| 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 | 39.1 | Very low | 33.6 | Very low | 232 Ų | 232 | 152.6 Ų | 152.6 | 100% | 1.143 | 82% | 0.819 | S | S | * | * | 0 | 88.6 | 0 | -66.3 | 177.3 | 175.9 | 0 | 0 | 105.6 | |||||
| 2 | E | 34.4 | Very low | 34 | Very low | 196 Ų | 196 | 150.5 Ų | 150.5 | 92% | 0.916 | 83% | 0.825 | S | S | * | * | 78.3 | 129.2 | 88.3 | -95.3 | -179.2 | 127 | 0 | 0 | 114.6 | |||||
| 3 | G | 34.7 | Very low | 34.4 | Very low | 72 Ų | 72 | 147.7 Ų | 147.7 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | trans | 82.8 | 110.1 | 163.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 4 | N | 29.3 | Very low | 34.8 | Very low | 147 Ų | 147 | 145.1 Ų | 145.1 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | cis | 59.9 | 129.1 | 37.5 | -151.9 | 17.5 | 0 | 0 | 0 | 116.2 | ||||
| 5 | K | 32.6 | Very low | 35.6 | Very low | 174 Ų | 174 | 141.1 Ų | 141.1 | 76% | 0.757 | 79% | 0.793 | S | S | * | * | trans | 87.5 | 130.5 | 170.7 | -58.9 | -174.9 | 179.4 | -176.2 | 0 | 115 | ||||
| 6 | E | 35.5 | Very low | 36.3 | Very low | 172 Ų | 172 | 137.6 Ų | 137.6 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | cis | -150.9 | 139.3 | 25.4 | -105.5 | 148.2 | 175.3 | 0 | 0 | 108.9 | ||||
| 7 | N | 29.8 | Very low | 36.7 | Very low | 152 Ų | 152 | 135.9 Ų | 135.9 | 81% | 0.813 | 77% | 0.768 | S | S | * | * | 55.5 | 120.4 | 88.6 | -141.4 | 23.7 | 0 | 0 | 0 | 111.9 | |||||
| 8 | S | 32 | Very low | 37 | Very low | 87 Ų | 87 | 131 Ų | 131 | 61% | 0.608 | 75% | 0.753 | S | S | * | * | -175.6 | 131.4 | 50.5 | 49.5 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 9 | S | 33.4 | Very low | 37.3 | Very low | 112 Ų | 112 | 132.9 Ų | 132.9 | 78% | 0.783 | 75% | 0.751 | S | S | * | * | trans | 30.2 | 95.7 | 139.8 | 62.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 10 | E | 34.8 | Very low | 37.5 | Very low | 193 Ų | 193 | 129.4 Ų | 129.4 | 90% | 0.902 | 74% | 0.739 | S | S | * | * | trans | -135.1 | 132 | 145.8 | -78.4 | -173.6 | 145.7 | 0 | 0 | 110 | ||||
| 11 | N | 34.3 | Very low | 37.8 | Very low | 142 Ų | 142 | 126.1 Ų | 126.1 | 76% | 0.759 | 73% | 0.728 | S | S | * | * | trans | 93.1 | 56.3 | 156.7 | -143.1 | 22.8 | 0 | 0 | 0 | 120.2 | ||||
| 12 | S | 38.2 | Very low | 37.8 | Very low | 127 Ų | 127 | 125.3 Ų | 125.3 | 89% | 0.888 | 71% | 0.712 | S | S | * | * | trans | -113.4 | 14.6 | 166 | -47.1 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 13 | T | 38.7 | Very low | 38 | Very low | 114 Ų | 114 | 122 Ų | 122 | 70% | 0.699 | 70% | 0.701 | S | S | * | * | trans | -97.2 | 5.7 | -167.7 | -0.9 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 14 | D | 40.5 | Very low | 38.3 | Very low | 112 Ų | 112 | 128.1 Ų | 128.1 | 60% | 0.599 | 70% | 0.703 | S | S | * | * | trans | -121.9 | 25.1 | -166.6 | -124.3 | -19.7 | 0 | 0 | 0 | 118 | I17 | D14-I17 WeakPolarHBondContact OD1-CB 3.2Å; D14-I17 WeakPolarHBondContact OD1-CD1 3.36Å; D14-I17 VanDerWaalsContact OD1-CG1 3.27Å; D14-I17 WeakPolarHBondContact OD1-CG1 3.27Å | ||
| 15 | A | 46.5 | Very low | 38.6 | Very low | 85 Ų | 85 | 128.5 Ų | 128.5 | 70% | 0.702 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -91.1 | -19.7 | 168.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 16 | S | 47 | Very low | 38.8 | Very low | 85 Ų | 85 | 128.9 Ų | 128.9 | 59% | 0.594 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -81.3 | -31.4 | -178.5 | 50.2 | 0 | 0 | 0 | 0 | 112.8 | G18 K19 | S16-G18 VanDerWaalsContact C-N 3.34Å; S16-G18 PolarHBondContact O-N 3.23Å; S16-K19 PolarHBondContact O-N 3.23Å |
| 17 | I | 43.9 | Very low | 39.1 | Very low | 108 Ų | 108 | 126.3 Ų | 126.3 | 55% | 0.554 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -68.5 | -34.8 | 179.2 | -54.3 | -167.1 | 0 | 0 | 0 | 111 | D14 K19 A20 A21 | D14-I17 WeakPolarHBondContact OD1-CB 3.2Å; D14-I17 WeakPolarHBondContact OD1-CD1 3.36Å; D14-I17 VanDerWaalsContact OD1-CG1 3.27Å; D14-I17 WeakPolarHBondContact OD1-CG1 3.27Å; I17-K19 VanDerWaalsContact C-N 3.29Å; I17-K19 PolarHBondContact O-N 3.48Å; I17-A20 PolarHBondContact O-N 3.2Å; I17-A21 PolarHBondContact O-N 3.3Å |
| 18 | G | 41.9 | Very low | 39.4 | Very low | 48 Ų | 48 | 125.8 Ų | 125.8 | 50% | 0.495 | 70% | 0.703 | S | S | . | * | H | α-helix | trans | -64.1 | -28.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | S16 | S16-G18 VanDerWaalsContact C-N 3.34Å; S16-G18 PolarHBondContact O-N 3.23Å |
| 19 | K | 41.4 | Very low | 39.8 | Very low | 168 Ų | 168 | 125.3 Ų | 125.3 | 73% | 0.73 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -78.2 | -29.8 | 176.2 | -71.1 | -170.7 | 179.3 | -178.8 | 0 | 112.7 | S16 I17 | S16-K19 PolarHBondContact O-N 3.23Å; I17-K19 VanDerWaalsContact C-N 3.29Å; I17-K19 PolarHBondContact O-N 3.48Å |
| 20 | A | 42.1 | Very low | 40.1 | Very low | 62 Ų | 62 | 124.7 Ų | 124.7 | 51% | 0.512 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -72.2 | -37.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I17 | I17-A20 PolarHBondContact O-N 3.2Å |
| 21 | A | 44.2 | Very low | 40.4 | Very low | 61 Ų | 61 | 121.5 Ų | 121.5 | 50% | 0.504 | 70% | 0.7 | S | S | . | * | H | α-helix | trans | -67.9 | -36.9 | -180 | 0 | 0 | 0 | 0 | 0 | 113.1 | I17 N23 Y24 | I17-A21 PolarHBondContact O-N 3.3Å; A21-N23 PolarHBondContact O-N 3.28Å; A21-Y24 PolarHBondContact O-N 3.35Å |
| 22 | R | 38.4 | Very low | 40.9 | Very low | 215 Ų | 215 | 122.6 Ų | 122.6 | 81% | 0.811 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -20.7 | -178.3 | -107.7 | -174.5 | -173.4 | 178 | 3.3 | 114.9 | ||
| 23 | N | 39.9 | Very low | 41.1 | Very low | 127 Ų | 127 | 126.1 Ų | 126.1 | 68% | 0.679 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.9 | -10.4 | -180 | -88.5 | -6.9 | 0 | 0 | 0 | 113.8 | A21 | A21-N23 PolarHBondContact O-N 3.28Š|
| 24 | Y | 39.9 | Very low | 42.1 | Very low | 200 Ų | 200 | 125.3 Ų | 125.3 | 78% | 0.784 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | -27.1 | 178.5 | -96 | -88.9 | 0 | 0 | 0 | 113.2 | A21 Q26 | A21-Y24 PolarHBondContact O-N 3.35Å; Y24-Q26 VanDerWaalsContact C-N 3.25Å; Y24-Q26 PolarHBondContact O-N 3.25Å |
| 25 | D | 34.8 | Very low | 42.1 | Very low | 154 Ų | 154 | 123.9 Ų | 123.9 | 82% | 0.824 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -0.1 | -175.9 | -76.5 | -28.4 | 0 | 0 | 0 | 114.7 | ||
| 26 | Q | 37.7 | Very low | 42.4 | Very low | 183 Ų | 183 | 127.9 Ų | 127.9 | 86% | 0.855 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.6 | 9.6 | -176 | -114.8 | -178.9 | 3.6 | 0 | 0 | 116.1 | Y24 D28 | Y24-Q26 VanDerWaalsContact C-N 3.25Å; Y24-Q26 PolarHBondContact O-N 3.25Å; Q26-D28 PolarHBondContact O-N 3.47Å |
| 27 | V | 41.3 | Very low | 42.5 | Very low | 118 Ų | 118 | 127.8 Ų | 127.8 | 72% | 0.715 | 69% | 0.691 | S | S | * | * | trans | -96.1 | 89.8 | 179.5 | -169.8 | 0 | 0 | 0 | 0 | 110.3 | G29 | V27-G29 PolarHBondContact O-N 3.34Š| ||
| 28 | D | 37.4 | Very low | 42.4 | Very low | 141 Ų | 141 | 130 Ų | 130 | 75% | 0.754 | 70% | 0.704 | S | S | * | * | trans | -58.5 | 125.3 | 163.9 | -171.6 | 9.9 | 0 | 0 | 0 | 110 | Q26 S30 | Q26-D28 PolarHBondContact O-N 3.47Å; D28-S30 VanDerWaalsContact C-N 3.34Å; D28-S30 PolarHBondContact O-N 3.03Å | ||
| 29 | G | 40.2 | Very low | 42.6 | Very low | 77 Ų | 77 | 133.1 Ų | 133.1 | 79% | 0.794 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | 37.9 | -154.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | V27 | V27-G29 PolarHBondContact O-N 3.34Š|
| 30 | S | 39.1 | Very low | 42.2 | Very low | 98 Ų | 98 | 134 Ų | 134 | 69% | 0.685 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143.1 | 24.5 | -177.2 | 71.9 | 0 | 0 | 0 | 0 | 117 | D28 | D28-S30 VanDerWaalsContact C-N 3.34Å; D28-S30 PolarHBondContact O-N 3.03Å |
| 31 | V | 40.5 | Very low | 41.8 | Very low | 127 Ų | 127 | 141.9 Ų | 141.9 | 77% | 0.77 | 74% | 0.741 | S | S | * | * | trans | -127.5 | 111.1 | 174.2 | -167.3 | 0 | 0 | 0 | 0 | 110.2 | Y33 | V31-Y33 PolarHBondContact O-N 3.26Š| ||
| 32 | D | 44.7 | Very low | 41.2 | Very low | 164 Ų | 164 | 145 Ų | 145 | 88% | 0.877 | 76% | 0.756 | S | S | * | * | trans | -52.5 | 107.2 | 170.8 | -77.2 | -44.5 | 0 | 0 | 0 | 109.7 | N34 | D32-N34 PolarHBondContact O-N 3.42Š| ||
| 33 | Y | 42.3 | Very low | 41 | Very low | 202 Ų | 202 | 141.7 Ų | 141.7 | 79% | 0.792 | 76% | 0.76 | S | S | * | * | trans | -69.9 | 110.5 | 179.8 | 179 | -98.6 | 0 | 0 | 0 | 110.1 | V31 P35 | V31-Y33 PolarHBondContact O-N 3.26Å; Y33-P35 HydrophobicContact CE1-CB 3.91Å; Y33-P35 HydrophobicContact CE1-CG 4.49Å | ||
| 34 | N | 60.6 | Low | 40.4 | Very low | 96 Ų | 96 | 147.1 Ų | 147.1 | 51% | 0.513 | 77% | 0.77 | S | S | . | * | trans | -108.8 | 111.4 | 171.8 | -170.8 | -3.3 | 0 | 0 | 0 | 110 | D32 F36 S37 | D32-N34 PolarHBondContact O-N 3.42Å; N34-F36 PolarHBondContact O-N 2.99Å; N34-S37 PolarHBondContact O-N 3.27Å; N34-S37 PolarHBondContact O-OG 3.3Å | ||
| 35 | P | 41.3 | Very low | 39.8 | Very low | 82 Ų | 82 | 141.2 Ų | 141.2 | 53% | 0.532 | 77% | 0.77 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.4 | 2.5 | -171.1 | 27.5 | -35.3 | 0 | 0 | 0 | 115.6 | Y33 | Y33-P35 HydrophobicContact CE1-CB 3.91Å; Y33-P35 HydrophobicContact CE1-CG 4.49Å |
| 36 | F | 51.7 | Low | 39.8 | Very low | 169 Ų | 169 | 138.2 Ų | 138.2 | 74% | 0.741 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.3 | -0.2 | 180 | -56.5 | -72.2 | 0 | 0 | 0 | 114.1 | N34 | N34-F36 PolarHBondContact O-N 2.99Š|
| 37 | S | 48.6 | Very low | 39.3 | Very low | 83 Ų | 83 | 135 Ų | 135 | 58% | 0.58 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -80.2 | -15 | -174.7 | 51.2 | 0 | 0 | 0 | 0 | 115.5 | N34 S39 | N34-S37 PolarHBondContact O-N 3.27Å; N34-S37 PolarHBondContact O-OG 3.3Å; S37-S39 VanDerWaalsContact C-N 3.28Å; S37-S39 PolarHBondContact O-N 3.26Å |
| 38 | D | 43.3 | Very low | 38.9 | Very low | 155 Ų | 155 | 136.6 Ų | 136.6 | 83% | 0.829 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -81.6 | 4.6 | -175.3 | -84.5 | -23.2 | 0 | 0 | 0 | 115.5 | Q40 | D38-Q40 VanDerWaalsContact C-N 3.26Å; D38-Q40 PolarHBondContact O-N 3.31Å |
| 39 | S | 45.3 | Very low | 38.6 | Very low | 113 Ų | 113 | 135.1 Ų | 135.1 | 79% | 0.79 | 77% | 0.768 | S | S | * | * | G | 310 helix | trans | -82.7 | 7.5 | 179.2 | -60.3 | 0 | 0 | 0 | 0 | 114.8 | S37 | S37-S39 VanDerWaalsContact C-N 3.28Å; S37-S39 PolarHBondContact O-N 3.26Å |
| 40 | Q | 33.9 | Very low | 38.2 | Very low | 187 Ų | 187 | 136.8 Ų | 136.8 | 87% | 0.874 | 77% | 0.765 | S | S | * | * | trans | -117.6 | 65 | 176.5 | -72.4 | -175.4 | -9.1 | 0 | 0 | 112.1 | D38 | D38-Q40 VanDerWaalsContact C-N 3.26Å; D38-Q40 PolarHBondContact O-N 3.31Å | ||
| 41 | R | 32.7 | Very low | 38.1 | Very low | 228 Ų | 228 | 138 Ų | 138 | 86% | 0.86 | 77% | 0.77 | S | S | * | * | trans | -108.4 | 126.9 | 150.8 | -83.4 | -171.9 | 176.8 | -153.8 | 0.6 | 109.9 | V43 | R41-V43 PolarHBondContact O-N 3.19Š| ||
| 42 | P | 30.6 | Very low | 37.7 | Very low | 126 Ų | 126 | 138.4 Ų | 138.4 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -76.9 | 115.8 | -170.1 | 24 | -22.6 | 0 | 0 | 0 | 111 | R44 | P42-R44 PolarHBondContact O-N 3.01Š| ||
| 43 | V | 34.4 | Very low | 37.2 | Very low | 146 Ų | 146 | 138.1 Ų | 138.1 | 89% | 0.885 | 77% | 0.77 | S | S | * | * | trans | -79.1 | 104.3 | 168.7 | -176.2 | 0 | 0 | 0 | 0 | 108 | R41 G45 | R41-V43 PolarHBondContact O-N 3.19Å; V43-G45 PolarHBondContact O-N 3.4Å | ||
| 44 | R | 28.2 | Very low | 36.7 | Very low | 240 Ų | 240 | 134.2 Ų | 134.2 | 91% | 0.906 | 77% | 0.769 | S | S | * | * | trans | -61.9 | 122.9 | 166.6 | -87.9 | 177.5 | 166.3 | 177.1 | -4.2 | 109.6 | P42 | P42-R44 PolarHBondContact O-N 3.01Š| ||
| 45 | G | 27.5 | Very low | 35.3 | Very low | 76 Ų | 76 | 134.7 Ų | 134.7 | 78% | 0.784 | 79% | 0.787 | S | S | * | * | trans | 71.1 | 98.1 | 142.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | V43 | V43-G45 PolarHBondContact O-N 3.4Š| ||
| 46 | A | 33.6 | Very low | 34.9 | Very low | 92 Ų | 92 | 134.5 Ų | 134.5 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -159.7 | 104.4 | 133.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | N48 | A46-N48 PolarHBondContact O-N 3.01Š| ||
| 47 | S | 28.8 | Very low | 34.1 | Very low | 116 Ų | 116 | 135.6 Ų | 135.6 | 81% | 0.811 | 80% | 0.802 | S | S | * | * | trans | -54.6 | 115 | 161 | 48.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 48 | N | 31.6 | Very low | 33.4 | Very low | 150 Ų | 150 | 139 Ų | 139 | 80% | 0.802 | 81% | 0.814 | S | S | * | * | trans | -143.2 | 132.1 | 155.6 | -91.8 | -25.4 | 0 | 0 | 0 | 109.6 | A46 | A46-N48 PolarHBondContact O-N 3.01Š| ||
| 49 | P | 31.1 | Very low | 32.7 | Very low | 111 Ų | 111 | 135.8 Ų | 135.8 | 72% | 0.721 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 163.5 | -173.5 | 16.5 | -11.6 | 0 | 0 | 0 | 112.9 | ||
| 50 | P | 32.1 | Very low | 32 | Very low | 112 Ų | 112 | 135.8 Ų | 135.8 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 141.1 | -173.2 | 24.1 | -32.6 | 0 | 0 | 0 | 112 | V52 | P50-V52 PolarHBondContact O-N 3.22Š|
| 51 | P | 37.4 | Very low | 31.9 | Very low | 123 Ų | 123 | 131.7 Ų | 131.7 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 120.1 | 176 | -16.2 | 28.6 | 0 | 0 | 0 | 110.5 | L53 | P51-L53 PolarHBondContact O-N 3.28Š|
| 52 | V | 32.9 | Very low | 31.6 | Very low | 136 Ų | 136 | 127.1 Ų | 127.1 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | -69.9 | 113.6 | 165.8 | 178.5 | 0 | 0 | 0 | 0 | 107.1 | P50 P54 | P50-V52 PolarHBondContact O-N 3.22Å; V52-P54 WeakPolarHBondContact O-CD 3.4Å | ||
| 53 | L | 33.4 | Very low | 31.8 | Very low | 157 Ų | 157 | 131.3 Ų | 131.3 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | trans | -65.6 | 122.7 | 176.3 | -76.8 | 160.5 | 0 | 0 | 0 | 109.7 | P51 A55 | P51-L53 PolarHBondContact O-N 3.28Å; L53-A55 PolarHBondContact O-N 3.25Å | ||
| 54 | P | 31.8 | Very low | 31.5 | Very low | 120 Ų | 120 | 129.4 Ų | 129.4 | 78% | 0.779 | 79% | 0.787 | S | S | * | * | trans | -67.3 | 118.6 | 173 | -17 | 30.8 | 0 | 0 | 0 | 110 | V52 A56 | V52-P54 WeakPolarHBondContact O-CD 3.4Å; P54-A56 VanDerWaalsContact C-N 3.25Å; P54-A56 PolarHBondContact O-N 2.93Å | ||
| 55 | A | 30.9 | Very low | 31.7 | Very low | 106 Ų | 106 | 122.6 Ų | 122.6 | 88% | 0.876 | 78% | 0.783 | S | S | * | * | trans | -71.9 | 80 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | L53 | L53-A55 PolarHBondContact O-N 3.25Š| ||
| 56 | A | 33.8 | Very low | 31.9 | Very low | 79 Ų | 79 | 124.3 Ų | 124.3 | 65% | 0.653 | 78% | 0.782 | S | S | * | * | trans | -104.3 | 102.4 | 159.8 | 0 | 0 | 0 | 0 | 0 | 107 | P54 D58 | P54-A56 VanDerWaalsContact C-N 3.25Å; P54-A56 PolarHBondContact O-N 2.93Å; A56-D58 VanDerWaalsContact C-N 3.25Å; A56-D58 PolarHBondContact O-N 2.93Å | ||
| 57 | M | 33.8 | Very low | 31.9 | Very low | 192 Ų | 192 | 126.9 Ų | 126.9 | 95% | 0.946 | 79% | 0.788 | S | S | * | * | trans | -66.7 | 82.2 | 172.3 | -74.6 | 154.2 | 113.9 | 0 | 0 | 109.1 | ||||
| 58 | D | 33.4 | Very low | 32 | Very low | 155 Ų | 155 | 124 Ų | 124 | 83% | 0.829 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 122.9 | 159.1 | -82.3 | -34 | 0 | 0 | 0 | 108.5 | A56 | A56-D58 VanDerWaalsContact C-N 3.25Å; A56-D58 PolarHBondContact O-N 2.93Å |
| 59 | A | 30.3 | Very low | 32.1 | Very low | 87 Ų | 87 | 122.8 Ų | 122.8 | 72% | 0.719 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 141.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 60 | P | 29.1 | Very low | 32.3 | Very low | 112 Ų | 112 | 121 Ų | 121 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -61 | 137.5 | -175.4 | 24.1 | -32.3 | 0 | 0 | 0 | 110.6 | T62 | P60-T62 PolarHBondContact O-N 3.44Š|
| 61 | P | 33.6 | Very low | 32.8 | Very low | 101 Ų | 101 | 123.6 Ų | 123.6 | 66% | 0.656 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 128.3 | -179.3 | 23.3 | -31.2 | 0 | 0 | 0 | 109.7 | Y63 | P61-Y63 WeakPolarHBondContact O-CD2 3.38Å; P61-Y63 PolarHBondContact O-N 3Å |
| 62 | T | 26.5 | Very low | 32.9 | Very low | 133 Ų | 133 | 126 Ų | 126 | 82% | 0.816 | 78% | 0.784 | S | S | * | * | trans | -59 | 107.1 | 173.3 | -53.7 | 0 | 0 | 0 | 0 | 108.7 | P60 S64 | P60-T62 PolarHBondContact O-N 3.44Å; T62-S64 PolarHBondContact O-N 3.42Å | ||
| 63 | Y | 33.3 | Very low | 33.4 | Very low | 213 Ų | 213 | 125.2 Ų | 125.2 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | -66.2 | 98.9 | 172.3 | -76.2 | -91.5 | 0 | 0 | 0 | 108.7 | P61 A65 | P61-Y63 WeakPolarHBondContact O-CD2 3.38Å; P61-Y63 PolarHBondContact O-N 3Å; Y63-A65 PolarHBondContact O-N 3.3Å; Y63-A65 VanDerWaalsContact O-N 3.15Å | ||
| 64 | S | 28.5 | Very low | 34 | Very low | 106 Ų | 106 | 122.2 Ų | 122.2 | 74% | 0.741 | 77% | 0.771 | S | S | * | * | trans | -63.8 | 113.9 | 163.2 | -71.9 | 0 | 0 | 0 | 0 | 108.2 | T62 S66 | T62-S64 PolarHBondContact O-N 3.42Å; S64-S66 VanDerWaalsContact C-N 3.28Å; S64-S66 PolarHBondContact O-N 2.96Å | ||
| 65 | A | 31.8 | Very low | 35.4 | Very low | 98 Ų | 98 | 122.7 Ų | 122.7 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | trans | -59.7 | 86.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | Y63 | Y63-A65 PolarHBondContact O-N 3.3Å; Y63-A65 VanDerWaalsContact O-N 3.15Å | ||
| 66 | S | 32.8 | Very low | 36.5 | Very low | 111 Ų | 111 | 123.8 Ų | 123.8 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | trans | -90.4 | 110.7 | 154.9 | 50 | 0 | 0 | 0 | 0 | 106.8 | S64 G68 | S64-S66 VanDerWaalsContact C-N 3.28Å; S64-S66 PolarHBondContact O-N 2.96Å; S66-G68 PolarHBondContact O-N 2.95Å | ||
| 67 | V | 32.3 | Very low | 37.9 | Very low | 146 Ų | 146 | 121.3 Ų | 121.3 | 89% | 0.885 | 75% | 0.746 | S | S | * | * | trans | -68.8 | 79 | 178.5 | -175.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 68 | G | 31.6 | Very low | 39.5 | Very low | 57 Ų | 57 | 117.2 Ų | 117.2 | 59% | 0.588 | 73% | 0.725 | S | S | * | * | trans | -92.5 | 127.5 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109 | S66 G70 | S66-G68 PolarHBondContact O-N 2.95Å; G68-G70 PolarHBondContact O-N 3.08Å | ||
| 69 | P | 34.8 | Very low | 41.4 | Very low | 124 Ų | 124 | 112.1 Ų | 112.1 | 81% | 0.805 | 70% | 0.701 | S | S | * | * | trans | -57.8 | 127.2 | -179.7 | 22.4 | -30.6 | 0 | 0 | 0 | 109.5 | L71 | P69-L71 PolarHBondContact O-N 3.43Š| ||
| 70 | G | 35 | Very low | 43.6 | Very low | 74 Ų | 74 | 112.3 Ų | 112.3 | 76% | 0.763 | 69% | 0.69 | S | S | * | * | trans | -45.5 | 107.3 | -172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | G68 K72 | G68-G70 PolarHBondContact O-N 3.08Å; G70-K72 PolarHBondContact O-N 3.04Å | ||
| 71 | L | 41.6 | Very low | 45.7 | Very low | 165 Ų | 165 | 111.8 Ų | 111.8 | 86% | 0.864 | 68% | 0.681 | S | S | * | * | trans | -61.2 | 100.2 | 167 | -78 | 149.9 | 0 | 0 | 0 | 106.8 | P69 P73 | P69-L71 PolarHBondContact O-N 3.43Å; L71-P73 WeakPolarHBondContact O-CD 3.29Å; L71-P73 VanDerWaalsContact O-N 3.14Å | ||
| 72 | K | 39 | Very low | 47.7 | Very low | 173 Ų | 173 | 110.2 Ų | 110.2 | 75% | 0.752 | 67% | 0.666 | S | S | * | * | trans | -50.9 | 122.3 | 161.5 | -79.4 | -178.1 | 177.8 | -177.4 | 0 | 106.2 | G70 T74 | G70-K72 PolarHBondContact O-N 3.04Å; K72-T74 VanDerWaalsContact C-N 3.35Å; K72-T74 PolarHBondContact O-N 2.76Å; K72-T74 PolarHBondContact O-OG1 2.98Å | ||
| 73 | P | 44.6 | Very low | 50.1 | Low | 121 Ų | 121 | 110.1 Ų | 110.1 | 79% | 0.786 | 66% | 0.655 | S | S | * | * | trans | -57.1 | 102.4 | 177 | -22.1 | 32 | 0 | 0 | 0 | 108 | L71 L75 | L71-P73 WeakPolarHBondContact O-CD 3.29Å; L71-P73 VanDerWaalsContact O-N 3.14Å; P73-L75 VanDerWaalsContact C-N 3.29Å; P73-L75 PolarHBondContact O-N 2.86Å | ||
| 74 | T | 46.1 | Very low | 52.1 | Low | 94 Ų | 94 | 108.6 Ų | 108.6 | 58% | 0.577 | 65% | 0.647 | S | S | * | * | trans | -81.3 | 90.1 | 176.2 | -56.9 | 0 | 0 | 0 | 0 | 104.9 | K72 | K72-T74 VanDerWaalsContact C-N 3.35Å; K72-T74 PolarHBondContact O-N 2.76Å; K72-T74 PolarHBondContact O-OG1 2.98Å | ||
| 75 | L | 60.7 | Low | 54.1 | Low | 130 Ų | 130 | 109.7 Ų | 109.7 | 68% | 0.681 | 64% | 0.641 | S | S | * | * | trans | -52.5 | 125.9 | 173.5 | -143.8 | 79 | 0 | 0 | 0 | 107.6 | P73 G77 H78 | P73-L75 VanDerWaalsContact C-N 3.29Å; P73-L75 PolarHBondContact O-N 2.86Å; L75-G77 PolarHBondContact O-N 3.4Å; L75-G77 VanDerWaalsContact O-N 3.08Å; L75-H78 WeakPolarHBondContact O-CB 3.45Å; L75-H78 PolarHBondContact O-N 2.65Å | ||
| 76 | P | 55 | Low | 56 | Low | 129 Ų | 129 | 109.6 Ų | 109.6 | 84% | 0.838 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.6 | 118.6 | 179.8 | -23.3 | 31.8 | 0 | 0 | 0 | 109.5 | ||
| 77 | G | 62.9 | Low | 57.6 | Low | 27 Ų | 27 | 107 Ų | 107 | 28% | 0.278 | 61% | 0.608 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 108.6 | -21 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | L75 S79 D80 L81 | L75-G77 PolarHBondContact O-N 3.4Å; L75-G77 VanDerWaalsContact O-N 3.08Å; G77-S79 VanDerWaalsContact C-N 3.31Å; G77-S79 PolarHBondContact O-N 3.12Å; G77-D80 PolarHBondContact O-N 2.71Å; G77-L81 VanDerWaalsContact O-CG 3.29Å; G77-L81 WeakPolarHBondContact O-CG 3.35Å; G77-L81 PolarHBondContact O-N 2.89Å |
| 78 | H | 67.6 | Low | 59.2 | Low | 106 Ų | 106 | 103 Ų | 103 | 49% | 0.491 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.5 | -40.7 | 174.1 | -170.4 | 67.3 | 0 | 0 | 0 | 111.2 | L75 L81 L82 | L75-H78 WeakPolarHBondContact O-CB 3.45Å; L75-H78 PolarHBondContact O-N 2.65Å; H78-L81 PolarHBondContact O-N 3.12Å; H78-L82 WeakPolarHBondContact O-CB 3.38Å; H78-L82 VanDerWaalsContact O-CG 3.23Å; H78-L82 WeakPolarHBondContact O-CG 3.48Å; H78-L82 PolarHBondContact O-N 3.32Å |
| 79 | S | 71.4 | Confident | 60.7 | Low | 48 Ų | 48 | 106.7 Ų | 106.7 | 34% | 0.336 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -64.6 | -36.6 | 175.6 | 30.9 | 0 | 0 | 0 | 0 | 113.2 | G77 L82 K83 | G77-S79 VanDerWaalsContact C-N 3.31Å; G77-S79 PolarHBondContact O-N 3.12Å; S79-L82 PolarHBondContact O-N 3.36Å; S79-K83 WeakPolarHBondContact O-CG 3.45Å; S79-K83 PolarHBondContact O-N 2.76Å |
| 80 | D | 76.7 | Confident | 61.9 | Low | 90 Ų | 90 | 104.6 Ų | 104.6 | 48% | 0.481 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -74.1 | -37 | 177.6 | -65.2 | -35.5 | 0 | 0 | 0 | 112.1 | G77 K83 R84 | G77-D80 PolarHBondContact O-N 2.71Å; D80-K83 PolarHBondContact O-N 3.46Å; D80-R84 WeakPolarHBondContact O-CG 3.23Å; D80-R84 PolarHBondContact O-N 3.02Å |
| 81 | L | 73.7 | Confident | 63.3 | Low | 102 Ų | 102 | 104.7 Ų | 104.7 | 53% | 0.534 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.7 | -43.4 | 171.2 | -70.2 | 173.2 | 0 | 0 | 0 | 111.2 | G77 H78 R84 Q85 | G77-L81 VanDerWaalsContact O-CG 3.29Å; G77-L81 WeakPolarHBondContact O-CG 3.35Å; G77-L81 PolarHBondContact O-N 2.89Å; H78-L81 PolarHBondContact O-N 3.12Å; L81-R84 PolarHBondContact O-N 2.93Å; L81-Q85 WeakPolarHBondContact O-CB 3.42Å; L81-Q85 WeakPolarHBondContact O-CG 3.38Å; L81-Q85 PolarHBondContact O-N 3.31Å |
| 82 | L | 75.6 | Confident | 64 | Low | 67 Ų | 67 | 101.9 Ų | 101.9 | 35% | 0.351 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.7 | -47.7 | 174.4 | -74 | 172.4 | 0 | 0 | 0 | 111.3 | H78 S79 R84 Q85 E86 | H78-L82 WeakPolarHBondContact O-CB 3.38Å; H78-L82 VanDerWaalsContact O-CG 3.23Å; H78-L82 WeakPolarHBondContact O-CG 3.48Å; H78-L82 PolarHBondContact O-N 3.32Å; S79-L82 PolarHBondContact O-N 3.36Å; L82-R84 VanDerWaalsContact C-N 3.33Å; L82-R84 PolarHBondContact O-N 3.45Å; L82-Q85 CarbonylContact O-C 3.56Å; L82-Q85 WeakPolarHBondContact O-CB 3.3Å; L82-Q85 PolarHBondContact O-N 2.8Å; L82-Q85 VanDerWaalsContact O-N 3.12Å; L82-E86 WeakPolarHBondContact O-CB 3.45Å; L82-E86 WeakPolarHBondContact O-CG 3.33Å; L82-E86 PolarHBondContact O-N 2.95Å |
| 83 | K | 76.7 | Confident | 65 | Low | 132 Ų | 132 | 99.5 Ų | 99.5 | 57% | 0.574 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -59.1 | -40.7 | 175.9 | -75.8 | 174.5 | -177.5 | 173.5 | 0 | 112.7 | S79 D80 E86 A87 | S79-K83 WeakPolarHBondContact O-CG 3.45Å; S79-K83 PolarHBondContact O-N 2.76Å; D80-K83 PolarHBondContact O-N 3.46Å; K83-E86 PolarHBondContact O-N 3.49Å; K83-A87 WeakPolarHBondContact O-CB 3.44Å; K83-A87 PolarHBondContact O-N 2.77Å |
| 84 | R | 74.9 | Confident | 65.9 | Low | 180 Ų | 180 | 97.5 Ų | 97.5 | 68% | 0.679 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66.1 | -39.4 | 175.1 | -74 | 178.5 | 179.6 | -178.2 | 1.2 | 111.8 | D80 L81 L82 S88 | D80-R84 WeakPolarHBondContact O-CG 3.23Å; D80-R84 PolarHBondContact O-N 3.02Å; L81-R84 PolarHBondContact O-N 2.93Å; L82-R84 VanDerWaalsContact C-N 3.33Å; L82-R84 PolarHBondContact O-N 3.45Å; R84-S88 VanDerWaalsContact O-CB 3.3Å; R84-S88 WeakPolarHBondContact O-CB 3.21Å; R84-S88 PolarHBondContact O-N 3.4Å; R84-S88 PolarHBondContact O-OG 3.25Å |
| 85 | Q | 71.9 | Confident | 67 | Low | 130 Ų | 130 | 96.2 Ų | 96.2 | 61% | 0.607 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.4 | -41.6 | 173.5 | -79.1 | -176.5 | -36.5 | 0 | 0 | 111.7 | L81 L82 S88 R89 | L81-Q85 WeakPolarHBondContact O-CB 3.42Å; L81-Q85 WeakPolarHBondContact O-CG 3.38Å; L81-Q85 PolarHBondContact O-N 3.31Å; L82-Q85 CarbonylContact O-C 3.56Å; L82-Q85 WeakPolarHBondContact O-CB 3.3Å; L82-Q85 PolarHBondContact O-N 2.8Å; L82-Q85 VanDerWaalsContact O-N 3.12Å; Q85-S88 PolarHBondContact O-N 3.19Å; Q85-R89 WeakPolarHBondContact O-CB 3.43Å; Q85-R89 PolarHBondContact O-N 2.86Å |
| 86 | E | 70.2 | Confident | 67.6 | Low | 96 Ų | 96 | 95.2 Ų | 95.2 | 45% | 0.449 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.5 | -49.4 | 176.6 | -74.6 | 173.7 | 176.8 | 0 | 0 | 111.5 | L82 K83 S88 R89 D90 | L82-E86 WeakPolarHBondContact O-CB 3.45Å; L82-E86 WeakPolarHBondContact O-CG 3.33Å; L82-E86 PolarHBondContact O-N 2.95Å; K83-E86 PolarHBondContact O-N 3.49Å; E86-S88 VanDerWaalsContact C-N 3.3Å; E86-S88 PolarHBondContact O-N 2.93Å; E86-R89 CarbonylContact O-C 3.59Å; E86-R89 WeakPolarHBondContact O-CA 3.45Å; E86-R89 WeakPolarHBondContact O-CB 3.38Å; E86-R89 PolarHBondContact O-N 3.36Å; E86-R89 VanDerWaalsContact O-N 3.08Å; E86-D90 WeakPolarHBondContact O-CB 3.35Å; E86-D90 VanDerWaalsContact O-CG 3.25Å; E86-D90 PolarHBondContact O-N 3.01Å |
| 87 | A | 68.4 | Low | 68.7 | Low | 55 Ų | 55 | 92.4 Ų | 92.4 | 46% | 0.455 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.3 | -39.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | K83 T91 | K83-A87 WeakPolarHBondContact O-CB 3.44Å; K83-A87 PolarHBondContact O-N 2.77Å; A87-T91 WeakPolarHBondContact O-CB 3.39Å; A87-T91 PolarHBondContact O-N 2.95Å; A87-T91 PolarHBondContact O-OG1 3.33Å |
| 88 | S | 64.6 | Low | 69.7 | Low | 63 Ų | 63 | 94.3 Ų | 94.3 | 44% | 0.441 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.2 | -46.3 | 173.1 | -58.6 | 0 | 0 | 0 | 0 | 110.7 | R84 Q85 E86 T91 Y92 | R84-S88 VanDerWaalsContact O-CB 3.3Å; R84-S88 WeakPolarHBondContact O-CB 3.21Å; R84-S88 PolarHBondContact O-N 3.4Å; R84-S88 PolarHBondContact O-OG 3.25Å; Q85-S88 PolarHBondContact O-N 3.19Å; E86-S88 VanDerWaalsContact C-N 3.3Å; E86-S88 PolarHBondContact O-N 2.93Å; S88-T91 WeakPolarHBondContact O-CB 3.29Å; S88-T91 PolarHBondContact O-N 2.94Å; S88-Y92 WeakPolarHBondContact O-CD2 3.43Å; S88-Y92 PolarHBondContact O-N 2.72Å |
| 89 | R | 63.9 | Low | 70.4 | Confident | 134 Ų | 134 | 91.4 Ų | 91.4 | 51% | 0.506 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 178.2 | -175.6 | -171.8 | 69.1 | 90.3 | 14.1 | 112.1 | Q85 E86 T91 Y92 L93 | Q85-R89 WeakPolarHBondContact O-CB 3.43Å; Q85-R89 PolarHBondContact O-N 2.86Å; E86-R89 CarbonylContact O-C 3.59Å; E86-R89 WeakPolarHBondContact O-CA 3.45Å; E86-R89 WeakPolarHBondContact O-CB 3.38Å; E86-R89 PolarHBondContact O-N 3.36Å; E86-R89 VanDerWaalsContact O-N 3.08Å; R89-T91 VanDerWaalsContact C-N 3.33Å; R89-Y92 CarbonylContact O-C 3.54Å; R89-Y92 WeakPolarHBondContact O-CA 3.43Å; R89-Y92 WeakPolarHBondContact O-CB 3.49Å; R89-Y92 PolarHBondContact O-N 3.47Å; R89-Y92 VanDerWaalsContact O-N 3.08Å; R89-L93 HydrophobicContact CG-CD1 4.31Å; R89-L93 WeakPolarHBondContact O-CG 3.46Å; R89-L93 PolarHBondContact O-N 3.09Å |
| 90 | D | 60.5 | Low | 70.7 | Confident | 80 Ų | 80 | 91.1 Ų | 91.1 | 43% | 0.428 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.1 | -38 | 177.9 | -68.8 | -13.5 | 0 | 0 | 0 | 110.4 | E86 Y92 L93 A94 | E86-D90 WeakPolarHBondContact O-CB 3.35Å; E86-D90 VanDerWaalsContact O-CG 3.25Å; E86-D90 PolarHBondContact O-N 3.01Å; D90-Y92 VanDerWaalsContact C-N 3.3Å; D90-Y92 PolarHBondContact O-N 3.03Å; D90-L93 PolarHBondContact O-N 3.24Å; D90-A94 WeakPolarHBondContact O-CB 3.42Å; D90-A94 PolarHBondContact O-N 2.76Å |
| 91 | T | 62.5 | Low | 70.5 | Confident | 77 Ų | 77 | 91.1 Ų | 91.1 | 47% | 0.472 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.3 | -37.4 | 169.6 | -53.8 | 0 | 0 | 0 | 0 | 111.6 | A87 S88 R89 | A87-T91 WeakPolarHBondContact O-CB 3.39Å; A87-T91 PolarHBondContact O-N 2.95Å; A87-T91 PolarHBondContact O-OG1 3.33Å; S88-T91 WeakPolarHBondContact O-CB 3.29Å; S88-T91 PolarHBondContact O-N 2.94Å; R89-T91 VanDerWaalsContact C-N 3.33Å |
| 92 | Y | 57.9 | Low | 70.5 | Confident | 106 Ų | 106 | 89.5 Ų | 89.5 | 42% | 0.416 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.9 | -40.3 | 173.1 | -82.3 | -72.4 | 0 | 0 | 0 | 112.8 | S88 R89 D90 R95 K189 | S88-Y92 WeakPolarHBondContact O-CD2 3.43Å; S88-Y92 PolarHBondContact O-N 2.72Å; R89-Y92 CarbonylContact O-C 3.54Å; R89-Y92 WeakPolarHBondContact O-CA 3.43Å; R89-Y92 WeakPolarHBondContact O-CB 3.49Å; R89-Y92 PolarHBondContact O-N 3.47Å; R89-Y92 VanDerWaalsContact O-N 3.08Å; D90-Y92 VanDerWaalsContact C-N 3.3Å; D90-Y92 PolarHBondContact O-N 3.03Å; Y92-R95 PolarHBondContact O-N 3.32Å; Y92-K189 VanDerWaalsContact CE1-NZ 3.31Å |
| 93 | L | 59.7 | Low | 70.5 | Confident | 122 Ų | 122 | 89.4 Ų | 89.4 | 64% | 0.639 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -71.9 | -29.7 | 178.4 | -69.7 | 172.7 | 0 | 0 | 0 | 112.6 | R89 D90 R95 | R89-L93 HydrophobicContact CG-CD1 4.31Å; R89-L93 WeakPolarHBondContact O-CG 3.46Å; R89-L93 PolarHBondContact O-N 3.09Å; D90-L93 PolarHBondContact O-N 3.24Å; L93-R95 PolarHBondContact O-N 3.13Å |
| 94 | A | 63.2 | Low | 70.5 | Confident | 79 Ų | 79 | 89.4 Ų | 89.4 | 65% | 0.653 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | -15.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | D90 T96 | D90-A94 WeakPolarHBondContact O-CB 3.42Å; D90-A94 PolarHBondContact O-N 2.76Å; A94-T96 PolarHBondContact O-N 3.05Å |
| 95 | R | 69.9 | Low | 70.8 | Confident | 68 Ų | 68 | 90.6 Ų | 90.6 | 26% | 0.257 | 49% | 0.491 | S | S | . | . | S | Bend | trans | -76.7 | 116.4 | 177.9 | -68.3 | -177.4 | 179.1 | 115 | -1.2 | 110.2 | Y92 L93 P97 F113 | Y92-R95 PolarHBondContact O-N 3.32Å; L93-R95 PolarHBondContact O-N 3.13Å; R95-P97 WeakPolarHBondContact O-CD 3.37Å; R95-F113 HydrophobicContact CB-CD2 3.77Å; R95-F113 HydrophobicContact CB-CE2 4Å; R95-F113 HydrophobicContact CB-CG 4.05Å; R95-F113 HydrophobicContact CB-CZ 4.49Å; R95-F113 HydrophobicContact CG-CE2 4.35Å; R95-F113 HydrophobicContact CG-CZ 4.41Å |
| 96 | T | 73.1 | Confident | 70.9 | Confident | 109 Ų | 109 | 85.8 Ų | 85.8 | 67% | 0.669 | 47% | 0.471 | S | S | * | . | P | Polyproline II helix | trans | -62.8 | 124.5 | 175.5 | 51.5 | 0 | 0 | 0 | 0 | 110.5 | A94 N98 F113 | A94-T96 PolarHBondContact O-N 3.05Å; T96-N98 PolarHBondContact O-N 3.16Å; T96-F113 WeakPolarHBondContact O-CD2 3.19Å |
| 97 | P | 78.6 | Confident | 71.2 | Confident | 70 Ų | 70 | 87 Ų | 87 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | P | Polyproline II helix | trans | -50.3 | 127.6 | 170.4 | -28.8 | 36.9 | 0 | 0 | 0 | 111.4 | R95 P110 | R95-P97 WeakPolarHBondContact O-CD 3.37Å; P97-P110 HydrophobicContact CB-CB 4.07Å; P97-P110 WeakPolarHBondContact CB-O 3.32Å; P97-P110 WeakPolarHBondContact O-CB 3.41Å |
| 98 | N | 83.9 | Confident | 71.3 | Confident | 66 Ų | 66 | 88 Ų | 88 | 35% | 0.353 | 49% | 0.488 | S | S | . | . | trans | -122.3 | -3.3 | -175.3 | 68.9 | -24.9 | 0 | 0 | 0 | 113.1 | T96 L112 F113 H114 | T96-N98 PolarHBondContact O-N 3.16Å; N98-L112 PolarHBondContact N-O 3.38Å; N98-L112 VanDerWaalsContact N-O 3.08Å; N98-L112 PolarHBondContact OD1-O 3.21Å; N98-F113 WeakPolarHBondContact OD1-CA 3.48Å; N98-H114 PolarHBondContact ND2-O 2.98Å; N98-H114 PolarHBondContact OD1-N 2.93Å | ||
| 99 | W | 81.5 | Confident | 71.6 | Confident | 46 Ų | 46 | 92.3 Ų | 92.3 | 17% | 0.174 | 50% | 0.501 | C | S | . | . | B | Isolated β-bridge | trans | -133.2 | 141.4 | -175 | -169.5 | -86.4 | 0 | 0 | 0 | 113.1 | P101 C111 L112 H114 F132 W135 F177 | W99-P101 HydrophobicContact CE3-CG 4.22Å; W99-P101 HydrophobicContact CH2-CG 4.48Å; W99-P101 VanDerWaalsContact CZ3-CD 3.47Å; W99-P101 HydrophobicContact CZ3-CG 3.92Å; W99-C111 PolarHBondContact O-N 2.83Å; W99-C111 VanDerWaalsContact O-N 3.12Å; W99-L112 WeakPolarHBondContact CA-O 3.44Å; W99-L112 WeakPolarHBondContact CB-O 3.32Å; W99-L112 PolarHBondContact N-O 3.44Å; W99-L112 PolarHBondContact O-N 2.97Å; W99-H114 HydrophobicContact CB-CB 3.76Å; W99-H114 HydrophobicContact CG-CB 4.09Å; W99-F132 HydrophobicContact CH2-CE2 4.03Å; W99-F132 AromaticContact CH2-CZ 3.75Å; W99-F132 HydrophobicContact CH2-CZ 3.75Å; W99-F132 HydrophobicContact CZ2-CE2 4.13Å; W99-F132 HydrophobicContact CZ2-CZ 4.32Å; W99-F132 HydrophobicContact CZ3-CZ 4.22Å; W99-W135 HydrophobicContact CZ2-CH2 4.14Å; W99-W135 AromaticContact CZ2-CZ3 3.94Å; W99-W135 HydrophobicContact CZ2-CZ3 3.94Å; W99-F177 AromaticContact CD1-CE1 3.88Å; W99-F177 AromaticContact CD1-CZ 3.42Å; W99-F177 VanDerWaalsContact CD1-CZ 3.42Å; W99-F177 HydrophobicContact CG-CZ 4.45Å; W99-F177 HydrophobicContact CZ2-CE2 4.44Å; W99-F177 AromaticContact NE1-CE1 3.7Å; W99-F177 AromaticContact NE1-CE2 3.43Å; W99-F177 AromaticContact NE1-CZ 3.08Å |
| 100 | P | 77.9 | Confident | 72.2 | Confident | 41 Ų | 41 | 88.3 Ų | 88.3 | 27% | 0.266 | 49% | 0.492 | S | S | . | . | S | Bend | cis | -71.2 | 148.9 | -7.6 | 28.6 | -33.5 | 0 | 0 | 0 | 112.6 | L102 | P100-L102 VanDerWaalsContact C-N 3.26Å; P100-L102 HydrophobicContact CB-CG 4.18Å; P100-L102 HydrophobicContact CG-CD1 3.78Å; P100-L102 HydrophobicContact CG-CG 3.92Å; P100-L102 PolarHBondContact O-N 3.08Å |
| 101 | P | 71.9 | Confident | 73 | Confident | 90 Ų | 90 | 88.9 Ų | 88.9 | 58% | 0.584 | 50% | 0.502 | S | S | * | . | trans | -75.7 | 83.1 | 176 | 31.8 | -34.8 | 0 | 0 | 0 | 108.6 | W99 | W99-P101 HydrophobicContact CE3-CG 4.22Å; W99-P101 HydrophobicContact CH2-CG 4.48Å; W99-P101 VanDerWaalsContact CZ3-CD 3.47Å; W99-P101 HydrophobicContact CZ3-CG 3.92Å | ||
| 102 | L | 73.4 | Confident | 73.9 | Confident | 68 Ų | 68 | 88.5 Ų | 88.5 | 36% | 0.356 | 50% | 0.496 | S | S | . | . | trans | -90.8 | 143 | 176.2 | -64.7 | 170.9 | 0 | 0 | 0 | 109.4 | P100 C106 V108 | P100-L102 VanDerWaalsContact C-N 3.26Å; P100-L102 HydrophobicContact CB-CG 4.18Å; P100-L102 HydrophobicContact CG-CD1 3.78Å; P100-L102 HydrophobicContact CG-CG 3.92Å; P100-L102 PolarHBondContact O-N 3.08Å; L102-C106 HydrophobicContact CB-CB 3.88Å; L102-C106 HydrophobicContact CD1-CB 4.35Å; L102-V108 HydrophobicContact CD1-CB 3.64Å; L102-V108 HydrophobicContact CD1-CG1 3.88Å; L102-V108 WeakPolarHBondContact CD1-O 3.01Å | ||
| 103 | P | 75.8 | Confident | 74.9 | Confident | 66 Ų | 66 | 85.7 Ų | 85.7 | 43% | 0.429 | 49% | 0.486 | S | S | . | . | trans | -53.8 | 149.5 | 168.3 | -25.1 | 34.9 | 0 | 0 | 0 | 110.9 | W105 C106 | P103-W105 HydrophobicContact CB-CD2 4.29Å; P103-W105 HydrophobicContact CB-CG 4.07Å; P103-W105 HydrophobicContact CB-CZ2 4.42Å; P103-W105 HydrophobicContact CG-CZ2 4.13Å; P103-W105 PolarHBondContact O-N 3.33Å; P103-C106 WeakPolarHBondContact O-CB 3.41Å; P103-C106 PolarHBondContact O-N 2.85Å | ||
| 104 | S | 77 | Confident | 76.1 | Confident | 132 Ų | 132 | 80.7 Ų | 80.7 | 92% | 0.923 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | -17.1 | -177.5 | 54.2 | 0 | 0 | 0 | 0 | 114.9 | C106 | S104-C106 VanDerWaalsContact C-N 3.32Š|
| 105 | W | 80.8 | Confident | 77.3 | Confident | 204 Ų | 204 | 79 Ų | 79 | 77% | 0.773 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -16.4 | 175 | 61.9 | -105.4 | 0 | 0 | 0 | 113.7 | P103 | P103-W105 HydrophobicContact CB-CD2 4.29Å; P103-W105 HydrophobicContact CB-CG 4.07Å; P103-W105 HydrophobicContact CB-CZ2 4.42Å; P103-W105 HydrophobicContact CG-CZ2 4.13Å; P103-W105 PolarHBondContact O-N 3.33Å |
| 106 | C | 75.1 | Confident | 78.2 | Confident | 30 Ų | 30 | 76.2 Ų | 76.2 | 20% | 0.203 | 43% | 0.43 | C | S | . | . | S | Bend | trans | -80.3 | 128.3 | 178.9 | -164.4 | 0 | 0 | 0 | 0 | 109.9 | L102 P103 S104 V108 | L102-C106 HydrophobicContact CB-CB 3.88Å; L102-C106 HydrophobicContact CD1-CB 4.35Å; P103-C106 WeakPolarHBondContact O-CB 3.41Å; P103-C106 PolarHBondContact O-N 2.85Å; S104-C106 VanDerWaalsContact C-N 3.32Å; C106-V108 PolarHBondContact O-N 3.24Å; C106-V108 VanDerWaalsContact O-N 3.12Å |
| 107 | P | 76.3 | Confident | 78.9 | Confident | 122 Ų | 122 | 75.2 Ų | 75.2 | 79% | 0.792 | 42% | 0.42 | S | S | * | . | S | Bend | trans | -68.5 | -11.1 | -178.6 | 27.4 | -35.1 | 0 | 0 | 0 | 113.6 | Q109 | P107-Q109 PolarHBondContact O-N 2.73Š|
| 108 | V | 70.1 | Confident | 79.4 | Confident | 76 Ų | 76 | 75.9 Ų | 75.9 | 46% | 0.461 | 42% | 0.423 | S | S | . | . | trans | -84.4 | 104.9 | 176.1 | -175.9 | 0 | 0 | 0 | 0 | 108 | L102 C106 | L102-V108 HydrophobicContact CD1-CB 3.64Å; L102-V108 HydrophobicContact CD1-CG1 3.88Å; L102-V108 WeakPolarHBondContact CD1-O 3.01Å; C106-V108 PolarHBondContact O-N 3.24Å; C106-V108 VanDerWaalsContact O-N 3.12Å | ||
| 109 | Q | 70.9 | Confident | 79.6 | Confident | 153 Ų | 153 | 73.5 Ų | 73.5 | 72% | 0.715 | 41% | 0.409 | S | S | * | . | trans | -67.5 | 154.8 | 170.7 | -68 | -163.1 | -32 | 0 | 0 | 110.5 | P107 C111 | P107-Q109 PolarHBondContact O-N 2.73Å; Q109-C111 PolarHBondContact O-N 3.08Å; Q109-C111 PolarHBondContact O-SG 3.36Å | ||
| 110 | P | 76.6 | Confident | 80 | Confident | 50 Ų | 50 | 71.5 Ų | 71.5 | 33% | 0.325 | 40% | 0.402 | S | S | . | . | trans | -52.3 | 117.9 | 165.8 | -24.9 | 34.9 | 0 | 0 | 0 | 109.2 | P97 | P97-P110 HydrophobicContact CB-CB 4.07Å; P97-P110 WeakPolarHBondContact CB-O 3.32Å; P97-P110 WeakPolarHBondContact O-CB 3.41Å | ||
| 111 | C | 77.8 | Confident | 80.6 | Confident | 92 Ų | 92 | 72 Ų | 72 | 62% | 0.622 | 41% | 0.405 | S | S | * | . | trans | -98.8 | -16.6 | -178.8 | -67.3 | 0 | 0 | 0 | 0 | 112 | W99 Q109 | W99-C111 PolarHBondContact O-N 2.83Å; W99-C111 VanDerWaalsContact O-N 3.12Å; Q109-C111 PolarHBondContact O-N 3.08Å; Q109-C111 PolarHBondContact O-SG 3.36Å | ||
| 112 | L | 80.2 | Confident | 81.4 | Confident | 69 Ų | 69 | 74.3 Ų | 74.3 | 36% | 0.361 | 41% | 0.408 | S | S | . | . | B | Isolated β-bridge | trans | -129.4 | 137 | -165.9 | -58.1 | 166.2 | 0 | 0 | 0 | 110.4 | N98 W99 F177 | N98-L112 PolarHBondContact N-O 3.38Å; N98-L112 VanDerWaalsContact N-O 3.08Å; N98-L112 PolarHBondContact OD1-O 3.21Å; W99-L112 WeakPolarHBondContact CA-O 3.44Å; W99-L112 WeakPolarHBondContact CB-O 3.32Å; W99-L112 PolarHBondContact N-O 3.44Å; W99-L112 PolarHBondContact O-N 2.97Å; L112-F177 HydrophobicContact CD1-CE1 3.99Å |
| 113 | F | 79.2 | Confident | 82.2 | Confident | 46 Ų | 46 | 77.5 Ų | 77.5 | 20% | 0.202 | 42% | 0.421 | C | S | . | . | trans | -77.8 | 138.1 | 161.4 | -168.6 | -99.6 | 0 | 0 | 0 | 109.5 | R95 T96 N98 D115 E119 R182 | R95-F113 HydrophobicContact CB-CD2 3.77Å; R95-F113 HydrophobicContact CB-CE2 4Å; R95-F113 HydrophobicContact CB-CG 4.05Å; R95-F113 HydrophobicContact CB-CZ 4.49Å; R95-F113 HydrophobicContact CG-CE2 4.35Å; R95-F113 HydrophobicContact CG-CZ 4.41Å; T96-F113 WeakPolarHBondContact O-CD2 3.19Å; N98-F113 WeakPolarHBondContact OD1-CA 3.48Å; F113-D115 HydrophobicContact CE1-CB 3.7Å; F113-D115 HydrophobicContact CZ-CB 3.78Å; F113-E119 VanDerWaalsContact CD1-CD 3.42Å; F113-E119 HydrophobicContact CD1-CG 4.02Å; F113-E119 WeakPolarHBondContact CD1-OE1 3.39Å; F113-E119 HydrophobicContact CE1-CG 3.78Å; F113-R182 PolarHBondContact O-NH1 3.43Å | ||
| 114 | H | 85.7 | Confident | 83 | Confident | 17 Ų | 17 | 76.3 Ų | 76.3 | 8% | 0.079 | 41% | 0.409 | C | S | . | . | trans | -148.9 | 106.4 | 178 | -173.1 | 61 | 0 | 0 | 0 | 109.3 | N98 W99 Y181 Y185 | N98-H114 PolarHBondContact ND2-O 2.98Å; N98-H114 PolarHBondContact OD1-N 2.93Å; W99-H114 HydrophobicContact CB-CB 3.76Å; W99-H114 HydrophobicContact CG-CB 4.09Å; H114-Y181 AromaticContact CE1-CE1 3.73Å; H114-Y181 AromaticContact CE1-CZ 3.78Å; H114-Y181 PolarHBondContact CE1-OH 2.89Å; H114-Y181 PolarHBondContact NE2-OH 3.46Å; H114-Y185 AromaticContact CE1-CD2 3.5Å; H114-Y185 AromaticContact CE1-CE2 3.23Å; H114-Y185 WeakPolarHBondContact CE1-CE2 3.44Å; H114-Y185 AromaticContact CE1-CZ 3.97Å; H114-Y185 AromaticContact ND1-CD2 3.81Å; H114-Y185 AromaticContact ND1-CE2 3.39Å; H114-Y185 WeakPolarHBondContact ND1-CE2 3.26Å; H114-Y185 AromaticContact ND1-CZ 3.64Å | ||
| 115 | D | 86.9 | Confident | 83.8 | Confident | 43 Ų | 43 | 70.7 Ų | 70.7 | 23% | 0.23 | 37% | 0.368 | C | S | . | . | trans | -147.5 | 107.5 | 170.6 | -170.9 | -16.9 | 0 | 0 | 0 | 110 | F113 N117 V118 E119 Y185 | F113-D115 HydrophobicContact CE1-CB 3.7Å; F113-D115 HydrophobicContact CZ-CB 3.78Å; D115-N117 VanDerWaalsContact C-N 3.26Å; D115-N117 PolarHBondContact O-N 2.96Å; D115-N117 WeakPolarHBondContact OD1-CB 3.26Å; D115-N117 PolarHBondContact OD1-N 2.81Å; D115-N117 PolarHBondContact OD1-ND2 2.94Å; D115-V118 HydrophobicContact CB-CB 4.27Å; D115-V118 HydrophobicContact CB-CG2 4.49Å; D115-V118 PolarHBondContact O-N 2.83Å; D115-V118 VanDerWaalsContact OD2-CG2 3.29Å; D115-V118 WeakPolarHBondContact OD2-CG2 3.34Å; D115-E119 WeakPolarHBondContact O-CB 3.26Å; D115-E119 PolarHBondContact O-N 3.35Å; D115-Y185 PolarHBondContact N-OH 2.87Å; D115-Y185 PolarHBondContact O-OH 3.16Å | ||
| 116 | I | 89.7 | Confident | 84.5 | Confident | 11 Ų | 11 | 68.6 Ų | 68.6 | 6% | 0.056 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.8 | -31.3 | -179.4 | -60.2 | 168.2 | 0 | 0 | 0 | 111.4 | V118 I120 Q125 V128 R129 F132 Y185 | I116-V118 VanDerWaalsContact C-N 3.35Å; I116-I120 HydrophobicContact CG2-CB 4.18Å; I116-I120 HydrophobicContact CG2-CG1 4.1Å; I116-I120 WeakPolarHBondContact O-CB 3.44Å; I116-I120 PolarHBondContact O-N 2.85Å; I116-Q125 HydrophobicContact CG2-CB 4.01Å; I116-Q125 HydrophobicContact CG2-CG 4.04Å; I116-Q125 PolarHBondContact O-NE2 3.25Å; I116-V128 HydrophobicContact CD1-CG1 4.15Å; I116-V128 HydrophobicContact CG1-CG1 4.06Å; I116-V128 HydrophobicContact CG2-CB 4.42Å; I116-V128 HydrophobicContact CG2-CG1 4.33Å; I116-R129 HydrophobicContact CD1-CG 3.87Å; I116-R129 HydrophobicContact CG2-CG 4.06Å; I116-F132 HydrophobicContact CD1-CB 4.31Å; I116-Y185 HydrophobicContact CG1-CE2 3.88Å |
| 117 | N | 88.1 | Confident | 85.5 | Confident | 87 Ų | 87 | 67.5 Ų | 67.5 | 47% | 0.465 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -71.6 | -34.2 | -176.1 | -53.2 | -77.3 | 0 | 0 | 0 | 112.3 | D115 Q125 R129 | D115-N117 VanDerWaalsContact C-N 3.26Å; D115-N117 PolarHBondContact O-N 2.96Å; D115-N117 WeakPolarHBondContact OD1-CB 3.26Å; D115-N117 PolarHBondContact OD1-N 2.81Å; D115-N117 PolarHBondContact OD1-ND2 2.94Å; N117-Q125 PolarHBondContact O-NE2 2.95Å; N117-Q125 VanDerWaalsContact O-NE2 3.12Å; N117-R129 PolarHBondContact OD1-NH2 3.2Å |
| 118 | V | 88.2 | Confident | 86.4 | Confident | 84 Ų | 84 | 61.7 Ų | 61.7 | 51% | 0.509 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -95.9 | -41.6 | -172.6 | 177.5 | 0 | 0 | 0 | 0 | 111.1 | D115 I116 | D115-V118 HydrophobicContact CB-CB 4.27Å; D115-V118 HydrophobicContact CB-CG2 4.49Å; D115-V118 PolarHBondContact O-N 2.83Å; D115-V118 VanDerWaalsContact OD2-CG2 3.29Å; D115-V118 WeakPolarHBondContact OD2-CG2 3.34Å; I116-V118 VanDerWaalsContact C-N 3.35Å |
| 119 | E | 87.8 | Confident | 87.7 | Confident | 16 Ų | 16 | 62.3 Ų | 62.3 | 8% | 0.075 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -91.7 | -24.6 | -173 | -57.5 | -162.6 | 116.3 | 0 | 0 | 114 | F113 D115 Y185 K189 | F113-E119 VanDerWaalsContact CD1-CD 3.42Å; F113-E119 HydrophobicContact CD1-CG 4.02Å; F113-E119 WeakPolarHBondContact CD1-OE1 3.39Å; F113-E119 HydrophobicContact CE1-CG 3.78Å; D115-E119 WeakPolarHBondContact O-CB 3.26Å; D115-E119 PolarHBondContact O-N 3.35Å; E119-Y185 WeakPolarHBondContact CB-OH 3.43Å; E119-Y185 WeakPolarHBondContact OE2-CE1 3.04Å; E119-Y185 VanDerWaalsContact OE2-CZ 3.25Å; E119-Y185 PolarHBondContact OE2-OH 3.15Å; E119-K189 HydrophobicContact CB-CD 4.04Å; E119-K189 HydrophobicContact CB-CG 4.15Å; E119-K189 WeakPolarHBondContact OE1-CE 3.43Å; E119-K189 IonicContact OE1-NZ 2.66Å; E119-K189 PolarHBondContact OE1-NZ 3.34Å; E119-K189 IonicContact OE2-NZ 3.77Å |
| 120 | I | 90.7 | Very high | 88.9 | Confident | 4 Ų | 4 | 58.6 Ų | 58.6 | 2% | 0.021 | 30% | 0.296 | C | S | . | . | S | Bend | trans | -101.5 | 127.9 | -176.4 | -53.4 | -60.5 | 0 | 0 | 0 | 109.6 | I116 Q125 V128 Y185 F188 K189 | I116-I120 HydrophobicContact CG2-CB 4.18Å; I116-I120 HydrophobicContact CG2-CG1 4.1Å; I116-I120 WeakPolarHBondContact O-CB 3.44Å; I116-I120 PolarHBondContact O-N 2.85Å; I120-Q125 HydrophobicContact CB-CG 4.1Å; I120-Q125 HydrophobicContact CG2-CG 4.09Å; I120-Q125 WeakPolarHBondContact O-CG 3.19Å; I120-Q125 PolarHBondContact O-NE2 2.91Å; I120-V128 HydrophobicContact CD1-CG2 4.38Å; I120-V128 HydrophobicContact CG1-CG1 4.25Å; I120-V128 HydrophobicContact CG1-CG2 4.33Å; I120-V128 HydrophobicContact CG2-CB 4.45Å; I120-V128 HydrophobicContact CG2-CG2 3.9Å; I120-Y185 HydrophobicContact CD1-CD1 4.38Å; I120-Y185 HydrophobicContact CD1-CD2 4.06Å; I120-Y185 HydrophobicContact CD1-CE1 4.24Å; I120-Y185 HydrophobicContact CD1-CE2 3.88Å; I120-Y185 HydrophobicContact CD1-CG 4.32Å; I120-Y185 HydrophobicContact CG1-CD2 4.3Å; I120-Y185 HydrophobicContact CG1-CE2 3.82Å; I120-F188 HydrophobicContact CD1-CB 4.41Å; I120-F188 HydrophobicContact CG2-CB 4.32Å; I120-K189 HydrophobicContact CD1-CB 3.62Å; I120-K189 HydrophobicContact CD1-CG 4.41Å |
| 121 | P | 89.9 | Confident | 89.9 | Confident | 51 Ų | 51 | 56.2 Ų | 56.2 | 33% | 0.331 | 28% | 0.281 | S | S | . | . | trans | -52.9 | 140.9 | 173.7 | -26.2 | 34.1 | 0 | 0 | 0 | 112.1 | Q123 Y124 Q125 F188 | P121-Q123 PolarHBondContact O-N 3.39Å; P121-Q123 VanDerWaalsContact O-N 3.09Å; P121-Y124 HydrophobicContact CB-CD2 4.01Å; P121-Y124 HydrophobicContact CG-CD2 4.18Å; P121-Y124 PolarHBondContact O-N 3.2Å; P121-Q125 PolarHBondContact O-N 2.99Å; P121-F188 WeakPolarHBondContact CD-O 3.24Å | ||
| 122 | Q | 90.4 | Very high | 90.8 | Very high | 139 Ų | 139 | 53.6 Ų | 53.6 | 65% | 0.65 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -52.2 | -39.2 | -171 | -69.2 | -67.7 | -26.6 | 0 | 0 | 113.1 | Y124 Q125 | Q122-Y124 PolarHBondContact O-N 3.35Å; Q122-Q125 VanDerWaalsContact CD-NE2 3.27Å; Q122-Q125 PolarHBondContact O-N 3.13Å |
| 123 | Q | 90 | Very high | 91.6 | Very high | 135 Ų | 135 | 54.6 Ų | 54.6 | 63% | 0.631 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -63.4 | -23.6 | 178.5 | 68.1 | -97.3 | 29.2 | 0 | 0 | 114.3 | P121 | P121-Q123 PolarHBondContact O-N 3.39Å; P121-Q123 VanDerWaalsContact O-N 3.09Å |
| 124 | Y | 92.3 | Very high | 92.4 | Very high | 41 Ų | 41 | 53 Ų | 53 | 16% | 0.161 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -106.4 | -7.2 | -176 | -54 | -47.9 | 0 | 0 | 0 | 113.8 | P121 Q122 K126 I127 V128 F188 V264 | P121-Y124 HydrophobicContact CB-CD2 4.01Å; P121-Y124 HydrophobicContact CG-CD2 4.18Å; P121-Y124 PolarHBondContact O-N 3.2Å; Q122-Y124 PolarHBondContact O-N 3.35Å; Y124-K126 VanDerWaalsContact C-N 3.27Å; Y124-K126 PolarHBondContact O-N 3.44Å; Y124-I127 WeakPolarHBondContact O-CG2 3.2Å; Y124-I127 PolarHBondContact O-N 3.29Å; Y124-V128 PolarHBondContact O-N 3.13Å; Y124-V128 VanDerWaalsContact O-N 3.13Å; Y124-F188 AromaticContact CD1-CD1 3.81Å; Y124-F188 HydrophobicContact CD1-CD1 3.81Å; Y124-F188 AromaticContact CD1-CE1 3.8Å; Y124-F188 HydrophobicContact CD1-CE1 3.8Å; Y124-F188 AromaticContact CD2-CD1 3.88Å; Y124-F188 HydrophobicContact CD2-CD1 3.88Å; Y124-F188 HydrophobicContact CE1-CD1 4.46Å; Y124-F188 HydrophobicContact CE1-CE1 4.32Å; Y124-F188 AromaticContact CG-CD1 3.48Å; Y124-F188 HydrophobicContact CG-CD1 3.48Å; Y124-F188 VanDerWaalsContact CG-CD1 3.48Å; Y124-F188 AromaticContact CG-CE1 3.99Å; Y124-F188 HydrophobicContact CG-CE1 3.99Å; Y124-F188 HydrophobicContact CG-CG 4.38Å; Y124-V264 HydrophobicContact CD1-CG1 4.19Å; Y124-V264 HydrophobicContact CE1-CG1 3.72Å |
| 125 | Q | 93.5 | Very high | 92.9 | Very high | 14 Ų | 14 | 53.3 Ų | 53.3 | 7% | 0.065 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -58.9 | -40.1 | -179.1 | -67.8 | -171.6 | 11.2 | 0 | 0 | 112.5 | I116 N117 I120 P121 Q122 I127 V128 R129 | I116-Q125 HydrophobicContact CG2-CB 4.01Å; I116-Q125 HydrophobicContact CG2-CG 4.04Å; I116-Q125 PolarHBondContact O-NE2 3.25Å; N117-Q125 PolarHBondContact O-NE2 2.95Å; N117-Q125 VanDerWaalsContact O-NE2 3.12Å; I120-Q125 HydrophobicContact CB-CG 4.1Å; I120-Q125 HydrophobicContact CG2-CG 4.09Å; I120-Q125 WeakPolarHBondContact O-CG 3.19Å; I120-Q125 PolarHBondContact O-NE2 2.91Å; P121-Q125 PolarHBondContact O-N 2.99Å; Q122-Q125 VanDerWaalsContact CD-NE2 3.27Å; Q122-Q125 PolarHBondContact O-N 3.13Å; Q125-I127 VanDerWaalsContact C-N 3.34Å; Q125-I127 PolarHBondContact O-N 3.03Å; Q125-V128 PolarHBondContact O-N 3.01Å; Q125-R129 WeakPolarHBondContact O-CB 3.48Å; Q125-R129 VanDerWaalsContact O-CG 3.26Å; Q125-R129 WeakPolarHBondContact O-CG 3.49Å; Q125-R129 PolarHBondContact O-N 3.29Å |
| 126 | K | 95.1 | Very high | 93.4 | Very high | 161 Ų | 161 | 53.2 Ų | 53.2 | 70% | 0.7 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -60.5 | -42 | 180 | -173.6 | 174 | -177.2 | 172 | 0 | 112.3 | Y124 M130 | Y124-K126 VanDerWaalsContact C-N 3.27Å; Y124-K126 PolarHBondContact O-N 3.44Å; K126-M130 WeakPolarHBondContact O-CB 3.36Å; K126-M130 PolarHBondContact O-N 3.42Å |
| 127 | I | 95.7 | Very high | 93.7 | Very high | 7 Ų | 7 | 55.5 Ų | 55.5 | 4% | 0.036 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -72.5 | -38.7 | -179.5 | -170.4 | 165.2 | 0 | 0 | 0 | 111.5 | Y124 Q125 M130 G131 F188 L257 R260 V261 V264 | Y124-I127 WeakPolarHBondContact O-CG2 3.2Å; Y124-I127 PolarHBondContact O-N 3.29Å; Q125-I127 VanDerWaalsContact C-N 3.34Å; Q125-I127 PolarHBondContact O-N 3.03Å; I127-M130 WeakPolarHBondContact O-CB 3.37Å; I127-M130 PolarHBondContact O-N 3.32Å; I127-G131 PolarHBondContact O-N 2.72Å; I127-F188 HydrophobicContact CD1-CE2 4.28Å; I127-F188 HydrophobicContact CD1-CZ 3.95Å; I127-F188 HydrophobicContact CG1-CE2 4.39Å; I127-F188 HydrophobicContact CG1-CZ 4.47Å; I127-F188 HydrophobicContact CG2-CD1 4.46Å; I127-F188 HydrophobicContact CG2-CD2 4.26Å; I127-F188 HydrophobicContact CG2-CE1 4.08Å; I127-F188 HydrophobicContact CG2-CE2 3.84Å; I127-F188 HydrophobicContact CG2-CZ 3.75Å; I127-L257 HydrophobicContact CG1-CD1 3.89Å; I127-R260 HydrophobicContact CD1-CB 4.23Å; I127-R260 HydrophobicContact CD1-CG 3.8Å; I127-V261 HydrophobicContact CD1-CB 4.24Å; I127-V261 HydrophobicContact CD1-CG2 3.52Å; I127-V261 HydrophobicContact CG1-CG2 4Å; I127-V264 HydrophobicContact CD1-CG2 4.22Å |
| 128 | V | 96.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.1 | -40.2 | 175.8 | 177.7 | 0 | 0 | 0 | 0 | 111.5 | I116 I120 Y124 Q125 M130 G131 F132 Y185 F188 | I116-V128 HydrophobicContact CD1-CG1 4.15Å; I116-V128 HydrophobicContact CG1-CG1 4.06Å; I116-V128 HydrophobicContact CG2-CB 4.42Å; I116-V128 HydrophobicContact CG2-CG1 4.33Å; I120-V128 HydrophobicContact CD1-CG2 4.38Å; I120-V128 HydrophobicContact CG1-CG1 4.25Å; I120-V128 HydrophobicContact CG1-CG2 4.33Å; I120-V128 HydrophobicContact CG2-CB 4.45Å; I120-V128 HydrophobicContact CG2-CG2 3.9Å; Y124-V128 PolarHBondContact O-N 3.13Å; Y124-V128 VanDerWaalsContact O-N 3.13Å; Q125-V128 PolarHBondContact O-N 3.01Å; V128-M130 VanDerWaalsContact C-N 3.35Å; V128-G131 PolarHBondContact O-N 2.82Å; V128-F132 PolarHBondContact O-N 3.43Å; V128-Y185 HydrophobicContact CG1-CD2 3.63Å; V128-Y185 HydrophobicContact CG1-CE2 4.22Å; V128-F188 HydrophobicContact CG2-CB 3.69Å; V128-F188 HydrophobicContact CG2-CD2 3.65Å; V128-F188 HydrophobicContact CG2-CG 3.89Å |
| 129 | R | 96.5 | Very high | 94.5 | Very high | 88 Ų | 88 | 48.9 Ų | 48.9 | 33% | 0.332 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.3 | -41.3 | 172.3 | -73 | 178.8 | -155 | -84.9 | -2.1 | 112.1 | I116 N117 Q125 G131 F132 N133 | I116-R129 HydrophobicContact CD1-CG 3.87Å; I116-R129 HydrophobicContact CG2-CG 4.06Å; N117-R129 PolarHBondContact OD1-NH2 3.2Å; Q125-R129 WeakPolarHBondContact O-CB 3.48Å; Q125-R129 VanDerWaalsContact O-CG 3.26Å; Q125-R129 WeakPolarHBondContact O-CG 3.49Å; Q125-R129 PolarHBondContact O-N 3.29Å; R129-G131 VanDerWaalsContact C-N 3.3Å; R129-G131 PolarHBondContact O-N 3.02Å; R129-F132 PolarHBondContact O-N 3.07Å; R129-N133 WeakPolarHBondContact O-CB 3.43Å; R129-N133 VanDerWaalsContact O-CG 3.23Å; R129-N133 PolarHBondContact O-N 3.39Å |
| 130 | M | 96.9 | Very high | 94.9 | Very high | 75 Ų | 75 | 53.7 Ų | 53.7 | 37% | 0.369 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.1 | -44.8 | 175.2 | -169.7 | 173.9 | 81.7 | 0 | 0 | 110.8 | K126 I127 V128 L134 L257 R260 | K126-M130 WeakPolarHBondContact O-CB 3.36Å; K126-M130 PolarHBondContact O-N 3.42Å; I127-M130 WeakPolarHBondContact O-CB 3.37Å; I127-M130 PolarHBondContact O-N 3.32Å; V128-M130 VanDerWaalsContact C-N 3.35Å; M130-L134 VanDerWaalsContact O-CB 3.23Å; M130-L134 WeakPolarHBondContact O-CB 3.38Å; M130-L134 PolarHBondContact O-N 2.76Å; M130-L257 HydrophobicContact CE-CB 3.92Å; M130-L257 HydrophobicContact CE-CD1 3.24Å; M130-L257 HydrophobicContact CE-CG 4.15Å; M130-R260 HydrophobicContact CE-CB 4.48Å |
| 131 | G | 96.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.9 | -41.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | I127 V128 R129 L134 W135 W180 | I127-G131 PolarHBondContact O-N 2.72Å; V128-G131 PolarHBondContact O-N 2.82Å; R129-G131 VanDerWaalsContact C-N 3.3Å; R129-G131 PolarHBondContact O-N 3.02Å; G131-L134 PolarHBondContact O-N 2.99Å; G131-W135 PolarHBondContact O-N 2.88Å; G131-W180 WeakPolarHBondContact O-CH2 3.24Å |
| 132 | F | 96.2 | Very high | 95.4 | Very high | 37 Ų | 37 | 51.9 Ų | 51.9 | 16% | 0.162 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65 | -49 | 177.8 | -176.6 | -111.9 | 0 | 0 | 0 | 112 | W99 I116 V128 R129 L134 W135 C136 Y181 | W99-F132 HydrophobicContact CH2-CE2 4.03Å; W99-F132 AromaticContact CH2-CZ 3.75Å; W99-F132 HydrophobicContact CH2-CZ 3.75Å; W99-F132 HydrophobicContact CZ2-CE2 4.13Å; W99-F132 HydrophobicContact CZ2-CZ 4.32Å; W99-F132 HydrophobicContact CZ3-CZ 4.22Å; I116-F132 HydrophobicContact CD1-CB 4.31Å; V128-F132 PolarHBondContact O-N 3.43Å; R129-F132 PolarHBondContact O-N 3.07Å; F132-L134 VanDerWaalsContact C-N 3.29Å; F132-L134 PolarHBondContact O-N 3.17Å; F132-W135 HydrophobicContact CD2-CE3 4.27Å; F132-W135 HydrophobicContact CE2-CE3 4.04Å; F132-W135 HydrophobicContact CE2-CZ3 4.09Å; F132-W135 WeakPolarHBondContact O-CB 3.41Å; F132-W135 PolarHBondContact O-N 3.38Å; F132-W135 VanDerWaalsContact O-N 3.1Å; F132-C136 PolarHBondContact O-N 3.35Å; F132-C136 PolarHBondContact O-SG 3.36Å; F132-Y181 HydrophobicContact CB-CD2 4.47Å; F132-Y181 HydrophobicContact CB-CE2 3.53Å; F132-Y181 WeakPolarHBondContact CB-OH 3.35Å; F132-Y181 AromaticContact CD2-CE1 3.81Å; F132-Y181 HydrophobicContact CD2-CE1 3.81Å; F132-Y181 AromaticContact CD2-CE2 3.96Å; F132-Y181 HydrophobicContact CD2-CE2 3.96Å; F132-Y181 AromaticContact CD2-CZ 3.48Å; F132-Y181 VanDerWaalsContact CD2-CZ 3.48Å; F132-Y181 WeakPolarHBondContact CD2-OH 3.29Å; F132-Y181 HydrophobicContact CG-CE2 4.24Å |
| 133 | N | 96.7 | Very high | 95.7 | Very high | 91 Ų | 91 | 50.9 Ų | 50.9 | 49% | 0.487 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.2 | -40.4 | 178.6 | -69 | -8.5 | 0 | 0 | 0 | 111 | R129 W135 C136 I137 | R129-N133 WeakPolarHBondContact O-CB 3.43Å; R129-N133 VanDerWaalsContact O-CG 3.23Å; R129-N133 PolarHBondContact O-N 3.39Å; N133-W135 VanDerWaalsContact C-N 3.31Å; N133-W135 PolarHBondContact O-N 2.83Å; N133-C136 PolarHBondContact O-N 3.42Å; N133-I137 VanDerWaalsContact O-CG1 3.25Å; N133-I137 WeakPolarHBondContact O-CG1 3.39Å; N133-I137 PolarHBondContact O-N 2.91Å |
| 134 | L | 97.7 | Very high | 96 | Very high | 12 Ų | 12 | 46.1 Ų | 46.1 | 6% | 0.063 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.9 | -38.9 | 175.2 | -173.8 | 67.2 | 0 | 0 | 0 | 111.8 | M130 G131 F132 I137 Y138 G253 M254 L257 | M130-L134 VanDerWaalsContact O-CB 3.23Å; M130-L134 WeakPolarHBondContact O-CB 3.38Å; M130-L134 PolarHBondContact O-N 2.76Å; G131-L134 PolarHBondContact O-N 2.99Å; F132-L134 VanDerWaalsContact C-N 3.29Å; F132-L134 PolarHBondContact O-N 3.17Å; L134-I137 PolarHBondContact O-N 3.08Å; L134-Y138 WeakPolarHBondContact O-CB 3.43Å; L134-Y138 PolarHBondContact O-N 3.39Å; L134-G253 VanDerWaalsContact CD2-C 3.44Å; L134-M254 HydrophobicContact CD2-CB 4.29Å; L134-M254 HydrophobicContact CD2-CG 3.67Å; L134-M254 HydrophobicContact CG-CG 4.38Å; L134-L257 HydrophobicContact CD2-CB 4.38Å; L134-L257 HydrophobicContact CD2-CD2 4.02Å |
| 135 | W | 96.4 | Very high | 96.2 | Very high | 24 Ų | 24 | 44.2 Ų | 44.2 | 9% | 0.091 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.5 | -46.3 | 172.6 | 176.9 | 76.6 | 0 | 0 | 0 | 111.6 | W99 G131 F132 N133 I137 Y138 V139 T173 F177 W180 | W99-W135 HydrophobicContact CZ2-CH2 4.14Å; W99-W135 AromaticContact CZ2-CZ3 3.94Å; W99-W135 HydrophobicContact CZ2-CZ3 3.94Å; G131-W135 PolarHBondContact O-N 2.88Å; F132-W135 HydrophobicContact CD2-CE3 4.27Å; F132-W135 HydrophobicContact CE2-CE3 4.04Å; F132-W135 HydrophobicContact CE2-CZ3 4.09Å; F132-W135 WeakPolarHBondContact O-CB 3.41Å; F132-W135 PolarHBondContact O-N 3.38Å; F132-W135 VanDerWaalsContact O-N 3.1Å; N133-W135 VanDerWaalsContact C-N 3.31Å; N133-W135 PolarHBondContact O-N 2.83Å; W135-I137 PolarHBondContact O-N 3.35Å; W135-Y138 WeakPolarHBondContact O-CB 3.01Å; W135-Y138 PolarHBondContact O-N 2.9Å; W135-V139 HydrophobicContact CD2-CG2 4.32Å; W135-V139 HydrophobicContact CZ2-CG2 3.96Å; W135-V139 WeakPolarHBondContact O-CG2 3.5Å; W135-V139 PolarHBondContact O-N 2.94Å; W135-T173 HydrophobicContact CZ2-CG2 4.15Å; W135-F177 HydrophobicContact CD2-CD2 4.1Å; W135-F177 AromaticContact CE2-CD2 3.77Å; W135-F177 HydrophobicContact CE3-CD2 4.28Å; W135-F177 AromaticContact CH2-CD2 3.89Å; W135-F177 HydrophobicContact CH2-CD2 3.89Å; W135-F177 HydrophobicContact CZ2-CB 3.7Å; W135-F177 AromaticContact CZ2-CD2 3.67Å; W135-F177 HydrophobicContact CZ2-CD2 3.67Å; W135-F177 HydrophobicContact CZ2-CG 4.03Å; W135-F177 HydrophobicContact CZ3-CD2 4.18Å; W135-W180 HydrophobicContact CB-CH2 3.44Å; W135-W180 VanDerWaalsContact CB-CH2 3.44Å; W135-W180 HydrophobicContact CB-CZ2 3.36Å; W135-W180 HydrophobicContact CB-CZ3 4.47Å; W135-W180 AromaticContact CD1-CE2 3.75Å; W135-W180 AromaticContact CD1-CZ2 3.46Å; W135-W180 VanDerWaalsContact CD1-CZ2 3.46Å; W135-W180 AromaticContact CD1-NE1 3.88Å; W135-W180 HydrophobicContact CG-CH2 4.31Å; W135-W180 AromaticContact CG-CZ2 3.79Å; W135-W180 HydrophobicContact CG-CZ2 3.79Å |
| 136 | C | 96 | Very high | 96.3 | Very high | 40 Ų | 40 | 44.9 Ų | 44.9 | 27% | 0.27 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -59.9 | -45.4 | 176.3 | -67.7 | 0 | 0 | 0 | 0 | 111.9 | F132 N133 Y138 V139 L140 | F132-C136 PolarHBondContact O-N 3.35Å; F132-C136 PolarHBondContact O-SG 3.36Å; N133-C136 PolarHBondContact O-N 3.42Å; C136-Y138 VanDerWaalsContact C-N 3.33Å; C136-Y138 PolarHBondContact O-N 3.04Å; C136-V139 PolarHBondContact O-N 3.19Å; C136-L140 WeakPolarHBondContact O-CG 3.38Å; C136-L140 PolarHBondContact O-N 3.19Å |
| 137 | I | 97.5 | Very high | 96.4 | Very high | 60 Ų | 60 | 41.5 Ų | 41.5 | 31% | 0.308 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.4 | -43.3 | 176.6 | -67.1 | 166.5 | 0 | 0 | 0 | 110.2 | N133 L134 W135 V139 L140 V141 F249 | N133-I137 VanDerWaalsContact O-CG1 3.25Å; N133-I137 WeakPolarHBondContact O-CG1 3.39Å; N133-I137 PolarHBondContact O-N 2.91Å; L134-I137 PolarHBondContact O-N 3.08Å; W135-I137 PolarHBondContact O-N 3.35Å; I137-V139 VanDerWaalsContact C-N 3.33Å; I137-V139 PolarHBondContact O-N 2.97Å; I137-L140 WeakPolarHBondContact O-CB 3.4Å; I137-L140 PolarHBondContact O-N 2.91Å; I137-L140 VanDerWaalsContact O-N 3.16Å; I137-V141 HydrophobicContact CG2-CG2 4.35Å; I137-V141 WeakPolarHBondContact O-CG2 3.33Å; I137-V141 PolarHBondContact O-N 3.19Å; I137-F249 HydrophobicContact CD1-CE1 4Å; I137-F249 HydrophobicContact CG2-CD1 4.12Å; I137-F249 HydrophobicContact CG2-CE1 4.2Å |
| 138 | Y | 96.3 | Very high | 96.5 | Very high | 1 Ų | 1 | 41.2 Ų | 41.2 | 0% | 0.004 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.3 | -43.8 | 175.9 | 176.2 | -101.8 | 0 | 0 | 0 | 112.2 | L134 W135 C136 L140 V141 C142 A176 Q206 V210 Q213 Y247 C250 | L134-Y138 WeakPolarHBondContact O-CB 3.43Å; L134-Y138 PolarHBondContact O-N 3.39Å; W135-Y138 WeakPolarHBondContact O-CB 3.01Å; W135-Y138 PolarHBondContact O-N 2.9Å; C136-Y138 VanDerWaalsContact C-N 3.33Å; C136-Y138 PolarHBondContact O-N 3.04Å; Y138-L140 PolarHBondContact O-N 3.35Å; Y138-V141 PolarHBondContact O-N 3.3Å; Y138-C142 PolarHBondContact O-N 3.32Å; Y138-C142 PolarHBondContact O-SG 3.26Å; Y138-A176 HydrophobicContact CD1-CB 4.47Å; Y138-A176 HydrophobicContact CE1-CB 4.23Å; Y138-Q206 PolarHBondContact OH-NE2 3.26Å; Y138-V210 HydrophobicContact CD2-CG2 4.31Å; Y138-V210 HydrophobicContact CE2-CG2 3.74Å; Y138-Q213 PolarHBondContact OH-NE2 2.89Å; Y138-Q213 PolarHBondContact OH-OE1 2.79Å; Y138-Y247 HydrophobicContact CE2-CD1 4.37Å; Y138-Y247 HydrophobicContact CE2-CE1 4.04Å; Y138-C250 HydrophobicContact CD2-CB 4.21Å |
| 139 | V | 95.6 | Very high | 96.5 | Very high | 31 Ų | 31 | 41.2 Ų | 41.2 | 19% | 0.188 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63 | -41.6 | 175.1 | 175.3 | 0 | 0 | 0 | 0 | 111.7 | W135 C136 I137 V141 C142 F143 T173 | W135-V139 HydrophobicContact CD2-CG2 4.32Å; W135-V139 HydrophobicContact CZ2-CG2 3.96Å; W135-V139 WeakPolarHBondContact O-CG2 3.5Å; W135-V139 PolarHBondContact O-N 2.94Å; C136-V139 PolarHBondContact O-N 3.19Å; I137-V139 VanDerWaalsContact C-N 3.33Å; I137-V139 PolarHBondContact O-N 2.97Å; V139-V141 VanDerWaalsContact C-N 3.33Å; V139-V141 PolarHBondContact O-N 3.1Å; V139-C142 WeakPolarHBondContact O-CB 3.37Å; V139-C142 PolarHBondContact O-N 2.78Å; V139-F143 PolarHBondContact O-N 2.94Å; V139-T173 HydrophobicContact CG1-CG2 3.99Å; V139-T173 HydrophobicContact CG2-CG2 3.67Å |
| 140 | L | 96.2 | Very high | 96.6 | Very high | 117 Ų | 117 | 40.5 Ų | 40.5 | 61% | 0.613 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -62.2 | -40.4 | 175.4 | -69.2 | 173.6 | 0 | 0 | 0 | 112 | C136 I137 Y138 F143 A144 | C136-L140 WeakPolarHBondContact O-CG 3.38Å; C136-L140 PolarHBondContact O-N 3.19Å; I137-L140 WeakPolarHBondContact O-CB 3.4Å; I137-L140 PolarHBondContact O-N 2.91Å; I137-L140 VanDerWaalsContact O-N 3.16Å; Y138-L140 PolarHBondContact O-N 3.35Å; L140-F143 PolarHBondContact O-N 3.26Å; L140-A144 WeakPolarHBondContact O-CB 3.46Å; L140-A144 PolarHBondContact O-N 2.66Å |
| 141 | V | 96.7 | Very high | 96.6 | Very high | 15 Ų | 15 | 37.8 Ų | 37.8 | 9% | 0.091 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.6 | -40.6 | 175.3 | 174.8 | 0 | 0 | 0 | 0 | 110.9 | I137 Y138 V139 F143 A144 N145 V243 Y247 | I137-V141 HydrophobicContact CG2-CG2 4.35Å; I137-V141 WeakPolarHBondContact O-CG2 3.33Å; I137-V141 PolarHBondContact O-N 3.19Å; Y138-V141 PolarHBondContact O-N 3.3Å; V139-V141 VanDerWaalsContact C-N 3.33Å; V139-V141 PolarHBondContact O-N 3.1Å; V141-F143 VanDerWaalsContact C-N 3.29Å; V141-F143 PolarHBondContact O-N 3.37Å; V141-A144 CarbonylContact O-C 3.52Å; V141-A144 PolarHBondContact O-N 3.34Å; V141-N145 WeakPolarHBondContact O-CB 3.43Å; V141-N145 PolarHBondContact O-N 3.35Å; V141-V243 HydrophobicContact CG1-CG1 4.45Å; V141-Y247 HydrophobicContact CG1-CD1 3.59Å; V141-Y247 HydrophobicContact CG1-CD2 3.84Å; V141-Y247 HydrophobicContact CG1-CE1 3.67Å; V141-Y247 HydrophobicContact CG1-CE2 3.95Å; V141-Y247 HydrophobicContact CG1-CG 3.65Å |
| 142 | C | 94.6 | Very high | 96.6 | Very high | 2 Ų | 2 | 39.4 Ų | 39.4 | 1% | 0.014 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.6 | -38.8 | 172.2 | -75.7 | 0 | 0 | 0 | 0 | 112.4 | Y138 V139 N145 I169 | Y138-C142 PolarHBondContact O-N 3.32Å; Y138-C142 PolarHBondContact O-SG 3.26Å; V139-C142 WeakPolarHBondContact O-CB 3.37Å; V139-C142 PolarHBondContact O-N 2.78Å; C142-N145 WeakPolarHBondContact O-CB 3.41Å; C142-N145 PolarHBondContact O-N 2.84Å; C142-I169 HydrophobicContact CB-CG1 4.37Å |
| 143 | F | 95.5 | Very high | 96.6 | Very high | 118 Ų | 118 | 41.7 Ų | 41.7 | 52% | 0.518 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -67.2 | -45 | 173.9 | -176.2 | -97.6 | 0 | 0 | 0 | 111.8 | V139 L140 V141 N145 I146 I147 I169 | V139-F143 PolarHBondContact O-N 2.94Å; L140-F143 PolarHBondContact O-N 3.26Å; V141-F143 VanDerWaalsContact C-N 3.29Å; V141-F143 PolarHBondContact O-N 3.37Å; F143-N145 PolarHBondContact O-N 3.19Å; F143-I146 HydrophobicContact CD2-CD1 4.49Å; F143-I146 WeakPolarHBondContact O-CB 3.23Å; F143-I146 PolarHBondContact O-N 2.51Å; F143-I147 HydrophobicContact CD1-CD1 4.36Å; F143-I147 HydrophobicContact CE1-CD1 4Å; F143-I169 HydrophobicContact CB-CD1 3.88Å; F143-I169 HydrophobicContact CD2-CD1 4.04Å; F143-I169 HydrophobicContact CG-CD1 4.49Å |
| 144 | A | 96.7 | Very high | 96.6 | Very high | 34 Ų | 34 | 42.4 Ų | 42.4 | 28% | 0.281 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -60 | -32.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L140 V141 I146 I147 G148 V243 | L140-A144 WeakPolarHBondContact O-CB 3.46Å; L140-A144 PolarHBondContact O-N 2.66Å; V141-A144 CarbonylContact O-C 3.52Å; V141-A144 PolarHBondContact O-N 3.34Å; A144-I146 VanDerWaalsContact C-N 3.25Å; A144-I146 PolarHBondContact O-N 3.36Å; A144-I147 WeakPolarHBondContact O-CB 3.39Å; A144-I147 PolarHBondContact O-N 2.96Å; A144-I147 VanDerWaalsContact O-N 3.1Å; A144-G148 PolarHBondContact O-N 2.88Å; A144-V243 HydrophobicContact CB-CG2 4.01Å; A144-V243 VanDerWaalsContact O-CG2 3.31Å; A144-V243 WeakPolarHBondContact O-CG2 3.19Å |
| 145 | N | 96.6 | Very high | 96.5 | Very high | 1 Ų | 1 | 43.5 Ų | 43.5 | 1% | 0.005 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63 | -28.6 | 174.7 | -174.4 | 57.6 | 0 | 0 | 0 | 113.1 | V141 C142 F143 S149 N220 C221 V243 Y247 | V141-N145 WeakPolarHBondContact O-CB 3.43Å; V141-N145 PolarHBondContact O-N 3.35Å; C142-N145 WeakPolarHBondContact O-CB 3.41Å; C142-N145 PolarHBondContact O-N 2.84Å; F143-N145 PolarHBondContact O-N 3.19Å; N145-S149 WeakPolarHBondContact O-CB 3.45Å; N145-S149 PolarHBondContact O-N 2.98Å; N145-S149 PolarHBondContact O-OG 3.23Å; N145-N220 PolarHBondContact ND2-OD1 3.45Å; N145-C221 PolarHBondContact OD1-N 3.44Å; N145-C221 PolarHBondContact OD1-SG 2.96Å; N145-V243 HydrophobicContact CB-CG1 3.66Å; N145-Y247 HydrophobicContact CB-CE2 3.99Å; N145-Y247 WeakPolarHBondContact CB-OH 3.39Å |
| 146 | I | 96.7 | Very high | 96.4 | Very high | 29 Ų | 29 | 44.4 Ų | 44.4 | 15% | 0.149 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -66.6 | -45.2 | 171.7 | -58.4 | 172.7 | 0 | 0 | 0 | 109.9 | F143 A144 S149 L150 F162 I166 I169 | F143-I146 HydrophobicContact CD2-CD1 4.49Å; F143-I146 WeakPolarHBondContact O-CB 3.23Å; F143-I146 PolarHBondContact O-N 2.51Å; A144-I146 VanDerWaalsContact C-N 3.25Å; A144-I146 PolarHBondContact O-N 3.36Å; I146-S149 PolarHBondContact O-N 3.01Å; I146-L150 VanDerWaalsContact O-CB 3.3Å; I146-L150 WeakPolarHBondContact O-CB 3.37Å; I146-L150 PolarHBondContact O-N 2.94Å; I146-F162 HydrophobicContact CG2-CD2 4.43Å; I146-F162 HydrophobicContact CG2-CE2 3.82Å; I146-I166 HydrophobicContact CG2-CG1 4.28Å; I146-I169 HydrophobicContact CD1-CB 4.25Å; I146-I169 HydrophobicContact CD1-CD1 4.16Å; I146-I169 HydrophobicContact CD1-CG2 3.72Å |
| 147 | I | 97.4 | Very high | 96.2 | Very high | 90 Ų | 90 | 43.1 Ų | 43.1 | 46% | 0.462 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -63.6 | -46.4 | 178 | -56.4 | 173.9 | 0 | 0 | 0 | 110.3 | F143 A144 L150 A151 V239 | F143-I147 HydrophobicContact CD1-CD1 4.36Å; F143-I147 HydrophobicContact CE1-CD1 4Å; A144-I147 WeakPolarHBondContact O-CB 3.39Å; A144-I147 PolarHBondContact O-N 2.96Å; A144-I147 VanDerWaalsContact O-N 3.1Å; I147-L150 PolarHBondContact O-N 3.26Å; I147-A151 WeakPolarHBondContact O-CB 3.23Å; I147-A151 PolarHBondContact O-N 3.45Å; I147-V239 HydrophobicContact CG2-CG1 4.21Å |
| 148 | G | 97.4 | Very high | 95.9 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.8 | -39.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A144 A151 Y152 | A144-G148 PolarHBondContact O-N 2.88Å; G148-A151 PolarHBondContact O-N 3.38Å; G148-Y152 WeakPolarHBondContact O-CB 3.45Å; G148-Y152 PolarHBondContact O-N 3.26Å |
| 149 | S | 97 | Very high | 95.8 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -71.4 | -31.8 | 176.9 | -60.9 | 0 | 0 | 0 | 0 | 112.4 | N145 I146 F153 | N145-S149 WeakPolarHBondContact O-CB 3.45Å; N145-S149 PolarHBondContact O-N 2.98Å; N145-S149 PolarHBondContact O-OG 3.23Å; I146-S149 PolarHBondContact O-N 3.01Å; S149-F153 WeakPolarHBondContact O-CB 3.37Å; S149-F153 PolarHBondContact O-N 3.3Å |
| 150 | L | 97.3 | Very high | 95.8 | Very high | 73 Ų | 73 | 47.2 Ų | 47.2 | 38% | 0.382 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -66.2 | -46.6 | 170.8 | -180 | 61.4 | 0 | 0 | 0 | 110.6 | I146 I147 Y152 F153 V154 F162 | I146-L150 VanDerWaalsContact O-CB 3.3Å; I146-L150 WeakPolarHBondContact O-CB 3.37Å; I146-L150 PolarHBondContact O-N 2.94Å; I147-L150 PolarHBondContact O-N 3.26Å; L150-Y152 VanDerWaalsContact C-N 3.3Å; L150-Y152 PolarHBondContact O-N 3.45Å; L150-F153 HydrophobicContact CD1-CD1 4.48Å; L150-F153 PolarHBondContact O-N 3.34Å; L150-F153 VanDerWaalsContact O-N 3.15Å; L150-V154 HydrophobicContact CD1-CG1 4.04Å; L150-V154 HydrophobicContact CG-CG1 4.47Å; L150-V154 WeakPolarHBondContact O-CG1 3.35Å; L150-V154 WeakPolarHBondContact O-CG2 3.43Å; L150-V154 PolarHBondContact O-N 3.44Å; L150-F162 HydrophobicContact CB-CD2 3.85Å; L150-F162 HydrophobicContact CB-CE2 3.76Å; L150-F162 HydrophobicContact CD1-CD2 4.28Å; L150-F162 HydrophobicContact CD1-CE1 4.41Å; L150-F162 HydrophobicContact CD1-CE2 3.95Å; L150-F162 HydrophobicContact CD1-CZ 4.01Å; L150-F162 HydrophobicContact CG-CE2 4.32Å |
| 151 | A | 96.9 | Very high | 95.7 | Very high | 18 Ų | 18 | 41.8 Ų | 41.8 | 15% | 0.149 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.6 | -43.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | I147 G148 V154 T155 A236 V239 | I147-A151 WeakPolarHBondContact O-CB 3.23Å; I147-A151 PolarHBondContact O-N 3.45Å; G148-A151 PolarHBondContact O-N 3.38Å; A151-V154 WeakPolarHBondContact O-CG2 3.33Å; A151-T155 WeakPolarHBondContact O-CB 3.42Å; A151-T155 WeakPolarHBondContact O-CG2 3.24Å; A151-T155 PolarHBondContact O-N 3.33Å; A151-T155 PolarHBondContact O-OG1 2.86Å; A151-A236 HydrophobicContact CB-CB 4.07Å; A151-V239 HydrophobicContact CB-CB 4.49Å |
| 152 | Y | 96.5 | Very high | 95.6 | Very high | 34 Ų | 34 | 43.4 Ų | 43.4 | 13% | 0.133 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.3 | -50.1 | 172.5 | -177.7 | -123.7 | 0 | 0 | 0 | 111.3 | G148 L150 T155 G156 G157 Q161 H229 M240 | G148-Y152 WeakPolarHBondContact O-CB 3.45Å; G148-Y152 PolarHBondContact O-N 3.26Å; L150-Y152 VanDerWaalsContact C-N 3.3Å; L150-Y152 PolarHBondContact O-N 3.45Å; Y152-T155 PolarHBondContact O-N 3.49Å; Y152-T155 PolarHBondContact O-OG1 2.73Å; Y152-G156 PolarHBondContact O-N 2.9Å; Y152-G157 VanDerWaalsContact CZ-CA 3.42Å; Y152-G157 VanDerWaalsContact O-CA 3.24Å; Y152-G157 WeakPolarHBondContact O-CA 3.46Å; Y152-G157 PolarHBondContact O-N 3.49Å; Y152-Q161 HydrophobicContact CD1-CB 4.41Å; Y152-Q161 HydrophobicContact CD1-CG 4.28Å; Y152-H229 HydrophobicContact CD2-CB 4.45Å; Y152-H229 AromaticContact CD2-CE1 3.7Å; Y152-H229 AromaticContact CD2-CG 3.83Å; Y152-H229 AromaticContact CD2-ND1 3.6Å; Y152-H229 AromaticContact CD2-NE2 3.99Å; Y152-H229 HydrophobicContact CE2-CB 4.42Å; Y152-H229 AromaticContact CE2-CE1 3.94Å; Y152-H229 AromaticContact CE2-ND1 3.51Å; Y152-M240 HydrophobicContact CD2-CE 3.67Å; Y152-M240 HydrophobicContact CD2-SD 3.73Å; Y152-M240 HydrophobicContact CE2-CE 4.28Å; Y152-M240 HydrophobicContact CG-CE 3.93Å; Y152-M240 HydrophobicContact CG-SD 4.07Å |
| 153 | F | 96.5 | Very high | 95.6 | Very high | 86 Ų | 86 | 44.8 Ų | 44.8 | 38% | 0.377 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.7 | -49.5 | -179.1 | 174.5 | -141.9 | 0 | 0 | 0 | 113 | S149 L150 T155 G156 A159 F162 | S149-F153 WeakPolarHBondContact O-CB 3.37Å; S149-F153 PolarHBondContact O-N 3.3Å; L150-F153 HydrophobicContact CD1-CD1 4.48Å; L150-F153 PolarHBondContact O-N 3.34Å; L150-F153 VanDerWaalsContact O-N 3.15Å; F153-T155 PolarHBondContact O-N 3.27Å; F153-T155 VanDerWaalsContact O-N 3.17Å; F153-G156 PolarHBondContact O-N 3.11Å; F153-G156 VanDerWaalsContact O-N 3.14Å; F153-A159 HydrophobicContact CD2-CB 3.75Å; F153-A159 HydrophobicContact CE1-CB 4.45Å; F153-A159 HydrophobicContact CE2-CB 3.44Å; F153-A159 VanDerWaalsContact CE2-CB 3.44Å; F153-A159 HydrophobicContact CG-CB 4.41Å; F153-A159 HydrophobicContact CZ-CB 3.83Å; F153-F162 HydrophobicContact CB-CB 4.12Å; F153-F162 HydrophobicContact CD1-CB 4.34Å; F153-F162 HydrophobicContact CD1-CD1 4.06Å; F153-F162 HydrophobicContact CD1-CG 4.34Å; F153-F162 HydrophobicContact CG-CB 4.45Å |
| 154 | V | 96.7 | Very high | 95.6 | Very high | 105 Ų | 105 | 41.7 Ų | 41.7 | 64% | 0.636 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -68.5 | -16.2 | -178.2 | -57.8 | 0 | 0 | 0 | 0 | 113.4 | L150 A151 | L150-V154 HydrophobicContact CD1-CG1 4.04Å; L150-V154 HydrophobicContact CG-CG1 4.47Å; L150-V154 WeakPolarHBondContact O-CG1 3.35Å; L150-V154 WeakPolarHBondContact O-CG2 3.43Å; L150-V154 PolarHBondContact O-N 3.44Å; A151-V154 WeakPolarHBondContact O-CG2 3.33Å |
| 155 | T | 96.8 | Very high | 95.5 | Very high | 35 Ų | 35 | 40.1 Ų | 40.1 | 22% | 0.215 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -103.1 | 20.5 | 176.9 | 56.3 | 0 | 0 | 0 | 0 | 113.1 | A151 Y152 F153 H229 N233 A236 | A151-T155 WeakPolarHBondContact O-CB 3.42Å; A151-T155 WeakPolarHBondContact O-CG2 3.24Å; A151-T155 PolarHBondContact O-N 3.33Å; A151-T155 PolarHBondContact O-OG1 2.86Å; Y152-T155 PolarHBondContact O-N 3.49Å; Y152-T155 PolarHBondContact O-OG1 2.73Å; F153-T155 PolarHBondContact O-N 3.27Å; F153-T155 VanDerWaalsContact O-N 3.17Å; T155-H229 PolarHBondContact OG1-CE1 2.85Å; T155-H229 PolarHBondContact OG1-NE2 3.22Å; T155-N233 HydrophobicContact CG2-CB 4.05Å; T155-N233 WeakPolarHBondContact CG2-ND2 3.44Å; T155-A236 HydrophobicContact CG2-CB 3.84Å; T155-A236 WeakPolarHBondContact OG1-CB 3.36Å |
| 156 | G | 92.8 | Very high | 95.4 | Very high | 44 Ų | 44 | 43.6 Ų | 43.6 | 45% | 0.454 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 95.3 | 10.6 | 172 | 0 | 0 | 0 | 0 | 0 | 115.1 | Y152 F153 R232 | Y152-G156 PolarHBondContact O-N 2.9Å; F153-G156 PolarHBondContact O-N 3.11Å; F153-G156 VanDerWaalsContact O-N 3.14Å; G156-R232 PolarHBondContact O-NH1 3.03Å |
| 157 | G | 91.8 | Very high | 95.2 | Very high | 13 Ų | 13 | 47 Ų | 47 | 13% | 0.134 | 28% | 0.281 | C | S | . | . | trans | -78.5 | -177.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y152 A159 | Y152-G157 VanDerWaalsContact CZ-CA 3.42Å; Y152-G157 VanDerWaalsContact O-CA 3.24Å; Y152-G157 WeakPolarHBondContact O-CA 3.46Å; Y152-G157 PolarHBondContact O-N 3.49Å; G157-A159 PolarHBondContact O-N 3.1Å | ||
| 158 | S | 91.7 | Very high | 95 | Very high | 44 Ų | 44 | 44.2 Ų | 44.2 | 31% | 0.308 | 27% | 0.266 | S | S | . | . | trans | -74.2 | 124.1 | -174.9 | -179.4 | 0 | 0 | 0 | 0 | 113.1 | V160 Q161 | S158-V160 PolarHBondContact O-N 3.18Å; S158-V160 WeakPolarHBondContact OG-CB 3.5Å; S158-V160 PolarHBondContact OG-N 3.46Å; S158-Q161 WeakPolarHBondContact O-CB 3.26Å; S158-Q161 PolarHBondContact O-N 3.48Å | ||
| 159 | A | 93.9 | Very high | 94.7 | Very high | 49 Ų | 49 | 45.8 Ų | 45.8 | 41% | 0.405 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -61.8 | -30 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | F153 G157 Q161 F162 G163 | F153-A159 HydrophobicContact CD2-CB 3.75Å; F153-A159 HydrophobicContact CE1-CB 4.45Å; F153-A159 HydrophobicContact CE2-CB 3.44Å; F153-A159 VanDerWaalsContact CE2-CB 3.44Å; F153-A159 HydrophobicContact CG-CB 4.41Å; F153-A159 HydrophobicContact CZ-CB 3.83Å; G157-A159 PolarHBondContact O-N 3.1Å; A159-Q161 VanDerWaalsContact C-N 3.29Å; A159-Q161 PolarHBondContact O-N 3.26Å; A159-F162 PolarHBondContact O-N 3.2Å; A159-G163 PolarHBondContact O-N 3.15Å |
| 160 | V | 95.3 | Very high | 94.5 | Very high | 84 Ų | 84 | 49.9 Ų | 49.9 | 51% | 0.509 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 178.5 | 178.4 | 0 | 0 | 0 | 0 | 110.5 | S158 G163 L164 | S158-V160 PolarHBondContact O-N 3.18Å; S158-V160 WeakPolarHBondContact OG-CB 3.5Å; S158-V160 PolarHBondContact OG-N 3.46Å; V160-G163 PolarHBondContact O-N 2.88Å; V160-L164 HydrophobicContact CG1-CD1 3.8Å; V160-L164 HydrophobicContact CG1-CG 4.17Å; V160-L164 WeakPolarHBondContact O-CB 3.48Å; V160-L164 VanDerWaalsContact O-CG 3.3Å; V160-L164 WeakPolarHBondContact O-CG 3.29Å; V160-L164 PolarHBondContact O-N 2.89Å |
| 161 | Q | 94.6 | Very high | 94.2 | Very high | 4 Ų | 4 | 50.5 Ų | 50.5 | 2% | 0.019 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 175.4 | 170.8 | 165.9 | -24.3 | 0 | 0 | 111.9 | Y152 S158 A159 L164 S165 Y219 N220 | Y152-Q161 HydrophobicContact CD1-CB 4.41Å; Y152-Q161 HydrophobicContact CD1-CG 4.28Å; S158-Q161 WeakPolarHBondContact O-CB 3.26Å; S158-Q161 PolarHBondContact O-N 3.48Å; A159-Q161 VanDerWaalsContact C-N 3.29Å; A159-Q161 PolarHBondContact O-N 3.26Å; Q161-L164 PolarHBondContact O-N 3.47Å; Q161-S165 WeakPolarHBondContact O-CB 3.46Å; Q161-S165 PolarHBondContact O-N 3.37Å; Q161-Y219 WeakPolarHBondContact CG-O 3.31Å; Q161-N220 PolarHBondContact NE2-O 3.37Å |
| 162 | F | 95.9 | Very high | 93.8 | Very high | 48 Ų | 48 | 51.2 Ų | 51.2 | 21% | 0.211 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.5 | -49.5 | 174 | 174.9 | -115.7 | 0 | 0 | 0 | 111.9 | I146 L150 F153 A159 L164 S165 I166 | I146-F162 HydrophobicContact CG2-CD2 4.43Å; I146-F162 HydrophobicContact CG2-CE2 3.82Å; L150-F162 HydrophobicContact CB-CD2 3.85Å; L150-F162 HydrophobicContact CB-CE2 3.76Å; L150-F162 HydrophobicContact CD1-CD2 4.28Å; L150-F162 HydrophobicContact CD1-CE1 4.41Å; L150-F162 HydrophobicContact CD1-CE2 3.95Å; L150-F162 HydrophobicContact CD1-CZ 4.01Å; L150-F162 HydrophobicContact CG-CE2 4.32Å; F153-F162 HydrophobicContact CB-CB 4.12Å; F153-F162 HydrophobicContact CD1-CB 4.34Å; F153-F162 HydrophobicContact CD1-CD1 4.06Å; F153-F162 HydrophobicContact CD1-CG 4.34Å; F153-F162 HydrophobicContact CG-CB 4.45Å; A159-F162 PolarHBondContact O-N 3.2Å; F162-L164 PolarHBondContact O-N 2.88Å; F162-S165 PolarHBondContact O-N 3.49Å; F162-S165 PolarHBondContact O-OG 3.13Å; F162-I166 HydrophobicContact CE1-CD1 4.09Å; F162-I166 HydrophobicContact CE2-CD1 4.22Å; F162-I166 HydrophobicContact CZ-CD1 3.84Å; F162-I166 PolarHBondContact O-N 2.95Å |
| 163 | G | 94.5 | Very high | 93.4 | Very high | 32 Ų | 32 | 50.9 Ų | 50.9 | 33% | 0.33 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.1 | -43.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | A159 V160 S165 I166 I167 | A159-G163 PolarHBondContact O-N 3.15Å; V160-G163 PolarHBondContact O-N 2.88Å; G163-S165 VanDerWaalsContact C-N 3.34Å; G163-S165 PolarHBondContact O-N 2.88Å; G163-I166 PolarHBondContact O-N 3.41Å; G163-I167 PolarHBondContact O-N 3.35Å |
| 164 | L | 94.1 | Very high | 93.1 | Very high | 53 Ų | 53 | 49.9 Ų | 49.9 | 28% | 0.277 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -66.9 | -33.1 | 177.6 | -73.4 | 175.5 | 0 | 0 | 0 | 112.6 | V160 Q161 F162 I166 I167 Q168 Y219 | V160-L164 HydrophobicContact CG1-CD1 3.8Å; V160-L164 HydrophobicContact CG1-CG 4.17Å; V160-L164 WeakPolarHBondContact O-CB 3.48Å; V160-L164 VanDerWaalsContact O-CG 3.3Å; V160-L164 WeakPolarHBondContact O-CG 3.29Å; V160-L164 PolarHBondContact O-N 2.89Å; Q161-L164 PolarHBondContact O-N 3.47Å; F162-L164 PolarHBondContact O-N 2.88Å; L164-I166 VanDerWaalsContact C-N 3.26Å; L164-I166 PolarHBondContact O-N 2.86Å; L164-I167 HydrophobicContact CD2-CD1 4.48Å; L164-I167 PolarHBondContact O-N 2.86Å; L164-Q168 VanDerWaalsContact O-CB 3.27Å; L164-Q168 WeakPolarHBondContact O-CB 3.27Å; L164-Q168 WeakPolarHBondContact O-CG 3.27Å; L164-Q168 PolarHBondContact O-N 3.03Å; L164-Y219 HydrophobicContact CD1-CD2 3.32Å; L164-Y219 HydrophobicContact CD1-CE2 4.03Å; L164-Y219 HydrophobicContact CD1-CG 3.64Å |
| 165 | S | 95.5 | Very high | 92.8 | Very high | 1 Ų | 1 | 47.1 Ų | 47.1 | 1% | 0.007 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -60.8 | -35.7 | 176.2 | 75.2 | 0 | 0 | 0 | 0 | 112.4 | Q161 F162 G163 I169 | Q161-S165 WeakPolarHBondContact O-CB 3.46Å; Q161-S165 PolarHBondContact O-N 3.37Å; F162-S165 PolarHBondContact O-N 3.49Å; F162-S165 PolarHBondContact O-OG 3.13Å; G163-S165 VanDerWaalsContact C-N 3.34Å; G163-S165 PolarHBondContact O-N 2.88Å; S165-I169 PolarHBondContact O-N 3.49Å; S165-I169 VanDerWaalsContact O-N 3.13Å |
| 166 | I | 94.5 | Very high | 92.5 | Very high | 73 Ų | 73 | 45.4 Ų | 45.4 | 37% | 0.374 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -70.5 | -45.6 | 176.3 | -59.3 | 171 | 0 | 0 | 0 | 110.5 | I146 F162 G163 L164 Q168 I169 C170 | I146-I166 HydrophobicContact CG2-CG1 4.28Å; F162-I166 HydrophobicContact CE1-CD1 4.09Å; F162-I166 HydrophobicContact CE2-CD1 4.22Å; F162-I166 HydrophobicContact CZ-CD1 3.84Å; F162-I166 PolarHBondContact O-N 2.95Å; G163-I166 PolarHBondContact O-N 3.41Å; L164-I166 VanDerWaalsContact C-N 3.26Å; L164-I166 PolarHBondContact O-N 2.86Å; I166-Q168 VanDerWaalsContact C-N 3.28Å; I166-Q168 PolarHBondContact O-N 3.37Å; I166-I169 WeakPolarHBondContact O-CG2 3.08Å; I166-I169 PolarHBondContact O-N 3.43Å; I166-C170 PolarHBondContact O-N 3.03Å; I166-C170 PolarHBondContact O-SG 3.08Å; I166-C170 VanDerWaalsContact O-SG 3.38Å |
| 167 | I | 93.4 | Very high | 92.5 | Very high | 101 Ų | 101 | 44.1 Ų | 44.1 | 52% | 0.518 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -63 | -40.6 | 177.2 | -63.9 | 170.3 | 0 | 0 | 0 | 110.3 | G163 L164 I169 C170 V171 | G163-I167 PolarHBondContact O-N 3.35Å; L164-I167 HydrophobicContact CD2-CD1 4.48Å; L164-I167 PolarHBondContact O-N 2.86Å; I167-I169 PolarHBondContact O-N 2.89Å; I167-C170 PolarHBondContact O-N 2.91Å; I167-V171 HydrophobicContact CG2-CG2 4.25Å; I167-V171 WeakPolarHBondContact O-CG2 3.28Å; I167-V171 PolarHBondContact O-N 3.35Å |
| 168 | Q | 91.8 | Very high | 92.5 | Very high | 32 Ų | 32 | 47.6 Ų | 47.6 | 15% | 0.15 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.4 | -45.4 | 178.3 | -80.1 | 175.1 | 9.8 | 0 | 0 | 111.9 | L164 I166 C170 V171 L172 A218 N220 | L164-Q168 VanDerWaalsContact O-CB 3.27Å; L164-Q168 WeakPolarHBondContact O-CB 3.27Å; L164-Q168 WeakPolarHBondContact O-CG 3.27Å; L164-Q168 PolarHBondContact O-N 3.03Å; I166-Q168 VanDerWaalsContact C-N 3.28Å; I166-Q168 PolarHBondContact O-N 3.37Å; Q168-C170 VanDerWaalsContact C-N 3.3Å; Q168-C170 PolarHBondContact O-N 2.8Å; Q168-V171 PolarHBondContact O-N 2.94Å; Q168-L172 HydrophobicContact CB-CD1 3.99Å; Q168-L172 HydrophobicContact CB-CG 4.45Å; Q168-L172 HydrophobicContact CG-CD1 4.05Å; Q168-L172 WeakPolarHBondContact O-CA 3.31Å; Q168-L172 WeakPolarHBondContact O-CB 3.44Å; Q168-L172 WeakPolarHBondContact O-CG 3.27Å; Q168-L172 PolarHBondContact O-N 2.84Å; Q168-A218 PolarHBondContact NE2-O 2.88Å; Q168-N220 PolarHBondContact NE2-ND2 3.44Å; Q168-N220 PolarHBondContact OE1-ND2 3.3Å; Q168-N220 PolarHBondContact OE1-OD1 3.02Å; Q168-N220 VanDerWaalsContact OE1-OD1 3.06Å |
| 169 | I | 92.3 | Very high | 92.5 | Very high | 32 Ų | 32 | 49.5 Ų | 49.5 | 16% | 0.164 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64.1 | -38.6 | 177.9 | -162.6 | 167.5 | 0 | 0 | 0 | 111.5 | C142 F143 I146 S165 I166 I167 V171 T173 | C142-I169 HydrophobicContact CB-CG1 4.37Å; F143-I169 HydrophobicContact CB-CD1 3.88Å; F143-I169 HydrophobicContact CD2-CD1 4.04Å; F143-I169 HydrophobicContact CG-CD1 4.49Å; I146-I169 HydrophobicContact CD1-CB 4.25Å; I146-I169 HydrophobicContact CD1-CD1 4.16Å; I146-I169 HydrophobicContact CD1-CG2 3.72Å; S165-I169 PolarHBondContact O-N 3.49Å; S165-I169 VanDerWaalsContact O-N 3.13Å; I166-I169 WeakPolarHBondContact O-CG2 3.08Å; I166-I169 PolarHBondContact O-N 3.43Å; I167-I169 PolarHBondContact O-N 2.89Å; I169-V171 PolarHBondContact O-N 3.49Å; I169-T173 WeakPolarHBondContact CG1-OG1 3.46Å; I169-T173 WeakPolarHBondContact O-CB 3.3Å; I169-T173 PolarHBondContact O-N 2.9Å; I169-T173 PolarHBondContact O-OG1 3.45Å |
| 170 | C | 91.7 | Very high | 92.4 | Very high | 86 Ų | 86 | 47.3 Ų | 47.3 | 58% | 0.581 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -67.3 | -36.2 | -179.5 | -69.1 | 0 | 0 | 0 | 0 | 112.7 | I166 I167 Q168 P174 | I166-C170 PolarHBondContact O-N 3.03Å; I166-C170 PolarHBondContact O-SG 3.08Å; I166-C170 VanDerWaalsContact O-SG 3.38Å; I167-C170 PolarHBondContact O-N 2.91Å; Q168-C170 VanDerWaalsContact C-N 3.3Å; Q168-C170 PolarHBondContact O-N 2.8Å; C170-P174 WeakPolarHBondContact O-CD 3.28Å; C170-P174 WeakPolarHBondContact O-CG 3.17Å |
| 171 | V | 91.2 | Very high | 92.4 | Very high | 86 Ų | 86 | 43.3 Ų | 43.3 | 52% | 0.521 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -94.1 | -50 | -177.5 | 177.8 | 0 | 0 | 0 | 0 | 112 | I167 Q168 I169 T173 P174 C175 | I167-V171 HydrophobicContact CG2-CG2 4.25Å; I167-V171 WeakPolarHBondContact O-CG2 3.28Å; I167-V171 PolarHBondContact O-N 3.35Å; Q168-V171 PolarHBondContact O-N 2.94Å; I169-V171 PolarHBondContact O-N 3.49Å; V171-T173 PolarHBondContact O-N 3Å; V171-P174 WeakPolarHBondContact O-CD 3.23Å; V171-P174 WeakPolarHBondContact O-CG 3.43Å; V171-C175 WeakPolarHBondContact O-CB 3.48Å; V171-C175 PolarHBondContact O-N 2.95Å; V171-C175 VanDerWaalsContact O-N 3.1Å |
| 172 | L | 88.7 | Confident | 92.3 | Very high | 33 Ų | 33 | 44.3 Ų | 44.3 | 17% | 0.173 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -70 | -31.4 | -174.3 | -63.5 | 178.7 | 0 | 0 | 0 | 112.3 | Q168 A176 | Q168-L172 HydrophobicContact CB-CD1 3.99Å; Q168-L172 HydrophobicContact CB-CG 4.45Å; Q168-L172 HydrophobicContact CG-CD1 4.05Å; Q168-L172 WeakPolarHBondContact O-CA 3.31Å; Q168-L172 WeakPolarHBondContact O-CB 3.44Å; Q168-L172 WeakPolarHBondContact O-CG 3.27Å; Q168-L172 PolarHBondContact O-N 2.84Å; L172-A176 WeakPolarHBondContact O-CA 3.27Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 3.08Å |
| 173 | T | 88.9 | Confident | 92.2 | Very high | 27 Ų | 27 | 42.7 Ų | 42.7 | 17% | 0.166 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.6 | -55.4 | 178.8 | -58 | 0 | 0 | 0 | 0 | 112.8 | W135 V139 I169 V171 F177 | W135-T173 HydrophobicContact CZ2-CG2 4.15Å; V139-T173 HydrophobicContact CG1-CG2 3.99Å; V139-T173 HydrophobicContact CG2-CG2 3.67Å; I169-T173 WeakPolarHBondContact CG1-OG1 3.46Å; I169-T173 WeakPolarHBondContact O-CB 3.3Å; I169-T173 PolarHBondContact O-N 2.9Å; I169-T173 PolarHBondContact O-OG1 3.45Å; V171-T173 PolarHBondContact O-N 3Å; T173-F177 PolarHBondContact O-N 3.47Å; T173-F177 VanDerWaalsContact O-N 3.12Å |
| 174 | P | 89.7 | Confident | 92.3 | Very high | 65 Ų | 65 | 41.1 Ų | 41.1 | 42% | 0.422 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -67.6 | -38.8 | 176.7 | 25.8 | -33.8 | 0 | 0 | 0 | 111.9 | C170 V171 A176 F177 V178 | C170-P174 WeakPolarHBondContact O-CD 3.28Å; C170-P174 WeakPolarHBondContact O-CG 3.17Å; V171-P174 WeakPolarHBondContact O-CD 3.23Å; V171-P174 WeakPolarHBondContact O-CG 3.43Å; P174-A176 PolarHBondContact O-N 3.1Å; P174-F177 PolarHBondContact O-N 3.41Å; P174-V178 WeakPolarHBondContact O-CB 3.16Å; P174-V178 WeakPolarHBondContact O-CG2 3.27Å; P174-V178 PolarHBondContact O-N 2.84Å |
| 175 | C | 90.2 | Very high | 92.3 | Very high | 47 Ų | 47 | 38.8 Ų | 38.8 | 32% | 0.318 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -60.6 | -45.7 | 177.3 | -175.6 | 0 | 0 | 0 | 0 | 111.3 | V171 F177 V178 L179 | V171-C175 WeakPolarHBondContact O-CB 3.48Å; V171-C175 PolarHBondContact O-N 2.95Å; V171-C175 VanDerWaalsContact O-N 3.1Å; C175-F177 VanDerWaalsContact C-N 3.34Å; C175-F177 PolarHBondContact O-N 3.27Å; C175-V178 PolarHBondContact O-N 3.39Å; C175-L179 WeakPolarHBondContact O-CB 3.38Å; C175-L179 WeakPolarHBondContact O-CG 3.01Å; C175-L179 PolarHBondContact O-N 2.91Å; C175-L179 WeakPolarHBondContact SG-CD1 3.38Å |
| 176 | A | 90.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -56.7 | -48.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y138 L172 P174 V178 W180 Y181 | Y138-A176 HydrophobicContact CD1-CB 4.47Å; Y138-A176 HydrophobicContact CE1-CB 4.23Å; L172-A176 WeakPolarHBondContact O-CA 3.27Å; L172-A176 WeakPolarHBondContact O-CB 3.39Å; L172-A176 PolarHBondContact O-N 3.08Å; P174-A176 PolarHBondContact O-N 3.1Å; A176-V178 PolarHBondContact O-N 3.25Å; A176-W180 PolarHBondContact O-N 2.79Å; A176-W180 VanDerWaalsContact O-N 3.12Å; A176-W180 PolarHBondContact O-NE1 3.45Å; A176-W180 VanDerWaalsContact O-NE1 3.13Å; A176-Y181 PolarHBondContact O-N 3.1Å |
| 177 | F | 92.2 | Very high | 92 | Very high | 16 Ų | 16 | 40.1 Ų | 40.1 | 7% | 0.07 | 22% | 0.224 | C | C | . | . | I | π-helix | trans | -60.9 | -48 | -179.8 | -175 | -104.4 | 0 | 0 | 0 | 112.1 | W99 L112 W135 T173 P174 C175 Y181 R182 | W99-F177 AromaticContact CD1-CE1 3.88Å; W99-F177 AromaticContact CD1-CZ 3.42Å; W99-F177 VanDerWaalsContact CD1-CZ 3.42Å; W99-F177 HydrophobicContact CG-CZ 4.45Å; W99-F177 HydrophobicContact CZ2-CE2 4.44Å; W99-F177 AromaticContact NE1-CE1 3.7Å; W99-F177 AromaticContact NE1-CE2 3.43Å; W99-F177 AromaticContact NE1-CZ 3.08Å; L112-F177 HydrophobicContact CD1-CE1 3.99Å; W135-F177 HydrophobicContact CD2-CD2 4.1Å; W135-F177 AromaticContact CE2-CD2 3.77Å; W135-F177 HydrophobicContact CE3-CD2 4.28Å; W135-F177 AromaticContact CH2-CD2 3.89Å; W135-F177 HydrophobicContact CH2-CD2 3.89Å; W135-F177 HydrophobicContact CZ2-CB 3.7Å; W135-F177 AromaticContact CZ2-CD2 3.67Å; W135-F177 HydrophobicContact CZ2-CD2 3.67Å; W135-F177 HydrophobicContact CZ2-CG 4.03Å; W135-F177 HydrophobicContact CZ3-CD2 4.18Å; T173-F177 PolarHBondContact O-N 3.47Å; T173-F177 VanDerWaalsContact O-N 3.12Å; P174-F177 PolarHBondContact O-N 3.41Å; C175-F177 VanDerWaalsContact C-N 3.34Å; C175-F177 PolarHBondContact O-N 3.27Å; F177-Y181 AromaticContact CD2-CD1 3.67Å; F177-Y181 HydrophobicContact CD2-CD1 3.67Å; F177-Y181 HydrophobicContact CD2-CE1 4.46Å; F177-Y181 HydrophobicContact CD2-CG 4.4Å; F177-Y181 AromaticContact CE2-CD1 3.4Å; F177-Y181 HydrophobicContact CE2-CD1 3.4Å; F177-Y181 VanDerWaalsContact CE2-CD1 3.4Å; F177-Y181 AromaticContact CE2-CE1 3.78Å; F177-Y181 HydrophobicContact CE2-CE1 3.78Å; F177-Y181 HydrophobicContact CE2-CG 4.49Å; F177-Y181 HydrophobicContact CZ-CD1 4.21Å; F177-Y181 HydrophobicContact CZ-CE1 4.46Å; F177-R182 HydrophobicContact CD1-CG 4.03Å; F177-R182 HydrophobicContact CE1-CG 3.79Å; F177-R182 HydrophobicContact CZ-CG 4.19Å; F177-R182 WeakPolarHBondContact O-CB 3.31Å; F177-R182 VanDerWaalsContact O-CG 3.27Å; F177-R182 WeakPolarHBondContact O-CG 3.25Å; F177-R182 PolarHBondContact O-N 3.39Å |
| 178 | V | 91.3 | Very high | 92 | Very high | 86 Ų | 86 | 35.5 Ų | 35.5 | 52% | 0.521 | 20% | 0.2 | S | C | . | . | I | π-helix | trans | -76.5 | -40.5 | -174.2 | 175.5 | 0 | 0 | 0 | 0 | 112.3 | P174 C175 A176 P183 | P174-V178 WeakPolarHBondContact O-CB 3.16Å; P174-V178 WeakPolarHBondContact O-CG2 3.27Å; P174-V178 PolarHBondContact O-N 2.84Å; C175-V178 PolarHBondContact O-N 3.39Å; A176-V178 PolarHBondContact O-N 3.25Å; V178-P183 VanDerWaalsContact O-CD 3.26Å; V178-P183 WeakPolarHBondContact O-CD 3.37Å |
| 179 | L | 91.9 | Very high | 91.9 | Very high | 84 Ų | 84 | 36.2 Ų | 36.2 | 44% | 0.44 | 20% | 0.202 | S | C | . | . | I | π-helix | trans | -87.3 | -33.2 | -171.6 | -62 | -170.1 | 0 | 0 | 0 | 112.9 | C175 P183 V202 | C175-L179 WeakPolarHBondContact O-CB 3.38Å; C175-L179 WeakPolarHBondContact O-CG 3.01Å; C175-L179 PolarHBondContact O-N 2.91Å; C175-L179 WeakPolarHBondContact SG-CD1 3.38Å; L179-P183 WeakPolarHBondContact O-CD 3.4Å; L179-P183 VanDerWaalsContact O-CG 3.22Å; L179-P183 WeakPolarHBondContact O-CG 3.36Å; L179-V202 HydrophobicContact CB-CG1 3.71Å; L179-V202 WeakPolarHBondContact O-CB 3.36Å; L179-V202 VanDerWaalsContact O-CG1 3.23Å; L179-V202 WeakPolarHBondContact O-CG1 3.49Å |
| 180 | W | 92.1 | Very high | 91.7 | Very high | 4 Ų | 4 | 39.1 Ų | 39.1 | 2% | 0.015 | 22% | 0.218 | C | C | . | . | I | π-helix | trans | -116.5 | -46.4 | -177.8 | 76.7 | -104.2 | 0 | 0 | 0 | 113.8 | G131 W135 A176 L184 Y199 V202 M254 L257 | G131-W180 WeakPolarHBondContact O-CH2 3.24Å; W135-W180 HydrophobicContact CB-CH2 3.44Å; W135-W180 VanDerWaalsContact CB-CH2 3.44Å; W135-W180 HydrophobicContact CB-CZ2 3.36Å; W135-W180 HydrophobicContact CB-CZ3 4.47Å; W135-W180 AromaticContact CD1-CE2 3.75Å; W135-W180 AromaticContact CD1-CZ2 3.46Å; W135-W180 VanDerWaalsContact CD1-CZ2 3.46Å; W135-W180 AromaticContact CD1-NE1 3.88Å; W135-W180 HydrophobicContact CG-CH2 4.31Å; W135-W180 AromaticContact CG-CZ2 3.79Å; W135-W180 HydrophobicContact CG-CZ2 3.79Å; A176-W180 PolarHBondContact O-N 2.79Å; A176-W180 VanDerWaalsContact O-N 3.12Å; A176-W180 PolarHBondContact O-NE1 3.45Å; A176-W180 VanDerWaalsContact O-NE1 3.13Å; W180-L184 PolarHBondContact O-N 3.47Å; W180-Y199 HydrophobicContact CE3-CE2 4.46Å; W180-Y199 WeakPolarHBondContact O-CD2 3.41Å; W180-V202 HydrophobicContact CB-CG1 3.98Å; W180-M254 HydrophobicContact CD2-CE 4.27Å; W180-M254 HydrophobicContact CH2-CE 4.01Å; W180-M254 HydrophobicContact CZ2-CE 3.52Å; W180-L257 HydrophobicContact CZ3-CD2 4.34Å |
| 181 | Y | 95.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 21% | 0.207 | C | C | . | . | I | π-helix | trans | -70.3 | -42.7 | -177.2 | 176.7 | -103.2 | 0 | 0 | 0 | 111.8 | H114 F132 A176 F177 L184 Y185 | H114-Y181 AromaticContact CE1-CE1 3.73Å; H114-Y181 AromaticContact CE1-CZ 3.78Å; H114-Y181 PolarHBondContact CE1-OH 2.89Å; H114-Y181 PolarHBondContact NE2-OH 3.46Å; F132-Y181 HydrophobicContact CB-CD2 4.47Å; F132-Y181 HydrophobicContact CB-CE2 3.53Å; F132-Y181 WeakPolarHBondContact CB-OH 3.35Å; F132-Y181 AromaticContact CD2-CE1 3.81Å; F132-Y181 HydrophobicContact CD2-CE1 3.81Å; F132-Y181 AromaticContact CD2-CE2 3.96Å; F132-Y181 HydrophobicContact CD2-CE2 3.96Å; F132-Y181 AromaticContact CD2-CZ 3.48Å; F132-Y181 VanDerWaalsContact CD2-CZ 3.48Å; F132-Y181 WeakPolarHBondContact CD2-OH 3.29Å; F132-Y181 HydrophobicContact CG-CE2 4.24Å; A176-Y181 PolarHBondContact O-N 3.1Å; F177-Y181 AromaticContact CD2-CD1 3.67Å; F177-Y181 HydrophobicContact CD2-CD1 3.67Å; F177-Y181 HydrophobicContact CD2-CE1 4.46Å; F177-Y181 HydrophobicContact CD2-CG 4.4Å; F177-Y181 AromaticContact CE2-CD1 3.4Å; F177-Y181 HydrophobicContact CE2-CD1 3.4Å; F177-Y181 VanDerWaalsContact CE2-CD1 3.4Å; F177-Y181 AromaticContact CE2-CE1 3.78Å; F177-Y181 HydrophobicContact CE2-CE1 3.78Å; F177-Y181 HydrophobicContact CE2-CG 4.49Å; F177-Y181 HydrophobicContact CZ-CD1 4.21Å; F177-Y181 HydrophobicContact CZ-CE1 4.46Å; Y181-L184 WeakPolarHBondContact O-CB 3.12Å; Y181-L184 PolarHBondContact O-N 2.97Å; Y181-Y185 PolarHBondContact O-N 2.87Å |
| 182 | R | 92.9 | Very high | 91 | Very high | 25 Ų | 25 | 34.8 Ų | 34.8 | 9% | 0.094 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.4 | -44.8 | 179.9 | -82.4 | -74.9 | 178.2 | -179.9 | -3.4 | 113.2 | F113 F177 L184 Y185 K186 | F113-R182 PolarHBondContact O-NH1 3.43Å; F177-R182 HydrophobicContact CD1-CG 4.03Å; F177-R182 HydrophobicContact CE1-CG 3.79Å; F177-R182 HydrophobicContact CZ-CG 4.19Å; F177-R182 WeakPolarHBondContact O-CB 3.31Å; F177-R182 VanDerWaalsContact O-CG 3.27Å; F177-R182 WeakPolarHBondContact O-CG 3.25Å; F177-R182 PolarHBondContact O-N 3.39Å; R182-L184 VanDerWaalsContact C-N 3.32Å; R182-L184 PolarHBondContact O-N 3.48Å; R182-Y185 PolarHBondContact O-N 2.86Å; R182-K186 WeakPolarHBondContact O-CG 3.36Å; R182-K186 PolarHBondContact O-N 3.23Å |
| 183 | P | 93.7 | Very high | 90.9 | Very high | 13 Ų | 13 | 33.2 Ų | 33.2 | 8% | 0.084 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.5 | -40 | 173.1 | -32.8 | 42.3 | 0 | 0 | 0 | 112.8 | V178 L179 Y185 K186 A187 I198 | V178-P183 VanDerWaalsContact O-CD 3.26Å; V178-P183 WeakPolarHBondContact O-CD 3.37Å; L179-P183 WeakPolarHBondContact O-CD 3.4Å; L179-P183 VanDerWaalsContact O-CG 3.22Å; L179-P183 WeakPolarHBondContact O-CG 3.36Å; P183-Y185 PolarHBondContact O-N 3.3Å; P183-K186 PolarHBondContact O-N 3.47Å; P183-A187 VanDerWaalsContact O-CB 3.26Å; P183-A187 WeakPolarHBondContact O-CB 3.46Å; P183-A187 PolarHBondContact O-N 2.85Å; P183-I198 HydrophobicContact CB-CB 4.47Å; P183-I198 HydrophobicContact CB-CG2 3.97Å; P183-I198 HydrophobicContact CG-CG2 3.91Å |
| 184 | L | 95.7 | Very high | 90.9 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -56.6 | -49.6 | 173.1 | -179.1 | 65.6 | 0 | 0 | 0 | 111.6 | W180 Y181 R182 A187 F188 Y199 L257 V261 | W180-L184 PolarHBondContact O-N 3.47Å; Y181-L184 WeakPolarHBondContact O-CB 3.12Å; Y181-L184 PolarHBondContact O-N 2.97Å; R182-L184 VanDerWaalsContact C-N 3.32Å; R182-L184 PolarHBondContact O-N 3.48Å; L184-A187 PolarHBondContact O-N 2.98Å; L184-F188 HydrophobicContact CD1-CD2 3.94Å; L184-F188 HydrophobicContact CD1-CE2 3.6Å; L184-F188 HydrophobicContact CG-CD2 4.41Å; L184-F188 HydrophobicContact CG-CE2 4.49Å; L184-F188 WeakPolarHBondContact O-CD2 3.34Å; L184-F188 PolarHBondContact O-N 3.29Å; L184-Y199 HydrophobicContact CB-CD2 3.56Å; L184-Y199 HydrophobicContact CB-CE2 3.69Å; L184-Y199 HydrophobicContact CB-CG 4.24Å; L184-Y199 HydrophobicContact CD1-CD1 4.15Å; L184-Y199 HydrophobicContact CD1-CD2 4.06Å; L184-Y199 HydrophobicContact CD1-CE1 3.9Å; L184-Y199 HydrophobicContact CD1-CE2 3.8Å; L184-Y199 HydrophobicContact CD1-CG 4.22Å; L184-Y199 HydrophobicContact CD2-CE2 4.18Å; L184-Y199 HydrophobicContact CG-CD2 4.35Å; L184-Y199 HydrophobicContact CG-CE2 4.1Å; L184-L257 HydrophobicContact CD2-CD2 4.14Å; L184-V261 HydrophobicContact CD1-CG1 4.15Å; L184-V261 HydrophobicContact CD1-CG2 3.61Å |
| 185 | Y | 94.9 | Very high | 91 | Very high | 3 Ų | 3 | 32.3 Ų | 32.3 | 1% | 0.012 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -60.7 | -47.8 | 179.2 | -173.4 | -88.9 | 0 | 0 | 0 | 111.7 | H114 D115 I116 E119 I120 V128 Y181 R182 P183 A187 F188 K189 | H114-Y185 AromaticContact CE1-CD2 3.5Å; H114-Y185 AromaticContact CE1-CE2 3.23Å; H114-Y185 WeakPolarHBondContact CE1-CE2 3.44Å; H114-Y185 AromaticContact CE1-CZ 3.97Å; H114-Y185 AromaticContact ND1-CD2 3.81Å; H114-Y185 AromaticContact ND1-CE2 3.39Å; H114-Y185 WeakPolarHBondContact ND1-CE2 3.26Å; H114-Y185 AromaticContact ND1-CZ 3.64Å; D115-Y185 PolarHBondContact N-OH 2.87Å; D115-Y185 PolarHBondContact O-OH 3.16Å; I116-Y185 HydrophobicContact CG1-CE2 3.88Å; E119-Y185 WeakPolarHBondContact CB-OH 3.43Å; E119-Y185 WeakPolarHBondContact OE2-CE1 3.04Å; E119-Y185 VanDerWaalsContact OE2-CZ 3.25Å; E119-Y185 PolarHBondContact OE2-OH 3.15Å; I120-Y185 HydrophobicContact CD1-CD1 4.38Å; I120-Y185 HydrophobicContact CD1-CD2 4.06Å; I120-Y185 HydrophobicContact CD1-CE1 4.24Å; I120-Y185 HydrophobicContact CD1-CE2 3.88Å; I120-Y185 HydrophobicContact CD1-CG 4.32Å; I120-Y185 HydrophobicContact CG1-CD2 4.3Å; I120-Y185 HydrophobicContact CG1-CE2 3.82Å; V128-Y185 HydrophobicContact CG1-CD2 3.63Å; V128-Y185 HydrophobicContact CG1-CE2 4.22Å; Y181-Y185 PolarHBondContact O-N 2.87Å; R182-Y185 PolarHBondContact O-N 2.86Å; P183-Y185 PolarHBondContact O-N 3.3Å; Y185-A187 VanDerWaalsContact C-N 3.34Å; Y185-A187 PolarHBondContact O-N 3.37Å; Y185-F188 PolarHBondContact O-N 2.86Å; Y185-K189 HydrophobicContact CE1-CD 4.01Å; Y185-K189 VanDerWaalsContact O-CB 3.26Å; Y185-K189 WeakPolarHBondContact O-CB 3.43Å; Y185-K189 PolarHBondContact O-N 3.46Å |
| 186 | K | 92.1 | Very high | 91.1 | Very high | 103 Ų | 103 | 30.2 Ų | 30.2 | 45% | 0.448 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -63.5 | -38 | 178.7 | -74.3 | -176.3 | 178.4 | -176.8 | 0 | 112.5 | R182 P183 K189 N190 N195 | R182-K186 WeakPolarHBondContact O-CG 3.36Å; R182-K186 PolarHBondContact O-N 3.23Å; P183-K186 PolarHBondContact O-N 3.47Å; K186-K189 PolarHBondContact O-N 2.88Å; K186-N190 PolarHBondContact O-N 3.46Å; K186-N195 HydrophobicContact CB-CB 4.27Å |
| 187 | A | 92.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.2 | -47.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | P183 L184 Y185 D191 S192 N195 F196 | P183-A187 VanDerWaalsContact O-CB 3.26Å; P183-A187 WeakPolarHBondContact O-CB 3.46Å; P183-A187 PolarHBondContact O-N 2.85Å; L184-A187 PolarHBondContact O-N 2.98Å; Y185-A187 VanDerWaalsContact C-N 3.34Å; Y185-A187 PolarHBondContact O-N 3.37Å; A187-D191 WeakPolarHBondContact O-CA 3.46Å; A187-D191 PolarHBondContact O-N 3.4Å; A187-S192 PolarHBondContact O-N 2.79Å; A187-N195 HydrophobicContact CB-CB 3.86Å; A187-F196 HydrophobicContact CB-CB 4.45Å; A187-F196 HydrophobicContact CB-CD1 3.69Å; A187-F196 HydrophobicContact CB-CD2 3.81Å; A187-F196 HydrophobicContact CB-CE1 3.75Å; A187-F196 HydrophobicContact CB-CE2 3.87Å; A187-F196 HydrophobicContact CB-CG 3.72Å; A187-F196 HydrophobicContact CB-CZ 3.84Å; A187-F196 WeakPolarHBondContact O-CE2 3.17Å |
| 188 | F | 92.8 | Very high | 91.4 | Very high | 3 Ų | 3 | 36.2 Ų | 36.2 | 1% | 0.013 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -79.7 | -28.1 | 178.6 | -75.1 | -65.7 | 0 | 0 | 0 | 114.6 | I120 P121 Y124 I127 V128 L184 Y185 F196 V261 V264 | I120-F188 HydrophobicContact CD1-CB 4.41Å; I120-F188 HydrophobicContact CG2-CB 4.32Å; P121-F188 WeakPolarHBondContact CD-O 3.24Å; Y124-F188 AromaticContact CD1-CD1 3.81Å; Y124-F188 HydrophobicContact CD1-CD1 3.81Å; Y124-F188 AromaticContact CD1-CE1 3.8Å; Y124-F188 HydrophobicContact CD1-CE1 3.8Å; Y124-F188 AromaticContact CD2-CD1 3.88Å; Y124-F188 HydrophobicContact CD2-CD1 3.88Å; Y124-F188 HydrophobicContact CE1-CD1 4.46Å; Y124-F188 HydrophobicContact CE1-CE1 4.32Å; Y124-F188 AromaticContact CG-CD1 3.48Å; Y124-F188 HydrophobicContact CG-CD1 3.48Å; Y124-F188 VanDerWaalsContact CG-CD1 3.48Å; Y124-F188 AromaticContact CG-CE1 3.99Å; Y124-F188 HydrophobicContact CG-CE1 3.99Å; Y124-F188 HydrophobicContact CG-CG 4.38Å; I127-F188 HydrophobicContact CD1-CE2 4.28Å; I127-F188 HydrophobicContact CD1-CZ 3.95Å; I127-F188 HydrophobicContact CG1-CE2 4.39Å; I127-F188 HydrophobicContact CG1-CZ 4.47Å; I127-F188 HydrophobicContact CG2-CD1 4.46Å; I127-F188 HydrophobicContact CG2-CD2 4.26Å; I127-F188 HydrophobicContact CG2-CE1 4.08Å; I127-F188 HydrophobicContact CG2-CE2 3.84Å; I127-F188 HydrophobicContact CG2-CZ 3.75Å; V128-F188 HydrophobicContact CG2-CB 3.69Å; V128-F188 HydrophobicContact CG2-CD2 3.65Å; V128-F188 HydrophobicContact CG2-CG 3.89Å; L184-F188 HydrophobicContact CD1-CD2 3.94Å; L184-F188 HydrophobicContact CD1-CE2 3.6Å; L184-F188 HydrophobicContact CG-CD2 4.41Å; L184-F188 HydrophobicContact CG-CE2 4.49Å; L184-F188 WeakPolarHBondContact O-CD2 3.34Å; L184-F188 PolarHBondContact O-N 3.29Å; Y185-F188 PolarHBondContact O-N 2.86Å; F188-F196 HydrophobicContact CD1-CE1 4.27Å; F188-F196 AromaticContact CD1-CZ 3.83Å; F188-F196 HydrophobicContact CD1-CZ 3.83Å; F188-F196 HydrophobicContact CD2-CE1 4.36Å; F188-F196 AromaticContact CE1-CE1 3.83Å; F188-F196 HydrophobicContact CE1-CE1 3.83Å; F188-F196 AromaticContact CE1-CZ 3.71Å; F188-F196 HydrophobicContact CE1-CZ 3.71Å; F188-F196 AromaticContact CE2-CE1 3.95Å; F188-F196 HydrophobicContact CE2-CE1 3.95Å; F188-F196 HydrophobicContact CE2-CZ 4.45Å; F188-F196 HydrophobicContact CG-CZ 4.27Å; F188-F196 AromaticContact CZ-CE1 3.66Å; F188-F196 HydrophobicContact CZ-CE1 3.66Å; F188-F196 HydrophobicContact CZ-CZ 4.04Å; F188-V261 HydrophobicContact CE2-CG1 4.02Å; F188-V261 HydrophobicContact CE2-CG2 4.12Å; F188-V261 HydrophobicContact CZ-CG1 4Å; F188-V261 HydrophobicContact CZ-CG2 4.38Å; F188-V264 HydrophobicContact CE1-CG1 3.84Å; F188-V264 HydrophobicContact CZ-CG1 4.34Å |
| 189 | K | 90.1 | Very high | 91.6 | Very high | 48 Ų | 48 | 32.3 Ų | 32.3 | 21% | 0.209 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -65.6 | -49.7 | 175.3 | -177.8 | -178.7 | 164.6 | 175 | 0 | 111.6 | Y92 E119 I120 Y185 K186 | Y92-K189 VanDerWaalsContact CE1-NZ 3.31Å; E119-K189 HydrophobicContact CB-CD 4.04Å; E119-K189 HydrophobicContact CB-CG 4.15Å; E119-K189 WeakPolarHBondContact OE1-CE 3.43Å; E119-K189 IonicContact OE1-NZ 2.66Å; E119-K189 PolarHBondContact OE1-NZ 3.34Å; E119-K189 IonicContact OE2-NZ 3.77Å; I120-K189 HydrophobicContact CD1-CB 3.62Å; I120-K189 HydrophobicContact CD1-CG 4.41Å; Y185-K189 HydrophobicContact CE1-CD 4.01Å; Y185-K189 VanDerWaalsContact O-CB 3.26Å; Y185-K189 WeakPolarHBondContact O-CB 3.43Å; Y185-K189 PolarHBondContact O-N 3.46Å; K186-K189 PolarHBondContact O-N 2.88Å |
| 190 | N | 86.8 | Confident | 91.7 | Very high | 92 Ų | 92 | 29.7 Ų | 29.7 | 49% | 0.492 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -102.5 | 1.1 | -170.5 | -62.9 | -13.9 | 0 | 0 | 0 | 113.1 | K186 S192 | K186-N190 PolarHBondContact O-N 3.46Å; N190-S192 PolarHBondContact O-N 2.93Å; N190-S192 VanDerWaalsContact O-N 3.13Å |
| 191 | D | 84.6 | Confident | 91.9 | Very high | 65 Ų | 65 | 36.6 Ų | 36.6 | 35% | 0.348 | 18% | 0.179 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 48.5 | 36.1 | -170.1 | -169.4 | 44.4 | 0 | 0 | 0 | 113.4 | A187 K274 | A187-D191 WeakPolarHBondContact O-CA 3.46Å; A187-D191 PolarHBondContact O-N 3.4Å; D191-K274 PolarHBondContact O-NZ 3.34Å; D191-K274 IonicContact OD1-NZ 3.98Å; D191-K274 IonicContact OD2-NZ 2.76Å; D191-K274 PolarHBondContact OD2-NZ 3.25Å |
| 192 | S | 84.4 | Confident | 91.9 | Very high | 16 Ų | 16 | 37.8 Ų | 37.8 | 11% | 0.112 | 19% | 0.186 | C | C | . | . | trans | -92.6 | 115.9 | -171.7 | 172.3 | 0 | 0 | 0 | 0 | 111.5 | A187 N190 V194 N195 F196 E278 | A187-S192 PolarHBondContact O-N 2.79Å; N190-S192 PolarHBondContact O-N 2.93Å; N190-S192 VanDerWaalsContact O-N 3.13Å; S192-V194 VanDerWaalsContact C-N 3.29Å; S192-V194 PolarHBondContact O-N 3.37Å; S192-N195 WeakPolarHBondContact CB-ND2 3.37Å; S192-N195 PolarHBondContact O-N 3.26Å; S192-N195 VanDerWaalsContact O-N 3.15Å; S192-N195 PolarHBondContact OG-ND2 3.44Å; S192-N195 VanDerWaalsContact OG-ND2 3.11Å; S192-F196 VanDerWaalsContact O-CD2 3.24Å; S192-F196 WeakPolarHBondContact O-CD2 3.17Å; S192-F196 PolarHBondContact O-N 3.26Å; S192-E278 WeakPolarHBondContact CA-OE2 3.27Å; S192-E278 WeakPolarHBondContact CB-OE2 3.1Å; S192-E278 PolarHBondContact OG-OE2 3.48Å | ||
| 193 | S | 87.5 | Confident | 92.1 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.3 | -33.2 | 179.7 | 51.6 | 0 | 0 | 0 | 0 | 112.9 | N195 F196 M197 A275 E278 | S193-N195 PolarHBondContact O-N 2.91Å; S193-F196 WeakPolarHBondContact O-CB 3.36Å; S193-F196 PolarHBondContact O-N 3.03Å; S193-M197 WeakPolarHBondContact O-CG 3.31Å; S193-M197 PolarHBondContact O-N 3.28Å; S193-A275 WeakPolarHBondContact OG-CA 3.19Å; S193-A275 WeakPolarHBondContact OG-CB 3.26Å; S193-A275 PolarHBondContact OG-N 3.08Å; S193-E278 PolarHBondContact N-OE1 3.33Å; S193-E278 VanDerWaalsContact N-OE1 3.07Å; S193-E278 PolarHBondContact N-OE2 3.38Å; S193-E278 PolarHBondContact OG-OE1 3.44Å; S193-E278 PolarHBondContact OG-OE2 3.31Å |
| 194 | V | 88.6 | Confident | 92.1 | Very high | 43 Ų | 43 | 42 Ų | 42 | 26% | 0.261 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -61.6 | -43.8 | 173.7 | 178 | 0 | 0 | 0 | 0 | 111.4 | S192 F196 M197 I198 A275 E278 F279 | S192-V194 VanDerWaalsContact C-N 3.29Å; S192-V194 PolarHBondContact O-N 3.37Å; V194-F196 VanDerWaalsContact C-N 3.32Å; V194-F196 PolarHBondContact O-N 3.19Å; V194-M197 PolarHBondContact O-N 3.46Å; V194-I198 HydrophobicContact CG1-CD1 4.11Å; V194-I198 WeakPolarHBondContact O-CG1 3.33Å; V194-I198 PolarHBondContact O-N 2.99Å; V194-A275 HydrophobicContact CG2-CB 4.2Å; V194-E278 HydrophobicContact CG2-CB 4.38Å; V194-F279 HydrophobicContact CG2-CB 4.33Å |
| 195 | N | 90.9 | Very high | 92.2 | Very high | 30 Ų | 30 | 45.1 Ų | 45.1 | 16% | 0.16 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.9 | -33.1 | 178.2 | -72.9 | -73.2 | 0 | 0 | 0 | 112.1 | K186 A187 S192 S193 Y199 | K186-N195 HydrophobicContact CB-CB 4.27Å; A187-N195 HydrophobicContact CB-CB 3.86Å; S192-N195 WeakPolarHBondContact CB-ND2 3.37Å; S192-N195 PolarHBondContact O-N 3.26Å; S192-N195 VanDerWaalsContact O-N 3.15Å; S192-N195 PolarHBondContact OG-ND2 3.44Å; S192-N195 VanDerWaalsContact OG-ND2 3.11Å; S193-N195 PolarHBondContact O-N 2.91Å; N195-Y199 WeakPolarHBondContact O-CB 3.45Å; N195-Y199 PolarHBondContact O-N 3.32Å |
| 196 | F | 93.4 | Very high | 92.1 | Very high | 4 Ų | 4 | 45.8 Ų | 45.8 | 2% | 0.018 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.4 | -44.4 | 170 | -79.1 | -71.3 | 0 | 0 | 0 | 111.8 | A187 F188 S192 S193 V194 Y199 F200 V261 Y265 | A187-F196 HydrophobicContact CB-CB 4.45Å; A187-F196 HydrophobicContact CB-CD1 3.69Å; A187-F196 HydrophobicContact CB-CD2 3.81Å; A187-F196 HydrophobicContact CB-CE1 3.75Å; A187-F196 HydrophobicContact CB-CE2 3.87Å; A187-F196 HydrophobicContact CB-CG 3.72Å; A187-F196 HydrophobicContact CB-CZ 3.84Å; A187-F196 WeakPolarHBondContact O-CE2 3.17Å; F188-F196 HydrophobicContact CD1-CE1 4.27Å; F188-F196 AromaticContact CD1-CZ 3.83Å; F188-F196 HydrophobicContact CD1-CZ 3.83Å; F188-F196 HydrophobicContact CD2-CE1 4.36Å; F188-F196 AromaticContact CE1-CE1 3.83Å; F188-F196 HydrophobicContact CE1-CE1 3.83Å; F188-F196 AromaticContact CE1-CZ 3.71Å; F188-F196 HydrophobicContact CE1-CZ 3.71Å; F188-F196 AromaticContact CE2-CE1 3.95Å; F188-F196 HydrophobicContact CE2-CE1 3.95Å; F188-F196 HydrophobicContact CE2-CZ 4.45Å; F188-F196 HydrophobicContact CG-CZ 4.27Å; F188-F196 AromaticContact CZ-CE1 3.66Å; F188-F196 HydrophobicContact CZ-CE1 3.66Å; F188-F196 HydrophobicContact CZ-CZ 4.04Å; S192-F196 VanDerWaalsContact O-CD2 3.24Å; S192-F196 WeakPolarHBondContact O-CD2 3.17Å; S192-F196 PolarHBondContact O-N 3.26Å; S193-F196 WeakPolarHBondContact O-CB 3.36Å; S193-F196 PolarHBondContact O-N 3.03Å; V194-F196 VanDerWaalsContact C-N 3.32Å; V194-F196 PolarHBondContact O-N 3.19Å; F196-Y199 WeakPolarHBondContact O-CB 3.22Å; F196-Y199 PolarHBondContact O-N 2.66Å; F196-F200 HydrophobicContact CB-CE2 3.99Å; F196-F200 HydrophobicContact CB-CZ 4.49Å; F196-F200 HydrophobicContact CD1-CZ 4.29Å; F196-F200 WeakPolarHBondContact O-CD2 3.44Å; F196-F200 VanDerWaalsContact O-CG 3.31Å; F196-F200 WeakPolarHBondContact O-CG 3.5Å; F196-F200 PolarHBondContact O-N 3.06Å; F196-V261 HydrophobicContact CD1-CG1 3.94Å; F196-V261 HydrophobicContact CE1-CG1 3.9Å; F196-Y265 HydrophobicContact CB-CD2 3.7Å; F196-Y265 HydrophobicContact CB-CE2 3.84Å; F196-Y265 HydrophobicContact CD1-CD2 4.08Å; F196-Y265 AromaticContact CD2-CD2 3.76Å; F196-Y265 HydrophobicContact CD2-CD2 3.76Å; F196-Y265 HydrophobicContact CD2-CE2 4.16Å; F196-Y265 HydrophobicContact CE2-CD2 4.41Å; F196-Y265 AromaticContact CG-CD2 3.58Å; F196-Y265 HydrophobicContact CG-CD2 3.58Å; F196-Y265 HydrophobicContact CG-CE2 4.11Å; F196-Y265 HydrophobicContact CG-CG 4.46Å |
| 197 | M | 93.3 | Very high | 92.3 | Very high | 65 Ų | 65 | 42.6 Ų | 42.6 | 32% | 0.32 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -62.9 | -45.6 | 178.4 | -66.3 | -54.9 | 98.3 | 0 | 0 | 112 | S193 V194 Y199 F200 F201 Y265 | S193-M197 WeakPolarHBondContact O-CG 3.31Å; S193-M197 PolarHBondContact O-N 3.28Å; V194-M197 PolarHBondContact O-N 3.46Å; M197-Y199 VanDerWaalsContact C-N 3.3Å; M197-Y199 PolarHBondContact O-N 2.87Å; M197-F200 HydrophobicContact CE-CD2 3.54Å; M197-F200 HydrophobicContact CE-CE2 3.58Å; M197-F200 PolarHBondContact O-N 2.81Å; M197-F200 HydrophobicContact SD-CD2 4.47Å; M197-F201 PolarHBondContact O-N 2.93Å; M197-Y265 HydrophobicContact CE-CD1 4.31Å; M197-Y265 HydrophobicContact CE-CE1 3.57Å; M197-Y265 HydrophobicContact CE-CE2 3.8Å; M197-Y265 VanDerWaalsContact CE-OH 3.3Å; M197-Y265 WeakPolarHBondContact CE-OH 3.4Å |
| 198 | I | 93.9 | Very high | 92.5 | Very high | 77 Ų | 77 | 47 Ų | 47 | 40% | 0.395 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.4 | -46.3 | 174.8 | -65.8 | 167.5 | 0 | 0 | 0 | 110 | P183 V194 F200 F201 V202 | P183-I198 HydrophobicContact CB-CB 4.47Å; P183-I198 HydrophobicContact CB-CG2 3.97Å; P183-I198 HydrophobicContact CG-CG2 3.91Å; V194-I198 HydrophobicContact CG1-CD1 4.11Å; V194-I198 WeakPolarHBondContact O-CG1 3.33Å; V194-I198 PolarHBondContact O-N 2.99Å; I198-F200 PolarHBondContact O-N 3.36Å; I198-F201 PolarHBondContact O-N 2.98Å; I198-V202 HydrophobicContact CG2-CG2 4.28Å; I198-V202 WeakPolarHBondContact O-CG2 3.37Å; I198-V202 PolarHBondContact O-N 3.43Å |
| 199 | Y | 95.6 | Very high | 92.5 | Very high | 3 Ų | 3 | 49.2 Ų | 49.2 | 1% | 0.012 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -57.7 | -50.1 | 177.1 | 169.8 | -103.4 | 0 | 0 | 0 | 111.7 | W180 L184 N195 F196 M197 F201 V202 S203 L257 L258 V261 | W180-Y199 HydrophobicContact CE3-CE2 4.46Å; W180-Y199 WeakPolarHBondContact O-CD2 3.41Å; L184-Y199 HydrophobicContact CB-CD2 3.56Å; L184-Y199 HydrophobicContact CB-CE2 3.69Å; L184-Y199 HydrophobicContact CB-CG 4.24Å; L184-Y199 HydrophobicContact CD1-CD1 4.15Å; L184-Y199 HydrophobicContact CD1-CD2 4.06Å; L184-Y199 HydrophobicContact CD1-CE1 3.9Å; L184-Y199 HydrophobicContact CD1-CE2 3.8Å; L184-Y199 HydrophobicContact CD1-CG 4.22Å; L184-Y199 HydrophobicContact CD2-CE2 4.18Å; L184-Y199 HydrophobicContact CG-CD2 4.35Å; L184-Y199 HydrophobicContact CG-CE2 4.1Å; N195-Y199 WeakPolarHBondContact O-CB 3.45Å; N195-Y199 PolarHBondContact O-N 3.32Å; F196-Y199 WeakPolarHBondContact O-CB 3.22Å; F196-Y199 PolarHBondContact O-N 2.66Å; M197-Y199 VanDerWaalsContact C-N 3.3Å; M197-Y199 PolarHBondContact O-N 2.87Å; Y199-F201 PolarHBondContact O-N 3.16Å; Y199-V202 PolarHBondContact O-N 3.38Å; Y199-S203 WeakPolarHBondContact O-CB 3.14Å; Y199-S203 PolarHBondContact O-N 3.32Å; Y199-S203 PolarHBondContact O-OG 2.6Å; Y199-L257 WeakPolarHBondContact OH-CG 3.4Å; Y199-L258 HydrophobicContact CE1-CD1 4.44Å; Y199-V261 HydrophobicContact CD1-CG1 3.88Å; Y199-V261 HydrophobicContact CE1-CB 3.82Å; Y199-V261 HydrophobicContact CE1-CG1 3.67Å; Y199-V261 HydrophobicContact CE1-CG2 3.88Å |
| 200 | F | 95.4 | Very high | 92.8 | Very high | 30 Ų | 30 | 46.9 Ų | 46.9 | 13% | 0.132 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.6 | -43.8 | -179.2 | -64.7 | -44.6 | 0 | 0 | 0 | 112.4 | F196 M197 I198 S203 F204 L258 V261 H262 Y265 | F196-F200 HydrophobicContact CB-CE2 3.99Å; F196-F200 HydrophobicContact CB-CZ 4.49Å; F196-F200 HydrophobicContact CD1-CZ 4.29Å; F196-F200 WeakPolarHBondContact O-CD2 3.44Å; F196-F200 VanDerWaalsContact O-CG 3.31Å; F196-F200 WeakPolarHBondContact O-CG 3.5Å; F196-F200 PolarHBondContact O-N 3.06Å; M197-F200 HydrophobicContact CE-CD2 3.54Å; M197-F200 HydrophobicContact CE-CE2 3.58Å; M197-F200 PolarHBondContact O-N 2.81Å; M197-F200 HydrophobicContact SD-CD2 4.47Å; I198-F200 PolarHBondContact O-N 3.36Å; F200-S203 WeakPolarHBondContact CA-OG 3.18Å; F200-S203 PolarHBondContact O-OG 3.42Å; F200-F204 WeakPolarHBondContact O-CB 3.45Å; F200-F204 PolarHBondContact O-N 3.27Å; F200-F204 VanDerWaalsContact O-N 3.09Å; F200-L258 HydrophobicContact CD1-CD1 3.86Å; F200-V261 HydrophobicContact CE1-CB 4.14Å; F200-V261 HydrophobicContact CE1-CG1 3.69Å; F200-V261 HydrophobicContact CZ-CG1 4.01Å; F200-H262 HydrophobicContact CE1-CB 3.91Å; F200-H262 HydrophobicContact CZ-CB 4.19Å; F200-Y265 AromaticContact CE2-CD1 3.86Å; F200-Y265 HydrophobicContact CE2-CD1 3.86Å; F200-Y265 HydrophobicContact CE2-CD2 4.35Å; F200-Y265 HydrophobicContact CE2-CE1 4.36Å; F200-Y265 AromaticContact CE2-CG 3.87Å; F200-Y265 HydrophobicContact CE2-CG 3.87Å; F200-Y265 HydrophobicContact CZ-CD1 4.24Å; F200-Y265 AromaticContact CZ-CG 4Å; F200-Y265 HydrophobicContact CZ-CG 4Å |
| 201 | F | 95.6 | Very high | 93.2 | Very high | 148 Ų | 148 | 45 Ų | 45 | 65% | 0.649 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -63.4 | -51.4 | 178.4 | 179.1 | -102.2 | 0 | 0 | 0 | 111.7 | M197 I198 Y199 F204 V205 | M197-F201 PolarHBondContact O-N 2.93Å; I198-F201 PolarHBondContact O-N 2.98Å; Y199-F201 PolarHBondContact O-N 3.16Å; F201-F204 PolarHBondContact O-N 3.41Å; F201-V205 HydrophobicContact CE1-CG2 4.43Å; F201-V205 HydrophobicContact CZ-CG2 4.36Å; F201-V205 PolarHBondContact O-N 3.49Å |
| 202 | V | 95.8 | Very high | 93.7 | Very high | 26 Ų | 26 | 44.3 Ų | 44.3 | 16% | 0.158 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.6 | -41.9 | -178.2 | 178 | 0 | 0 | 0 | 0 | 111.7 | L179 W180 I198 Y199 F204 V205 Q206 | L179-V202 HydrophobicContact CB-CG1 3.71Å; L179-V202 WeakPolarHBondContact O-CB 3.36Å; L179-V202 VanDerWaalsContact O-CG1 3.23Å; L179-V202 WeakPolarHBondContact O-CG1 3.49Å; W180-V202 HydrophobicContact CB-CG1 3.98Å; I198-V202 HydrophobicContact CG2-CG2 4.28Å; I198-V202 WeakPolarHBondContact O-CG2 3.37Å; I198-V202 PolarHBondContact O-N 3.43Å; Y199-V202 PolarHBondContact O-N 3.38Å; V202-F204 VanDerWaalsContact C-N 3.25Å; V202-F204 PolarHBondContact O-N 3.04Å; V202-V205 PolarHBondContact O-N 3.28Å; V202-Q206 WeakPolarHBondContact O-CB 3.36Å; V202-Q206 PolarHBondContact O-N 2.82Å |
| 203 | S | 95.8 | Very high | 94.2 | Very high | 11 Ų | 11 | 43.7 Ų | 43.7 | 8% | 0.077 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.4 | -31.8 | 179.7 | 55.3 | 0 | 0 | 0 | 0 | 112.2 | Y199 F200 L207 L258 | Y199-S203 WeakPolarHBondContact O-CB 3.14Å; Y199-S203 PolarHBondContact O-N 3.32Å; Y199-S203 PolarHBondContact O-OG 2.6Å; F200-S203 WeakPolarHBondContact CA-OG 3.18Å; F200-S203 PolarHBondContact O-OG 3.42Å; S203-L207 WeakPolarHBondContact O-CB 3.44Å; S203-L207 PolarHBondContact O-N 3.04Å; S203-L258 WeakPolarHBondContact OG-CD1 3.36Å |
| 204 | F | 95.4 | Very high | 94.7 | Very high | 114 Ų | 114 | 44.9 Ų | 44.9 | 50% | 0.5 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -65.2 | -46.9 | 170.5 | -179.8 | -102.4 | 0 | 0 | 0 | 112.2 | F200 F201 V202 Q206 L207 I208 | F200-F204 WeakPolarHBondContact O-CB 3.45Å; F200-F204 PolarHBondContact O-N 3.27Å; F200-F204 VanDerWaalsContact O-N 3.09Å; F201-F204 PolarHBondContact O-N 3.41Å; V202-F204 VanDerWaalsContact C-N 3.25Å; V202-F204 PolarHBondContact O-N 3.04Å; F204-Q206 VanDerWaalsContact C-N 3.32Å; F204-Q206 PolarHBondContact O-N 2.96Å; F204-L207 WeakPolarHBondContact O-CB 3.46Å; F204-L207 PolarHBondContact O-N 3.12Å; F204-L207 VanDerWaalsContact O-N 3.16Å; F204-I208 HydrophobicContact CD1-CD1 4.32Å; F204-I208 HydrophobicContact CE1-CD1 3.83Å; F204-I208 HydrophobicContact CZ-CD1 4.26Å; F204-I208 PolarHBondContact O-N 3.09Å |
| 205 | V | 95.7 | Very high | 95.1 | Very high | 67 Ų | 67 | 46.8 Ų | 46.8 | 41% | 0.406 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.2 | -42.8 | 174.8 | 174.9 | 0 | 0 | 0 | 0 | 111 | F201 V202 L207 I208 V209 | F201-V205 HydrophobicContact CE1-CG2 4.43Å; F201-V205 HydrophobicContact CZ-CG2 4.36Å; F201-V205 PolarHBondContact O-N 3.49Å; V202-V205 PolarHBondContact O-N 3.28Å; V205-L207 VanDerWaalsContact C-N 3.28Å; V205-L207 PolarHBondContact O-N 2.95Å; V205-I208 WeakPolarHBondContact O-CB 3.35Å; V205-I208 PolarHBondContact O-N 3.42Å; V205-I208 VanDerWaalsContact O-N 3.13Å; V205-V209 PolarHBondContact O-N 3.24Å; V205-V209 VanDerWaalsContact O-N 3.07Å |
| 206 | Q | 94.6 | Very high | 95.2 | Very high | 16 Ų | 16 | 45.6 Ų | 45.6 | 8% | 0.075 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.5 | -36.6 | 176.1 | -176.9 | 62.9 | 45.7 | 0 | 0 | 111.7 | Y138 V202 F204 I208 V209 V210 M254 | Y138-Q206 PolarHBondContact OH-NE2 3.26Å; V202-Q206 WeakPolarHBondContact O-CB 3.36Å; V202-Q206 PolarHBondContact O-N 2.82Å; F204-Q206 VanDerWaalsContact C-N 3.32Å; F204-Q206 PolarHBondContact O-N 2.96Å; Q206-I208 VanDerWaalsContact C-N 3.31Å; Q206-I208 PolarHBondContact O-N 2.9Å; Q206-V209 WeakPolarHBondContact O-CB 3.34Å; Q206-V209 PolarHBondContact O-N 3.46Å; Q206-V210 WeakPolarHBondContact O-CG2 2.92Å; Q206-V210 PolarHBondContact O-N 3.4Å; Q206-M254 HydrophobicContact CG-CE 3.55Å; Q206-M254 HydrophobicContact CG-SD 3.78Å |
| 207 | L | 96.1 | Very high | 94.9 | Very high | 36 Ų | 36 | 51.1 Ų | 51.1 | 19% | 0.188 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.7 | -38.3 | 175.4 | -171.7 | 69.9 | 0 | 0 | 0 | 111.7 | S203 F204 V205 V210 A211 G251 M254 L255 | S203-L207 WeakPolarHBondContact O-CB 3.44Å; S203-L207 PolarHBondContact O-N 3.04Å; F204-L207 WeakPolarHBondContact O-CB 3.46Å; F204-L207 PolarHBondContact O-N 3.12Å; F204-L207 VanDerWaalsContact O-N 3.16Å; V205-L207 VanDerWaalsContact C-N 3.28Å; V205-L207 PolarHBondContact O-N 2.95Å; L207-V210 PolarHBondContact O-N 3.5Å; L207-A211 WeakPolarHBondContact O-CB 3.43Å; L207-A211 PolarHBondContact O-N 3.46Å; L207-G251 WeakPolarHBondContact CD1-O 3.26Å; L207-M254 HydrophobicContact CD1-CB 4.1Å; L207-L255 HydrophobicContact CD1-CB 4.14Å; L207-L255 HydrophobicContact CD2-CB 4.47Å; L207-L255 HydrophobicContact CD2-CD1 3.85Å |
| 208 | I | 95.6 | Very high | 94.3 | Very high | 92 Ų | 92 | 49.8 Ų | 49.8 | 47% | 0.472 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63.9 | -45.4 | 173.6 | -62.4 | 170.4 | 0 | 0 | 0 | 110.4 | F204 V205 Q206 V210 A211 V212 | F204-I208 HydrophobicContact CD1-CD1 4.32Å; F204-I208 HydrophobicContact CE1-CD1 3.83Å; F204-I208 HydrophobicContact CZ-CD1 4.26Å; F204-I208 PolarHBondContact O-N 3.09Å; V205-I208 WeakPolarHBondContact O-CB 3.35Å; V205-I208 PolarHBondContact O-N 3.42Å; V205-I208 VanDerWaalsContact O-N 3.13Å; Q206-I208 VanDerWaalsContact C-N 3.31Å; Q206-I208 PolarHBondContact O-N 2.9Å; I208-V210 VanDerWaalsContact C-N 3.32Å; I208-V210 PolarHBondContact O-N 2.97Å; I208-A211 WeakPolarHBondContact O-CB 3.49Å; I208-A211 PolarHBondContact O-N 3.35Å; I208-V212 WeakPolarHBondContact O-CG2 3.4Å; I208-V212 PolarHBondContact O-N 3.42Å |
| 209 | V | 93.8 | Very high | 93.7 | Very high | 50 Ų | 50 | 52 Ų | 52 | 30% | 0.303 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57.5 | -46.2 | 176.5 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | V205 Q206 V212 Q213 | V205-V209 PolarHBondContact O-N 3.24Å; V205-V209 VanDerWaalsContact O-N 3.07Å; Q206-V209 WeakPolarHBondContact O-CB 3.34Å; Q206-V209 PolarHBondContact O-N 3.46Å; V209-V212 PolarHBondContact O-N 2.87Å; V209-Q213 WeakPolarHBondContact O-CG 3.34Å; V209-Q213 PolarHBondContact O-N 3.16Å; V209-Q213 VanDerWaalsContact O-N 3.09Å |
| 210 | V | 95.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.6 | -38.6 | 177.5 | 176.7 | 0 | 0 | 0 | 0 | 111.4 | Y138 Q206 L207 I208 V212 Q213 V214 M254 | Y138-V210 HydrophobicContact CD2-CG2 4.31Å; Y138-V210 HydrophobicContact CE2-CG2 3.74Å; Q206-V210 WeakPolarHBondContact O-CG2 2.92Å; Q206-V210 PolarHBondContact O-N 3.4Å; L207-V210 PolarHBondContact O-N 3.5Å; I208-V210 VanDerWaalsContact C-N 3.32Å; I208-V210 PolarHBondContact O-N 2.97Å; V210-V212 VanDerWaalsContact C-N 3.31Å; V210-V212 PolarHBondContact O-N 3.21Å; V210-Q213 WeakPolarHBondContact O-CB 3.44Å; V210-Q213 PolarHBondContact O-N 3.45Å; V210-Q213 VanDerWaalsContact O-N 3.14Å; V210-V214 HydrophobicContact CG1-CG2 4.18Å; V210-V214 VanDerWaalsContact O-CG2 3.27Å; V210-V214 WeakPolarHBondContact O-CG2 3.32Å; V210-V214 PolarHBondContact O-N 2.79Å; V210-M254 HydrophobicContact CG2-SD 3.77Å |
| 211 | A | 95.9 | Very high | 93.4 | Very high | 51 Ų | 51 | 50.5 Ų | 50.5 | 42% | 0.421 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.1 | -41.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | L207 I208 Q213 V214 L215 | L207-A211 WeakPolarHBondContact O-CB 3.43Å; L207-A211 PolarHBondContact O-N 3.46Å; I208-A211 WeakPolarHBondContact O-CB 3.49Å; I208-A211 PolarHBondContact O-N 3.35Å; A211-Q213 VanDerWaalsContact C-N 3.34Å; A211-Q213 PolarHBondContact O-N 3.13Å; A211-V214 PolarHBondContact O-N 3.03Å; A211-L215 WeakPolarHBondContact O-CG 3.27Å; A211-L215 PolarHBondContact O-N 2.94Å |
| 212 | V | 95.5 | Very high | 93.4 | Very high | 51 Ų | 51 | 43.5 Ų | 43.5 | 31% | 0.309 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.1 | -39.2 | 174.6 | 170.9 | 0 | 0 | 0 | 0 | 111.7 | I208 V209 V210 L215 G216 L217 A218 | I208-V212 WeakPolarHBondContact O-CG2 3.4Å; I208-V212 PolarHBondContact O-N 3.42Å; V209-V212 PolarHBondContact O-N 2.87Å; V210-V212 VanDerWaalsContact C-N 3.31Å; V210-V212 PolarHBondContact O-N 3.21Å; V212-L215 PolarHBondContact O-N 3.25Å; V212-G216 PolarHBondContact O-N 3.12Å; V212-L217 HydrophobicContact CG1-CB 4.29Å; V212-L217 PolarHBondContact O-N 3.12Å; V212-A218 HydrophobicContact CG1-CB 3.49Å; V212-A218 VanDerWaalsContact CG1-CB 3.49Å |
| 213 | Q | 95.4 | Very high | 93.5 | Very high | 4 Ų | 4 | 46.5 Ų | 46.5 | 2% | 0.019 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66.7 | -42.9 | 175.3 | -68.2 | 165.6 | -1.5 | 0 | 0 | 112.1 | Y138 V209 V210 A211 L215 G216 N220 G222 Y247 | Y138-Q213 PolarHBondContact OH-NE2 2.89Å; Y138-Q213 PolarHBondContact OH-OE1 2.79Å; V209-Q213 WeakPolarHBondContact O-CG 3.34Å; V209-Q213 PolarHBondContact O-N 3.16Å; V209-Q213 VanDerWaalsContact O-N 3.09Å; V210-Q213 WeakPolarHBondContact O-CB 3.44Å; V210-Q213 PolarHBondContact O-N 3.45Å; V210-Q213 VanDerWaalsContact O-N 3.14Å; A211-Q213 VanDerWaalsContact C-N 3.34Å; A211-Q213 PolarHBondContact O-N 3.13Å; Q213-L215 VanDerWaalsContact C-N 3.31Å; Q213-L215 PolarHBondContact O-N 2.79Å; Q213-G216 PolarHBondContact O-N 2.84Å; Q213-N220 HydrophobicContact CB-CB 4.48Å; Q213-G222 WeakPolarHBondContact O-CA 3.44Å; Q213-Y247 HydrophobicContact CB-CD1 4.06Å; Q213-Y247 HydrophobicContact CB-CD2 4.31Å; Q213-Y247 HydrophobicContact CB-CE1 4.17Å; Q213-Y247 HydrophobicContact CB-CE2 4.4Å; Q213-Y247 HydrophobicContact CB-CG 4.15Å; Q213-Y247 HydrophobicContact CG-CE1 4.41Å; Q213-Y247 VanDerWaalsContact OE1-CD1 3.3Å |
| 214 | V | 97.7 | Very high | 93.5 | Very high | 24 Ų | 24 | 49.9 Ų | 49.9 | 15% | 0.145 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.3 | -44.7 | 175.6 | 169.6 | 0 | 0 | 0 | 0 | 110.4 | V210 A211 G222 W223 Y247 T248 | V210-V214 HydrophobicContact CG1-CG2 4.18Å; V210-V214 VanDerWaalsContact O-CG2 3.27Å; V210-V214 WeakPolarHBondContact O-CG2 3.32Å; V210-V214 PolarHBondContact O-N 2.79Å; A211-V214 PolarHBondContact O-N 3.03Å; V214-G222 CarbonylContact O-C 3.5Å; V214-G222 WeakPolarHBondContact O-CA 3.34Å; V214-W223 VanDerWaalsContact O-CD1 3.26Å; V214-W223 PolarHBondContact O-N 3.44Å; V214-Y247 VanDerWaalsContact CG2-C 3.44Å; V214-Y247 WeakPolarHBondContact CG2-O 3.39Å; V214-T248 WeakPolarHBondContact CG1-OG1 3.44Å |
| 215 | L | 96.4 | Very high | 93.5 | Very high | 83 Ų | 83 | 45.6 Ų | 45.6 | 44% | 0.435 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -71.4 | -34 | 178.8 | -66.4 | 173.6 | 0 | 0 | 0 | 112.3 | A211 V212 Q213 L217 I224 | A211-L215 WeakPolarHBondContact O-CG 3.27Å; A211-L215 PolarHBondContact O-N 2.94Å; V212-L215 PolarHBondContact O-N 3.25Å; Q213-L215 VanDerWaalsContact C-N 3.31Å; Q213-L215 PolarHBondContact O-N 2.79Å; L215-L217 HydrophobicContact CB-CD1 4.27Å; L215-L217 HydrophobicContact CB-CG 4.04Å; L215-L217 HydrophobicContact CD1-CD1 3.99Å; L215-I224 HydrophobicContact CB-CD1 4.39Å; L215-I224 VanDerWaalsContact O-CB 3.26Å; L215-I224 WeakPolarHBondContact O-CB 3.5Å; L215-I224 WeakPolarHBondContact O-CD1 3.47Å; L215-I224 WeakPolarHBondContact O-CG1 3.47Å; L215-I224 PolarHBondContact O-N 3.25Å; L215-I224 VanDerWaalsContact O-N 3.07Å |
| 216 | G | 92.5 | Very high | 93.5 | Very high | 5 Ų | 5 | 42.4 Ų | 42.4 | 5% | 0.052 | 23% | 0.226 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 93.3 | 12.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | V212 Q213 A218 N225 | V212-G216 PolarHBondContact O-N 3.12Å; Q213-G216 PolarHBondContact O-N 2.84Å; G216-A218 VanDerWaalsContact C-N 3.3Å; G216-A218 PolarHBondContact O-N 3.27Å; G216-N225 PolarHBondContact O-ND2 3.36Å |
| 217 | L | 87.6 | Confident | 93.6 | Very high | 121 Ų | 121 | 46.7 Ų | 46.7 | 63% | 0.634 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.8 | -20 | -175.6 | -65.6 | 174.2 | 0 | 0 | 0 | 114.2 | V212 L215 I224 | V212-L217 HydrophobicContact CG1-CB 4.29Å; V212-L217 PolarHBondContact O-N 3.12Å; L215-L217 HydrophobicContact CB-CD1 4.27Å; L215-L217 HydrophobicContact CB-CG 4.04Å; L215-L217 HydrophobicContact CD1-CD1 3.99Å; L217-I224 HydrophobicContact CD2-CD1 3.93Å; L217-I224 HydrophobicContact CG-CD1 4.44Å |
| 218 | A | 80.1 | Confident | 93.5 | Very high | 36 Ų | 36 | 51 Ų | 51 | 30% | 0.298 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.3 | 48 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q168 V212 G216 N220 | Q168-A218 PolarHBondContact NE2-O 2.88Å; V212-A218 HydrophobicContact CG1-CB 3.49Å; V212-A218 VanDerWaalsContact CG1-CB 3.49Å; G216-A218 VanDerWaalsContact C-N 3.3Å; G216-A218 PolarHBondContact O-N 3.27Å; A218-N220 PolarHBondContact O-N 3.11Å; A218-N220 PolarHBondContact O-ND2 2.9Å; A218-N220 VanDerWaalsContact O-ND2 3.08Å |
| 219 | Y | 82.1 | Confident | 93.5 | Very high | 125 Ų | 125 | 46.9 Ų | 46.9 | 49% | 0.49 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.3 | 51.7 | 177.2 | -47.1 | -84.3 | 0 | 0 | 0 | 112.6 | Q161 L164 | Q161-Y219 WeakPolarHBondContact CG-O 3.31Å; L164-Y219 HydrophobicContact CD1-CD2 3.32Å; L164-Y219 HydrophobicContact CD1-CE2 4.03Å; L164-Y219 HydrophobicContact CD1-CG 3.64Å |
| 220 | N | 90.9 | Very high | 93.6 | Very high | 1 Ų | 1 | 47.8 Ų | 47.8 | 1% | 0.005 | 25% | 0.246 | C | C | . | . | S | Bend | trans | -117 | 163.8 | 172.3 | -84.2 | -87 | 0 | 0 | 0 | 109.2 | N145 Q161 Q168 Q213 A218 G222 N225 Y247 | N145-N220 PolarHBondContact ND2-OD1 3.45Å; Q161-N220 PolarHBondContact NE2-O 3.37Å; Q168-N220 PolarHBondContact NE2-ND2 3.44Å; Q168-N220 PolarHBondContact OE1-ND2 3.3Å; Q168-N220 PolarHBondContact OE1-OD1 3.02Å; Q168-N220 VanDerWaalsContact OE1-OD1 3.06Å; Q213-N220 HydrophobicContact CB-CB 4.48Å; A218-N220 PolarHBondContact O-N 3.11Å; A218-N220 PolarHBondContact O-ND2 2.9Å; A218-N220 VanDerWaalsContact O-ND2 3.08Å; N220-G222 VanDerWaalsContact C-N 3.3Å; N220-G222 PolarHBondContact O-N 3.14Å; N220-N225 PolarHBondContact O-ND2 3.21Å; N220-Y247 PolarHBondContact OD1-OH 3.35Å |
| 221 | C | 94.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -53.2 | -48.5 | 177.8 | -68.3 | 0 | 0 | 0 | 0 | 112 | N145 N225 T226 M240 V243 | N145-C221 PolarHBondContact OD1-N 3.44Å; N145-C221 PolarHBondContact OD1-SG 2.96Å; C221-N225 WeakPolarHBondContact O-CB 3.27Å; C221-T226 PolarHBondContact O-N 2.9Å; C221-T226 PolarHBondContact O-OG1 2.87Å; C221-M240 HydrophobicContact CB-CB 4.07Å; C221-M240 HydrophobicContact CB-CG 4.35Å; C221-V243 HydrophobicContact CB-CB 3.84Å; C221-V243 HydrophobicContact CB-CG1 3.76Å |
| 222 | G | 95.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 29% | 0.294 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 45.2 | 160.9 | 166 | 0 | 0 | 0 | 0 | 0 | 118.3 | Q213 V214 N220 I224 T226 S244 | Q213-G222 WeakPolarHBondContact O-CA 3.44Å; V214-G222 CarbonylContact O-C 3.5Å; V214-G222 WeakPolarHBondContact O-CA 3.34Å; N220-G222 VanDerWaalsContact C-N 3.3Å; N220-G222 PolarHBondContact O-N 3.14Å; G222-I224 VanDerWaalsContact C-N 3.35Å; G222-I224 PolarHBondContact O-N 3.48Å; G222-T226 WeakPolarHBondContact O-CB 3.37Å; G222-T226 PolarHBondContact O-N 2.96Å; G222-T226 PolarHBondContact O-OG1 2.73Å; G222-S244 VanDerWaalsContact CA-OG 3.31Å; G222-S244 WeakPolarHBondContact CA-OG 3.33Å; G222-S244 PolarHBondContact N-OG 3.46Å; G222-S244 PolarHBondContact O-OG 2.76Å |
| 223 | W | 97.6 | Very high | 93.4 | Very high | 89 Ų | 89 | 59.2 Ų | 59.2 | 34% | 0.337 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -62.2 | -41.6 | -179.3 | -77.5 | 97.7 | 0 | 0 | 0 | 112.7 | V214 L227 L241 I245 T248 | V214-W223 VanDerWaalsContact O-CD1 3.26Å; V214-W223 PolarHBondContact O-N 3.44Å; W223-L227 HydrophobicContact CE3-CD1 4.35Å; W223-L227 HydrophobicContact CE3-CG 4.43Å; W223-L227 VanDerWaalsContact O-CB 3.3Å; W223-L227 WeakPolarHBondContact O-CB 3.23Å; W223-L227 WeakPolarHBondContact O-CG 3.43Å; W223-L227 PolarHBondContact O-N 2.96Å; W223-L241 HydrophobicContact CE3-CD1 4.37Å; W223-L241 HydrophobicContact CH2-CD1 3.94Å; W223-L241 HydrophobicContact CZ3-CD1 3.69Å; W223-I245 HydrophobicContact CH2-CG1 4.27Å; W223-I245 HydrophobicContact CZ2-CG1 4.16Å; W223-T248 PolarHBondContact NE1-OG1 3.45Å |
| 224 | I | 95.5 | Very high | 93.4 | Very high | 82 Ų | 82 | 63.4 Ų | 63.4 | 42% | 0.421 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.2 | -56.4 | -177.8 | -62.9 | 169.3 | 0 | 0 | 0 | 110.4 | L215 L217 G222 T226 L227 E228 | L215-I224 HydrophobicContact CB-CD1 4.39Å; L215-I224 VanDerWaalsContact O-CB 3.26Å; L215-I224 WeakPolarHBondContact O-CB 3.5Å; L215-I224 WeakPolarHBondContact O-CD1 3.47Å; L215-I224 WeakPolarHBondContact O-CG1 3.47Å; L215-I224 PolarHBondContact O-N 3.25Å; L215-I224 VanDerWaalsContact O-N 3.07Å; L217-I224 HydrophobicContact CD2-CD1 3.93Å; L217-I224 HydrophobicContact CG-CD1 4.44Å; G222-I224 VanDerWaalsContact C-N 3.35Å; G222-I224 PolarHBondContact O-N 3.48Å; I224-T226 VanDerWaalsContact C-N 3.32Å; I224-T226 PolarHBondContact O-N 3.18Å; I224-L227 PolarHBondContact O-N 3.22Å; I224-E228 WeakPolarHBondContact O-CB 3.36Å; I224-E228 PolarHBondContact O-N 3.1Å |
| 225 | N | 94.8 | Very high | 93.4 | Very high | 25 Ų | 25 | 64.6 Ų | 64.6 | 13% | 0.134 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -68.8 | -32.8 | -176 | -48.6 | -40.7 | 0 | 0 | 0 | 111.7 | G216 N220 C221 H229 M240 | G216-N225 PolarHBondContact O-ND2 3.36Å; N220-N225 PolarHBondContact O-ND2 3.21Å; C221-N225 WeakPolarHBondContact O-CB 3.27Å; N225-H229 VanDerWaalsContact O-CB 3.27Å; N225-H229 WeakPolarHBondContact O-CB 3.46Å; N225-H229 PolarHBondContact O-N 2.94Å; N225-H229 VanDerWaalsContact O-N 3.15Å; N225-M240 HydrophobicContact CB-CE 4.01Å |
| 226 | T | 96.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.4 | -50.8 | 173.9 | -61.4 | 0 | 0 | 0 | 0 | 111.7 | C221 G222 I224 H229 F230 M240 L241 S244 | C221-T226 PolarHBondContact O-N 2.9Å; C221-T226 PolarHBondContact O-OG1 2.87Å; G222-T226 WeakPolarHBondContact O-CB 3.37Å; G222-T226 PolarHBondContact O-N 2.96Å; G222-T226 PolarHBondContact O-OG1 2.73Å; I224-T226 VanDerWaalsContact C-N 3.32Å; I224-T226 PolarHBondContact O-N 3.18Å; T226-H229 PolarHBondContact O-N 3.47Å; T226-F230 HydrophobicContact CG2-CD2 4.41Å; T226-F230 HydrophobicContact CG2-CE2 3.87Å; T226-F230 VanDerWaalsContact O-CD2 3.27Å; T226-F230 WeakPolarHBondContact O-CD2 3.37Å; T226-F230 PolarHBondContact O-N 3.08Å; T226-M240 HydrophobicContact CG2-CB 4.11Å; T226-M240 WeakPolarHBondContact OG1-CB 3.47Å; T226-M240 PolarHBondContact OG1-O 2.97Å; T226-L241 HydrophobicContact CG2-CB 3.67Å; T226-L241 HydrophobicContact CG2-CD1 4.03Å; T226-L241 HydrophobicContact CG2-CG 4.47Å; T226-S244 PolarHBondContact OG1-OG 3.47Å |
| 227 | L | 96 | Very high | 93.6 | Very high | 106 Ų | 106 | 60.7 Ų | 60.7 | 56% | 0.555 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -65.6 | -39.7 | -176.3 | -71.6 | 173.3 | 0 | 0 | 0 | 111.8 | W223 I224 H229 | W223-L227 HydrophobicContact CE3-CD1 4.35Å; W223-L227 HydrophobicContact CE3-CG 4.43Å; W223-L227 VanDerWaalsContact O-CB 3.3Å; W223-L227 WeakPolarHBondContact O-CB 3.23Å; W223-L227 WeakPolarHBondContact O-CG 3.43Å; W223-L227 PolarHBondContact O-N 2.96Å; I224-L227 PolarHBondContact O-N 3.22Å; L227-H229 VanDerWaalsContact C-N 3.33Å; L227-H229 PolarHBondContact O-N 3.42Å |
| 228 | E | 94.2 | Very high | 94.1 | Very high | 126 Ų | 126 | 58.2 Ų | 58.2 | 59% | 0.589 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -61.7 | -41.9 | 175.2 | -173.7 | 177.6 | 168.2 | 0 | 0 | 111.7 | I224 F230 S231 | I224-E228 WeakPolarHBondContact O-CB 3.36Å; I224-E228 PolarHBondContact O-N 3.1Å; E228-F230 VanDerWaalsContact C-N 3.31Å; E228-F230 PolarHBondContact O-N 2.92Å; E228-S231 PolarHBondContact O-N 2.98Å; E228-S231 PolarHBondContact O-OG 3.5Å |
| 229 | H | 95.6 | Very high | 94.9 | Very high | 6 Ų | 6 | 59 Ų | 59 | 3% | 0.028 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -74.4 | -16.5 | -173.5 | -158 | 65.4 | 0 | 0 | 0 | 114.6 | Y152 T155 N225 T226 L227 S231 R232 N233 A237 M240 | Y152-H229 HydrophobicContact CD2-CB 4.45Å; Y152-H229 AromaticContact CD2-CE1 3.7Å; Y152-H229 AromaticContact CD2-CG 3.83Å; Y152-H229 AromaticContact CD2-ND1 3.6Å; Y152-H229 AromaticContact CD2-NE2 3.99Å; Y152-H229 HydrophobicContact CE2-CB 4.42Å; Y152-H229 AromaticContact CE2-CE1 3.94Å; Y152-H229 AromaticContact CE2-ND1 3.51Å; T155-H229 PolarHBondContact OG1-CE1 2.85Å; T155-H229 PolarHBondContact OG1-NE2 3.22Å; N225-H229 VanDerWaalsContact O-CB 3.27Å; N225-H229 WeakPolarHBondContact O-CB 3.46Å; N225-H229 PolarHBondContact O-N 2.94Å; N225-H229 VanDerWaalsContact O-N 3.15Å; T226-H229 PolarHBondContact O-N 3.47Å; L227-H229 VanDerWaalsContact C-N 3.33Å; L227-H229 PolarHBondContact O-N 3.42Å; H229-S231 PolarHBondContact O-N 3.3Å; H229-R232 PolarHBondContact O-N 3.24Å; H229-N233 PolarHBondContact O-N 3.17Å; H229-A237 HydrophobicContact CB-CB 4.46Å; H229-M240 HydrophobicContact CB-CE 4.36Å; H229-M240 HydrophobicContact CB-SD 4.05Å |
| 230 | F | 95.9 | Very high | 95.6 | Very high | 69 Ų | 69 | 53 Ų | 53 | 30% | 0.303 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | -31.3 | 173.7 | -91.7 | -74.4 | 0 | 0 | 0 | 112.9 | T226 E228 R232 T234 A237 V238 L241 | T226-F230 HydrophobicContact CG2-CD2 4.41Å; T226-F230 HydrophobicContact CG2-CE2 3.87Å; T226-F230 VanDerWaalsContact O-CD2 3.27Å; T226-F230 WeakPolarHBondContact O-CD2 3.37Å; T226-F230 PolarHBondContact O-N 3.08Å; E228-F230 VanDerWaalsContact C-N 3.31Å; E228-F230 PolarHBondContact O-N 2.92Å; F230-R232 PolarHBondContact O-N 3.24Å; F230-T234 HydrophobicContact CD1-CG2 4.25Å; F230-T234 HydrophobicContact CE1-CG2 4.32Å; F230-A237 HydrophobicContact CB-CB 4.21Å; F230-A237 HydrophobicContact CD1-CB 3.62Å; F230-A237 HydrophobicContact CD2-CB 3.79Å; F230-A237 HydrophobicContact CE1-CB 3.82Å; F230-A237 HydrophobicContact CE2-CB 3.99Å; F230-A237 HydrophobicContact CG-CB 3.6Å; F230-A237 HydrophobicContact CZ-CB 3.99Å; F230-V238 HydrophobicContact CE1-CG2 4.17Å; F230-V238 HydrophobicContact CZ-CG2 4.48Å; F230-L241 HydrophobicContact CZ-CB 4.49Å; F230-L241 HydrophobicContact CZ-CD2 4.12Å |
| 231 | S | 93.5 | Very high | 96 | Very high | 113 Ų | 113 | 55 Ų | 55 | 79% | 0.79 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -18.4 | 176.8 | 67.8 | 0 | 0 | 0 | 0 | 113.5 | E228 H229 | E228-S231 PolarHBondContact O-N 2.98Å; E228-S231 PolarHBondContact O-OG 3.5Å; H229-S231 PolarHBondContact O-N 3.3Å |
| 232 | R | 93.3 | Very high | 96.1 | Very high | 166 Ų | 166 | 60.8 Ų | 60.8 | 63% | 0.626 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.4 | -48.6 | -169.4 | -146.7 | 177.9 | -170.4 | -168.9 | -2 | 112.5 | G156 H229 F230 | G156-R232 PolarHBondContact O-NH1 3.03Å; H229-R232 PolarHBondContact O-N 3.24Å; F230-R232 PolarHBondContact O-N 3.24Å |
| 233 | N | 96.1 | Very high | 96.2 | Very high | 63 Ų | 63 | 61 Ų | 61 | 34% | 0.337 | 33% | 0.326 | S | S | . | . | trans | -149.4 | 105.7 | 175.9 | -171.3 | -61.9 | 0 | 0 | 0 | 110.6 | T155 H229 G235 A236 A237 | T155-N233 HydrophobicContact CG2-CB 4.05Å; T155-N233 WeakPolarHBondContact CG2-ND2 3.44Å; H229-N233 PolarHBondContact O-N 3.17Å; N233-G235 VanDerWaalsContact C-N 3.3Å; N233-G235 PolarHBondContact O-N 2.91Å; N233-G235 PolarHBondContact OD1-N 2.8Å; N233-G235 VanDerWaalsContact OD1-N 3.07Å; N233-A236 HydrophobicContact CB-CB 4.27Å; N233-A236 PolarHBondContact O-N 3.17Å; N233-A236 PolarHBondContact OD1-N 3.36Å; N233-A237 WeakPolarHBondContact O-CB 3.46Å; N233-A237 PolarHBondContact O-N 2.85Å | ||
| 234 | T | 95.8 | Very high | 96.3 | Very high | 92 Ų | 92 | 56.8 Ų | 56.8 | 56% | 0.564 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -60 | -38.5 | -178.3 | -46.6 | 0 | 0 | 0 | 0 | 112.7 | F230 A237 V238 | F230-T234 HydrophobicContact CD1-CG2 4.25Å; F230-T234 HydrophobicContact CE1-CG2 4.32Å; T234-A237 PolarHBondContact O-N 3.38Å; T234-V238 WeakPolarHBondContact O-CG2 3.35Å; T234-V238 PolarHBondContact O-N 3.16Å |
| 235 | G | 96.2 | Very high | 96.4 | Very high | 48 Ų | 48 | 56.9 Ų | 56.9 | 50% | 0.495 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.4 | -49.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | N233 V238 V239 | N233-G235 VanDerWaalsContact C-N 3.3Å; N233-G235 PolarHBondContact O-N 2.91Å; N233-G235 PolarHBondContact OD1-N 2.8Å; N233-G235 VanDerWaalsContact OD1-N 3.07Å; G235-V238 PolarHBondContact O-N 3.45Å; G235-V239 PolarHBondContact O-N 3.17Å |
| 236 | A | 96.6 | Very high | 96.5 | Very high | 6 Ų | 6 | 56.3 Ų | 56.3 | 5% | 0.05 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.4 | -40.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A151 T155 N233 V238 V239 M240 | A151-A236 HydrophobicContact CB-CB 4.07Å; T155-A236 HydrophobicContact CG2-CB 3.84Å; T155-A236 WeakPolarHBondContact OG1-CB 3.36Å; N233-A236 HydrophobicContact CB-CB 4.27Å; N233-A236 PolarHBondContact O-N 3.17Å; N233-A236 PolarHBondContact OD1-N 3.36Å; A236-V238 VanDerWaalsContact C-N 3.31Å; A236-V238 PolarHBondContact O-N 3.37Å; A236-V239 PolarHBondContact O-N 3.06Å; A236-V239 VanDerWaalsContact O-N 3.14Å; A236-M240 WeakPolarHBondContact O-CG 3.43Å; A236-M240 PolarHBondContact O-N 3.22Å |
| 237 | A | 97.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.8 | -36.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | H229 F230 N233 T234 V239 M240 L241 | H229-A237 HydrophobicContact CB-CB 4.46Å; F230-A237 HydrophobicContact CB-CB 4.21Å; F230-A237 HydrophobicContact CD1-CB 3.62Å; F230-A237 HydrophobicContact CD2-CB 3.79Å; F230-A237 HydrophobicContact CE1-CB 3.82Å; F230-A237 HydrophobicContact CE2-CB 3.99Å; F230-A237 HydrophobicContact CG-CB 3.6Å; F230-A237 HydrophobicContact CZ-CB 3.99Å; N233-A237 WeakPolarHBondContact O-CB 3.46Å; N233-A237 PolarHBondContact O-N 2.85Å; T234-A237 PolarHBondContact O-N 3.38Å; A237-V239 PolarHBondContact O-N 3.2Å; A237-M240 PolarHBondContact O-N 2.92Å; A237-L241 WeakPolarHBondContact O-CB 3.36Å; A237-L241 PolarHBondContact O-N 3.34Å |
| 238 | V | 97.9 | Very high | 96.6 | Very high | 70 Ų | 70 | 53.3 Ų | 53.3 | 42% | 0.424 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 173.9 | 170.1 | 0 | 0 | 0 | 0 | 111.7 | F230 T234 G235 A236 L241 L242 | F230-V238 HydrophobicContact CE1-CG2 4.17Å; F230-V238 HydrophobicContact CZ-CG2 4.48Å; T234-V238 WeakPolarHBondContact O-CG2 3.35Å; T234-V238 PolarHBondContact O-N 3.16Å; G235-V238 PolarHBondContact O-N 3.45Å; A236-V238 VanDerWaalsContact C-N 3.31Å; A236-V238 PolarHBondContact O-N 3.37Å; V238-L241 WeakPolarHBondContact O-CB 3.42Å; V238-L241 PolarHBondContact O-N 2.72Å; V238-L242 PolarHBondContact O-N 3.4Å |
| 239 | V | 97.4 | Very high | 96.8 | Very high | 51 Ų | 51 | 53.1 Ų | 53.1 | 31% | 0.309 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.8 | -44.3 | 176.2 | -178.9 | 0 | 0 | 0 | 0 | 110.7 | I147 A151 G235 A236 A237 L241 L242 V243 | I147-V239 HydrophobicContact CG2-CG1 4.21Å; A151-V239 HydrophobicContact CB-CB 4.49Å; G235-V239 PolarHBondContact O-N 3.17Å; A236-V239 PolarHBondContact O-N 3.06Å; A236-V239 VanDerWaalsContact O-N 3.14Å; A237-V239 PolarHBondContact O-N 3.2Å; V239-L241 VanDerWaalsContact C-N 3.28Å; V239-L241 PolarHBondContact O-N 3.23Å; V239-L242 PolarHBondContact O-N 3.27Å; V239-V243 PolarHBondContact O-N 2.82Å |
| 240 | M | 97.4 | Very high | 96.9 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61.3 | -37.2 | 175.3 | -65.3 | 171 | 71.1 | 0 | 0 | 111.8 | Y152 C221 N225 T226 H229 A236 A237 L242 V243 S244 | Y152-M240 HydrophobicContact CD2-CE 3.67Å; Y152-M240 HydrophobicContact CD2-SD 3.73Å; Y152-M240 HydrophobicContact CE2-CE 4.28Å; Y152-M240 HydrophobicContact CG-CE 3.93Å; Y152-M240 HydrophobicContact CG-SD 4.07Å; C221-M240 HydrophobicContact CB-CB 4.07Å; C221-M240 HydrophobicContact CB-CG 4.35Å; N225-M240 HydrophobicContact CB-CE 4.01Å; T226-M240 HydrophobicContact CG2-CB 4.11Å; T226-M240 WeakPolarHBondContact OG1-CB 3.47Å; T226-M240 PolarHBondContact OG1-O 2.97Å; H229-M240 HydrophobicContact CB-CE 4.36Å; H229-M240 HydrophobicContact CB-SD 4.05Å; A236-M240 WeakPolarHBondContact O-CG 3.43Å; A236-M240 PolarHBondContact O-N 3.22Å; A237-M240 PolarHBondContact O-N 2.92Å; M240-L242 PolarHBondContact O-N 2.94Å; M240-V243 WeakPolarHBondContact O-CB 3.13Å; M240-V243 PolarHBondContact O-N 3.47Å; M240-S244 PolarHBondContact O-N 3.26Å; M240-S244 PolarHBondContact O-OG 3.12Å; M240-S244 VanDerWaalsContact O-OG 3.08Å |
| 241 | L | 97.8 | Very high | 97 | Very high | 44 Ų | 44 | 50.1 Ų | 50.1 | 23% | 0.23 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 177.7 | -177.9 | 65.5 | 0 | 0 | 0 | 112.2 | W223 T226 F230 A237 V238 V239 V243 S244 I245 | W223-L241 HydrophobicContact CE3-CD1 4.37Å; W223-L241 HydrophobicContact CH2-CD1 3.94Å; W223-L241 HydrophobicContact CZ3-CD1 3.69Å; T226-L241 HydrophobicContact CG2-CB 3.67Å; T226-L241 HydrophobicContact CG2-CD1 4.03Å; T226-L241 HydrophobicContact CG2-CG 4.47Å; F230-L241 HydrophobicContact CZ-CB 4.49Å; F230-L241 HydrophobicContact CZ-CD2 4.12Å; A237-L241 WeakPolarHBondContact O-CB 3.36Å; A237-L241 PolarHBondContact O-N 3.34Å; V238-L241 WeakPolarHBondContact O-CB 3.42Å; V238-L241 PolarHBondContact O-N 2.72Å; V239-L241 VanDerWaalsContact C-N 3.28Å; V239-L241 PolarHBondContact O-N 3.23Å; L241-V243 VanDerWaalsContact C-N 3.26Å; L241-V243 PolarHBondContact O-N 3.28Å; L241-S244 PolarHBondContact O-N 2.9Å; L241-I245 HydrophobicContact CD1-CD1 4.24Å; L241-I245 HydrophobicContact CD1-CG1 4.35Å; L241-I245 HydrophobicContact CG-CD1 3.92Å; L241-I245 HydrophobicContact CG-CG1 4.44Å; L241-I245 WeakPolarHBondContact O-CG1 3.08Å; L241-I245 PolarHBondContact O-N 2.88Å |
| 242 | L | 97.9 | Very high | 97.2 | Very high | 121 Ų | 121 | 48.4 Ų | 48.4 | 63% | 0.634 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -59.5 | -39.7 | 175.9 | -67 | 175 | 0 | 0 | 0 | 111.5 | V238 V239 M240 G246 | V238-L242 PolarHBondContact O-N 3.4Å; V239-L242 PolarHBondContact O-N 3.27Å; M240-L242 PolarHBondContact O-N 2.94Å; L242-G246 PolarHBondContact O-N 3.47Å |
| 243 | V | 97.7 | Very high | 97.5 | Very high | 4 Ų | 4 | 41.3 Ų | 41.3 | 2% | 0.024 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -66.1 | -45.5 | 176 | 178.9 | 0 | 0 | 0 | 0 | 110.9 | V141 A144 N145 C221 V239 M240 L241 I245 G246 Y247 | V141-V243 HydrophobicContact CG1-CG1 4.45Å; A144-V243 HydrophobicContact CB-CG2 4.01Å; A144-V243 VanDerWaalsContact O-CG2 3.31Å; A144-V243 WeakPolarHBondContact O-CG2 3.19Å; N145-V243 HydrophobicContact CB-CG1 3.66Å; C221-V243 HydrophobicContact CB-CB 3.84Å; C221-V243 HydrophobicContact CB-CG1 3.76Å; V239-V243 PolarHBondContact O-N 2.82Å; M240-V243 WeakPolarHBondContact O-CB 3.13Å; M240-V243 PolarHBondContact O-N 3.47Å; L241-V243 VanDerWaalsContact C-N 3.26Å; L241-V243 PolarHBondContact O-N 3.28Å; V243-I245 PolarHBondContact O-N 3.46Å; V243-G246 WeakPolarHBondContact O-CA 3.11Å; V243-G246 PolarHBondContact O-N 3.31Å; V243-G246 VanDerWaalsContact O-N 3.14Å; V243-Y247 HydrophobicContact CG1-CD2 3.73Å; V243-Y247 HydrophobicContact CG1-CE2 3.52Å; V243-Y247 WeakPolarHBondContact O-CD2 3.49Å; V243-Y247 PolarHBondContact O-N 3.19Å |
| 244 | S | 98.1 | Very high | 97.5 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.7 | -45.4 | 179 | -62 | 0 | 0 | 0 | 0 | 112.2 | G222 T226 M240 L241 G246 Y247 T248 | G222-S244 VanDerWaalsContact CA-OG 3.31Å; G222-S244 WeakPolarHBondContact CA-OG 3.33Å; G222-S244 PolarHBondContact N-OG 3.46Å; G222-S244 PolarHBondContact O-OG 2.76Å; T226-S244 PolarHBondContact OG1-OG 3.47Å; M240-S244 PolarHBondContact O-N 3.26Å; M240-S244 PolarHBondContact O-OG 3.12Å; M240-S244 VanDerWaalsContact O-OG 3.08Å; L241-S244 PolarHBondContact O-N 2.9Å; S244-G246 VanDerWaalsContact C-N 3.32Å; S244-G246 PolarHBondContact O-N 3.2Å; S244-Y247 PolarHBondContact O-N 3.41Å; S244-T248 PolarHBondContact O-N 3.48Å; S244-T248 PolarHBondContact O-OG1 3.02Å; S244-T248 VanDerWaalsContact O-OG1 3.08Å |
| 245 | I | 98.2 | Very high | 97.6 | Very high | 84 Ų | 84 | 37.8 Ų | 37.8 | 43% | 0.431 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -60.7 | -43.6 | 172.9 | -68 | 168.8 | 0 | 0 | 0 | 110.4 | W223 L241 V243 Y247 T248 F249 | W223-I245 HydrophobicContact CH2-CG1 4.27Å; W223-I245 HydrophobicContact CZ2-CG1 4.16Å; L241-I245 HydrophobicContact CD1-CD1 4.24Å; L241-I245 HydrophobicContact CD1-CG1 4.35Å; L241-I245 HydrophobicContact CG-CD1 3.92Å; L241-I245 HydrophobicContact CG-CG1 4.44Å; L241-I245 WeakPolarHBondContact O-CG1 3.08Å; L241-I245 PolarHBondContact O-N 2.88Å; V243-I245 PolarHBondContact O-N 3.46Å; I245-Y247 PolarHBondContact O-N 2.9Å; I245-T248 PolarHBondContact O-N 3.1Å; I245-F249 WeakPolarHBondContact O-CB 3.4Å; I245-F249 PolarHBondContact O-N 3.17Å |
| 246 | G | 97.8 | Very high | 97.7 | Very high | 13 Ų | 13 | 41.5 Ų | 41.5 | 13% | 0.134 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -58.4 | -45.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | L242 V243 S244 F249 C250 | L242-G246 PolarHBondContact O-N 3.47Å; V243-G246 WeakPolarHBondContact O-CA 3.11Å; V243-G246 PolarHBondContact O-N 3.31Å; V243-G246 VanDerWaalsContact O-N 3.14Å; S244-G246 VanDerWaalsContact C-N 3.32Å; S244-G246 PolarHBondContact O-N 3.2Å; G246-F249 PolarHBondContact O-N 2.96Å; G246-C250 PolarHBondContact O-N 2.83Å; G246-C250 PolarHBondContact O-SG 3.36Å |
| 247 | Y | 97.2 | Very high | 97.8 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.7 | -39.3 | 175.7 | -80.4 | -56.4 | 0 | 0 | 0 | 111.8 | Y138 V141 N145 Q213 V214 N220 V243 S244 I245 F249 C250 G251 | Y138-Y247 HydrophobicContact CE2-CD1 4.37Å; Y138-Y247 HydrophobicContact CE2-CE1 4.04Å; V141-Y247 HydrophobicContact CG1-CD1 3.59Å; V141-Y247 HydrophobicContact CG1-CD2 3.84Å; V141-Y247 HydrophobicContact CG1-CE1 3.67Å; V141-Y247 HydrophobicContact CG1-CE2 3.95Å; V141-Y247 HydrophobicContact CG1-CG 3.65Å; N145-Y247 HydrophobicContact CB-CE2 3.99Å; N145-Y247 WeakPolarHBondContact CB-OH 3.39Å; Q213-Y247 HydrophobicContact CB-CD1 4.06Å; Q213-Y247 HydrophobicContact CB-CD2 4.31Å; Q213-Y247 HydrophobicContact CB-CE1 4.17Å; Q213-Y247 HydrophobicContact CB-CE2 4.4Å; Q213-Y247 HydrophobicContact CB-CG 4.15Å; Q213-Y247 HydrophobicContact CG-CE1 4.41Å; Q213-Y247 VanDerWaalsContact OE1-CD1 3.3Å; V214-Y247 VanDerWaalsContact CG2-C 3.44Å; V214-Y247 WeakPolarHBondContact CG2-O 3.39Å; N220-Y247 PolarHBondContact OD1-OH 3.35Å; V243-Y247 HydrophobicContact CG1-CD2 3.73Å; V243-Y247 HydrophobicContact CG1-CE2 3.52Å; V243-Y247 WeakPolarHBondContact O-CD2 3.49Å; V243-Y247 PolarHBondContact O-N 3.19Å; S244-Y247 PolarHBondContact O-N 3.41Å; I245-Y247 PolarHBondContact O-N 2.9Å; Y247-F249 VanDerWaalsContact C-N 3.35Å; Y247-C250 PolarHBondContact O-N 3.34Å; Y247-G251 PolarHBondContact O-N 2.88Å |
| 248 | T | 98 | Very high | 97.8 | Very high | 44 Ų | 44 | 42.5 Ų | 42.5 | 27% | 0.27 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.6 | -45.1 | 175.3 | -60.7 | 0 | 0 | 0 | 0 | 111 | V214 W223 S244 I245 C250 G251 V252 | V214-T248 WeakPolarHBondContact CG1-OG1 3.44Å; W223-T248 PolarHBondContact NE1-OG1 3.45Å; S244-T248 PolarHBondContact O-N 3.48Å; S244-T248 PolarHBondContact O-OG1 3.02Å; S244-T248 VanDerWaalsContact O-OG1 3.08Å; I245-T248 PolarHBondContact O-N 3.1Å; T248-C250 VanDerWaalsContact C-N 3.33Å; T248-C250 PolarHBondContact O-N 3.18Å; T248-G251 PolarHBondContact O-N 3.5Å; T248-V252 HydrophobicContact CG2-CG2 4.44Å; T248-V252 WeakPolarHBondContact O-CG2 3.46Å; T248-V252 PolarHBondContact O-N 3.14Å |
| 249 | F | 98.3 | Very high | 97.7 | Very high | 121 Ų | 121 | 45.3 Ų | 45.3 | 53% | 0.531 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -58.7 | -44.7 | 174.9 | 178.7 | -93 | 0 | 0 | 0 | 111.6 | I137 I245 G246 Y247 G253 | I137-F249 HydrophobicContact CD1-CE1 4Å; I137-F249 HydrophobicContact CG2-CD1 4.12Å; I137-F249 HydrophobicContact CG2-CE1 4.2Å; I245-F249 WeakPolarHBondContact O-CB 3.4Å; I245-F249 PolarHBondContact O-N 3.17Å; G246-F249 PolarHBondContact O-N 2.96Å; Y247-F249 VanDerWaalsContact C-N 3.35Å; F249-G253 PolarHBondContact O-N 3.46Å |
| 250 | C | 97.3 | Very high | 97.6 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62 | -44.6 | 176 | -67.2 | 0 | 0 | 0 | 0 | 112.1 | Y138 G246 Y247 T248 G253 M254 | Y138-C250 HydrophobicContact CD2-CB 4.21Å; G246-C250 PolarHBondContact O-N 2.83Å; G246-C250 PolarHBondContact O-SG 3.36Å; Y247-C250 PolarHBondContact O-N 3.34Å; T248-C250 VanDerWaalsContact C-N 3.33Å; T248-C250 PolarHBondContact O-N 3.18Å; C250-G253 PolarHBondContact O-N 2.91Å; C250-M254 WeakPolarHBondContact O-CB 3.21Å; C250-M254 VanDerWaalsContact O-CG 3.31Å; C250-M254 WeakPolarHBondContact O-CG 3.01Å; C250-M254 PolarHBondContact O-N 3.41Å |
| 251 | G | 97.6 | Very high | 97.6 | Very high | 12 Ų | 12 | 48.8 Ų | 48.8 | 12% | 0.124 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63 | -46.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | L207 Y247 T248 M254 L255 | L207-G251 WeakPolarHBondContact CD1-O 3.26Å; Y247-G251 PolarHBondContact O-N 2.88Å; T248-G251 PolarHBondContact O-N 3.5Å; G251-M254 PolarHBondContact O-N 3.41Å; G251-L255 WeakPolarHBondContact O-CB 3.39Å; G251-L255 PolarHBondContact O-N 2.87Å |
| 252 | V | 98.3 | Very high | 97.3 | Very high | 78 Ų | 78 | 49.8 Ų | 49.8 | 47% | 0.473 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.7 | -45.8 | 174.7 | 174 | 0 | 0 | 0 | 0 | 110.6 | T248 M254 L255 M256 | T248-V252 HydrophobicContact CG2-CG2 4.44Å; T248-V252 WeakPolarHBondContact O-CG2 3.46Å; T248-V252 PolarHBondContact O-N 3.14Å; V252-M254 VanDerWaalsContact C-N 3.31Å; V252-M254 PolarHBondContact O-N 3.09Å; V252-L255 PolarHBondContact O-N 3.4Å; V252-M256 HydrophobicContact CG1-CG 4.33Å; V252-M256 HydrophobicContact CG1-SD 3.93Å; V252-M256 WeakPolarHBondContact O-CB 3.33Å; V252-M256 VanDerWaalsContact O-CG 3.29Å; V252-M256 WeakPolarHBondContact O-CG 3.47Å; V252-M256 PolarHBondContact O-N 3.34Å |
| 253 | G | 98.1 | Very high | 97.1 | Very high | 16 Ų | 16 | 53.7 Ų | 53.7 | 17% | 0.165 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.3 | -39.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L134 F249 C250 M256 L257 | L134-G253 VanDerWaalsContact CD2-C 3.44Å; F249-G253 PolarHBondContact O-N 3.46Å; C250-G253 PolarHBondContact O-N 2.91Å; G253-M256 PolarHBondContact O-N 3.22Å; G253-L257 VanDerWaalsContact O-CB 3.27Å; G253-L257 WeakPolarHBondContact O-CB 3.27Å; G253-L257 PolarHBondContact O-N 3.45Å |
| 254 | M | 97.6 | Very high | 96.8 | Very high | 14 Ų | 14 | 55 Ų | 55 | 7% | 0.069 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.9 | -44.3 | 177.2 | -81 | -173 | 158.4 | 0 | 0 | 111.4 | L134 W180 Q206 L207 V210 C250 G251 V252 L257 L258 | L134-M254 HydrophobicContact CD2-CB 4.29Å; L134-M254 HydrophobicContact CD2-CG 3.67Å; L134-M254 HydrophobicContact CG-CG 4.38Å; W180-M254 HydrophobicContact CD2-CE 4.27Å; W180-M254 HydrophobicContact CH2-CE 4.01Å; W180-M254 HydrophobicContact CZ2-CE 3.52Å; Q206-M254 HydrophobicContact CG-CE 3.55Å; Q206-M254 HydrophobicContact CG-SD 3.78Å; L207-M254 HydrophobicContact CD1-CB 4.1Å; V210-M254 HydrophobicContact CG2-SD 3.77Å; C250-M254 WeakPolarHBondContact O-CB 3.21Å; C250-M254 VanDerWaalsContact O-CG 3.31Å; C250-M254 WeakPolarHBondContact O-CG 3.01Å; C250-M254 PolarHBondContact O-N 3.41Å; G251-M254 PolarHBondContact O-N 3.41Å; V252-M254 VanDerWaalsContact C-N 3.31Å; V252-M254 PolarHBondContact O-N 3.09Å; M254-L257 PolarHBondContact O-N 3.13Å; M254-L258 WeakPolarHBondContact O-CB 3.36Å; M254-L258 PolarHBondContact O-N 3Å |
| 255 | L | 98 | Very high | 96.4 | Very high | 68 Ų | 68 | 55.7 Ų | 55.7 | 36% | 0.356 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | 176 | -177.9 | 61.3 | 0 | 0 | 0 | 111.6 | L207 G251 V252 L258 F259 | L207-L255 HydrophobicContact CD1-CB 4.14Å; L207-L255 HydrophobicContact CD2-CB 4.47Å; L207-L255 HydrophobicContact CD2-CD1 3.85Å; G251-L255 WeakPolarHBondContact O-CB 3.39Å; G251-L255 PolarHBondContact O-N 2.87Å; V252-L255 PolarHBondContact O-N 3.4Å; L255-L258 WeakPolarHBondContact O-CB 3.47Å; L255-L258 PolarHBondContact O-N 3.03Å; L255-F259 HydrophobicContact CD1-CD2 4Å; L255-F259 HydrophobicContact CD1-CE2 3.4Å; L255-F259 VanDerWaalsContact CD1-CE2 3.4Å; L255-F259 HydrophobicContact CD1-CZ 3.94Å; L255-F259 HydrophobicContact CD2-CE2 4.29Å; L255-F259 HydrophobicContact CG-CD2 4.02Å; L255-F259 HydrophobicContact CG-CE2 3.65Å; L255-F259 VanDerWaalsContact O-CD2 3.23Å; L255-F259 WeakPolarHBondContact O-CD2 3.4Å; L255-F259 PolarHBondContact O-N 3.27Å; L255-F259 VanDerWaalsContact O-N 3.08Å |
| 256 | M | 97.9 | Very high | 95.9 | Very high | 126 Ų | 126 | 60.1 Ų | 60.1 | 62% | 0.621 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -62.5 | -43.4 | 176 | -72.1 | 178.3 | 70.2 | 0 | 0 | 112 | V252 G253 F259 R260 | V252-M256 HydrophobicContact CG1-CG 4.33Å; V252-M256 HydrophobicContact CG1-SD 3.93Å; V252-M256 WeakPolarHBondContact O-CB 3.33Å; V252-M256 VanDerWaalsContact O-CG 3.29Å; V252-M256 WeakPolarHBondContact O-CG 3.47Å; V252-M256 PolarHBondContact O-N 3.34Å; G253-M256 PolarHBondContact O-N 3.22Å; M256-F259 PolarHBondContact O-N 3.07Å; M256-R260 WeakPolarHBondContact O-CB 3.43Å; M256-R260 PolarHBondContact O-N 3.24Å |
| 257 | L | 97.8 | Very high | 95.4 | Very high | 1 Ų | 1 | 63.9 Ų | 63.9 | 1% | 0.005 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63 | -45.3 | 176.7 | 178.7 | 65.9 | 0 | 0 | 0 | 110.9 | I127 M130 L134 W180 L184 Y199 G253 M254 F259 R260 V261 | I127-L257 HydrophobicContact CG1-CD1 3.89Å; M130-L257 HydrophobicContact CE-CB 3.92Å; M130-L257 HydrophobicContact CE-CD1 3.24Å; M130-L257 HydrophobicContact CE-CG 4.15Å; L134-L257 HydrophobicContact CD2-CB 4.38Å; L134-L257 HydrophobicContact CD2-CD2 4.02Å; W180-L257 HydrophobicContact CZ3-CD2 4.34Å; L184-L257 HydrophobicContact CD2-CD2 4.14Å; Y199-L257 WeakPolarHBondContact OH-CG 3.4Å; G253-L257 VanDerWaalsContact O-CB 3.27Å; G253-L257 WeakPolarHBondContact O-CB 3.27Å; G253-L257 PolarHBondContact O-N 3.45Å; M254-L257 PolarHBondContact O-N 3.13Å; L257-F259 PolarHBondContact O-N 2.98Å; L257-R260 PolarHBondContact O-N 3.41Å; L257-R260 VanDerWaalsContact O-N 3.13Å; L257-V261 HydrophobicContact CD1-CG2 3.96Å; L257-V261 HydrophobicContact CG-CG2 4.23Å; L257-V261 VanDerWaalsContact O-CG2 3.28Å; L257-V261 WeakPolarHBondContact O-CG2 3.44Å; L257-V261 PolarHBondContact O-N 2.85Å |
| 258 | L | 96.8 | Very high | 94.4 | Very high | 26 Ų | 26 | 66.7 Ų | 66.7 | 14% | 0.136 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -54.3 | -52.2 | 176.7 | 179.5 | 72.7 | 0 | 0 | 0 | 111.1 | Y199 F200 S203 M254 L255 R260 V261 H262 | Y199-L258 HydrophobicContact CE1-CD1 4.44Å; F200-L258 HydrophobicContact CD1-CD1 3.86Å; S203-L258 WeakPolarHBondContact OG-CD1 3.36Å; M254-L258 WeakPolarHBondContact O-CB 3.36Å; M254-L258 PolarHBondContact O-N 3Å; L255-L258 WeakPolarHBondContact O-CB 3.47Å; L255-L258 PolarHBondContact O-N 3.03Å; L258-R260 VanDerWaalsContact C-N 3.32Å; L258-R260 PolarHBondContact O-N 3.49Å; L258-V261 PolarHBondContact O-N 3.1Å; L258-H262 VanDerWaalsContact O-CB 3.27Å; L258-H262 WeakPolarHBondContact O-CB 3.42Å; L258-H262 PolarHBondContact O-N 2.83Å |
| 259 | F | 96.6 | Very high | 93 | Very high | 128 Ų | 128 | 67.6 Ų | 67.6 | 56% | 0.561 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -62.9 | -37.8 | 177.7 | -74.2 | -51.7 | 0 | 0 | 0 | 112.7 | L255 M256 L257 H262 R263 | L255-F259 HydrophobicContact CD1-CD2 4Å; L255-F259 HydrophobicContact CD1-CE2 3.4Å; L255-F259 VanDerWaalsContact CD1-CE2 3.4Å; L255-F259 HydrophobicContact CD1-CZ 3.94Å; L255-F259 HydrophobicContact CD2-CE2 4.29Å; L255-F259 HydrophobicContact CG-CD2 4.02Å; L255-F259 HydrophobicContact CG-CE2 3.65Å; L255-F259 VanDerWaalsContact O-CD2 3.23Å; L255-F259 WeakPolarHBondContact O-CD2 3.4Å; L255-F259 PolarHBondContact O-N 3.27Å; L255-F259 VanDerWaalsContact O-N 3.08Å; M256-F259 PolarHBondContact O-N 3.07Å; L257-F259 PolarHBondContact O-N 2.98Å; F259-H262 PolarHBondContact O-N 3.38Å; F259-R263 WeakPolarHBondContact O-CB 3.49Å; F259-R263 PolarHBondContact O-N 3.28Å |
| 260 | R | 95.9 | Very high | 91.3 | Very high | 125 Ų | 125 | 62.3 Ų | 62.3 | 47% | 0.472 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66 | -45.7 | 178 | -167.2 | -177.3 | 179.8 | 84.9 | 6 | 111.7 | I127 M130 M256 L257 L258 R263 V264 | I127-R260 HydrophobicContact CD1-CB 4.23Å; I127-R260 HydrophobicContact CD1-CG 3.8Å; M130-R260 HydrophobicContact CE-CB 4.48Å; M256-R260 WeakPolarHBondContact O-CB 3.43Å; M256-R260 PolarHBondContact O-N 3.24Å; L257-R260 PolarHBondContact O-N 3.41Å; L257-R260 VanDerWaalsContact O-N 3.13Å; L258-R260 VanDerWaalsContact C-N 3.32Å; L258-R260 PolarHBondContact O-N 3.49Å; R260-R263 PolarHBondContact O-N 3.29Å; R260-V264 WeakPolarHBondContact O-CG2 3.36Å; R260-V264 PolarHBondContact O-N 3.43Å; R260-V264 VanDerWaalsContact O-N 3.08Å |
| 261 | V | 95.7 | Very high | 89.5 | Confident | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.1 | -44.3 | 177.1 | 177.2 | 0 | 0 | 0 | 0 | 109.9 | I127 L184 F188 F196 Y199 F200 L257 L258 R263 V264 Y265 | I127-V261 HydrophobicContact CD1-CB 4.24Å; I127-V261 HydrophobicContact CD1-CG2 3.52Å; I127-V261 HydrophobicContact CG1-CG2 4Å; L184-V261 HydrophobicContact CD1-CG1 4.15Å; L184-V261 HydrophobicContact CD1-CG2 3.61Å; F188-V261 HydrophobicContact CE2-CG1 4.02Å; F188-V261 HydrophobicContact CE2-CG2 4.12Å; F188-V261 HydrophobicContact CZ-CG1 4Å; F188-V261 HydrophobicContact CZ-CG2 4.38Å; F196-V261 HydrophobicContact CD1-CG1 3.94Å; F196-V261 HydrophobicContact CE1-CG1 3.9Å; Y199-V261 HydrophobicContact CD1-CG1 3.88Å; Y199-V261 HydrophobicContact CE1-CB 3.82Å; Y199-V261 HydrophobicContact CE1-CG1 3.67Å; Y199-V261 HydrophobicContact CE1-CG2 3.88Å; F200-V261 HydrophobicContact CE1-CB 4.14Å; F200-V261 HydrophobicContact CE1-CG1 3.69Å; F200-V261 HydrophobicContact CZ-CG1 4.01Å; L257-V261 HydrophobicContact CD1-CG2 3.96Å; L257-V261 HydrophobicContact CG-CG2 4.23Å; L257-V261 VanDerWaalsContact O-CG2 3.28Å; L257-V261 WeakPolarHBondContact O-CG2 3.44Å; L257-V261 PolarHBondContact O-N 2.85Å; L258-V261 PolarHBondContact O-N 3.1Å; V261-R263 VanDerWaalsContact C-N 3.31Å; V261-R263 PolarHBondContact O-N 3.34Å; V261-V264 PolarHBondContact O-N 3.39Å; V261-Y265 WeakPolarHBondContact O-CB 3.45Å; V261-Y265 PolarHBondContact O-N 2.72Å |
| 262 | H | 93.6 | Very high | 88.1 | Confident | 65 Ų | 65 | 71.4 Ų | 71.4 | 30% | 0.301 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -60.4 | -40.4 | 177.2 | -179.6 | -105.1 | 0 | 0 | 0 | 112.1 | F200 L258 F259 Y265 R266 | F200-H262 HydrophobicContact CE1-CB 3.91Å; F200-H262 HydrophobicContact CZ-CB 4.19Å; L258-H262 VanDerWaalsContact O-CB 3.27Å; L258-H262 WeakPolarHBondContact O-CB 3.42Å; L258-H262 PolarHBondContact O-N 2.83Å; F259-H262 PolarHBondContact O-N 3.38Å; H262-Y265 PolarHBondContact O-N 3.29Å; H262-R266 PolarHBondContact CE1-NH1 3.4Å; H262-R266 VanDerWaalsContact CE1-NH1 3.35Å; H262-R266 PolarHBondContact NE2-NH1 2.97Å; H262-R266 PolarHBondContact O-N 2.74Å |
| 263 | R | 92.4 | Very high | 86.8 | Confident | 202 Ų | 202 | 70.6 Ų | 70.6 | 76% | 0.762 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -61.6 | -45.1 | 174.1 | -178.6 | 176 | 178.5 | 165.1 | 0.6 | 112 | F259 R260 V261 R266 S267 | F259-R263 WeakPolarHBondContact O-CB 3.49Å; F259-R263 PolarHBondContact O-N 3.28Å; R260-R263 PolarHBondContact O-N 3.29Å; V261-R263 VanDerWaalsContact C-N 3.31Å; V261-R263 PolarHBondContact O-N 3.34Å; R263-R266 PolarHBondContact O-N 3.5Å; R263-S267 WeakPolarHBondContact O-CB 3.31Å; R263-S267 PolarHBondContact O-N 3.13Å; R263-S267 PolarHBondContact O-OG 3.4Å |
| 264 | V | 91.7 | Very high | 85.8 | Confident | 31 Ų | 31 | 72.7 Ų | 72.7 | 19% | 0.188 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.6 | -48.8 | 177 | 175.6 | 0 | 0 | 0 | 0 | 110.3 | Y124 I127 F188 R260 V261 R266 S267 T268 | Y124-V264 HydrophobicContact CD1-CG1 4.19Å; Y124-V264 HydrophobicContact CE1-CG1 3.72Å; I127-V264 HydrophobicContact CD1-CG2 4.22Å; F188-V264 HydrophobicContact CE1-CG1 3.84Å; F188-V264 HydrophobicContact CZ-CG1 4.34Å; R260-V264 WeakPolarHBondContact O-CG2 3.36Å; R260-V264 PolarHBondContact O-N 3.43Å; R260-V264 VanDerWaalsContact O-N 3.08Å; V261-V264 PolarHBondContact O-N 3.39Å; V264-R266 VanDerWaalsContact C-N 3.31Å; V264-R266 PolarHBondContact O-N 3.38Å; V264-S267 WeakPolarHBondContact CA-OG 3.13Å; V264-S267 PolarHBondContact O-N 3Å; V264-S267 PolarHBondContact O-OG 3.35Å; V264-T268 HydrophobicContact CG1-CG2 4.49Å; V264-T268 WeakPolarHBondContact O-CG2 3.39Å; V264-T268 PolarHBondContact O-N 2.99Å; V264-T268 VanDerWaalsContact O-N 3.13Å; V264-T268 PolarHBondContact O-OG1 3.5Å |
| 265 | Y | 90.2 | Very high | 84.9 | Confident | 16 Ų | 16 | 72.5 Ų | 72.5 | 6% | 0.063 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -55.9 | -41.6 | 177.1 | 177 | -99.8 | 0 | 0 | 0 | 112.9 | F196 M197 F200 V261 H262 T268 A270 | F196-Y265 HydrophobicContact CB-CD2 3.7Å; F196-Y265 HydrophobicContact CB-CE2 3.84Å; F196-Y265 HydrophobicContact CD1-CD2 4.08Å; F196-Y265 AromaticContact CD2-CD2 3.76Å; F196-Y265 HydrophobicContact CD2-CD2 3.76Å; F196-Y265 HydrophobicContact CD2-CE2 4.16Å; F196-Y265 HydrophobicContact CE2-CD2 4.41Å; F196-Y265 AromaticContact CG-CD2 3.58Å; F196-Y265 HydrophobicContact CG-CD2 3.58Å; F196-Y265 HydrophobicContact CG-CE2 4.11Å; F196-Y265 HydrophobicContact CG-CG 4.46Å; M197-Y265 HydrophobicContact CE-CD1 4.31Å; M197-Y265 HydrophobicContact CE-CE1 3.57Å; M197-Y265 HydrophobicContact CE-CE2 3.8Å; M197-Y265 VanDerWaalsContact CE-OH 3.3Å; M197-Y265 WeakPolarHBondContact CE-OH 3.4Å; F200-Y265 AromaticContact CE2-CD1 3.86Å; F200-Y265 HydrophobicContact CE2-CD1 3.86Å; F200-Y265 HydrophobicContact CE2-CD2 4.35Å; F200-Y265 HydrophobicContact CE2-CE1 4.36Å; F200-Y265 AromaticContact CE2-CG 3.87Å; F200-Y265 HydrophobicContact CE2-CG 3.87Å; F200-Y265 HydrophobicContact CZ-CD1 4.24Å; F200-Y265 AromaticContact CZ-CG 4Å; F200-Y265 HydrophobicContact CZ-CG 4Å; V261-Y265 WeakPolarHBondContact O-CB 3.45Å; V261-Y265 PolarHBondContact O-N 2.72Å; H262-Y265 PolarHBondContact O-N 3.29Å; Y265-T268 PolarHBondContact O-OG1 3.14Å; Y265-A270 HydrophobicContact CD2-CB 3.83Å; Y265-A270 WeakPolarHBondContact CE1-O 3.2Å; Y265-A270 HydrophobicContact CE2-CB 3.5Å; Y265-A270 VanDerWaalsContact CZ-O 3.23Å; Y265-A270 PolarHBondContact OH-O 3.41Å |
| 266 | R | 87.9 | Confident | 83.9 | Confident | 177 Ų | 177 | 75.2 Ų | 75.2 | 67% | 0.668 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -71.1 | -32.2 | 176 | -109.9 | 171.6 | 160.8 | 77.6 | 4.3 | 113.3 | H262 R263 V264 | H262-R266 PolarHBondContact CE1-NH1 3.4Å; H262-R266 VanDerWaalsContact CE1-NH1 3.35Å; H262-R266 PolarHBondContact NE2-NH1 2.97Å; H262-R266 PolarHBondContact O-N 2.74Å; R263-R266 PolarHBondContact O-N 3.5Å; V264-R266 VanDerWaalsContact C-N 3.31Å; V264-R266 PolarHBondContact O-N 3.38Å |
| 267 | S | 85.5 | Confident | 83.2 | Confident | 92 Ų | 92 | 75.8 Ų | 75.8 | 64% | 0.643 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -74.7 | -24.7 | 180 | 66.1 | 0 | 0 | 0 | 0 | 113.8 | R263 V264 G269 | R263-S267 WeakPolarHBondContact O-CB 3.31Å; R263-S267 PolarHBondContact O-N 3.13Å; R263-S267 PolarHBondContact O-OG 3.4Å; V264-S267 WeakPolarHBondContact CA-OG 3.13Å; V264-S267 PolarHBondContact O-N 3Å; V264-S267 PolarHBondContact O-OG 3.35Å; S267-G269 VanDerWaalsContact C-N 3.26Å; S267-G269 PolarHBondContact O-N 2.84Å |
| 268 | T | 77.5 | Confident | 82.5 | Confident | 58 Ų | 58 | 78.2 Ų | 78.2 | 36% | 0.356 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.5 | 0 | 179.4 | 54.9 | 0 | 0 | 0 | 0 | 113.5 | V264 Y265 A270 | V264-T268 HydrophobicContact CG1-CG2 4.49Å; V264-T268 WeakPolarHBondContact O-CG2 3.39Å; V264-T268 PolarHBondContact O-N 2.99Å; V264-T268 VanDerWaalsContact O-N 3.13Å; V264-T268 PolarHBondContact O-OG1 3.5Å; Y265-T268 PolarHBondContact O-OG1 3.14Å; T268-A270 PolarHBondContact O-N 3.08Å; T268-A270 VanDerWaalsContact O-N 3.16Å |
| 269 | G | 68.1 | Low | 81.7 | Confident | 63 Ų | 63 | 83.3 Ų | 83.3 | 65% | 0.649 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.1 | 6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114 | S267 S271 | S267-G269 VanDerWaalsContact C-N 3.26Å; S267-G269 PolarHBondContact O-N 2.84Å; G269-S271 PolarHBondContact O-N 3.38Å |
| 270 | A | 63.8 | Low | 80.9 | Confident | 10 Ų | 10 | 79.8 Ų | 79.8 | 8% | 0.083 | 41% | 0.405 | C | S | . | . | trans | -63.3 | 120 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | Y265 T268 K274 | Y265-A270 HydrophobicContact CD2-CB 3.83Å; Y265-A270 WeakPolarHBondContact CE1-O 3.2Å; Y265-A270 HydrophobicContact CE2-CB 3.5Å; Y265-A270 VanDerWaalsContact CZ-O 3.23Å; Y265-A270 PolarHBondContact OH-O 3.41Å; T268-A270 PolarHBondContact O-N 3.08Å; T268-A270 VanDerWaalsContact O-N 3.16Å; A270-K274 HydrophobicContact CB-CD 4.31Å | ||
| 271 | S | 59.7 | Low | 80 | Confident | 55 Ų | 55 | 80.1 Ų | 80.1 | 39% | 0.385 | 41% | 0.412 | S | S | . | . | trans | -123.2 | 166.4 | -176.1 | 73.2 | 0 | 0 | 0 | 0 | 110.8 | G269 A273 K274 A275 | G269-S271 PolarHBondContact O-N 3.38Å; S271-A273 PolarHBondContact O-N 3.21Å; S271-A273 VanDerWaalsContact O-N 3.1Å; S271-A273 WeakPolarHBondContact OG-CB 3.45Å; S271-A273 PolarHBondContact OG-N 3.05Å; S271-K274 WeakPolarHBondContact O-CB 3.11Å; S271-K274 PolarHBondContact O-N 3.49Å; S271-A275 PolarHBondContact O-N 2.87Å | ||
| 272 | F | 66.2 | Low | 78.9 | Confident | 148 Ų | 148 | 82 Ų | 82 | 65% | 0.649 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -51.8 | -30.2 | 170.8 | -178 | -97.2 | 0 | 0 | 0 | 112.2 | A275 Q276 | F272-A275 WeakPolarHBondContact O-CB 3.27Å; F272-A275 PolarHBondContact O-N 3.04Å; F272-Q276 PolarHBondContact O-N 2.67Å |
| 273 | A | 71 | Confident | 77.9 | Confident | 62 Ų | 62 | 81.7 Ų | 81.7 | 51% | 0.512 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.7 | -43.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S271 A275 Q276 E277 | S271-A273 PolarHBondContact O-N 3.21Å; S271-A273 VanDerWaalsContact O-N 3.1Å; S271-A273 WeakPolarHBondContact OG-CB 3.45Å; S271-A273 PolarHBondContact OG-N 3.05Å; A273-A275 PolarHBondContact O-N 3.21Å; A273-Q276 PolarHBondContact O-N 2.96Å; A273-E277 WeakPolarHBondContact O-CB 3.34Å; A273-E277 PolarHBondContact O-N 3Å |
| 274 | K | 77.7 | Confident | 77 | Confident | 60 Ų | 60 | 77.8 Ų | 77.8 | 26% | 0.261 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -59.4 | -38.8 | 172.4 | -168.7 | -169.3 | -179.1 | -166.8 | 0 | 110.6 | D191 A270 S271 E277 E278 | D191-K274 PolarHBondContact O-NZ 3.34Å; D191-K274 IonicContact OD1-NZ 3.98Å; D191-K274 IonicContact OD2-NZ 2.76Å; D191-K274 PolarHBondContact OD2-NZ 3.25Å; A270-K274 HydrophobicContact CB-CD 4.31Å; S271-K274 WeakPolarHBondContact O-CB 3.11Å; S271-K274 PolarHBondContact O-N 3.49Å; K274-E277 PolarHBondContact O-N 3.06Å; K274-E278 WeakPolarHBondContact CD-OE1 3.31Å; K274-E278 WeakPolarHBondContact CE-OE1 3.41Å; K274-E278 WeakPolarHBondContact CG-OE1 3.27Å; K274-E278 IonicContact NZ-OE1 3.8Å; K274-E278 WeakPolarHBondContact O-CB 3.42Å; K274-E278 WeakPolarHBondContact O-CG 3.43Å; K274-E278 PolarHBondContact O-N 3.22Å |
| 275 | A | 78.4 | Confident | 76.3 | Confident | 9 Ų | 9 | 79 Ų | 79 | 7% | 0.074 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -66.8 | -39.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S193 V194 S271 F272 A273 F279 | S193-A275 WeakPolarHBondContact OG-CA 3.19Å; S193-A275 WeakPolarHBondContact OG-CB 3.26Å; S193-A275 PolarHBondContact OG-N 3.08Å; V194-A275 HydrophobicContact CG2-CB 4.2Å; S271-A275 PolarHBondContact O-N 2.87Å; F272-A275 WeakPolarHBondContact O-CB 3.27Å; F272-A275 PolarHBondContact O-N 3.04Å; A273-A275 PolarHBondContact O-N 3.21Å; A275-F279 WeakPolarHBondContact O-CB 3.32Å; A275-F279 PolarHBondContact O-N 2.99Å |
| 276 | Q | 77.5 | Confident | 75.4 | Confident | 126 Ų | 126 | 81.7 Ų | 81.7 | 59% | 0.589 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -66.6 | -39.2 | 174.9 | -170.8 | 178 | -56.5 | 0 | 0 | 111.5 | F272 A273 S280 | F272-Q276 PolarHBondContact O-N 2.67Å; A273-Q276 PolarHBondContact O-N 2.96Å; Q276-S280 VanDerWaalsContact O-CB 3.28Å; Q276-S280 WeakPolarHBondContact O-CB 3.44Å; Q276-S280 PolarHBondContact O-N 2.97Å; Q276-S280 PolarHBondContact O-OG 3.17Å |
| 277 | E | 83.8 | Confident | 74.8 | Confident | 138 Ų | 138 | 77.2 Ų | 77.2 | 65% | 0.645 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -64.5 | -49.9 | 174.2 | -171.9 | 178.5 | -174.6 | 0 | 0 | 111.4 | A273 K274 F279 S280 H281 | A273-E277 WeakPolarHBondContact O-CB 3.34Å; A273-E277 PolarHBondContact O-N 3Å; K274-E277 PolarHBondContact O-N 3.06Å; E277-F279 VanDerWaalsContact C-N 3.33Å; E277-F279 PolarHBondContact O-N 3.36Å; E277-S280 PolarHBondContact O-N 3.23Å; E277-S280 PolarHBondContact O-OG 2.78Å; E277-H281 VanDerWaalsContact O-CB 3.24Å; E277-H281 WeakPolarHBondContact O-CB 3.18Å; E277-H281 PolarHBondContact O-N 3.31Å |
| 278 | E | 82.1 | Confident | 74.1 | Confident | 52 Ų | 52 | 79.2 Ų | 79.2 | 24% | 0.243 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -59.1 | -42.6 | 175.6 | -78.1 | 177.3 | -139.9 | 0 | 0 | 112.1 | S192 S193 V194 K274 G282 | S192-E278 WeakPolarHBondContact CA-OE2 3.27Å; S192-E278 WeakPolarHBondContact CB-OE2 3.1Å; S192-E278 PolarHBondContact OG-OE2 3.48Å; S193-E278 PolarHBondContact N-OE1 3.33Å; S193-E278 VanDerWaalsContact N-OE1 3.07Å; S193-E278 PolarHBondContact N-OE2 3.38Å; S193-E278 PolarHBondContact OG-OE1 3.44Å; S193-E278 PolarHBondContact OG-OE2 3.31Å; V194-E278 HydrophobicContact CG2-CB 4.38Å; K274-E278 WeakPolarHBondContact CD-OE1 3.31Å; K274-E278 WeakPolarHBondContact CE-OE1 3.41Å; K274-E278 WeakPolarHBondContact CG-OE1 3.27Å; K274-E278 IonicContact NZ-OE1 3.8Å; K274-E278 WeakPolarHBondContact O-CB 3.42Å; K274-E278 WeakPolarHBondContact O-CG 3.43Å; K274-E278 PolarHBondContact O-N 3.22Å; E278-G282 PolarHBondContact O-N 3.07Å |
| 279 | F | 79.6 | Confident | 74 | Confident | 132 Ų | 132 | 79.1 Ų | 79.1 | 58% | 0.579 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -68.6 | -47.8 | 179.8 | -176.5 | -98.6 | 0 | 0 | 0 | 111.8 | V194 A275 E277 H281 G282 V283 | V194-F279 HydrophobicContact CG2-CB 4.33Å; A275-F279 WeakPolarHBondContact O-CB 3.32Å; A275-F279 PolarHBondContact O-N 2.99Å; E277-F279 VanDerWaalsContact C-N 3.33Å; E277-F279 PolarHBondContact O-N 3.36Å; F279-H281 VanDerWaalsContact C-N 3.35Å; F279-H281 PolarHBondContact O-N 3.49Å; F279-G282 PolarHBondContact O-N 3.38Å; F279-V283 HydrophobicContact CD1-CG2 4.18Å; F279-V283 HydrophobicContact CE1-CG2 3.8Å; F279-V283 HydrophobicContact CE2-CG2 4.25Å; F279-V283 HydrophobicContact CZ-CG2 3.84Å; F279-V283 VanDerWaalsContact O-CG2 3.31Å; F279-V283 WeakPolarHBondContact O-CG2 3.34Å; F279-V283 PolarHBondContact O-N 3.32Å |
| 280 | S | 81.5 | Confident | 74.4 | Confident | 54 Ų | 54 | 80.4 Ų | 80.4 | 38% | 0.378 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 178.1 | 57.3 | 0 | 0 | 0 | 0 | 111.7 | Q276 E277 V283 I284 | Q276-S280 VanDerWaalsContact O-CB 3.28Å; Q276-S280 WeakPolarHBondContact O-CB 3.44Å; Q276-S280 PolarHBondContact O-N 2.97Å; Q276-S280 PolarHBondContact O-OG 3.17Å; E277-S280 PolarHBondContact O-N 3.23Å; E277-S280 PolarHBondContact O-OG 2.78Å; S280-V283 PolarHBondContact O-N 3.42Å; S280-I284 WeakPolarHBondContact O-CD1 3.44Å; S280-I284 VanDerWaalsContact O-CG1 3.27Å; S280-I284 WeakPolarHBondContact O-CG1 3.34Å; S280-I284 PolarHBondContact O-N 3.39Å |
| 281 | H | 76.4 | Confident | 75 | Confident | 133 Ų | 133 | 85.4 Ų | 85.4 | 62% | 0.616 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -65 | -39.4 | 174.3 | -168.1 | -87.3 | 0 | 0 | 0 | 112.1 | E277 F279 S285 | E277-H281 VanDerWaalsContact O-CB 3.24Å; E277-H281 WeakPolarHBondContact O-CB 3.18Å; E277-H281 PolarHBondContact O-N 3.31Å; F279-H281 VanDerWaalsContact C-N 3.35Å; F279-H281 PolarHBondContact O-N 3.49Å; H281-S285 WeakPolarHBondContact O-CB 3.19Å; H281-S285 PolarHBondContact O-N 3.36Å; H281-S285 PolarHBondContact O-OG 3.32Å |
| 282 | G | 73.3 | Confident | 75.7 | Confident | 39 Ų | 39 | 85 Ų | 85 | 40% | 0.402 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.8 | -37.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | E278 F279 S285 N286 | E278-G282 PolarHBondContact O-N 3.07Å; F279-G282 PolarHBondContact O-N 3.38Å; G282-S285 PolarHBondContact O-OG 2.82Å; G282-N286 PolarHBondContact O-N 2.9Å |
| 283 | V | 72.2 | Confident | 76.1 | Confident | 58 Ų | 58 | 80.7 Ų | 80.7 | 35% | 0.352 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -71.9 | -43.7 | 177 | 172.9 | 0 | 0 | 0 | 0 | 111 | F279 S280 S285 N286 V289 | F279-V283 HydrophobicContact CD1-CG2 4.18Å; F279-V283 HydrophobicContact CE1-CG2 3.8Å; F279-V283 HydrophobicContact CE2-CG2 4.25Å; F279-V283 HydrophobicContact CZ-CG2 3.84Å; F279-V283 VanDerWaalsContact O-CG2 3.31Å; F279-V283 WeakPolarHBondContact O-CG2 3.34Å; F279-V283 PolarHBondContact O-N 3.32Å; S280-V283 PolarHBondContact O-N 3.42Å; V283-S285 PolarHBondContact O-N 2.91Å; V283-N286 WeakPolarHBondContact O-CB 3.3Å; V283-N286 PolarHBondContact O-N 3.37Å; V283-V289 HydrophobicContact CG1-CG1 4.24Å; V283-V289 HydrophobicContact CG1-CG2 4.22Å; V283-V289 VanDerWaalsContact O-CB 3.27Å; V283-V289 WeakPolarHBondContact O-CB 3.3Å; V283-V289 WeakPolarHBondContact O-CG1 3.41Å; V283-V289 WeakPolarHBondContact O-CG2 3.43Å |
| 284 | I | 73.8 | Confident | 76.3 | Confident | 120 Ų | 120 | 82.1 Ų | 82.1 | 62% | 0.615 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -69 | -34 | -179.1 | -66.8 | 166.3 | 0 | 0 | 0 | 112.1 | S280 N286 Q290 | S280-I284 WeakPolarHBondContact O-CD1 3.44Å; S280-I284 VanDerWaalsContact O-CG1 3.27Å; S280-I284 WeakPolarHBondContact O-CG1 3.34Å; S280-I284 PolarHBondContact O-N 3.39Å; I284-N286 VanDerWaalsContact C-N 3.29Å; I284-N286 PolarHBondContact O-N 2.89Å; I284-Q290 VanDerWaalsContact O-CG 3.24Å; I284-Q290 WeakPolarHBondContact O-CG 3.49Å; I284-Q290 PolarHBondContact O-NE2 3.26Å; I284-Q290 VanDerWaalsContact O-NE2 3.1Å |
| 285 | S | 75.8 | Confident | 76.3 | Confident | 57 Ų | 57 | 84 Ų | 84 | 40% | 0.399 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.2 | -11.6 | 178.6 | 56.4 | 0 | 0 | 0 | 0 | 113.8 | H281 G282 V283 P287 | H281-S285 WeakPolarHBondContact O-CB 3.19Å; H281-S285 PolarHBondContact O-N 3.36Å; H281-S285 PolarHBondContact O-OG 3.32Å; G282-S285 PolarHBondContact O-OG 2.82Å; V283-S285 PolarHBondContact O-N 2.91Å; S285-P287 WeakPolarHBondContact O-CD 3.26Å |
| 286 | N | 72.2 | Confident | 76.1 | Confident | 73 Ų | 73 | 88 Ų | 88 | 39% | 0.39 | 48% | 0.484 | S | S | . | . | trans | -67.6 | 121.5 | -178.5 | -170.9 | -37.7 | 0 | 0 | 0 | 110.4 | G282 V283 I284 H288 V289 Q290 | G282-N286 PolarHBondContact O-N 2.9Å; V283-N286 WeakPolarHBondContact O-CB 3.3Å; V283-N286 PolarHBondContact O-N 3.37Å; I284-N286 VanDerWaalsContact C-N 3.29Å; I284-N286 PolarHBondContact O-N 2.89Å; N286-H288 PolarHBondContact O-N 3.31Å; N286-H288 VanDerWaalsContact O-N 3.1Å; N286-H288 WeakPolarHBondContact OD1-CB 3.48Å; N286-H288 PolarHBondContact OD1-N 3.19Å; N286-V289 HydrophobicContact CB-CB 4.14Å; N286-V289 HydrophobicContact CB-CG2 3.9Å; N286-V289 PolarHBondContact O-N 2.63Å; N286-Q290 WeakPolarHBondContact O-CG 3.2Å; N286-Q290 PolarHBondContact O-N 3.35Å | ||
| 287 | P | 74.8 | Confident | 76 | Confident | 83 Ų | 83 | 84.5 Ų | 84.5 | 54% | 0.539 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -55.1 | -32.3 | -180 | -25.7 | 33.8 | 0 | 0 | 0 | 113.3 | S285 Q290 Q291 | S285-P287 WeakPolarHBondContact O-CD 3.26Å; P287-Q290 PolarHBondContact O-N 3.45Å; P287-Q291 VanDerWaalsContact O-CB 3.27Å; P287-Q291 WeakPolarHBondContact O-CB 3.46Å; P287-Q291 WeakPolarHBondContact O-CG 3.36Å; P287-Q291 PolarHBondContact O-N 3.39Å |
| 288 | H | 71.4 | Confident | 75.7 | Confident | 134 Ų | 134 | 80.1 Ų | 80.1 | 62% | 0.62 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -70.9 | -39 | 177.9 | -167.4 | 64.4 | 0 | 0 | 0 | 112 | N286 Q291 A292 | N286-H288 PolarHBondContact O-N 3.31Å; N286-H288 VanDerWaalsContact O-N 3.1Å; N286-H288 WeakPolarHBondContact OD1-CB 3.48Å; N286-H288 PolarHBondContact OD1-N 3.19Å; H288-Q291 PolarHBondContact O-N 3.28Å; H288-A292 VanDerWaalsContact O-CB 3.27Å; H288-A292 WeakPolarHBondContact O-CB 3.42Å; H288-A292 PolarHBondContact O-N 3.46Å |
| 289 | V | 74.2 | Confident | 75.5 | Confident | 55 Ų | 55 | 81.8 Ų | 81.8 | 33% | 0.333 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -69.6 | -39.8 | 173.9 | 177.7 | 0 | 0 | 0 | 0 | 110 | V283 N286 A292 A293 | V283-V289 HydrophobicContact CG1-CG1 4.24Å; V283-V289 HydrophobicContact CG1-CG2 4.22Å; V283-V289 VanDerWaalsContact O-CB 3.27Å; V283-V289 WeakPolarHBondContact O-CB 3.3Å; V283-V289 WeakPolarHBondContact O-CG1 3.41Å; V283-V289 WeakPolarHBondContact O-CG2 3.43Å; N286-V289 HydrophobicContact CB-CB 4.14Å; N286-V289 HydrophobicContact CB-CG2 3.9Å; N286-V289 PolarHBondContact O-N 2.63Å; V289-A292 PolarHBondContact O-N 2.98Å; V289-A293 WeakPolarHBondContact O-CB 3.33Å; V289-A293 PolarHBondContact O-N 2.8Å |
| 290 | Q | 77.1 | Confident | 75.4 | Confident | 90 Ų | 90 | 79 Ų | 79 | 42% | 0.421 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.8 | -45 | 173.6 | -68.8 | -177.2 | -4.4 | 0 | 0 | 111.4 | I284 N286 P287 A293 V294 | I284-Q290 VanDerWaalsContact O-CG 3.24Å; I284-Q290 WeakPolarHBondContact O-CG 3.49Å; I284-Q290 PolarHBondContact O-NE2 3.26Å; I284-Q290 VanDerWaalsContact O-NE2 3.1Å; N286-Q290 WeakPolarHBondContact O-CG 3.2Å; N286-Q290 PolarHBondContact O-N 3.35Å; P287-Q290 PolarHBondContact O-N 3.45Å; Q290-A293 PolarHBondContact O-N 3.4Å; Q290-V294 VanDerWaalsContact O-CB 3.29Å; Q290-V294 WeakPolarHBondContact O-CB 3.27Å; Q290-V294 WeakPolarHBondContact O-CG2 3.48Å; Q290-V294 PolarHBondContact O-N 3.37Å |
| 291 | Q | 76.6 | Confident | 75.3 | Confident | 116 Ų | 116 | 80 Ų | 80 | 54% | 0.542 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.7 | -44.9 | 175.6 | -76.9 | 171.6 | 0.4 | 0 | 0 | 111.5 | P287 H288 V294 N295 | P287-Q291 VanDerWaalsContact O-CB 3.27Å; P287-Q291 WeakPolarHBondContact O-CB 3.46Å; P287-Q291 WeakPolarHBondContact O-CG 3.36Å; P287-Q291 PolarHBondContact O-N 3.39Å; H288-Q291 PolarHBondContact O-N 3.28Å; Q291-V294 PolarHBondContact O-N 2.96Å; Q291-N295 VanDerWaalsContact O-CB 3.31Å; Q291-N295 WeakPolarHBondContact O-CB 3.36Å; Q291-N295 PolarHBondContact O-N 3.42Å; Q291-N295 PolarHBondContact O-ND2 3.07Å; Q291-N295 PolarHBondContact O-OD1 3.33Å |
| 292 | A | 74.8 | Confident | 75.2 | Confident | 47 Ų | 47 | 82.4 Ų | 82.4 | 39% | 0.388 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | H288 V289 N295 V296 | H288-A292 VanDerWaalsContact O-CB 3.27Å; H288-A292 WeakPolarHBondContact O-CB 3.42Å; H288-A292 PolarHBondContact O-N 3.46Å; V289-A292 PolarHBondContact O-N 2.98Å; A292-N295 PolarHBondContact O-N 3.03Å; A292-V296 VanDerWaalsContact O-CG2 3.32Å; A292-V296 WeakPolarHBondContact O-CG2 3.4Å; A292-V296 PolarHBondContact O-N 3.01Å |
| 293 | A | 73.1 | Confident | 75.3 | Confident | 57 Ų | 57 | 84.1 Ų | 84.1 | 47% | 0.471 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.4 | -42.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V289 Q290 V296 A297 | V289-A293 WeakPolarHBondContact O-CB 3.33Å; V289-A293 PolarHBondContact O-N 2.8Å; Q290-A293 PolarHBondContact O-N 3.4Å; A293-V296 PolarHBondContact O-N 3.42Å; A293-A297 VanDerWaalsContact O-CB 3.26Å; A293-A297 WeakPolarHBondContact O-CB 3.35Å; A293-A297 PolarHBondContact O-N 3.34Å |
| 294 | V | 76.2 | Confident | 75.5 | Confident | 92 Ų | 92 | 88.1 Ų | 88.1 | 56% | 0.558 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.9 | -42.6 | 174.5 | 168.8 | 0 | 0 | 0 | 0 | 110.9 | Q290 Q291 S298 | Q290-V294 VanDerWaalsContact O-CB 3.29Å; Q290-V294 WeakPolarHBondContact O-CB 3.27Å; Q290-V294 WeakPolarHBondContact O-CG2 3.48Å; Q290-V294 PolarHBondContact O-N 3.37Å; Q291-V294 PolarHBondContact O-N 2.96Å; V294-S298 WeakPolarHBondContact O-CB 3.45Å; V294-S298 PolarHBondContact O-N 3.38Å; V294-S298 PolarHBondContact O-OG 3.33Å |
| 295 | N | 76.8 | Confident | 75.5 | Confident | 100 Ų | 100 | 89.4 Ų | 89.4 | 54% | 0.535 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.9 | -46.2 | 177.7 | -70.2 | -16.5 | 0 | 0 | 0 | 111.5 | Q291 A292 S298 T299 | Q291-N295 VanDerWaalsContact O-CB 3.31Å; Q291-N295 WeakPolarHBondContact O-CB 3.36Å; Q291-N295 PolarHBondContact O-N 3.42Å; Q291-N295 PolarHBondContact O-ND2 3.07Å; Q291-N295 PolarHBondContact O-OD1 3.33Å; A292-N295 PolarHBondContact O-N 3.03Å; N295-S298 PolarHBondContact O-N 2.76Å; N295-S298 PolarHBondContact O-OG 3.41Å; N295-T299 PolarHBondContact O-N 2.96Å; N295-T299 PolarHBondContact O-OG1 3.07Å |
| 296 | V | 76 | Confident | 75.3 | Confident | 92 Ų | 92 | 90.1 Ų | 90.1 | 56% | 0.558 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.1 | -48.7 | 176.5 | 173.2 | 0 | 0 | 0 | 0 | 111 | A292 A293 S298 T299 T300 | A292-V296 VanDerWaalsContact O-CG2 3.32Å; A292-V296 WeakPolarHBondContact O-CG2 3.4Å; A292-V296 PolarHBondContact O-N 3.01Å; A293-V296 PolarHBondContact O-N 3.42Å; V296-S298 VanDerWaalsContact C-N 3.3Å; V296-S298 PolarHBondContact O-N 2.96Å; V296-T299 WeakPolarHBondContact O-CB 3.44Å; V296-T299 PolarHBondContact O-N 3.35Å; V296-T300 PolarHBondContact O-N 3.2Å; V296-T300 PolarHBondContact O-OG1 3.28Å |
| 297 | A | 75 | Confident | 75 | Confident | 53 Ų | 53 | 89.6 Ų | 89.6 | 44% | 0.438 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -57.1 | -44.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | A293 T299 T300 V301 | A293-A297 VanDerWaalsContact O-CB 3.26Å; A293-A297 WeakPolarHBondContact O-CB 3.35Å; A293-A297 PolarHBondContact O-N 3.34Å; A297-T299 VanDerWaalsContact C-N 3.29Å; A297-T299 PolarHBondContact O-N 3.27Å; A297-T300 PolarHBondContact O-N 3.48Å; A297-V301 WeakPolarHBondContact O-CB 3.45Å; A297-V301 WeakPolarHBondContact O-CG2 3.47Å; A297-V301 PolarHBondContact O-N 3.15Å |
| 298 | S | 77.8 | Confident | 74.3 | Confident | 46 Ų | 46 | 89.9 Ų | 89.9 | 32% | 0.322 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64 | -33.4 | 176.7 | 76.2 | 0 | 0 | 0 | 0 | 113 | V294 N295 V296 R302 | V294-S298 WeakPolarHBondContact O-CB 3.45Å; V294-S298 PolarHBondContact O-N 3.38Å; V294-S298 PolarHBondContact O-OG 3.33Å; N295-S298 PolarHBondContact O-N 2.76Å; N295-S298 PolarHBondContact O-OG 3.41Å; V296-S298 VanDerWaalsContact C-N 3.3Å; V296-S298 PolarHBondContact O-N 2.96Å; S298-R302 WeakPolarHBondContact O-CB 3.48Å; S298-R302 VanDerWaalsContact O-CG 3.27Å; S298-R302 WeakPolarHBondContact O-CG 3.24Å; S298-R302 PolarHBondContact O-N 3.15Å; S298-R302 VanDerWaalsContact O-N 3.11Å |
| 299 | T | 77.6 | Confident | 73.8 | Confident | 86 Ų | 86 | 87.3 Ų | 87.3 | 53% | 0.528 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -74.4 | -45 | 178.7 | -53.2 | 0 | 0 | 0 | 0 | 111.3 | N295 V296 A297 R302 S303 | N295-T299 PolarHBondContact O-N 2.96Å; N295-T299 PolarHBondContact O-OG1 3.07Å; V296-T299 WeakPolarHBondContact O-CB 3.44Å; V296-T299 PolarHBondContact O-N 3.35Å; A297-T299 VanDerWaalsContact C-N 3.29Å; A297-T299 PolarHBondContact O-N 3.27Å; T299-R302 PolarHBondContact O-N 3.42Å; T299-S303 PolarHBondContact O-N 3.4Å; T299-S303 PolarHBondContact O-OG 2.77Å |
| 300 | T | 77.9 | Confident | 72.7 | Confident | 75 Ų | 75 | 87 Ų | 87 | 46% | 0.46 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 176.4 | -56.7 | 0 | 0 | 0 | 0 | 111.3 | V296 A297 R302 S303 Q304 | V296-T300 PolarHBondContact O-N 3.2Å; V296-T300 PolarHBondContact O-OG1 3.28Å; A297-T300 PolarHBondContact O-N 3.48Å; T300-R302 VanDerWaalsContact C-N 3.35Å; T300-R302 PolarHBondContact O-N 3.24Å; T300-S303 WeakPolarHBondContact CA-OG 3.48Å; T300-S303 PolarHBondContact O-N 3.28Å; T300-S303 PolarHBondContact O-OG 3.35Å; T300-Q304 PolarHBondContact O-N 3.17Å |
| 301 | V | 77.6 | Confident | 71.6 | Confident | 73 Ų | 73 | 88.7 Ų | 88.7 | 44% | 0.442 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.4 | -47.3 | 175.6 | 171 | 0 | 0 | 0 | 0 | 110.4 | A297 S303 Q304 F305 | A297-V301 WeakPolarHBondContact O-CB 3.45Å; A297-V301 WeakPolarHBondContact O-CG2 3.47Å; A297-V301 PolarHBondContact O-N 3.15Å; V301-S303 PolarHBondContact O-N 2.65Å; V301-Q304 PolarHBondContact O-N 2.91Å; V301-F305 HydrophobicContact CG1-CD2 3.63Å; V301-F305 HydrophobicContact CG1-CE2 3.52Å; V301-F305 WeakPolarHBondContact O-CD2 3.49Å; V301-F305 PolarHBondContact O-N 3.21Å |
| 302 | R | 74.4 | Confident | 70.7 | Confident | 185 Ų | 185 | 87.8 Ų | 87.8 | 70% | 0.698 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.4 | -42.2 | 176 | -78.2 | 176.6 | -175.6 | 165.5 | 2.6 | 113 | S298 T299 T300 Q304 F305 A306 | S298-R302 WeakPolarHBondContact O-CB 3.48Å; S298-R302 VanDerWaalsContact O-CG 3.27Å; S298-R302 WeakPolarHBondContact O-CG 3.24Å; S298-R302 PolarHBondContact O-N 3.15Å; S298-R302 VanDerWaalsContact O-N 3.11Å; T299-R302 PolarHBondContact O-N 3.42Å; T300-R302 VanDerWaalsContact C-N 3.35Å; T300-R302 PolarHBondContact O-N 3.24Å; R302-Q304 VanDerWaalsContact C-N 3.35Å; R302-F305 PolarHBondContact O-N 3.44Å; R302-A306 WeakPolarHBondContact O-CB 3.49Å; R302-A306 PolarHBondContact O-N 2.96Å |
| 303 | S | 75.6 | Confident | 69.7 | Low | 74 Ų | 74 | 93 Ų | 93 | 52% | 0.517 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -66 | -36 | 177.9 | 56.3 | 0 | 0 | 0 | 0 | 113 | T299 T300 V301 A306 G307 | T299-S303 PolarHBondContact O-N 3.4Å; T299-S303 PolarHBondContact O-OG 2.77Å; T300-S303 WeakPolarHBondContact CA-OG 3.48Å; T300-S303 PolarHBondContact O-N 3.28Å; T300-S303 PolarHBondContact O-OG 3.35Å; V301-S303 PolarHBondContact O-N 2.65Å; S303-A306 PolarHBondContact O-N 2.86Å; S303-G307 PolarHBondContact O-N 3.48Å |
| 304 | Q | 77.3 | Confident | 68.3 | Low | 142 Ų | 142 | 102 Ų | 102 | 66% | 0.664 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.6 | -42.2 | 177.5 | -172.9 | 175.3 | -17.7 | 0 | 0 | 111.2 | T300 V301 R302 G307 S308 | T300-Q304 PolarHBondContact O-N 3.17Å; V301-Q304 PolarHBondContact O-N 2.91Å; R302-Q304 VanDerWaalsContact C-N 3.35Å; Q304-G307 PolarHBondContact O-N 2.76Å; Q304-S308 PolarHBondContact O-N 3.33Å; Q304-S308 VanDerWaalsContact O-N 3.1Å; Q304-S308 PolarHBondContact O-OG 2.79Å |
| 305 | F | 73.3 | Confident | 67.5 | Low | 147 Ų | 147 | 110.9 Ų | 110.9 | 65% | 0.645 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -67.6 | -37.8 | 174.4 | -79.3 | -68.2 | 0 | 0 | 0 | 112.8 | V301 R302 S308 A309 | V301-F305 HydrophobicContact CG1-CD2 3.63Å; V301-F305 HydrophobicContact CG1-CE2 3.52Å; V301-F305 WeakPolarHBondContact O-CD2 3.49Å; V301-F305 PolarHBondContact O-N 3.21Å; R302-F305 PolarHBondContact O-N 3.44Å; F305-S308 WeakPolarHBondContact CA-OG 3.3Å; F305-S308 PolarHBondContact O-OG 3.45Å; F305-A309 PolarHBondContact O-N 3.25Å |
| 306 | A | 72.6 | Confident | 67 | Low | 72 Ų | 72 | 111.5 Ų | 111.5 | 60% | 0.595 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -67.7 | -38.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R302 S303 A309 | R302-A306 WeakPolarHBondContact O-CB 3.49Å; R302-A306 PolarHBondContact O-N 2.96Å; S303-A306 PolarHBondContact O-N 2.86Å; A306-A309 PolarHBondContact O-N 3.25Å |
| 307 | G | 66.1 | Low | 66.5 | Low | 62 Ų | 62 | 112.5 Ų | 112.5 | 64% | 0.639 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -71.9 | -27.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | S303 Q304 A309 | S303-G307 PolarHBondContact O-N 3.48Å; Q304-G307 PolarHBondContact O-N 2.76Å; G307-A309 VanDerWaalsContact C-N 3.35Å |
| 308 | S | 59.8 | Low | 66.1 | Low | 89 Ų | 89 | 115.8 Ų | 115.8 | 62% | 0.622 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -83.8 | -9.2 | 175.5 | 39.2 | 0 | 0 | 0 | 0 | 113.7 | Q304 F305 | Q304-S308 PolarHBondContact O-N 3.33Å; Q304-S308 VanDerWaalsContact O-N 3.1Å; Q304-S308 PolarHBondContact O-OG 2.79Å; F305-S308 WeakPolarHBondContact CA-OG 3.3Å; F305-S308 PolarHBondContact O-OG 3.45Å |
| 309 | A | 59.3 | Low | 65.4 | Low | 80 Ų | 80 | 119.9 Ų | 119.9 | 66% | 0.661 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | 18.8 | 173 | 0 | 0 | 0 | 0 | 0 | 113.7 | F305 A306 G307 | F305-A309 PolarHBondContact O-N 3.25Å; A306-A309 PolarHBondContact O-N 3.25Å; G307-A309 VanDerWaalsContact C-N 3.35Å |
| 310 | G | 52.9 | Low | 64.6 | Low | 49 Ų | 49 | 122 Ų | 122 | 51% | 0.505 | 68% | 0.676 | S | S | . | * | trans | -60.6 | 148.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A312 | G310-A312 PolarHBondContact O-N 3.34Š| ||
| 311 | P | 52.8 | Low | 63.7 | Low | 126 Ų | 126 | 125.1 Ų | 125.1 | 82% | 0.818 | 69% | 0.69 | S | S | * | * | trans | -65 | 123.9 | -156.5 | -8.6 | 21.6 | 0 | 0 | 0 | 111.1 | E313 | P311-E313 PolarHBondContact O-N 3.48Š| ||
| 312 | A | 58.4 | Low | 62.7 | Low | 96 Ų | 96 | 128.9 Ų | 128.9 | 79% | 0.793 | 71% | 0.708 | S | S | * | * | trans | -54.2 | 115.5 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | G310 R314 | G310-A312 PolarHBondContact O-N 3.34Å; A312-R314 PolarHBondContact O-N 3.14Å | ||
| 313 | E | 52.3 | Low | 61.8 | Low | 156 Ų | 156 | 124.5 Ų | 124.5 | 73% | 0.729 | 71% | 0.709 | S | S | * | * | trans | -50.8 | 121.7 | 175.3 | -81 | 178 | 139.9 | 0 | 0 | 109.2 | P311 Y315 | P311-E313 PolarHBondContact O-N 3.48Å; E313-Y315 HydrophobicContact CB-CD2 4.38Å; E313-Y315 HydrophobicContact CB-CE2 4.15Å; E313-Y315 PolarHBondContact O-N 2.8Å | ||
| 314 | R | 45.7 | Very low | 60.7 | Low | 248 Ų | 248 | 128.8 Ų | 128.8 | 94% | 0.936 | 73% | 0.725 | S | S | * | * | trans | -62.8 | 113 | 166.8 | -71.7 | -176.5 | 177 | -173.2 | -0.8 | 107.5 | A312 | A312-R314 PolarHBondContact O-N 3.14Š| ||
| 315 | Y | 57.6 | Low | 59.2 | Low | 278 Ų | 278 | 127.5 Ų | 127.5 | 100% | 1.09 | 73% | 0.73 | S | S | * | * | trans | -106.3 | 0 | 153.5 | -76.5 | -80.3 | 0 | 0 | 0 | 108.4 | E313 | E313-Y315 HydrophobicContact CB-CD2 4.38Å; E313-Y315 HydrophobicContact CB-CE2 4.15Å; E313-Y315 PolarHBondContact O-N 2.8Å |
Retrieved 315 of 315 residues in 243.8 ms
(Link to these results)