| 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 | 38.6 | Very low | 34.1 | Very low | 243 Ų | 243 | 156.5 Ų | 156.5 | 100% | 1.197 | 83% | 0.826 | S | S | * | * | 0 | 80.5 | 0 | -78.2 | -177 | 174.5 | 0 | 0 | 105.8 | |||||
| 2 | D | 38.5 | Very low | 33.7 | Very low | 155 Ų | 155 | 154.4 Ų | 154.4 | 83% | 0.829 | 82% | 0.824 | S | S | * | * | trans | -72.2 | 133.2 | 168.8 | -55 | -85.7 | 0 | 0 | 0 | 107.9 | ||||
| 3 | D | 35.8 | Very low | 33.3 | Very low | 138 Ų | 138 | 147.7 Ų | 147.7 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | -154.7 | 123.9 | 150.1 | -113.4 | -35.9 | 0 | 0 | 0 | 112.2 | ||||
| 4 | Q | 33.8 | Very low | 33.2 | Very low | 162 Ų | 162 | 150.7 Ų | 150.7 | 76% | 0.757 | 83% | 0.827 | S | S | * | * | trans | 69.9 | 85.3 | 140.3 | -73.2 | 165.7 | 37.7 | 0 | 0 | 120.4 | ||||
| 5 | T | 35.6 | Very low | 32.9 | Very low | 124 Ų | 124 | 146.1 Ų | 146.1 | 76% | 0.761 | 83% | 0.828 | S | S | * | * | 17.3 | 116.4 | 102.9 | -41.6 | 0 | 0 | 0 | 0 | 117.6 | |||||
| 6 | R | 36.3 | Very low | 32.6 | Very low | 208 Ų | 208 | 142 Ų | 142 | 79% | 0.785 | 83% | 0.828 | S | S | * | * | 117.1 | 133.1 | 120.5 | -118.6 | -179.4 | 177.7 | 164 | 1.1 | 119 | |||||
| 7 | M | 32.8 | Very low | 32.7 | Very low | 148 Ų | 148 | 143.9 Ų | 143.9 | 73% | 0.729 | 83% | 0.833 | S | S | * | * | trans | 92.4 | 106.2 | 147.7 | -52.4 | -88.5 | -148.3 | 0 | 0 | 117.1 | ||||
| 8 | L | 32.6 | Very low | 32.7 | Very low | 172 Ų | 172 | 142.6 Ų | 142.6 | 90% | 0.901 | 83% | 0.833 | S | S | * | * | -175.7 | 93.7 | 117.7 | -92.5 | 161.9 | 0 | 0 | 0 | 110.1 | |||||
| 9 | T | 31.8 | Very low | 32.8 | Very low | 139 Ų | 139 | 145 Ų | 145 | 85% | 0.853 | 84% | 0.836 | S | S | * | * | trans | -62.7 | 140.5 | 139.6 | 36.7 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 10 | G | 29 | Very low | 32.9 | Very low | 63 Ų | 63 | 143.6 Ų | 143.6 | 65% | 0.649 | 83% | 0.832 | S | S | * | * | cis | 169.9 | 162.6 | 3.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 11 | L | 30.3 | Very low | 33 | Very low | 169 Ų | 169 | 144.2 Ų | 144.2 | 89% | 0.885 | 83% | 0.832 | S | S | * | * | trans | -178.6 | 118.6 | 150 | -100.3 | 150.3 | 0 | 0 | 0 | 110.5 | ||||
| 12 | T | 29.6 | Very low | 33.3 | Very low | 132 Ų | 132 | 138.8 Ų | 138.8 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | trans | -18 | 148 | 148.8 | 49 | 0 | 0 | 0 | 0 | 117 | ||||
| 13 | G | 28.5 | Very low | 33.4 | Very low | 67 Ų | 67 | 134.1 Ų | 134.1 | 69% | 0.691 | 80% | 0.801 | S | S | * | * | cis | 170.3 | -166.6 | 5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 14 | L | 31.4 | Very low | 33.6 | Very low | 190 Ų | 190 | 132.5 Ų | 132.5 | 100% | 0.995 | 79% | 0.793 | S | S | * | * | trans | 80.6 | 126.6 | 177.9 | -54.5 | 169 | 0 | 0 | 0 | 115.6 | ||||
| 15 | G | 28.2 | Very low | 34.1 | Very low | 81 Ų | 81 | 129.6 Ų | 129.6 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | cis | 172.3 | 138.4 | -1 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 16 | G | 28 | Very low | 34.4 | Very low | 81 Ų | 81 | 128.8 Ų | 128.8 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | trans | -179.4 | 100.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 17 | L | 35.8 | Very low | 34.4 | Very low | 174 Ų | 174 | 122.5 Ų | 122.5 | 91% | 0.911 | 77% | 0.767 | S | S | * | * | trans | -56.3 | 134.3 | -176 | -69.2 | 129.3 | 0 | 0 | 0 | 115 | ||||
| 18 | S | 32 | Very low | 34.6 | Very low | 120 Ų | 120 | 119.8 Ų | 119.8 | 84% | 0.839 | 76% | 0.758 | S | S | * | * | trans | -168.7 | 113.7 | 138.2 | -81 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 19 | Q | 35.3 | Very low | 35.1 | Very low | 189 Ų | 189 | 120.8 Ų | 120.8 | 88% | 0.883 | 75% | 0.75 | S | S | * | * | trans | 32.2 | 131.8 | 160.3 | -82.2 | 176.3 | -29.9 | 0 | 0 | 122.5 | ||||
| 20 | P | 35.1 | Very low | 35.3 | Very low | 116 Ų | 116 | 122.4 Ų | 122.4 | 75% | 0.753 | 75% | 0.745 | S | S | * | * | trans | -72.5 | 132.2 | 162.9 | 31.6 | -30.4 | 0 | 0 | 0 | 110.3 | V22 | P20-V22 PolarHBondContact O-N 3.3Å; P20-V22 VanDerWaalsContact O-N 3.13Å | ||
| 21 | D | 35.1 | Very low | 35.4 | Very low | 158 Ų | 158 | 127.1 Ų | 127.1 | 85% | 0.845 | 75% | 0.75 | S | S | * | * | trans | -50 | 112.1 | 167.8 | -172.2 | 39.4 | 0 | 0 | 0 | 109.7 | G23 | D21-G23 VanDerWaalsContact C-N 3.33Å; D21-G23 PolarHBondContact O-N 3.44Å | ||
| 22 | V | 43.5 | Very low | 35.6 | Very low | 128 Ų | 128 | 125.6 Ų | 125.6 | 78% | 0.776 | 74% | 0.739 | S | S | * | * | trans | -71.9 | 95.5 | 175 | 179.2 | 0 | 0 | 0 | 0 | 106 | P20 D24 | P20-V22 PolarHBondContact O-N 3.3Å; P20-V22 VanDerWaalsContact O-N 3.13Å; V22-D24 PolarHBondContact O-N 3.45Å | ||
| 23 | G | 41.3 | Very low | 35.7 | Very low | 58 Ų | 58 | 124.1 Ų | 124.1 | 60% | 0.598 | 73% | 0.734 | S | S | * | * | trans | -48.9 | 125.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | D21 P25 | D21-G23 VanDerWaalsContact C-N 3.33Å; D21-G23 PolarHBondContact O-N 3.44Å; G23-P25 WeakPolarHBondContact O-CD 3.34Å | ||
| 24 | D | 39 | Very low | 36.2 | Very low | 104 Ų | 104 | 128.6 Ų | 128.6 | 56% | 0.556 | 74% | 0.741 | S | S | * | * | trans | -51.4 | 116.4 | 179.5 | -171.7 | -13.8 | 0 | 0 | 0 | 110.8 | V22 D26 S27 | V22-D24 PolarHBondContact O-N 3.45Å; D24-D26 PolarHBondContact O-N 3.31Å; D24-D26 VanDerWaalsContact O-N 3.08Å; D24-D26 PolarHBondContact OD1-N 3.4Å; D24-D26 VanDerWaalsContact OD1-N 3.15Å; D24-S27 PolarHBondContact O-N 2.93Å | ||
| 25 | P | 44 | Very low | 36.3 | Very low | 101 Ų | 101 | 122.6 Ų | 122.6 | 66% | 0.656 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -64.7 | -12.4 | -177 | 25.2 | -32.9 | 0 | 0 | 0 | 113.4 | G23 | G23-P25 WeakPolarHBondContact O-CD 3.34Å |
| 26 | D | 42.3 | Very low | 36.5 | Very low | 106 Ų | 106 | 126.7 Ų | 126.7 | 57% | 0.567 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -80.2 | -22.7 | 176.9 | -96.5 | -23.7 | 0 | 0 | 0 | 113.9 | D24 K30 | D24-D26 PolarHBondContact O-N 3.31Å; D24-D26 VanDerWaalsContact O-N 3.08Å; D24-D26 PolarHBondContact OD1-N 3.4Å; D24-D26 VanDerWaalsContact OD1-N 3.15Å; D26-K30 PolarHBondContact O-N 3.41Å |
| 27 | S | 37.5 | Very low | 37 | Very low | 77 Ų | 77 | 128.7 Ų | 128.7 | 54% | 0.538 | 72% | 0.721 | S | S | . | * | H | α-helix | trans | -77.9 | -30.5 | -178.5 | -152.3 | 0 | 0 | 0 | 0 | 112.2 | D24 | D24-S27 PolarHBondContact O-N 2.93Å |
| 28 | V | 37.2 | Very low | 37.7 | Very low | 91 Ų | 91 | 128.5 Ų | 128.5 | 55% | 0.552 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -73.1 | -35.1 | 173.4 | -178.2 | 0 | 0 | 0 | 0 | 110.9 | Q31 Q32 | V28-Q31 PolarHBondContact O-N 3.33Å; V28-Q32 PolarHBondContact O-N 3.08Å |
| 29 | R | 42.9 | Very low | 38.7 | Very low | 192 Ų | 192 | 128.2 Ų | 128.2 | 73% | 0.725 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -70.1 | -34.2 | 179.7 | -157.7 | 173.6 | -166.7 | 174.1 | 4.2 | 113.2 | ||
| 30 | K | 34.4 | Very low | 40 | Very low | 173 Ų | 173 | 123.7 Ų | 123.7 | 75% | 0.752 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -73.1 | -24.2 | 175.4 | -100.7 | 174.7 | 179.6 | 163.9 | 0 | 114.1 | D26 | D26-K30 PolarHBondContact O-N 3.41Å |
| 31 | Q | 32.3 | Very low | 41.3 | Very low | 162 Ų | 162 | 120 Ų | 120 | 76% | 0.757 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -91.5 | -25 | -177.8 | -138 | 165.3 | -26.4 | 0 | 0 | 112.9 | V28 | V28-Q31 PolarHBondContact O-N 3.33Å |
| 32 | Q | 33.6 | Very low | 42.4 | Very low | 137 Ų | 137 | 114 Ų | 114 | 64% | 0.64 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -76.2 | -22.1 | 173.1 | -84.5 | 177.2 | -14.2 | 0 | 0 | 114.2 | V28 L34 | V28-Q32 PolarHBondContact O-N 3.08Å; Q32-L34 VanDerWaalsContact C-N 3.28Å; Q32-L34 PolarHBondContact O-N 3.45Å |
| 33 | S | 33.2 | Very low | 43.7 | Very low | 101 Ų | 101 | 111.7 Ų | 111.7 | 71% | 0.706 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -9.8 | -178.4 | -177.9 | 0 | 0 | 0 | 0 | 114.7 | ||
| 34 | L | 37.4 | Very low | 44.7 | Very low | 161 Ų | 161 | 110.8 Ų | 110.8 | 84% | 0.843 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.4 | 9.2 | -172 | -111.8 | 100.9 | 0 | 0 | 0 | 115.2 | Q32 | Q32-L34 VanDerWaalsContact C-N 3.28Å; Q32-L34 PolarHBondContact O-N 3.45Å |
| 35 | G | 34.2 | Very low | 45.8 | Very low | 65 Ų | 65 | 107 Ų | 107 | 67% | 0.67 | 58% | 0.576 | S | S | * | * | S | Bend | trans | -154.5 | 7.7 | -171.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||
| 36 | Q | 31.9 | Very low | 46.8 | Very low | 167 Ų | 167 | 108.5 Ų | 108.5 | 78% | 0.78 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -87.1 | 126.4 | 163.7 | -76.1 | -168.6 | -56.5 | 0 | 0 | 108.3 | Q38 | Q36-Q38 PolarHBondContact O-N 3.48Š|
| 37 | P | 38.6 | Very low | 48 | Very low | 123 Ų | 123 | 108.4 Ų | 108.4 | 80% | 0.799 | 57% | 0.57 | S | S | * | * | trans | -55.8 | 112.6 | 161.4 | -12.1 | 25.9 | 0 | 0 | 0 | 105.6 | Q39 | P37-Q39 VanDerWaalsContact C-N 3.33Å; P37-Q39 PolarHBondContact O-N 2.93Å | ||
| 38 | Q | 50.5 | Low | 49.1 | Very low | 170 Ų | 170 | 107.1 Ų | 107.1 | 79% | 0.794 | 56% | 0.556 | S | S | * | * | trans | -59.8 | 107.3 | 167.9 | -169.5 | 167.3 | 8 | 0 | 0 | 104.3 | Q36 D40 | Q36-Q38 PolarHBondContact O-N 3.48Å; Q38-D40 PolarHBondContact O-N 3.3Å | ||
| 39 | Q | 53.4 | Low | 50.5 | Low | 113 Ų | 113 | 107.7 Ų | 107.7 | 53% | 0.528 | 55% | 0.554 | S | S | . | * | trans | -48.9 | 119 | -176.6 | -139.4 | 173.6 | -6 | 0 | 0 | 107 | P37 I41 D43 I44 | P37-Q39 VanDerWaalsContact C-N 3.33Å; P37-Q39 PolarHBondContact O-N 2.93Å; Q39-I41 PolarHBondContact O-N 2.8Å; Q39-D43 HydrophobicContact CG-CB 4.44Å; Q39-I44 HydrophobicContact CB-CD1 4.23Å; Q39-I44 HydrophobicContact CB-CG1 4.19Å; Q39-I44 HydrophobicContact CG-CG1 4.23Å | ||
| 40 | D | 63.7 | Low | 51.3 | Low | 94 Ų | 94 | 101.2 Ų | 101.2 | 50% | 0.503 | 54% | 0.542 | S | S | . | . | trans | -60.6 | 141.3 | -173.9 | -166 | -16 | 0 | 0 | 0 | 107.1 | Q38 G42 D43 I44 | Q38-D40 PolarHBondContact O-N 3.3Å; D40-G42 PolarHBondContact O-N 3.1Å; D40-G42 VanDerWaalsContact O-N 3.15Å; D40-G42 PolarHBondContact OD1-N 2.81Å; D40-D43 HydrophobicContact CB-CB 4.28Å; D40-D43 VanDerWaalsContact CB-OD2 3.3Å; D40-D43 WeakPolarHBondContact CB-OD2 3.43Å; D40-D43 PolarHBondContact N-OD2 3.43Å; D40-D43 WeakPolarHBondContact O-CA 3.39Å; D40-D43 WeakPolarHBondContact O-CB 3.23Å; D40-D43 PolarHBondContact O-N 3.32Å; D40-I44 PolarHBondContact O-N 3.46Å | ||
| 41 | I | 60.6 | Low | 52.4 | Low | 40 Ų | 40 | 97.1 Ų | 97.1 | 21% | 0.205 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -55.3 | -34.5 | 173.8 | -66.1 | 168.2 | 0 | 0 | 0 | 108.4 | Q39 D43 I44 L45 I247 L251 | Q39-I41 PolarHBondContact O-N 2.8Å; I41-D43 PolarHBondContact O-N 3.43Å; I41-I44 PolarHBondContact O-N 3.02Å; I41-L45 HydrophobicContact CG2-CD1 3.85Å; I41-L45 HydrophobicContact CG2-CG 4.21Å; I41-L45 WeakPolarHBondContact O-CB 3.25Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.4Å; I41-I247 HydrophobicContact CG2-CG2 4.49Å; I41-L251 HydrophobicContact CD1-CD1 4.43Å |
| 42 | G | 59.6 | Low | 53.6 | Low | 30 Ų | 30 | 90.7 Ų | 90.7 | 31% | 0.309 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -56.3 | -42.5 | 169.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | D40 L45 Q46 | D40-G42 PolarHBondContact O-N 3.1Å; D40-G42 VanDerWaalsContact O-N 3.15Å; D40-G42 PolarHBondContact OD1-N 2.81Å; G42-L45 PolarHBondContact O-N 3.49Å; G42-Q46 WeakPolarHBondContact O-CB 3.44Å; G42-Q46 WeakPolarHBondContact O-CG 3.17Å; G42-Q46 PolarHBondContact O-N 3.08Å |
| 43 | D | 69.4 | Low | 54.5 | Low | 80 Ų | 80 | 88.7 Ų | 88.7 | 43% | 0.428 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.7 | -40.4 | 179.5 | -61.3 | -31.9 | 0 | 0 | 0 | 111.6 | Q39 D40 I41 Q46 Q47 | Q39-D43 HydrophobicContact CG-CB 4.44Å; D40-D43 HydrophobicContact CB-CB 4.28Å; D40-D43 VanDerWaalsContact CB-OD2 3.3Å; D40-D43 WeakPolarHBondContact CB-OD2 3.43Å; D40-D43 PolarHBondContact N-OD2 3.43Å; D40-D43 WeakPolarHBondContact O-CA 3.39Å; D40-D43 WeakPolarHBondContact O-CB 3.23Å; D40-D43 PolarHBondContact O-N 3.32Å; I41-D43 PolarHBondContact O-N 3.43Å; D43-Q46 PolarHBondContact O-N 3.38Å; D43-Q47 VanDerWaalsContact O-CB 3.28Å; D43-Q47 WeakPolarHBondContact O-CB 3.19Å; D43-Q47 PolarHBondContact O-N 3.08Å |
| 44 | I | 64.2 | Low | 55.5 | Low | 39 Ų | 39 | 90.6 Ų | 90.6 | 20% | 0.2 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -66.3 | -42.8 | 177.2 | -62.7 | 173.6 | 0 | 0 | 0 | 109.9 | Q39 D40 I41 Q47 I48 I247 | Q39-I44 HydrophobicContact CB-CD1 4.23Å; Q39-I44 HydrophobicContact CB-CG1 4.19Å; Q39-I44 HydrophobicContact CG-CG1 4.23Å; D40-I44 PolarHBondContact O-N 3.46Å; I41-I44 PolarHBondContact O-N 3.02Å; I44-Q47 PolarHBondContact O-N 3.28Å; I44-I48 HydrophobicContact CG2-CD1 3.99Å; I44-I48 VanDerWaalsContact O-CG1 3.25Å; I44-I48 WeakPolarHBondContact O-CG1 3.35Å; I44-I48 PolarHBondContact O-N 2.97Å; I44-I247 HydrophobicContact CG2-CD1 4.42Å |
| 45 | L | 60.7 | Low | 56.1 | Low | 26 Ų | 26 | 85.9 Ų | 85.9 | 14% | 0.136 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -66.4 | -42.4 | 177.4 | -70.1 | 174.6 | 0 | 0 | 0 | 111.7 | I41 G42 Q47 I48 M49 A207 F244 | I41-L45 HydrophobicContact CG2-CD1 3.85Å; I41-L45 HydrophobicContact CG2-CG 4.21Å; I41-L45 WeakPolarHBondContact O-CB 3.25Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.4Å; G42-L45 PolarHBondContact O-N 3.49Å; L45-Q47 PolarHBondContact O-N 3.49Å; L45-I48 PolarHBondContact O-N 2.86Å; L45-M49 WeakPolarHBondContact O-CG 3.29Å; L45-M49 PolarHBondContact O-N 3.2Å; L45-A207 HydrophobicContact CD1-CB 4.2Å; L45-A207 HydrophobicContact CD2-CB 3.93Å; L45-F244 HydrophobicContact CD2-CE1 4.3Å |
| 46 | Q | 65.9 | Low | 56.8 | Low | 131 Ų | 131 | 85 Ų | 85 | 61% | 0.612 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -63.5 | -40 | 174.3 | -84.7 | 175.2 | 2.8 | 0 | 0 | 112.3 | G42 D43 I48 M49 A50 | G42-Q46 WeakPolarHBondContact O-CB 3.44Å; G42-Q46 WeakPolarHBondContact O-CG 3.17Å; G42-Q46 PolarHBondContact O-N 3.08Å; D43-Q46 PolarHBondContact O-N 3.38Å; Q46-I48 VanDerWaalsContact C-N 3.33Å; Q46-I48 PolarHBondContact O-N 3.48Å; Q46-M49 PolarHBondContact O-N 3.44Å; Q46-A50 VanDerWaalsContact O-CB 3.29Å; Q46-A50 WeakPolarHBondContact O-CB 3.34Å; Q46-A50 PolarHBondContact O-N 3.4Å |
| 47 | Q | 67.6 | Low | 57.6 | Low | 105 Ų | 105 | 82.1 Ų | 82.1 | 49% | 0.491 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64 | -39.9 | 176 | -172.7 | 173.8 | 9.7 | 0 | 0 | 111.6 | D43 I44 L45 I51 | D43-Q47 VanDerWaalsContact O-CB 3.28Å; D43-Q47 WeakPolarHBondContact O-CB 3.19Å; D43-Q47 PolarHBondContact O-N 3.08Å; I44-Q47 PolarHBondContact O-N 3.28Å; L45-Q47 PolarHBondContact O-N 3.49Å; Q47-I51 HydrophobicContact CG-CD1 4.2Å; Q47-I51 WeakPolarHBondContact O-CD1 3.14Å; Q47-I51 WeakPolarHBondContact O-CG1 3.29Å; Q47-I51 PolarHBondContact O-N 2.92Å |
| 48 | I | 60.3 | Low | 58.2 | Low | 50 Ų | 50 | 81 Ų | 81 | 26% | 0.256 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.4 | -42.5 | 175.8 | -69.5 | 166.3 | 0 | 0 | 0 | 111 | I44 L45 Q46 I51 T52 F211 I247 | I44-I48 HydrophobicContact CG2-CD1 3.99Å; I44-I48 VanDerWaalsContact O-CG1 3.25Å; I44-I48 WeakPolarHBondContact O-CG1 3.35Å; I44-I48 PolarHBondContact O-N 2.97Å; L45-I48 PolarHBondContact O-N 2.86Å; Q46-I48 VanDerWaalsContact C-N 3.33Å; Q46-I48 PolarHBondContact O-N 3.48Å; I48-I51 PolarHBondContact O-N 3.43Å; I48-T52 PolarHBondContact O-N 3.14Å; I48-T52 PolarHBondContact O-OG1 3.49Å; I48-F211 HydrophobicContact CG2-CD2 3.92Å; I48-F211 HydrophobicContact CG2-CE2 3.53Å; I48-F211 HydrophobicContact CG2-CZ 4.22Å; I48-I247 HydrophobicContact CD1-CD1 4.49Å |
| 49 | M | 65.4 | Low | 57.9 | Low | 103 Ų | 103 | 75.1 Ų | 75.1 | 51% | 0.507 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.7 | -39.5 | 176.7 | -74 | 174.1 | 49 | 0 | 0 | 112.9 | L45 Q46 T52 D53 | L45-M49 WeakPolarHBondContact O-CG 3.29Å; L45-M49 PolarHBondContact O-N 3.2Å; Q46-M49 PolarHBondContact O-N 3.44Å; M49-T52 VanDerWaalsContact C-OG1 3.25Å; M49-T52 VanDerWaalsContact CA-OG1 3.27Å; M49-T52 WeakPolarHBondContact CA-OG1 3.39Å; M49-T52 PolarHBondContact O-N 2.7Å; M49-T52 VanDerWaalsContact O-N 3.15Å; M49-T52 PolarHBondContact O-OG1 3.46Å; M49-D53 PolarHBondContact O-N 2.91Å; M49-D53 VanDerWaalsContact O-N 3.11Å |
| 50 | A | 61 | Low | 57.7 | Low | 55 Ų | 55 | 75.5 Ų | 75.5 | 46% | 0.455 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66.2 | -38.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q46 T52 D53 E54 | Q46-A50 VanDerWaalsContact O-CB 3.29Å; Q46-A50 WeakPolarHBondContact O-CB 3.34Å; Q46-A50 PolarHBondContact O-N 3.4Å; A50-T52 PolarHBondContact O-N 3.08Å; A50-D53 PolarHBondContact O-N 3.41Å; A50-E54 WeakPolarHBondContact O-CB 3.43Å; A50-E54 PolarHBondContact O-N 3.06Å |
| 51 | I | 57.7 | Low | 56.9 | Low | 87 Ų | 87 | 74.8 Ų | 74.8 | 45% | 0.446 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.7 | -34.2 | 173.4 | -68.9 | 164.7 | 0 | 0 | 0 | 110.7 | Q47 I48 S55 | Q47-I51 HydrophobicContact CG-CD1 4.2Å; Q47-I51 WeakPolarHBondContact O-CD1 3.14Å; Q47-I51 WeakPolarHBondContact O-CG1 3.29Å; Q47-I51 PolarHBondContact O-N 2.92Å; I48-I51 PolarHBondContact O-N 3.43Å; I51-S55 WeakPolarHBondContact O-CB 3.41Å; I51-S55 PolarHBondContact O-N 2.74Å; I51-S55 PolarHBondContact O-OG 2.95Å |
| 52 | T | 56.3 | Low | 56.1 | Low | 28 Ų | 28 | 81.3 Ų | 81.3 | 17% | 0.172 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -69.3 | -38.8 | 175.1 | 35.9 | 0 | 0 | 0 | 0 | 113.6 | I48 M49 A50 S55 L56 F211 | I48-T52 PolarHBondContact O-N 3.14Å; I48-T52 PolarHBondContact O-OG1 3.49Å; M49-T52 VanDerWaalsContact C-OG1 3.25Å; M49-T52 VanDerWaalsContact CA-OG1 3.27Å; M49-T52 WeakPolarHBondContact CA-OG1 3.39Å; M49-T52 PolarHBondContact O-N 2.7Å; M49-T52 VanDerWaalsContact O-N 3.15Å; M49-T52 PolarHBondContact O-OG1 3.46Å; A50-T52 PolarHBondContact O-N 3.08Å; T52-S55 PolarHBondContact O-N 3.35Å; T52-L56 WeakPolarHBondContact O-CB 3.37Å; T52-L56 PolarHBondContact O-N 3.4Å; T52-F211 HydrophobicContact CG2-CD2 4.23Å; T52-F211 HydrophobicContact CG2-CE2 3.35Å; T52-F211 HydrophobicContact CG2-CZ 3.93Å |
| 53 | D | 53.5 | Low | 55.2 | Low | 95 Ų | 95 | 82.6 Ų | 82.6 | 51% | 0.508 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -67.1 | -43.5 | 176.6 | -71.2 | -22.1 | 0 | 0 | 0 | 111 | M49 A50 S55 L56 D57 | M49-D53 PolarHBondContact O-N 2.91Å; M49-D53 VanDerWaalsContact O-N 3.11Å; A50-D53 PolarHBondContact O-N 3.41Å; D53-S55 PolarHBondContact O-N 3.23Å; D53-L56 WeakPolarHBondContact O-CB 3.41Å; D53-L56 PolarHBondContact O-N 2.98Å; D53-D57 PolarHBondContact O-N 3.25Å |
| 54 | E | 52.7 | Low | 53.9 | Low | 141 Ų | 141 | 83.9 Ų | 83.9 | 66% | 0.659 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -65.9 | -38.5 | 176.8 | -164.9 | 173.3 | -158.7 | 0 | 0 | 112 | A50 E58 | A50-E54 WeakPolarHBondContact O-CB 3.43Å; A50-E54 PolarHBondContact O-N 3.06Å; E54-E58 PolarHBondContact O-N 2.91Å |
| 55 | S | 50.9 | Low | 52.7 | Low | 61 Ų | 61 | 86.8 Ų | 86.8 | 43% | 0.427 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -71.1 | -28.6 | 174.8 | -59.8 | 0 | 0 | 0 | 0 | 112.9 | I51 T52 D53 A59 | I51-S55 WeakPolarHBondContact O-CB 3.41Å; I51-S55 PolarHBondContact O-N 2.74Å; I51-S55 PolarHBondContact O-OG 2.95Å; T52-S55 PolarHBondContact O-N 3.35Å; D53-S55 PolarHBondContact O-N 3.23Å; S55-A59 WeakPolarHBondContact O-CB 3.13Å; S55-A59 PolarHBondContact O-N 3.49Å |
| 56 | L | 48.6 | Very low | 51.9 | Low | 47 Ų | 47 | 94.7 Ų | 94.7 | 25% | 0.246 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -69.7 | -46.3 | 176.6 | -172.7 | 73.6 | 0 | 0 | 0 | 110.4 | T52 D53 A59 Q60 L218 | T52-L56 WeakPolarHBondContact O-CB 3.37Å; T52-L56 PolarHBondContact O-N 3.4Å; D53-L56 WeakPolarHBondContact O-CB 3.41Å; D53-L56 PolarHBondContact O-N 2.98Å; L56-A59 PolarHBondContact O-N 3.01Å; L56-Q60 WeakPolarHBondContact O-CB 3.37Å; L56-Q60 WeakPolarHBondContact O-CG 3.41Å; L56-Q60 PolarHBondContact O-N 3.43Å; L56-L218 HydrophobicContact CD1-CD1 4.15Å |
| 57 | D | 50 | Low | 50.5 | Low | 106 Ų | 106 | 96.6 Ų | 96.6 | 57% | 0.567 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65 | -43.6 | 176.2 | -75 | -18.4 | 0 | 0 | 0 | 111.4 | D53 Q60 A61 | D53-D57 PolarHBondContact O-N 3.25Å; D57-Q60 PolarHBondContact O-N 2.87Å; D57-A61 WeakPolarHBondContact O-CB 3.49Å; D57-A61 PolarHBondContact O-N 3.31Å |
| 58 | E | 50.3 | Low | 49 | Very low | 100 Ų | 100 | 96.7 Ų | 96.7 | 47% | 0.467 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.8 | -41.1 | 174.2 | -90.2 | -155.4 | 152.6 | 0 | 0 | 113 | E54 A61 R62 | E54-E58 PolarHBondContact O-N 2.91Å; E58-A61 PolarHBondContact O-N 2.94Å; E58-R62 WeakPolarHBondContact O-CB 3.39Å; E58-R62 WeakPolarHBondContact O-CG 3.49Å; E58-R62 PolarHBondContact O-N 2.99Å; E58-R62 IonicContact OE1-NH1 3.01Å; E58-R62 IonicContact OE2-CZ 3.42Å; E58-R62 IonicContact OE2-NH1 2.65Å; E58-R62 PolarHBondContact OE2-NH1 3.37Å |
| 59 | A | 43.2 | Very low | 48.1 | Very low | 47 Ų | 47 | 100.2 Ų | 100.2 | 39% | 0.388 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.8 | -34 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | S55 L56 S63 | S55-A59 WeakPolarHBondContact O-CB 3.13Å; S55-A59 PolarHBondContact O-N 3.49Å; L56-A59 PolarHBondContact O-N 3.01Å; A59-S63 PolarHBondContact O-N 2.89Å |
| 60 | Q | 50.1 | Low | 46.7 | Very low | 121 Ų | 121 | 99 Ų | 99 | 57% | 0.565 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -67 | -43.4 | 171.1 | -75.5 | 178.3 | -25.7 | 0 | 0 | 111.1 | L56 D57 R62 S63 | L56-Q60 WeakPolarHBondContact O-CB 3.37Å; L56-Q60 WeakPolarHBondContact O-CG 3.41Å; L56-Q60 PolarHBondContact O-N 3.43Å; D57-Q60 PolarHBondContact O-N 2.87Å; Q60-R62 PolarHBondContact O-N 3.11Å; Q60-S63 PolarHBondContact O-N 2.93Å; Q60-S63 PolarHBondContact O-OG 2.78Å |
| 61 | A | 46.6 | Very low | 45.5 | Very low | 79 Ų | 79 | 104.6 Ų | 104.6 | 65% | 0.653 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.2 | -36.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113.4 | D57 E58 | D57-A61 WeakPolarHBondContact O-CB 3.49Å; D57-A61 PolarHBondContact O-N 3.31Å; E58-A61 PolarHBondContact O-N 2.94Å |
| 62 | R | 43.1 | Very low | 44.4 | Very low | 177 Ų | 177 | 112 Ų | 112 | 67% | 0.668 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -8.6 | 179.4 | -75.8 | 174 | 158.2 | 141.1 | 2.3 | 115.1 | E58 Q60 W64 | E58-R62 WeakPolarHBondContact O-CB 3.39Å; E58-R62 WeakPolarHBondContact O-CG 3.49Å; E58-R62 PolarHBondContact O-N 2.99Å; E58-R62 IonicContact OE1-NH1 3.01Å; E58-R62 IonicContact OE2-CZ 3.42Å; E58-R62 IonicContact OE2-NH1 2.65Å; E58-R62 PolarHBondContact OE2-NH1 3.37Å; Q60-R62 PolarHBondContact O-N 3.11Å; R62-W64 PolarHBondContact O-N 2.81Å; R62-W64 VanDerWaalsContact O-N 3.08Å |
| 63 | S | 42.5 | Very low | 43.7 | Very low | 56 Ų | 56 | 113.4 Ų | 113.4 | 39% | 0.392 | 61% | 0.61 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.4 | -6.5 | -177 | 68.2 | 0 | 0 | 0 | 0 | 114.3 | A59 Q60 | A59-S63 PolarHBondContact O-N 2.89Å; Q60-S63 PolarHBondContact O-N 2.93Å; Q60-S63 PolarHBondContact O-OG 2.78Å |
| 64 | W | 41.8 | Very low | 42.6 | Very low | 108 Ų | 108 | 112.2 Ų | 112.2 | 41% | 0.409 | 62% | 0.62 | S | S | . | * | S | Bend | trans | -139.2 | 105.4 | 170.2 | -58 | 93.6 | 0 | 0 | 0 | 109.3 | R62 E66 F97 K101 | R62-W64 PolarHBondContact O-N 2.81Å; R62-W64 VanDerWaalsContact O-N 3.08Å; W64-E66 PolarHBondContact O-N 3.49Å; W64-F97 AromaticContact CE3-CE1 3.61Å; W64-F97 HydrophobicContact CE3-CE1 3.61Å; W64-F97 AromaticContact CE3-CZ 3.88Å; W64-F97 HydrophobicContact CE3-CZ 3.88Å; W64-F97 AromaticContact CZ3-CE1 3.52Å; W64-F97 HydrophobicContact CZ3-CE1 3.52Å; W64-F97 AromaticContact CZ3-CZ 3.66Å; W64-F97 HydrophobicContact CZ3-CZ 3.66Å; W64-K101 HydrophobicContact CH2-CD 3.38Å; W64-K101 HydrophobicContact CH2-CG 4.3Å; W64-K101 HydrophobicContact CZ2-CD 3.99Å; W64-K101 HydrophobicContact CZ3-CD 3.99Å |
| 65 | P | 38.8 | Very low | 42.1 | Very low | 100 Ų | 100 | 110.8 Ų | 110.8 | 65% | 0.649 | 63% | 0.625 | S | S | * | * | trans | -64.3 | 124.4 | 162.8 | 7.6 | 2.6 | 0 | 0 | 0 | 107.5 | E67 | P65-E67 HydrophobicContact CB-CG 4.23Å; P65-E67 PolarHBondContact O-N 3.15Å | ||
| 66 | E | 42.8 | Very low | 41.4 | Very low | 192 Ų | 192 | 115.6 Ų | 115.6 | 90% | 0.897 | 65% | 0.647 | S | S | * | * | trans | -70.6 | 60.5 | 166.4 | -159.1 | -177.1 | -167.1 | 0 | 0 | 108.6 | W64 S68 | W64-E66 PolarHBondContact O-N 3.49Å; E66-S68 PolarHBondContact O-N 3.48Å | ||
| 67 | E | 38 | Very low | 40.6 | Very low | 170 Ų | 170 | 120.2 Ų | 120.2 | 79% | 0.794 | 67% | 0.671 | S | S | * | * | trans | -78.7 | 113 | 171.6 | -84.6 | -176.1 | 164.1 | 0 | 0 | 108.5 | P65 | P65-E67 HydrophobicContact CB-CG 4.23Å; P65-E67 PolarHBondContact O-N 3.15Å | ||
| 68 | S | 35.4 | Very low | 40.4 | Very low | 108 Ų | 108 | 120.4 Ų | 120.4 | 76% | 0.755 | 68% | 0.678 | S | S | * | * | trans | -48.1 | 138 | 170.6 | -69 | 0 | 0 | 0 | 0 | 110.3 | E66 A70 | E66-S68 PolarHBondContact O-N 3.48Å; S68-A70 PolarHBondContact O-N 2.85Å | ||
| 69 | P | 40.3 | Very low | 39.6 | Very low | 124 Ų | 124 | 120.7 Ų | 120.7 | 81% | 0.805 | 69% | 0.687 | S | S | * | * | trans | -63.2 | 110.1 | -174.6 | -17.6 | 29.4 | 0 | 0 | 0 | 110.5 | H71 | P69-H71 PolarHBondContact O-N 3.33Š| ||
| 70 | A | 37.1 | Very low | 39.2 | Very low | 77 Ų | 77 | 127.5 Ų | 127.5 | 64% | 0.636 | 71% | 0.711 | S | S | * | * | trans | -57.4 | 122.6 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108 | S68 W72 | S68-A70 PolarHBondContact O-N 2.85Å; A70-W72 PolarHBondContact O-N 3.02Å | ||
| 71 | H | 36.8 | Very low | 38.3 | Very low | 172 Ų | 172 | 125.6 Ų | 125.6 | 80% | 0.796 | 72% | 0.724 | S | S | * | * | trans | -53.7 | 96.1 | 174.8 | 175.4 | 40.3 | 0 | 0 | 0 | 110.3 | P69 G73 | P69-H71 PolarHBondContact O-N 3.33Å; H71-G73 VanDerWaalsContact C-N 3.33Å; H71-G73 PolarHBondContact O-N 2.93Å | ||
| 72 | W | 33.7 | Very low | 37.5 | Very low | 242 Ų | 242 | 125.8 Ų | 125.8 | 92% | 0.917 | 73% | 0.733 | S | S | * | * | trans | -83.5 | 89.4 | 157.5 | -73.4 | 101.7 | 0 | 0 | 0 | 106.8 | A70 G74 | A70-W72 PolarHBondContact O-N 3.02Å; W72-G74 PolarHBondContact O-N 3.12Å | ||
| 73 | G | 40.4 | Very low | 37.2 | Very low | 59 Ų | 59 | 129.4 Ų | 129.4 | 61% | 0.608 | 75% | 0.747 | S | S | * | * | trans | -62.5 | 111.6 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | H71 | H71-G73 VanDerWaalsContact C-N 3.33Å; H71-G73 PolarHBondContact O-N 2.93Å | ||
| 74 | G | 30.8 | Very low | 36.8 | Very low | 70 Ų | 70 | 131.5 Ų | 131.5 | 72% | 0.722 | 77% | 0.767 | S | S | * | * | trans | -137.6 | 102.9 | 165.6 | 0 | 0 | 0 | 0 | 0 | 106.1 | W72 | W72-G74 PolarHBondContact O-N 3.12Š| ||
| 75 | S | 43 | Very low | 36.3 | Very low | 110 Ų | 110 | 130.1 Ų | 130.1 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | trans | -44.7 | 135.8 | 176 | -52.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 76 | D | 35.6 | Very low | 36 | Very low | 163 Ų | 163 | 129.6 Ų | 129.6 | 87% | 0.872 | 80% | 0.799 | S | S | * | * | 179.2 | 100.9 | 126.4 | -80.6 | -25.2 | 0 | 0 | 0 | 108.5 | |||||
| 77 | D | 32.1 | Very low | 35.5 | Very low | 144 Ų | 144 | 124 Ų | 124 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | trans | -91.5 | 140.7 | 155.3 | -169.6 | 34.1 | 0 | 0 | 0 | 105.7 | T79 | D77-T79 PolarHBondContact OD1-N 3.5Š| ||
| 78 | P | 45.5 | Very low | 35.3 | Very low | 110 Ų | 110 | 125 Ų | 125 | 71% | 0.714 | 80% | 0.8 | S | S | * | * | -146.1 | 151.3 | 83.2 | 36.9 | -17.6 | 0 | 0 | 0 | 115.7 | |||||
| 79 | T | 34.8 | Very low | 35.6 | Very low | 105 Ų | 105 | 124.9 Ų | 124.9 | 64% | 0.644 | 81% | 0.806 | S | S | * | * | trans | 107.8 | 111.9 | 136.4 | -8.3 | 0 | 0 | 0 | 0 | 118.9 | D77 | D77-T79 PolarHBondContact OD1-N 3.5Š| ||
| 80 | E | 34.4 | Very low | 35.4 | Very low | 190 Ų | 190 | 122.6 Ų | 122.6 | 89% | 0.888 | 80% | 0.804 | S | S | * | * | trans | 70.2 | 116.8 | 141.3 | -87.6 | -174 | 152.1 | 0 | 0 | 122.2 | ||||
| 81 | G | 30.5 | Very low | 35.6 | Very low | 82 Ų | 82 | 123.4 Ų | 123.4 | 85% | 0.845 | 82% | 0.82 | S | S | * | * | 123.1 | 111.4 | 121.6 | 0 | 0 | 0 | 0 | 0 | 117 | |||||
| 82 | G | 30.9 | Very low | 35.9 | Very low | 82 Ų | 82 | 118.2 Ų | 118.2 | 85% | 0.845 | 81% | 0.813 | S | S | * | * | trans | 118.4 | 112 | 143.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 83 | R | 35.8 | Very low | 36.7 | Very low | 254 Ų | 254 | 110.4 Ų | 110.4 | 96% | 0.958 | 79% | 0.789 | S | S | * | * | trans | -41 | 145.8 | 159.8 | -73.7 | 168.4 | 155.2 | -160.7 | -5.1 | 113.5 | ||||
| 84 | A | 34.3 | Very low | 37.4 | Very low | 99 Ų | 99 | 111.5 Ų | 111.5 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | 156.1 | 142.4 | 105.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 85 | G | 31.3 | Very low | 38.7 | Very low | 79 Ų | 79 | 114.7 Ų | 114.7 | 81% | 0.814 | 79% | 0.786 | S | S | * | * | trans | 86.8 | 111.9 | 134.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 86 | G | 33.3 | Very low | 39.7 | Very low | 89 Ų | 89 | 114.9 Ų | 114.9 | 92% | 0.918 | 78% | 0.778 | S | S | * | * | trans | -74.3 | 178.9 | 173 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 87 | G | 31.1 | Very low | 41 | Very low | 74 Ų | 74 | 111.3 Ų | 111.3 | 76% | 0.763 | 76% | 0.755 | S | S | * | * | trans | 148.6 | 98.3 | 167.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 88 | M | 35 | Very low | 42.5 | Very low | 192 Ų | 192 | 108.2 Ų | 108.2 | 95% | 0.946 | 74% | 0.736 | S | S | * | * | trans | 34.9 | 136.8 | 143.2 | -70.6 | -176.9 | 144.3 | 0 | 0 | 123.1 | ||||
| 89 | A | 40.2 | Very low | 43.7 | Very low | 106 Ų | 106 | 108.9 Ų | 108.9 | 88% | 0.876 | 73% | 0.729 | S | S | * | * | trans | 80.6 | 131 | 138.6 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 90 | G | 35.7 | Very low | 45.3 | Very low | 75 Ų | 75 | 112.4 Ų | 112.4 | 77% | 0.773 | 73% | 0.73 | S | S | * | * | trans | 111.7 | 104.8 | 159 | 0 | 0 | 0 | 0 | 0 | 113.8 | G92 | G90-G92 PolarHBondContact O-N 3.2Š| ||
| 91 | G | 41.3 | Very low | 46.9 | Very low | 94 Ų | 94 | 106.8 Ų | 106.8 | 97% | 0.969 | 70% | 0.703 | S | S | * | * | trans | -67.5 | 66.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 92 | G | 44.9 | Very low | 49 | Very low | 63 Ų | 63 | 108.7 Ų | 108.7 | 65% | 0.649 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 121.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | G90 | G90-G92 PolarHBondContact O-N 3.2Š|
| 93 | L | 49.7 | Very low | 51.2 | Low | 78 Ų | 78 | 107.6 Ų | 107.6 | 41% | 0.408 | 67% | 0.673 | S | S | . | * | P | Polyproline II helix | trans | -50.2 | 135.6 | 170.4 | -73.4 | 166.6 | 0 | 0 | 0 | 109.6 | L95 F97 | L93-L95 PolarHBondContact O-N 3.42Å; L93-F97 HydrophobicContact CB-CD1 4.46Å; L93-F97 HydrophobicContact CD1-CD1 4.15Å; L93-F97 HydrophobicContact CD1-CE1 4.19Å |
| 94 | P | 55.9 | Low | 53 | Low | 83 Ų | 83 | 101.9 Ų | 101.9 | 54% | 0.539 | 66% | 0.661 | S | S | . | * | P | Polyproline II helix | trans | -55.2 | 135.1 | -173.6 | 19.7 | -30.9 | 0 | 0 | 0 | 110.5 | N96 F97 | P94-N96 PolarHBondContact O-N 3.19Å; P94-F97 HydrophobicContact CG-CB 4.36Å; P94-F97 WeakPolarHBondContact O-CB 3.49Å; P94-F97 PolarHBondContact O-N 3.15Å |
| 95 | L | 57.9 | Low | 55 | Low | 137 Ų | 137 | 101 Ų | 101 | 72% | 0.717 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -43.7 | -34.2 | -179.3 | -86.9 | 156 | 0 | 0 | 0 | 113.2 | L93 F97 H99 | L93-L95 PolarHBondContact O-N 3.42Å; L95-F97 PolarHBondContact O-N 3.09Å; L95-H99 PolarHBondContact O-N 3.07Å; L95-H99 VanDerWaalsContact O-N 3.15Å; L95-H99 PolarHBondContact O-ND1 2.88Å |
| 96 | N | 63.9 | Low | 57.4 | Low | 113 Ų | 113 | 101.4 Ų | 101.4 | 60% | 0.604 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -62.9 | -34 | 177.3 | -112 | -34.8 | 0 | 0 | 0 | 114.5 | P94 R100 | P94-N96 PolarHBondContact O-N 3.19Å; N96-R100 WeakPolarHBondContact O-CB 3.25Å; N96-R100 VanDerWaalsContact O-CG 3.29Å; N96-R100 WeakPolarHBondContact O-CG 3.49Å; N96-R100 PolarHBondContact O-N 3.45Å; N96-R100 VanDerWaalsContact O-N 3.07Å |
| 97 | F | 62.4 | Low | 59.8 | Low | 89 Ų | 89 | 102.1 Ų | 102.1 | 39% | 0.39 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -74.5 | -44.2 | 180 | -178.1 | -99.7 | 0 | 0 | 0 | 111.9 | W64 L93 P94 L95 H99 R100 K101 | W64-F97 AromaticContact CE3-CE1 3.61Å; W64-F97 HydrophobicContact CE3-CE1 3.61Å; W64-F97 AromaticContact CE3-CZ 3.88Å; W64-F97 HydrophobicContact CE3-CZ 3.88Å; W64-F97 AromaticContact CZ3-CE1 3.52Å; W64-F97 HydrophobicContact CZ3-CE1 3.52Å; W64-F97 AromaticContact CZ3-CZ 3.66Å; W64-F97 HydrophobicContact CZ3-CZ 3.66Å; L93-F97 HydrophobicContact CB-CD1 4.46Å; L93-F97 HydrophobicContact CD1-CD1 4.15Å; L93-F97 HydrophobicContact CD1-CE1 4.19Å; P94-F97 HydrophobicContact CG-CB 4.36Å; P94-F97 WeakPolarHBondContact O-CB 3.49Å; P94-F97 PolarHBondContact O-N 3.15Å; L95-F97 PolarHBondContact O-N 3.09Å; F97-H99 VanDerWaalsContact C-N 3.32Å; F97-H99 PolarHBondContact O-N 3.37Å; F97-R100 PolarHBondContact O-N 3.37Å; F97-K101 WeakPolarHBondContact O-CB 3.18Å; F97-K101 PolarHBondContact O-N 2.99Å |
| 98 | Q | 64.2 | Low | 62.5 | Low | 79 Ų | 79 | 110.1 Ų | 110.1 | 37% | 0.369 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -63.5 | -38.6 | 175.7 | -67.6 | -64.5 | -15 | 0 | 0 | 111.6 | H102 | Q98-H102 WeakPolarHBondContact O-CB 3.42Å; Q98-H102 PolarHBondContact O-N 3.19Å |
| 99 | H | 69.3 | Low | 65 | Low | 123 Ų | 123 | 107 Ų | 107 | 57% | 0.569 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -64.9 | -44.1 | 174 | -78.5 | 98.9 | 0 | 0 | 0 | 112.8 | L95 F97 H102 A103 | L95-H99 PolarHBondContact O-N 3.07Å; L95-H99 VanDerWaalsContact O-N 3.15Å; L95-H99 PolarHBondContact O-ND1 2.88Å; F97-H99 VanDerWaalsContact C-N 3.32Å; F97-H99 PolarHBondContact O-N 3.37Å; H99-H102 PolarHBondContact O-N 3.24Å; H99-A103 WeakPolarHBondContact O-CB 3.44Å; H99-A103 PolarHBondContact O-N 3.41Å |
| 100 | R | 69.9 | Low | 67.1 | Low | 179 Ų | 179 | 103.8 Ų | 103.8 | 68% | 0.675 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.7 | -42.4 | 175.9 | -75.9 | 176.7 | -173.6 | -172.2 | 1.6 | 112.3 | N96 F97 A103 L104 | N96-R100 WeakPolarHBondContact O-CB 3.25Å; N96-R100 VanDerWaalsContact O-CG 3.29Å; N96-R100 WeakPolarHBondContact O-CG 3.49Å; N96-R100 PolarHBondContact O-N 3.45Å; N96-R100 VanDerWaalsContact O-N 3.07Å; F97-R100 PolarHBondContact O-N 3.37Å; R100-A103 PolarHBondContact O-N 2.84Å; R100-L104 PolarHBondContact O-N 3.42Å |
| 101 | K | 67.5 | Low | 69.4 | Low | 73 Ų | 73 | 104.7 Ų | 104.7 | 32% | 0.317 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -59.8 | -45.8 | 173.9 | 177.3 | -173.4 | 167.6 | -173.5 | 0 | 111.3 | W64 F97 L104 N105 | W64-K101 HydrophobicContact CH2-CD 3.38Å; W64-K101 HydrophobicContact CH2-CG 4.3Å; W64-K101 HydrophobicContact CZ2-CD 3.99Å; W64-K101 HydrophobicContact CZ3-CD 3.99Å; F97-K101 WeakPolarHBondContact O-CB 3.18Å; F97-K101 PolarHBondContact O-N 2.99Å; K101-L104 PolarHBondContact O-N 2.99Å; K101-N105 VanDerWaalsContact O-CB 3.28Å; K101-N105 WeakPolarHBondContact O-CB 3.19Å; K101-N105 PolarHBondContact O-N 3.24Å |
| 102 | H | 74.9 | Confident | 71.6 | Confident | 121 Ų | 121 | 103 Ų | 103 | 56% | 0.56 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.1 | -44.7 | 176.7 | -174.6 | 72.5 | 0 | 0 | 0 | 111.8 | Q98 H99 L104 N105 C106 | Q98-H102 WeakPolarHBondContact O-CB 3.42Å; Q98-H102 PolarHBondContact O-N 3.19Å; H99-H102 PolarHBondContact O-N 3.24Å; H102-L104 PolarHBondContact O-N 2.87Å; H102-N105 WeakPolarHBondContact O-CB 3.4Å; H102-N105 PolarHBondContact O-N 2.98Å; H102-N105 VanDerWaalsContact O-N 3.13Å; H102-C106 PolarHBondContact O-N 3.05Å; H102-C106 PolarHBondContact O-SG 3.49Å |
| 103 | A | 77.1 | Confident | 73.5 | Confident | 60 Ų | 60 | 105 Ų | 105 | 50% | 0.496 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -59.7 | -42.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | H99 R100 N105 C106 H107 | H99-A103 WeakPolarHBondContact O-CB 3.44Å; H99-A103 PolarHBondContact O-N 3.41Å; R100-A103 PolarHBondContact O-N 2.84Å; A103-N105 VanDerWaalsContact C-N 3.34Å; A103-C106 PolarHBondContact O-N 2.72Å; A103-H107 PolarHBondContact O-N 3.07Å; A103-H107 VanDerWaalsContact O-N 3.16Å |
| 104 | L | 73.2 | Confident | 75.4 | Confident | 134 Ų | 134 | 103.2 Ų | 103.2 | 70% | 0.702 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66.1 | -38.3 | 175.6 | -143.1 | 93.4 | 0 | 0 | 0 | 111.7 | R100 K101 H102 C106 H107 | R100-L104 PolarHBondContact O-N 3.42Å; K101-L104 PolarHBondContact O-N 2.99Å; H102-L104 PolarHBondContact O-N 2.87Å; L104-C106 VanDerWaalsContact C-N 3.31Å; L104-C106 PolarHBondContact O-N 2.65Å; L104-H107 WeakPolarHBondContact O-CB 3.23Å; L104-H107 PolarHBondContact O-N 3.38Å |
| 105 | N | 76 | Confident | 76.8 | Confident | 80 Ų | 80 | 102.2 Ų | 102.2 | 43% | 0.428 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.6 | -32.6 | -180 | -158.1 | 9 | 0 | 0 | 0 | 112.2 | K101 H102 A103 K110 | K101-N105 VanDerWaalsContact O-CB 3.28Å; K101-N105 WeakPolarHBondContact O-CB 3.19Å; K101-N105 PolarHBondContact O-N 3.24Å; H102-N105 WeakPolarHBondContact O-CB 3.4Å; H102-N105 PolarHBondContact O-N 2.98Å; H102-N105 VanDerWaalsContact O-N 3.13Å; A103-N105 VanDerWaalsContact C-N 3.34Å; N105-K110 WeakPolarHBondContact O-CD 3.47Å; N105-K110 PolarHBondContact OD1-NZ 3.19Å |
| 106 | C | 82.1 | Confident | 78.3 | Confident | 87 Ų | 87 | 99.3 Ų | 99.3 | 59% | 0.588 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.1 | 2.2 | 178.1 | -64.2 | 0 | 0 | 0 | 0 | 113.8 | H102 A103 L104 | H102-C106 PolarHBondContact O-N 3.05Å; H102-C106 PolarHBondContact O-SG 3.49Å; A103-C106 PolarHBondContact O-N 2.72Å; L104-C106 VanDerWaalsContact C-N 3.31Å; L104-C106 PolarHBondContact O-N 2.65Å |
| 107 | H | 83.6 | Confident | 79.4 | Confident | 105 Ų | 105 | 97.4 Ų | 97.4 | 49% | 0.486 | 49% | 0.494 | S | S | . | . | trans | -70.4 | 131.9 | -173.8 | -167.1 | -94.2 | 0 | 0 | 0 | 112.4 | A103 L104 M109 K110 | A103-H107 PolarHBondContact O-N 3.07Å; A103-H107 VanDerWaalsContact O-N 3.16Å; L104-H107 WeakPolarHBondContact O-CB 3.23Å; L104-H107 PolarHBondContact O-N 3.38Å; H107-M109 PolarHBondContact ND1-N 3.22Å; H107-M109 PolarHBondContact O-N 2.83Å; H107-M109 VanDerWaalsContact O-N 3.14Å; H107-K110 WeakPolarHBondContact O-CB 3.43Å; H107-K110 PolarHBondContact O-N 3.5Å | ||
| 108 | R | 88 | Confident | 80.5 | Confident | 241 Ų | 241 | 94 Ų | 94 | 91% | 0.909 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | -31.7 | -176.8 | -80.5 | 176.7 | 67.4 | -177.6 | 1.2 | 114.4 | K110 P111 | R108-K110 VanDerWaalsContact C-N 3.35Å; R108-P111 WeakPolarHBondContact O-CD 3.34Å |
| 109 | M | 87.6 | Confident | 81.5 | Confident | 127 Ų | 127 | 94.5 Ų | 94.5 | 63% | 0.626 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -5 | 179.2 | -61.6 | -170.6 | 70 | 0 | 0 | 114 | H107 A112 L113 | H107-M109 PolarHBondContact ND1-N 3.22Å; H107-M109 PolarHBondContact O-N 2.83Å; H107-M109 VanDerWaalsContact O-N 3.14Å; M109-A112 PolarHBondContact O-N 3.5Å; M109-A112 VanDerWaalsContact O-N 3.17Å; M109-L113 PolarHBondContact O-N 2.96Å |
| 110 | K | 83.6 | Confident | 82.2 | Confident | 38 Ų | 38 | 92.9 Ų | 92.9 | 17% | 0.165 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -53.5 | -46.7 | -178.8 | 173.8 | -178.6 | 169.9 | 174 | 0 | 112.6 | N105 H107 R108 A112 L113 F114 R224 | N105-K110 WeakPolarHBondContact O-CD 3.47Å; N105-K110 PolarHBondContact OD1-NZ 3.19Å; H107-K110 WeakPolarHBondContact O-CB 3.43Å; H107-K110 PolarHBondContact O-N 3.5Å; R108-K110 VanDerWaalsContact C-N 3.35Å; K110-A112 PolarHBondContact O-N 3Å; K110-L113 PolarHBondContact O-N 2.99Å; K110-F114 HydrophobicContact CG-CD1 4.04Å; K110-F114 HydrophobicContact CG-CE1 4.1Å; K110-F114 WeakPolarHBondContact O-CB 3.49Å; K110-F114 WeakPolarHBondContact O-CD1 3.34Å; K110-F114 PolarHBondContact O-N 3.23Å; K110-R224 PolarHBondContact NZ-O 2.74Å |
| 111 | P | 84.8 | Confident | 82.7 | Confident | 95 Ų | 95 | 87.1 Ų | 87.1 | 62% | 0.617 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -61.3 | -41.7 | 178.9 | -23.6 | 35.2 | 0 | 0 | 0 | 112.9 | R108 F114 S115 | R108-P111 WeakPolarHBondContact O-CD 3.34Å; P111-F114 PolarHBondContact O-N 2.73Å; P111-S115 PolarHBondContact O-N 3.48Å |
| 112 | A | 86.9 | Confident | 83.1 | Confident | 58 Ų | 58 | 85.7 Ų | 85.7 | 48% | 0.479 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -66.1 | -42.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | M109 K110 S115 V116 | M109-A112 PolarHBondContact O-N 3.5Å; M109-A112 VanDerWaalsContact O-N 3.17Å; K110-A112 PolarHBondContact O-N 3Å; A112-S115 WeakPolarHBondContact O-CB 3.46Å; A112-S115 PolarHBondContact O-N 3.49Å; A112-V116 WeakPolarHBondContact O-CG2 3.45Å; A112-V116 PolarHBondContact O-N 3.44Å; A112-V116 VanDerWaalsContact O-N 3.13Å |
| 113 | L | 85.8 | Confident | 83.2 | Confident | 104 Ų | 104 | 86.8 Ų | 86.8 | 55% | 0.545 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 176.5 | -176.2 | 66.3 | 0 | 0 | 0 | 111.7 | M109 K110 S115 V116 L117 | M109-L113 PolarHBondContact O-N 2.96Å; K110-L113 PolarHBondContact O-N 2.99Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 2.91Å; L113-V116 PolarHBondContact O-N 3.47Å; L113-L117 HydrophobicContact CD1-CD1 4.41Å; L113-L117 HydrophobicContact CG-CD1 4.02Å; L113-L117 WeakPolarHBondContact O-CB 3.18Å; L113-L117 VanDerWaalsContact O-CG 3.29Å; L113-L117 WeakPolarHBondContact O-CG 3.33Å; L113-L117 PolarHBondContact O-N 2.85Å |
| 114 | F | 88.2 | Confident | 83 | Confident | 41 Ų | 41 | 87.4 Ų | 87.4 | 18% | 0.18 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -60.8 | -41.1 | 175.4 | -92.4 | 46.3 | 0 | 0 | 0 | 111.5 | K110 P111 L117 C118 S223 R226 P227 | K110-F114 HydrophobicContact CG-CD1 4.04Å; K110-F114 HydrophobicContact CG-CE1 4.1Å; K110-F114 WeakPolarHBondContact O-CB 3.49Å; K110-F114 WeakPolarHBondContact O-CD1 3.34Å; K110-F114 PolarHBondContact O-N 3.23Å; P111-F114 PolarHBondContact O-N 2.73Å; F114-L117 PolarHBondContact O-N 2.99Å; F114-C118 WeakPolarHBondContact O-CB 3.39Å; F114-C118 PolarHBondContact O-N 3.33Å; F114-C118 PolarHBondContact O-SG 2.94Å; F114-S223 WeakPolarHBondContact CE2-O 3.34Å; F114-R226 WeakPolarHBondContact CE2-O 3.38Å; F114-P227 HydrophobicContact CD1-CG 4.2Å; F114-P227 HydrophobicContact CD2-CB 4.47Å; F114-P227 HydrophobicContact CD2-CG 4.3Å; F114-P227 HydrophobicContact CE1-CG 4.23Å; F114-P227 HydrophobicContact CE2-CG 4.35Å; F114-P227 HydrophobicContact CG-CG 4.22Å; F114-P227 HydrophobicContact CZ-CG 4.3Å |
| 115 | S | 86.9 | Confident | 82.4 | Confident | 62 Ų | 62 | 84.5 Ų | 84.5 | 43% | 0.434 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -58.5 | -50.5 | 176.1 | -166.2 | 0 | 0 | 0 | 0 | 112 | P111 A112 L113 L117 C118 E119 | P111-S115 PolarHBondContact O-N 3.48Å; A112-S115 WeakPolarHBondContact O-CB 3.46Å; A112-S115 PolarHBondContact O-N 3.49Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 2.91Å; S115-L117 PolarHBondContact O-N 3.2Å; S115-C118 PolarHBondContact O-N 2.83Å; S115-E119 PolarHBondContact O-N 3.12Å |
| 116 | V | 88.2 | Confident | 81.4 | Confident | 76 Ų | 76 | 81.7 Ų | 81.7 | 46% | 0.461 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -63.5 | -41.8 | 179.6 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | A112 L113 E119 I120 | A112-V116 WeakPolarHBondContact O-CG2 3.45Å; A112-V116 PolarHBondContact O-N 3.44Å; A112-V116 VanDerWaalsContact O-N 3.13Å; L113-V116 PolarHBondContact O-N 3.47Å; V116-E119 PolarHBondContact O-N 3.2Å; V116-I120 HydrophobicContact CG1-CD1 3.83Å; V116-I120 HydrophobicContact CG1-CG1 4.39Å; V116-I120 VanDerWaalsContact O-CG1 3.3Å; V116-I120 WeakPolarHBondContact O-CG1 3.38Å; V116-I120 PolarHBondContact O-N 3.44Å |
| 117 | L | 87.3 | Confident | 79.9 | Confident | 73 Ų | 73 | 82 Ų | 82 | 38% | 0.382 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.1 | -39.2 | 177.1 | -70.6 | 172.8 | 0 | 0 | 0 | 112 | L113 F114 S115 I120 K121 P227 | L113-L117 HydrophobicContact CD1-CD1 4.41Å; L113-L117 HydrophobicContact CG-CD1 4.02Å; L113-L117 WeakPolarHBondContact O-CB 3.18Å; L113-L117 VanDerWaalsContact O-CG 3.29Å; L113-L117 WeakPolarHBondContact O-CG 3.33Å; L113-L117 PolarHBondContact O-N 2.85Å; F114-L117 PolarHBondContact O-N 2.99Å; S115-L117 PolarHBondContact O-N 3.2Å; L117-I120 PolarHBondContact O-N 3.42Å; L117-K121 VanDerWaalsContact O-CB 3.26Å; L117-K121 WeakPolarHBondContact O-CB 3.47Å; L117-K121 PolarHBondContact O-N 2.96Å; L117-P227 HydrophobicContact CB-CB 3.94Å; L117-P227 HydrophobicContact CB-CG 3.8Å; L117-P227 HydrophobicContact CD1-CG 3.68Å; L117-P227 HydrophobicContact CG-CG 4.4Å |
| 118 | C | 86.2 | Confident | 78.3 | Confident | 19 Ų | 19 | 83.9 Ų | 83.9 | 13% | 0.128 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -61.1 | -47.5 | 171.9 | -74.9 | 0 | 0 | 0 | 0 | 111 | F114 S115 I120 K121 E122 I228 | F114-C118 WeakPolarHBondContact O-CB 3.39Å; F114-C118 PolarHBondContact O-N 3.33Å; F114-C118 PolarHBondContact O-SG 2.94Å; S115-C118 PolarHBondContact O-N 2.83Å; C118-I120 PolarHBondContact O-N 2.98Å; C118-K121 WeakPolarHBondContact O-CB 3.44Å; C118-K121 PolarHBondContact O-N 3.4Å; C118-E122 WeakPolarHBondContact O-CG 3.42Å; C118-E122 PolarHBondContact O-N 3.45Å; C118-I228 PolarHBondContact SG-O 3.03Å |
| 119 | E | 84.7 | Confident | 76.6 | Confident | 89 Ų | 89 | 82.2 Ų | 82.2 | 42% | 0.416 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -60.5 | -43.1 | 177.1 | -75.9 | -177.8 | -146.3 | 0 | 0 | 113.3 | S115 V116 K121 E122 K123 | S115-E119 PolarHBondContact O-N 3.12Å; V116-E119 PolarHBondContact O-N 3.2Å; E119-K121 VanDerWaalsContact C-N 3.34Å; E119-E122 PolarHBondContact O-N 3.38Å; E119-K123 WeakPolarHBondContact O-CB 3.4Å; E119-K123 VanDerWaalsContact O-CG 3.31Å; E119-K123 WeakPolarHBondContact O-CG 3.36Å; E119-K123 PolarHBondContact O-N 3.22Å; E119-K123 IonicContact OE2-NZ 3.77Å; E119-K123 PolarHBondContact OE2-NZ 3.01Å |
| 120 | I | 84.6 | Confident | 74.7 | Confident | 88 Ų | 88 | 79.2 Ų | 79.2 | 45% | 0.451 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.1 | -46.5 | 176.3 | -69.4 | 167.7 | 0 | 0 | 0 | 109.3 | V116 L117 C118 E122 K123 T124 | V116-I120 HydrophobicContact CG1-CD1 3.83Å; V116-I120 HydrophobicContact CG1-CG1 4.39Å; V116-I120 VanDerWaalsContact O-CG1 3.3Å; V116-I120 WeakPolarHBondContact O-CG1 3.38Å; V116-I120 PolarHBondContact O-N 3.44Å; L117-I120 PolarHBondContact O-N 3.42Å; C118-I120 PolarHBondContact O-N 2.98Å; I120-E122 VanDerWaalsContact C-N 3.29Å; I120-E122 PolarHBondContact O-N 3.22Å; I120-K123 PolarHBondContact O-N 2.75Å; I120-T124 HydrophobicContact CG2-CG2 4.34Å; I120-T124 WeakPolarHBondContact O-CB 3.44Å; I120-T124 PolarHBondContact O-N 3.5Å; I120-T124 PolarHBondContact O-OG1 3.48Å |
| 121 | K | 79 | Confident | 72.8 | Confident | 59 Ų | 59 | 84 Ų | 84 | 26% | 0.257 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.2 | -38.7 | 177.9 | -167 | -179.8 | -176.7 | -172.4 | 0 | 111.3 | L117 C118 E119 V125 E232 | L117-K121 VanDerWaalsContact O-CB 3.26Å; L117-K121 WeakPolarHBondContact O-CB 3.47Å; L117-K121 PolarHBondContact O-N 2.96Å; C118-K121 WeakPolarHBondContact O-CB 3.44Å; C118-K121 PolarHBondContact O-N 3.4Å; E119-K121 VanDerWaalsContact C-N 3.34Å; K121-V125 HydrophobicContact CG-CB 4.27Å; K121-V125 HydrophobicContact CG-CG2 3.98Å; K121-V125 WeakPolarHBondContact O-CA 3.36Å; K121-V125 VanDerWaalsContact O-CB 3.23Å; K121-V125 WeakPolarHBondContact O-CB 3.35Å; K121-V125 PolarHBondContact O-N 3.47Å; K121-E232 WeakPolarHBondContact CE-OE2 3.49Å; K121-E232 IonicContact NZ-OE1 3.87Å; K121-E232 PolarHBondContact NZ-OE1 3.39Å; K121-E232 IonicContact NZ-OE2 2.77Å; K121-E232 PolarHBondContact NZ-OE2 3.02Å |
| 122 | E | 76.4 | Confident | 71.1 | Confident | 43 Ų | 43 | 84.8 Ų | 84.8 | 20% | 0.201 | 46% | 0.464 | C | S | . | . | I | π-helix | trans | -62.2 | -49.9 | 173.7 | -71.2 | -170.9 | -167.4 | 0 | 0 | 111.9 | C118 E119 I120 T124 L126 S229 K231 | C118-E122 WeakPolarHBondContact O-CG 3.42Å; C118-E122 PolarHBondContact O-N 3.45Å; E119-E122 PolarHBondContact O-N 3.38Å; I120-E122 VanDerWaalsContact C-N 3.29Å; I120-E122 PolarHBondContact O-N 3.22Å; E122-T124 VanDerWaalsContact C-N 3.33Å; E122-T124 PolarHBondContact O-N 3.02Å; E122-L126 HydrophobicContact CB-CD1 3.89Å; E122-L126 HydrophobicContact CG-CD1 3.64Å; E122-L126 VanDerWaalsContact O-CB 3.23Å; E122-L126 WeakPolarHBondContact O-CB 3.35Å; E122-L126 PolarHBondContact O-N 2.98Å; E122-S229 VanDerWaalsContact CD-OG 3.26Å; E122-S229 WeakPolarHBondContact CG-OG 3.44Å; E122-S229 PolarHBondContact OE1-OG 3.07Å; E122-K231 HydrophobicContact CG-CD 4.3Å; E122-K231 WeakPolarHBondContact OE2-CE 3.23Å; E122-K231 IonicContact OE2-NZ 2.62Å; E122-K231 PolarHBondContact OE2-NZ 2.9Å |
| 123 | K | 76.8 | Confident | 69.3 | Low | 144 Ų | 144 | 90 Ų | 90 | 63% | 0.626 | 48% | 0.479 | S | S | * | . | I | π-helix | trans | -67.1 | -32.7 | -177.5 | -69.8 | 166.3 | -177.8 | 162.9 | 0 | 112.9 | E119 I120 S127 | E119-K123 WeakPolarHBondContact O-CB 3.4Å; E119-K123 VanDerWaalsContact O-CG 3.31Å; E119-K123 WeakPolarHBondContact O-CG 3.36Å; E119-K123 PolarHBondContact O-N 3.22Å; E119-K123 IonicContact OE2-NZ 3.77Å; E119-K123 PolarHBondContact OE2-NZ 3.01Å; I120-K123 PolarHBondContact O-N 2.75Å; K123-S127 WeakPolarHBondContact O-CB 3.34Å |
| 124 | T | 73.4 | Confident | 67.6 | Low | 72 Ų | 72 | 94.2 Ų | 94.2 | 44% | 0.442 | 50% | 0.496 | S | S | . | . | I | π-helix | trans | -97.7 | -39.9 | -174.6 | 52.6 | 0 | 0 | 0 | 0 | 114 | I120 E122 I128 | I120-T124 HydrophobicContact CG2-CG2 4.34Å; I120-T124 WeakPolarHBondContact O-CB 3.44Å; I120-T124 PolarHBondContact O-N 3.5Å; I120-T124 PolarHBondContact O-OG1 3.48Å; E122-T124 VanDerWaalsContact C-N 3.33Å; E122-T124 PolarHBondContact O-N 3.02Å; T124-I128 WeakPolarHBondContact O-CD1 3.39Å; T124-I128 VanDerWaalsContact O-CG1 3.31Å; T124-I128 WeakPolarHBondContact O-CG1 3.47Å |
| 125 | V | 59.3 | Low | 66.1 | Low | 73 Ų | 73 | 96.7 Ų | 96.7 | 44% | 0.442 | 51% | 0.511 | S | S | . | . | I | π-helix | trans | -96.3 | -35.4 | -173.4 | -178.3 | 0 | 0 | 0 | 0 | 112.1 | K121 | K121-V125 HydrophobicContact CG-CB 4.27Å; K121-V125 HydrophobicContact CG-CG2 3.98Å; K121-V125 WeakPolarHBondContact O-CA 3.36Å; K121-V125 VanDerWaalsContact O-CB 3.23Å; K121-V125 WeakPolarHBondContact O-CB 3.35Å; K121-V125 PolarHBondContact O-N 3.47Å |
| 126 | L | 56.1 | Low | 64.9 | Low | 21 Ų | 21 | 98.7 Ų | 98.7 | 11% | 0.11 | 52% | 0.522 | C | S | . | . | I | π-helix | trans | -82.3 | -25.1 | -179.2 | -54 | 179.4 | 0 | 0 | 0 | 113.3 | E122 I128 K231 | E122-L126 HydrophobicContact CB-CD1 3.89Å; E122-L126 HydrophobicContact CG-CD1 3.64Å; E122-L126 VanDerWaalsContact O-CB 3.23Å; E122-L126 WeakPolarHBondContact O-CB 3.35Å; E122-L126 PolarHBondContact O-N 2.98Å; L126-I128 PolarHBondContact O-N 2.89Å; L126-K231 HydrophobicContact CD1-CB 3.43Å; L126-K231 VanDerWaalsContact CD1-CB 3.43Å; L126-K231 HydrophobicContact CD1-CD 3.51Å; L126-K231 HydrophobicContact CD1-CG 4.13Å |
| 127 | S | 50.3 | Low | 63.8 | Low | 95 Ų | 95 | 100.1 Ų | 100.1 | 66% | 0.664 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -19.1 | 175.3 | -168.7 | 0 | 0 | 0 | 0 | 113.1 | K123 | K123-S127 WeakPolarHBondContact O-CB 3.34Š|
| 128 | I | 50.8 | Low | 63.4 | Low | 144 Ų | 144 | 99.9 Ų | 99.9 | 74% | 0.738 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | -27.1 | -175.1 | -62.5 | 175.8 | 0 | 0 | 0 | 112.4 | T124 L126 | T124-I128 WeakPolarHBondContact O-CD1 3.39Å; T124-I128 VanDerWaalsContact O-CG1 3.31Å; T124-I128 WeakPolarHBondContact O-CG1 3.47Å; L126-I128 PolarHBondContact O-N 2.89Å |
| 129 | R | 52.4 | Low | 63.3 | Low | 206 Ų | 206 | 103.6 Ų | 103.6 | 78% | 0.777 | 56% | 0.556 | S | S | * | * | S | Bend | trans | -110.7 | 95.6 | 170.6 | -83.5 | -176.2 | 173.8 | -174 | -1.1 | 107.6 | ||
| 130 | G | 46.5 | Very low | 63.2 | Low | 64 Ų | 64 | 104.1 Ų | 104.1 | 66% | 0.66 | 56% | 0.558 | S | S | * | * | trans | -32.2 | 135.4 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q132 | G130-Q132 VanDerWaalsContact C-N 3.27Å; G130-Q132 PolarHBondContact O-N 2.93Å | ||
| 131 | V | 43.7 | Very low | 63.2 | Low | 138 Ų | 138 | 100.8 Ų | 100.8 | 84% | 0.836 | 54% | 0.542 | S | S | * | . | trans | -50.2 | 98.4 | 160.5 | 178.8 | 0 | 0 | 0 | 0 | 106.3 | E133 | V131-E133 VanDerWaalsContact C-N 3.33Å; V131-E133 PolarHBondContact O-N 3.49Å | ||
| 132 | Q | 49.2 | Very low | 63.5 | Low | 112 Ų | 112 | 103.1 Ų | 103.1 | 52% | 0.523 | 56% | 0.555 | S | S | . | * | trans | -75.5 | 100.1 | 172.2 | -160.2 | 164.9 | 6.5 | 0 | 0 | 104.1 | G130 D135 | G130-Q132 VanDerWaalsContact C-N 3.27Å; G130-Q132 PolarHBondContact O-N 2.93Å; Q132-D135 PolarHBondContact NE2-OD2 3.06Å | ||
| 133 | E | 49.9 | Very low | 64.1 | Low | 168 Ų | 168 | 109.7 Ų | 109.7 | 79% | 0.785 | 58% | 0.577 | S | S | * | * | trans | -34.9 | 140.1 | 159.3 | -95.3 | 176 | 141.1 | 0 | 0 | 108.8 | V131 D135 | V131-E133 VanDerWaalsContact C-N 3.33Å; V131-E133 PolarHBondContact O-N 3.49Å; E133-D135 PolarHBondContact O-N 3.24Å | ||
| 134 | E | 49.1 | Very low | 64.7 | Low | 192 Ų | 192 | 103.1 Ų | 103.1 | 90% | 0.897 | 55% | 0.549 | S | S | * | . | trans | -45.5 | 104.8 | 170.2 | -97.2 | -127.5 | 129.5 | 0 | 0 | 108.9 | ||||
| 135 | D | 56.5 | Low | 65.3 | Low | 92 Ų | 92 | 101.5 Ų | 101.5 | 49% | 0.492 | 54% | 0.538 | S | S | . | . | P | Polyproline II helix | trans | -61.4 | 130.1 | 177 | -85.3 | -58.3 | 0 | 0 | 0 | 106.6 | Q132 E133 R242 | Q132-D135 PolarHBondContact NE2-OD2 3.06Å; E133-D135 PolarHBondContact O-N 3.24Å; D135-R242 IonicContact OD2-NH2 3.45Å |
| 136 | P | 62.3 | Low | 66.7 | Low | 105 Ų | 105 | 102.5 Ų | 102.5 | 68% | 0.682 | 54% | 0.541 | S | S | * | . | P | Polyproline II helix | trans | -54.1 | 149 | 176.6 | 21.5 | -31.4 | 0 | 0 | 0 | 110.1 | D138 | P136-D138 PolarHBondContact O-N 3.48Š|
| 137 | P | 65.9 | Low | 68.2 | Low | 106 Ų | 106 | 104.4 Ų | 104.4 | 69% | 0.688 | 55% | 0.55 | S | S | * | . | P | Polyproline II helix | trans | -53.6 | 132.9 | -178.6 | 20.1 | -31.2 | 0 | 0 | 0 | 110.1 | P139 | P137-P139 WeakPolarHBondContact O-CD 3.3Å; P137-P139 VanDerWaalsContact O-N 3.09Å |
| 138 | D | 77.4 | Confident | 70.1 | Confident | 67 Ų | 67 | 100 Ų | 100 | 36% | 0.358 | 52% | 0.519 | S | S | . | . | P | Polyproline II helix | trans | -50.3 | 117.5 | -174.3 | -177.7 | -15.6 | 0 | 0 | 0 | 110.4 | P136 Q140 I141 M142 | P136-D138 PolarHBondContact O-N 3.48Å; D138-Q140 PolarHBondContact O-N 3.11Å; D138-Q140 WeakPolarHBondContact OD1-CB 3.36Å; D138-Q140 PolarHBondContact OD1-N 2.78Å; D138-I141 HydrophobicContact CB-CB 4.15Å; D138-I141 HydrophobicContact CB-CD1 3.89Å; D138-I141 HydrophobicContact CB-CG1 3.88Å; D138-I141 PolarHBondContact O-N 3.05Å; D138-M142 PolarHBondContact O-N 3.41Å; D138-M142 VanDerWaalsContact O-N 3.08Å |
| 139 | P | 84.2 | Confident | 71.8 | Confident | 97 Ų | 97 | 97.2 Ų | 97.2 | 63% | 0.63 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -53.9 | -30.3 | -179.4 | -26.7 | 33.9 | 0 | 0 | 0 | 113.3 | P137 R143 | P137-P139 WeakPolarHBondContact O-CD 3.3Å; P137-P139 VanDerWaalsContact O-N 3.09Å; P139-R143 WeakPolarHBondContact O-CB 3.35Å; P139-R143 PolarHBondContact O-N 3.15Å |
| 140 | Q | 82.8 | Confident | 73.3 | Confident | 100 Ų | 100 | 91 Ų | 91 | 47% | 0.467 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.9 | -43 | 178.6 | -174.1 | 167 | -15.6 | 0 | 0 | 111.7 | D138 M142 R143 L144 M249 | D138-Q140 PolarHBondContact O-N 3.11Å; D138-Q140 WeakPolarHBondContact OD1-CB 3.36Å; D138-Q140 PolarHBondContact OD1-N 2.78Å; Q140-M142 VanDerWaalsContact C-N 3.32Å; Q140-M142 PolarHBondContact O-N 3.19Å; Q140-R143 PolarHBondContact O-N 3.02Å; Q140-L144 WeakPolarHBondContact O-CG 3.49Å; Q140-L144 PolarHBondContact O-N 2.95Å; Q140-M249 HydrophobicContact CB-SD 4.34Å; Q140-M249 HydrophobicContact CG-SD 3.98Å |
| 141 | I | 85.3 | Confident | 75.1 | Confident | 19 Ų | 19 | 89.7 Ų | 89.7 | 10% | 0.097 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -60.9 | -45.3 | 174.9 | -65.2 | -179 | 0 | 0 | 0 | 109.9 | D138 R143 L144 D145 M249 K252 | D138-I141 HydrophobicContact CB-CB 4.15Å; D138-I141 HydrophobicContact CB-CD1 3.89Å; D138-I141 HydrophobicContact CB-CG1 3.88Å; D138-I141 PolarHBondContact O-N 3.05Å; I141-R143 VanDerWaalsContact C-N 3.32Å; I141-R143 PolarHBondContact O-N 3.06Å; I141-L144 WeakPolarHBondContact O-CB 3.37Å; I141-L144 PolarHBondContact O-N 3.06Å; I141-L144 VanDerWaalsContact O-N 3.13Å; I141-D145 PolarHBondContact O-N 2.91Å; I141-M249 HydrophobicContact CD1-CB 4.22Å; I141-M249 HydrophobicContact CG1-CB 3.93Å; I141-M249 HydrophobicContact CG1-CG 4.2Å; I141-K252 HydrophobicContact CG2-CD 4.22Å |
| 142 | M | 85.8 | Confident | 76.9 | Confident | 107 Ų | 107 | 84 Ų | 84 | 53% | 0.527 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63.7 | -37.2 | 179.7 | -164.5 | 178 | 71.8 | 0 | 0 | 112.4 | D138 Q140 D145 N146 | D138-M142 PolarHBondContact O-N 3.41Å; D138-M142 VanDerWaalsContact O-N 3.08Å; Q140-M142 VanDerWaalsContact C-N 3.32Å; Q140-M142 PolarHBondContact O-N 3.19Å; M142-D145 PolarHBondContact O-N 3.27Å; M142-N146 PolarHBondContact O-N 3.44Å; M142-N146 VanDerWaalsContact O-N 3.07Å; M142-N146 PolarHBondContact O-ND2 2.89Å |
| 143 | R | 88.4 | Confident | 78.4 | Confident | 181 Ų | 181 | 78.7 Ų | 78.7 | 68% | 0.683 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -63.1 | -43 | 173.4 | -178.1 | -178.5 | 177.4 | -175.7 | -0.6 | 111.7 | P139 Q140 I141 N146 M147 | P139-R143 WeakPolarHBondContact O-CB 3.35Å; P139-R143 PolarHBondContact O-N 3.15Å; Q140-R143 PolarHBondContact O-N 3.02Å; I141-R143 VanDerWaalsContact C-N 3.32Å; I141-R143 PolarHBondContact O-N 3.06Å; R143-N146 PolarHBondContact O-N 2.93Å; R143-M147 PolarHBondContact O-N 3.33Å; R143-M147 VanDerWaalsContact O-N 3.09Å |
| 144 | L | 88.9 | Confident | 79.7 | Confident | 6 Ų | 6 | 72.1 Ų | 72.1 | 3% | 0.031 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -65.9 | -40 | 177.7 | -68.6 | 169.2 | 0 | 0 | 0 | 111.4 | Q140 I141 N146 M147 L148 M249 K252 Q253 C256 | Q140-L144 WeakPolarHBondContact O-CG 3.49Å; Q140-L144 PolarHBondContact O-N 2.95Å; I141-L144 WeakPolarHBondContact O-CB 3.37Å; I141-L144 PolarHBondContact O-N 3.06Å; I141-L144 VanDerWaalsContact O-N 3.13Å; L144-N146 PolarHBondContact O-N 3.08Å; L144-M147 WeakPolarHBondContact O-CB 3.31Å; L144-M147 PolarHBondContact O-N 3.45Å; L144-M147 VanDerWaalsContact O-N 3.12Å; L144-L148 WeakPolarHBondContact O-CG 3.44Å; L144-L148 PolarHBondContact O-N 2.94Å; L144-M249 HydrophobicContact CD1-CG 4.13Å; L144-K252 HydrophobicContact CB-CB 3.88Å; L144-K252 HydrophobicContact CB-CD 4.45Å; L144-K252 HydrophobicContact CD1-CB 3.99Å; L144-K252 HydrophobicContact CG-CB 4.48Å; L144-Q253 HydrophobicContact CD1-CB 4.16Å; L144-C256 HydrophobicContact CD2-CB 4.15Å |
| 145 | D | 87.3 | Confident | 80.5 | Confident | 38 Ų | 38 | 64.3 Ų | 64.3 | 20% | 0.203 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.6 | -48.3 | 174.5 | -79.4 | -37.9 | 0 | 0 | 0 | 112.4 | I141 M142 M147 L148 L149 K252 | I141-D145 PolarHBondContact O-N 2.91Å; M142-D145 PolarHBondContact O-N 3.27Å; D145-M147 PolarHBondContact O-N 3.09Å; D145-L148 PolarHBondContact O-N 2.72Å; D145-L149 VanDerWaalsContact O-CB 3.3Å; D145-L149 WeakPolarHBondContact O-CB 3.33Å; D145-L149 WeakPolarHBondContact O-CD1 3.36Å; D145-L149 VanDerWaalsContact O-CG 3.31Å; D145-L149 WeakPolarHBondContact O-CG 3.48Å; D145-L149 PolarHBondContact O-N 3.35Å; D145-K252 WeakPolarHBondContact OD1-CD 3.37Å; D145-K252 WeakPolarHBondContact OD1-CE 3.44Å; D145-K252 IonicContact OD1-NZ 2.88Å; D145-K252 PolarHBondContact OD1-NZ 3.35Å; D145-K252 IonicContact OD2-NZ 3.99Å; D145-K252 PolarHBondContact OD2-NZ 2.96Å |
| 146 | N | 88.9 | Confident | 80.5 | Confident | 94 Ų | 94 | 66 Ų | 66 | 50% | 0.503 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.9 | -35.1 | 176.1 | -73.2 | -52.2 | 0 | 0 | 0 | 112.2 | M142 R143 L144 A150 | M142-N146 PolarHBondContact O-N 3.44Å; M142-N146 VanDerWaalsContact O-N 3.07Å; M142-N146 PolarHBondContact O-ND2 2.89Å; R143-N146 PolarHBondContact O-N 2.93Å; L144-N146 PolarHBondContact O-N 3.08Å; N146-A150 WeakPolarHBondContact O-CB 3.31Å; N146-A150 PolarHBondContact O-N 3.22Å |
| 147 | M | 87.3 | Confident | 80.1 | Confident | 62 Ų | 62 | 68.2 Ų | 68.2 | 31% | 0.305 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -68 | -45.5 | 176.4 | -168.1 | -177.4 | -59.5 | 0 | 0 | 111.8 | R143 L144 D145 A150 E151 C256 | R143-M147 PolarHBondContact O-N 3.33Å; R143-M147 VanDerWaalsContact O-N 3.09Å; L144-M147 WeakPolarHBondContact O-CB 3.31Å; L144-M147 PolarHBondContact O-N 3.45Å; L144-M147 VanDerWaalsContact O-N 3.12Å; D145-M147 PolarHBondContact O-N 3.09Å; M147-A150 PolarHBondContact O-N 2.79Å; M147-E151 PolarHBondContact O-N 3.08Å; M147-C256 HydrophobicContact SD-CB 3.58Å; M147-C256 VanDerWaalsContact SD-CB 3.58Å |
| 148 | L | 88.8 | Confident | 79.1 | Confident | 1 Ų | 1 | 73.1 Ų | 73.1 | 1% | 0.005 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -66.6 | -38.7 | 177 | -66.3 | 177.5 | 0 | 0 | 0 | 111.7 | L144 D145 E151 G152 V153 S154 Y197 K252 T255 C256 | L144-L148 WeakPolarHBondContact O-CG 3.44Å; L144-L148 PolarHBondContact O-N 2.94Å; D145-L148 PolarHBondContact O-N 2.72Å; L148-E151 PolarHBondContact O-N 3Å; L148-G152 PolarHBondContact O-N 3.39Å; L148-G152 VanDerWaalsContact O-N 3.16Å; L148-V153 HydrophobicContact CB-CB 4.23Å; L148-V153 HydrophobicContact CD2-CB 4.03Å; L148-V153 HydrophobicContact CD2-CG1 3.86Å; L148-V153 WeakPolarHBondContact O-CA 3.3Å; L148-V153 PolarHBondContact O-N 2.88Å; L148-S154 PolarHBondContact O-N 3.04Å; L148-Y197 HydrophobicContact CD1-CD2 4.48Å; L148-Y197 HydrophobicContact CD1-CE1 4.42Å; L148-Y197 HydrophobicContact CD1-CE2 3.86Å; L148-K252 HydrophobicContact CD1-CB 3.96Å; L148-K252 HydrophobicContact CD1-CG 3.85Å; L148-T255 HydrophobicContact CD2-CG2 3.55Å; L148-C256 WeakPolarHBondContact CD2-SG 3.25Å |
| 149 | L | 87.4 | Confident | 77.5 | Confident | 86 Ų | 86 | 72.5 Ų | 72.5 | 45% | 0.45 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.8 | -46 | 174 | -80.6 | 160.1 | 0 | 0 | 0 | 111.6 | D145 E151 G152 S154 | D145-L149 VanDerWaalsContact O-CB 3.3Å; D145-L149 WeakPolarHBondContact O-CB 3.33Å; D145-L149 WeakPolarHBondContact O-CD1 3.36Å; D145-L149 VanDerWaalsContact O-CG 3.31Å; D145-L149 WeakPolarHBondContact O-CG 3.48Å; D145-L149 PolarHBondContact O-N 3.35Å; L149-E151 VanDerWaalsContact C-N 3.29Å; L149-E151 PolarHBondContact O-N 3.31Å; L149-G152 PolarHBondContact O-N 3.12Å; L149-S154 WeakPolarHBondContact CA-O 3.5Å; L149-S154 WeakPolarHBondContact CD2-O 3.36Å |
| 150 | A | 84 | Confident | 75.6 | Confident | 77 Ų | 77 | 69.8 Ų | 69.8 | 64% | 0.636 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -62.5 | -35.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | N146 M147 G152 | N146-A150 WeakPolarHBondContact O-CB 3.31Å; N146-A150 PolarHBondContact O-N 3.22Å; M147-A150 PolarHBondContact O-N 2.79Å; A150-G152 PolarHBondContact O-N 3.27Å |
| 151 | E | 83.8 | Confident | 73.9 | Confident | 35 Ų | 35 | 66.2 Ų | 66.2 | 16% | 0.164 | 38% | 0.38 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | 2.6 | 177.3 | -64.9 | -73.2 | 170.3 | 0 | 0 | 112.4 | M147 L148 L149 V153 V259 R263 | M147-E151 PolarHBondContact O-N 3.08Å; L148-E151 PolarHBondContact O-N 3Å; L149-E151 VanDerWaalsContact C-N 3.29Å; L149-E151 PolarHBondContact O-N 3.31Å; E151-V153 HydrophobicContact CB-CG2 4.15Å; E151-V153 PolarHBondContact O-N 3.13Å; E151-V259 HydrophobicContact CB-CG1 3.91Å; E151-V259 HydrophobicContact CG-CG1 3.64Å; E151-R263 IonicContact OE1-CZ 3.82Å; E151-R263 IonicContact OE1-NH1 3.81Å; E151-R263 PolarHBondContact OE1-NH1 2.87Å |
| 152 | G | 80.9 | Confident | 72.3 | Confident | 19 Ų | 19 | 69.1 Ų | 69.1 | 20% | 0.196 | 40% | 0.402 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 65.8 | 26.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | L148 L149 A150 R194 | L148-G152 PolarHBondContact O-N 3.39Å; L148-G152 VanDerWaalsContact O-N 3.16Å; L149-G152 PolarHBondContact O-N 3.12Å; A150-G152 PolarHBondContact O-N 3.27Å; G152-R194 WeakPolarHBondContact O-CD 3.36Å; G152-R194 PolarHBondContact O-NH1 3.07Å |
| 153 | V | 82 | Confident | 70.7 | Confident | 1 Ų | 1 | 67 Ų | 67 | 1% | 0.006 | 40% | 0.402 | C | S | . | . | S | Bend | trans | -88.8 | -30.6 | 178.2 | 177.9 | 0 | 0 | 0 | 0 | 112.8 | L148 E151 L190 R194 Y197 H198 T255 V259 | L148-V153 HydrophobicContact CB-CB 4.23Å; L148-V153 HydrophobicContact CD2-CB 4.03Å; L148-V153 HydrophobicContact CD2-CG1 3.86Å; L148-V153 WeakPolarHBondContact O-CA 3.3Å; L148-V153 PolarHBondContact O-N 2.88Å; E151-V153 HydrophobicContact CB-CG2 4.15Å; E151-V153 PolarHBondContact O-N 3.13Å; V153-L190 HydrophobicContact CG2-CD1 4.14Å; V153-R194 HydrophobicContact CB-CG 4.13Å; V153-R194 HydrophobicContact CG1-CG 4.12Å; V153-R194 HydrophobicContact CG2-CG 3.91Å; V153-Y197 HydrophobicContact CG1-CD1 3.86Å; V153-Y197 HydrophobicContact CG1-CG 4.07Å; V153-H198 PolarHBondContact O-CE1 3.5Å; V153-T255 HydrophobicContact CG1-CG2 3.67Å; V153-V259 HydrophobicContact CG2-CG2 3.86Å |
| 154 | S | 77.5 | Confident | 69 | Low | 29 Ų | 29 | 59.6 Ų | 59.6 | 20% | 0.203 | 38% | 0.379 | C | S | . | . | S | Bend | trans | -121.5 | 144.6 | 172.1 | -162.8 | 0 | 0 | 0 | 0 | 108.9 | L148 L149 | L148-S154 PolarHBondContact O-N 3.04Å; L149-S154 WeakPolarHBondContact CA-O 3.5Å; L149-S154 WeakPolarHBondContact CD2-O 3.36Å |
| 155 | G | 66 | Low | 67.3 | Low | 29 Ų | 29 | 60.8 Ų | 60.8 | 30% | 0.299 | 39% | 0.389 | S | S | . | . | S | Bend | trans | 135.9 | 162.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | E157 | G155-E157 PolarHBondContact O-N 2.98Š|
| 156 | P | 55.1 | Low | 65.7 | Low | 128 Ų | 128 | 61.6 Ų | 61.6 | 83% | 0.831 | 40% | 0.402 | S | S | * | . | trans | -60.4 | 115.4 | -175.4 | 22.3 | -30.9 | 0 | 0 | 0 | 110.9 | K158 | P156-K158 PolarHBondContact O-N 3.44Š| ||
| 157 | E | 54.3 | Low | 64.2 | Low | 150 Ų | 150 | 60.1 Ų | 60.1 | 70% | 0.701 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | 21.1 | -167.4 | -72.1 | -93.4 | 100.1 | 0 | 0 | 117.1 | G155 H198 | G155-E157 PolarHBondContact O-N 2.98Å; E157-H198 IonicContact OE1-CE1 3.3Å; E157-H198 IonicContact OE1-NE2 2.78Å |
| 158 | K | 44.7 | Very low | 62.6 | Low | 210 Ų | 210 | 58.8 Ų | 58.8 | 91% | 0.913 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.7 | 11.1 | -174.3 | -82.1 | -166.8 | 175.6 | -179.4 | 0 | 117.8 | P156 | P156-K158 PolarHBondContact O-N 3.44Š|
| 159 | G | 43.3 | Very low | 60.9 | Low | 53 Ų | 53 | 61.2 Ų | 61.2 | 55% | 0.546 | 42% | 0.422 | S | S | . | . | S | Bend | trans | -176.6 | -10.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 119.1 | G161 S162 | G159-G161 PolarHBondContact O-N 3.26Å; G159-S162 PolarHBondContact O-N 2.78Å |
| 160 | G | 44.8 | Very low | 59.4 | Low | 40 Ų | 40 | 61.3 Ų | 61.3 | 41% | 0.412 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -70.7 | -29.1 | -169.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | S162 A163 A164 | G160-S162 PolarHBondContact O-N 3.37Å; G160-A163 PolarHBondContact O-N 3.01Å; G160-A163 VanDerWaalsContact O-N 3.12Å; G160-A164 PolarHBondContact O-N 3.16Å; G160-A164 VanDerWaalsContact O-N 3.11Å |
| 161 | G | 47.7 | Very low | 58.1 | Low | 26 Ų | 26 | 61.1 Ų | 61.1 | 27% | 0.268 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.2 | -23.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | G159 A165 | G159-G161 PolarHBondContact O-N 3.26Å; G161-A165 WeakPolarHBondContact O-CB 3.11Å |
| 162 | S | 52.3 | Low | 56.7 | Low | 80 Ų | 80 | 60.5 Ų | 60.5 | 56% | 0.559 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -77.3 | -42 | 173.2 | 179.8 | 0 | 0 | 0 | 0 | 111.5 | G159 G160 A166 | G159-S162 PolarHBondContact O-N 2.78Å; G160-S162 PolarHBondContact O-N 3.37Å; S162-A166 WeakPolarHBondContact O-CB 3.3Å; S162-A166 PolarHBondContact O-N 3.27Å |
| 163 | A | 51.7 | Low | 55.1 | Low | 63 Ų | 63 | 63.9 Ų | 63.9 | 52% | 0.521 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -70.9 | -41.9 | -176 | 0 | 0 | 0 | 0 | 0 | 112.9 | G160 A166 A167 | G160-A163 PolarHBondContact O-N 3.01Å; G160-A163 VanDerWaalsContact O-N 3.12Å; A163-A166 PolarHBondContact O-N 3.36Å; A163-A167 WeakPolarHBondContact O-CB 3.15Å; A163-A167 PolarHBondContact O-N 2.89Å |
| 164 | A | 53.3 | Low | 53.6 | Low | 25 Ų | 25 | 66.6 Ų | 66.6 | 21% | 0.207 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -67.6 | -39.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | G160 A167 A168 | G160-A164 PolarHBondContact O-N 3.16Å; G160-A164 VanDerWaalsContact O-N 3.11Å; A164-A167 PolarHBondContact O-N 2.88Å; A164-A168 WeakPolarHBondContact O-CB 3.35Å; A164-A168 PolarHBondContact O-N 3.42Å |
| 165 | A | 51.6 | Low | 52.1 | Low | 30 Ų | 30 | 69.7 Ų | 69.7 | 25% | 0.248 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -66.8 | -38.2 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | G161 A169 | G161-A165 WeakPolarHBondContact O-CB 3.11Å; A165-A169 VanDerWaalsContact O-CB 3.29Å; A165-A169 WeakPolarHBondContact O-CB 3.46Å; A165-A169 PolarHBondContact O-N 3.32Å |
| 166 | A | 53.6 | Low | 51.4 | Low | 56 Ų | 56 | 73.2 Ų | 73.2 | 46% | 0.463 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -68.2 | -37.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S162 A163 A169 A170 | S162-A166 WeakPolarHBondContact O-CB 3.3Å; S162-A166 PolarHBondContact O-N 3.27Å; A163-A166 PolarHBondContact O-N 3.36Å; A166-A169 PolarHBondContact O-N 3.45Å; A166-A170 VanDerWaalsContact O-CB 3.23Å; A166-A170 WeakPolarHBondContact O-CB 3.39Å; A166-A170 PolarHBondContact O-N 3.38Å |
| 167 | A | 57.3 | Low | 51.2 | Low | 63 Ų | 63 | 73 Ų | 73 | 52% | 0.521 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67.6 | -41 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A163 A164 A170 A171 | A163-A167 WeakPolarHBondContact O-CB 3.15Å; A163-A167 PolarHBondContact O-N 2.89Å; A164-A167 PolarHBondContact O-N 2.88Å; A167-A170 PolarHBondContact O-N 3.46Å; A167-A171 PolarHBondContact O-N 3.44Å; A167-A171 VanDerWaalsContact O-N 3.1Å |
| 168 | A | 54.7 | Low | 50.9 | Low | 34 Ų | 34 | 70.5 Ų | 70.5 | 28% | 0.281 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.1 | -35.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A164 | A164-A168 WeakPolarHBondContact O-CB 3.35Å; A164-A168 PolarHBondContact O-N 3.42Å |
| 169 | A | 53.9 | Low | 51.5 | Low | 52 Ų | 52 | 62.5 Ų | 62.5 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -73.5 | -38.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A165 A166 A171 A172 | A165-A169 VanDerWaalsContact O-CB 3.29Å; A165-A169 WeakPolarHBondContact O-CB 3.46Å; A165-A169 PolarHBondContact O-N 3.32Å; A166-A169 PolarHBondContact O-N 3.45Å; A169-A171 VanDerWaalsContact C-N 3.3Å; A169-A171 PolarHBondContact O-N 3.34Å; A169-A172 VanDerWaalsContact O-CB 3.25Å; A169-A172 WeakPolarHBondContact O-CB 3.49Å; A169-A172 PolarHBondContact O-N 3.39Å |
| 170 | A | 54.8 | Low | 52.3 | Low | 87 Ų | 87 | 63.6 Ų | 63.6 | 72% | 0.719 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.5 | -32.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A166 A167 A172 | A166-A170 VanDerWaalsContact O-CB 3.23Å; A166-A170 WeakPolarHBondContact O-CB 3.39Å; A166-A170 PolarHBondContact O-N 3.38Å; A167-A170 PolarHBondContact O-N 3.46Å; A170-A172 PolarHBondContact O-N 2.99Å |
| 171 | A | 56.5 | Low | 53.1 | Low | 73 Ų | 73 | 67.5 Ų | 67.5 | 60% | 0.603 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.9 | 0.6 | 172 | 0 | 0 | 0 | 0 | 0 | 114.1 | A167 A169 R270 | A167-A171 PolarHBondContact O-N 3.44Å; A167-A171 VanDerWaalsContact O-N 3.1Å; A169-A171 VanDerWaalsContact C-N 3.3Å; A169-A171 PolarHBondContact O-N 3.34Å; A171-R270 PolarHBondContact O-NH1 2.94Å; A171-R270 PolarHBondContact O-NH2 2.84Å |
| 172 | A | 54.1 | Low | 54 | Low | 23 Ų | 23 | 70 Ų | 70 | 19% | 0.19 | 51% | 0.509 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | -18.7 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | A169 A170 G174 R270 | A169-A172 VanDerWaalsContact O-CB 3.25Å; A169-A172 WeakPolarHBondContact O-CB 3.49Å; A169-A172 PolarHBondContact O-N 3.39Å; A170-A172 PolarHBondContact O-N 2.99Å; A172-G174 PolarHBondContact O-N 3.03Å; A172-R270 VanDerWaalsContact CA-NH1 3.3Å |
| 173 | G | 48.4 | Very low | 55.2 | Low | 90 Ų | 90 | 68.4 Ų | 68.4 | 93% | 0.928 | 49% | 0.492 | S | S | * | . | trans | 42.7 | 30 | 164.3 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 174 | G | 50.1 | Low | 56.7 | Low | 58 Ų | 58 | 68.7 Ų | 68.7 | 60% | 0.598 | 49% | 0.491 | S | S | * | . | trans | -140.3 | 152.3 | -166.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | A172 | A172-G174 PolarHBondContact O-N 3.03Š| ||
| 175 | S | 46.1 | Very low | 58.2 | Low | 93 Ų | 93 | 71.6 Ų | 71.6 | 65% | 0.65 | 50% | 0.503 | S | S | * | . | trans | -56.6 | 147.8 | -171 | -168.8 | 0 | 0 | 0 | 0 | 114.7 | T177 | S175-T177 PolarHBondContact O-N 3.3Š| ||
| 176 | P | 51.8 | Low | 60 | Low | 104 Ų | 104 | 71.4 Ų | 71.4 | 68% | 0.675 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.4 | -15.5 | -151.2 | -12.8 | 29.1 | 0 | 0 | 0 | 117.1 | ||
| 177 | T | 50.6 | Low | 61.5 | Low | 123 Ų | 123 | 75.1 Ų | 75.1 | 76% | 0.755 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | -31.9 | -157.1 | 57.2 | 0 | 0 | 0 | 0 | 115.4 | S175 | S175-T177 PolarHBondContact O-N 3.3Š|
| 178 | D | 48.7 | Very low | 63.1 | Low | 97 Ų | 97 | 74.9 Ų | 74.9 | 52% | 0.519 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | -31.7 | 179.9 | -167 | 33.6 | 0 | 0 | 0 | 111.4 | S180 K272 | D178-S180 PolarHBondContact O-N 3.34Å; D178-K272 IonicContact OD2-NZ 3.08Å; D178-K272 PolarHBondContact OD2-NZ 3.36Å; D178-K272 VanDerWaalsContact OD2-NZ 3.08Å |
| 179 | S | 57.4 | Low | 64.9 | Low | 42 Ų | 42 | 78.6 Ų | 78.6 | 29% | 0.294 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -78.3 | -15.3 | -177.9 | -58 | 0 | 0 | 0 | 0 | 114.2 | I181 H183 | S179-I181 PolarHBondContact O-N 3.09Å; S179-H183 WeakPolarHBondContact O-CB 3.42Å; S179-H183 PolarHBondContact O-CD2 2.97Å; S179-H183 PolarHBondContact O-N 3.49Å; S179-H183 VanDerWaalsContact O-N 3.07Å |
| 180 | S | 60.2 | Low | 66.6 | Low | 77 Ų | 77 | 76.6 Ų | 76.6 | 54% | 0.538 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68 | -33.8 | -175.7 | -169.3 | 0 | 0 | 0 | 0 | 113.1 | D178 S184 | D178-S180 PolarHBondContact O-N 3.34Å; S180-S184 WeakPolarHBondContact O-CB 3.41Å; S180-S184 PolarHBondContact O-N 3.48Å; S180-S184 VanDerWaalsContact O-N 3.15Å |
| 181 | I | 60.1 | Low | 68.3 | Low | 121 Ų | 121 | 74.4 Ų | 74.4 | 62% | 0.621 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -74.7 | -45.4 | 179.9 | -62.7 | 172.7 | 0 | 0 | 0 | 110.1 | S179 H183 S184 D185 | S179-I181 PolarHBondContact O-N 3.09Å; I181-H183 VanDerWaalsContact C-N 3.31Å; I181-H183 PolarHBondContact O-N 2.91Å; I181-S184 WeakPolarHBondContact O-CB 3.5Å; I181-S184 PolarHBondContact O-N 3.34Å; I181-S184 VanDerWaalsContact O-N 3.09Å; I181-D185 PolarHBondContact O-N 3.05Å |
| 182 | E | 67.1 | Low | 70 | Confident | 79 Ų | 79 | 76.4 Ų | 76.4 | 37% | 0.369 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.6 | -37.3 | 177.6 | -63.5 | -175.7 | 161.9 | 0 | 0 | 112.4 | Y186 F266 | E182-Y186 PolarHBondContact O-N 3.01Å; E182-Y186 VanDerWaalsContact O-N 3.11Å; E182-F266 HydrophobicContact CB-CE2 4.34Å |
| 183 | H | 76.6 | Confident | 71.9 | Confident | 46 Ų | 46 | 76.6 Ų | 76.6 | 21% | 0.213 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -69.4 | -33 | 174.1 | -87.9 | -76.3 | 0 | 0 | 0 | 112.8 | S179 I181 R187 F266 | S179-H183 WeakPolarHBondContact O-CB 3.42Å; S179-H183 PolarHBondContact O-CD2 2.97Å; S179-H183 PolarHBondContact O-N 3.49Å; S179-H183 VanDerWaalsContact O-N 3.07Å; I181-H183 VanDerWaalsContact C-N 3.31Å; I181-H183 PolarHBondContact O-N 2.91Å; H183-R187 WeakPolarHBondContact O-CB 3.28Å; H183-R187 PolarHBondContact O-N 3.49Å; H183-F266 AromaticContact CE1-CE1 3.9Å; H183-F266 AromaticContact CE1-CZ 3.41Å; H183-F266 VanDerWaalsContact CE1-CZ 3.41Å; H183-F266 WeakPolarHBondContact CE1-CZ 3.35Å; H183-F266 AromaticContact CG-CZ 3.98Å; H183-F266 AromaticContact ND1-CZ 3.57Å; H183-F266 AromaticContact NE2-CZ 3.69Å |
| 184 | S | 83.7 | Confident | 74 | Confident | 70 Ų | 70 | 73.9 Ų | 73.9 | 49% | 0.49 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.4 | -47.3 | 174.1 | -179 | 0 | 0 | 0 | 0 | 111.3 | S180 I181 Y186 R187 A188 | S180-S184 WeakPolarHBondContact O-CB 3.41Å; S180-S184 PolarHBondContact O-N 3.48Å; S180-S184 VanDerWaalsContact O-N 3.15Å; I181-S184 WeakPolarHBondContact O-CB 3.5Å; I181-S184 PolarHBondContact O-N 3.34Å; I181-S184 VanDerWaalsContact O-N 3.09Å; S184-Y186 PolarHBondContact O-N 3.26Å; S184-R187 PolarHBondContact O-N 3.15Å; S184-A188 WeakPolarHBondContact O-CB 3.37Å; S184-A188 PolarHBondContact O-N 3.47Å |
| 185 | D | 85.8 | Confident | 76 | Confident | 85 Ų | 85 | 78 Ų | 78 | 46% | 0.455 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.3 | -39.8 | 179.7 | -72.7 | -16.1 | 0 | 0 | 0 | 112.6 | I181 A188 K189 | I181-D185 PolarHBondContact O-N 3.05Å; D185-A188 PolarHBondContact O-N 3.36Å; D185-K189 WeakPolarHBondContact O-CB 3.49Å; D185-K189 VanDerWaalsContact O-CG 3.29Å; D185-K189 WeakPolarHBondContact O-CG 3.36Å; D185-K189 PolarHBondContact O-N 2.95Å |
| 186 | Y | 87.9 | Confident | 78.2 | Confident | 26 Ų | 26 | 77.9 Ų | 77.9 | 10% | 0.102 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -61 | -46.4 | 173.5 | 176.3 | -97.1 | 0 | 0 | 0 | 111.3 | E182 S184 A188 K189 L190 L262 F266 | E182-Y186 PolarHBondContact O-N 3.01Å; E182-Y186 VanDerWaalsContact O-N 3.11Å; S184-Y186 PolarHBondContact O-N 3.26Å; Y186-A188 PolarHBondContact O-N 3.44Å; Y186-K189 PolarHBondContact O-N 2.88Å; Y186-L190 HydrophobicContact CE1-CD2 4.34Å; Y186-L190 WeakPolarHBondContact O-CB 3.44Å; Y186-L190 PolarHBondContact O-N 3.37Å; Y186-L262 HydrophobicContact CD2-CD1 4.09Å; Y186-L262 HydrophobicContact CD2-CD2 4.1Å; Y186-L262 HydrophobicContact CD2-CG 3.74Å; Y186-L262 HydrophobicContact CE2-CD1 4.46Å; Y186-L262 HydrophobicContact CE2-CD2 3.96Å; Y186-L262 HydrophobicContact CE2-CG 3.63Å; Y186-F266 HydrophobicContact CD2-CB 3.6Å; Y186-F266 HydrophobicContact CD2-CD1 4.34Å; Y186-F266 AromaticContact CD2-CD2 3.88Å; Y186-F266 HydrophobicContact CD2-CD2 3.88Å; Y186-F266 AromaticContact CD2-CG 3.66Å; Y186-F266 HydrophobicContact CD2-CG 3.66Å; Y186-F266 HydrophobicContact CE2-CB 3.93Å; Y186-F266 HydrophobicContact CE2-CG 4.18Å; Y186-F266 HydrophobicContact CG-CB 4.46Å; Y186-F266 AromaticContact CG-CD2 3.91Å; Y186-F266 HydrophobicContact CG-CD2 3.91Å; Y186-F266 HydrophobicContact CG-CE2 4.35Å; Y186-F266 HydrophobicContact CG-CG 4.05Å |
| 187 | R | 87.1 | Confident | 80.2 | Confident | 134 Ų | 134 | 73.1 Ų | 73.1 | 51% | 0.506 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 179.4 | -171.6 | 178.8 | -174.6 | 168.4 | 2.5 | 112 | H183 S184 L190 A191 | H183-R187 WeakPolarHBondContact O-CB 3.28Å; H183-R187 PolarHBondContact O-N 3.49Å; S184-R187 PolarHBondContact O-N 3.15Å; R187-L190 PolarHBondContact O-N 3.11Å; R187-A191 WeakPolarHBondContact O-CB 3.4Å; R187-A191 PolarHBondContact O-N 3.36Å |
| 188 | A | 90.1 | Very high | 82.2 | Confident | 58 Ų | 58 | 69.9 Ų | 69.9 | 48% | 0.479 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.1 | -46.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | S184 D185 Y186 L190 A191 Q192 | S184-A188 WeakPolarHBondContact O-CB 3.37Å; S184-A188 PolarHBondContact O-N 3.47Å; D185-A188 PolarHBondContact O-N 3.36Å; Y186-A188 PolarHBondContact O-N 3.44Å; A188-L190 PolarHBondContact O-N 3.28Å; A188-A191 WeakPolarHBondContact O-CB 3.4Å; A188-A191 PolarHBondContact O-N 2.96Å; A188-Q192 PolarHBondContact O-N 3.05Å |
| 189 | K | 91.8 | Very high | 84.3 | Confident | 112 Ų | 112 | 67.5 Ų | 67.5 | 49% | 0.487 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.9 | -39.7 | 176.4 | -73.2 | 173.1 | -176.8 | 170.6 | 0 | 112.5 | D185 Y186 Q192 I193 L262 | D185-K189 WeakPolarHBondContact O-CB 3.49Å; D185-K189 VanDerWaalsContact O-CG 3.29Å; D185-K189 WeakPolarHBondContact O-CG 3.36Å; D185-K189 PolarHBondContact O-N 2.95Å; Y186-K189 PolarHBondContact O-N 2.88Å; K189-Q192 WeakPolarHBondContact O-CB 2.99Å; K189-Q192 PolarHBondContact O-N 3.13Å; K189-I193 WeakPolarHBondContact O-CG1 3.48Å; K189-I193 PolarHBondContact O-N 3.22Å; K189-L262 HydrophobicContact CB-CD1 3.75Å; K189-L262 HydrophobicContact CB-CD2 3.88Å; K189-L262 HydrophobicContact CB-CG 4.5Å; K189-L262 HydrophobicContact CD-CD1 3.82Å; K189-L262 HydrophobicContact CG-CD1 4.43Å |
| 190 | L | 90.5 | Very high | 85.9 | Confident | 11 Ų | 11 | 67.4 Ų | 67.4 | 6% | 0.058 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 174.4 | -176.1 | 62.1 | 0 | 0 | 0 | 111 | V153 Y186 R187 A188 Q192 I193 R194 V259 L262 | V153-L190 HydrophobicContact CG2-CD1 4.14Å; Y186-L190 HydrophobicContact CE1-CD2 4.34Å; Y186-L190 WeakPolarHBondContact O-CB 3.44Å; Y186-L190 PolarHBondContact O-N 3.37Å; R187-L190 PolarHBondContact O-N 3.11Å; A188-L190 PolarHBondContact O-N 3.28Å; L190-Q192 VanDerWaalsContact C-N 3.3Å; L190-Q192 PolarHBondContact O-N 2.91Å; L190-I193 PolarHBondContact O-N 3.48Å; L190-R194 WeakPolarHBondContact O-CG 3.31Å; L190-R194 PolarHBondContact O-N 2.99Å; L190-V259 HydrophobicContact CD1-CG1 4.46Å; L190-V259 HydrophobicContact CD1-CG2 4.21Å; L190-L262 HydrophobicContact CB-CD2 3.98Å; L190-L262 HydrophobicContact CD1-CD2 4.49Å |
| 191 | A | 89.1 | Confident | 87.3 | Confident | 41 Ų | 41 | 65 Ų | 65 | 34% | 0.339 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.2 | -38.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | R187 A188 R194 Q195 | R187-A191 WeakPolarHBondContact O-CB 3.4Å; R187-A191 PolarHBondContact O-N 3.36Å; A188-A191 WeakPolarHBondContact O-CB 3.4Å; A188-A191 PolarHBondContact O-N 2.96Å; A191-R194 WeakPolarHBondContact O-CB 3.43Å; A191-R194 PolarHBondContact O-N 3.31Å; A191-Q195 PolarHBondContact O-N 2.87Å |
| 192 | Q | 94.1 | Very high | 88.7 | Confident | 114 Ų | 114 | 65.9 Ų | 65.9 | 53% | 0.533 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.8 | -45.1 | 174 | -172.1 | -178.1 | 5.4 | 0 | 0 | 111.9 | A188 K189 L190 R194 Q195 I196 | A188-Q192 PolarHBondContact O-N 3.05Å; K189-Q192 WeakPolarHBondContact O-CB 2.99Å; K189-Q192 PolarHBondContact O-N 3.13Å; L190-Q192 VanDerWaalsContact C-N 3.3Å; L190-Q192 PolarHBondContact O-N 2.91Å; Q192-R194 VanDerWaalsContact C-N 3.27Å; Q192-R194 PolarHBondContact O-N 3.04Å; Q192-Q195 PolarHBondContact O-N 3.43Å; Q192-I196 HydrophobicContact CG-CD1 4.01Å; Q192-I196 VanDerWaalsContact O-CG1 3.32Å; Q192-I196 WeakPolarHBondContact O-CG1 3.35Å; Q192-I196 PolarHBondContact O-N 3.49Å |
| 193 | I | 93 | Very high | 89.8 | Confident | 27 Ų | 27 | 67.4 Ų | 67.4 | 14% | 0.138 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -58.2 | -42.6 | 175.2 | -67 | 169.3 | 0 | 0 | 0 | 110.6 | K189 L190 I196 Y197 T255 A258 V259 L262 | K189-I193 WeakPolarHBondContact O-CG1 3.48Å; K189-I193 PolarHBondContact O-N 3.22Å; L190-I193 PolarHBondContact O-N 3.48Å; I193-I196 PolarHBondContact O-N 3.47Å; I193-Y197 WeakPolarHBondContact O-CB 3.29Å; I193-Y197 PolarHBondContact O-N 3.09Å; I193-T255 HydrophobicContact CG2-CG2 3.86Å; I193-A258 HydrophobicContact CD1-CB 4.09Å; I193-A258 HydrophobicContact CG1-CB 4.42Å; I193-A258 HydrophobicContact CG2-CB 4.46Å; I193-V259 HydrophobicContact CD1-CG2 4.48Å; I193-V259 HydrophobicContact CG2-CG2 3.96Å; I193-L262 HydrophobicContact CD1-CB 4.25Å; I193-L262 HydrophobicContact CD1-CD2 3.77Å |
| 194 | R | 92 | Very high | 90.4 | Very high | 33 Ų | 33 | 65.8 Ų | 65.8 | 13% | 0.125 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -61.1 | -46.5 | 176 | -68.7 | -168 | -72.9 | -119 | -10.6 | 112.9 | G152 V153 L190 A191 Q192 I196 Y197 H198 | G152-R194 WeakPolarHBondContact O-CD 3.36Å; G152-R194 PolarHBondContact O-NH1 3.07Å; V153-R194 HydrophobicContact CB-CG 4.13Å; V153-R194 HydrophobicContact CG1-CG 4.12Å; V153-R194 HydrophobicContact CG2-CG 3.91Å; L190-R194 WeakPolarHBondContact O-CG 3.31Å; L190-R194 PolarHBondContact O-N 2.99Å; A191-R194 WeakPolarHBondContact O-CB 3.43Å; A191-R194 PolarHBondContact O-N 3.31Å; Q192-R194 VanDerWaalsContact C-N 3.27Å; Q192-R194 PolarHBondContact O-N 3.04Å; R194-I196 VanDerWaalsContact C-N 3.32Å; R194-I196 PolarHBondContact O-N 3.39Å; R194-Y197 PolarHBondContact O-N 2.97Å; R194-H198 PolarHBondContact O-N 2.9Å; R194-H198 PolarHBondContact O-ND1 3.41Å |
| 195 | Q | 92.8 | Very high | 90.6 | Very high | 145 Ų | 145 | 67.5 Ų | 67.5 | 68% | 0.678 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -62.6 | -42.8 | -179.6 | -175 | 179.3 | -2.8 | 0 | 0 | 111.2 | A191 Q192 S199 | A191-Q195 PolarHBondContact O-N 2.87Å; Q192-Q195 PolarHBondContact O-N 3.43Å; Q195-S199 VanDerWaalsContact O-CB 3.31Å; Q195-S199 WeakPolarHBondContact O-CB 3.46Å; Q195-S199 PolarHBondContact O-N 3.02Å |
| 196 | I | 92.8 | Very high | 90.9 | Very high | 91 Ų | 91 | 68.5 Ų | 68.5 | 47% | 0.467 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.7 | -48.7 | 176.6 | -66.5 | 166.1 | 0 | 0 | 0 | 110 | Q192 I193 R194 H198 S199 E200 | Q192-I196 HydrophobicContact CG-CD1 4.01Å; Q192-I196 VanDerWaalsContact O-CG1 3.32Å; Q192-I196 WeakPolarHBondContact O-CG1 3.35Å; Q192-I196 PolarHBondContact O-N 3.49Å; I193-I196 PolarHBondContact O-N 3.47Å; R194-I196 VanDerWaalsContact C-N 3.32Å; R194-I196 PolarHBondContact O-N 3.39Å; I196-H198 PolarHBondContact O-N 3.13Å; I196-S199 PolarHBondContact O-N 2.74Å; I196-E200 HydrophobicContact CG2-CG 4.2Å; I196-E200 WeakPolarHBondContact O-CB 3.46Å; I196-E200 WeakPolarHBondContact O-CG 3.44Å; I196-E200 PolarHBondContact O-N 3.25Å |
| 197 | Y | 94.2 | Very high | 90.9 | Very high | 3 Ų | 3 | 68.2 Ų | 68.2 | 1% | 0.012 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -55.4 | -50 | 178.7 | 171 | -109.6 | 0 | 0 | 0 | 112.5 | L148 V153 I193 R194 E200 L201 L251 K252 T255 | L148-Y197 HydrophobicContact CD1-CD2 4.48Å; L148-Y197 HydrophobicContact CD1-CE1 4.42Å; L148-Y197 HydrophobicContact CD1-CE2 3.86Å; V153-Y197 HydrophobicContact CG1-CD1 3.86Å; V153-Y197 HydrophobicContact CG1-CG 4.07Å; I193-Y197 WeakPolarHBondContact O-CB 3.29Å; I193-Y197 PolarHBondContact O-N 3.09Å; R194-Y197 PolarHBondContact O-N 2.97Å; Y197-E200 PolarHBondContact O-N 2.85Å; Y197-L201 HydrophobicContact CE1-CD2 4.3Å; Y197-L201 VanDerWaalsContact O-CB 3.23Å; Y197-L201 WeakPolarHBondContact O-CB 3.4Å; Y197-L201 PolarHBondContact O-N 3.48Å; Y197-L251 HydrophobicContact CD2-CD1 4.49Å; Y197-L251 HydrophobicContact CD2-CD2 4.36Å; Y197-L251 HydrophobicContact CD2-CG 4.12Å; Y197-L251 HydrophobicContact CE2-CD2 4.29Å; Y197-L251 HydrophobicContact CE2-CG 4.21Å; Y197-K252 HydrophobicContact CE2-CG 4.14Å; Y197-T255 HydrophobicContact CD2-CG2 4.01Å; Y197-T255 WeakPolarHBondContact CD2-OG1 3.45Å; Y197-T255 HydrophobicContact CG-CG2 4.04Å |
| 198 | H | 92.1 | Very high | 91 | Very high | 55 Ų | 55 | 62.4 Ų | 62.4 | 26% | 0.255 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -67.4 | -39.4 | -179.7 | -70.7 | 93.1 | 0 | 0 | 0 | 112.5 | V153 E157 R194 I196 L201 E202 | V153-H198 PolarHBondContact O-CE1 3.5Å; E157-H198 IonicContact OE1-CE1 3.3Å; E157-H198 IonicContact OE1-NE2 2.78Å; R194-H198 PolarHBondContact O-N 2.9Å; R194-H198 PolarHBondContact O-ND1 3.41Å; I196-H198 PolarHBondContact O-N 3.13Å; H198-L201 PolarHBondContact O-N 2.81Å; H198-E202 WeakPolarHBondContact O-CB 3.41Å; H198-E202 PolarHBondContact O-N 2.88Å |
| 199 | S | 92.4 | Very high | 91 | Very high | 48 Ų | 48 | 62.5 Ų | 62.5 | 34% | 0.336 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 177.3 | -178.2 | 0 | 0 | 0 | 0 | 112.2 | Q195 I196 K203 | Q195-S199 VanDerWaalsContact O-CB 3.31Å; Q195-S199 WeakPolarHBondContact O-CB 3.46Å; Q195-S199 PolarHBondContact O-N 3.02Å; I196-S199 PolarHBondContact O-N 2.74Å; S199-K203 WeakPolarHBondContact O-CG 3.41Å; S199-K203 PolarHBondContact O-N 2.62Å |
| 200 | E | 90.4 | Very high | 90.9 | Very high | 40 Ų | 40 | 62 Ų | 62 | 19% | 0.187 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -70.5 | -36 | 177.3 | -67.5 | -56.1 | 122.1 | 0 | 0 | 111.8 | I196 Y197 K203 Y204 L251 | I196-E200 HydrophobicContact CG2-CG 4.2Å; I196-E200 WeakPolarHBondContact O-CB 3.46Å; I196-E200 WeakPolarHBondContact O-CG 3.44Å; I196-E200 PolarHBondContact O-N 3.25Å; Y197-E200 PolarHBondContact O-N 2.85Å; E200-K203 PolarHBondContact O-N 2.88Å; E200-K203 IonicContact OE1-NZ 2.74Å; E200-K203 PolarHBondContact OE1-NZ 2.84Å; E200-Y204 WeakPolarHBondContact O-CB 3.06Å; E200-Y204 PolarHBondContact O-N 3.39Å; E200-L251 HydrophobicContact CB-CD1 3.75Å; E200-L251 HydrophobicContact CB-CD2 4.19Å; E200-L251 HydrophobicContact CG-CD1 4.5Å |
| 201 | L | 89.8 | Confident | 90.9 | Very high | 25 Ų | 25 | 63.5 Ų | 63.5 | 13% | 0.131 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -63.3 | -44.6 | 175 | -175.3 | 65.8 | 0 | 0 | 0 | 111.4 | Y197 H198 Y204 E205 L251 | Y197-L201 HydrophobicContact CE1-CD2 4.3Å; Y197-L201 VanDerWaalsContact O-CB 3.23Å; Y197-L201 WeakPolarHBondContact O-CB 3.4Å; Y197-L201 PolarHBondContact O-N 3.48Å; H198-L201 PolarHBondContact O-N 2.81Å; L201-Y204 HydrophobicContact CD1-CD1 4.18Å; L201-Y204 WeakPolarHBondContact O-CB 3.41Å; L201-Y204 PolarHBondContact O-N 3Å; L201-E205 HydrophobicContact CG-CG 4.5Å; L201-E205 WeakPolarHBondContact O-CG 3.46Å; L201-E205 PolarHBondContact O-N 3.48Å; L201-L251 HydrophobicContact CB-CD2 4.08Å; L201-L251 HydrophobicContact CD1-CD2 4.22Å |
| 202 | E | 90.2 | Very high | 90.9 | Very high | 140 Ų | 140 | 62.4 Ų | 62.4 | 65% | 0.654 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -62.1 | -45.2 | 177.9 | -176.2 | 177.4 | -158.6 | 0 | 0 | 111.7 | H198 Y204 E205 Q206 | H198-E202 WeakPolarHBondContact O-CB 3.41Å; H198-E202 PolarHBondContact O-N 2.88Å; E202-Y204 VanDerWaalsContact C-N 3.3Å; E202-Y204 PolarHBondContact O-N 3.47Å; E202-E205 PolarHBondContact O-N 2.95Å; E202-Q206 WeakPolarHBondContact O-CB 3.24Å; E202-Q206 PolarHBondContact O-N 3.4Å |
| 203 | K | 89.1 | Confident | 90.7 | Very high | 112 Ų | 112 | 61.5 Ų | 61.5 | 49% | 0.487 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -58.6 | -43.2 | 174.4 | -70 | 171.6 | -169.4 | 170.7 | 0 | 111.8 | S199 E200 A207 | S199-K203 WeakPolarHBondContact O-CG 3.41Å; S199-K203 PolarHBondContact O-N 2.62Å; E200-K203 PolarHBondContact O-N 2.88Å; E200-K203 IonicContact OE1-NZ 2.74Å; E200-K203 PolarHBondContact OE1-NZ 2.84Å; K203-A207 WeakPolarHBondContact O-CB 3.36Å; K203-A207 PolarHBondContact O-N 3.29Å |
| 204 | Y | 89.4 | Confident | 90.6 | Very high | 12 Ų | 12 | 63.6 Ų | 63.6 | 5% | 0.047 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -63.5 | -46.5 | 177.3 | 160.2 | -89.5 | 0 | 0 | 0 | 112.2 | E200 L201 E202 Q206 A207 C208 F244 I247 Q248 | E200-Y204 WeakPolarHBondContact O-CB 3.06Å; E200-Y204 PolarHBondContact O-N 3.39Å; L201-Y204 HydrophobicContact CD1-CD1 4.18Å; L201-Y204 WeakPolarHBondContact O-CB 3.41Å; L201-Y204 PolarHBondContact O-N 3Å; E202-Y204 VanDerWaalsContact C-N 3.3Å; E202-Y204 PolarHBondContact O-N 3.47Å; Y204-Q206 VanDerWaalsContact C-N 3.33Å; Y204-Q206 PolarHBondContact O-N 3.27Å; Y204-A207 PolarHBondContact O-N 2.99Å; Y204-C208 WeakPolarHBondContact O-CB 3.4Å; Y204-C208 PolarHBondContact O-N 2.96Å; Y204-F244 AromaticContact CD2-CD1 4Å; Y204-F244 HydrophobicContact CD2-CD1 4Å; Y204-F244 HydrophobicContact CE2-CB 3.96Å; Y204-F244 AromaticContact CE2-CD1 3.47Å; Y204-F244 HydrophobicContact CE2-CD1 3.47Å; Y204-F244 VanDerWaalsContact CE2-CD1 3.47Å; Y204-F244 HydrophobicContact CE2-CE1 4.45Å; Y204-F244 HydrophobicContact CE2-CG 4.2Å; Y204-F244 WeakPolarHBondContact CE2-O 3.4Å; Y204-F244 WeakPolarHBondContact OH-CB 3.49Å; Y204-F244 PolarHBondContact OH-O 3.23Å; Y204-I247 HydrophobicContact CD2-CB 4.25Å; Y204-I247 HydrophobicContact CD2-CG2 3.84Å; Y204-I247 HydrophobicContact CE2-CB 3.93Å; Y204-I247 HydrophobicContact CE2-CG2 4.05Å; Y204-Q248 HydrophobicContact CE1-CB 4.11Å; Y204-Q248 HydrophobicContact CE1-CG 4.43Å; Y204-Q248 HydrophobicContact CE2-CB 4.28Å; Y204-Q248 PolarHBondContact OH-OE1 3.15Å |
| 205 | E | 89 | Confident | 90.4 | Very high | 105 Ų | 105 | 63.2 Ų | 63.2 | 49% | 0.491 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.7 | -40.7 | 179.1 | -75 | 179.8 | 170.6 | 0 | 0 | 111.3 | L201 E202 C208 S209 | L201-E205 HydrophobicContact CG-CG 4.5Å; L201-E205 WeakPolarHBondContact O-CG 3.46Å; L201-E205 PolarHBondContact O-N 3.48Å; E202-E205 PolarHBondContact O-N 2.95Å; E205-C208 PolarHBondContact O-N 3.23Å; E205-S209 WeakPolarHBondContact O-CB 3.45Å; E205-S209 PolarHBondContact O-N 2.89Å; E205-S209 PolarHBondContact O-OG 2.85Å |
| 206 | Q | 91.4 | Very high | 90.2 | Very high | 106 Ų | 106 | 58.5 Ų | 58.5 | 50% | 0.495 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.1 | -50.1 | 174.5 | -174.7 | 62.8 | 24.2 | 0 | 0 | 111.1 | E202 Y204 C208 S209 E210 | E202-Q206 WeakPolarHBondContact O-CB 3.24Å; E202-Q206 PolarHBondContact O-N 3.4Å; Y204-Q206 VanDerWaalsContact C-N 3.33Å; Y204-Q206 PolarHBondContact O-N 3.27Å; Q206-C208 VanDerWaalsContact C-N 3.33Å; Q206-C208 PolarHBondContact O-N 3.49Å; Q206-S209 WeakPolarHBondContact O-CB 3.49Å; Q206-S209 PolarHBondContact O-N 3.48Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.31Å; Q206-E210 PolarHBondContact NE2-OE1 3.24Å; Q206-E210 WeakPolarHBondContact O-CG 3.35Å; Q206-E210 PolarHBondContact O-N 3.31Å |
| 207 | A | 87.8 | Confident | 90.1 | Very high | 20 Ų | 20 | 59.1 Ų | 59.1 | 17% | 0.165 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -61.9 | -39.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L45 K203 Y204 S209 F211 | L45-A207 HydrophobicContact CD1-CB 4.2Å; L45-A207 HydrophobicContact CD2-CB 3.93Å; K203-A207 WeakPolarHBondContact O-CB 3.36Å; K203-A207 PolarHBondContact O-N 3.29Å; Y204-A207 PolarHBondContact O-N 2.99Å; A207-S209 VanDerWaalsContact C-N 3.34Å; A207-F211 VanDerWaalsContact O-CB 3.23Å; A207-F211 WeakPolarHBondContact O-CB 3.39Å; A207-F211 PolarHBondContact O-N 3.01Å |
| 208 | C | 89.4 | Confident | 89.8 | Confident | 13 Ų | 13 | 62 Ų | 62 | 9% | 0.088 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 175.1 | -170.2 | 0 | 0 | 0 | 0 | 111.4 | Y204 E205 Q206 T212 F244 | Y204-C208 WeakPolarHBondContact O-CB 3.4Å; Y204-C208 PolarHBondContact O-N 2.96Å; E205-C208 PolarHBondContact O-N 3.23Å; Q206-C208 VanDerWaalsContact C-N 3.33Å; Q206-C208 PolarHBondContact O-N 3.49Å; C208-T212 VanDerWaalsContact O-CB 3.25Å; C208-T212 WeakPolarHBondContact O-CB 3.47Å; C208-T212 PolarHBondContact O-N 2.88Å; C208-T212 PolarHBondContact O-OG1 3.38Å; C208-F244 VanDerWaalsContact CA-CE1 3.47Å; C208-F244 HydrophobicContact CB-CD1 3.53Å; C208-F244 HydrophobicContact CB-CE1 3.67Å; C208-F244 HydrophobicContact CB-CG 4.04Å; C208-F244 HydrophobicContact CB-CZ 4.25Å |
| 209 | S | 90.1 | Very high | 89.6 | Confident | 59 Ų | 59 | 60.4 Ų | 60.4 | 41% | 0.413 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.3 | -47.4 | 178.8 | -60.9 | 0 | 0 | 0 | 0 | 111.7 | E205 Q206 A207 T212 N213 | E205-S209 WeakPolarHBondContact O-CB 3.45Å; E205-S209 PolarHBondContact O-N 2.89Å; E205-S209 PolarHBondContact O-OG 2.85Å; Q206-S209 WeakPolarHBondContact O-CB 3.49Å; Q206-S209 PolarHBondContact O-N 3.48Å; A207-S209 VanDerWaalsContact C-N 3.34Å; S209-T212 PolarHBondContact O-N 3.23Å; S209-N213 VanDerWaalsContact O-CB 3.31Å; S209-N213 WeakPolarHBondContact O-CB 3.37Å; S209-N213 PolarHBondContact O-N 3.42Å; S209-N213 PolarHBondContact O-ND2 2.98Å; S209-N213 VanDerWaalsContact O-ND2 3.08Å |
| 210 | E | 90.3 | Very high | 89.3 | Confident | 103 Ų | 103 | 65.6 Ų | 65.6 | 48% | 0.481 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61 | -48 | 177.8 | -74.2 | 177 | -174.5 | 0 | 0 | 111.9 | Q206 T212 N213 H214 | Q206-E210 WeakPolarHBondContact CG-OE1 3.31Å; Q206-E210 PolarHBondContact NE2-OE1 3.24Å; Q206-E210 WeakPolarHBondContact O-CG 3.35Å; Q206-E210 PolarHBondContact O-N 3.31Å; E210-T212 PolarHBondContact O-N 2.99Å; E210-N213 PolarHBondContact O-N 3.29Å; E210-H214 WeakPolarHBondContact O-CB 3.42Å; E210-H214 PolarHBondContact O-N 2.94Å |
| 211 | F | 88.8 | Confident | 89.1 | Confident | 42 Ų | 42 | 68.6 Ų | 68.6 | 18% | 0.184 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.3 | -45.5 | 178.8 | -172 | -90.3 | 0 | 0 | 0 | 111.8 | I48 T52 A207 N213 H214 V215 I240 F244 | I48-F211 HydrophobicContact CG2-CD2 3.92Å; I48-F211 HydrophobicContact CG2-CE2 3.53Å; I48-F211 HydrophobicContact CG2-CZ 4.22Å; T52-F211 HydrophobicContact CG2-CD2 4.23Å; T52-F211 HydrophobicContact CG2-CE2 3.35Å; T52-F211 HydrophobicContact CG2-CZ 3.93Å; A207-F211 VanDerWaalsContact O-CB 3.23Å; A207-F211 WeakPolarHBondContact O-CB 3.39Å; A207-F211 PolarHBondContact O-N 3.01Å; F211-N213 VanDerWaalsContact C-N 3.35Å; F211-N213 PolarHBondContact O-N 2.94Å; F211-H214 PolarHBondContact O-N 3.22Å; F211-V215 HydrophobicContact CD1-CG2 4.17Å; F211-V215 HydrophobicContact CE1-CG2 3.76Å; F211-V215 HydrophobicContact CZ-CG2 4.14Å; F211-V215 WeakPolarHBondContact O-CG2 3.26Å; F211-V215 PolarHBondContact O-N 2.95Å; F211-I240 HydrophobicContact CD1-CD1 3.81Å; F211-I240 HydrophobicContact CD1-CG1 4.07Å; F211-I240 HydrophobicContact CD1-CG2 3.67Å; F211-I240 HydrophobicContact CE1-CD1 3.61Å; F211-I240 HydrophobicContact CE1-CG1 3.7Å; F211-I240 HydrophobicContact CE1-CG2 4.1Å; F211-F244 HydrophobicContact CB-CE2 4.33Å; F211-F244 HydrophobicContact CB-CZ 4.16Å; F211-F244 HydrophobicContact CD1-CE2 4.07Å; F211-F244 HydrophobicContact CG-CE2 4.26Å; F211-F244 HydrophobicContact CG-CZ 4.41Å |
| 212 | T | 89.4 | Confident | 88.8 | Confident | 18 Ų | 18 | 69.6 Ų | 69.6 | 11% | 0.11 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.3 | -45.4 | 177.4 | -58.6 | 0 | 0 | 0 | 0 | 110.7 | C208 S209 E210 H214 V215 M216 V237 | C208-T212 VanDerWaalsContact O-CB 3.25Å; C208-T212 WeakPolarHBondContact O-CB 3.47Å; C208-T212 PolarHBondContact O-N 2.88Å; C208-T212 PolarHBondContact O-OG1 3.38Å; S209-T212 PolarHBondContact O-N 3.23Å; E210-T212 PolarHBondContact O-N 2.99Å; T212-H214 VanDerWaalsContact C-N 3.35Å; T212-H214 PolarHBondContact O-N 3.24Å; T212-V215 PolarHBondContact O-N 2.8Å; T212-M216 HydrophobicContact CG2-CG 4.28Å; T212-M216 WeakPolarHBondContact O-CB 3.32Å; T212-M216 WeakPolarHBondContact O-CG 3.3Å; T212-M216 PolarHBondContact O-N 2.94Å; T212-V237 HydrophobicContact CG2-CG1 4Å; T212-V237 HydrophobicContact CG2-CG2 4.17Å |
| 213 | N | 91.1 | Very high | 88.5 | Confident | 94 Ų | 94 | 65 Ų | 65 | 50% | 0.503 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.8 | -41.9 | 176.7 | -76 | -32.9 | 0 | 0 | 0 | 112.2 | S209 E210 F211 M216 N217 | S209-N213 VanDerWaalsContact O-CB 3.31Å; S209-N213 WeakPolarHBondContact O-CB 3.37Å; S209-N213 PolarHBondContact O-N 3.42Å; S209-N213 PolarHBondContact O-ND2 2.98Å; S209-N213 VanDerWaalsContact O-ND2 3.08Å; E210-N213 PolarHBondContact O-N 3.29Å; F211-N213 VanDerWaalsContact C-N 3.35Å; F211-N213 PolarHBondContact O-N 2.94Å; N213-M216 PolarHBondContact O-N 3.27Å; N213-N217 WeakPolarHBondContact O-CB 3.49Å; N213-N217 VanDerWaalsContact O-CG 3.23Å; N213-N217 PolarHBondContact O-N 3.42Å; N213-N217 PolarHBondContact O-ND2 2.9Å |
| 214 | H | 89.4 | Confident | 88.3 | Confident | 72 Ų | 72 | 67 Ų | 67 | 33% | 0.333 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -60.5 | -49.9 | 176.8 | -176.1 | 81 | 0 | 0 | 0 | 111.4 | E210 F211 T212 M216 N217 L218 | E210-H214 WeakPolarHBondContact O-CB 3.42Å; E210-H214 PolarHBondContact O-N 2.94Å; F211-H214 PolarHBondContact O-N 3.22Å; T212-H214 VanDerWaalsContact C-N 3.35Å; T212-H214 PolarHBondContact O-N 3.24Å; H214-M216 VanDerWaalsContact C-N 3.35Å; H214-M216 PolarHBondContact O-N 3.37Å; H214-N217 PolarHBondContact O-N 3.41Å; H214-L218 WeakPolarHBondContact O-CB 3.49Å; H214-L218 PolarHBondContact O-N 2.98Å |
| 215 | V | 88.3 | Confident | 87.9 | Confident | 24 Ų | 24 | 70.7 Ų | 70.7 | 15% | 0.145 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -63 | -41.2 | 177.7 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | F211 T212 L218 L219 I240 | F211-V215 HydrophobicContact CD1-CG2 4.17Å; F211-V215 HydrophobicContact CE1-CG2 3.76Å; F211-V215 HydrophobicContact CZ-CG2 4.14Å; F211-V215 WeakPolarHBondContact O-CG2 3.26Å; F211-V215 PolarHBondContact O-N 2.95Å; T212-V215 PolarHBondContact O-N 2.8Å; V215-L218 PolarHBondContact O-N 3.48Å; V215-L219 HydrophobicContact CG1-CD1 3.82Å; V215-L219 HydrophobicContact CG1-CG 4.27Å; V215-L219 WeakPolarHBondContact O-CB 3.5Å; V215-L219 VanDerWaalsContact O-CG 3.3Å; V215-L219 WeakPolarHBondContact O-CG 3.47Å; V215-L219 PolarHBondContact O-N 2.98Å; V215-I240 HydrophobicContact CB-CD1 3.93Å; V215-I240 HydrophobicContact CG1-CD1 3.96Å; V215-I240 HydrophobicContact CG2-CD1 3.85Å |
| 216 | M | 88.7 | Confident | 87.6 | Confident | 46 Ų | 46 | 71.9 Ų | 71.9 | 23% | 0.227 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 176.6 | -74.3 | -67 | -78.6 | 0 | 0 | 112 | T212 N213 H214 L219 R220 I233 V237 | T212-M216 HydrophobicContact CG2-CG 4.28Å; T212-M216 WeakPolarHBondContact O-CB 3.32Å; T212-M216 WeakPolarHBondContact O-CG 3.3Å; T212-M216 PolarHBondContact O-N 2.94Å; N213-M216 PolarHBondContact O-N 3.27Å; H214-M216 VanDerWaalsContact C-N 3.35Å; H214-M216 PolarHBondContact O-N 3.37Å; M216-L219 PolarHBondContact O-N 3.23Å; M216-R220 WeakPolarHBondContact O-CB 3.3Å; M216-R220 VanDerWaalsContact O-CG 3.24Å; M216-R220 WeakPolarHBondContact O-CG 3.31Å; M216-R220 PolarHBondContact O-N 3.48Å; M216-I233 HydrophobicContact CE-CG2 3.76Å; M216-I233 HydrophobicContact SD-CG2 3.14Å; M216-I233 WeakPolarHBondContact SD-CG2 3.34Å; M216-V237 HydrophobicContact CG-CG2 4.05Å; M216-V237 HydrophobicContact SD-CG2 3.46Å; M216-V237 WeakPolarHBondContact SD-CG2 3.5Å |
| 217 | N | 90.3 | Very high | 87.2 | Confident | 104 Ų | 104 | 68.4 Ų | 68.4 | 56% | 0.556 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -65.1 | -42.8 | 177.2 | -73.1 | -22.8 | 0 | 0 | 0 | 111.5 | N213 H214 R220 E221 | N213-N217 WeakPolarHBondContact O-CB 3.49Å; N213-N217 VanDerWaalsContact O-CG 3.23Å; N213-N217 PolarHBondContact O-N 3.42Å; N213-N217 PolarHBondContact O-ND2 2.9Å; H214-N217 PolarHBondContact O-N 3.41Å; N217-R220 PolarHBondContact O-N 3.02Å; N217-E221 PolarHBondContact O-N 2.89Å |
| 218 | L | 88.8 | Confident | 87.1 | Confident | 63 Ų | 63 | 68.2 Ų | 68.2 | 33% | 0.33 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -60.2 | -48.6 | 176.4 | 179.9 | 63.6 | 0 | 0 | 0 | 111.5 | L56 H214 V215 R220 E221 Q222 | L56-L218 HydrophobicContact CD1-CD1 4.15Å; H214-L218 WeakPolarHBondContact O-CB 3.49Å; H214-L218 PolarHBondContact O-N 2.98Å; V215-L218 PolarHBondContact O-N 3.48Å; L218-R220 VanDerWaalsContact C-N 3.33Å; L218-R220 PolarHBondContact O-N 3.06Å; L218-E221 PolarHBondContact O-N 3.47Å; L218-Q222 HydrophobicContact CD1-CG 4.38Å; L218-Q222 WeakPolarHBondContact O-CB 3.32Å; L218-Q222 VanDerWaalsContact O-CG 3.24Å; L218-Q222 WeakPolarHBondContact O-CG 3.28Å; L218-Q222 PolarHBondContact O-N 2.89Å |
| 219 | L | 87.1 | Confident | 86.9 | Confident | 22 Ų | 22 | 67.7 Ų | 67.7 | 12% | 0.115 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.1 | -37.1 | 178.6 | -69.9 | 174 | 0 | 0 | 0 | 111.9 | V215 M216 S223 I228 I233 M236 | V215-L219 HydrophobicContact CG1-CD1 3.82Å; V215-L219 HydrophobicContact CG1-CG 4.27Å; V215-L219 WeakPolarHBondContact O-CB 3.5Å; V215-L219 VanDerWaalsContact O-CG 3.3Å; V215-L219 WeakPolarHBondContact O-CG 3.47Å; V215-L219 PolarHBondContact O-N 2.98Å; M216-L219 PolarHBondContact O-N 3.23Å; L219-S223 WeakPolarHBondContact O-CB 3.44Å; L219-S223 PolarHBondContact O-N 3.08Å; L219-I228 HydrophobicContact CD2-CD1 4.39Å; L219-I228 WeakPolarHBondContact O-CD1 3.41Å; L219-I233 HydrophobicContact CB-CD1 4.46Å; L219-I233 HydrophobicContact CB-CG1 4.19Å; L219-I233 HydrophobicContact CD1-CB 4.37Å; L219-I233 HydrophobicContact CD1-CG1 4.18Å; L219-I233 HydrophobicContact CD1-CG2 4.22Å; L219-M236 HydrophobicContact CD1-CB 4.05Å; L219-M236 HydrophobicContact CD1-CG 4.18Å |
| 220 | R | 86.9 | Confident | 86.6 | Confident | 158 Ų | 158 | 68.6 Ų | 68.6 | 60% | 0.596 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -61.7 | -45.4 | 172.8 | -78.2 | 174 | -178.9 | -104.2 | 2 | 111.6 | M216 N217 L218 S223 | M216-R220 WeakPolarHBondContact O-CB 3.3Å; M216-R220 VanDerWaalsContact O-CG 3.24Å; M216-R220 WeakPolarHBondContact O-CG 3.31Å; M216-R220 PolarHBondContact O-N 3.48Å; N217-R220 PolarHBondContact O-N 3.02Å; L218-R220 VanDerWaalsContact C-N 3.33Å; L218-R220 PolarHBondContact O-N 3.06Å; R220-S223 WeakPolarHBondContact O-CB 3.37Å; R220-S223 PolarHBondContact O-N 3.25Å; R220-S223 PolarHBondContact O-OG 3.47Å |
| 221 | E | 86.1 | Confident | 86.2 | Confident | 102 Ų | 102 | 68.4 Ų | 68.4 | 48% | 0.477 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.6 | -42 | 179.4 | -168.2 | 56.7 | -148.5 | 0 | 0 | 111.6 | N217 L218 S223 R224 | N217-E221 PolarHBondContact O-N 2.89Å; L218-E221 PolarHBondContact O-N 3.47Å; E221-S223 VanDerWaalsContact C-N 3.26Å; E221-S223 PolarHBondContact O-N 3.34Å; E221-R224 VanDerWaalsContact O-CB 3.29Å; E221-R224 WeakPolarHBondContact O-CB 3.49Å; E221-R224 WeakPolarHBondContact O-CG 3.42Å; E221-R224 PolarHBondContact O-N 3.04Å; E221-R224 VanDerWaalsContact O-N 3.12Å; E221-R224 WeakPolarHBondContact OE1-CD 3.39Å; E221-R224 IonicContact OE1-NE 2.7Å; E221-R224 IonicContact OE1-NH1 2.78Å; E221-R224 PolarHBondContact OE1-NH1 3.44Å; E221-R224 VanDerWaalsContact OE2-CD 3.22Å; E221-R224 WeakPolarHBondContact OE2-CD 3.44Å; E221-R224 IonicContact OE2-CZ 3.89Å; E221-R224 IonicContact OE2-NE 3.72Å; E221-R224 IonicContact OE2-NH1 3.68Å; E221-R224 PolarHBondContact OE2-NH1 3.12Å |
| 222 | Q | 83.5 | Confident | 85.8 | Confident | 47 Ų | 47 | 68 Ų | 68 | 22% | 0.22 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.9 | -33.1 | 174.1 | -68.6 | -69.7 | -51.9 | 0 | 0 | 112.5 | L218 R224 T225 R226 I228 | L218-Q222 HydrophobicContact CD1-CG 4.38Å; L218-Q222 WeakPolarHBondContact O-CB 3.32Å; L218-Q222 VanDerWaalsContact O-CG 3.24Å; L218-Q222 WeakPolarHBondContact O-CG 3.28Å; L218-Q222 PolarHBondContact O-N 2.89Å; Q222-R224 PolarHBondContact O-N 3.32Å; Q222-T225 PolarHBondContact O-N 2.82Å; Q222-T225 PolarHBondContact O-OG1 2.96Å; Q222-R226 WeakPolarHBondContact O-CG 3.37Å; Q222-R226 PolarHBondContact O-N 3.37Å; Q222-I228 HydrophobicContact CB-CD1 3.55Å |
| 223 | S | 84.4 | Confident | 85.6 | Confident | 42 Ų | 42 | 68.5 Ų | 68.5 | 29% | 0.294 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -15.7 | 178.2 | 79.8 | 0 | 0 | 0 | 0 | 113.3 | F114 L219 R220 E221 R226 | F114-S223 WeakPolarHBondContact CE2-O 3.34Å; L219-S223 WeakPolarHBondContact O-CB 3.44Å; L219-S223 PolarHBondContact O-N 3.08Å; R220-S223 WeakPolarHBondContact O-CB 3.37Å; R220-S223 PolarHBondContact O-N 3.25Å; R220-S223 PolarHBondContact O-OG 3.47Å; E221-S223 VanDerWaalsContact C-N 3.26Å; E221-S223 PolarHBondContact O-N 3.34Å; S223-R226 CarbonylContact C-O 3.4Å; S223-R226 WeakPolarHBondContact CA-O 3.47Å |
| 224 | R | 83.9 | Confident | 85.3 | Confident | 154 Ų | 154 | 70 Ų | 70 | 58% | 0.581 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.5 | -27.1 | 176.4 | -54.8 | 173.1 | 84.2 | 162.6 | 3.9 | 112 | K110 E221 Q222 | K110-R224 PolarHBondContact NZ-O 2.74Å; E221-R224 VanDerWaalsContact O-CB 3.29Å; E221-R224 WeakPolarHBondContact O-CB 3.49Å; E221-R224 WeakPolarHBondContact O-CG 3.42Å; E221-R224 PolarHBondContact O-N 3.04Å; E221-R224 VanDerWaalsContact O-N 3.12Å; E221-R224 WeakPolarHBondContact OE1-CD 3.39Å; E221-R224 IonicContact OE1-NE 2.7Å; E221-R224 IonicContact OE1-NH1 2.78Å; E221-R224 PolarHBondContact OE1-NH1 3.44Å; E221-R224 VanDerWaalsContact OE2-CD 3.22Å; E221-R224 WeakPolarHBondContact OE2-CD 3.44Å; E221-R224 IonicContact OE2-CZ 3.89Å; E221-R224 IonicContact OE2-NE 3.72Å; E221-R224 IonicContact OE2-NH1 3.68Å; E221-R224 PolarHBondContact OE2-NH1 3.12Å; Q222-R224 PolarHBondContact O-N 3.32Å |
| 225 | T | 80.6 | Confident | 85 | Confident | 91 Ų | 91 | 70.4 Ų | 70.4 | 56% | 0.558 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.6 | -18.4 | -174.2 | 56 | 0 | 0 | 0 | 0 | 113.2 | Q222 | Q222-T225 PolarHBondContact O-N 2.82Å; Q222-T225 PolarHBondContact O-OG1 2.96Å |
| 226 | R | 84 | Confident | 84.8 | Confident | 129 Ų | 129 | 72.8 Ų | 72.8 | 49% | 0.487 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -143.9 | 153.2 | 173.7 | 64.8 | -175.9 | -173.7 | -156.7 | 0.4 | 112.1 | F114 Q222 S223 I228 | F114-R226 WeakPolarHBondContact CE2-O 3.38Å; Q222-R226 WeakPolarHBondContact O-CG 3.37Å; Q222-R226 PolarHBondContact O-N 3.37Å; S223-R226 CarbonylContact C-O 3.4Å; S223-R226 WeakPolarHBondContact CA-O 3.47Å; R226-I228 HydrophobicContact CG-CD1 4.36Å; R226-I228 HydrophobicContact CG-CG1 4.17Å; R226-I228 PolarHBondContact O-N 2.94Å |
| 227 | P | 82.4 | Confident | 84.6 | Confident | 34 Ų | 34 | 71.8 Ų | 71.8 | 22% | 0.221 | 34% | 0.342 | C | S | . | . | trans | -63.1 | 119.8 | 175.3 | -19.9 | 31.4 | 0 | 0 | 0 | 112.1 | F114 L117 | F114-P227 HydrophobicContact CD1-CG 4.2Å; F114-P227 HydrophobicContact CD2-CB 4.47Å; F114-P227 HydrophobicContact CD2-CG 4.3Å; F114-P227 HydrophobicContact CE1-CG 4.23Å; F114-P227 HydrophobicContact CE2-CG 4.35Å; F114-P227 HydrophobicContact CG-CG 4.22Å; F114-P227 HydrophobicContact CZ-CG 4.3Å; L117-P227 HydrophobicContact CB-CB 3.94Å; L117-P227 HydrophobicContact CB-CG 3.8Å; L117-P227 HydrophobicContact CD1-CG 3.68Å; L117-P227 HydrophobicContact CG-CG 4.4Å | ||
| 228 | I | 85.3 | Confident | 84.3 | Confident | 15 Ų | 15 | 68.6 Ų | 68.6 | 8% | 0.077 | 33% | 0.33 | C | S | . | . | trans | -126.3 | 123.2 | 173.1 | -61.5 | -177.4 | 0 | 0 | 0 | 107.4 | C118 L219 Q222 R226 E232 I233 | C118-I228 PolarHBondContact SG-O 3.03Å; L219-I228 HydrophobicContact CD2-CD1 4.39Å; L219-I228 WeakPolarHBondContact O-CD1 3.41Å; Q222-I228 HydrophobicContact CB-CD1 3.55Å; R226-I228 HydrophobicContact CG-CD1 4.36Å; R226-I228 HydrophobicContact CG-CG1 4.17Å; R226-I228 PolarHBondContact O-N 2.94Å; I228-E232 HydrophobicContact CG2-CB 4.42Å; I228-E232 HydrophobicContact CG2-CG 4.49Å; I228-I233 HydrophobicContact CG2-CD1 4.19Å; I228-I233 HydrophobicContact CG2-CG1 3.84Å | ||
| 229 | S | 84.8 | Confident | 84.1 | Confident | 2 Ų | 2 | 69.2 Ų | 69.2 | 1% | 0.014 | 33% | 0.332 | C | S | . | . | trans | -78.1 | 143.7 | 178.1 | 156 | 0 | 0 | 0 | 0 | 110.2 | E122 K231 E232 I233 | E122-S229 VanDerWaalsContact CD-OG 3.26Å; E122-S229 WeakPolarHBondContact CG-OG 3.44Å; E122-S229 PolarHBondContact OE1-OG 3.07Å; S229-K231 PolarHBondContact O-N 3.14Å; S229-K231 PolarHBondContact OG-N 3.32Å; S229-K231 VanDerWaalsContact OG-N 3.17Å; S229-E232 VanDerWaalsContact O-CB 3.27Å; S229-E232 WeakPolarHBondContact O-CB 3.34Å; S229-E232 PolarHBondContact O-N 2.94Å; S229-I233 PolarHBondContact O-N 3.42Å | ||
| 230 | P | 83.9 | Confident | 84 | Confident | 78 Ų | 78 | 68.9 Ų | 68.9 | 51% | 0.506 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -51.6 | -38.9 | 171.7 | -26.8 | 35.4 | 0 | 0 | 0 | 113.4 | E232 I233 E234 | P230-E232 PolarHBondContact O-N 3.36Å; P230-I233 WeakPolarHBondContact O-CB 3.39Å; P230-I233 PolarHBondContact O-N 2.99Å; P230-I233 VanDerWaalsContact O-N 3.07Å; P230-E234 PolarHBondContact O-N 3.18Å |
| 231 | K | 81.8 | Confident | 84 | Confident | 99 Ų | 99 | 65.6 Ų | 65.6 | 43% | 0.43 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.4 | -22.2 | 177 | -67.6 | 179 | -178.7 | 154.2 | 0 | 113.8 | E122 L126 S229 R235 | E122-K231 HydrophobicContact CG-CD 4.3Å; E122-K231 WeakPolarHBondContact OE2-CE 3.23Å; E122-K231 IonicContact OE2-NZ 2.62Å; E122-K231 PolarHBondContact OE2-NZ 2.9Å; L126-K231 HydrophobicContact CD1-CB 3.43Å; L126-K231 VanDerWaalsContact CD1-CB 3.43Å; L126-K231 HydrophobicContact CD1-CD 3.51Å; L126-K231 HydrophobicContact CD1-CG 4.13Å; S229-K231 PolarHBondContact O-N 3.14Å; S229-K231 PolarHBondContact OG-N 3.32Å; S229-K231 VanDerWaalsContact OG-N 3.17Å; K231-R235 VanDerWaalsContact O-CG 3.28Å; K231-R235 WeakPolarHBondContact O-CG 3.37Å; K231-R235 PolarHBondContact O-N 3.48Å; K231-R235 PolarHBondContact O-NE 3.4Å |
| 232 | E | 81.8 | Confident | 83.9 | Confident | 35 Ų | 35 | 65.7 Ų | 65.7 | 16% | 0.164 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -73 | -40 | 171.9 | -178.5 | 172.3 | -157.6 | 0 | 0 | 111.4 | K121 I228 S229 P230 R235 M236 | K121-E232 WeakPolarHBondContact CE-OE2 3.49Å; K121-E232 IonicContact NZ-OE1 3.87Å; K121-E232 PolarHBondContact NZ-OE1 3.39Å; K121-E232 IonicContact NZ-OE2 2.77Å; K121-E232 PolarHBondContact NZ-OE2 3.02Å; I228-E232 HydrophobicContact CG2-CB 4.42Å; I228-E232 HydrophobicContact CG2-CG 4.49Å; S229-E232 VanDerWaalsContact O-CB 3.27Å; S229-E232 WeakPolarHBondContact O-CB 3.34Å; S229-E232 PolarHBondContact O-N 2.94Å; P230-E232 PolarHBondContact O-N 3.36Å; E232-R235 VanDerWaalsContact CA-NH2 3.35Å; E232-R235 PolarHBondContact O-N 3.35Å; E232-M236 WeakPolarHBondContact O-CG 3.4Å; E232-M236 PolarHBondContact O-N 3.18Å; E232-M236 VanDerWaalsContact O-N 3.08Å |
| 233 | I | 84.6 | Confident | 83.9 | Confident | 28 Ų | 28 | 70.6 Ų | 70.6 | 14% | 0.144 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62.9 | -49.6 | 175.1 | -58.4 | 177.9 | 0 | 0 | 0 | 109.9 | M216 L219 I228 S229 P230 R235 M236 V237 | M216-I233 HydrophobicContact CE-CG2 3.76Å; M216-I233 HydrophobicContact SD-CG2 3.14Å; M216-I233 WeakPolarHBondContact SD-CG2 3.34Å; L219-I233 HydrophobicContact CB-CD1 4.46Å; L219-I233 HydrophobicContact CB-CG1 4.19Å; L219-I233 HydrophobicContact CD1-CB 4.37Å; L219-I233 HydrophobicContact CD1-CG1 4.18Å; L219-I233 HydrophobicContact CD1-CG2 4.22Å; I228-I233 HydrophobicContact CG2-CD1 4.19Å; I228-I233 HydrophobicContact CG2-CG1 3.84Å; S229-I233 PolarHBondContact O-N 3.42Å; P230-I233 WeakPolarHBondContact O-CB 3.39Å; P230-I233 PolarHBondContact O-N 2.99Å; P230-I233 VanDerWaalsContact O-N 3.07Å; I233-R235 VanDerWaalsContact C-N 3.33Å; I233-R235 PolarHBondContact O-N 3.23Å; I233-M236 PolarHBondContact O-N 3.41Å; I233-M236 VanDerWaalsContact O-N 3.13Å; I233-V237 WeakPolarHBondContact O-CG2 3.43Å; I233-V237 PolarHBondContact O-N 3.49Å |
| 234 | E | 85.1 | Confident | 84 | Confident | 126 Ų | 126 | 69 Ų | 69 | 59% | 0.589 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -56.1 | -44.4 | 176.9 | -70.8 | 167.8 | -172.7 | 0 | 0 | 112.2 | P230 M236 V237 A238 | P230-E234 PolarHBondContact O-N 3.18Å; E234-M236 PolarHBondContact O-N 3.33Å; E234-V237 PolarHBondContact O-N 3.19Å; E234-A238 WeakPolarHBondContact O-CB 3.2Å; E234-A238 PolarHBondContact O-N 2.93Å |
| 235 | R | 82.6 | Confident | 84.1 | Confident | 80 Ų | 80 | 63.9 Ų | 63.9 | 30% | 0.302 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.2 | -40.2 | 176.6 | -77.9 | -179.1 | -58.7 | 124.8 | -1.5 | 112.9 | K231 E232 I233 A238 I239 | K231-R235 VanDerWaalsContact O-CG 3.28Å; K231-R235 WeakPolarHBondContact O-CG 3.37Å; K231-R235 PolarHBondContact O-N 3.48Å; K231-R235 PolarHBondContact O-NE 3.4Å; E232-R235 VanDerWaalsContact CA-NH2 3.35Å; E232-R235 PolarHBondContact O-N 3.35Å; I233-R235 VanDerWaalsContact C-N 3.33Å; I233-R235 PolarHBondContact O-N 3.23Å; R235-A238 PolarHBondContact O-N 3.49Å; R235-I239 VanDerWaalsContact O-CG1 3.27Å; R235-I239 WeakPolarHBondContact O-CG1 3.34Å; R235-I239 PolarHBondContact O-N 3.22Å |
| 236 | M | 84 | Confident | 84.3 | Confident | 73 Ų | 73 | 62.2 Ų | 62.2 | 36% | 0.36 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.9 | -45.4 | 177.3 | -69.9 | -59.1 | 168.8 | 0 | 0 | 110.6 | L219 E232 I233 E234 A238 I239 I240 | L219-M236 HydrophobicContact CD1-CB 4.05Å; L219-M236 HydrophobicContact CD1-CG 4.18Å; E232-M236 WeakPolarHBondContact O-CG 3.4Å; E232-M236 PolarHBondContact O-N 3.18Å; E232-M236 VanDerWaalsContact O-N 3.08Å; I233-M236 PolarHBondContact O-N 3.41Å; I233-M236 VanDerWaalsContact O-N 3.13Å; E234-M236 PolarHBondContact O-N 3.33Å; M236-A238 VanDerWaalsContact C-N 3.33Å; M236-A238 PolarHBondContact O-N 3.38Å; M236-I239 PolarHBondContact O-N 2.95Å; M236-I239 HydrophobicContact SD-CD1 4.31Å; M236-I240 VanDerWaalsContact O-CG1 3.27Å; M236-I240 WeakPolarHBondContact O-CG1 3.29Å; M236-I240 PolarHBondContact O-N 2.92Å |
| 237 | V | 85.6 | Confident | 84.4 | Confident | 26 Ų | 26 | 57 Ų | 57 | 16% | 0.158 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.2 | -42 | 174.6 | 174.4 | 0 | 0 | 0 | 0 | 111.6 | T212 M216 I233 E234 I239 I240 H241 | T212-V237 HydrophobicContact CG2-CG1 4Å; T212-V237 HydrophobicContact CG2-CG2 4.17Å; M216-V237 HydrophobicContact CG-CG2 4.05Å; M216-V237 HydrophobicContact SD-CG2 3.46Å; M216-V237 WeakPolarHBondContact SD-CG2 3.5Å; I233-V237 WeakPolarHBondContact O-CG2 3.43Å; I233-V237 PolarHBondContact O-N 3.49Å; E234-V237 PolarHBondContact O-N 3.19Å; V237-I239 PolarHBondContact O-N 3.29Å; V237-I240 WeakPolarHBondContact O-CB 3.36Å; V237-I240 PolarHBondContact O-N 2.78Å; V237-H241 WeakPolarHBondContact CG1-NE2 3.39Å; V237-H241 PolarHBondContact O-CD2 3.28Å; V237-H241 VanDerWaalsContact O-CD2 3.24Å; V237-H241 PolarHBondContact O-N 3.13Å |
| 238 | A | 83.8 | Confident | 84.6 | Confident | 37 Ų | 37 | 57.5 Ų | 57.5 | 31% | 0.306 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.5 | -39.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E234 R235 M236 I240 H241 R242 | E234-A238 WeakPolarHBondContact O-CB 3.2Å; E234-A238 PolarHBondContact O-N 2.93Å; R235-A238 PolarHBondContact O-N 3.49Å; M236-A238 VanDerWaalsContact C-N 3.33Å; M236-A238 PolarHBondContact O-N 3.38Å; A238-I240 VanDerWaalsContact C-N 3.31Å; A238-I240 PolarHBondContact O-N 2.92Å; A238-H241 PolarHBondContact O-N 3.44Å; A238-R242 WeakPolarHBondContact O-CG 3.39Å; A238-R242 PolarHBondContact O-N 2.69Å |
| 239 | I | 84.6 | Confident | 84.7 | Confident | 75 Ų | 75 | 58.7 Ų | 58.7 | 39% | 0.385 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 174.9 | -68.8 | 163.2 | 0 | 0 | 0 | 110.8 | R235 M236 V237 R242 K243 | R235-I239 VanDerWaalsContact O-CG1 3.27Å; R235-I239 WeakPolarHBondContact O-CG1 3.34Å; R235-I239 PolarHBondContact O-N 3.22Å; M236-I239 PolarHBondContact O-N 2.95Å; M236-I239 HydrophobicContact SD-CD1 4.31Å; V237-I239 PolarHBondContact O-N 3.29Å; I239-R242 PolarHBondContact O-N 3.41Å; I239-K243 PolarHBondContact O-N 2.98Å; I239-K243 VanDerWaalsContact O-N 3.07Å |
| 240 | I | 85.3 | Confident | 84.9 | Confident | 15 Ų | 15 | 63.7 Ų | 63.7 | 8% | 0.077 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.2 | -56.9 | 175.8 | -65.4 | 169.8 | 0 | 0 | 0 | 109.2 | F211 V215 M236 V237 A238 R242 K243 F244 | F211-I240 HydrophobicContact CD1-CD1 3.81Å; F211-I240 HydrophobicContact CD1-CG1 4.07Å; F211-I240 HydrophobicContact CD1-CG2 3.67Å; F211-I240 HydrophobicContact CE1-CD1 3.61Å; F211-I240 HydrophobicContact CE1-CG1 3.7Å; F211-I240 HydrophobicContact CE1-CG2 4.1Å; V215-I240 HydrophobicContact CB-CD1 3.93Å; V215-I240 HydrophobicContact CG1-CD1 3.96Å; V215-I240 HydrophobicContact CG2-CD1 3.85Å; M236-I240 VanDerWaalsContact O-CG1 3.27Å; M236-I240 WeakPolarHBondContact O-CG1 3.29Å; M236-I240 PolarHBondContact O-N 2.92Å; V237-I240 WeakPolarHBondContact O-CB 3.36Å; V237-I240 PolarHBondContact O-N 2.78Å; A238-I240 VanDerWaalsContact C-N 3.31Å; A238-I240 PolarHBondContact O-N 2.92Å; I240-R242 VanDerWaalsContact C-N 3.27Å; I240-R242 PolarHBondContact O-N 3.03Å; I240-K243 WeakPolarHBondContact O-CB 3.42Å; I240-K243 PolarHBondContact O-N 3.3Å; I240-F244 HydrophobicContact CG2-CD2 3.55Å; I240-F244 HydrophobicContact CG2-CE2 3.66Å; I240-F244 WeakPolarHBondContact O-CD2 3.47Å; I240-F244 PolarHBondContact O-N 3.16Å |
| 241 | H | 85.8 | Confident | 85.3 | Confident | 90 Ų | 90 | 60.5 Ų | 60.5 | 42% | 0.417 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -55.4 | -41.5 | 179.9 | -73.5 | -57.7 | 0 | 0 | 0 | 112.4 | V237 A238 K243 F244 S245 | V237-H241 WeakPolarHBondContact CG1-NE2 3.39Å; V237-H241 PolarHBondContact O-CD2 3.28Å; V237-H241 VanDerWaalsContact O-CD2 3.24Å; V237-H241 PolarHBondContact O-N 3.13Å; A238-H241 PolarHBondContact O-N 3.44Å; H241-K243 PolarHBondContact O-N 3.38Å; H241-F244 CarbonylContact O-C 2.99Å; H241-F244 PolarHBondContact O-N 3.36Å; H241-S245 PolarHBondContact O-N 3.43Å; H241-S245 PolarHBondContact O-OG 3.39Å |
| 242 | R | 84.3 | Confident | 85.8 | Confident | 104 Ų | 104 | 56.3 Ų | 56.3 | 39% | 0.392 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60 | -43.4 | 175.1 | -75.1 | 174.4 | -178.2 | 153.8 | 1.4 | 113.4 | D135 A238 I239 I240 S245 S246 | D135-R242 IonicContact OD2-NH2 3.45Å; A238-R242 WeakPolarHBondContact O-CG 3.39Å; A238-R242 PolarHBondContact O-N 2.69Å; I239-R242 PolarHBondContact O-N 3.41Å; I240-R242 VanDerWaalsContact C-N 3.27Å; I240-R242 PolarHBondContact O-N 3.03Å; R242-S245 PolarHBondContact O-N 2.98Å; R242-S246 PolarHBondContact O-N 3Å |
| 243 | K | 83.6 | Confident | 86.3 | Confident | 150 Ų | 150 | 57.9 Ų | 57.9 | 65% | 0.652 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -64 | -43.6 | 175.9 | -77 | 180 | 172 | -76.6 | 0 | 111.1 | I239 I240 H241 S245 S246 | I239-K243 PolarHBondContact O-N 2.98Å; I239-K243 VanDerWaalsContact O-N 3.07Å; I240-K243 WeakPolarHBondContact O-CB 3.42Å; I240-K243 PolarHBondContact O-N 3.3Å; H241-K243 PolarHBondContact O-N 3.38Å; K243-S245 VanDerWaalsContact C-N 3.33Å; K243-S245 PolarHBondContact O-N 3.46Å; K243-S246 WeakPolarHBondContact O-CB 3.35Å; K243-S246 PolarHBondContact O-N 3.49Å |
| 244 | F | 87 | Confident | 86.7 | Confident | 7 Ų | 7 | 58.6 Ų | 58.6 | 3% | 0.031 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -65.4 | -34.8 | 177.1 | -86.7 | -89.9 | 0 | 0 | 0 | 111.6 | L45 Y204 C208 F211 I240 H241 S246 I247 Q248 | L45-F244 HydrophobicContact CD2-CE1 4.3Å; Y204-F244 AromaticContact CD2-CD1 4Å; Y204-F244 HydrophobicContact CD2-CD1 4Å; Y204-F244 HydrophobicContact CE2-CB 3.96Å; Y204-F244 AromaticContact CE2-CD1 3.47Å; Y204-F244 HydrophobicContact CE2-CD1 3.47Å; Y204-F244 VanDerWaalsContact CE2-CD1 3.47Å; Y204-F244 HydrophobicContact CE2-CE1 4.45Å; Y204-F244 HydrophobicContact CE2-CG 4.2Å; Y204-F244 WeakPolarHBondContact CE2-O 3.4Å; Y204-F244 WeakPolarHBondContact OH-CB 3.49Å; Y204-F244 PolarHBondContact OH-O 3.23Å; C208-F244 VanDerWaalsContact CA-CE1 3.47Å; C208-F244 HydrophobicContact CB-CD1 3.53Å; C208-F244 HydrophobicContact CB-CE1 3.67Å; C208-F244 HydrophobicContact CB-CG 4.04Å; C208-F244 HydrophobicContact CB-CZ 4.25Å; F211-F244 HydrophobicContact CB-CE2 4.33Å; F211-F244 HydrophobicContact CB-CZ 4.16Å; F211-F244 HydrophobicContact CD1-CE2 4.07Å; F211-F244 HydrophobicContact CG-CE2 4.26Å; F211-F244 HydrophobicContact CG-CZ 4.41Å; I240-F244 HydrophobicContact CG2-CD2 3.55Å; I240-F244 HydrophobicContact CG2-CE2 3.66Å; I240-F244 WeakPolarHBondContact O-CD2 3.47Å; I240-F244 PolarHBondContact O-N 3.16Å; H241-F244 CarbonylContact O-C 2.99Å; H241-F244 PolarHBondContact O-N 3.36Å; F244-S246 PolarHBondContact O-N 2.92Å; F244-I247 PolarHBondContact O-N 2.83Å; F244-I247 VanDerWaalsContact O-N 3.09Å; F244-Q248 PolarHBondContact O-N 2.7Å |
| 245 | S | 85.4 | Confident | 87.1 | Confident | 47 Ų | 47 | 53.1 Ų | 53.1 | 33% | 0.329 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.2 | -34.3 | 175.6 | -59.5 | 0 | 0 | 0 | 0 | 112.7 | H241 R242 K243 I247 Q248 M249 | H241-S245 PolarHBondContact O-N 3.43Å; H241-S245 PolarHBondContact O-OG 3.39Å; R242-S245 PolarHBondContact O-N 2.98Å; K243-S245 VanDerWaalsContact C-N 3.33Å; K243-S245 PolarHBondContact O-N 3.46Å; S245-I247 PolarHBondContact O-N 2.86Å; S245-Q248 PolarHBondContact O-N 3.3Å; S245-M249 PolarHBondContact O-N 3.23Å |
| 246 | S | 84.5 | Confident | 87.6 | Confident | 56 Ų | 56 | 49.5 Ų | 49.5 | 39% | 0.392 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.7 | -40 | 175.3 | -174.3 | 0 | 0 | 0 | 0 | 112.3 | R242 K243 F244 M249 Q250 | R242-S246 PolarHBondContact O-N 3Å; K243-S246 WeakPolarHBondContact O-CB 3.35Å; K243-S246 PolarHBondContact O-N 3.49Å; F244-S246 PolarHBondContact O-N 2.92Å; S246-M249 PolarHBondContact O-N 3.08Å; S246-Q250 WeakPolarHBondContact O-CG 3.45Å; S246-Q250 PolarHBondContact O-N 3.23Å; S246-Q250 VanDerWaalsContact O-N 3.16Å |
| 247 | I | 85.7 | Confident | 88.1 | Confident | 19 Ų | 19 | 50.8 Ų | 50.8 | 10% | 0.097 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -68.9 | -42.8 | 178 | -59.9 | 172.1 | 0 | 0 | 0 | 109.7 | I41 I44 I48 Y204 F244 S245 M249 Q250 L251 | I41-I247 HydrophobicContact CG2-CG2 4.49Å; I44-I247 HydrophobicContact CG2-CD1 4.42Å; I48-I247 HydrophobicContact CD1-CD1 4.49Å; Y204-I247 HydrophobicContact CD2-CB 4.25Å; Y204-I247 HydrophobicContact CD2-CG2 3.84Å; Y204-I247 HydrophobicContact CE2-CB 3.93Å; Y204-I247 HydrophobicContact CE2-CG2 4.05Å; F244-I247 PolarHBondContact O-N 2.83Å; F244-I247 VanDerWaalsContact O-N 3.09Å; S245-I247 PolarHBondContact O-N 2.86Å; I247-M249 VanDerWaalsContact C-N 3.3Å; I247-M249 PolarHBondContact O-N 3.18Å; I247-Q250 WeakPolarHBondContact O-CB 3.48Å; I247-Q250 PolarHBondContact O-N 3.37Å; I247-Q250 VanDerWaalsContact O-N 3.13Å; I247-L251 PolarHBondContact O-N 2.95Å |
| 248 | Q | 87.2 | Confident | 88.4 | Confident | 45 Ų | 45 | 51.4 Ų | 51.4 | 21% | 0.21 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.3 | -41 | 175 | -175.5 | 177.8 | -52.1 | 0 | 0 | 112.2 | Y204 F244 S245 Q250 L251 K252 | Y204-Q248 HydrophobicContact CE1-CB 4.11Å; Y204-Q248 HydrophobicContact CE1-CG 4.43Å; Y204-Q248 HydrophobicContact CE2-CB 4.28Å; Y204-Q248 PolarHBondContact OH-OE1 3.15Å; F244-Q248 PolarHBondContact O-N 2.7Å; S245-Q248 PolarHBondContact O-N 3.3Å; Q248-Q250 VanDerWaalsContact C-N 3.35Å; Q248-L251 PolarHBondContact O-N 2.81Å; Q248-K252 HydrophobicContact CG-CD 4.43Å; Q248-K252 VanDerWaalsContact NE2-NZ 3.13Å; Q248-K252 WeakPolarHBondContact O-CG 3.34Å; Q248-K252 PolarHBondContact O-N 3.46Å |
| 249 | M | 88.1 | Confident | 88.9 | Confident | 40 Ų | 40 | 49.8 Ų | 49.8 | 20% | 0.197 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.1 | -44.8 | 174.6 | -178.9 | 175.8 | 56.8 | 0 | 0 | 111.4 | Q140 I141 L144 S245 S246 I247 K252 Q253 | Q140-M249 HydrophobicContact CB-SD 4.34Å; Q140-M249 HydrophobicContact CG-SD 3.98Å; I141-M249 HydrophobicContact CD1-CB 4.22Å; I141-M249 HydrophobicContact CG1-CB 3.93Å; I141-M249 HydrophobicContact CG1-CG 4.2Å; L144-M249 HydrophobicContact CD1-CG 4.13Å; S245-M249 PolarHBondContact O-N 3.23Å; S246-M249 PolarHBondContact O-N 3.08Å; I247-M249 VanDerWaalsContact C-N 3.3Å; I247-M249 PolarHBondContact O-N 3.18Å; M249-K252 PolarHBondContact O-N 3.21Å; M249-Q253 VanDerWaalsContact O-CB 3.29Å; M249-Q253 WeakPolarHBondContact O-CB 3.36Å; M249-Q253 PolarHBondContact O-N 3.22Å |
| 250 | Q | 89.6 | Confident | 89.1 | Confident | 108 Ų | 108 | 51.9 Ų | 51.9 | 51% | 0.505 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -62.7 | -43 | 178.1 | -72.3 | 177.8 | -17.3 | 0 | 0 | 112.4 | S246 I247 Q248 Q253 S254 | S246-Q250 WeakPolarHBondContact O-CG 3.45Å; S246-Q250 PolarHBondContact O-N 3.23Å; S246-Q250 VanDerWaalsContact O-N 3.16Å; I247-Q250 WeakPolarHBondContact O-CB 3.48Å; I247-Q250 PolarHBondContact O-N 3.37Å; I247-Q250 VanDerWaalsContact O-N 3.13Å; Q248-Q250 VanDerWaalsContact C-N 3.35Å; Q250-Q253 PolarHBondContact O-N 3.23Å; Q250-S254 PolarHBondContact O-N 2.94Å; Q250-S254 PolarHBondContact O-OG 3.49Å |
| 251 | L | 90.6 | Very high | 89.4 | Confident | 10 Ų | 10 | 56 Ų | 56 | 5% | 0.052 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 176.1 | 176.5 | 62.9 | 0 | 0 | 0 | 111.8 | I41 Y197 E200 L201 I247 Q248 S254 T255 | I41-L251 HydrophobicContact CD1-CD1 4.43Å; Y197-L251 HydrophobicContact CD2-CD1 4.49Å; Y197-L251 HydrophobicContact CD2-CD2 4.36Å; Y197-L251 HydrophobicContact CD2-CG 4.12Å; Y197-L251 HydrophobicContact CE2-CD2 4.29Å; Y197-L251 HydrophobicContact CE2-CG 4.21Å; E200-L251 HydrophobicContact CB-CD1 3.75Å; E200-L251 HydrophobicContact CB-CD2 4.19Å; E200-L251 HydrophobicContact CG-CD1 4.5Å; L201-L251 HydrophobicContact CB-CD2 4.08Å; L201-L251 HydrophobicContact CD1-CD2 4.22Å; I247-L251 PolarHBondContact O-N 2.95Å; Q248-L251 PolarHBondContact O-N 2.81Å; L251-S254 PolarHBondContact O-OG 2.99Å; L251-T255 WeakPolarHBondContact O-CB 3.33Å; L251-T255 PolarHBondContact O-N 3.28Å; L251-T255 VanDerWaalsContact O-N 3.12Å; L251-T255 PolarHBondContact O-OG1 3.36Å |
| 252 | K | 92.1 | Very high | 89.7 | Confident | 11 Ų | 11 | 52.7 Ų | 52.7 | 5% | 0.048 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65.8 | -40.7 | 178 | -68.4 | -179.6 | -175.9 | -178.2 | 0 | 111.4 | I141 L144 D145 L148 Y197 Q248 M249 T255 C256 | I141-K252 HydrophobicContact CG2-CD 4.22Å; L144-K252 HydrophobicContact CB-CB 3.88Å; L144-K252 HydrophobicContact CB-CD 4.45Å; L144-K252 HydrophobicContact CD1-CB 3.99Å; L144-K252 HydrophobicContact CG-CB 4.48Å; D145-K252 WeakPolarHBondContact OD1-CD 3.37Å; D145-K252 WeakPolarHBondContact OD1-CE 3.44Å; D145-K252 IonicContact OD1-NZ 2.88Å; D145-K252 PolarHBondContact OD1-NZ 3.35Å; D145-K252 IonicContact OD2-NZ 3.99Å; D145-K252 PolarHBondContact OD2-NZ 2.96Å; L148-K252 HydrophobicContact CD1-CB 3.96Å; L148-K252 HydrophobicContact CD1-CG 3.85Å; Y197-K252 HydrophobicContact CE2-CG 4.14Å; Q248-K252 HydrophobicContact CG-CD 4.43Å; Q248-K252 VanDerWaalsContact NE2-NZ 3.13Å; Q248-K252 WeakPolarHBondContact O-CG 3.34Å; Q248-K252 PolarHBondContact O-N 3.46Å; M249-K252 PolarHBondContact O-N 3.21Å; K252-T255 PolarHBondContact O-N 3.48Å; K252-C256 WeakPolarHBondContact O-CB 3.47Å; K252-C256 PolarHBondContact O-N 3.07Å; K252-C256 PolarHBondContact O-SG 3.33Å |
| 253 | Q | 92.9 | Very high | 89.8 | Confident | 68 Ų | 68 | 53.5 Ų | 53.5 | 32% | 0.318 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.1 | -51.3 | 177.6 | -178.3 | 65 | 40.3 | 0 | 0 | 111.9 | L144 M249 Q250 T255 C256 E257 | L144-Q253 HydrophobicContact CD1-CB 4.16Å; M249-Q253 VanDerWaalsContact O-CB 3.29Å; M249-Q253 WeakPolarHBondContact O-CB 3.36Å; M249-Q253 PolarHBondContact O-N 3.22Å; Q250-Q253 PolarHBondContact O-N 3.23Å; Q253-T255 VanDerWaalsContact C-N 3.28Å; Q253-T255 PolarHBondContact O-N 2.77Å; Q253-C256 WeakPolarHBondContact O-CB 3.32Å; Q253-C256 PolarHBondContact O-N 3.44Å; Q253-E257 PolarHBondContact NE2-OE1 3.09Å; Q253-E257 WeakPolarHBondContact O-CG 3.38Å; Q253-E257 PolarHBondContact O-N 3.45Å |
| 254 | S | 92.8 | Very high | 90 | Very high | 44 Ų | 44 | 49.1 Ų | 49.1 | 31% | 0.308 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63 | -36.5 | -180 | 65.7 | 0 | 0 | 0 | 0 | 112.1 | Q250 L251 E257 A258 | Q250-S254 PolarHBondContact O-N 2.94Å; Q250-S254 PolarHBondContact O-OG 3.49Å; L251-S254 PolarHBondContact O-OG 2.99Å; S254-E257 PolarHBondContact O-N 2.72Å; S254-A258 WeakPolarHBondContact O-CB 3.48Å; S254-A258 PolarHBondContact O-N 2.9Å |
| 255 | T | 94.7 | Very high | 90 | Very high | 10 Ų | 10 | 57.6 Ų | 57.6 | 6% | 0.061 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -65.5 | -47 | 175.6 | -56 | 0 | 0 | 0 | 0 | 111.3 | L148 V153 I193 Y197 L251 K252 Q253 E257 A258 V259 | L148-T255 HydrophobicContact CD2-CG2 3.55Å; V153-T255 HydrophobicContact CG1-CG2 3.67Å; I193-T255 HydrophobicContact CG2-CG2 3.86Å; Y197-T255 HydrophobicContact CD2-CG2 4.01Å; Y197-T255 WeakPolarHBondContact CD2-OG1 3.45Å; Y197-T255 HydrophobicContact CG-CG2 4.04Å; L251-T255 WeakPolarHBondContact O-CB 3.33Å; L251-T255 PolarHBondContact O-N 3.28Å; L251-T255 VanDerWaalsContact O-N 3.12Å; L251-T255 PolarHBondContact O-OG1 3.36Å; K252-T255 PolarHBondContact O-N 3.48Å; Q253-T255 VanDerWaalsContact C-N 3.28Å; Q253-T255 PolarHBondContact O-N 2.77Å; T255-E257 VanDerWaalsContact C-N 3.32Å; T255-E257 PolarHBondContact O-N 3.27Å; T255-A258 WeakPolarHBondContact O-CB 3.43Å; T255-A258 PolarHBondContact O-N 3.48Å; T255-V259 WeakPolarHBondContact O-CG2 3.36Å; T255-V259 PolarHBondContact O-N 3.17Å |
| 256 | C | 92.8 | Very high | 89.9 | Confident | 4 Ų | 4 | 56.5 Ų | 56.5 | 3% | 0.027 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -57.1 | -45.7 | 174.4 | -76.6 | 0 | 0 | 0 | 0 | 111.7 | L144 M147 L148 K252 Q253 A258 V259 M260 | L144-C256 HydrophobicContact CD2-CB 4.15Å; M147-C256 HydrophobicContact SD-CB 3.58Å; M147-C256 VanDerWaalsContact SD-CB 3.58Å; L148-C256 WeakPolarHBondContact CD2-SG 3.25Å; K252-C256 WeakPolarHBondContact O-CB 3.47Å; K252-C256 PolarHBondContact O-N 3.07Å; K252-C256 PolarHBondContact O-SG 3.33Å; Q253-C256 WeakPolarHBondContact O-CB 3.32Å; Q253-C256 PolarHBondContact O-N 3.44Å; C256-A258 PolarHBondContact O-N 3.01Å; C256-V259 PolarHBondContact O-N 2.96Å; C256-M260 VanDerWaalsContact O-CG 3.24Å; C256-M260 WeakPolarHBondContact O-CG 3.39Å; C256-M260 PolarHBondContact O-N 3.49Å |
| 257 | E | 93.4 | Very high | 89.8 | Confident | 101 Ų | 101 | 57 Ų | 57 | 47% | 0.472 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -60.5 | -44.4 | 176.6 | -73.7 | 173.8 | -168.1 | 0 | 0 | 112.1 | Q253 S254 T255 V259 M260 I261 | Q253-E257 PolarHBondContact NE2-OE1 3.09Å; Q253-E257 WeakPolarHBondContact O-CG 3.38Å; Q253-E257 PolarHBondContact O-N 3.45Å; S254-E257 PolarHBondContact O-N 2.72Å; T255-E257 VanDerWaalsContact C-N 3.32Å; T255-E257 PolarHBondContact O-N 3.27Å; E257-V259 VanDerWaalsContact C-N 3.32Å; E257-V259 PolarHBondContact O-N 3.4Å; E257-M260 PolarHBondContact O-N 2.92Å; E257-I261 WeakPolarHBondContact O-CB 3.31Å; E257-I261 VanDerWaalsContact O-CG1 3.26Å; E257-I261 WeakPolarHBondContact O-CG1 3.49Å; E257-I261 PolarHBondContact O-N 2.92Å |
| 258 | A | 93.5 | Very high | 89.5 | Confident | 38 Ų | 38 | 59.9 Ų | 59.9 | 31% | 0.314 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59 | -42.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | I193 S254 T255 C256 I261 L262 | I193-A258 HydrophobicContact CD1-CB 4.09Å; I193-A258 HydrophobicContact CG1-CB 4.42Å; I193-A258 HydrophobicContact CG2-CB 4.46Å; S254-A258 WeakPolarHBondContact O-CB 3.48Å; S254-A258 PolarHBondContact O-N 2.9Å; T255-A258 WeakPolarHBondContact O-CB 3.43Å; T255-A258 PolarHBondContact O-N 3.48Å; C256-A258 PolarHBondContact O-N 3.01Å; A258-I261 PolarHBondContact O-N 3.44Å; A258-L262 WeakPolarHBondContact O-CB 3.23Å; A258-L262 PolarHBondContact O-N 3.08Å |
| 259 | V | 92.4 | Very high | 89 | Confident | 4 Ų | 4 | 60.4 Ų | 60.4 | 2% | 0.024 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 175.8 | 176.6 | 0 | 0 | 0 | 0 | 111.3 | E151 V153 L190 I193 T255 C256 E257 I261 L262 R263 | E151-V259 HydrophobicContact CB-CG1 3.91Å; E151-V259 HydrophobicContact CG-CG1 3.64Å; V153-V259 HydrophobicContact CG2-CG2 3.86Å; L190-V259 HydrophobicContact CD1-CG1 4.46Å; L190-V259 HydrophobicContact CD1-CG2 4.21Å; I193-V259 HydrophobicContact CD1-CG2 4.48Å; I193-V259 HydrophobicContact CG2-CG2 3.96Å; T255-V259 WeakPolarHBondContact O-CG2 3.36Å; T255-V259 PolarHBondContact O-N 3.17Å; C256-V259 PolarHBondContact O-N 2.96Å; E257-V259 VanDerWaalsContact C-N 3.32Å; E257-V259 PolarHBondContact O-N 3.4Å; V259-I261 VanDerWaalsContact C-N 3.35Å; V259-I261 PolarHBondContact O-N 2.88Å; V259-L262 PolarHBondContact O-N 2.95Å; V259-R263 WeakPolarHBondContact O-CB 3.18Å; V259-R263 PolarHBondContact O-N 3.34Å |
| 260 | M | 89.4 | Confident | 88.2 | Confident | 119 Ų | 119 | 63.4 Ų | 63.4 | 59% | 0.586 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -61.6 | -42.7 | 178.4 | -65.5 | -142 | 86.8 | 0 | 0 | 111.7 | C256 E257 R263 S264 | C256-M260 VanDerWaalsContact O-CG 3.24Å; C256-M260 WeakPolarHBondContact O-CG 3.39Å; C256-M260 PolarHBondContact O-N 3.49Å; E257-M260 PolarHBondContact O-N 2.92Å; M260-R263 PolarHBondContact O-N 3.44Å; M260-S264 WeakPolarHBondContact O-CB 3.42Å; M260-S264 PolarHBondContact O-N 2.76Å |
| 261 | I | 92 | Very high | 87.5 | Confident | 100 Ų | 100 | 66.1 Ų | 66.1 | 51% | 0.513 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.8 | -45.9 | 176.1 | -69.7 | 165.7 | 0 | 0 | 0 | 110.5 | E257 A258 V259 R263 S264 R265 | E257-I261 WeakPolarHBondContact O-CB 3.31Å; E257-I261 VanDerWaalsContact O-CG1 3.26Å; E257-I261 WeakPolarHBondContact O-CG1 3.49Å; E257-I261 PolarHBondContact O-N 2.92Å; A258-I261 PolarHBondContact O-N 3.44Å; V259-I261 VanDerWaalsContact C-N 3.35Å; V259-I261 PolarHBondContact O-N 2.88Å; I261-R263 VanDerWaalsContact C-N 3.33Å; I261-R263 PolarHBondContact O-N 3.05Å; I261-S264 PolarHBondContact O-N 3.25Å; I261-R265 WeakPolarHBondContact O-CB 3.34Å; I261-R265 WeakPolarHBondContact O-CG 3.3Å; I261-R265 PolarHBondContact O-N 3.13Å |
| 262 | L | 91.1 | Very high | 85.9 | Confident | 21 Ų | 21 | 73 Ų | 73 | 11% | 0.11 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -59.9 | -45.1 | 178.3 | -179.7 | 62.9 | 0 | 0 | 0 | 110.9 | Y186 K189 L190 I193 A258 V259 R265 F266 | Y186-L262 HydrophobicContact CD2-CD1 4.09Å; Y186-L262 HydrophobicContact CD2-CD2 4.1Å; Y186-L262 HydrophobicContact CD2-CG 3.74Å; Y186-L262 HydrophobicContact CE2-CD1 4.46Å; Y186-L262 HydrophobicContact CE2-CD2 3.96Å; Y186-L262 HydrophobicContact CE2-CG 3.63Å; K189-L262 HydrophobicContact CB-CD1 3.75Å; K189-L262 HydrophobicContact CB-CD2 3.88Å; K189-L262 HydrophobicContact CB-CG 4.5Å; K189-L262 HydrophobicContact CD-CD1 3.82Å; K189-L262 HydrophobicContact CG-CD1 4.43Å; L190-L262 HydrophobicContact CB-CD2 3.98Å; L190-L262 HydrophobicContact CD1-CD2 4.49Å; I193-L262 HydrophobicContact CD1-CB 4.25Å; I193-L262 HydrophobicContact CD1-CD2 3.77Å; A258-L262 WeakPolarHBondContact O-CB 3.23Å; A258-L262 PolarHBondContact O-N 3.08Å; V259-L262 PolarHBondContact O-N 2.95Å; L262-R265 PolarHBondContact O-N 3.38Å; L262-F266 WeakPolarHBondContact O-CB 3.42Å; L262-F266 PolarHBondContact O-N 3.45Å |
| 263 | R | 87.6 | Confident | 84.4 | Confident | 121 Ų | 121 | 83.4 Ų | 83.4 | 46% | 0.457 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 177.2 | -170.2 | 172.6 | -179.8 | 171.1 | -1.4 | 112.2 | E151 V259 M260 I261 F266 L267 | E151-R263 IonicContact OE1-CZ 3.82Å; E151-R263 IonicContact OE1-NH1 3.81Å; E151-R263 PolarHBondContact OE1-NH1 2.87Å; V259-R263 WeakPolarHBondContact O-CB 3.18Å; V259-R263 PolarHBondContact O-N 3.34Å; M260-R263 PolarHBondContact O-N 3.44Å; I261-R263 VanDerWaalsContact C-N 3.33Å; I261-R263 PolarHBondContact O-N 3.05Å; R263-F266 PolarHBondContact O-N 2.95Å; R263-L267 HydrophobicContact CG-CD1 4.2Å; R263-L267 WeakPolarHBondContact O-CB 3.36Å; R263-L267 WeakPolarHBondContact O-CG 3.27Å; R263-L267 PolarHBondContact O-N 3.23Å |
| 264 | S | 87 | Confident | 83.4 | Confident | 59 Ų | 59 | 90.9 Ų | 90.9 | 41% | 0.413 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60.4 | -50.1 | 175.7 | -171.7 | 0 | 0 | 0 | 0 | 111.1 | M260 I261 F266 L267 D268 | M260-S264 WeakPolarHBondContact O-CB 3.42Å; M260-S264 PolarHBondContact O-N 2.76Å; I261-S264 PolarHBondContact O-N 3.25Å; S264-F266 VanDerWaalsContact C-N 3.28Å; S264-F266 PolarHBondContact O-N 3.05Å; S264-L267 PolarHBondContact O-N 2.78Å; S264-D268 WeakPolarHBondContact O-CB 3.28Å; S264-D268 VanDerWaalsContact O-CG 3.24Å; S264-D268 PolarHBondContact O-N 3.17Å |
| 265 | R | 86.7 | Confident | 82.8 | Confident | 184 Ų | 184 | 95.9 Ų | 95.9 | 69% | 0.694 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -60.2 | -39.6 | 179.5 | -75.7 | -173.9 | 163.7 | -161.3 | -3.4 | 112.3 | I261 L262 D268 A269 | I261-R265 WeakPolarHBondContact O-CB 3.34Å; I261-R265 WeakPolarHBondContact O-CG 3.3Å; I261-R265 PolarHBondContact O-N 3.13Å; L262-R265 PolarHBondContact O-N 3.38Å; R265-D268 PolarHBondContact O-N 3.2Å; R265-A269 WeakPolarHBondContact O-CB 3.46Å; R265-A269 PolarHBondContact O-N 3.07Å |
| 266 | F | 85.1 | Confident | 82.5 | Confident | 25 Ų | 25 | 98.1 Ų | 98.1 | 11% | 0.11 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -65.1 | -46.1 | 176.2 | -177.7 | -103.1 | 0 | 0 | 0 | 112.1 | E182 H183 Y186 L262 R263 S264 D268 A269 R270 | E182-F266 HydrophobicContact CB-CE2 4.34Å; H183-F266 AromaticContact CE1-CE1 3.9Å; H183-F266 AromaticContact CE1-CZ 3.41Å; H183-F266 VanDerWaalsContact CE1-CZ 3.41Å; H183-F266 WeakPolarHBondContact CE1-CZ 3.35Å; H183-F266 AromaticContact CG-CZ 3.98Å; H183-F266 AromaticContact ND1-CZ 3.57Å; H183-F266 AromaticContact NE2-CZ 3.69Å; Y186-F266 HydrophobicContact CD2-CB 3.6Å; Y186-F266 HydrophobicContact CD2-CD1 4.34Å; Y186-F266 AromaticContact CD2-CD2 3.88Å; Y186-F266 HydrophobicContact CD2-CD2 3.88Å; Y186-F266 AromaticContact CD2-CG 3.66Å; Y186-F266 HydrophobicContact CD2-CG 3.66Å; Y186-F266 HydrophobicContact CE2-CB 3.93Å; Y186-F266 HydrophobicContact CE2-CG 4.18Å; Y186-F266 HydrophobicContact CG-CB 4.46Å; Y186-F266 AromaticContact CG-CD2 3.91Å; Y186-F266 HydrophobicContact CG-CD2 3.91Å; Y186-F266 HydrophobicContact CG-CE2 4.35Å; Y186-F266 HydrophobicContact CG-CG 4.05Å; L262-F266 WeakPolarHBondContact O-CB 3.42Å; L262-F266 PolarHBondContact O-N 3.45Å; R263-F266 PolarHBondContact O-N 2.95Å; S264-F266 VanDerWaalsContact C-N 3.28Å; S264-F266 PolarHBondContact O-N 3.05Å; F266-D268 VanDerWaalsContact C-N 3.31Å; F266-D268 PolarHBondContact O-N 3.22Å; F266-A269 PolarHBondContact O-N 2.98Å; F266-R270 WeakPolarHBondContact O-CB 3.27Å; F266-R270 PolarHBondContact O-N 3.26Å |
| 267 | L | 80.9 | Confident | 82.3 | Confident | 66 Ų | 66 | 102.2 Ų | 102.2 | 35% | 0.346 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.4 | -30.7 | 177.1 | -70.2 | 173.1 | 0 | 0 | 0 | 113 | R263 S264 R271 | R263-L267 HydrophobicContact CG-CD1 4.2Å; R263-L267 WeakPolarHBondContact O-CB 3.36Å; R263-L267 WeakPolarHBondContact O-CG 3.27Å; R263-L267 PolarHBondContact O-N 3.23Å; S264-L267 PolarHBondContact O-N 2.78Å; L267-R271 WeakPolarHBondContact O-CB 3.49Å; L267-R271 PolarHBondContact O-N 2.83Å; L267-R271 PolarHBondContact O-NE 3.01Å |
| 268 | D | 80 | Confident | 82.2 | Confident | 79 Ų | 79 | 105.1 Ų | 105.1 | 42% | 0.422 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -71.1 | -41 | 173.5 | -71.7 | -28.9 | 0 | 0 | 0 | 111.8 | S264 R265 F266 R271 | S264-D268 WeakPolarHBondContact O-CB 3.28Å; S264-D268 VanDerWaalsContact O-CG 3.24Å; S264-D268 PolarHBondContact O-N 3.17Å; R265-D268 PolarHBondContact O-N 3.2Å; F266-D268 VanDerWaalsContact C-N 3.31Å; F266-D268 PolarHBondContact O-N 3.22Å; D268-R271 PolarHBondContact O-N 3Å; D268-R271 IonicContact OD1-CZ 2.65Å; D268-R271 VanDerWaalsContact OD1-CZ 3.26Å; D268-R271 IonicContact OD1-NH1 3.26Å; D268-R271 IonicContact OD1-NH2 2.72Å; D268-R271 PolarHBondContact OD1-NH2 3.13Å |
| 269 | A | 77 | Confident | 82.2 | Confident | 56 Ų | 56 | 109.8 Ų | 109.8 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.8 | -42.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | R265 F266 R271 | R265-A269 WeakPolarHBondContact O-CB 3.46Å; R265-A269 PolarHBondContact O-N 3.07Å; F266-A269 PolarHBondContact O-N 2.98Å; A269-R271 VanDerWaalsContact C-N 3.34Å; A269-R271 PolarHBondContact O-N 3.36Å |
| 270 | R | 69.9 | Low | 82.2 | Confident | 103 Ų | 103 | 109.7 Ų | 109.7 | 39% | 0.389 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.4 | -31.4 | 177.2 | -161.5 | 178.6 | 91.7 | 170.1 | 9.5 | 113.1 | A171 A172 F266 K272 | A171-R270 PolarHBondContact O-NH1 2.94Å; A171-R270 PolarHBondContact O-NH2 2.84Å; A172-R270 VanDerWaalsContact CA-NH1 3.3Å; F266-R270 WeakPolarHBondContact O-CB 3.27Å; F266-R270 PolarHBondContact O-N 3.26Å; R270-K272 PolarHBondContact O-N 3.43Å |
| 271 | R | 74.9 | Confident | 82.4 | Confident | 165 Ų | 165 | 106.2 Ų | 106.2 | 62% | 0.623 | 48% | 0.481 | S | S | * | . | S | Bend | trans | -69.9 | 75.3 | 166.9 | -91.8 | -179 | -78.4 | 154.1 | 0.1 | 108.2 | L267 D268 A269 R273 | L267-R271 WeakPolarHBondContact O-CB 3.49Å; L267-R271 PolarHBondContact O-N 2.83Å; L267-R271 PolarHBondContact O-NE 3.01Å; D268-R271 PolarHBondContact O-N 3Å; D268-R271 IonicContact OD1-CZ 2.65Å; D268-R271 VanDerWaalsContact OD1-CZ 3.26Å; D268-R271 IonicContact OD1-NH1 3.26Å; D268-R271 IonicContact OD1-NH2 2.72Å; D268-R271 PolarHBondContact OD1-NH2 3.13Å; A269-R271 VanDerWaalsContact C-N 3.34Å; A269-R271 PolarHBondContact O-N 3.36Å; R271-R273 PolarHBondContact O-N 3.43Å |
| 272 | K | 57.9 | Low | 82.5 | Confident | 155 Ų | 155 | 104.5 Ų | 104.5 | 67% | 0.674 | 47% | 0.471 | S | S | * | . | trans | -40.6 | 104.3 | 175.6 | -133.1 | 154.9 | -171.5 | 155.4 | 0 | 108.1 | D178 R270 R274 | D178-K272 IonicContact OD2-NZ 3.08Å; D178-K272 PolarHBondContact OD2-NZ 3.36Å; D178-K272 VanDerWaalsContact OD2-NZ 3.08Å; R270-K272 PolarHBondContact O-N 3.43Å; K272-R274 PolarHBondContact O-N 2.86Å | ||
| 273 | R | 61.1 | Low | 82.7 | Confident | 230 Ų | 230 | 105.2 Ų | 105.2 | 87% | 0.868 | 48% | 0.475 | S | S | * | . | trans | -63.4 | 95.1 | 169.6 | -100.8 | -170.3 | -176.7 | -178.5 | 3.2 | 105.6 | R271 N275 | R271-R273 PolarHBondContact O-N 3.43Å; R273-N275 PolarHBondContact O-N 3.17Å; R273-N275 VanDerWaalsContact O-N 3.15Å | ||
| 274 | R | 71.5 | Confident | 83 | Confident | 224 Ų | 224 | 99.4 Ų | 99.4 | 85% | 0.845 | 45% | 0.454 | S | S | * | . | P | Polyproline II helix | trans | -65.7 | 116.8 | 168 | -77.9 | 176.7 | 77.1 | -173.5 | 4.5 | 106.1 | K272 F276 | K272-R274 PolarHBondContact O-N 2.86Å; R274-F276 PolarHBondContact O-N 3.24Å |
| 275 | N | 81.1 | Confident | 83.4 | Confident | 150 Ų | 150 | 97.2 Ų | 97.2 | 80% | 0.802 | 44% | 0.437 | S | S | * | . | P | Polyproline II helix | trans | -53.8 | 141.4 | 164.4 | -69.8 | -28 | 0 | 0 | 0 | 107.6 | R273 N277 | R273-N275 PolarHBondContact O-N 3.17Å; R273-N275 VanDerWaalsContact O-N 3.15Å; N275-N277 PolarHBondContact O-N 3.43Å |
| 276 | F | 87.9 | Confident | 83.8 | Confident | 57 Ų | 57 | 92.6 Ų | 92.6 | 25% | 0.25 | 42% | 0.424 | C | S | . | . | P | Polyproline II helix | trans | -57.1 | 144.9 | 169.5 | -60.1 | -31.5 | 0 | 0 | 0 | 108.6 | R274 A280 L284 I311 Q315 W319 | R274-F276 PolarHBondContact O-N 3.24Å; F276-A280 HydrophobicContact CB-CB 4.17Å; F276-L284 HydrophobicContact CD2-CD1 4.03Å; F276-L284 HydrophobicContact CE2-CD1 4.25Å; F276-I311 HydrophobicContact CD1-CG2 3.92Å; F276-I311 HydrophobicContact CD2-CD1 4.44Å; F276-I311 HydrophobicContact CE1-CD1 4.34Å; F276-I311 HydrophobicContact CE1-CG2 3.92Å; F276-I311 HydrophobicContact CE2-CD1 4.06Å; F276-I311 HydrophobicContact CZ-CD1 4.04Å; F276-Q315 HydrophobicContact CE1-CB 4.39Å; F276-Q315 HydrophobicContact CE1-CG 4.48Å; F276-Q315 HydrophobicContact CZ-CB 3.92Å; F276-Q315 HydrophobicContact CZ-CG 4.33Å; F276-W319 AromaticContact CD2-CD1 3.71Å; F276-W319 HydrophobicContact CE2-CB 4.13Å; F276-W319 AromaticContact CE2-CD1 3.49Å; F276-W319 VanDerWaalsContact CE2-CD1 3.49Å; F276-W319 HydrophobicContact CE2-CG 4.08Å |
| 277 | N | 88.9 | Confident | 84.2 | Confident | 90 Ų | 90 | 93.8 Ų | 93.8 | 48% | 0.481 | 43% | 0.428 | S | S | . | . | P | Polyproline II helix | trans | -61.3 | 163 | 175.4 | 66.4 | 35.2 | 0 | 0 | 0 | 109.7 | N275 Q279 A280 T281 | N275-N277 PolarHBondContact O-N 3.43Å; N277-Q279 VanDerWaalsContact C-N 3.27Å; N277-Q279 PolarHBondContact O-N 3.46Å; N277-Q279 PolarHBondContact OD1-N 3.06Å; N277-A280 PolarHBondContact O-N 3.38Å; N277-A280 WeakPolarHBondContact OD1-CB 3.33Å; N277-A280 PolarHBondContact OD1-N 2.88Å; N277-T281 PolarHBondContact O-N 3.46Å; N277-T281 PolarHBondContact O-OG1 3.34Å |
| 278 | K | 90.8 | Very high | 84.9 | Confident | 161 Ų | 161 | 90.7 Ų | 90.7 | 70% | 0.7 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -58.1 | -42.5 | -176.1 | -168.7 | -177.1 | -178.6 | -164.3 | 0 | 111.5 | T281 E282 | K278-T281 PolarHBondContact O-N 3.28Å; K278-E282 WeakPolarHBondContact CE-OE1 3.45Å; K278-E282 IonicContact NZ-OE1 3.84Å; K278-E282 WeakPolarHBondContact O-CB 3.14Å; K278-E282 WeakPolarHBondContact O-CG 3.46Å; K278-E282 PolarHBondContact O-N 3.21Å |
| 279 | Q | 93 | Very high | 85.6 | Confident | 137 Ų | 137 | 87.9 Ų | 87.9 | 64% | 0.64 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -60.2 | -49.5 | 179.4 | -174.7 | -179.1 | 10.8 | 0 | 0 | 112.7 | N277 T281 E282 V283 | N277-Q279 VanDerWaalsContact C-N 3.27Å; N277-Q279 PolarHBondContact O-N 3.46Å; N277-Q279 PolarHBondContact OD1-N 3.06Å; Q279-T281 VanDerWaalsContact C-N 3.29Å; Q279-T281 PolarHBondContact O-N 2.87Å; Q279-E282 PolarHBondContact O-N 3.08Å; Q279-V283 WeakPolarHBondContact O-CG2 3.14Å; Q279-V283 PolarHBondContact O-N 2.99Å |
| 280 | A | 92.6 | Very high | 86.2 | Confident | 2 Ų | 2 | 88.5 Ų | 88.5 | 2% | 0.017 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -61.1 | -41 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | F276 N277 V283 L284 C309 | F276-A280 HydrophobicContact CB-CB 4.17Å; N277-A280 PolarHBondContact O-N 3.38Å; N277-A280 WeakPolarHBondContact OD1-CB 3.33Å; N277-A280 PolarHBondContact OD1-N 2.88Å; A280-V283 PolarHBondContact O-N 3.44Å; A280-L284 WeakPolarHBondContact O-CB 3.25Å; A280-L284 WeakPolarHBondContact O-CD1 3.28Å; A280-L284 WeakPolarHBondContact O-CG 3.38Å; A280-L284 PolarHBondContact O-N 3.3Å; A280-C309 HydrophobicContact CB-CB 3.68Å |
| 281 | T | 93.8 | Very high | 87.3 | Confident | 45 Ų | 45 | 87.3 Ų | 87.3 | 28% | 0.276 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66.4 | -39.3 | 177.1 | -54 | 0 | 0 | 0 | 0 | 111.9 | N277 K278 Q279 N285 | N277-T281 PolarHBondContact O-N 3.46Å; N277-T281 PolarHBondContact O-OG1 3.34Å; K278-T281 PolarHBondContact O-N 3.28Å; Q279-T281 VanDerWaalsContact C-N 3.29Å; Q279-T281 PolarHBondContact O-N 2.87Å; T281-N285 WeakPolarHBondContact O-CB 3.38Å; T281-N285 VanDerWaalsContact O-CG 3.31Å; T281-N285 PolarHBondContact O-N 3.31Å; T281-N285 PolarHBondContact O-ND2 3.48Å; T281-N285 VanDerWaalsContact O-ND2 3.12Å |
| 282 | E | 93.7 | Very high | 88 | Confident | 65 Ų | 65 | 82.2 Ų | 82.2 | 30% | 0.304 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.4 | -49.2 | 174.8 | -79.4 | 174.1 | -168.5 | 0 | 0 | 111.5 | K278 Q279 L284 N285 E286 | K278-E282 WeakPolarHBondContact CE-OE1 3.45Å; K278-E282 IonicContact NZ-OE1 3.84Å; K278-E282 WeakPolarHBondContact O-CB 3.14Å; K278-E282 WeakPolarHBondContact O-CG 3.46Å; K278-E282 PolarHBondContact O-N 3.21Å; Q279-E282 PolarHBondContact O-N 3.08Å; E282-L284 VanDerWaalsContact C-N 3.32Å; E282-L284 PolarHBondContact O-N 3.47Å; E282-N285 PolarHBondContact O-N 3.37Å; E282-E286 WeakPolarHBondContact O-CB 3.43Å; E282-E286 PolarHBondContact O-N 3.29Å |
| 283 | V | 94.5 | Very high | 89.4 | Confident | 35 Ų | 35 | 80.7 Ų | 80.7 | 21% | 0.212 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -58.5 | -43.6 | 178 | 171.5 | 0 | 0 | 0 | 0 | 111.6 | Q279 A280 Y287 L305 K308 | Q279-V283 WeakPolarHBondContact O-CG2 3.14Å; Q279-V283 PolarHBondContact O-N 2.99Å; A280-V283 PolarHBondContact O-N 3.44Å; V283-Y287 PolarHBondContact O-N 2.9Å; V283-L305 HydrophobicContact CG1-CD2 3.84Å; V283-K308 HydrophobicContact CG1-CB 4.24Å |
| 284 | L | 95.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 74.5 Ų | 74.5 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -68 | -40.3 | 178.5 | -67.3 | 168.4 | 0 | 0 | 0 | 112.3 | F276 A280 E282 F288 L305 I311 V316 W319 F320 | F276-L284 HydrophobicContact CD2-CD1 4.03Å; F276-L284 HydrophobicContact CE2-CD1 4.25Å; A280-L284 WeakPolarHBondContact O-CB 3.25Å; A280-L284 WeakPolarHBondContact O-CD1 3.28Å; A280-L284 WeakPolarHBondContact O-CG 3.38Å; A280-L284 PolarHBondContact O-N 3.3Å; E282-L284 VanDerWaalsContact C-N 3.32Å; E282-L284 PolarHBondContact O-N 3.47Å; L284-F288 WeakPolarHBondContact O-CB 3.38Å; L284-F288 PolarHBondContact O-N 3.02Å; L284-L305 HydrophobicContact CD2-CB 4.36Å; L284-I311 HydrophobicContact CD1-CD1 4.04Å; L284-V316 HydrophobicContact CD2-CG1 4.22Å; L284-V316 HydrophobicContact CD2-CG2 4.47Å; L284-W319 VanDerWaalsContact C-CH2 3.5Å; L284-W319 HydrophobicContact CB-CD2 3.95Å; L284-W319 HydrophobicContact CB-CE3 3.86Å; L284-W319 HydrophobicContact CB-CH2 3.66Å; L284-W319 HydrophobicContact CB-CZ2 3.71Å; L284-W319 HydrophobicContact CB-CZ3 3.73Å; L284-W319 HydrophobicContact CD1-CB 4.47Å; L284-W319 HydrophobicContact CD1-CD2 3.84Å; L284-W319 HydrophobicContact CD1-CE3 4.39Å; L284-W319 HydrophobicContact CD1-CG 3.86Å; L284-W319 HydrophobicContact CD2-CE3 4.47Å; L284-W319 HydrophobicContact CG-CD2 4.38Å; L284-W319 HydrophobicContact CG-CE3 4.47Å; L284-W319 WeakPolarHBondContact O-CH2 3.45Å; L284-F320 HydrophobicContact CD2-CD2 4.48Å; L284-F320 HydrophobicContact CD2-CE2 3.68Å; L284-F320 HydrophobicContact CD2-CZ 4.44Å |
| 285 | N | 94.3 | Very high | 91.8 | Very high | 13 Ų | 13 | 64.5 Ų | 64.5 | 7% | 0.07 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.8 | -42.8 | 175.9 | -79 | -39 | 0 | 0 | 0 | 111.7 | T281 E282 Y287 F288 Y289 W319 K323 Y341 | T281-N285 WeakPolarHBondContact O-CB 3.38Å; T281-N285 VanDerWaalsContact O-CG 3.31Å; T281-N285 PolarHBondContact O-N 3.31Å; T281-N285 PolarHBondContact O-ND2 3.48Å; T281-N285 VanDerWaalsContact O-ND2 3.12Å; E282-N285 PolarHBondContact O-N 3.37Å; N285-Y287 VanDerWaalsContact C-N 3.34Å; N285-Y287 PolarHBondContact O-N 3.5Å; N285-F288 PolarHBondContact O-N 2.89Å; N285-F288 VanDerWaalsContact O-N 3.13Å; N285-Y289 HydrophobicContact CB-CD2 4.13Å; N285-Y289 HydrophobicContact CB-CE2 4.07Å; N285-Y289 WeakPolarHBondContact O-CD2 3.35Å; N285-Y289 PolarHBondContact O-N 2.83Å; N285-W319 WeakPolarHBondContact OD1-CH2 3.37Å; N285-W319 WeakPolarHBondContact OD1-CZ2 3.38Å; N285-K323 WeakPolarHBondContact OD1-CE 3.29Å; N285-K323 PolarHBondContact OD1-NZ 3.01Å; N285-Y341 HydrophobicContact CB-CE1 3.73Å; N285-Y341 HydrophobicContact CB-CE2 3.93Å; N285-Y341 VanDerWaalsContact CB-CZ 3.41Å; N285-Y341 WeakPolarHBondContact CB-OH 3.47Å; N285-Y341 PolarHBondContact ND2-OH 2.98Å |
| 286 | E | 94.6 | Very high | 92.4 | Very high | 87 Ų | 87 | 64 Ų | 64 | 41% | 0.407 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -57.3 | -47.8 | 178.5 | -174.6 | -177.4 | 158.5 | 0 | 0 | 111.1 | E282 S290 Y341 | E282-E286 WeakPolarHBondContact O-CB 3.43Å; E282-E286 PolarHBondContact O-N 3.29Å; E286-S290 VanDerWaalsContact O-CB 3.3Å; E286-S290 WeakPolarHBondContact O-CB 3.18Å; E286-S290 PolarHBondContact O-N 3.18Å; E286-S290 PolarHBondContact O-OG 2.93Å; E286-Y341 HydrophobicContact CB-CD1 4.44Å |
| 287 | Y | 95 | Very high | 92.8 | Very high | 49 Ų | 49 | 61.9 Ų | 61.9 | 19% | 0.192 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 173.8 | -172.8 | -81 | 0 | 0 | 0 | 111.8 | V283 N285 Y289 S290 H291 P297 A301 L305 F320 | V283-Y287 PolarHBondContact O-N 2.9Å; N285-Y287 VanDerWaalsContact C-N 3.34Å; N285-Y287 PolarHBondContact O-N 3.5Å; Y287-Y289 PolarHBondContact O-N 2.95Å; Y287-S290 WeakPolarHBondContact CA-OG 3.43Å; Y287-S290 PolarHBondContact O-OG 3.49Å; Y287-H291 HydrophobicContact CE1-CB 4.4Å; Y287-H291 AromaticContact CE2-CE1 3.81Å; Y287-H291 WeakPolarHBondContact O-CB 3.44Å; Y287-H291 PolarHBondContact O-N 3.01Å; Y287-H291 VanDerWaalsContact O-N 3.09Å; Y287-H291 PolarHBondContact O-ND1 3.4Å; Y287-H291 VanDerWaalsContact O-ND1 3.08Å; Y287-P297 HydrophobicContact CE1-CB 3.71Å; Y287-P297 HydrophobicContact CE1-CG 4.28Å; Y287-P297 WeakPolarHBondContact OH-CA 3.36Å; Y287-A301 HydrophobicContact CE2-CB 4.42Å; Y287-L305 HydrophobicContact CD1-CD1 4.18Å; Y287-L305 HydrophobicContact CD2-CD1 4.13Å; Y287-L305 HydrophobicContact CD2-CD2 4.35Å; Y287-L305 HydrophobicContact CE2-CD1 4.49Å; Y287-L305 HydrophobicContact CG-CD1 3.96Å; Y287-L305 HydrophobicContact CG-CD2 4.34Å; Y287-F320 AromaticContact CD1-CE1 3.61Å; Y287-F320 HydrophobicContact CD1-CE1 3.61Å; Y287-F320 AromaticContact CD1-CZ 3.5Å; Y287-F320 HydrophobicContact CD1-CZ 3.5Å; Y287-F320 HydrophobicContact CE1-CE1 4.19Å; Y287-F320 HydrophobicContact CE1-CZ 4.26Å; Y287-F320 HydrophobicContact CG-CZ 4.17Å |
| 288 | F | 94.9 | Very high | 93.1 | Very high | 2 Ų | 2 | 60.7 Ų | 60.7 | 1% | 0.009 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.4 | -45.3 | -178.2 | -177.2 | -89.1 | 0 | 0 | 0 | 113 | L284 N285 H291 L292 P295 W319 F320 K323 R324 Y327 | L284-F288 WeakPolarHBondContact O-CB 3.38Å; L284-F288 PolarHBondContact O-N 3.02Å; N285-F288 PolarHBondContact O-N 2.89Å; N285-F288 VanDerWaalsContact O-N 3.13Å; F288-H291 CarbonylContact O-C 3.5Å; F288-H291 PolarHBondContact O-N 2.89Å; F288-L292 HydrophobicContact CD1-CD1 4.21Å; F288-L292 HydrophobicContact CE1-CD1 3.69Å; F288-L292 HydrophobicContact CZ-CD1 4.4Å; F288-L292 WeakPolarHBondContact O-CA 3.31Å; F288-L292 PolarHBondContact O-N 3.49Å; F288-P295 HydrophobicContact CD2-CB 3.75Å; F288-P295 HydrophobicContact CE2-CB 3.67Å; F288-P295 HydrophobicContact CE2-CG 4.04Å; F288-P295 HydrophobicContact CG-CB 4.47Å; F288-P295 HydrophobicContact CZ-CB 4.33Å; F288-P295 HydrophobicContact CZ-CG 4.39Å; F288-W319 HydrophobicContact CB-CH2 4.26Å; F288-W319 HydrophobicContact CB-CZ3 4.12Å; F288-W319 HydrophobicContact CD2-CZ3 4.38Å; F288-W319 HydrophobicContact CG-CZ3 4.48Å; F288-F320 HydrophobicContact CB-CE1 4.02Å; F288-F320 AromaticContact CD2-CD1 3.94Å; F288-F320 HydrophobicContact CD2-CD1 3.94Å; F288-F320 HydrophobicContact CD2-CE1 4.03Å; F288-K323 HydrophobicContact CD1-CG 4Å; F288-K323 HydrophobicContact CD2-CB 4.19Å; F288-K323 HydrophobicContact CD2-CG 3.72Å; F288-K323 HydrophobicContact CE1-CG 3.95Å; F288-K323 HydrophobicContact CE2-CB 4Å; F288-K323 HydrophobicContact CE2-CG 3.65Å; F288-K323 HydrophobicContact CG-CG 3.9Å; F288-K323 HydrophobicContact CZ-CB 4.48Å; F288-K323 HydrophobicContact CZ-CG 3.78Å; F288-R324 HydrophobicContact CE2-CG 3.75Å; F288-R324 HydrophobicContact CZ-CG 4.37Å; F288-Y327 HydrophobicContact CE1-CD2 4.04Å; F288-Y327 HydrophobicContact CE1-CG 4.14Å; F288-Y327 HydrophobicContact CZ-CG 4.21Å |
| 289 | Y | 93.5 | Very high | 93.2 | Very high | 20 Ų | 20 | 58 Ų | 58 | 8% | 0.078 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -79.7 | -31.1 | -177.9 | -69.2 | -65.1 | 0 | 0 | 0 | 113 | N285 Y287 H291 L292 K323 Y327 E337 A338 Y341 | N285-Y289 HydrophobicContact CB-CD2 4.13Å; N285-Y289 HydrophobicContact CB-CE2 4.07Å; N285-Y289 WeakPolarHBondContact O-CD2 3.35Å; N285-Y289 PolarHBondContact O-N 2.83Å; Y287-Y289 PolarHBondContact O-N 2.95Å; Y289-H291 PolarHBondContact O-N 3.41Å; Y289-L292 HydrophobicContact CD1-CD1 4.16Å; Y289-L292 PolarHBondContact O-N 3.27Å; Y289-K323 WeakPolarHBondContact OH-CE 3.22Å; Y289-K323 PolarHBondContact OH-NZ 3.32Å; Y289-Y327 HydrophobicContact CE1-CD2 4.33Å; Y289-Y327 HydrophobicContact CE1-CE2 4.12Å; Y289-E337 HydrophobicContact CE2-CB 4.42Å; Y289-E337 WeakPolarHBondContact OH-CB 3.23Å; Y289-E337 PolarHBondContact OH-OE2 3.15Å; Y289-A338 HydrophobicContact CD1-CB 3.57Å; Y289-A338 HydrophobicContact CE1-CB 3.68Å; Y289-Y341 HydrophobicContact CD2-CD1 4.36Å; Y289-Y341 AromaticContact CD2-CD2 3.36Å; Y289-Y341 HydrophobicContact CD2-CD2 3.36Å; Y289-Y341 AromaticContact CD2-CE2 3.93Å; Y289-Y341 HydrophobicContact CD2-CE2 3.93Å; Y289-Y341 AromaticContact CD2-CG 3.64Å; Y289-Y341 HydrophobicContact CD2-CG 3.64Å; Y289-Y341 AromaticContact CE2-CD2 3.61Å; Y289-Y341 HydrophobicContact CE2-CD2 3.61Å; Y289-Y341 AromaticContact CE2-CE2 3.83Å; Y289-Y341 HydrophobicContact CE2-CE2 3.83Å; Y289-Y341 HydrophobicContact CE2-CG 4.35Å; Y289-Y341 HydrophobicContact CG-CD2 4.26Å; Y289-Y341 HydrophobicContact CG-CG 4.31Å |
| 290 | S | 90.4 | Very high | 93.3 | Very high | 68 Ų | 68 | 58.6 Ų | 58.6 | 48% | 0.476 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -66.6 | -26.5 | 170.7 | 54.4 | 0 | 0 | 0 | 0 | 112.6 | E286 Y287 | E286-S290 VanDerWaalsContact O-CB 3.3Å; E286-S290 WeakPolarHBondContact O-CB 3.18Å; E286-S290 PolarHBondContact O-N 3.18Å; E286-S290 PolarHBondContact O-OG 2.93Å; Y287-S290 WeakPolarHBondContact CA-OG 3.43Å; Y287-S290 PolarHBondContact O-OG 3.49Å |
| 291 | H | 92.4 | Very high | 93.5 | Very high | 79 Ų | 79 | 59.2 Ų | 59.2 | 37% | 0.366 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.9 | 32.6 | 178.9 | -61.8 | 74.3 | 0 | 0 | 0 | 112.4 | Y287 F288 Y289 S293 N294 P295 | Y287-H291 HydrophobicContact CE1-CB 4.4Å; Y287-H291 AromaticContact CE2-CE1 3.81Å; Y287-H291 WeakPolarHBondContact O-CB 3.44Å; Y287-H291 PolarHBondContact O-N 3.01Å; Y287-H291 VanDerWaalsContact O-N 3.09Å; Y287-H291 PolarHBondContact O-ND1 3.4Å; Y287-H291 VanDerWaalsContact O-ND1 3.08Å; F288-H291 CarbonylContact O-C 3.5Å; F288-H291 PolarHBondContact O-N 2.89Å; Y289-H291 PolarHBondContact O-N 3.41Å; H291-S293 PolarHBondContact O-N 3.42Å; H291-S293 VanDerWaalsContact O-N 3.13Å; H291-N294 CarbonylContact O-C 3.55Å; H291-N294 PolarHBondContact O-N 3.42Å; H291-P295 WeakPolarHBondContact O-CA 3.38Å; H291-P295 WeakPolarHBondContact O-CD 3.33Å |
| 292 | L | 90.5 | Very high | 93.6 | Very high | 57 Ų | 57 | 59.1 Ų | 59.1 | 30% | 0.298 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -27.4 | -171.6 | -166.4 | 64.5 | 0 | 0 | 0 | 114 | F288 Y289 N294 Y327 A338 | F288-L292 HydrophobicContact CD1-CD1 4.21Å; F288-L292 HydrophobicContact CE1-CD1 3.69Å; F288-L292 HydrophobicContact CZ-CD1 4.4Å; F288-L292 WeakPolarHBondContact O-CA 3.31Å; F288-L292 PolarHBondContact O-N 3.49Å; Y289-L292 HydrophobicContact CD1-CD1 4.16Å; Y289-L292 PolarHBondContact O-N 3.27Å; L292-N294 VanDerWaalsContact C-N 3.32Å; L292-Y327 HydrophobicContact CD1-CD1 4.49Å; L292-Y327 HydrophobicContact CD1-CD2 4.43Å; L292-Y327 HydrophobicContact CD1-CE1 4.04Å; L292-Y327 HydrophobicContact CD1-CE2 4Å; L292-A338 HydrophobicContact CD2-CB 4.39Å |
| 293 | S | 87.4 | Confident | 93.8 | Very high | 124 Ų | 124 | 61.4 Ų | 61.4 | 87% | 0.867 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.5 | -31.6 | 173.5 | 55.9 | 0 | 0 | 0 | 0 | 112.7 | H291 | H291-S293 PolarHBondContact O-N 3.42Å; H291-S293 VanDerWaalsContact O-N 3.13Å |
| 294 | N | 90.9 | Very high | 93.8 | Very high | 99 Ų | 99 | 65.1 Ų | 65.1 | 53% | 0.529 | 34% | 0.335 | S | S | . | . | trans | -148.1 | 74.4 | 179.3 | -171 | 29.4 | 0 | 0 | 0 | 112.3 | H291 L292 Y296 | H291-N294 CarbonylContact O-C 3.55Å; H291-N294 PolarHBondContact O-N 3.42Å; L292-N294 VanDerWaalsContact C-N 3.32Å; N294-Y296 PolarHBondContact O-N 2.59Å; N294-Y296 VanDerWaalsContact OD1-CD2 3.28Å; N294-Y296 WeakPolarHBondContact OD1-CD2 3.27Å | ||
| 295 | P | 91.6 | Very high | 93.8 | Very high | 15 Ų | 15 | 65.6 Ų | 65.6 | 10% | 0.097 | 34% | 0.337 | C | S | . | . | trans | -83.3 | 56.1 | -173.4 | 32.5 | -34.4 | 0 | 0 | 0 | 112 | F288 H291 R324 | F288-P295 HydrophobicContact CD2-CB 3.75Å; F288-P295 HydrophobicContact CE2-CB 3.67Å; F288-P295 HydrophobicContact CE2-CG 4.04Å; F288-P295 HydrophobicContact CG-CB 4.47Å; F288-P295 HydrophobicContact CZ-CB 4.33Å; F288-P295 HydrophobicContact CZ-CG 4.39Å; H291-P295 WeakPolarHBondContact O-CA 3.38Å; H291-P295 WeakPolarHBondContact O-CD 3.33Å; P295-R324 HydrophobicContact CB-CG 4.47Å; P295-R324 HydrophobicContact CG-CG 3.95Å; P295-R324 PolarHBondContact O-NH1 3.04Å | ||
| 296 | Y | 94.9 | Very high | 93.9 | Very high | 140 Ų | 140 | 65.3 Ų | 65.3 | 55% | 0.549 | 34% | 0.336 | S | S | . | . | trans | -124.5 | 86.5 | 178.1 | -67.7 | -92.7 | 0 | 0 | 0 | 109 | N294 R324 | N294-Y296 PolarHBondContact O-N 2.59Å; N294-Y296 VanDerWaalsContact OD1-CD2 3.28Å; N294-Y296 WeakPolarHBondContact OD1-CD2 3.27Å; Y296-R324 VanDerWaalsContact CE1-NE 3.32Å; Y296-R324 PolarHBondContact OH-NE 3.19Å | ||
| 297 | P | 94.4 | Very high | 94 | Very high | 11 Ų | 11 | 70 Ų | 70 | 7% | 0.071 | 36% | 0.355 | C | S | . | . | trans | -60.6 | 139.7 | 178.3 | 23.2 | -32 | 0 | 0 | 0 | 111 | Y287 A301 K302 L305 F320 | Y287-P297 HydrophobicContact CE1-CB 3.71Å; Y287-P297 HydrophobicContact CE1-CG 4.28Å; Y287-P297 WeakPolarHBondContact OH-CA 3.36Å; P297-A301 HydrophobicContact CB-CB 3.89Å; P297-K302 HydrophobicContact CB-CG 4Å; P297-K302 HydrophobicContact CG-CG 3.86Å; P297-K302 VanDerWaalsContact O-CE 3.3Å; P297-K302 WeakPolarHBondContact O-CE 3.42Å; P297-L305 HydrophobicContact CB-CD1 4.44Å; P297-F320 HydrophobicContact CG-CD1 4.14Å; P297-F320 HydrophobicContact CG-CD2 4.06Å; P297-F320 HydrophobicContact CG-CE1 4.28Å; P297-F320 HydrophobicContact CG-CE2 4.2Å; P297-F320 HydrophobicContact CG-CG 4.04Å; P297-F320 HydrophobicContact CG-CZ 4.32Å | ||
| 298 | S | 95.6 | Very high | 94 | Very high | 66 Ų | 66 | 73.8 Ų | 73.8 | 46% | 0.462 | 37% | 0.373 | S | S | . | . | trans | -62.8 | 167.9 | 169.1 | 63.3 | 0 | 0 | 0 | 0 | 111 | E300 A301 K302 | S298-E300 VanDerWaalsContact C-N 3.34Å; S298-E300 PolarHBondContact O-N 3.42Å; S298-A301 PolarHBondContact O-N 2.93Å; S298-A301 WeakPolarHBondContact OG-CB 3.3Å; S298-A301 PolarHBondContact OG-N 3.31Å; S298-K302 WeakPolarHBondContact O-CG 3.38Å; S298-K302 PolarHBondContact O-N 3.46Å | ||
| 299 | E | 94.1 | Very high | 93.9 | Very high | 104 Ų | 104 | 74.1 Ų | 74.1 | 49% | 0.486 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | -179.7 | -156.7 | 59.6 | -160.6 | 0 | 0 | 111.8 | A301 K302 E303 | E299-A301 PolarHBondContact O-N 2.94Å; E299-K302 WeakPolarHBondContact O-CB 3.47Å; E299-K302 PolarHBondContact O-N 3.17Å; E299-K302 VanDerWaalsContact O-N 3.15Å; E299-K302 IonicContact OE2-NZ 3.98Å; E299-K302 PolarHBondContact OE2-NZ 2.94Å; E299-E303 PolarHBondContact O-N 3.4Å |
| 300 | E | 95.1 | Very high | 93.9 | Very high | 149 Ų | 149 | 76.4 Ų | 76.4 | 70% | 0.696 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -58.6 | -43.9 | 173.2 | -65.4 | 178.2 | 168.2 | 0 | 0 | 112.2 | S298 K302 E303 E304 | S298-E300 VanDerWaalsContact C-N 3.34Å; S298-E300 PolarHBondContact O-N 3.42Å; E300-K302 VanDerWaalsContact C-N 3.3Å; E300-K302 PolarHBondContact O-N 2.61Å; E300-E303 WeakPolarHBondContact O-CB 3.27Å; E300-E303 PolarHBondContact O-N 2.91Å; E300-E304 PolarHBondContact O-N 3.26Å |
| 301 | A | 95.4 | Very high | 94.1 | Very high | 16 Ų | 16 | 74.5 Ų | 74.5 | 13% | 0.132 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -64.5 | -35.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | Y287 P297 S298 E299 L305 | Y287-A301 HydrophobicContact CE2-CB 4.42Å; P297-A301 HydrophobicContact CB-CB 3.89Å; S298-A301 PolarHBondContact O-N 2.93Å; S298-A301 WeakPolarHBondContact OG-CB 3.3Å; S298-A301 PolarHBondContact OG-N 3.31Å; E299-A301 PolarHBondContact O-N 2.94Å; A301-L305 WeakPolarHBondContact O-CB 3.4Å; A301-L305 WeakPolarHBondContact O-CD1 3.24Å; A301-L305 WeakPolarHBondContact O-CG 3.44Å; A301-L305 PolarHBondContact O-N 3.36Å |
| 302 | K | 96.6 | Very high | 94.2 | Very high | 42 Ų | 42 | 74.5 Ų | 74.5 | 18% | 0.183 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -67.8 | -38.8 | 174.4 | -65 | 171.2 | -162.9 | 161.9 | 0 | 111.8 | P297 S298 E299 E300 L305 A306 V313 V316 | P297-K302 HydrophobicContact CB-CG 4Å; P297-K302 HydrophobicContact CG-CG 3.86Å; P297-K302 VanDerWaalsContact O-CE 3.3Å; P297-K302 WeakPolarHBondContact O-CE 3.42Å; S298-K302 WeakPolarHBondContact O-CG 3.38Å; S298-K302 PolarHBondContact O-N 3.46Å; E299-K302 WeakPolarHBondContact O-CB 3.47Å; E299-K302 PolarHBondContact O-N 3.17Å; E299-K302 VanDerWaalsContact O-N 3.15Å; E299-K302 IonicContact OE2-NZ 3.98Å; E299-K302 PolarHBondContact OE2-NZ 2.94Å; E300-K302 VanDerWaalsContact C-N 3.3Å; E300-K302 PolarHBondContact O-N 2.61Å; K302-L305 PolarHBondContact O-N 2.92Å; K302-A306 WeakPolarHBondContact O-CB 3.08Å; K302-A306 PolarHBondContact O-N 3.3Å; K302-V313 HydrophobicContact CB-CG1 3.99Å; K302-V313 HydrophobicContact CD-CG1 4.38Å; K302-V316 HydrophobicContact CB-CG1 4.22Å; K302-V316 HydrophobicContact CG-CG1 4.22Å |
| 303 | E | 96.9 | Very high | 94.4 | Very high | 114 Ų | 114 | 74 Ų | 74 | 53% | 0.533 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 175.4 | -71.4 | -178.8 | 176.9 | 0 | 0 | 111.4 | E299 E300 A306 K307 V313 | E299-E303 PolarHBondContact O-N 3.4Å; E300-E303 WeakPolarHBondContact O-CB 3.27Å; E300-E303 PolarHBondContact O-N 2.91Å; E303-A306 WeakPolarHBondContact O-CB 3.31Å; E303-A306 PolarHBondContact O-N 2.61Å; E303-K307 WeakPolarHBondContact O-CB 3.41Å; E303-K307 PolarHBondContact O-N 3.32Å; E303-V313 HydrophobicContact CG-CG2 4.13Å |
| 304 | E | 96.1 | Very high | 94.8 | Very high | 113 Ų | 113 | 71.6 Ų | 71.6 | 53% | 0.528 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.5 | -46.1 | 174.6 | -75.1 | -163.7 | -174.6 | 0 | 0 | 112.6 | E300 A306 K307 K308 | E300-E304 PolarHBondContact O-N 3.26Å; E304-A306 VanDerWaalsContact C-N 3.33Å; E304-A306 PolarHBondContact O-N 3.49Å; E304-K307 PolarHBondContact O-N 3.22Å; E304-K308 WeakPolarHBondContact O-CB 3.4Å; E304-K308 WeakPolarHBondContact O-CG 3.21Å; E304-K308 PolarHBondContact O-N 2.9Å; E304-K308 IonicContact OE2-NZ 3.2Å; E304-K308 PolarHBondContact OE2-NZ 3.07Å |
| 305 | L | 96.1 | Very high | 94.9 | Very high | 9 Ų | 9 | 70.6 Ų | 70.6 | 5% | 0.047 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.5 | -40.9 | 178.6 | -72.5 | 167.7 | 0 | 0 | 0 | 111.1 | V283 L284 Y287 P297 A301 K302 K307 K308 C309 V316 F320 | V283-L305 HydrophobicContact CG1-CD2 3.84Å; L284-L305 HydrophobicContact CD2-CB 4.36Å; Y287-L305 HydrophobicContact CD1-CD1 4.18Å; Y287-L305 HydrophobicContact CD2-CD1 4.13Å; Y287-L305 HydrophobicContact CD2-CD2 4.35Å; Y287-L305 HydrophobicContact CE2-CD1 4.49Å; Y287-L305 HydrophobicContact CG-CD1 3.96Å; Y287-L305 HydrophobicContact CG-CD2 4.34Å; P297-L305 HydrophobicContact CB-CD1 4.44Å; A301-L305 WeakPolarHBondContact O-CB 3.4Å; A301-L305 WeakPolarHBondContact O-CD1 3.24Å; A301-L305 WeakPolarHBondContact O-CG 3.44Å; A301-L305 PolarHBondContact O-N 3.36Å; K302-L305 PolarHBondContact O-N 2.92Å; L305-K307 VanDerWaalsContact C-N 3.35Å; L305-K307 PolarHBondContact O-N 3.5Å; L305-K308 PolarHBondContact O-N 3.48Å; L305-C309 WeakPolarHBondContact O-CB 3.23Å; L305-C309 PolarHBondContact O-N 2.83Å; L305-C309 PolarHBondContact O-SG 3.33Å; L305-V316 HydrophobicContact CB-CG1 4.16Å; L305-V316 HydrophobicContact CB-CG2 4.4Å; L305-V316 HydrophobicContact CD1-CG1 4.35Å; L305-F320 HydrophobicContact CD1-CE2 3.78Å; L305-F320 HydrophobicContact CD1-CZ 3.9Å |
| 306 | A | 96.3 | Very high | 95.1 | Very high | 7 Ų | 7 | 69.9 Ų | 69.9 | 6% | 0.058 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -58.2 | -47.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111 | K302 E303 E304 C309 G310 I311 V313 V316 | K302-A306 WeakPolarHBondContact O-CB 3.08Å; K302-A306 PolarHBondContact O-N 3.3Å; E303-A306 WeakPolarHBondContact O-CB 3.31Å; E303-A306 PolarHBondContact O-N 2.61Å; E304-A306 VanDerWaalsContact C-N 3.33Å; E304-A306 PolarHBondContact O-N 3.49Å; A306-C309 PolarHBondContact O-N 3.34Å; A306-G310 PolarHBondContact O-N 2.97Å; A306-I311 CarbonylContact C-O 3.4Å; A306-I311 WeakPolarHBondContact CA-O 3.29Å; A306-I311 VanDerWaalsContact CB-O 3.25Å; A306-I311 WeakPolarHBondContact CB-O 3.5Å; A306-I311 PolarHBondContact O-N 2.89Å; A306-I311 VanDerWaalsContact O-N 3.08Å; A306-V313 HydrophobicContact CB-CG2 3.92Å; A306-V316 HydrophobicContact CB-CG2 3.91Å |
| 307 | K | 96.3 | Very high | 95.1 | Very high | 185 Ų | 185 | 65.3 Ų | 65.3 | 80% | 0.804 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -63.7 | -46.3 | 177.2 | -169.6 | 177.6 | -178.9 | 179.9 | 0 | 112.3 | E303 E304 L305 C309 G310 | E303-K307 WeakPolarHBondContact O-CB 3.41Å; E303-K307 PolarHBondContact O-N 3.32Å; E304-K307 PolarHBondContact O-N 3.22Å; L305-K307 VanDerWaalsContact C-N 3.35Å; L305-K307 PolarHBondContact O-N 3.5Å; K307-C309 VanDerWaalsContact C-N 3.32Å; K307-C309 PolarHBondContact O-N 3.11Å; K307-G310 PolarHBondContact O-N 2.62Å |
| 308 | K | 94.3 | Very high | 95.1 | Very high | 130 Ų | 130 | 69.1 Ų | 69.1 | 57% | 0.565 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -64 | -35.3 | 178.5 | -73.9 | 170.5 | -179 | 161.7 | 0 | 112.5 | V283 E304 L305 | V283-K308 HydrophobicContact CG1-CB 4.24Å; E304-K308 WeakPolarHBondContact O-CB 3.4Å; E304-K308 WeakPolarHBondContact O-CG 3.21Å; E304-K308 PolarHBondContact O-N 2.9Å; E304-K308 IonicContact OE2-NZ 3.2Å; E304-K308 PolarHBondContact OE2-NZ 3.07Å; L305-K308 PolarHBondContact O-N 3.48Å |
| 309 | C | 93.8 | Very high | 95.1 | Very high | 8 Ų | 8 | 67.8 Ų | 67.8 | 5% | 0.054 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -91.9 | -12 | -176.6 | -64.2 | 0 | 0 | 0 | 0 | 113.9 | A280 L305 A306 K307 I311 | A280-C309 HydrophobicContact CB-CB 3.68Å; L305-C309 WeakPolarHBondContact O-CB 3.23Å; L305-C309 PolarHBondContact O-N 2.83Å; L305-C309 PolarHBondContact O-SG 3.33Å; A306-C309 PolarHBondContact O-N 3.34Å; K307-C309 VanDerWaalsContact C-N 3.32Å; K307-C309 PolarHBondContact O-N 3.11Å; C309-I311 VanDerWaalsContact C-N 3.34Å; C309-I311 HydrophobicContact CB-CD1 3.87Å; C309-I311 HydrophobicContact CB-CG1 3.75Å |
| 310 | G | 93.4 | Very high | 95.3 | Very high | 69 Ų | 69 | 63 Ų | 63 | 71% | 0.711 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.1 | 35.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | A306 K307 | A306-G310 PolarHBondContact O-N 2.97Å; K307-G310 PolarHBondContact O-N 2.62Å |
| 311 | I | 93.9 | Very high | 95.3 | Very high | 28 Ų | 28 | 56.8 Ų | 56.8 | 14% | 0.144 | 31% | 0.312 | C | S | . | . | S | Bend | trans | -127.5 | 168.5 | -179.7 | 64.6 | -178.1 | 0 | 0 | 0 | 110.4 | F276 L284 A306 C309 Q315 V316 | F276-I311 HydrophobicContact CD1-CG2 3.92Å; F276-I311 HydrophobicContact CD2-CD1 4.44Å; F276-I311 HydrophobicContact CE1-CD1 4.34Å; F276-I311 HydrophobicContact CE1-CG2 3.92Å; F276-I311 HydrophobicContact CE2-CD1 4.06Å; F276-I311 HydrophobicContact CZ-CD1 4.04Å; L284-I311 HydrophobicContact CD1-CD1 4.04Å; A306-I311 CarbonylContact C-O 3.4Å; A306-I311 WeakPolarHBondContact CA-O 3.29Å; A306-I311 VanDerWaalsContact CB-O 3.25Å; A306-I311 WeakPolarHBondContact CB-O 3.5Å; A306-I311 PolarHBondContact O-N 2.89Å; A306-I311 VanDerWaalsContact O-N 3.08Å; C309-I311 VanDerWaalsContact C-N 3.34Å; C309-I311 HydrophobicContact CB-CD1 3.87Å; C309-I311 HydrophobicContact CB-CG1 3.75Å; I311-Q315 HydrophobicContact CB-CB 4.25Å; I311-Q315 HydrophobicContact CD1-CB 4.35Å; I311-Q315 HydrophobicContact CG1-CB 4.47Å; I311-V316 HydrophobicContact CD1-CG2 3.76Å; I311-V316 HydrophobicContact CG1-CG2 3.85Å |
| 312 | T | 94.8 | Very high | 95.2 | Very high | 79 Ų | 79 | 59.9 Ų | 59.9 | 49% | 0.485 | 33% | 0.326 | S | S | . | . | trans | -78.2 | 153.8 | 178.8 | 62.8 | 0 | 0 | 0 | 0 | 112.3 | S314 Q315 V316 | T312-S314 PolarHBondContact O-N 3.4Å; T312-Q315 WeakPolarHBondContact O-CA 3.46Å; T312-Q315 WeakPolarHBondContact O-CB 3.49Å; T312-Q315 PolarHBondContact O-N 3.44Å; T312-Q315 WeakPolarHBondContact OG1-CB 3.5Å; T312-Q315 VanDerWaalsContact OG1-CD 3.31Å; T312-Q315 VanDerWaalsContact OG1-CG 3.23Å; T312-Q315 WeakPolarHBondContact OG1-CG 3.44Å; T312-Q315 PolarHBondContact OG1-N 3.48Å; T312-Q315 PolarHBondContact OG1-OE1 3.28Å; T312-V316 PolarHBondContact O-N 2.93Å | ||
| 313 | V | 95.4 | Very high | 95.1 | Very high | 46 Ų | 46 | 58.9 Ų | 58.9 | 28% | 0.279 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -57.2 | -35.4 | 174.9 | -180 | 0 | 0 | 0 | 0 | 111.9 | K302 E303 A306 V316 S317 | K302-V313 HydrophobicContact CB-CG1 3.99Å; K302-V313 HydrophobicContact CD-CG1 4.38Å; E303-V313 HydrophobicContact CG-CG2 4.13Å; A306-V313 HydrophobicContact CB-CG2 3.92Å; V313-V316 PolarHBondContact O-N 3.22Å; V313-S317 PolarHBondContact O-N 2.85Å; V313-S317 PolarHBondContact O-OG 2.93Å; V313-S317 VanDerWaalsContact O-OG 3.06Å |
| 314 | S | 94 | Very high | 95.1 | Very high | 74 Ų | 74 | 56.6 Ų | 56.6 | 52% | 0.517 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64 | -40.9 | 173.7 | -175 | 0 | 0 | 0 | 0 | 112.1 | T312 S317 N318 | T312-S314 PolarHBondContact O-N 3.4Å; S314-S317 PolarHBondContact O-N 3.37Å; S314-N318 WeakPolarHBondContact O-CB 3.39Å; S314-N318 PolarHBondContact O-N 3.13Å; S314-N318 PolarHBondContact O-ND2 3.39Å |
| 315 | Q | 93.1 | Very high | 94.9 | Very high | 78 Ų | 78 | 55.3 Ų | 55.3 | 36% | 0.364 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 174.8 | -78.5 | 166.9 | -44.5 | 0 | 0 | 112.3 | F276 I311 T312 W319 | F276-Q315 HydrophobicContact CE1-CB 4.39Å; F276-Q315 HydrophobicContact CE1-CG 4.48Å; F276-Q315 HydrophobicContact CZ-CB 3.92Å; F276-Q315 HydrophobicContact CZ-CG 4.33Å; I311-Q315 HydrophobicContact CB-CB 4.25Å; I311-Q315 HydrophobicContact CD1-CB 4.35Å; I311-Q315 HydrophobicContact CG1-CB 4.47Å; T312-Q315 WeakPolarHBondContact O-CA 3.46Å; T312-Q315 WeakPolarHBondContact O-CB 3.49Å; T312-Q315 PolarHBondContact O-N 3.44Å; T312-Q315 WeakPolarHBondContact OG1-CB 3.5Å; T312-Q315 VanDerWaalsContact OG1-CD 3.31Å; T312-Q315 VanDerWaalsContact OG1-CG 3.23Å; T312-Q315 WeakPolarHBondContact OG1-CG 3.44Å; T312-Q315 PolarHBondContact OG1-N 3.48Å; T312-Q315 PolarHBondContact OG1-OE1 3.28Å; Q315-W319 VanDerWaalsContact O-CB 3.31Å; Q315-W319 WeakPolarHBondContact O-CB 3.26Å; Q315-W319 PolarHBondContact O-N 2.9Å |
| 316 | V | 96.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -61.3 | -50.8 | 172.5 | 178.5 | 0 | 0 | 0 | 0 | 110.3 | L284 K302 L305 A306 I311 T312 V313 N318 W319 F320 | L284-V316 HydrophobicContact CD2-CG1 4.22Å; L284-V316 HydrophobicContact CD2-CG2 4.47Å; K302-V316 HydrophobicContact CB-CG1 4.22Å; K302-V316 HydrophobicContact CG-CG1 4.22Å; L305-V316 HydrophobicContact CB-CG1 4.16Å; L305-V316 HydrophobicContact CB-CG2 4.4Å; L305-V316 HydrophobicContact CD1-CG1 4.35Å; A306-V316 HydrophobicContact CB-CG2 3.91Å; I311-V316 HydrophobicContact CD1-CG2 3.76Å; I311-V316 HydrophobicContact CG1-CG2 3.85Å; T312-V316 PolarHBondContact O-N 2.93Å; V313-V316 PolarHBondContact O-N 3.22Å; V316-N318 VanDerWaalsContact C-N 3.33Å; V316-N318 PolarHBondContact O-N 3.46Å; V316-W319 PolarHBondContact O-N 2.83Å; V316-W319 VanDerWaalsContact O-N 3.08Å; V316-F320 HydrophobicContact CG1-CD2 3.73Å; V316-F320 HydrophobicContact CG1-CE2 3.79Å; V316-F320 WeakPolarHBondContact O-CD2 3.44Å; V316-F320 PolarHBondContact O-N 3.22Å |
| 317 | S | 95.6 | Very high | 94.4 | Very high | 43 Ų | 43 | 63.3 Ų | 63.3 | 30% | 0.301 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -56.2 | -46.6 | 178.8 | -64.4 | 0 | 0 | 0 | 0 | 112.2 | V313 S314 F320 G321 | V313-S317 PolarHBondContact O-N 2.85Å; V313-S317 PolarHBondContact O-OG 2.93Å; V313-S317 VanDerWaalsContact O-OG 3.06Å; S314-S317 PolarHBondContact O-N 3.37Å; S317-F320 PolarHBondContact O-N 3.27Å; S317-G321 PolarHBondContact O-N 2.86Å |
| 318 | N | 94.7 | Very high | 94.1 | Very high | 92 Ų | 92 | 62.3 Ų | 62.3 | 49% | 0.492 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 176.6 | -72.5 | -33.7 | 0 | 0 | 0 | 112.1 | S314 V316 N322 | S314-N318 WeakPolarHBondContact O-CB 3.39Å; S314-N318 PolarHBondContact O-N 3.13Å; S314-N318 PolarHBondContact O-ND2 3.39Å; V316-N318 VanDerWaalsContact C-N 3.33Å; V316-N318 PolarHBondContact O-N 3.46Å; N318-N322 VanDerWaalsContact O-CB 3.31Å; N318-N322 WeakPolarHBondContact O-CB 3.43Å; N318-N322 VanDerWaalsContact O-CG 3.23Å; N318-N322 PolarHBondContact O-N 3.45Å; N318-N322 PolarHBondContact O-ND2 3.45Å |
| 319 | W | 95.6 | Very high | 93.9 | Very high | 38 Ų | 38 | 63.9 Ų | 63.9 | 14% | 0.144 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.2 | -47.9 | 178 | -171.9 | 97.2 | 0 | 0 | 0 | 111.4 | F276 L284 N285 F288 Q315 V316 N322 K323 | F276-W319 AromaticContact CD2-CD1 3.71Å; F276-W319 HydrophobicContact CE2-CB 4.13Å; F276-W319 AromaticContact CE2-CD1 3.49Å; F276-W319 VanDerWaalsContact CE2-CD1 3.49Å; F276-W319 HydrophobicContact CE2-CG 4.08Å; L284-W319 VanDerWaalsContact C-CH2 3.5Å; L284-W319 HydrophobicContact CB-CD2 3.95Å; L284-W319 HydrophobicContact CB-CE3 3.86Å; L284-W319 HydrophobicContact CB-CH2 3.66Å; L284-W319 HydrophobicContact CB-CZ2 3.71Å; L284-W319 HydrophobicContact CB-CZ3 3.73Å; L284-W319 HydrophobicContact CD1-CB 4.47Å; L284-W319 HydrophobicContact CD1-CD2 3.84Å; L284-W319 HydrophobicContact CD1-CE3 4.39Å; L284-W319 HydrophobicContact CD1-CG 3.86Å; L284-W319 HydrophobicContact CD2-CE3 4.47Å; L284-W319 HydrophobicContact CG-CD2 4.38Å; L284-W319 HydrophobicContact CG-CE3 4.47Å; L284-W319 WeakPolarHBondContact O-CH2 3.45Å; N285-W319 WeakPolarHBondContact OD1-CH2 3.37Å; N285-W319 WeakPolarHBondContact OD1-CZ2 3.38Å; F288-W319 HydrophobicContact CB-CH2 4.26Å; F288-W319 HydrophobicContact CB-CZ3 4.12Å; F288-W319 HydrophobicContact CD2-CZ3 4.38Å; F288-W319 HydrophobicContact CG-CZ3 4.48Å; Q315-W319 VanDerWaalsContact O-CB 3.31Å; Q315-W319 WeakPolarHBondContact O-CB 3.26Å; Q315-W319 PolarHBondContact O-N 2.9Å; V316-W319 PolarHBondContact O-N 2.83Å; V316-W319 VanDerWaalsContact O-N 3.08Å; W319-N322 PolarHBondContact O-N 2.98Å; W319-K323 HydrophobicContact CD2-CB 4.48Å; W319-K323 HydrophobicContact CE3-CB 4.06Å; W319-K323 HydrophobicContact CH2-CB 4.08Å; W319-K323 HydrophobicContact CH2-CD 3.78Å; W319-K323 HydrophobicContact CH2-CG 3.72Å; W319-K323 HydrophobicContact CZ2-CD 3.95Å; W319-K323 HydrophobicContact CZ2-CG 4.31Å; W319-K323 HydrophobicContact CZ3-CB 3.84Å; W319-K323 HydrophobicContact CZ3-CD 4.42Å; W319-K323 HydrophobicContact CZ3-CG 3.88Å; W319-K323 WeakPolarHBondContact O-CB 3.45Å; W319-K323 PolarHBondContact O-N 3.33Å |
| 320 | F | 96.7 | Very high | 93.5 | Very high | 3 Ų | 3 | 67.9 Ų | 67.9 | 1% | 0.013 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 178.7 | -86.1 | -88.2 | 0 | 0 | 0 | 112.3 | L284 Y287 F288 P297 L305 V316 S317 N322 K323 R324 | L284-F320 HydrophobicContact CD2-CD2 4.48Å; L284-F320 HydrophobicContact CD2-CE2 3.68Å; L284-F320 HydrophobicContact CD2-CZ 4.44Å; Y287-F320 AromaticContact CD1-CE1 3.61Å; Y287-F320 HydrophobicContact CD1-CE1 3.61Å; Y287-F320 AromaticContact CD1-CZ 3.5Å; Y287-F320 HydrophobicContact CD1-CZ 3.5Å; Y287-F320 HydrophobicContact CE1-CE1 4.19Å; Y287-F320 HydrophobicContact CE1-CZ 4.26Å; Y287-F320 HydrophobicContact CG-CZ 4.17Å; F288-F320 HydrophobicContact CB-CE1 4.02Å; F288-F320 AromaticContact CD2-CD1 3.94Å; F288-F320 HydrophobicContact CD2-CD1 3.94Å; F288-F320 HydrophobicContact CD2-CE1 4.03Å; P297-F320 HydrophobicContact CG-CD1 4.14Å; P297-F320 HydrophobicContact CG-CD2 4.06Å; P297-F320 HydrophobicContact CG-CE1 4.28Å; P297-F320 HydrophobicContact CG-CE2 4.2Å; P297-F320 HydrophobicContact CG-CG 4.04Å; P297-F320 HydrophobicContact CG-CZ 4.32Å; L305-F320 HydrophobicContact CD1-CE2 3.78Å; L305-F320 HydrophobicContact CD1-CZ 3.9Å; V316-F320 HydrophobicContact CG1-CD2 3.73Å; V316-F320 HydrophobicContact CG1-CE2 3.79Å; V316-F320 WeakPolarHBondContact O-CD2 3.44Å; V316-F320 PolarHBondContact O-N 3.22Å; S317-F320 PolarHBondContact O-N 3.27Å; F320-N322 VanDerWaalsContact C-N 3.35Å; F320-N322 PolarHBondContact O-N 3.43Å; F320-K323 PolarHBondContact O-N 3.29Å; F320-R324 WeakPolarHBondContact O-CG 3.48Å; F320-R324 PolarHBondContact O-N 3.03Å |
| 321 | G | 95.5 | Very high | 92.9 | Very high | 19 Ų | 19 | 69 Ų | 69 | 20% | 0.196 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -57.1 | -47.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | S317 I325 | S317-G321 PolarHBondContact O-N 2.86Å; G321-I325 WeakPolarHBondContact O-CG1 3.46Å; G321-I325 PolarHBondContact O-N 2.98Å |
| 322 | N | 95 | Very high | 92.1 | Very high | 81 Ų | 81 | 70.4 Ų | 70.4 | 43% | 0.433 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.5 | -42.9 | 178 | -75.1 | -45.9 | 0 | 0 | 0 | 112.9 | N318 W319 F320 I325 R326 | N318-N322 VanDerWaalsContact O-CB 3.31Å; N318-N322 WeakPolarHBondContact O-CB 3.43Å; N318-N322 VanDerWaalsContact O-CG 3.23Å; N318-N322 PolarHBondContact O-N 3.45Å; N318-N322 PolarHBondContact O-ND2 3.45Å; W319-N322 PolarHBondContact O-N 2.98Å; F320-N322 VanDerWaalsContact C-N 3.35Å; F320-N322 PolarHBondContact O-N 3.43Å; N322-I325 PolarHBondContact O-N 3.07Å; N322-R326 VanDerWaalsContact O-CG 3.32Å; N322-R326 WeakPolarHBondContact O-CG 3.15Å; N322-R326 PolarHBondContact O-N 3.17Å |
| 323 | K | 94.4 | Very high | 91.3 | Very high | 21 Ų | 21 | 74.1 Ų | 74.1 | 9% | 0.091 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -63.7 | -42.2 | -179.9 | -171.8 | 79 | -176.3 | -167.7 | 0 | 110.8 | N285 F288 Y289 W319 F320 I325 R326 Y327 E337 | N285-K323 WeakPolarHBondContact OD1-CE 3.29Å; N285-K323 PolarHBondContact OD1-NZ 3.01Å; F288-K323 HydrophobicContact CD1-CG 4Å; F288-K323 HydrophobicContact CD2-CB 4.19Å; F288-K323 HydrophobicContact CD2-CG 3.72Å; F288-K323 HydrophobicContact CE1-CG 3.95Å; F288-K323 HydrophobicContact CE2-CB 4Å; F288-K323 HydrophobicContact CE2-CG 3.65Å; F288-K323 HydrophobicContact CG-CG 3.9Å; F288-K323 HydrophobicContact CZ-CB 4.48Å; F288-K323 HydrophobicContact CZ-CG 3.78Å; Y289-K323 WeakPolarHBondContact OH-CE 3.22Å; Y289-K323 PolarHBondContact OH-NZ 3.32Å; W319-K323 HydrophobicContact CD2-CB 4.48Å; W319-K323 HydrophobicContact CE3-CB 4.06Å; W319-K323 HydrophobicContact CH2-CB 4.08Å; W319-K323 HydrophobicContact CH2-CD 3.78Å; W319-K323 HydrophobicContact CH2-CG 3.72Å; W319-K323 HydrophobicContact CZ2-CD 3.95Å; W319-K323 HydrophobicContact CZ2-CG 4.31Å; W319-K323 HydrophobicContact CZ3-CB 3.84Å; W319-K323 HydrophobicContact CZ3-CD 4.42Å; W319-K323 HydrophobicContact CZ3-CG 3.88Å; W319-K323 WeakPolarHBondContact O-CB 3.45Å; W319-K323 PolarHBondContact O-N 3.33Å; F320-K323 PolarHBondContact O-N 3.29Å; K323-I325 PolarHBondContact O-N 3.12Å; K323-R326 PolarHBondContact O-N 3.25Å; K323-Y327 VanDerWaalsContact O-CB 3.3Å; K323-Y327 WeakPolarHBondContact O-CB 3.41Å; K323-Y327 PolarHBondContact O-N 2.65Å; K323-E337 IonicContact NZ-OE2 3.64Å; K323-E337 PolarHBondContact NZ-OE2 3.26Å |
| 324 | R | 94.9 | Very high | 90.5 | Very high | 65 Ų | 65 | 73.8 Ų | 73.8 | 25% | 0.245 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59 | -46.2 | 174.1 | -74.4 | -166.4 | -56.7 | -89 | -0.6 | 112.7 | F288 P295 Y296 F320 Y327 K328 | F288-R324 HydrophobicContact CE2-CG 3.75Å; F288-R324 HydrophobicContact CZ-CG 4.37Å; P295-R324 HydrophobicContact CB-CG 4.47Å; P295-R324 HydrophobicContact CG-CG 3.95Å; P295-R324 PolarHBondContact O-NH1 3.04Å; Y296-R324 VanDerWaalsContact CE1-NE 3.32Å; Y296-R324 PolarHBondContact OH-NE 3.19Å; F320-R324 WeakPolarHBondContact O-CG 3.48Å; F320-R324 PolarHBondContact O-N 3.03Å; R324-Y327 PolarHBondContact O-N 2.87Å; R324-K328 WeakPolarHBondContact O-CB 3.4Å; R324-K328 PolarHBondContact O-N 3.47Å |
| 325 | I | 93 | Very high | 89.7 | Confident | 87 Ų | 87 | 74 Ų | 74 | 45% | 0.446 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63 | -44.8 | 178.6 | -66 | 168.4 | 0 | 0 | 0 | 110.6 | G321 N322 K323 K329 | G321-I325 WeakPolarHBondContact O-CG1 3.46Å; G321-I325 PolarHBondContact O-N 2.98Å; N322-I325 PolarHBondContact O-N 3.07Å; K323-I325 PolarHBondContact O-N 3.12Å; I325-K329 HydrophobicContact CG2-CD 4.1Å; I325-K329 WeakPolarHBondContact O-CB 3.24Å; I325-K329 WeakPolarHBondContact O-CG 3.46Å; I325-K329 PolarHBondContact O-N 2.93Å |
| 326 | R | 91.7 | Very high | 88.9 | Confident | 150 Ų | 150 | 77.2 Ų | 77.2 | 57% | 0.566 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -64.5 | -44.3 | 178.9 | -70.6 | 177.1 | -166.9 | -174.2 | 4.5 | 112.2 | N322 K323 K329 N330 F334 | N322-R326 VanDerWaalsContact O-CG 3.32Å; N322-R326 WeakPolarHBondContact O-CG 3.15Å; N322-R326 PolarHBondContact O-N 3.17Å; K323-R326 PolarHBondContact O-N 3.25Å; R326-K329 PolarHBondContact O-N 2.9Å; R326-N330 PolarHBondContact O-N 3.15Å; R326-F334 HydrophobicContact CB-CE2 4.18Å; R326-F334 HydrophobicContact CB-CZ 4.27Å; R326-F334 WeakPolarHBondContact O-CE2 3.29Å |
| 327 | Y | 90.6 | Very high | 88.2 | Confident | 34 Ų | 34 | 80.8 Ų | 80.8 | 13% | 0.133 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -59.5 | -50.9 | 177.4 | -173.9 | -92.2 | 0 | 0 | 0 | 110.9 | F288 Y289 L292 K323 R324 K329 N330 I331 F334 Q335 | F288-Y327 HydrophobicContact CE1-CD2 4.04Å; F288-Y327 HydrophobicContact CE1-CG 4.14Å; F288-Y327 HydrophobicContact CZ-CG 4.21Å; Y289-Y327 HydrophobicContact CE1-CD2 4.33Å; Y289-Y327 HydrophobicContact CE1-CE2 4.12Å; L292-Y327 HydrophobicContact CD1-CD1 4.49Å; L292-Y327 HydrophobicContact CD1-CD2 4.43Å; L292-Y327 HydrophobicContact CD1-CE1 4.04Å; L292-Y327 HydrophobicContact CD1-CE2 4Å; K323-Y327 VanDerWaalsContact O-CB 3.3Å; K323-Y327 WeakPolarHBondContact O-CB 3.41Å; K323-Y327 PolarHBondContact O-N 2.65Å; R324-Y327 PolarHBondContact O-N 2.87Å; Y327-K329 VanDerWaalsContact C-N 3.31Å; Y327-K329 PolarHBondContact O-N 3.38Å; Y327-N330 CarbonylContact O-C 3.5Å; Y327-N330 PolarHBondContact O-N 3.21Å; Y327-I331 HydrophobicContact CE1-CG1 4.38Å; Y327-I331 WeakPolarHBondContact O-CG1 3.21Å; Y327-I331 PolarHBondContact O-N 2.67Å; Y327-I331 VanDerWaalsContact O-N 3.14Å; Y327-F334 HydrophobicContact CD2-CB 3.46Å; Y327-F334 VanDerWaalsContact CD2-CB 3.46Å; Y327-F334 HydrophobicContact CD2-CG 4.21Å; Y327-F334 HydrophobicContact CE2-CB 3.71Å; Y327-F334 HydrophobicContact CG-CB 4.47Å; Y327-Q335 PolarHBondContact OH-OE1 3.47Å |
| 328 | K | 89.5 | Confident | 87.4 | Confident | 163 Ų | 163 | 79.1 Ų | 79.1 | 71% | 0.709 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -60.8 | -37.1 | 179.2 | -172.4 | 173.9 | 67.9 | 173 | 0 | 113 | R324 | R324-K328 WeakPolarHBondContact O-CB 3.4Å; R324-K328 PolarHBondContact O-N 3.47Å |
| 329 | K | 89.9 | Confident | 86.9 | Confident | 163 Ų | 163 | 79 Ų | 79 | 71% | 0.709 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -74.9 | -20.9 | 179.9 | -75.9 | -175.5 | 176.5 | -171.3 | 0 | 113.8 | I325 R326 Y327 | I325-K329 HydrophobicContact CG2-CD 4.1Å; I325-K329 WeakPolarHBondContact O-CB 3.24Å; I325-K329 WeakPolarHBondContact O-CG 3.46Å; I325-K329 PolarHBondContact O-N 2.93Å; R326-K329 PolarHBondContact O-N 2.9Å; Y327-K329 VanDerWaalsContact C-N 3.31Å; Y327-K329 PolarHBondContact O-N 3.38Å |
| 330 | N | 84.5 | Confident | 86.4 | Confident | 92 Ų | 92 | 83.1 Ų | 83.1 | 49% | 0.492 | 41% | 0.407 | S | S | . | . | trans | -143.8 | 52.2 | -172.6 | -95.9 | -32.5 | 0 | 0 | 0 | 112.2 | R326 Y327 G332 K333 F334 | R326-N330 PolarHBondContact O-N 3.15Å; Y327-N330 CarbonylContact O-C 3.5Å; Y327-N330 PolarHBondContact O-N 3.21Å; N330-G332 VanDerWaalsContact C-N 3.3Å; N330-G332 PolarHBondContact O-N 2.88Å; N330-K333 PolarHBondContact O-N 3.45Å; N330-F334 HydrophobicContact CB-CD2 3.91Å; N330-F334 HydrophobicContact CB-CE2 3.91Å; N330-F334 VanDerWaalsContact O-CD2 3.3Å; N330-F334 WeakPolarHBondContact O-CD2 3.3Å; N330-F334 PolarHBondContact O-N 3.01Å | ||
| 331 | I | 81.1 | Confident | 85.9 | Confident | 92 Ų | 92 | 85 Ų | 85 | 47% | 0.472 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -50.5 | -47.7 | -175.6 | -73.9 | 171.6 | 0 | 0 | 0 | 112.1 | Y327 K333 F334 Q335 | Y327-I331 HydrophobicContact CE1-CG1 4.38Å; Y327-I331 WeakPolarHBondContact O-CG1 3.21Å; Y327-I331 PolarHBondContact O-N 2.67Å; Y327-I331 VanDerWaalsContact O-N 3.14Å; I331-K333 PolarHBondContact O-N 3.07Å; I331-F334 PolarHBondContact O-N 3.27Å; I331-Q335 WeakPolarHBondContact O-CB 3.41Å; I331-Q335 PolarHBondContact O-N 2.93Å |
| 332 | G | 77.2 | Confident | 85.3 | Confident | 58 Ų | 58 | 86.9 Ų | 86.9 | 60% | 0.598 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -58.3 | -42.5 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | N330 | N330-G332 VanDerWaalsContact C-N 3.3Å; N330-G332 PolarHBondContact O-N 2.88Å |
| 333 | K | 77.8 | Confident | 84.8 | Confident | 158 Ų | 158 | 87.4 Ų | 87.4 | 69% | 0.687 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -71.7 | -37.6 | 178 | -79.6 | -171.7 | 175 | -176.3 | 0 | 112.8 | N330 I331 Q335 | N330-K333 PolarHBondContact O-N 3.45Å; I331-K333 PolarHBondContact O-N 3.07Å; K333-Q335 VanDerWaalsContact C-N 3.33Å |
| 334 | F | 79.4 | Confident | 84.3 | Confident | 39 Ų | 39 | 90.8 Ų | 90.8 | 17% | 0.171 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -84.1 | -9.9 | -178.2 | -71.2 | -71.6 | 0 | 0 | 0 | 113.3 | R326 Y327 N330 I331 E337 A338 | R326-F334 HydrophobicContact CB-CE2 4.18Å; R326-F334 HydrophobicContact CB-CZ 4.27Å; R326-F334 WeakPolarHBondContact O-CE2 3.29Å; Y327-F334 HydrophobicContact CD2-CB 3.46Å; Y327-F334 VanDerWaalsContact CD2-CB 3.46Å; Y327-F334 HydrophobicContact CD2-CG 4.21Å; Y327-F334 HydrophobicContact CE2-CB 3.71Å; Y327-F334 HydrophobicContact CG-CB 4.47Å; N330-F334 HydrophobicContact CB-CD2 3.91Å; N330-F334 HydrophobicContact CB-CE2 3.91Å; N330-F334 VanDerWaalsContact O-CD2 3.3Å; N330-F334 WeakPolarHBondContact O-CD2 3.3Å; N330-F334 PolarHBondContact O-N 3.01Å; I331-F334 PolarHBondContact O-N 3.27Å; F334-E337 WeakPolarHBondContact CD1-OE2 3.46Å; F334-E337 PolarHBondContact O-N 3.23Å; F334-A338 WeakPolarHBondContact O-CB 3.18Å; F334-A338 PolarHBondContact O-N 2.96Å |
| 335 | Q | 77.1 | Confident | 83.7 | Confident | 78 Ų | 78 | 90.8 Ų | 90.8 | 36% | 0.364 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -67.9 | -36.8 | 172.7 | -169 | 64.1 | 42.9 | 0 | 0 | 111.8 | Y327 I331 K333 A338 N339 | Y327-Q335 PolarHBondContact OH-OE1 3.47Å; I331-Q335 WeakPolarHBondContact O-CB 3.41Å; I331-Q335 PolarHBondContact O-N 2.93Å; K333-Q335 VanDerWaalsContact C-N 3.33Å; Q335-A338 WeakPolarHBondContact O-CB 3.42Å; Q335-A338 PolarHBondContact O-N 3.34Å; Q335-N339 PolarHBondContact NE2-OD1 2.96Å; Q335-N339 VanDerWaalsContact O-CG 3.24Å; Q335-N339 PolarHBondContact O-N 3.44Å; Q335-N339 PolarHBondContact O-OD1 3.36Å |
| 336 | E | 76.4 | Confident | 83.1 | Confident | 145 Ų | 145 | 89.6 Ų | 89.6 | 68% | 0.678 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -63.8 | -43.1 | 173.6 | -70.1 | 178.1 | -177.8 | 0 | 0 | 111.5 | N339 L340 | E336-N339 PolarHBondContact O-N 3.14Å; E336-L340 WeakPolarHBondContact O-CG 3.48Å; E336-L340 PolarHBondContact O-N 2.73Å; E336-L340 VanDerWaalsContact O-N 3.11Å |
| 337 | E | 81.1 | Confident | 82.7 | Confident | 76 Ų | 76 | 86 Ų | 86 | 36% | 0.355 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61.1 | -44.6 | 171.8 | -74.2 | -171.6 | 175.4 | 0 | 0 | 111.2 | Y289 K323 F334 N339 L340 Y341 | Y289-E337 HydrophobicContact CE2-CB 4.42Å; Y289-E337 WeakPolarHBondContact OH-CB 3.23Å; Y289-E337 PolarHBondContact OH-OE2 3.15Å; K323-E337 IonicContact NZ-OE2 3.64Å; K323-E337 PolarHBondContact NZ-OE2 3.26Å; F334-E337 WeakPolarHBondContact CD1-OE2 3.46Å; F334-E337 PolarHBondContact O-N 3.23Å; E337-N339 VanDerWaalsContact C-N 3.3Å; E337-N339 PolarHBondContact O-N 2.97Å; E337-L340 WeakPolarHBondContact O-CB 3.12Å; E337-L340 PolarHBondContact O-N 2.59Å; E337-L340 VanDerWaalsContact O-N 3.15Å; E337-Y341 VanDerWaalsContact O-CD2 3.28Å; E337-Y341 WeakPolarHBondContact O-CD2 3.34Å; E337-Y341 PolarHBondContact O-N 2.98Å; E337-Y341 VanDerWaalsContact O-N 3.09Å |
| 338 | A | 80.3 | Confident | 82.2 | Confident | 8 Ų | 8 | 87.9 Ų | 87.9 | 7% | 0.066 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -59 | -42 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y289 L292 F334 Q335 L340 Y341 A342 | Y289-A338 HydrophobicContact CD1-CB 3.57Å; Y289-A338 HydrophobicContact CE1-CB 3.68Å; L292-A338 HydrophobicContact CD2-CB 4.39Å; F334-A338 WeakPolarHBondContact O-CB 3.18Å; F334-A338 PolarHBondContact O-N 2.96Å; Q335-A338 WeakPolarHBondContact O-CB 3.42Å; Q335-A338 PolarHBondContact O-N 3.34Å; A338-L340 PolarHBondContact O-N 3.16Å; A338-Y341 PolarHBondContact O-N 3.46Å; A338-A342 WeakPolarHBondContact O-CB 3.5Å; A338-A342 PolarHBondContact O-N 3.48Å |
| 339 | N | 84.2 | Confident | 81.8 | Confident | 89 Ų | 89 | 83 Ų | 83 | 48% | 0.476 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.1 | -40.7 | 176.6 | -69.2 | -7.1 | 0 | 0 | 0 | 111.7 | Q335 E336 E337 A342 V343 | Q335-N339 PolarHBondContact NE2-OD1 2.96Å; Q335-N339 VanDerWaalsContact O-CG 3.24Å; Q335-N339 PolarHBondContact O-N 3.44Å; Q335-N339 PolarHBondContact O-OD1 3.36Å; E336-N339 PolarHBondContact O-N 3.14Å; E337-N339 VanDerWaalsContact C-N 3.3Å; E337-N339 PolarHBondContact O-N 2.97Å; N339-A342 PolarHBondContact O-N 3.28Å; N339-V343 VanDerWaalsContact O-CG2 3.31Å; N339-V343 WeakPolarHBondContact O-CG2 3.28Å; N339-V343 PolarHBondContact O-N 2.94Å |
| 340 | L | 85.2 | Confident | 81.3 | Confident | 124 Ų | 124 | 77.8 Ų | 77.8 | 65% | 0.649 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -60.4 | -45.2 | 175.6 | -74.3 | 164.8 | 0 | 0 | 0 | 112.1 | E336 E337 A338 V343 K344 | E336-L340 WeakPolarHBondContact O-CG 3.48Å; E336-L340 PolarHBondContact O-N 2.73Å; E336-L340 VanDerWaalsContact O-N 3.11Å; E337-L340 WeakPolarHBondContact O-CB 3.12Å; E337-L340 PolarHBondContact O-N 2.59Å; E337-L340 VanDerWaalsContact O-N 3.15Å; A338-L340 PolarHBondContact O-N 3.16Å; L340-V343 PolarHBondContact O-N 3.39Å; L340-K344 WeakPolarHBondContact O-CB 3.46Å; L340-K344 PolarHBondContact O-N 3.44Å |
| 341 | Y | 84.8 | Confident | 80.9 | Confident | 42 Ų | 42 | 77.9 Ų | 77.9 | 17% | 0.165 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -70.7 | -33.3 | 178.1 | -79 | -86.3 | 0 | 0 | 0 | 112.5 | N285 E286 Y289 E337 A338 K344 T345 | N285-Y341 HydrophobicContact CB-CE1 3.73Å; N285-Y341 HydrophobicContact CB-CE2 3.93Å; N285-Y341 VanDerWaalsContact CB-CZ 3.41Å; N285-Y341 WeakPolarHBondContact CB-OH 3.47Å; N285-Y341 PolarHBondContact ND2-OH 2.98Å; E286-Y341 HydrophobicContact CB-CD1 4.44Å; Y289-Y341 HydrophobicContact CD2-CD1 4.36Å; Y289-Y341 AromaticContact CD2-CD2 3.36Å; Y289-Y341 HydrophobicContact CD2-CD2 3.36Å; Y289-Y341 AromaticContact CD2-CE2 3.93Å; Y289-Y341 HydrophobicContact CD2-CE2 3.93Å; Y289-Y341 AromaticContact CD2-CG 3.64Å; Y289-Y341 HydrophobicContact CD2-CG 3.64Å; Y289-Y341 AromaticContact CE2-CD2 3.61Å; Y289-Y341 HydrophobicContact CE2-CD2 3.61Å; Y289-Y341 AromaticContact CE2-CE2 3.83Å; Y289-Y341 HydrophobicContact CE2-CE2 3.83Å; Y289-Y341 HydrophobicContact CE2-CG 4.35Å; Y289-Y341 HydrophobicContact CG-CD2 4.26Å; Y289-Y341 HydrophobicContact CG-CG 4.31Å; E337-Y341 VanDerWaalsContact O-CD2 3.28Å; E337-Y341 WeakPolarHBondContact O-CD2 3.34Å; E337-Y341 PolarHBondContact O-N 2.98Å; E337-Y341 VanDerWaalsContact O-N 3.09Å; A338-Y341 PolarHBondContact O-N 3.46Å; Y341-K344 PolarHBondContact O-N 2.99Å; Y341-T345 WeakPolarHBondContact O-CB 3.36Å; Y341-T345 PolarHBondContact O-N 3.13Å; Y341-T345 PolarHBondContact O-OG1 3.36Å |
| 342 | A | 83.5 | Confident | 80.6 | Confident | 59 Ų | 59 | 78.1 Ų | 78.1 | 49% | 0.488 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A338 N339 T345 A346 | A338-A342 WeakPolarHBondContact O-CB 3.5Å; A338-A342 PolarHBondContact O-N 3.48Å; N339-A342 PolarHBondContact O-N 3.28Å; A342-T345 PolarHBondContact O-N 2.96Å; A342-A346 WeakPolarHBondContact O-CB 3.39Å; A342-A346 PolarHBondContact O-N 2.87Å |
| 343 | V | 85.1 | Confident | 80.4 | Confident | 93 Ų | 93 | 78.4 Ų | 78.4 | 56% | 0.564 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -63.3 | -45 | 175.5 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | N339 L340 T345 A346 V347 | N339-V343 VanDerWaalsContact O-CG2 3.31Å; N339-V343 WeakPolarHBondContact O-CG2 3.28Å; N339-V343 PolarHBondContact O-N 2.94Å; L340-V343 PolarHBondContact O-N 3.39Å; V343-T345 VanDerWaalsContact C-N 3.35Å; V343-T345 PolarHBondContact O-N 2.96Å; V343-A346 PolarHBondContact O-N 3.08Å; V343-V347 HydrophobicContact CG1-CG2 4.41Å; V343-V347 WeakPolarHBondContact O-CG2 3.42Å; V343-V347 PolarHBondContact O-N 3.04Å |
| 344 | K | 83 | Confident | 80.1 | Confident | 91 Ų | 91 | 73.5 Ų | 73.5 | 40% | 0.396 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -58.4 | -47.2 | 177.4 | -170.7 | -178.6 | 177 | -171.4 | 0 | 111.7 | L340 Y341 A346 V347 D348 | L340-K344 WeakPolarHBondContact O-CB 3.46Å; L340-K344 PolarHBondContact O-N 3.44Å; Y341-K344 PolarHBondContact O-N 2.99Å; K344-A346 VanDerWaalsContact C-N 3.31Å; K344-A346 PolarHBondContact O-N 2.74Å; K344-V347 PolarHBondContact O-N 2.77Å; K344-D348 PolarHBondContact O-N 3.36Å |
| 345 | T | 81.9 | Confident | 79.2 | Confident | 65 Ų | 65 | 78.3 Ų | 78.3 | 40% | 0.399 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60.8 | -40.4 | 177.8 | -52.5 | 0 | 0 | 0 | 0 | 111.8 | Y341 A342 V343 D348 A349 | Y341-T345 WeakPolarHBondContact O-CB 3.36Å; Y341-T345 PolarHBondContact O-N 3.13Å; Y341-T345 PolarHBondContact O-OG1 3.36Å; A342-T345 PolarHBondContact O-N 2.96Å; V343-T345 VanDerWaalsContact C-N 3.35Å; V343-T345 PolarHBondContact O-N 2.96Å; T345-D348 PolarHBondContact O-N 3.41Å; T345-A349 WeakPolarHBondContact O-CB 3.37Å; T345-A349 PolarHBondContact O-N 3.43Å |
| 346 | A | 81.6 | Confident | 78.4 | Confident | 62 Ų | 62 | 77.5 Ų | 77.5 | 51% | 0.512 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -66.6 | -39.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | A342 V343 K344 A350 | A342-A346 WeakPolarHBondContact O-CB 3.39Å; A342-A346 PolarHBondContact O-N 2.87Å; V343-A346 PolarHBondContact O-N 3.08Å; K344-A346 VanDerWaalsContact C-N 3.31Å; K344-A346 PolarHBondContact O-N 2.74Å; A346-A350 WeakPolarHBondContact O-CB 3.33Å; A346-A350 PolarHBondContact O-N 2.91Å |
| 347 | V | 82.3 | Confident | 77.6 | Confident | 74 Ų | 74 | 74.7 Ų | 74.7 | 45% | 0.448 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.6 | -42.8 | 176.1 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | V343 K344 A349 A350 N351 | V343-V347 HydrophobicContact CG1-CG2 4.41Å; V343-V347 WeakPolarHBondContact O-CG2 3.42Å; V343-V347 PolarHBondContact O-N 3.04Å; K344-V347 PolarHBondContact O-N 2.77Å; V347-A349 VanDerWaalsContact C-N 3.34Å; V347-A349 PolarHBondContact O-N 2.91Å; V347-A350 PolarHBondContact O-N 3.32Å; V347-N351 PolarHBondContact O-N 3.07Å |
| 348 | D | 81.3 | Confident | 76.5 | Confident | 74 Ų | 74 | 79.2 Ų | 79.2 | 40% | 0.396 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.9 | -40.9 | 177.4 | -69.7 | -27.6 | 0 | 0 | 0 | 110.9 | K344 T345 A350 N351 V352 | K344-D348 PolarHBondContact O-N 3.36Å; T345-D348 PolarHBondContact O-N 3.41Å; D348-A350 PolarHBondContact O-N 3.47Å; D348-N351 PolarHBondContact O-N 3.3Å; D348-V352 VanDerWaalsContact O-CG2 3.29Å; D348-V352 WeakPolarHBondContact O-CG2 3.39Å; D348-V352 PolarHBondContact O-N 3.26Å |
| 349 | A | 79.4 | Confident | 75.2 | Confident | 61 Ų | 61 | 83 Ų | 83 | 50% | 0.504 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.7 | -38.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | T345 V347 S353 | T345-A349 WeakPolarHBondContact O-CB 3.37Å; T345-A349 PolarHBondContact O-N 3.43Å; V347-A349 VanDerWaalsContact C-N 3.34Å; V347-A349 PolarHBondContact O-N 2.91Å; A349-S353 PolarHBondContact O-N 2.83Å; A349-S353 VanDerWaalsContact O-N 3.08Å; A349-S353 PolarHBondContact O-OG 3.34Å |
| 350 | A | 80.4 | Confident | 73.7 | Confident | 53 Ų | 53 | 85.5 Ų | 85.5 | 44% | 0.438 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.2 | -38.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A346 V347 D348 S353 A354 | A346-A350 WeakPolarHBondContact O-CB 3.33Å; A346-A350 PolarHBondContact O-N 2.91Å; V347-A350 PolarHBondContact O-N 3.32Å; D348-A350 PolarHBondContact O-N 3.47Å; A350-S353 WeakPolarHBondContact CA-OG 3.49Å; A350-S353 PolarHBondContact O-OG 2.89Å; A350-A354 WeakPolarHBondContact O-CB 3.33Å; A350-A354 PolarHBondContact O-N 2.75Å |
| 351 | N | 75.7 | Confident | 71.9 | Confident | 94 Ų | 94 | 84.5 Ų | 84.5 | 50% | 0.503 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -69.8 | -40.8 | 176.2 | -85.5 | -6.1 | 0 | 0 | 0 | 112.5 | V347 D348 S353 A354 Q355 | V347-N351 PolarHBondContact O-N 3.07Å; D348-N351 PolarHBondContact O-N 3.3Å; N351-S353 VanDerWaalsContact C-N 3.34Å; N351-S353 PolarHBondContact O-N 3.44Å; N351-A354 PolarHBondContact O-N 2.9Å; N351-Q355 PolarHBondContact O-N 3.45Å |
| 352 | V | 74.3 | Confident | 70.1 | Confident | 97 Ų | 97 | 88.1 Ų | 88.1 | 59% | 0.588 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63 | -41.7 | 176 | 172.4 | 0 | 0 | 0 | 0 | 111 | D348 Q355 A356 | D348-V352 VanDerWaalsContact O-CG2 3.29Å; D348-V352 WeakPolarHBondContact O-CG2 3.39Å; D348-V352 PolarHBondContact O-N 3.26Å; V352-Q355 PolarHBondContact O-N 3.15Å; V352-A356 WeakPolarHBondContact O-CB 3.29Å; V352-A356 PolarHBondContact O-N 2.88Å |
| 353 | S | 73.9 | Confident | 68.1 | Low | 65 Ų | 65 | 90.3 Ų | 90.3 | 46% | 0.455 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.6 | -35.9 | 175.7 | 52.2 | 0 | 0 | 0 | 0 | 113.1 | A349 A350 N351 S357 | A349-S353 PolarHBondContact O-N 2.83Å; A349-S353 VanDerWaalsContact O-N 3.08Å; A349-S353 PolarHBondContact O-OG 3.34Å; A350-S353 WeakPolarHBondContact CA-OG 3.49Å; A350-S353 PolarHBondContact O-OG 2.89Å; N351-S353 VanDerWaalsContact C-N 3.34Å; N351-S353 PolarHBondContact O-N 3.44Å; S353-S357 WeakPolarHBondContact O-CB 3.45Å; S353-S357 PolarHBondContact O-N 2.94Å; S353-S357 VanDerWaalsContact O-N 3.08Å; S353-S357 PolarHBondContact O-OG 2.81Å |
| 354 | A | 70.8 | Confident | 66.3 | Low | 54 Ų | 54 | 92.1 Ų | 92.1 | 45% | 0.446 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -67.6 | -40.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | A350 N351 S357 Q358 | A350-A354 WeakPolarHBondContact O-CB 3.33Å; A350-A354 PolarHBondContact O-N 2.75Å; N351-A354 PolarHBondContact O-N 2.9Å; A354-S357 PolarHBondContact O-N 3.2Å; A354-Q358 PolarHBondContact O-N 3.34Å |
| 355 | Q | 61.9 | Low | 64.7 | Low | 140 Ų | 140 | 93.7 Ų | 93.7 | 65% | 0.654 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -69.6 | -38.8 | 174.9 | -89 | 173.3 | -48.4 | 0 | 0 | 112.8 | N351 V352 S357 Q358 A359 | N351-Q355 PolarHBondContact O-N 3.45Å; V352-Q355 PolarHBondContact O-N 3.15Å; Q355-S357 VanDerWaalsContact C-N 3.26Å; Q355-S357 PolarHBondContact O-N 3.35Å; Q355-Q358 PolarHBondContact O-N 2.79Å; Q355-A359 PolarHBondContact O-N 3.28Å |
| 356 | A | 59.6 | Low | 62.9 | Low | 61 Ų | 61 | 98.6 Ų | 98.6 | 50% | 0.504 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -63.8 | -32.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | V352 A359 | V352-A356 WeakPolarHBondContact O-CB 3.29Å; V352-A356 PolarHBondContact O-N 2.88Å; A356-A359 PolarHBondContact O-N 3.22Å |
| 357 | S | 59.7 | Low | 61.2 | Low | 86 Ų | 86 | 101 Ų | 101 | 60% | 0.601 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -72.6 | -26.9 | 177.9 | -56.5 | 0 | 0 | 0 | 0 | 113.5 | S353 A354 Q355 | S353-S357 WeakPolarHBondContact O-CB 3.45Å; S353-S357 PolarHBondContact O-N 2.94Å; S353-S357 VanDerWaalsContact O-N 3.08Å; S353-S357 PolarHBondContact O-OG 2.81Å; A354-S357 PolarHBondContact O-N 3.2Å; Q355-S357 VanDerWaalsContact C-N 3.26Å; Q355-S357 PolarHBondContact O-N 3.35Å |
| 358 | Q | 57.5 | Low | 59.2 | Low | 171 Ų | 171 | 101.6 Ų | 101.6 | 80% | 0.799 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -78.9 | -22.6 | 174.4 | -78.7 | -175.2 | 17.5 | 0 | 0 | 113.6 | A354 Q355 | A354-Q358 PolarHBondContact O-N 3.34Å; Q355-Q358 PolarHBondContact O-N 2.79Å |
| 359 | A | 53.6 | Low | 57 | Low | 88 Ų | 88 | 101.6 Ų | 101.6 | 73% | 0.727 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -84.6 | -7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q355 A356 | Q355-A359 PolarHBondContact O-N 3.28Å; A356-A359 PolarHBondContact O-N 3.22Å |
| 360 | N | 52.6 | Low | 55.3 | Low | 141 Ų | 141 | 110 Ų | 110 | 75% | 0.754 | 70% | 0.7 | S | S | * | * | trans | -122.9 | 47.3 | -169 | -147.4 | 52.4 | 0 | 0 | 0 | 114.4 | ||||
| 361 | S | 46.2 | Very low | 53.6 | Low | 103 Ų | 103 | 113.5 Ų | 113.5 | 72% | 0.72 | 72% | 0.718 | S | S | * | * | trans | -105.9 | 118 | 167.5 | -68.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 362 | P | 47.2 | Very low | 52.3 | Low | 119 Ų | 119 | 113.2 Ų | 113.2 | 77% | 0.773 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 119.8 | 168.6 | 17.6 | -5.1 | 0 | 0 | 0 | 109.3 | T364 | P362-T364 PolarHBondContact O-N 3.24Š|
| 363 | A | 42.8 | Very low | 51 | Low | 104 Ų | 104 | 114.7 Ų | 114.7 | 86% | 0.86 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 118.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 364 | T | 47.3 | Very low | 49.3 | Very low | 131 Ų | 131 | 117.8 Ų | 117.8 | 80% | 0.804 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 134.5 | 168.8 | 48.3 | 0 | 0 | 0 | 0 | 109.8 | P362 | P362-T364 PolarHBondContact O-N 3.24Š|
| 365 | P | 49.3 | Very low | 47.8 | Very low | 125 Ų | 125 | 125.7 Ų | 125.7 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 122 | 174.8 | 31.7 | -27.4 | 0 | 0 | 0 | 109.7 | ||
| 366 | N | 43.8 | Very low | 47.5 | Very low | 167 Ų | 167 | 125 Ų | 125 | 89% | 0.893 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 128.1 | 172.2 | -170.6 | 31.2 | 0 | 0 | 0 | 110 | ||
| 367 | S | 46.8 | Very low | 47.3 | Very low | 114 Ų | 114 | 127.2 Ų | 127.2 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 141.6 | 175.5 | -71.8 | 0 | 0 | 0 | 0 | 111.4 | ||
| 368 | G | 39 | Very low | 46.7 | Very low | 85 Ų | 85 | 131.2 Ų | 131.2 | 88% | 0.876 | 81% | 0.81 | S | S | * | * | trans | 127.5 | 107.6 | 150.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 369 | G | 34.9 | Very low | 45.8 | Very low | 74 Ų | 74 | 126.3 Ų | 126.3 | 76% | 0.763 | 81% | 0.805 | S | S | * | * | trans | 165.5 | 85.2 | 165.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 370 | Y | 44.5 | Very low | 45.2 | Very low | 239 Ų | 239 | 133.5 Ų | 133.5 | 94% | 0.937 | 81% | 0.814 | S | S | * | * | trans | -53 | 150.3 | 171.6 | -71.2 | -96.3 | 0 | 0 | 0 | 113.2 | ||||
| 371 | P | 45.4 | Very low | 44.4 | Very low | 125 Ų | 125 | 138.3 Ų | 138.3 | 81% | 0.812 | 84% | 0.838 | S | S | * | * | trans | -110 | 136.9 | 147.1 | 32.9 | -22.2 | 0 | 0 | 0 | 111.5 | ||||
| 372 | A | 46.3 | Very low | 44.3 | Very low | 89 Ų | 89 | 140.1 Ų | 140.1 | 74% | 0.736 | 84% | 0.844 | S | S | * | * | trans | -76.4 | 162.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 373 | P | 48.2 | Very low | 44.2 | Very low | 128 Ų | 128 | 141.2 Ų | 141.2 | 83% | 0.831 | 85% | 0.848 | S | S | * | * | trans | -92 | 144.1 | -158.8 | 35.4 | -31.7 | 0 | 0 | 0 | 113.3 | ||||
| 374 | C | 37.6 | Very low | 44.2 | Very low | 130 Ų | 130 | 143.3 Ų | 143.3 | 88% | 0.878 | 85% | 0.847 | S | S | * | * | trans | -99.8 | 107.3 | 169.8 | -47.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 375 | Y | 39.7 | Very low | 44.1 | Very low | 220 Ų | 220 | 144 Ų | 144 | 86% | 0.863 | 85% | 0.85 | S | S | * | * | trans | -85.7 | 128.9 | 174.3 | -150.2 | -95 | 0 | 0 | 0 | 109 | ||||
| 376 | T | 56.4 | Low | 43.7 | Very low | 126 Ų | 126 | 145.2 Ų | 145.2 | 77% | 0.773 | 85% | 0.852 | S | S | * | * | trans | -109.4 | 130.3 | 168.5 | 49 | 0 | 0 | 0 | 0 | 109 | ||||
| 377 | P | 54 | Low | 43.7 | Very low | 106 Ų | 106 | 143.7 Ų | 143.7 | 69% | 0.688 | 85% | 0.849 | S | S | * | * | trans | -89.2 | 161.1 | 176.4 | 35.1 | -30.4 | 0 | 0 | 0 | 112.5 | ||||
| 378 | D | 46.8 | Very low | 43.5 | Very low | 170 Ų | 170 | 145.9 Ų | 145.9 | 91% | 0.909 | 85% | 0.853 | S | S | * | * | trans | 86.3 | 104.7 | 163.3 | -82.4 | -44 | 0 | 0 | 0 | 121 | ||||
| 379 | G | 38.7 | Very low | 43.9 | Very low | 68 Ų | 68 | 150.5 Ų | 150.5 | 70% | 0.701 | 85% | 0.851 | S | S | * | * | 143.7 | 97.4 | 95.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 380 | R | 41.5 | Very low | 44.6 | Very low | 240 Ų | 240 | 156.9 Ų | 156.9 | 91% | 0.906 | 86% | 0.858 | S | S | * | * | trans | 177.6 | 134.9 | 134.3 | -110.3 | 176.6 | 169 | 172.8 | -2.9 | 114.9 | ||||
| 381 | L | 36.3 | Very low | 44.6 | Very low | 242 Ų | 242 | 149.5 Ų | 149.5 | 100% | 1.267 | 85% | 0.851 | S | S | * | * | trans | 85.8 | 0 | 160.3 | -64.6 | 167.7 | 0 | 0 | 0 | 118 |
Retrieved 381 of 381 residues in 277.3 ms
(Link to these results)