPolarHBondContact O-CB 3.46Å; S203-Q206 PolarHBondContact O-N 3.35Å; S203-Q206 WeakPolarHBondContact OG-CG 3.24Å; S203-Q206 PolarHBondContact OG-N 3.29Å; S203-Q206 PolarHBondContact OG-OE1 3.04Å; S203-I207 PolarHBondContact O-N 2.9Å; S203-I207 VanDerWaalsContact O-N 3.09Å | ||
| 204 | E | 98.4 | Very high | 98.4 | Very high | 54 Ų | 54 | 62.6 Ų | 62.6 | 25% | 0.252 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -49.1 | -33.6 | 171.1 | -84.3 | -162 | -127.7 | 0 | 0 | 113.3 | R190 R193 A197 I207 K208 | R190-E204 IonicContact CZ-OE1 2.74Å; R190-E204 IonicContact CZ-OE2 3.52Å; R190-E204 VanDerWaalsContact CZ-OE2 3.3Å; R190-E204 IonicContact NH1-OE1 3.09Å; R190-E204 PolarHBondContact NH1-OE1 2.85Å; R190-E204 IonicContact NH1-OE2 3.93Å; R190-E204 PolarHBondContact NH1-OE2 3.42Å; R190-E204 IonicContact NH2-OE1 3.66Å; R190-E204 PolarHBondContact NH2-OE1 3.28Å; R190-E204 IonicContact NH2-OE2 2.7Å; R193-E204 WeakPolarHBondContact CD-O 3.45Å; R193-E204 WeakPolarHBondContact CD-OE2 3.34Å; R193-E204 HydrophobicContact CG-CB 4.49Å; R193-E204 HydrophobicContact CG-CG 4.21Å; R193-E204 IonicContact CZ-OE2 3.01Å; R193-E204 IonicContact NH1-OE2 3.3Å; R193-E204 PolarHBondContact NH1-OE2 2.86Å; A197-E204 HydrophobicContact CB-CG 4.33Å; E204-I207 PolarHBondContact O-N 3.36Å; E204-K208 VanDerWaalsContact O-CB 3.32Å; E204-K208 WeakPolarHBondContact O-CB 3.36Å; E204-K208 PolarHBondContact O-N 2.89Å |
| 205 | R | 97.9 | Very high | 98.3 | Very high | 183 Ų | 183 | 63.3 Ų | 63.3 | 69% | 0.691 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -66.3 | -41.4 | 177.9 | -172.8 | 176.4 | -178.9 | -82.7 | -0.5 | 111.5 | S203 K208 I209 | S203-R205 PolarHBondContact O-N 3.11Å; R205-K208 PolarHBondContact O-N 3.07Å; R205-I209 HydrophobicContact CG-CD1 3.93Å; R205-I209 WeakPolarHBondContact O-CB 3.33Å; R205-I209 WeakPolarHBondContact O-CD1 3.42Å; R205-I209 VanDerWaalsContact O-CG1 3.23Å; R205-I209 WeakPolarHBondContact O-CG1 3.42Å; R205-I209 PolarHBondContact O-N 3.24Å |
| 206 | Q | 98.3 | Very high | 98.3 | Very high | 56 Ų | 56 | 65.3 Ų | 65.3 | 26% | 0.262 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.6 | -46.2 | 173 | -75.4 | 158.3 | -65.5 | 0 | 0 | 110.9 | Y170 L202 S203 K208 I209 W210 | Y170-Q206 HydrophobicContact CE1-CB 4.46Å; Y170-Q206 WeakPolarHBondContact OH-CB 3.44Å; L202-Q206 HydrophobicContact CB-CB 4.41Å; S203-Q206 WeakPolarHBondContact O-CA 3.4Å; S203-Q206 WeakPolarHBondContact O-CB 3.46Å; S203-Q206 PolarHBondContact O-N 3.35Å; S203-Q206 WeakPolarHBondContact OG-CG 3.24Å; S203-Q206 PolarHBondContact OG-N 3.29Å; S203-Q206 PolarHBondContact OG-OE1 3.04Å; Q206-K208 PolarHBondContact O-N 3.47Å; Q206-I209 PolarHBondContact O-N 2.94Å; Q206-W210 WeakPolarHBondContact O-CB 3.27Å; Q206-W210 PolarHBondContact O-N 3.09Å |
| 207 | I | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 70.6 Ų | 70.6 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -58.2 | -48.4 | 175.7 | -52.9 | -60.1 | 0 | 0 | 0 | 111 | L178 L188 R193 I196 A197 L202 S203 E204 I209 W210 F211 | L178-I207 HydrophobicContact CD2-CD1 3.85Å; L188-I207 HydrophobicContact CD1-CG2 3.46Å; L188-I207 VanDerWaalsContact CD1-CG2 3.46Å; R193-I207 HydrophobicContact CG-CB 3.93Å; R193-I207 HydrophobicContact CG-CG2 3.7Å; I196-I207 HydrophobicContact CG2-CD1 3.91Å; A197-I207 HydrophobicContact CB-CG1 4.1Å; L202-I207 HydrophobicContact CB-CD1 3.86Å; L202-I207 HydrophobicContact CB-CG1 4.43Å; L202-I207 HydrophobicContact CD1-CD1 4.01Å; S203-I207 PolarHBondContact O-N 2.9Å; S203-I207 VanDerWaalsContact O-N 3.09Å; E204-I207 PolarHBondContact O-N 3.36Å; I207-I209 PolarHBondContact O-N 3.41Å; I207-W210 PolarHBondContact O-N 3.33Å; I207-F211 HydrophobicContact CG2-CD2 4.11Å; I207-F211 HydrophobicContact CG2-CE2 4.39Å; I207-F211 PolarHBondContact O-N 3.17Å |
| 208 | K | 98.3 | Very high | 98 | Very high | 132 Ų | 132 | 74.3 Ų | 74.3 | 57% | 0.574 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -58.9 | -44.9 | 177.7 | -177.4 | -177.2 | 177.9 | -177.1 | 0 | 112.1 | E204 R205 Q206 Q212 | E204-K208 VanDerWaalsContact O-CB 3.32Å; E204-K208 WeakPolarHBondContact O-CB 3.36Å; E204-K208 PolarHBondContact O-N 2.89Å; R205-K208 PolarHBondContact O-N 3.07Å; Q206-K208 PolarHBondContact O-N 3.47Å; K208-Q212 WeakPolarHBondContact O-CB 3.33Å; K208-Q212 PolarHBondContact O-N 3.04Å |
| 209 | I | 98.4 | Very high | 97.9 | Very high | 66 Ų | 66 | 72.8 Ų | 72.8 | 34% | 0.338 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -67.8 | -43 | 179.1 | -71.2 | 168 | 0 | 0 | 0 | 110.8 | R205 Q206 I207 F211 Q212 N213 | R205-I209 HydrophobicContact CG-CD1 3.93Å; R205-I209 WeakPolarHBondContact O-CB 3.33Å; R205-I209 WeakPolarHBondContact O-CD1 3.42Å; R205-I209 VanDerWaalsContact O-CG1 3.23Å; R205-I209 WeakPolarHBondContact O-CG1 3.42Å; R205-I209 PolarHBondContact O-N 3.24Å; Q206-I209 PolarHBondContact O-N 2.94Å; I207-I209 PolarHBondContact O-N 3.41Å; I209-F211 PolarHBondContact O-N 3.17Å; I209-Q212 PolarHBondContact O-N 3.13Å; I209-N213 VanDerWaalsContact O-CG 3.26Å; I209-N213 PolarHBondContact O-N 3.02Å |
| 210 | W | 98.5 | Very high | 97.7 | Very high | 31 Ų | 31 | 74.9 Ų | 74.9 | 12% | 0.117 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61 | -46.7 | 177.4 | -169.5 | 104.9 | 0 | 0 | 0 | 111 | Y170 L178 E179 F182 Q206 I207 Q212 N213 R214 | Y170-W210 AromaticContact CE2-CD1 3.81Å; L178-W210 VanDerWaalsContact C-CH2 3.45Å; L178-W210 HydrophobicContact CB-CD2 3.93Å; L178-W210 HydrophobicContact CB-CE3 3.99Å; L178-W210 HydrophobicContact CB-CH2 3.72Å; L178-W210 HydrophobicContact CB-CZ2 3.62Å; L178-W210 HydrophobicContact CB-CZ3 3.89Å; L178-W210 HydrophobicContact CD1-CD2 3.97Å; L178-W210 HydrophobicContact CD1-CG 3.88Å; L178-W210 HydrophobicContact CD2-CD2 4.35Å; L178-W210 HydrophobicContact CD2-CE3 4.27Å; L178-W210 HydrophobicContact CG-CD2 4.31Å; L178-W210 WeakPolarHBondContact O-CH2 3.33Å; L178-W210 WeakPolarHBondContact O-CZ3 3.32Å; E179-W210 HydrophobicContact CG-CH2 3.87Å; E179-W210 HydrophobicContact CG-CZ2 3.84Å; F182-W210 HydrophobicContact CB-CH2 4.23Å; F182-W210 HydrophobicContact CB-CZ3 4.01Å; F182-W210 HydrophobicContact CG-CZ3 4.44Å; Q206-W210 WeakPolarHBondContact O-CB 3.27Å; Q206-W210 PolarHBondContact O-N 3.09Å; I207-W210 PolarHBondContact O-N 3.33Å; W210-Q212 VanDerWaalsContact C-N 3.3Å; W210-Q212 PolarHBondContact O-N 3.25Å; W210-N213 PolarHBondContact O-N 3.34Å; W210-R214 HydrophobicContact CD2-CB 4.47Å; W210-R214 HydrophobicContact CE3-CB 3.9Å; W210-R214 HydrophobicContact CE3-CG 4.48Å; W210-R214 HydrophobicContact CH2-CB 3.88Å; W210-R214 HydrophobicContact CH2-CG 3.58Å; W210-R214 HydrophobicContact CZ2-CB 4.47Å; W210-R214 HydrophobicContact CZ2-CG 4.34Å; W210-R214 HydrophobicContact CZ3-CB 3.57Å; W210-R214 HydrophobicContact CZ3-CG 3.67Å; W210-R214 WeakPolarHBondContact O-CB 3.37Å; W210-R214 PolarHBondContact O-N 2.86Å |
| 211 | F | 98.7 | Very high | 97.3 | Very high | 7 Ų | 7 | 78.3 Ų | 78.3 | 3% | 0.031 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -67.5 | -25.1 | 176.3 | -91.3 | -100.5 | 0 | 0 | 0 | 113.9 | L178 E181 F182 L188 I207 I209 R215 | L178-F211 HydrophobicContact CD2-CD2 4.5Å; L178-F211 HydrophobicContact CD2-CE2 3.96Å; E181-F211 HydrophobicContact CB-CZ 4.03Å; F182-F211 HydrophobicContact CB-CE1 4.05Å; F182-F211 HydrophobicContact CB-CZ 4.14Å; F182-F211 AromaticContact CD2-CD1 3.99Å; F182-F211 HydrophobicContact CD2-CD1 3.99Å; F182-F211 AromaticContact CD2-CE1 3.87Å; F182-F211 HydrophobicContact CD2-CE1 3.87Å; F182-F211 HydrophobicContact CG-CE1 4.48Å; L188-F211 HydrophobicContact CD1-CD1 4.24Å; L188-F211 HydrophobicContact CD1-CD2 3.63Å; L188-F211 HydrophobicContact CD1-CE1 4.12Å; L188-F211 HydrophobicContact CD1-CE2 3.53Å; L188-F211 HydrophobicContact CD1-CG 4.02Å; L188-F211 HydrophobicContact CD1-CZ 3.78Å; L188-F211 HydrophobicContact CD2-CE1 3.87Å; L188-F211 HydrophobicContact CD2-CE2 4.42Å; L188-F211 HydrophobicContact CD2-CZ 3.81Å; L188-F211 HydrophobicContact CG-CD1 3.86Å; L188-F211 HydrophobicContact CG-CD2 4.18Å; L188-F211 HydrophobicContact CG-CE1 3.65Å; L188-F211 HydrophobicContact CG-CE2 4.02Å; L188-F211 HydrophobicContact CG-CG 4.11Å; L188-F211 HydrophobicContact CG-CZ 3.76Å; I207-F211 HydrophobicContact CG2-CD2 4.11Å; I207-F211 HydrophobicContact CG2-CE2 4.39Å; I207-F211 PolarHBondContact O-N 3.17Å; I209-F211 PolarHBondContact O-N 3.17Å; F211-R215 WeakPolarHBondContact O-CB 3.46Å; F211-R215 WeakPolarHBondContact O-CG 3.49Å; F211-R215 PolarHBondContact O-N 2.92Å; F211-R215 PolarHBondContact O-NE 2.88Å |
| 212 | Q | 98.6 | Very high | 96.7 | Very high | 88 Ų | 88 | 78.7 Ų | 78.7 | 41% | 0.411 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -70.9 | -48.1 | 169.3 | -172.8 | 64 | 40.5 | 0 | 0 | 110.8 | K208 I209 W210 R215 M216 | K208-Q212 WeakPolarHBondContact O-CB 3.33Å; K208-Q212 PolarHBondContact O-N 3.04Å; I209-Q212 PolarHBondContact O-N 3.13Å; W210-Q212 VanDerWaalsContact C-N 3.3Å; W210-Q212 PolarHBondContact O-N 3.25Å; Q212-R215 PolarHBondContact O-N 3.3Å; Q212-M216 WeakPolarHBondContact O-CG 3.01Å; Q212-M216 PolarHBondContact O-N 2.93Å |
| 213 | N | 98.2 | Very high | 95.3 | Very high | 101 Ų | 101 | 85.6 Ų | 85.6 | 54% | 0.54 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 178.9 | -67 | -11.1 | 0 | 0 | 0 | 111.8 | I209 W210 R215 M216 K217 | I209-N213 VanDerWaalsContact O-CG 3.26Å; I209-N213 PolarHBondContact O-N 3.02Å; W210-N213 PolarHBondContact O-N 3.34Å; N213-R215 PolarHBondContact O-N 3.12Å; N213-M216 PolarHBondContact O-N 2.75Å; N213-K217 PolarHBondContact O-N 3.08Å |
| 214 | R | 98.3 | Very high | 93.5 | Very high | 35 Ų | 35 | 88.8 Ų | 88.8 | 13% | 0.132 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -65.7 | -38.4 | 179.5 | -168.5 | 66.7 | -179.5 | 88.9 | -10.7 | 112.4 | E179 F182 W210 W218 | E179-R214 IonicContact OE1-CZ 3.29Å; E179-R214 VanDerWaalsContact OE1-CZ 3.29Å; E179-R214 IonicContact OE1-NE 2.82Å; E179-R214 PolarHBondContact OE1-NE 3.03Å; E179-R214 IonicContact OE1-NH2 3.8Å; E179-R214 PolarHBondContact OE1-NH2 3.24Å; F182-R214 HydrophobicContact CB-CG 4.39Å; F182-R214 HydrophobicContact CD1-CG 3.6Å; F182-R214 HydrophobicContact CD2-CB 4.2Å; F182-R214 HydrophobicContact CD2-CG 3.74Å; F182-R214 HydrophobicContact CE1-CG 3.72Å; F182-R214 HydrophobicContact CE2-CB 4.23Å; F182-R214 HydrophobicContact CE2-CG 3.87Å; F182-R214 HydrophobicContact CG-CG 3.62Å; F182-R214 HydrophobicContact CZ-CG 3.85Å; W210-R214 HydrophobicContact CD2-CB 4.47Å; W210-R214 HydrophobicContact CE3-CB 3.9Å; W210-R214 HydrophobicContact CE3-CG 4.48Å; W210-R214 HydrophobicContact CH2-CB 3.88Å; W210-R214 HydrophobicContact CH2-CG 3.58Å; W210-R214 HydrophobicContact CZ2-CB 4.47Å; W210-R214 HydrophobicContact CZ2-CG 4.34Å; W210-R214 HydrophobicContact CZ3-CB 3.57Å; W210-R214 HydrophobicContact CZ3-CG 3.67Å; W210-R214 WeakPolarHBondContact O-CB 3.37Å; W210-R214 PolarHBondContact O-N 2.86Å; R214-W218 VanDerWaalsContact O-CB 3.24Å; R214-W218 WeakPolarHBondContact O-CB 3.49Å; R214-W218 PolarHBondContact O-N 3.36Å |
| 215 | R | 97.9 | Very high | 91.8 | Very high | 55 Ų | 55 | 92 Ų | 92 | 21% | 0.208 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -65.7 | -38.9 | 170.8 | -78.2 | -178.2 | -71.1 | 136.9 | 6.5 | 112.5 | F182 R186 F211 Q212 N213 W218 K219 | F182-R215 HydrophobicContact CE2-CG 3.74Å; F182-R215 HydrophobicContact CZ-CG 4.33Å; R186-R215 VanDerWaalsContact O-CD 3.31Å; R186-R215 WeakPolarHBondContact O-CD 3.45Å; F211-R215 WeakPolarHBondContact O-CB 3.46Å; F211-R215 WeakPolarHBondContact O-CG 3.49Å; F211-R215 PolarHBondContact O-N 2.92Å; F211-R215 PolarHBondContact O-NE 2.88Å; Q212-R215 PolarHBondContact O-N 3.3Å; N213-R215 PolarHBondContact O-N 3.12Å; R215-W218 PolarHBondContact O-N 2.75Å; R215-K219 WeakPolarHBondContact O-CB 3.16Å; R215-K219 PolarHBondContact O-N 3.18Å |
| 216 | M | 97.8 | Very high | 89.5 | Confident | 101 Ų | 101 | 90 Ų | 90 | 50% | 0.498 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -67.4 | -41.2 | 176.8 | -70.7 | -68.3 | -89.1 | 0 | 0 | 112 | Q212 N213 K219 K220 | Q212-M216 WeakPolarHBondContact O-CG 3.01Å; Q212-M216 PolarHBondContact O-N 2.93Å; N213-M216 PolarHBondContact O-N 2.75Å; M216-K219 PolarHBondContact O-N 3.06Å; M216-K220 PolarHBondContact O-N 2.88Å; M216-K220 VanDerWaalsContact O-N 3.11Å |
| 217 | K | 96.3 | Very high | 87.3 | Confident | 119 Ų | 119 | 93.4 Ų | 93.4 | 52% | 0.517 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.6 | -54 | 169.8 | 176.6 | 174.9 | 177.5 | -172.5 | 0 | 110.9 | N213 K219 K220 D221 | N213-K217 PolarHBondContact O-N 3.08Å; K217-K219 VanDerWaalsContact C-N 3.25Å; K217-K219 PolarHBondContact O-N 2.82Å; K217-K220 WeakPolarHBondContact O-CA 3.2Å; K217-K220 WeakPolarHBondContact O-CB 3.21Å; K217-K220 PolarHBondContact O-N 2.79Å; K217-D221 VanDerWaalsContact CE-OD2 3.27Å; K217-D221 WeakPolarHBondContact CE-OD2 3.4Å; K217-D221 VanDerWaalsContact CG-OD2 3.24Å; K217-D221 WeakPolarHBondContact CG-OD2 3.37Å; K217-D221 PolarHBondContact O-N 2.91Å |
| 218 | W | 95.4 | Very high | 85.2 | Confident | 85 Ų | 85 | 102.4 Ų | 102.4 | 32% | 0.322 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -55 | -39.7 | 178.2 | -177.4 | 80.3 | 0 | 0 | 0 | 112.5 | F182 R186 R214 R215 D221 H222 | F182-W218 HydrophobicContact CE1-CB 4.19Å; F182-W218 HydrophobicContact CE1-CG 4.2Å; F182-W218 HydrophobicContact CZ-CB 3.88Å; F182-W218 HydrophobicContact CZ-CG 4.04Å; R186-W218 VanDerWaalsContact NE-CE2 3.33Å; R214-W218 VanDerWaalsContact O-CB 3.24Å; R214-W218 WeakPolarHBondContact O-CB 3.49Å; R214-W218 PolarHBondContact O-N 3.36Å; R215-W218 PolarHBondContact O-N 2.75Å; W218-D221 PolarHBondContact O-N 3.12Å; W218-H222 AromaticContact CD1-CD2 3.28Å; W218-H222 AromaticContact CD1-NE2 3.38Å; W218-H222 AromaticContact CE2-CD2 3.59Å; W218-H222 AromaticContact CE2-CG 3.86Å; W218-H222 AromaticContact CE2-NE2 3.91Å; W218-H222 AromaticContact CG-CD2 3.9Å; W218-H222 HydrophobicContact CZ2-CB 4.35Å; W218-H222 AromaticContact NE1-CD2 3.03Å; W218-H222 PolarHBondContact NE1-CD2 2.57Å; W218-H222 AromaticContact NE1-CE1 3.67Å; W218-H222 AromaticContact NE1-CG 3.7Å; W218-H222 AromaticContact NE1-NE2 2.98Å; W218-H222 PolarHBondContact NE1-NE2 2.95Å; W218-H222 WeakPolarHBondContact O-CB 3.29Å; W218-H222 PolarHBondContact O-CD2 3.32Å; W218-H222 PolarHBondContact O-N 3.4Å |
| 219 | K | 94.9 | Very high | 83.1 | Confident | 110 Ų | 110 | 102.3 Ų | 102.3 | 48% | 0.478 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.2 | -44.6 | 173.1 | -172.6 | -178 | 71.2 | 169.8 | 0 | 111.8 | R215 M216 K217 K223 | R215-K219 WeakPolarHBondContact O-CB 3.16Å; R215-K219 PolarHBondContact O-N 3.18Å; M216-K219 PolarHBondContact O-N 3.06Å; K217-K219 VanDerWaalsContact C-N 3.25Å; K217-K219 PolarHBondContact O-N 2.82Å; K219-K223 HydrophobicContact CG-CG 4.01Å; K219-K223 WeakPolarHBondContact O-CB 3.08Å; K219-K223 WeakPolarHBondContact O-CG 3.47Å; K219-K223 PolarHBondContact O-N 3.43Å; K219-K223 VanDerWaalsContact O-N 3.16Å |
| 220 | K | 94.2 | Very high | 80.8 | Confident | 150 Ų | 150 | 110.9 Ų | 110.9 | 65% | 0.652 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63 | -49.4 | 176.6 | -174.3 | 176.8 | 179 | 178.4 | 0 | 110.9 | M216 K217 H222 K223 | M216-K220 PolarHBondContact O-N 2.88Å; M216-K220 VanDerWaalsContact O-N 3.11Å; K217-K220 WeakPolarHBondContact O-CA 3.2Å; K217-K220 WeakPolarHBondContact O-CB 3.21Å; K217-K220 PolarHBondContact O-N 2.79Å; K220-H222 VanDerWaalsContact C-N 3.31Å; K220-H222 PolarHBondContact O-N 2.97Å; K220-K223 PolarHBondContact O-N 3.04Å |
| 221 | D | 90 | Very high | 78.5 | Confident | 83 Ų | 83 | 114.4 Ų | 114.4 | 44% | 0.444 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.5 | -34.9 | -176.1 | -56 | -12.8 | 0 | 0 | 0 | 112.2 | K217 W218 | K217-D221 VanDerWaalsContact CE-OD2 3.27Å; K217-D221 WeakPolarHBondContact CE-OD2 3.4Å; K217-D221 VanDerWaalsContact CG-OD2 3.24Å; K217-D221 WeakPolarHBondContact CG-OD2 3.37Å; K217-D221 PolarHBondContact O-N 2.91Å; W218-D221 PolarHBondContact O-N 3.12Å |
| 222 | H | 84.6 | Confident | 75.9 | Confident | 124 Ų | 124 | 117.8 Ų | 117.8 | 57% | 0.574 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | 10.2 | -177.9 | -70.7 | -99.4 | 0 | 0 | 0 | 115.1 | W218 K220 | W218-H222 AromaticContact CD1-CD2 3.28Å; W218-H222 AromaticContact CD1-NE2 3.38Å; W218-H222 AromaticContact CE2-CD2 3.59Å; W218-H222 AromaticContact CE2-CG 3.86Å; W218-H222 AromaticContact CE2-NE2 3.91Å; W218-H222 AromaticContact CG-CD2 3.9Å; W218-H222 HydrophobicContact CZ2-CB 4.35Å; W218-H222 AromaticContact NE1-CD2 3.03Å; W218-H222 PolarHBondContact NE1-CD2 2.57Å; W218-H222 AromaticContact NE1-CE1 3.67Å; W218-H222 AromaticContact NE1-CG 3.7Å; W218-H222 AromaticContact NE1-NE2 2.98Å; W218-H222 PolarHBondContact NE1-NE2 2.95Å; W218-H222 WeakPolarHBondContact O-CB 3.29Å; W218-H222 PolarHBondContact O-CD2 3.32Å; W218-H222 PolarHBondContact O-N 3.4Å; K220-H222 VanDerWaalsContact C-N 3.31Å; K220-H222 PolarHBondContact O-N 2.97Å |
| 223 | K | 69.6 | Low | 73.2 | Confident | 159 Ų | 159 | 118.9 Ų | 118.9 | 69% | 0.691 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -107.1 | -1.8 | 175 | -73.6 | -72.7 | 169.5 | -162.4 | 0 | 114.6 | K219 K220 P225 | K219-K223 HydrophobicContact CG-CG 4.01Å; K219-K223 WeakPolarHBondContact O-CB 3.08Å; K219-K223 WeakPolarHBondContact O-CG 3.47Å; K219-K223 PolarHBondContact O-N 3.43Å; K219-K223 VanDerWaalsContact O-N 3.16Å; K220-K223 PolarHBondContact O-N 3.04Å; K223-P225 WeakPolarHBondContact O-CD 3.27Å |
| 224 | L | 59.7 | Low | 70.9 | Confident | 125 Ų | 125 | 122 Ų | 122 | 65% | 0.654 | 63% | 0.626 | S | S | * | * | trans | -104 | 92.9 | 173.8 | -69.3 | 167.5 | 0 | 0 | 0 | 109.7 | ||||
| 225 | P | 63.4 | Low | 68.1 | Low | 122 Ų | 122 | 124.1 Ų | 124.1 | 79% | 0.792 | 65% | 0.646 | S | S | * | * | trans | -65.7 | 136 | 165.7 | 29.3 | -33.1 | 0 | 0 | 0 | 109.6 | K223 | K223-P225 WeakPolarHBondContact O-CD 3.27Š| ||
| 226 | N | 49.7 | Very low | 65.7 | Low | 142 Ų | 142 | 129.2 Ų | 129.2 | 76% | 0.759 | 68% | 0.676 | S | S | * | * | trans | 59.9 | 78.8 | 169.4 | -167.9 | 28.8 | 0 | 0 | 0 | 118.6 | ||||
| 227 | T | 52.3 | Low | 62.8 | Low | 126 Ų | 126 | 129.8 Ų | 129.8 | 77% | 0.773 | 69% | 0.69 | S | S | * | * | trans | -134.6 | 89 | 132 | 45.8 | 0 | 0 | 0 | 0 | 110.5 | V229 | T227-V229 PolarHBondContact O-N 3.3Š| ||
| 228 | K | 54.3 | Low | 60.1 | Low | 189 Ų | 189 | 129.3 Ų | 129.3 | 82% | 0.822 | 70% | 0.702 | S | S | * | * | trans | -72.1 | 36 | -178 | 177.4 | 55.9 | -176.7 | -167.9 | 0 | 113.7 | ||||
| 229 | V | 54 | Low | 57.4 | Low | 130 Ų | 130 | 130.6 Ų | 130.6 | 79% | 0.788 | 72% | 0.724 | S | S | * | * | trans | -137.8 | 48.1 | -171.3 | -155.1 | 0 | 0 | 0 | 0 | 114.7 | T227 | T227-V229 PolarHBondContact O-N 3.3Š| ||
| 230 | R | 50.8 | Low | 54.8 | Low | 246 Ų | 246 | 133.5 Ų | 133.5 | 93% | 0.928 | 74% | 0.739 | S | S | * | * | trans | -162.3 | 43.3 | 150.6 | -116.8 | 170.8 | -168.7 | -128.4 | -0.5 | 116.7 | G232 | R230-G232 VanDerWaalsContact C-N 3.35Å; R230-G232 PolarHBondContact O-N 3.26Å | ||
| 231 | S | 49.3 | Very low | 52 | Low | 106 Ų | 106 | 132 Ų | 132 | 74% | 0.741 | 74% | 0.743 | S | S | * | * | trans | -78.3 | 89.1 | 154.6 | -63.5 | 0 | 0 | 0 | 0 | 108.5 | T233 | S231-T233 PolarHBondContact O-N 3.46Š| ||
| 232 | G | 43.9 | Very low | 49.5 | Very low | 78 Ų | 78 | 134.6 Ų | 134.6 | 80% | 0.804 | 76% | 0.761 | S | S | * | * | trans | -74.2 | 67.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | R230 N234 | R230-G232 VanDerWaalsContact C-N 3.35Å; R230-G232 PolarHBondContact O-N 3.26Å; G232-N234 PolarHBondContact O-N 2.64Å | ||
| 233 | T | 43.3 | Very low | 47.1 | Very low | 110 Ų | 110 | 133.6 Ų | 133.6 | 68% | 0.675 | 77% | 0.768 | S | S | * | * | trans | -75.2 | 106.7 | 174.9 | -51.9 | 0 | 0 | 0 | 0 | 109.3 | S231 S235 | S231-T233 PolarHBondContact O-N 3.46Å; T233-S235 WeakPolarHBondContact CG2-OG 3.33Å; T233-S235 PolarHBondContact O-N 3.4Å; T233-S235 VanDerWaalsContact O-N 3.12Å | ||
| 234 | N | 48.3 | Very low | 45.5 | Very low | 167 Ų | 167 | 130.4 Ų | 130.4 | 89% | 0.893 | 77% | 0.771 | S | S | * | * | trans | -82.8 | 83.5 | 174.2 | -160.1 | 33.4 | 0 | 0 | 0 | 109.6 | G232 | G232-N234 PolarHBondContact O-N 2.64Š| ||
| 235 | S | 40.1 | Very low | 44.4 | Very low | 79 Ų | 79 | 129.4 Ų | 129.4 | 55% | 0.552 | 78% | 0.775 | S | S | * | * | trans | -137.3 | 95.2 | 179.2 | 59.8 | 0 | 0 | 0 | 0 | 111 | T233 S237 | T233-S235 WeakPolarHBondContact CG2-OG 3.33Å; T233-S235 PolarHBondContact O-N 3.4Å; T233-S235 VanDerWaalsContact O-N 3.12Å; S235-S237 PolarHBondContact O-N 3.41Å | ||
| 236 | I | 47.2 | Very low | 43.3 | Very low | 162 Ų | 162 | 132.3 Ų | 132.3 | 83% | 0.831 | 78% | 0.778 | S | S | * | * | trans | -69.1 | 118.5 | 167.9 | -76 | 162.2 | 0 | 0 | 0 | 108.3 | ||||
| 237 | S | 38.1 | Very low | 42.7 | Very low | 113 Ų | 113 | 132.2 Ų | 132.2 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | trans | -158.5 | 91.6 | 172.9 | -69.4 | 0 | 0 | 0 | 0 | 108.8 | S235 | S235-S237 PolarHBondContact O-N 3.41Š| ||
| 238 | S | 39.8 | Very low | 41.9 | Very low | 110 Ų | 110 | 137.1 Ų | 137.1 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | -89.7 | 118.8 | -179.4 | 50.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 239 | S | 38.6 | Very low | 41.2 | Very low | 112 Ų | 112 | 133.6 Ų | 133.6 | 78% | 0.783 | 78% | 0.781 | S | S | * | * | trans | -162 | 120.2 | 159.1 | -92 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 240 | Q | 39.2 | Very low | 40.8 | Very low | 170 Ų | 170 | 133.5 Ų | 133.5 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | 21.7 | 118.6 | 134.5 | -66 | 175.3 | 60.4 | 0 | 0 | 117.8 | ||||
| 241 | T | 34.8 | Very low | 40.1 | Very low | 120 Ų | 120 | 125.2 Ų | 125.2 | 74% | 0.736 | 78% | 0.777 | S | S | * | * | 50 | 120.2 | 83 | 65.5 | 0 | 0 | 0 | 0 | 113 | |||||
| 242 | V | 39 | Very low | 40.2 | Very low | 136 Ų | 136 | 126 Ų | 126 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | cis | -138.9 | -161.6 | 16.1 | -66.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 243 | S | 33.7 | Very low | 40.1 | Very low | 104 Ų | 104 | 130.2 Ų | 130.2 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | cis | -158.2 | 162.5 | 6.2 | 42.3 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 244 | A | 36.7 | Very low | 40.1 | Very low | 91 Ų | 91 | 135.5 Ų | 135.5 | 75% | 0.752 | 79% | 0.792 | S | S | * | * | trans | 26.9 | 150.2 | 145.7 | 0 | 0 | 0 | 0 | 0 | 125.7 | ||||
| 245 | S | 35.2 | Very low | 39.9 | Very low | 105 Ų | 105 | 137 Ų | 137 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | trans | 95.1 | 106.9 | 146.9 | -59.9 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 246 | Q | 40.9 | Very low | 40.3 | Very low | 182 Ų | 182 | 142.2 Ų | 142.2 | 85% | 0.85 | 80% | 0.798 | S | S | * | * | trans | 40.6 | 130.1 | 133.6 | -51.9 | -177 | 19.4 | 0 | 0 | 119.4 | ||||
| 247 | N | 36.2 | Very low | 40.1 | Very low | 141 Ų | 141 | 141.7 Ų | 141.7 | 75% | 0.754 | 79% | 0.791 | S | S | * | * | -160.8 | -174.7 | 71.2 | -150.2 | -16 | 0 | 0 | 0 | 114.3 | |||||
| 248 | R | 37.5 | Very low | 40.6 | Very low | 228 Ų | 228 | 145.1 Ų | 145.1 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -79.5 | 179.3 | -177.5 | -50.8 | 154.2 | -178.6 | -127.1 | -0.9 | 111.1 | ||||
| 249 | S | 39.3 | Very low | 41 | Very low | 116 Ų | 116 | 145.7 Ų | 145.7 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | cis | -155.5 | 155.5 | 12.1 | 34.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 250 | S | 43.9 | Very low | 41.1 | Very low | 128 Ų | 128 | 145.3 Ų | 145.3 | 90% | 0.895 | 80% | 0.796 | S | S | * | * | trans | -77.3 | 141 | 172.6 | -51.4 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 251 | G | 36.3 | Very low | 41.7 | Very low | 71 Ų | 71 | 142.9 Ų | 142.9 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | trans | -117.8 | 138.2 | 168.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 252 | P | 52.3 | Low | 42.5 | Very low | 122 Ų | 122 | 148.8 Ų | 148.8 | 79% | 0.792 | 82% | 0.819 | S | S | * | * | trans | -83 | 159.1 | -168.8 | 32.3 | -36.1 | 0 | 0 | 0 | 115.2 | ||||
| 253 | L | 42.4 | Very low | 42.6 | Very low | 167 Ų | 167 | 149.5 Ų | 149.5 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | -89 | 111.8 | -173.8 | -165.4 | 91 | 0 | 0 | 0 | 112.1 | R255 | L253-R255 PolarHBondContact O-N 2.97Å; L253-R255 VanDerWaalsContact O-N 3.11Å | ||
| 254 | Y | 42.8 | Very low | 43.1 | Very low | 222 Ų | 222 | 151.8 Ų | 151.8 | 87% | 0.871 | 82% | 0.824 | S | S | * | * | trans | -77 | 97.3 | 174.8 | -96.6 | -84.7 | 0 | 0 | 0 | 112.6 | K256 | Y254-K256 PolarHBondContact O-N 3.38Š| ||
| 255 | R | 43.1 | Very low | 43.5 | Very low | 197 Ų | 197 | 155.2 Ų | 155.2 | 74% | 0.743 | 83% | 0.828 | S | S | * | * | trans | -80.8 | 99.3 | 173.2 | -170.2 | -174.5 | -162.1 | 176.9 | 4.6 | 110.1 | L253 H257 | L253-R255 PolarHBondContact O-N 2.97Å; L253-R255 VanDerWaalsContact O-N 3.11Å; R255-H257 PolarHBondContact O-N 3.07Å | ||
| 256 | K | 48.9 | Very low | 44 | Very low | 190 Ų | 190 | 158.2 Ų | 158.2 | 83% | 0.826 | 83% | 0.834 | S | S | * | * | trans | -68 | 116 | 173.1 | -72.7 | -169.6 | 176.2 | -173.3 | 0 | 110.6 | Y254 | Y254-K256 PolarHBondContact O-N 3.38Š| ||
| 257 | H | 42.4 | Very low | 44.2 | Very low | 150 Ų | 150 | 156.7 Ų | 156.7 | 69% | 0.694 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 126.2 | 162.3 | -74.9 | -118.9 | 0 | 0 | 0 | 108.3 | R255 | R255-H257 PolarHBondContact O-N 3.07Š|
| 258 | H | 50.3 | Low | 44.7 | Very low | 185 Ų | 185 | 157.7 Ų | 157.7 | 86% | 0.856 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 117 | 158.9 | -103 | -101.7 | 0 | 0 | 0 | 107.5 | ||
| 259 | V | 47.5 | Very low | 45.2 | Very low | 123 Ų | 123 | 152.7 Ų | 152.7 | 75% | 0.745 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 151.5 | 164.2 | -71.5 | 0 | 0 | 0 | 0 | 109.2 | ||
| 260 | A | 40.2 | Very low | 45.6 | Very low | 103 Ų | 103 | 155.5 Ų | 155.5 | 85% | 0.851 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 153.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 261 | T | 52.1 | Low | 45.8 | Very low | 120 Ų | 120 | 157.8 Ų | 157.8 | 74% | 0.736 | 83% | 0.833 | S | S | * | * | trans | -136.5 | 116.9 | 170.3 | -58.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 262 | L | 51.1 | Low | 46.7 | Very low | 244 Ų | 244 | 165.7 Ų | 165.7 | 100% | 1.277 | 84% | 0.843 | S | S | * | * | trans | 47.7 | 0 | 164 | -56.2 | 174.1 | 0 | 0 | 0 | 115.8 |
Retrieved 262 of 262 residues in 78.4 ms
(Link to these results)