| 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 | 41 | Very low | 40.6 | Very low | 230 Ų | 230 | 137.2 Ų | 137.2 | 100% | 1.133 | 80% | 0.802 | S | S | * | * | 0 | 101.4 | 0 | -78.3 | 152 | 178.2 | 0 | 0 | 106.2 | |||||
| 2 | T | 41 | Very low | 40.6 | Very low | 121 Ų | 121 | 132.4 Ų | 132.4 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | 70.3 | 121.2 | 91.5 | 55.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 3 | T | 40.7 | Very low | 40.3 | Very low | 132 Ų | 132 | 136.8 Ų | 136.8 | 81% | 0.81 | 81% | 0.81 | S | S | * | * | cis | -164 | 147.2 | 2.5 | -2.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 4 | N | 41.4 | Very low | 40.3 | Very low | 147 Ų | 147 | 136.1 Ų | 136.1 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | trans | -71.5 | 165.2 | 154.6 | -115 | -13.5 | 0 | 0 | 0 | 108.8 | ||||
| 5 | P | 47.2 | Very low | 40.1 | Very low | 107 Ų | 107 | 136.1 Ų | 136.1 | 70% | 0.695 | 81% | 0.81 | S | S | * | * | cis | -159.6 | 173.4 | 48.4 | 43.1 | -20.5 | 0 | 0 | 0 | 120.6 | ||||
| 6 | S | 37.9 | Very low | 40.3 | Very low | 93 Ų | 93 | 140.5 Ų | 140.5 | 65% | 0.65 | 82% | 0.815 | S | S | * | * | trans | 58.1 | 146.5 | 134.3 | 66.2 | 0 | 0 | 0 | 0 | 125.8 | ||||
| 7 | S | 37.9 | Very low | 40.2 | Very low | 112 Ų | 112 | 138 Ų | 138 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | trans | 74.7 | 148.2 | 148.3 | 67.9 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 8 | S | 43.7 | Very low | 40.9 | Very low | 114 Ų | 114 | 136.6 Ų | 136.6 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | cis | -159.9 | 159.7 | -3.1 | 29.1 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 9 | Q | 39.3 | Very low | 41 | Very low | 175 Ų | 175 | 140.6 Ų | 140.6 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -71.8 | 162.4 | 163.4 | -97.9 | -177.3 | 6.9 | 0 | 0 | 111.8 | ||||
| 10 | P | 41.6 | Very low | 41 | Very low | 122 Ų | 122 | 140.6 Ų | 140.6 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | -154.7 | -164.8 | 76.1 | 42.8 | -20.4 | 0 | 0 | 0 | 117.4 | |||||
| 11 | L | 35.6 | Very low | 41.1 | Very low | 156 Ų | 156 | 141.1 Ų | 141.1 | 82% | 0.817 | 79% | 0.792 | S | S | * | * | trans | -77.3 | 166.3 | -172.7 | -64.1 | 79 | 0 | 0 | 0 | 115.3 | ||||
| 12 | G | 39.8 | Very low | 41.2 | Very low | 80 Ų | 80 | 134.6 Ų | 134.6 | 83% | 0.825 | 77% | 0.769 | S | S | * | * | trans | -148.9 | 133.8 | 157.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 13 | Q | 36.8 | Very low | 41.4 | Very low | 189 Ų | 189 | 137.4 Ų | 137.4 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | trans | -110.8 | 156.5 | 171.3 | -63.6 | 175.7 | -16.1 | 0 | 0 | 109.7 | ||||
| 14 | S | 41 | Very low | 41.4 | Very low | 127 Ų | 127 | 133.9 Ų | 133.9 | 89% | 0.888 | 76% | 0.763 | S | S | * | * | -170.5 | 141.9 | 128.3 | -159.4 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 15 | N | 36.6 | Very low | 41.4 | Very low | 136 Ų | 136 | 134 Ų | 134 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | trans | -88.4 | 159.9 | -174.8 | -178.9 | 10.9 | 0 | 0 | 0 | 113.1 | ||||
| 16 | K | 44.2 | Very low | 41.3 | Very low | 207 Ų | 207 | 136.5 Ų | 136.5 | 90% | 0.9 | 77% | 0.77 | S | S | * | * | trans | -159.6 | 156.4 | 153.5 | -113.6 | 169.2 | -172.8 | 179.5 | 0 | 112.8 | ||||
| 17 | S | 37.9 | Very low | 41.4 | Very low | 98 Ų | 98 | 137.8 Ų | 137.8 | 69% | 0.685 | 78% | 0.776 | S | S | * | * | trans | -160.5 | -165.1 | -157.9 | -158.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 18 | P | 52.3 | Low | 41.3 | Very low | 112 Ų | 112 | 138.8 Ų | 138.8 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | -120.8 | -171.3 | -74.7 | 36.4 | -21.1 | 0 | 0 | 0 | 113.7 | |||||
| 19 | R | 43.4 | Very low | 41.2 | Very low | 214 Ų | 214 | 138.9 Ų | 138.9 | 81% | 0.808 | 78% | 0.778 | S | S | * | * | trans | -172.1 | 125.6 | 144.4 | -103 | -173 | 159 | 119.1 | 6.1 | 111.5 | ||||
| 20 | E | 41.7 | Very low | 41.2 | Very low | 140 Ų | 140 | 136.3 Ų | 136.3 | 65% | 0.654 | 78% | 0.78 | S | S | * | * | 69.1 | 136.7 | 100.7 | -67.5 | -174.9 | 126 | 0 | 0 | 114.9 | |||||
| 21 | H | 41.9 | Very low | 41.1 | Very low | 152 Ų | 152 | 135.4 Ų | 135.4 | 70% | 0.704 | 78% | 0.776 | S | S | * | * | cis | -165.1 | 151.5 | 10.5 | -140 | -65.1 | 0 | 0 | 0 | 113.2 | ||||
| 22 | S | 44.2 | Very low | 41.2 | Very low | 93 Ų | 93 | 132.4 Ų | 132.4 | 65% | 0.65 | 77% | 0.774 | S | S | * | * | trans | 59.7 | 152.9 | 150.5 | -76.3 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 23 | H | 45.3 | Very low | 41.3 | Very low | 179 Ų | 179 | 134.5 Ų | 134.5 | 83% | 0.829 | 77% | 0.773 | S | S | * | * | cis | -168.6 | 150.1 | -23.6 | -139.4 | -89 | 0 | 0 | 0 | 111.5 | ||||
| 24 | G | 39 | Very low | 41.1 | Very low | 58 Ų | 58 | 134 Ų | 134 | 60% | 0.598 | 77% | 0.771 | S | S | * | * | trans | 80.9 | 147 | 163.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 25 | D | 42.3 | Very low | 40.7 | Very low | 149 Ų | 149 | 135.1 Ų | 135.1 | 80% | 0.797 | 77% | 0.767 | S | S | * | * | cis | -154.1 | 142.3 | -6.9 | -93.1 | -38.4 | 0 | 0 | 0 | 113.8 | ||||
| 26 | L | 44.1 | Very low | 40.5 | Very low | 160 Ų | 160 | 140.5 Ų | 140.5 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | 58.9 | 156 | 160.7 | -86.4 | 70.1 | 0 | 0 | 0 | 120.5 | ||||
| 27 | P | 40 | Very low | 40.2 | Very low | 120 Ų | 120 | 138.7 Ų | 138.7 | 78% | 0.779 | 78% | 0.776 | S | S | * | * | trans | -123.7 | 158.7 | -141 | 41 | -28.1 | 0 | 0 | 0 | 116.7 | ||||
| 28 | T | 36.9 | Very low | 40 | Very low | 134 Ų | 134 | 143 Ų | 143 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | -107.1 | 145.3 | 176.3 | 35.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 29 | S | 41.6 | Very low | 39 | Very low | 115 Ų | 115 | 140.8 Ų | 140.8 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | 49.7 | 107.1 | 160.4 | 57.3 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 30 | S | 39.3 | Very low | 38.7 | Very low | 122 Ų | 122 | 138.7 Ų | 138.7 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | trans | -77.3 | 167.6 | 154.8 | -166.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 31 | S | 39 | Very low | 38.2 | Very low | 102 Ų | 102 | 138.2 Ų | 138.2 | 71% | 0.713 | 79% | 0.789 | S | S | * | * | trans | -80 | 146 | -166.8 | 53.7 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 32 | A | 38.2 | Very low | 38 | Very low | 94 Ų | 94 | 138.5 Ų | 138.5 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | trans | 68.7 | 168.6 | 146.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 33 | P | 41 | Very low | 37.6 | Very low | 123 Ų | 123 | 138.9 Ų | 138.9 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | cis | -125.3 | -169.5 | -12.1 | 34.4 | -14.9 | 0 | 0 | 0 | 114.1 | N35 | P33-N35 PolarHBondContact O-N 3.47Š| ||
| 34 | H | 34.2 | Very low | 37.1 | Very low | 179 Ų | 179 | 134.9 Ų | 134.9 | 83% | 0.829 | 79% | 0.785 | S | S | * | * | trans | -53.4 | 127.2 | 170.9 | -78.9 | -98.2 | 0 | 0 | 0 | 113.9 | ||||
| 35 | N | 32.1 | Very low | 37 | Very low | 151 Ų | 151 | 141.8 Ų | 141.8 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | 168.6 | 112.9 | 122.7 | -92.7 | -26.4 | 0 | 0 | 0 | 112.6 | P33 | P33-N35 PolarHBondContact O-N 3.47Š| |||
| 36 | R | 32.8 | Very low | 36.7 | Very low | 248 Ų | 248 | 141.4 Ų | 141.4 | 94% | 0.936 | 79% | 0.786 | S | S | * | * | trans | 175.6 | 95 | 150.3 | -101.4 | 165.8 | -153 | -121.2 | 3.9 | 111.2 | ||||
| 37 | L | 37.2 | Very low | 36.5 | Very low | 169 Ų | 169 | 138.5 Ų | 138.5 | 89% | 0.885 | 78% | 0.779 | S | S | * | * | trans | -160.4 | 32.4 | 153.9 | -114.8 | 162.5 | 0 | 0 | 0 | 113.2 | G39 | L37-G39 PolarHBondContact O-N 3.47Š| ||
| 38 | L | 34.1 | Very low | 37 | Very low | 190 Ų | 190 | 139 Ų | 139 | 100% | 0.995 | 77% | 0.774 | S | S | * | * | trans | -76.8 | 106.1 | 157 | -84.2 | 160.1 | 0 | 0 | 0 | 107.1 | ||||
| 39 | G | 31.1 | Very low | 37.8 | Very low | 65 Ų | 65 | 138.5 Ų | 138.5 | 67% | 0.67 | 77% | 0.766 | S | S | * | * | S | Bend | trans | 175.5 | -6.3 | -176.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | L37 | L37-G39 PolarHBondContact O-N 3.47Š|
| 40 | H | 35.9 | Very low | 38.7 | Very low | 170 Ų | 170 | 136.3 Ų | 136.3 | 79% | 0.787 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -153.6 | 125.4 | 172.4 | -116.4 | 55.9 | 0 | 0 | 0 | 111.6 | ||
| 41 | N | 32.9 | Very low | 40 | Very low | 129 Ų | 129 | 133.5 Ų | 133.5 | 69% | 0.69 | 73% | 0.726 | S | S | * | * | S | Bend | trans | 152.7 | -10 | 157.7 | -85.5 | -24.9 | 0 | 0 | 0 | 114.2 | S43 | N41-S43 VanDerWaalsContact C-N 3.35Å; N41-S43 PolarHBondContact O-N 3.49Å |
| 42 | H | 36.3 | Very low | 41.9 | Very low | 159 Ų | 159 | 131 Ų | 131 | 74% | 0.736 | 70% | 0.704 | S | S | * | * | G | 310 helix | trans | -69.4 | -26.5 | -174.6 | -114 | -89.4 | 0 | 0 | 0 | 114.8 | S44 | H42-S44 VanDerWaalsContact C-N 3.29Å; H42-S44 PolarHBondContact O-N 3.41Å |
| 43 | S | 35.8 | Very low | 43.8 | Very low | 101 Ų | 101 | 130 Ų | 130 | 71% | 0.706 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -70.2 | -17.4 | -179.2 | 46 | 0 | 0 | 0 | 0 | 115 | N41 | N41-S43 VanDerWaalsContact C-N 3.35Å; N41-S43 PolarHBondContact O-N 3.49Å |
| 44 | S | 36.2 | Very low | 45.7 | Very low | 94 Ų | 94 | 130 Ų | 130 | 66% | 0.657 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -96.5 | 8.8 | -175.8 | -56.1 | 0 | 0 | 0 | 0 | 114 | H42 | H42-S44 VanDerWaalsContact C-N 3.29Å; H42-S44 PolarHBondContact O-N 3.41Å |
| 45 | R | 35.7 | Very low | 47.9 | Very low | 203 Ų | 203 | 125.4 Ų | 125.4 | 77% | 0.766 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -129.6 | -3.4 | -169.2 | -153.9 | 166 | 179.5 | 155.4 | -1 | 115.6 | ||
| 46 | E | 36 | Very low | 49.9 | Very low | 142 Ų | 142 | 120.4 Ų | 120.4 | 66% | 0.664 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -93.5 | -15.7 | 179.9 | -63.9 | -173 | 131.5 | 0 | 0 | 113.9 | I48 N49 | E46-I48 PolarHBondContact O-N 3.14Å; E46-N49 PolarHBondContact O-N 2.87Å |
| 47 | S | 40 | Very low | 52.3 | Low | 98 Ų | 98 | 114 Ų | 114 | 69% | 0.685 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | 6.2 | -178 | 53.1 | 0 | 0 | 0 | 0 | 115.9 | ||
| 48 | I | 51.1 | Low | 54.5 | Low | 132 Ų | 132 | 112.7 Ų | 112.7 | 68% | 0.677 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | -9 | -175.6 | -64.8 | 174.1 | 0 | 0 | 0 | 112.1 | E46 | E46-I48 PolarHBondContact O-N 3.14Š|
| 49 | N | 53.3 | Low | 56.7 | Low | 123 Ų | 123 | 106.1 Ų | 106.1 | 66% | 0.658 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -108.6 | -7.7 | -170.7 | -76.5 | -24.5 | 0 | 0 | 0 | 116.4 | E46 | E46-N49 PolarHBondContact O-N 2.87Š|
| 50 | S | 59.7 | Low | 58.9 | Low | 69 Ų | 69 | 103.9 Ų | 103.9 | 48% | 0.483 | 54% | 0.542 | S | S | . | . | trans | -91.1 | 123.6 | 175.2 | 69.3 | 0 | 0 | 0 | 0 | 112 | N52 | S50-N52 PolarHBondContact O-N 3.33Å; S50-N52 PolarHBondContact O-OD1 3.38Å; S50-N52 PolarHBondContact OG-OD1 3.18Å | ||
| 51 | I | 67.6 | Low | 61.2 | Low | 62 Ų | 62 | 98 Ų | 98 | 32% | 0.318 | 52% | 0.523 | S | S | . | . | trans | -73.4 | 120.4 | 166 | -64.2 | 151.9 | 0 | 0 | 0 | 107.3 | P53 N391 W393 Q394 | I51-P53 WeakPolarHBondContact O-CD 3.41Å; I51-N391 HydrophobicContact CD1-CB 4.02Å; I51-W393 HydrophobicContact CD1-CB 3.77Å; I51-W393 HydrophobicContact CG1-CB 4.16Å; I51-W393 HydrophobicContact CG2-CB 3.99Å; I51-Q394 HydrophobicContact CD1-CG 4.06Å; I51-Q394 HydrophobicContact CG1-CG 3.51Å | ||
| 52 | N | 78.3 | Confident | 63.6 | Low | 50 Ų | 50 | 95.6 Ų | 95.6 | 27% | 0.267 | 51% | 0.506 | S | S | . | . | trans | -105.4 | 97.9 | -178.4 | -58.2 | -33.1 | 0 | 0 | 0 | 108.2 | S50 D54 Q55 M56 | S50-N52 PolarHBondContact O-N 3.33Å; S50-N52 PolarHBondContact O-OD1 3.38Å; S50-N52 PolarHBondContact OG-OD1 3.18Å; N52-D54 PolarHBondContact O-N 2.72Å; N52-Q55 HydrophobicContact CB-CB 3.98Å; N52-Q55 HydrophobicContact CB-CG 3.8Å; N52-Q55 PolarHBondContact ND2-OE1 2.9Å; N52-Q55 WeakPolarHBondContact O-CB 3.41Å; N52-Q55 PolarHBondContact O-N 3.01Å; N52-M56 PolarHBondContact O-N 3.15Å; N52-M56 VanDerWaalsContact O-N 3.15Å | ||
| 53 | P | 77.9 | Confident | 65.7 | Low | 74 Ų | 74 | 89.4 Ų | 89.4 | 48% | 0.481 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.1 | -34.8 | -172.9 | 24.6 | -34.1 | 0 | 0 | 0 | 112.1 | I51 Q55 M56 L57 | I51-P53 WeakPolarHBondContact O-CD 3.41Å; P53-Q55 VanDerWaalsContact C-N 3.32Å; P53-Q55 PolarHBondContact O-N 2.8Å; P53-M56 WeakPolarHBondContact O-CB 3.33Å; P53-M56 PolarHBondContact O-N 3.23Å; P53-L57 WeakPolarHBondContact O-CG 3.38Å; P53-L57 PolarHBondContact O-N 2.96Å |
| 54 | D | 81.5 | Confident | 68 | Low | 123 Ų | 123 | 86.6 Ų | 86.6 | 66% | 0.658 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -65.2 | -34.9 | 177.4 | -48.3 | -62.7 | 0 | 0 | 0 | 112.3 | N52 Y58 | N52-D54 PolarHBondContact O-N 2.72Å; D54-Y58 WeakPolarHBondContact O-CB 3.49Å; D54-Y58 PolarHBondContact O-N 3.41Å |
| 55 | Q | 79.7 | Confident | 70.4 | Confident | 82 Ų | 82 | 86.8 Ų | 86.8 | 38% | 0.383 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -69 | -45.1 | 174 | -68 | -177.7 | -18.3 | 0 | 0 | 110.8 | N52 P53 L57 Y58 Y59 | N52-Q55 HydrophobicContact CB-CB 3.98Å; N52-Q55 HydrophobicContact CB-CG 3.8Å; N52-Q55 PolarHBondContact ND2-OE1 2.9Å; N52-Q55 WeakPolarHBondContact O-CB 3.41Å; N52-Q55 PolarHBondContact O-N 3.01Å; P53-Q55 VanDerWaalsContact C-N 3.32Å; P53-Q55 PolarHBondContact O-N 2.8Å; Q55-L57 VanDerWaalsContact C-N 3.33Å; Q55-L57 PolarHBondContact O-N 3.49Å; Q55-Y58 PolarHBondContact O-N 2.85Å; Q55-Y59 HydrophobicContact CB-CD2 4.34Å; Q55-Y59 HydrophobicContact CB-CE2 4.15Å; Q55-Y59 WeakPolarHBondContact O-CD2 3.34Å; Q55-Y59 PolarHBondContact O-N 3.24Å |
| 56 | M | 75.5 | Confident | 72.6 | Confident | 45 Ų | 45 | 79.1 Ų | 79.1 | 22% | 0.222 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -57.1 | -46.3 | 175 | 173.2 | -173.9 | 147.1 | 0 | 0 | 111.4 | N52 P53 G60 W393 L396 L400 | N52-M56 PolarHBondContact O-N 3.15Å; N52-M56 VanDerWaalsContact O-N 3.15Å; P53-M56 WeakPolarHBondContact O-CB 3.33Å; P53-M56 PolarHBondContact O-N 3.23Å; M56-G60 PolarHBondContact O-N 3.4Å; M56-W393 HydrophobicContact CE-CE3 4.22Å; M56-W393 HydrophobicContact CE-CZ3 3.88Å; M56-W393 HydrophobicContact SD-CE3 3.87Å; M56-W393 HydrophobicContact SD-CZ3 4.14Å; M56-L396 HydrophobicContact CE-CD2 3.6Å; M56-L396 HydrophobicContact CG-CD2 4.36Å; M56-L396 HydrophobicContact SD-CD2 3.83Å; M56-L400 HydrophobicContact CB-CD1 4.44Å; M56-L400 HydrophobicContact CG-CD1 3.67Å |
| 57 | L | 81.6 | Confident | 74.9 | Confident | 115 Ų | 115 | 73.1 Ų | 73.1 | 60% | 0.602 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -64.1 | -43.7 | 176.2 | -72.6 | 169.6 | 0 | 0 | 0 | 111.8 | P53 Q55 G60 A61 | P53-L57 WeakPolarHBondContact O-CG 3.38Å; P53-L57 PolarHBondContact O-N 2.96Å; Q55-L57 VanDerWaalsContact C-N 3.33Å; Q55-L57 PolarHBondContact O-N 3.49Å; L57-G60 PolarHBondContact O-N 2.93Å; L57-A61 VanDerWaalsContact O-CB 3.26Å; L57-A61 WeakPolarHBondContact O-CB 3.41Å; L57-A61 PolarHBondContact O-N 2.86Å |
| 58 | Y | 84.1 | Confident | 77.3 | Confident | 141 Ų | 141 | 70.3 Ų | 70.3 | 55% | 0.553 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -60.2 | -50.6 | 177.7 | 175.1 | -96.8 | 0 | 0 | 0 | 112.3 | D54 Q55 A61 K62 | D54-Y58 WeakPolarHBondContact O-CB 3.49Å; D54-Y58 PolarHBondContact O-N 3.41Å; Q55-Y58 PolarHBondContact O-N 2.85Å; Y58-A61 PolarHBondContact O-N 3.09Å; Y58-K62 HydrophobicContact CE1-CD 4Å; Y58-K62 WeakPolarHBondContact O-CB 3.5Å; Y58-K62 PolarHBondContact O-N 3.49Å |
| 59 | Y | 79.5 | Confident | 79.2 | Confident | 52 Ų | 52 | 69 Ų | 69 | 20% | 0.204 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.6 | -39.5 | 179.2 | -69.9 | -63.5 | 0 | 0 | 0 | 111.9 | Q55 K62 Q63 I401 D404 | Q55-Y59 HydrophobicContact CB-CD2 4.34Å; Q55-Y59 HydrophobicContact CB-CE2 4.15Å; Q55-Y59 WeakPolarHBondContact O-CD2 3.34Å; Q55-Y59 PolarHBondContact O-N 3.24Å; Y59-K62 PolarHBondContact O-N 2.74Å; Y59-Q63 WeakPolarHBondContact O-CB 3.35Å; Y59-Q63 PolarHBondContact O-N 2.92Å; Y59-I401 HydrophobicContact CD2-CG1 3.75Å; Y59-I401 HydrophobicContact CE2-CD1 4.08Å; Y59-I401 HydrophobicContact CE2-CG1 3.42Å; Y59-I401 VanDerWaalsContact CE2-CG1 3.42Å; Y59-I401 HydrophobicContact CG-CG1 4.48Å; Y59-D404 HydrophobicContact CD1-CB 3.75Å; Y59-D404 HydrophobicContact CE1-CB 4.14Å; Y59-D404 WeakPolarHBondContact CE1-OD2 3.28Å |
| 60 | G | 78.7 | Confident | 81 | Confident | 18 Ų | 18 | 63.4 Ų | 63.4 | 19% | 0.186 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -62.7 | -47 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | M56 L57 Q63 I64 | M56-G60 PolarHBondContact O-N 3.4Å; L57-G60 PolarHBondContact O-N 2.93Å; G60-Q63 WeakPolarHBondContact O-CB 3.46Å; G60-Q63 PolarHBondContact O-N 3.35Å; G60-I64 WeakPolarHBondContact O-CG1 3.23Å; G60-I64 PolarHBondContact O-N 3.02Å; G60-I64 VanDerWaalsContact O-N 3.08Å |
| 61 | A | 84.5 | Confident | 82.6 | Confident | 46 Ų | 46 | 60.1 Ų | 60.1 | 38% | 0.38 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.6 | -42.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L57 Y58 Q63 I64 I65 | L57-A61 VanDerWaalsContact O-CB 3.26Å; L57-A61 WeakPolarHBondContact O-CB 3.41Å; L57-A61 PolarHBondContact O-N 2.86Å; Y58-A61 PolarHBondContact O-N 3.09Å; A61-Q63 VanDerWaalsContact C-N 3.35Å; A61-Q63 PolarHBondContact O-N 2.96Å; A61-I64 PolarHBondContact O-N 2.88Å; A61-I65 WeakPolarHBondContact O-CB 3.35Å; A61-I65 VanDerWaalsContact O-CG1 3.28Å; A61-I65 WeakPolarHBondContact O-CG1 3.49Å; A61-I65 PolarHBondContact O-N 3.39Å |
| 62 | K | 83.4 | Confident | 83.9 | Confident | 78 Ų | 78 | 58.5 Ų | 58.5 | 34% | 0.339 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.4 | -42.1 | 175.1 | -175.5 | -177.1 | 174.4 | -162 | 0 | 111.8 | Y58 Y59 S66 D404 | Y58-K62 HydrophobicContact CE1-CD 4Å; Y58-K62 WeakPolarHBondContact O-CB 3.5Å; Y58-K62 PolarHBondContact O-N 3.49Å; Y59-K62 PolarHBondContact O-N 2.74Å; K62-S66 WeakPolarHBondContact O-CB 3.48Å; K62-S66 PolarHBondContact O-N 2.89Å; K62-D404 VanDerWaalsContact CD-OD1 3.29Å; K62-D404 WeakPolarHBondContact CD-OD1 3.17Å; K62-D404 WeakPolarHBondContact CE-OD1 3.26Å; K62-D404 IonicContact NZ-OD1 3.74Å; K62-D404 PolarHBondContact NZ-OD1 2.87Å; K62-D404 IonicContact NZ-OD2 3.03Å; K62-D404 PolarHBondContact NZ-OD2 2.86Å |
| 63 | Q | 79.7 | Confident | 84.7 | Confident | 30 Ų | 30 | 59.6 Ų | 59.6 | 14% | 0.14 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -58.7 | -45.5 | 172.6 | 163.8 | 172.8 | -21.9 | 0 | 0 | 111.8 | Y59 G60 A61 L67 R403 V408 | Y59-Q63 WeakPolarHBondContact O-CB 3.35Å; Y59-Q63 PolarHBondContact O-N 2.92Å; G60-Q63 WeakPolarHBondContact O-CB 3.46Å; G60-Q63 PolarHBondContact O-N 3.35Å; A61-Q63 VanDerWaalsContact C-N 3.35Å; A61-Q63 PolarHBondContact O-N 2.96Å; Q63-L67 PolarHBondContact O-N 3.39Å; Q63-R403 VanDerWaalsContact NE2-NH2 3.16Å; Q63-V408 HydrophobicContact CB-CG2 4.28Å; Q63-V408 HydrophobicContact CG-CG2 3.79Å |
| 64 | I | 83.7 | Confident | 85.5 | Confident | 41 Ų | 41 | 56.1 Ų | 56.1 | 21% | 0.21 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -65.4 | -50.9 | 179 | -67 | 161.6 | 0 | 0 | 0 | 110.9 | G60 A61 S66 L67 F68 V449 | G60-I64 WeakPolarHBondContact O-CG1 3.23Å; G60-I64 PolarHBondContact O-N 3.02Å; G60-I64 VanDerWaalsContact O-N 3.08Å; A61-I64 PolarHBondContact O-N 2.88Å; I64-S66 VanDerWaalsContact C-N 3.31Å; I64-S66 PolarHBondContact O-N 3.39Å; I64-L67 WeakPolarHBondContact O-CB 3.22Å; I64-L67 PolarHBondContact O-N 2.93Å; I64-F68 HydrophobicContact CG2-CD1 3.9Å; I64-F68 HydrophobicContact CG2-CE1 3.78Å; I64-F68 HydrophobicContact CG2-CG 4.41Å; I64-F68 HydrophobicContact CG2-CZ 4.18Å; I64-F68 VanDerWaalsContact O-CD1 3.3Å; I64-F68 WeakPolarHBondContact O-CD1 3.45Å; I64-F68 PolarHBondContact O-N 3.47Å; I64-V449 HydrophobicContact CD1-CG1 4.3Å; I64-V449 HydrophobicContact CG1-CB 4.44Å; I64-V449 HydrophobicContact CG1-CG1 3.73Å |
| 65 | I | 86.5 | Confident | 86.2 | Confident | 99 Ų | 99 | 50.2 Ų | 50.2 | 51% | 0.508 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -59.9 | -42.6 | -179.3 | -68.1 | 164.1 | 0 | 0 | 0 | 110.9 | A61 L67 F68 I69 | A61-I65 WeakPolarHBondContact O-CB 3.35Å; A61-I65 VanDerWaalsContact O-CG1 3.28Å; A61-I65 WeakPolarHBondContact O-CG1 3.49Å; A61-I65 PolarHBondContact O-N 3.39Å; I65-L67 PolarHBondContact O-N 3.25Å; I65-F68 PolarHBondContact O-N 3.06Å; I65-I69 HydrophobicContact CG2-CD1 3.66Å; I65-I69 HydrophobicContact CG2-CG1 4.27Å; I65-I69 WeakPolarHBondContact O-CG1 3.35Å; I65-I69 PolarHBondContact O-N 3.21Å; I65-I69 VanDerWaalsContact O-N 3.1Å |
| 66 | S | 83 | Confident | 87.1 | Confident | 41 Ų | 41 | 51 Ų | 51 | 29% | 0.287 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -67.4 | -16.9 | 178.4 | -171.6 | 0 | 0 | 0 | 0 | 114.1 | K62 I64 T272 | K62-S66 WeakPolarHBondContact O-CB 3.48Å; K62-S66 PolarHBondContact O-N 2.89Å; I64-S66 VanDerWaalsContact C-N 3.31Å; I64-S66 PolarHBondContact O-N 3.39Å; S66-T272 VanDerWaalsContact OG-CB 3.28Å; S66-T272 WeakPolarHBondContact OG-CB 3.39Å; S66-T272 WeakPolarHBondContact OG-CG2 3.35Å |
| 67 | L | 83.1 | Confident | 88.1 | Confident | 16 Ų | 16 | 52 Ų | 52 | 8% | 0.084 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -89.9 | -42.2 | 173.4 | -165.4 | 169 | 0 | 0 | 0 | 110.2 | Q63 I64 I65 P70 V71 V408 L410 M445 V449 | Q63-L67 PolarHBondContact O-N 3.39Å; I64-L67 WeakPolarHBondContact O-CB 3.22Å; I64-L67 PolarHBondContact O-N 2.93Å; I65-L67 PolarHBondContact O-N 3.25Å; L67-P70 WeakPolarHBondContact O-CD 2.97Å; L67-P70 WeakPolarHBondContact O-CG 3.11Å; L67-V71 HydrophobicContact CD2-CG2 4.31Å; L67-V71 WeakPolarHBondContact O-CG2 3.3Å; L67-V408 HydrophobicContact CD1-CG1 4.36Å; L67-L410 HydrophobicContact CD1-CD1 3.99Å; L67-L410 HydrophobicContact CD2-CD1 4.26Å; L67-L410 HydrophobicContact CD2-CD2 3.72Å; L67-L410 HydrophobicContact CG-CD1 4.06Å; L67-L410 HydrophobicContact CG-CD2 3.94Å; L67-M445 HydrophobicContact CD2-CE 3.34Å; L67-V449 HydrophobicContact CD1-CG2 4.2Å |
| 68 | F | 90.1 | Very high | 88.8 | Confident | 39 Ų | 39 | 46.6 Ų | 46.6 | 17% | 0.171 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.3 | -48.2 | -176.2 | -86 | 40.2 | 0 | 0 | 0 | 112.8 | I64 I65 V71 T72 L442 M445 C446 | I64-F68 HydrophobicContact CG2-CD1 3.9Å; I64-F68 HydrophobicContact CG2-CE1 3.78Å; I64-F68 HydrophobicContact CG2-CG 4.41Å; I64-F68 HydrophobicContact CG2-CZ 4.18Å; I64-F68 VanDerWaalsContact O-CD1 3.3Å; I64-F68 WeakPolarHBondContact O-CD1 3.45Å; I64-F68 PolarHBondContact O-N 3.47Å; I65-F68 PolarHBondContact O-N 3.06Å; F68-V71 PolarHBondContact O-N 3.28Å; F68-V71 VanDerWaalsContact O-N 3.15Å; F68-T72 WeakPolarHBondContact O-CB 3.36Å; F68-T72 PolarHBondContact O-N 2.91Å; F68-T72 PolarHBondContact O-OG1 3.37Å; F68-L442 HydrophobicContact CD2-CD2 3.98Å; F68-L442 HydrophobicContact CE2-CB 4.13Å; F68-L442 HydrophobicContact CE2-CD2 4.09Å; F68-L442 HydrophobicContact CG-CD2 4.5Å; F68-L442 VanDerWaalsContact CZ-O 3.28Å; F68-L442 WeakPolarHBondContact CZ-O 3.22Å; F68-M445 HydrophobicContact CD1-CE 4.38Å; F68-M445 HydrophobicContact CE1-CB 4.03Å; F68-M445 HydrophobicContact CE1-CE 4.33Å; F68-M445 HydrophobicContact CZ-CB 4.14Å; F68-C446 HydrophobicContact CZ-CB 3.91Å |
| 69 | I | 91.6 | Very high | 89.4 | Confident | 104 Ų | 104 | 41.3 Ų | 41.3 | 53% | 0.533 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -49.3 | -56.3 | -175.9 | -69.3 | 165.2 | 0 | 0 | 0 | 113 | I65 V71 T72 V73 | I65-I69 HydrophobicContact CG2-CD1 3.66Å; I65-I69 HydrophobicContact CG2-CG1 4.27Å; I65-I69 WeakPolarHBondContact O-CG1 3.35Å; I65-I69 PolarHBondContact O-N 3.21Å; I65-I69 VanDerWaalsContact O-N 3.1Å; I69-V71 VanDerWaalsContact C-N 3.34Å; I69-V71 PolarHBondContact O-N 3.12Å; I69-T72 PolarHBondContact O-N 2.78Å; I69-V73 WeakPolarHBondContact O-CG2 3.35Å; I69-V73 PolarHBondContact O-N 2.75Å |
| 70 | P | 91.3 | Very high | 90.2 | Very high | 6 Ų | 6 | 41.2 Ų | 41.2 | 4% | 0.039 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -71.7 | -26.5 | -176.6 | 31 | -38.9 | 0 | 0 | 0 | 113.4 | L67 C74 I209 Y270 F415 | L67-P70 WeakPolarHBondContact O-CD 2.97Å; L67-P70 WeakPolarHBondContact O-CG 3.11Å; P70-C74 WeakPolarHBondContact O-CB 3.08Å; P70-C74 PolarHBondContact O-N 2.9Å; P70-C74 VanDerWaalsContact O-N 3.09Å; P70-I209 HydrophobicContact CB-CD1 3.62Å; P70-I209 HydrophobicContact CB-CG1 4.17Å; P70-Y270 HydrophobicContact CB-CE1 4.15Å; P70-Y270 HydrophobicContact CB-CE2 4.03Å; P70-Y270 VanDerWaalsContact CB-OH 3.29Å; P70-Y270 WeakPolarHBondContact CB-OH 3.47Å; P70-Y270 HydrophobicContact CG-CE1 3.8Å; P70-F415 HydrophobicContact CB-CE1 3.86Å; P70-F415 HydrophobicContact CB-CZ 4.48Å; P70-F415 HydrophobicContact CG-CE1 4.05Å; P70-F415 HydrophobicContact CG-CZ 4.38Å |
| 71 | V | 92.8 | Very high | 91 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -70.6 | -47.8 | 174.2 | 174 | 0 | 0 | 0 | 0 | 110.3 | L67 F68 I69 V73 C74 M75 L410 F415 Y418 M445 | L67-V71 HydrophobicContact CD2-CG2 4.31Å; L67-V71 WeakPolarHBondContact O-CG2 3.3Å; F68-V71 PolarHBondContact O-N 3.28Å; F68-V71 VanDerWaalsContact O-N 3.15Å; I69-V71 VanDerWaalsContact C-N 3.34Å; I69-V71 PolarHBondContact O-N 3.12Å; V71-V73 VanDerWaalsContact C-N 3.33Å; V71-V73 PolarHBondContact O-N 2.95Å; V71-C74 WeakPolarHBondContact O-CB 3.37Å; V71-C74 PolarHBondContact O-N 3.21Å; V71-C74 VanDerWaalsContact O-N 3.14Å; V71-M75 HydrophobicContact CG1-CE 3.65Å; V71-M75 HydrophobicContact CG1-CG 4.39Å; V71-M75 HydrophobicContact CG1-SD 3.98Å; V71-M75 VanDerWaalsContact O-CG 3.32Å; V71-M75 WeakPolarHBondContact O-CG 3.1Å; V71-M75 PolarHBondContact O-N 2.86Å; V71-L410 HydrophobicContact CG2-CD2 3.9Å; V71-F415 HydrophobicContact CB-CD1 4.35Å; V71-F415 HydrophobicContact CB-CE1 4.39Å; V71-F415 HydrophobicContact CG2-CD1 3.64Å; V71-F415 HydrophobicContact CG2-CE1 3.5Å; V71-F415 VanDerWaalsContact CG2-CE1 3.5Å; V71-F415 HydrophobicContact CG2-CG 4.37Å; V71-F415 HydrophobicContact CG2-CZ 4.16Å; V71-Y418 HydrophobicContact CG1-CD2 3.84Å; V71-M445 HydrophobicContact CB-CE 4.17Å; V71-M445 HydrophobicContact CG1-CE 3.93Å; V71-M445 HydrophobicContact CG1-SD 4.02Å; V71-M445 HydrophobicContact CG2-CE 4.04Å |
| 72 | T | 94.8 | Very high | 91.5 | Very high | 29 Ų | 29 | 39 Ų | 39 | 18% | 0.178 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -54.3 | -45.6 | 171.9 | -79.9 | 0 | 0 | 0 | 0 | 111.8 | F68 I69 C74 M75 L76 Y438 | F68-T72 WeakPolarHBondContact O-CB 3.36Å; F68-T72 PolarHBondContact O-N 2.91Å; F68-T72 PolarHBondContact O-OG1 3.37Å; I69-T72 PolarHBondContact O-N 2.78Å; T72-C74 VanDerWaalsContact C-N 3.35Å; T72-C74 PolarHBondContact O-N 2.67Å; T72-M75 PolarHBondContact O-N 3.17Å; T72-L76 HydrophobicContact CG2-CD1 3.65Å; T72-L76 HydrophobicContact CG2-CG 4.29Å; T72-L76 WeakPolarHBondContact O-CB 3.3Å; T72-L76 VanDerWaalsContact O-CG 3.26Å; T72-L76 WeakPolarHBondContact O-CG 3.48Å; T72-L76 PolarHBondContact O-N 3Å; T72-Y438 WeakPolarHBondContact CG2-OH 3.49Å; T72-Y438 PolarHBondContact OG1-OH 2.99Å |
| 73 | V | 95.2 | Very high | 92 | Very high | 73 Ų | 73 | 39 Ų | 39 | 44% | 0.442 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.7 | -39.4 | 178 | 171.4 | 0 | 0 | 0 | 0 | 111.7 | I69 V71 F77 I209 | I69-V73 WeakPolarHBondContact O-CG2 3.35Å; I69-V73 PolarHBondContact O-N 2.75Å; V71-V73 VanDerWaalsContact C-N 3.33Å; V71-V73 PolarHBondContact O-N 2.95Å; V73-F77 VanDerWaalsContact O-CB 3.31Å; V73-F77 WeakPolarHBondContact O-CB 3.23Å; V73-F77 PolarHBondContact O-N 3.46Å; V73-F77 VanDerWaalsContact O-N 3.07Å; V73-I209 HydrophobicContact CG1-CG2 4.22Å |
| 74 | C | 96.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.4 | -47.5 | 176.2 | -157.5 | 0 | 0 | 0 | 0 | 111.9 | P70 V71 T72 F77 V78 I209 S212 F415 S419 | P70-C74 WeakPolarHBondContact O-CB 3.08Å; P70-C74 PolarHBondContact O-N 2.9Å; P70-C74 VanDerWaalsContact O-N 3.09Å; V71-C74 WeakPolarHBondContact O-CB 3.37Å; V71-C74 PolarHBondContact O-N 3.21Å; V71-C74 VanDerWaalsContact O-N 3.14Å; T72-C74 VanDerWaalsContact C-N 3.35Å; T72-C74 PolarHBondContact O-N 2.67Å; C74-F77 PolarHBondContact O-N 2.99Å; C74-V78 PolarHBondContact O-N 2.84Å; C74-I209 HydrophobicContact CB-CG2 3.92Å; C74-I209 PolarHBondContact SG-O 3.26Å; C74-I209 VanDerWaalsContact SG-O 3.33Å; C74-S212 PolarHBondContact SG-OG 2.92Å; C74-F415 HydrophobicContact CB-CD1 4.27Å; C74-S419 PolarHBondContact SG-OG 3.37Å; C74-S419 VanDerWaalsContact SG-OG 3.37Å |
| 75 | M | 96 | Very high | 93.2 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.6 | -53.7 | 175.2 | -69.7 | 163.9 | 163.4 | 0 | 0 | 111.6 | V71 T72 F77 V78 V79 Y418 I422 Y438 I441 L442 | V71-M75 HydrophobicContact CG1-CE 3.65Å; V71-M75 HydrophobicContact CG1-CG 4.39Å; V71-M75 HydrophobicContact CG1-SD 3.98Å; V71-M75 VanDerWaalsContact O-CG 3.32Å; V71-M75 WeakPolarHBondContact O-CG 3.1Å; V71-M75 PolarHBondContact O-N 2.86Å; T72-M75 PolarHBondContact O-N 3.17Å; M75-F77 VanDerWaalsContact C-N 3.31Å; M75-F77 PolarHBondContact O-N 3.49Å; M75-V78 PolarHBondContact O-N 2.91Å; M75-V79 WeakPolarHBondContact O-CG2 3.21Å; M75-V79 PolarHBondContact O-N 2.77Å; M75-Y418 HydrophobicContact CE-CG 4.21Å; M75-I422 HydrophobicContact CB-CG2 4.11Å; M75-I422 HydrophobicContact CG-CG2 4.21Å; M75-Y438 HydrophobicContact CB-CD2 4.26Å; M75-Y438 HydrophobicContact CB-CE2 4.16Å; M75-Y438 HydrophobicContact SD-CD2 3.61Å; M75-Y438 HydrophobicContact SD-CE2 3.48Å; M75-Y438 WeakPolarHBondContact SD-CE2 3.29Å; M75-I441 HydrophobicContact CE-CB 3.94Å; M75-I441 HydrophobicContact CE-CD1 4.28Å; M75-I441 HydrophobicContact CE-CG2 3.39Å; M75-L442 HydrophobicContact CE-CD2 4.46Å; M75-L442 HydrophobicContact SD-CD2 4.48Å |
| 76 | L | 96.9 | Very high | 93.4 | Very high | 97 Ų | 97 | 41.4 Ų | 41.4 | 51% | 0.508 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -62 | -38.1 | -177.2 | -72.4 | 172.9 | 0 | 0 | 0 | 112.1 | T72 A80 | T72-L76 HydrophobicContact CG2-CD1 3.65Å; T72-L76 HydrophobicContact CG2-CG 4.29Å; T72-L76 WeakPolarHBondContact O-CB 3.3Å; T72-L76 VanDerWaalsContact O-CG 3.26Å; T72-L76 WeakPolarHBondContact O-CG 3.48Å; T72-L76 PolarHBondContact O-N 3Å; L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.21Å; L76-A80 PolarHBondContact O-N 3.46Å |
| 77 | F | 96.9 | Very high | 93.8 | Very high | 68 Ų | 68 | 42.4 Ų | 42.4 | 30% | 0.298 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.1 | -45.4 | 174.3 | 177.2 | -87.5 | 0 | 0 | 0 | 111.7 | V73 C74 M75 A80 V81 F163 F210 A213 L217 | V73-F77 VanDerWaalsContact O-CB 3.31Å; V73-F77 WeakPolarHBondContact O-CB 3.23Å; V73-F77 PolarHBondContact O-N 3.46Å; V73-F77 VanDerWaalsContact O-N 3.07Å; C74-F77 PolarHBondContact O-N 2.99Å; M75-F77 VanDerWaalsContact C-N 3.31Å; M75-F77 PolarHBondContact O-N 3.49Å; F77-A80 PolarHBondContact O-N 3.28Å; F77-V81 HydrophobicContact CD1-CG2 4.34Å; F77-V81 HydrophobicContact CE1-CG2 4.06Å; F77-V81 HydrophobicContact CZ-CG2 4.18Å; F77-V81 VanDerWaalsContact O-CG2 3.3Å; F77-V81 WeakPolarHBondContact O-CG2 3.44Å; F77-V81 PolarHBondContact O-N 3.39Å; F77-F163 HydrophobicContact CE1-CE2 4.33Å; F77-F163 HydrophobicContact CE1-CZ 4.24Å; F77-F163 HydrophobicContact CE2-CZ 4.29Å; F77-F163 HydrophobicContact CZ-CE1 4.23Å; F77-F163 HydrophobicContact CZ-CE2 4.01Å; F77-F163 AromaticContact CZ-CZ 3.49Å; F77-F163 HydrophobicContact CZ-CZ 3.49Å; F77-F163 VanDerWaalsContact CZ-CZ 3.49Å; F77-F210 HydrophobicContact CE1-CD2 4.44Å; F77-F210 HydrophobicContact CE2-CD2 4.47Å; F77-F210 AromaticContact CZ-CD2 3.89Å; F77-F210 HydrophobicContact CZ-CD2 3.89Å; F77-F210 AromaticContact CZ-CE2 3.8Å; F77-F210 HydrophobicContact CZ-CE2 3.8Å; F77-A213 HydrophobicContact CD1-CB 3.49Å; F77-A213 VanDerWaalsContact CD1-CB 3.49Å; F77-A213 HydrophobicContact CE1-CB 3.7Å; F77-L217 HydrophobicContact CE1-CD1 4.36Å |
| 78 | V | 97.4 | Very high | 94.2 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -68 | -38.4 | 178.1 | 171.8 | 0 | 0 | 0 | 0 | 112 | C74 M75 V81 A82 A213 L217 S419 | C74-V78 PolarHBondContact O-N 2.84Å; M75-V78 PolarHBondContact O-N 2.91Å; V78-V81 PolarHBondContact O-N 3.05Å; V78-A82 WeakPolarHBondContact O-CB 3.46Å; V78-A82 PolarHBondContact O-N 3.32Å; V78-A213 HydrophobicContact CG2-CB 3.57Å; V78-L217 HydrophobicContact CG1-CD2 4.06Å; V78-L217 HydrophobicContact CG1-CG 4.35Å; V78-L217 HydrophobicContact CG2-CG 4.24Å; V78-S419 WeakPolarHBondContact CG1-O 3.4Å |
| 79 | V | 96.6 | Very high | 94 | Very high | 30 Ų | 30 | 41.8 Ų | 41.8 | 18% | 0.182 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.2 | -50 | 172.7 | 171.4 | 0 | 0 | 0 | 0 | 110.5 | M75 V81 A82 S83 I422 T426 V434 | M75-V79 WeakPolarHBondContact O-CG2 3.21Å; M75-V79 PolarHBondContact O-N 2.77Å; V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 3.17Å; V79-A82 PolarHBondContact O-N 2.88Å; V79-S83 WeakPolarHBondContact O-CB 3.25Å; V79-S83 PolarHBondContact O-N 3.36Å; V79-S83 PolarHBondContact O-OG 2.84Å; V79-I422 HydrophobicContact CG2-CB 4.35Å; V79-I422 HydrophobicContact CG2-CG1 3.56Å; V79-I422 HydrophobicContact CG2-CG2 3.91Å; V79-T426 HydrophobicContact CG1-CG2 4.38Å; V79-V434 HydrophobicContact CG1-CG1 4.35Å; V79-V434 HydrophobicContact CG2-CG1 4.32Å |
| 80 | A | 96.1 | Very high | 93.6 | Very high | 51 Ų | 51 | 42.4 Ų | 42.4 | 42% | 0.421 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61 | -40.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L76 F77 S83 T84 | L76-A80 VanDerWaalsContact O-CB 3.28Å; L76-A80 WeakPolarHBondContact O-CB 3.21Å; L76-A80 PolarHBondContact O-N 3.46Å; F77-A80 PolarHBondContact O-N 3.28Å; A80-S83 PolarHBondContact O-OG 2.94Å; A80-T84 WeakPolarHBondContact O-CB 3.38Å; A80-T84 VanDerWaalsContact O-CG2 3.3Å; A80-T84 WeakPolarHBondContact O-CG2 3.03Å; A80-T84 PolarHBondContact O-N 3.45Å; A80-T84 PolarHBondContact O-OG1 2.89Å |
| 81 | V | 96.1 | Very high | 93.1 | Very high | 10 Ų | 10 | 43.5 Ų | 43.5 | 6% | 0.061 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -68.2 | -47.4 | 175.8 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | F77 V78 V79 S83 T84 V85 Y88 F163 L217 | F77-V81 HydrophobicContact CD1-CG2 4.34Å; F77-V81 HydrophobicContact CE1-CG2 4.06Å; F77-V81 HydrophobicContact CZ-CG2 4.18Å; F77-V81 VanDerWaalsContact O-CG2 3.3Å; F77-V81 WeakPolarHBondContact O-CG2 3.44Å; F77-V81 PolarHBondContact O-N 3.39Å; V78-V81 PolarHBondContact O-N 3.05Å; V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 3.17Å; V81-S83 PolarHBondContact O-N 3.02Å; V81-T84 PolarHBondContact O-N 3.43Å; V81-T84 VanDerWaalsContact O-N 3.16Å; V81-V85 HydrophobicContact CG1-CB 4.36Å; V81-V85 HydrophobicContact CG1-CG2 4.21Å; V81-V85 WeakPolarHBondContact O-CB 3.39Å; V81-V85 PolarHBondContact O-N 3.04Å; V81-Y88 HydrophobicContact CG1-CD2 3.82Å; V81-Y88 HydrophobicContact CG1-CE2 3.6Å; V81-F163 HydrophobicContact CG1-CE2 3.98Å; V81-F163 HydrophobicContact CG2-CE2 3.76Å; V81-F163 HydrophobicContact CG2-CZ 4.18Å; V81-L217 HydrophobicContact CB-CD1 4.23Å; V81-L217 HydrophobicContact CB-CD2 4.18Å; V81-L217 HydrophobicContact CG1-CD1 3.82Å; V81-L217 HydrophobicContact CG1-CD2 3.75Å; V81-L217 HydrophobicContact CG1-CG 4.47Å; V81-L217 HydrophobicContact CG2-CD1 4.48Å |
| 82 | A | 95 | Very high | 92 | Very high | 7 Ų | 7 | 49.2 Ų | 49.2 | 6% | 0.058 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63 | -27.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | V78 V79 L220 T426 L427 | V78-A82 WeakPolarHBondContact O-CB 3.46Å; V78-A82 PolarHBondContact O-N 3.32Å; V79-A82 PolarHBondContact O-N 2.88Å; A82-L220 HydrophobicContact CB-CD2 4.06Å; A82-T426 HydrophobicContact CB-CG2 4.09Å; A82-L427 HydrophobicContact CB-CD2 4.29Å; A82-L427 HydrophobicContact CB-CG 4.48Å; A82-L427 WeakPolarHBondContact O-CD2 3.5Å |
| 83 | S | 94 | Very high | 90.9 | Very high | 77 Ų | 77 | 54.2 Ų | 54.2 | 54% | 0.538 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.5 | -0.9 | 176.8 | 74.5 | 0 | 0 | 0 | 0 | 114.9 | V79 A80 V81 | V79-S83 WeakPolarHBondContact O-CB 3.25Å; V79-S83 PolarHBondContact O-N 3.36Å; V79-S83 PolarHBondContact O-OG 2.84Å; A80-S83 PolarHBondContact O-OG 2.94Å; V81-S83 PolarHBondContact O-N 3.02Å |
| 84 | T | 93.3 | Very high | 90 | Very high | 90 Ų | 90 | 53.9 Ų | 53.9 | 55% | 0.552 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -126.4 | -12.6 | 180 | 56.9 | 0 | 0 | 0 | 0 | 114.3 | A80 V81 | A80-T84 WeakPolarHBondContact O-CB 3.38Å; A80-T84 VanDerWaalsContact O-CG2 3.3Å; A80-T84 WeakPolarHBondContact O-CG2 3.03Å; A80-T84 PolarHBondContact O-N 3.45Å; A80-T84 PolarHBondContact O-OG1 2.89Å; V81-T84 PolarHBondContact O-N 3.43Å; V81-T84 VanDerWaalsContact O-N 3.16Å |
| 85 | V | 94.3 | Very high | 88.8 | Confident | 4 Ų | 4 | 55.8 Ų | 55.8 | 2% | 0.024 | 31% | 0.306 | C | S | . | . | trans | -126.3 | 88.4 | -175.3 | -173 | 0 | 0 | 0 | 0 | 109.6 | V81 F87 Y88 E166 V167 A170 | V81-V85 HydrophobicContact CG1-CB 4.36Å; V81-V85 HydrophobicContact CG1-CG2 4.21Å; V81-V85 WeakPolarHBondContact O-CB 3.39Å; V81-V85 PolarHBondContact O-N 3.04Å; V85-F87 HydrophobicContact CG1-CB 4.13Å; V85-F87 PolarHBondContact O-N 3.26Å; V85-Y88 HydrophobicContact CB-CD2 3.97Å; V85-Y88 HydrophobicContact CB-CE2 4.24Å; V85-Y88 HydrophobicContact CG1-CD2 3.9Å; V85-Y88 HydrophobicContact CG1-CE2 3.91Å; V85-Y88 PolarHBondContact O-N 2.91Å; V85-E166 HydrophobicContact CG1-CB 3.8Å; V85-V167 HydrophobicContact CG2-CG2 4.06Å; V85-A170 HydrophobicContact CB-CB 4.37Å; V85-A170 HydrophobicContact CG1-CB 4.3Å; V85-A170 HydrophobicContact CG2-CB 3.92Å | ||
| 86 | D | 91.6 | Very high | 87.6 | Confident | 128 Ų | 128 | 63 Ų | 63 | 68% | 0.684 | 34% | 0.343 | S | S | * | . | G | 310 helix | trans | -51.8 | -24.7 | -174.8 | -58.4 | -37.7 | 0 | 0 | 0 | 114.4 | Y88 G89 H90 | D86-Y88 PolarHBondContact O-N 3.25Å; D86-Y88 VanDerWaalsContact O-N 3.11Å; D86-G89 WeakPolarHBondContact O-CA 3.19Å; D86-G89 PolarHBondContact O-N 2.86Å; D86-H90 PolarHBondContact O-CD2 3.15Å |
| 87 | F | 91 | Very high | 86.4 | Confident | 62 Ų | 62 | 62.8 Ų | 62.8 | 27% | 0.272 | 34% | 0.336 | S | S | . | . | G | 310 helix | trans | -49 | -36.2 | 173.3 | 177.5 | -95.1 | 0 | 0 | 0 | 113 | V85 G89 T162 E166 K221 | V85-F87 HydrophobicContact CG1-CB 4.13Å; V85-F87 PolarHBondContact O-N 3.26Å; F87-G89 VanDerWaalsContact C-N 3.35Å; F87-T162 HydrophobicContact CZ-CG2 4.41Å; F87-E166 HydrophobicContact CB-CB 4.44Å; F87-E166 HydrophobicContact CB-CG 4.16Å; F87-E166 HydrophobicContact CD1-CG 3.75Å; F87-E166 HydrophobicContact CD2-CG 4.01Å; F87-E166 WeakPolarHBondContact CD2-OE2 3.31Å; F87-E166 HydrophobicContact CE1-CG 4.05Å; F87-E166 HydrophobicContact CE2-CG 4.3Å; F87-E166 HydrophobicContact CG-CB 4.48Å; F87-E166 HydrophobicContact CG-CG 3.71Å; F87-E166 HydrophobicContact CZ-CG 4.31Å; F87-K221 HydrophobicContact CD1-CD 3.78Å; F87-K221 HydrophobicContact CE1-CD 3.57Å; F87-K221 HydrophobicContact CE1-CG 3.99Å; F87-K221 HydrophobicContact CG-CD 4.43Å; F87-K221 HydrophobicContact CZ-CD 4.06Å; F87-K221 HydrophobicContact CZ-CG 4.46Å; F87-K221 WeakPolarHBondContact O-CD 3.49Å; F87-K221 WeakPolarHBondContact O-CE 3.42Å; F87-K221 PolarHBondContact O-NZ 3.41Å |
| 88 | Y | 91.2 | Very high | 85.6 | Confident | 10 Ų | 10 | 59.6 Ų | 59.6 | 4% | 0.039 | 32% | 0.322 | C | S | . | . | G | 310 helix | trans | -78.1 | -17.2 | 178.2 | -65.6 | -75.5 | 0 | 0 | 0 | 113.7 | V81 V85 D86 L217 K221 L427 | V81-Y88 HydrophobicContact CG1-CD2 3.82Å; V81-Y88 HydrophobicContact CG1-CE2 3.6Å; V85-Y88 HydrophobicContact CB-CD2 3.97Å; V85-Y88 HydrophobicContact CB-CE2 4.24Å; V85-Y88 HydrophobicContact CG1-CD2 3.9Å; V85-Y88 HydrophobicContact CG1-CE2 3.91Å; V85-Y88 PolarHBondContact O-N 2.91Å; D86-Y88 PolarHBondContact O-N 3.25Å; D86-Y88 VanDerWaalsContact O-N 3.11Å; Y88-L217 HydrophobicContact CD1-CB 4.15Å; Y88-L217 HydrophobicContact CD1-CD2 4.07Å; Y88-L217 HydrophobicContact CD2-CD2 4.32Å; Y88-L217 HydrophobicContact CE1-CB 3.69Å; Y88-L217 HydrophobicContact CE1-CD2 4.2Å; Y88-L217 HydrophobicContact CE1-CG 4.43Å; Y88-L217 HydrophobicContact CE2-CD2 4.42Å; Y88-L217 HydrophobicContact CG-CD2 4.15Å; Y88-K221 HydrophobicContact CD1-CB 4.1Å; Y88-L427 WeakPolarHBondContact O-CD1 3.5Å |
| 89 | G | 85.9 | Confident | 84.5 | Confident | 31 Ų | 31 | 62.9 Ų | 62.9 | 32% | 0.32 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -27.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | D86 F87 | D86-G89 WeakPolarHBondContact O-CA 3.19Å; D86-G89 PolarHBondContact O-N 2.86Å; F87-G89 VanDerWaalsContact C-N 3.35Å |
| 90 | H | 83.3 | Confident | 83.6 | Confident | 118 Ų | 118 | 66.4 Ų | 66.4 | 55% | 0.546 | 36% | 0.357 | S | S | . | . | trans | -105.6 | 145.1 | -175.5 | -63.1 | -79.2 | 0 | 0 | 0 | 112.2 | D86 K221 | D86-H90 PolarHBondContact O-CD2 3.15Å; H90-K221 PolarHBondContact O-NZ 3.5Å | ||
| 91 | T | 80 | Confident | 82.6 | Confident | 28 Ų | 28 | 68 Ų | 68 | 17% | 0.172 | 36% | 0.355 | C | S | . | . | trans | -122.7 | 75.5 | -179.3 | -52 | 0 | 0 | 0 | 0 | 110.9 | Y94 K221 | T91-Y94 HydrophobicContact CG2-CD1 3.62Å; T91-Y94 HydrophobicContact CG2-CE1 3.34Å; T91-Y94 HydrophobicContact CG2-CE2 4.3Å; T91-Y94 HydrophobicContact CG2-CG 4.24Å; T91-Y94 VanDerWaalsContact O-CE2 3.22Å; T91-Y94 WeakPolarHBondContact O-CE2 3.42Å; T91-Y94 PolarHBondContact O-OH 3.08Å; T91-K221 WeakPolarHBondContact CG2-O 3.48Å; T91-K221 PolarHBondContact OG1-O 3.43Å | ||
| 92 | D | 70.7 | Confident | 81.5 | Confident | 121 Ų | 121 | 70.5 Ų | 70.5 | 65% | 0.647 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -83.8 | -24.1 | 179.3 | -24.5 | -87.3 | 0 | 0 | 0 | 112.2 | K221 | D92-K221 IonicContact OD2-NZ 2.7Å; D92-K221 PolarHBondContact OD2-NZ 2.95Å |
| 93 | Q | 71.4 | Confident | 80.2 | Confident | 133 Ų | 133 | 74.4 Ų | 74.4 | 62% | 0.621 | 40% | 0.395 | S | S | * | . | S | Bend | trans | -122.1 | 130.3 | 175.4 | -68.6 | -176.5 | -7.1 | 0 | 0 | 108.5 | Y222 | Q93-Y222 HydrophobicContact CB-CE1 4.29Å; Q93-Y222 WeakPolarHBondContact O-CD1 3.31Å |
| 94 | Y | 75.8 | Confident | 79.1 | Confident | 66 Ų | 66 | 78.6 Ų | 78.6 | 26% | 0.259 | 41% | 0.412 | S | S | . | . | trans | -105.2 | 153.5 | -179.6 | -65.9 | -88.6 | 0 | 0 | 0 | 110.2 | T91 H101 P224 | T91-Y94 HydrophobicContact CG2-CD1 3.62Å; T91-Y94 HydrophobicContact CG2-CE1 3.34Å; T91-Y94 HydrophobicContact CG2-CE2 4.3Å; T91-Y94 HydrophobicContact CG2-CG 4.24Å; T91-Y94 VanDerWaalsContact O-CE2 3.22Å; T91-Y94 WeakPolarHBondContact O-CE2 3.42Å; T91-Y94 PolarHBondContact O-OH 3.08Å; Y94-H101 HydrophobicContact CD1-CB 4.22Å; Y94-H101 AromaticContact CD2-CD2 3.46Å; Y94-H101 VanDerWaalsContact CD2-CD2 3.46Å; Y94-H101 WeakPolarHBondContact CD2-CD2 3.21Å; Y94-H101 AromaticContact CD2-CE1 3.64Å; Y94-H101 AromaticContact CD2-CG 3.72Å; Y94-H101 AromaticContact CD2-ND1 3.82Å; Y94-H101 AromaticContact CD2-NE2 3.42Å; Y94-H101 WeakPolarHBondContact CD2-NE2 3.29Å; Y94-H101 HydrophobicContact CE1-CB 3.99Å; Y94-H101 HydrophobicContact CE2-CB 4.41Å; Y94-H101 AromaticContact CE2-CD2 3.3Å; Y94-H101 WeakPolarHBondContact CE2-CD2 3.32Å; Y94-H101 AromaticContact CE2-CG 3.79Å; Y94-H101 AromaticContact CE2-NE2 3.67Å; Y94-H101 AromaticContact CG-CE1 4Å; Y94-H101 AromaticContact CG-CG 3.9Å; Y94-H101 AromaticContact CG-ND1 3.81Å; Y94-H101 AromaticContact CZ-CD2 3.81Å; Y94-H101 AromaticContact CZ-CG 3.99Å; Y94-P224 HydrophobicContact CD1-CG 3.75Å; Y94-P224 HydrophobicContact CE1-CB 4.19Å; Y94-P224 HydrophobicContact CE1-CG 3.76Å | ||
| 95 | L | 70.7 | Confident | 78.3 | Confident | 41 Ų | 41 | 75.7 Ų | 75.7 | 22% | 0.215 | 40% | 0.397 | C | S | . | . | trans | -62.8 | 141.3 | 173.3 | -138.1 | 174.6 | 0 | 0 | 0 | 109.5 | Y97 T98 F121 Y222 L223 | L95-Y97 HydrophobicContact CD2-CD2 3.53Å; L95-Y97 HydrophobicContact CD2-CE2 4.02Å; L95-Y97 HydrophobicContact CD2-CG 4.22Å; L95-Y97 PolarHBondContact O-N 3.16Å; L95-T98 PolarHBondContact N-OG1 3.42Å; L95-T98 PolarHBondContact O-N 2.91Å; L95-T98 PolarHBondContact O-OG1 3.38Å; L95-F121 HydrophobicContact CD1-CD2 4.24Å; L95-F121 HydrophobicContact CD1-CE2 3.9Å; L95-Y222 PolarHBondContact N-O 3.35Å; L95-L223 HydrophobicContact CD1-CD2 4.4Å | ||
| 96 | L | 71.4 | Confident | 77.9 | Confident | 150 Ų | 150 | 81.6 Ų | 81.6 | 79% | 0.785 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.3 | -22.7 | 178.8 | -176.3 | 61.4 | 0 | 0 | 0 | 113.7 | ||
| 97 | Y | 72.4 | Confident | 77.8 | Confident | 93 Ų | 93 | 82.1 Ų | 82.1 | 37% | 0.365 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.6 | 2.7 | 178.5 | -50.3 | -48.4 | 0 | 0 | 0 | 114.4 | L95 P99 I120 V124 | L95-Y97 HydrophobicContact CD2-CD2 3.53Å; L95-Y97 HydrophobicContact CD2-CE2 4.02Å; L95-Y97 HydrophobicContact CD2-CG 4.22Å; L95-Y97 PolarHBondContact O-N 3.16Å; Y97-P99 VanDerWaalsContact O-CD 3.3Å; Y97-P99 WeakPolarHBondContact O-CD 3.46Å; Y97-I120 VanDerWaalsContact O-CG2 3.3Å; Y97-I120 WeakPolarHBondContact O-CG2 3.31Å; Y97-V124 HydrophobicContact CD1-CG2 3.94Å; Y97-V124 HydrophobicContact CD2-CG1 4.23Å; Y97-V124 HydrophobicContact CD2-CG2 4.36Å; Y97-V124 HydrophobicContact CE1-CG2 4.15Å; Y97-V124 HydrophobicContact CE2-CG1 3.94Å; Y97-V124 HydrophobicContact CG-CG2 4.06Å |
| 98 | T | 79.1 | Confident | 77.7 | Confident | 1 Ų | 1 | 81.8 Ų | 81.8 | 1% | 0.006 | 44% | 0.444 | C | S | . | . | trans | -117.1 | 67.1 | 173.1 | 59.1 | 0 | 0 | 0 | 0 | 110.5 | L95 F100 N117 L223 T227 | L95-T98 PolarHBondContact N-OG1 3.42Å; L95-T98 PolarHBondContact O-N 2.91Å; L95-T98 PolarHBondContact O-OG1 3.38Å; T98-F100 VanDerWaalsContact C-N 3.29Å; T98-F100 PolarHBondContact O-N 3.36Å; T98-N117 WeakPolarHBondContact CA-OD1 3.34Å; T98-N117 HydrophobicContact CG2-CB 4.08Å; T98-L223 HydrophobicContact CG2-CD2 4.12Å; T98-T227 HydrophobicContact CG2-CG2 4.21Å | ||
| 99 | P | 75.8 | Confident | 77.6 | Confident | 70 Ų | 70 | 84.1 Ų | 84.1 | 46% | 0.455 | 46% | 0.459 | S | S | . | . | trans | -69.7 | -23.3 | -171.6 | 29.2 | -36.7 | 0 | 0 | 0 | 113.7 | Y97 N117 I120 | Y97-P99 VanDerWaalsContact O-CD 3.3Å; Y97-P99 WeakPolarHBondContact O-CD 3.46Å; P99-N117 WeakPolarHBondContact CD-OD1 3.41Å; P99-I120 HydrophobicContact CG-CD1 3.89Å | ||
| 100 | F | 77.5 | Confident | 77.7 | Confident | 104 Ų | 104 | 85.9 Ų | 85.9 | 46% | 0.456 | 46% | 0.459 | S | S | . | . | trans | -100.8 | 98.7 | -175.4 | -57.3 | -65.1 | 0 | 0 | 0 | 111.1 | T98 Q113 A116 N117 I120 | T98-F100 VanDerWaalsContact C-N 3.29Å; T98-F100 PolarHBondContact O-N 3.36Å; F100-Q113 HydrophobicContact CB-CB 3.79Å; F100-Q113 HydrophobicContact CB-CG 3.71Å; F100-Q113 PolarHBondContact O-OE1 3.14Å; F100-A116 HydrophobicContact CD2-CB 4Å; F100-A116 HydrophobicContact CE2-CB 4.31Å; F100-N117 PolarHBondContact N-OD1 2.97Å; F100-N117 VanDerWaalsContact N-OD1 3.12Å; F100-N117 PolarHBondContact O-ND2 3.05Å; F100-I120 HydrophobicContact CE2-CD1 4.37Å | ||
| 101 | H | 73.8 | Confident | 78.1 | Confident | 83 Ų | 83 | 83.6 Ų | 83.6 | 38% | 0.384 | 45% | 0.454 | S | S | . | . | trans | -136.3 | 98.1 | 172.7 | 56.8 | -83.1 | 0 | 0 | 0 | 109.9 | Y94 P103 | Y94-H101 HydrophobicContact CD1-CB 4.22Å; Y94-H101 AromaticContact CD2-CD2 3.46Å; Y94-H101 VanDerWaalsContact CD2-CD2 3.46Å; Y94-H101 WeakPolarHBondContact CD2-CD2 3.21Å; Y94-H101 AromaticContact CD2-CE1 3.64Å; Y94-H101 AromaticContact CD2-CG 3.72Å; Y94-H101 AromaticContact CD2-ND1 3.82Å; Y94-H101 AromaticContact CD2-NE2 3.42Å; Y94-H101 WeakPolarHBondContact CD2-NE2 3.29Å; Y94-H101 HydrophobicContact CE1-CB 3.99Å; Y94-H101 HydrophobicContact CE2-CB 4.41Å; Y94-H101 AromaticContact CE2-CD2 3.3Å; Y94-H101 WeakPolarHBondContact CE2-CD2 3.32Å; Y94-H101 AromaticContact CE2-CG 3.79Å; Y94-H101 AromaticContact CE2-NE2 3.67Å; Y94-H101 AromaticContact CG-CE1 4Å; Y94-H101 AromaticContact CG-CG 3.9Å; Y94-H101 AromaticContact CG-ND1 3.81Å; Y94-H101 AromaticContact CZ-CD2 3.81Å; Y94-H101 AromaticContact CZ-CG 3.99Å; H101-P103 WeakPolarHBondContact O-CD 3.2Å | ||
| 102 | T | 72.9 | Confident | 78.7 | Confident | 64 Ų | 64 | 91 Ų | 91 | 39% | 0.393 | 48% | 0.478 | S | S | . | . | trans | -106.4 | 105.7 | 162.9 | 53.7 | 0 | 0 | 0 | 0 | 108.7 | A105 Q113 | T102-A105 WeakPolarHBondContact OG1-CB 3.24Å; T102-Q113 PolarHBondContact OG1-NE2 3.41Å; T102-Q113 PolarHBondContact OG1-OE1 3.15Å; T102-Q113 VanDerWaalsContact OG1-OE1 3.13Å | ||
| 103 | P | 67.4 | Low | 79.6 | Confident | 88 Ų | 88 | 86.6 Ų | 86.6 | 57% | 0.571 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.1 | 147.5 | 159.3 | -24.3 | 34.9 | 0 | 0 | 0 | 110.3 | H101 A105 | H101-P103 WeakPolarHBondContact O-CD 3.2Å; P103-A105 PolarHBondContact O-N 3.39Å |
| 104 | D | 71.2 | Confident | 80.6 | Confident | 166 Ų | 166 | 81 Ų | 81 | 89% | 0.888 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.6 | 17.7 | 169.8 | -43 | -39.7 | 0 | 0 | 0 | 116.8 | ||
| 105 | A | 76.1 | Confident | 81.4 | Confident | 28 Ų | 28 | 81 Ų | 81 | 23% | 0.231 | 43% | 0.433 | C | S | . | . | trans | -81 | 155.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113 | T102 P103 T109 | T102-A105 WeakPolarHBondContact OG1-CB 3.24Å; P103-A105 PolarHBondContact O-N 3.39Å; A105-T109 HydrophobicContact CB-CG2 3.88Å | ||
| 106 | D | 87.1 | Confident | 82.5 | Confident | 129 Ų | 129 | 79.8 Ų | 79.8 | 69% | 0.69 | 43% | 0.428 | S | S | * | . | trans | -46.8 | 145.6 | 178.4 | -65.5 | -61.7 | 0 | 0 | 0 | 113.3 | G108 T109 Q110 | D106-G108 PolarHBondContact O-N 3.17Å; D106-T109 CarbonylContact O-C 3.55Å; D106-T109 WeakPolarHBondContact O-CA 3.44Å; D106-T109 WeakPolarHBondContact O-CB 3.43Å; D106-T109 PolarHBondContact O-N 3.03Å; D106-Q110 PolarHBondContact O-N 3.1Å | ||
| 107 | I | 88.5 | Confident | 83.5 | Confident | 139 Ų | 139 | 72.7 Ų | 72.7 | 71% | 0.713 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -49.2 | -42.8 | -177.9 | -58.5 | 171.8 | 0 | 0 | 0 | 111.9 | T111 | I107-T111 VanDerWaalsContact O-CB 3.24Å; I107-T111 WeakPolarHBondContact O-CB 3.38Å; I107-T111 PolarHBondContact O-N 3.32Å; I107-T111 PolarHBondContact O-OG1 3.49Å |
| 108 | G | 89.6 | Confident | 84.4 | Confident | 55 Ų | 55 | 68.6 Ų | 68.6 | 57% | 0.567 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -64.9 | -42.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | D106 T111 W112 | D106-G108 PolarHBondContact O-N 3.17Å; G108-T111 PolarHBondContact O-N 3.38Å; G108-W112 WeakPolarHBondContact O-CB 3.48Å; G108-W112 PolarHBondContact O-N 2.78Å |
| 109 | T | 89.7 | Confident | 85.1 | Confident | 59 Ų | 59 | 74 Ų | 74 | 36% | 0.362 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -65.3 | -50.3 | 175.7 | -59.1 | 0 | 0 | 0 | 0 | 110.8 | A105 D106 T111 W112 Q113 | A105-T109 HydrophobicContact CB-CG2 3.88Å; D106-T109 CarbonylContact O-C 3.55Å; D106-T109 WeakPolarHBondContact O-CA 3.44Å; D106-T109 WeakPolarHBondContact O-CB 3.43Å; D106-T109 PolarHBondContact O-N 3.03Å; T109-T111 VanDerWaalsContact C-N 3.31Å; T109-T111 PolarHBondContact O-N 3.47Å; T109-W112 PolarHBondContact O-N 3.38Å; T109-Q113 HydrophobicContact CG2-CG 4.45Å; T109-Q113 WeakPolarHBondContact O-CB 3.48Å; T109-Q113 VanDerWaalsContact O-CG 3.29Å; T109-Q113 WeakPolarHBondContact O-CG 3.28Å; T109-Q113 PolarHBondContact O-N 3.47Å |
| 110 | Q | 88.3 | Confident | 86 | Confident | 68 Ų | 68 | 73.7 Ų | 73.7 | 32% | 0.318 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -57.9 | -42 | 176.1 | -173.8 | -178.7 | 61.2 | 0 | 0 | 111.9 | D106 T114 | D106-Q110 PolarHBondContact O-N 3.1Å; Q110-T114 VanDerWaalsContact O-CB 3.3Å; Q110-T114 WeakPolarHBondContact O-CB 3.5Å; Q110-T114 PolarHBondContact O-N 2.91Å; Q110-T114 PolarHBondContact O-OG1 3.43Å |
| 111 | T | 91.2 | Very high | 86.7 | Confident | 70 Ų | 70 | 69.2 Ų | 69.2 | 43% | 0.429 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63.5 | -48.9 | 176.5 | -58.5 | 0 | 0 | 0 | 0 | 111.4 | I107 G108 T109 Q113 T114 I115 | I107-T111 VanDerWaalsContact O-CB 3.24Å; I107-T111 WeakPolarHBondContact O-CB 3.38Å; I107-T111 PolarHBondContact O-N 3.32Å; I107-T111 PolarHBondContact O-OG1 3.49Å; G108-T111 PolarHBondContact O-N 3.38Å; T109-T111 VanDerWaalsContact C-N 3.31Å; T109-T111 PolarHBondContact O-N 3.47Å; T111-Q113 PolarHBondContact O-N 3.16Å; T111-T114 PolarHBondContact O-N 3.11Å; T111-I115 HydrophobicContact CG2-CD1 3.86Å; T111-I115 WeakPolarHBondContact O-CG1 3.38Å; T111-I115 PolarHBondContact O-N 3.37Å |
| 112 | W | 91.3 | Very high | 87.5 | Confident | 183 Ų | 183 | 66.3 Ų | 66.3 | 69% | 0.693 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.4 | -44.7 | 179.1 | 176.7 | -108.3 | 0 | 0 | 0 | 112.4 | G108 T109 T114 I115 A116 | G108-W112 WeakPolarHBondContact O-CB 3.48Å; G108-W112 PolarHBondContact O-N 2.78Å; T109-W112 PolarHBondContact O-N 3.38Å; W112-T114 VanDerWaalsContact C-N 3.34Å; W112-T114 PolarHBondContact O-N 3.08Å; W112-I115 PolarHBondContact O-N 3.48Å; W112-A116 WeakPolarHBondContact O-CB 3.35Å; W112-A116 PolarHBondContact O-N 2.67Å |
| 113 | Q | 90.4 | Very high | 88.5 | Confident | 29 Ų | 29 | 66.6 Ų | 66.6 | 14% | 0.136 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.5 | -42.1 | 175.9 | -68.4 | -174.7 | 10.7 | 0 | 0 | 112 | F100 T102 T109 T111 A116 N117 | F100-Q113 HydrophobicContact CB-CB 3.79Å; F100-Q113 HydrophobicContact CB-CG 3.71Å; F100-Q113 PolarHBondContact O-OE1 3.14Å; T102-Q113 PolarHBondContact OG1-NE2 3.41Å; T102-Q113 PolarHBondContact OG1-OE1 3.15Å; T102-Q113 VanDerWaalsContact OG1-OE1 3.13Å; T109-Q113 HydrophobicContact CG2-CG 4.45Å; T109-Q113 WeakPolarHBondContact O-CB 3.48Å; T109-Q113 VanDerWaalsContact O-CG 3.29Å; T109-Q113 WeakPolarHBondContact O-CG 3.28Å; T109-Q113 PolarHBondContact O-N 3.47Å; T111-Q113 PolarHBondContact O-N 3.16Å; Q113-A116 PolarHBondContact O-N 2.92Å; Q113-N117 WeakPolarHBondContact O-CB 3.06Å; Q113-N117 PolarHBondContact O-N 3.22Å; Q113-N117 PolarHBondContact O-ND2 3.41Å |
| 114 | T | 91.9 | Very high | 89.7 | Confident | 16 Ų | 16 | 64 Ų | 64 | 10% | 0.098 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60 | -48.9 | 176.1 | -63.6 | 0 | 0 | 0 | 0 | 111.2 | Q110 T111 W112 N117 T118 W226 L230 | Q110-T114 VanDerWaalsContact O-CB 3.3Å; Q110-T114 WeakPolarHBondContact O-CB 3.5Å; Q110-T114 PolarHBondContact O-N 2.91Å; Q110-T114 PolarHBondContact O-OG1 3.43Å; T111-T114 PolarHBondContact O-N 3.11Å; W112-T114 VanDerWaalsContact C-N 3.34Å; W112-T114 PolarHBondContact O-N 3.08Å; T114-N117 PolarHBondContact O-N 3.43Å; T114-T118 WeakPolarHBondContact O-CB 3.23Å; T114-T118 PolarHBondContact O-N 2.85Å; T114-T118 PolarHBondContact O-OG1 3.01Å; T114-T118 VanDerWaalsContact O-OG1 3.08Å; T114-W226 HydrophobicContact CG2-CB 3.81Å; T114-L230 HydrophobicContact CG2-CB 4.21Å; T114-L230 HydrophobicContact CG2-CD2 4.09Å |
| 115 | I | 94.1 | Very high | 90.6 | Very high | 65 Ų | 65 | 58 Ų | 58 | 33% | 0.333 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.8 | -45.7 | 177.7 | -67.9 | 166.9 | 0 | 0 | 0 | 110.6 | T111 W112 T118 L119 L230 | T111-I115 HydrophobicContact CG2-CD1 3.86Å; T111-I115 WeakPolarHBondContact O-CG1 3.38Å; T111-I115 PolarHBondContact O-N 3.37Å; W112-I115 PolarHBondContact O-N 3.48Å; I115-T118 PolarHBondContact O-N 3.37Å; I115-L119 HydrophobicContact CG2-CD1 3.84Å; I115-L119 HydrophobicContact CG2-CG 4.33Å; I115-L119 WeakPolarHBondContact O-CB 3.48Å; I115-L119 VanDerWaalsContact O-CG 3.31Å; I115-L119 WeakPolarHBondContact O-CG 3.26Å; I115-L119 PolarHBondContact O-N 2.83Å; I115-L230 HydrophobicContact CG1-CD2 3.94Å |
| 116 | A | 93 | Very high | 91.4 | Very high | 15 Ų | 15 | 58.5 Ų | 58.5 | 12% | 0.124 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.7 | -48.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F100 W112 Q113 T118 L119 I120 | F100-A116 HydrophobicContact CD2-CB 4Å; F100-A116 HydrophobicContact CE2-CB 4.31Å; W112-A116 WeakPolarHBondContact O-CB 3.35Å; W112-A116 PolarHBondContact O-N 2.67Å; Q113-A116 PolarHBondContact O-N 2.92Å; A116-T118 PolarHBondContact O-N 3.36Å; A116-L119 PolarHBondContact O-N 3.32Å; A116-I120 WeakPolarHBondContact O-CD1 3.49Å; A116-I120 VanDerWaalsContact O-CG1 3.25Å; A116-I120 WeakPolarHBondContact O-CG1 3.34Å; A116-I120 PolarHBondContact O-N 2.94Å |
| 117 | N | 92 | Very high | 91.7 | Very high | 2 Ų | 2 | 56 Ų | 56 | 1% | 0.011 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -57.3 | -47 | 175.2 | -75 | -18.5 | 0 | 0 | 0 | 111.9 | T98 P99 F100 Q113 T114 I120 F121 T227 | T98-N117 WeakPolarHBondContact CA-OD1 3.34Å; T98-N117 HydrophobicContact CG2-CB 4.08Å; P99-N117 WeakPolarHBondContact CD-OD1 3.41Å; F100-N117 PolarHBondContact N-OD1 2.97Å; F100-N117 VanDerWaalsContact N-OD1 3.12Å; F100-N117 PolarHBondContact O-ND2 3.05Å; Q113-N117 WeakPolarHBondContact O-CB 3.06Å; Q113-N117 PolarHBondContact O-N 3.22Å; Q113-N117 PolarHBondContact O-ND2 3.41Å; T114-N117 PolarHBondContact O-N 3.43Å; N117-I120 PolarHBondContact O-N 3.15Å; N117-F121 WeakPolarHBondContact O-CB 3.43Å; N117-F121 PolarHBondContact O-N 3Å; N117-T227 HydrophobicContact CB-CG2 3.92Å |
| 118 | T | 92.7 | Very high | 91.7 | Very high | 6 Ų | 6 | 54 Ų | 54 | 4% | 0.037 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 178.8 | -62.1 | 0 | 0 | 0 | 0 | 111.5 | T114 I115 A116 I120 F121 M122 L230 V231 A234 | T114-T118 WeakPolarHBondContact O-CB 3.23Å; T114-T118 PolarHBondContact O-N 2.85Å; T114-T118 PolarHBondContact O-OG1 3.01Å; T114-T118 VanDerWaalsContact O-OG1 3.08Å; I115-T118 PolarHBondContact O-N 3.37Å; A116-T118 PolarHBondContact O-N 3.36Å; T118-I120 PolarHBondContact O-N 3.26Å; T118-F121 PolarHBondContact O-N 3Å; T118-M122 HydrophobicContact CG2-CG 4.11Å; T118-M122 VanDerWaalsContact O-CB 3.28Å; T118-M122 WeakPolarHBondContact O-CB 3.34Å; T118-M122 WeakPolarHBondContact O-CG 3.32Å; T118-M122 PolarHBondContact O-N 2.7Å; T118-L230 HydrophobicContact CG2-CB 4.33Å; T118-L230 HydrophobicContact CG2-CD2 4.07Å; T118-L230 HydrophobicContact CG2-CG 4.17Å; T118-V231 HydrophobicContact CG2-CG2 3.88Å; T118-A234 HydrophobicContact CG2-CB 3.89Å |
| 119 | L | 93.7 | Very high | 91.7 | Very high | 116 Ų | 116 | 53.1 Ų | 53.1 | 61% | 0.607 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -64.3 | -39.3 | 176.3 | -71.9 | 173.2 | 0 | 0 | 0 | 112.5 | I115 A116 S123 | I115-L119 HydrophobicContact CG2-CD1 3.84Å; I115-L119 HydrophobicContact CG2-CG 4.33Å; I115-L119 WeakPolarHBondContact O-CB 3.48Å; I115-L119 VanDerWaalsContact O-CG 3.31Å; I115-L119 WeakPolarHBondContact O-CG 3.26Å; I115-L119 PolarHBondContact O-N 2.83Å; A116-L119 PolarHBondContact O-N 3.32Å; L119-S123 VanDerWaalsContact O-CB 3.28Å; L119-S123 WeakPolarHBondContact O-CB 3.39Å; L119-S123 PolarHBondContact O-N 3.48Å |
| 120 | I | 93.3 | Very high | 91.7 | Very high | 62 Ų | 62 | 52.7 Ų | 52.7 | 32% | 0.318 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63.8 | -49.9 | 174.4 | -65.8 | 162.4 | 0 | 0 | 0 | 110.2 | Y97 P99 F100 A116 N117 T118 M122 S123 V124 | Y97-I120 VanDerWaalsContact O-CG2 3.3Å; Y97-I120 WeakPolarHBondContact O-CG2 3.31Å; P99-I120 HydrophobicContact CG-CD1 3.89Å; F100-I120 HydrophobicContact CE2-CD1 4.37Å; A116-I120 WeakPolarHBondContact O-CD1 3.49Å; A116-I120 VanDerWaalsContact O-CG1 3.25Å; A116-I120 WeakPolarHBondContact O-CG1 3.34Å; A116-I120 PolarHBondContact O-N 2.94Å; N117-I120 PolarHBondContact O-N 3.15Å; T118-I120 PolarHBondContact O-N 3.26Å; I120-M122 PolarHBondContact O-N 3.27Å; I120-S123 WeakPolarHBondContact O-CB 3.36Å; I120-S123 PolarHBondContact O-N 2.72Å; I120-V124 WeakPolarHBondContact O-CG2 3.41Å; I120-V124 PolarHBondContact O-N 2.9Å |
| 121 | F | 92.3 | Very high | 91.9 | Very high | 10 Ų | 10 | 52.6 Ų | 52.6 | 4% | 0.044 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.9 | -47.1 | 178.5 | -178.5 | -90.6 | 0 | 0 | 0 | 112.2 | L95 N117 T118 S123 V124 V125 F219 L223 V231 L235 | L95-F121 HydrophobicContact CD1-CD2 4.24Å; L95-F121 HydrophobicContact CD1-CE2 3.9Å; N117-F121 WeakPolarHBondContact O-CB 3.43Å; N117-F121 PolarHBondContact O-N 3Å; T118-F121 PolarHBondContact O-N 3Å; F121-S123 VanDerWaalsContact C-N 3.34Å; F121-S123 PolarHBondContact O-N 3.43Å; F121-V124 PolarHBondContact O-N 3.5Å; F121-V125 HydrophobicContact CD1-CG2 4.14Å; F121-V125 HydrophobicContact CE1-CG2 3.73Å; F121-V125 HydrophobicContact CZ-CG2 4.1Å; F121-V125 WeakPolarHBondContact O-CG2 3.29Å; F121-V125 PolarHBondContact O-N 3.44Å; F121-F219 HydrophobicContact CE2-CE1 4.03Å; F121-F219 HydrophobicContact CZ-CD1 4.38Å; F121-F219 AromaticContact CZ-CE1 3.74Å; F121-F219 HydrophobicContact CZ-CE1 3.74Å; F121-F219 HydrophobicContact CZ-CZ 4.09Å; F121-L223 HydrophobicContact CD2-CD2 4.49Å; F121-V231 HydrophobicContact CD1-CG1 3.89Å; F121-V231 HydrophobicContact CD1-CG2 3.9Å; F121-V231 HydrophobicContact CE1-CG1 3.62Å; F121-V231 HydrophobicContact CE1-CG2 4.44Å; F121-V231 HydrophobicContact CG-CG2 4.38Å; F121-V231 HydrophobicContact CZ-CG1 4.46Å; F121-L235 HydrophobicContact CE1-CD1 4.32Å |
| 122 | M | 91.8 | Very high | 91.7 | Very high | 22 Ų | 22 | 51.9 Ų | 51.9 | 11% | 0.108 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.7 | -42.2 | 176.2 | -72.3 | -60 | -63.7 | 0 | 0 | 111.7 | T118 I120 V124 V125 V126 A234 L235 W238 | T118-M122 HydrophobicContact CG2-CG 4.11Å; T118-M122 VanDerWaalsContact O-CB 3.28Å; T118-M122 WeakPolarHBondContact O-CB 3.34Å; T118-M122 WeakPolarHBondContact O-CG 3.32Å; T118-M122 PolarHBondContact O-N 2.7Å; I120-M122 PolarHBondContact O-N 3.27Å; M122-V124 VanDerWaalsContact C-N 3.33Å; M122-V124 PolarHBondContact O-N 2.86Å; M122-V125 PolarHBondContact O-N 2.76Å; M122-V126 WeakPolarHBondContact O-CB 3.26Å; M122-V126 VanDerWaalsContact O-CG2 3.25Å; M122-V126 WeakPolarHBondContact O-CG2 3.17Å; M122-V126 PolarHBondContact O-N 2.85Å; M122-A234 HydrophobicContact CE-CB 4.11Å; M122-A234 WeakPolarHBondContact CE-O 3.32Å; M122-A234 HydrophobicContact CG-CB 3.82Å; M122-A234 HydrophobicContact SD-CB 3.72Å; M122-L235 HydrophobicContact CE-CD2 3.96Å; M122-L235 HydrophobicContact CE-CG 4.45Å; M122-L235 HydrophobicContact SD-CD2 3.52Å; M122-L235 VanDerWaalsContact SD-CD2 3.52Å; M122-L235 HydrophobicContact SD-CG 3.72Å; M122-W238 HydrophobicContact CE-CB 3.53Å; M122-W238 HydrophobicContact CE-CG 3.97Å |
| 123 | S | 92.3 | Very high | 91.5 | Very high | 70 Ų | 70 | 43.7 Ų | 43.7 | 49% | 0.49 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -58.3 | -43.6 | 175.2 | -173.4 | 0 | 0 | 0 | 0 | 111.8 | L119 I120 F121 V126 V127 | L119-S123 VanDerWaalsContact O-CB 3.28Å; L119-S123 WeakPolarHBondContact O-CB 3.39Å; L119-S123 PolarHBondContact O-N 3.48Å; I120-S123 WeakPolarHBondContact O-CB 3.36Å; I120-S123 PolarHBondContact O-N 2.72Å; F121-S123 VanDerWaalsContact C-N 3.34Å; F121-S123 PolarHBondContact O-N 3.43Å; S123-V126 PolarHBondContact O-N 2.86Å; S123-V127 WeakPolarHBondContact O-CB 3.49Å; S123-V127 VanDerWaalsContact O-CG2 3.28Å; S123-V127 WeakPolarHBondContact O-CG2 3.24Å; S123-V127 PolarHBondContact O-N 3.45Å |
| 124 | V | 93 | Very high | 91.5 | Very high | 35 Ų | 35 | 46.3 Ų | 46.3 | 21% | 0.212 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63 | -44.4 | 175.1 | 175.4 | 0 | 0 | 0 | 0 | 111.5 | Y97 I120 F121 M122 V127 M128 | Y97-V124 HydrophobicContact CD1-CG2 3.94Å; Y97-V124 HydrophobicContact CD2-CG1 4.23Å; Y97-V124 HydrophobicContact CD2-CG2 4.36Å; Y97-V124 HydrophobicContact CE1-CG2 4.15Å; Y97-V124 HydrophobicContact CE2-CG1 3.94Å; Y97-V124 HydrophobicContact CG-CG2 4.06Å; I120-V124 WeakPolarHBondContact O-CG2 3.41Å; I120-V124 PolarHBondContact O-N 2.9Å; F121-V124 PolarHBondContact O-N 3.5Å; M122-V124 VanDerWaalsContact C-N 3.33Å; M122-V124 PolarHBondContact O-N 2.86Å; V124-V127 PolarHBondContact O-N 3.2Å; V124-M128 HydrophobicContact CG1-CG 4.2Å; V124-M128 WeakPolarHBondContact O-CB 3.38Å; V124-M128 WeakPolarHBondContact O-CG 3.04Å; V124-M128 PolarHBondContact O-N 3.33Å |
| 125 | V | 91.1 | Very high | 91.4 | Very high | 39 Ų | 39 | 47.4 Ų | 47.4 | 24% | 0.236 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.8 | -44.9 | 177.2 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | F121 M122 T129 L235 | F121-V125 HydrophobicContact CD1-CG2 4.14Å; F121-V125 HydrophobicContact CE1-CG2 3.73Å; F121-V125 HydrophobicContact CZ-CG2 4.1Å; F121-V125 WeakPolarHBondContact O-CG2 3.29Å; F121-V125 PolarHBondContact O-N 3.44Å; M122-V125 PolarHBondContact O-N 2.76Å; V125-T129 WeakPolarHBondContact O-CB 3.38Å; V125-T129 PolarHBondContact O-N 3.33Å; V125-T129 PolarHBondContact O-OG1 3.36Å; V125-L235 HydrophobicContact CG1-CD2 4.04Å |
| 126 | V | 91.5 | Very high | 90.9 | Very high | 39 Ų | 39 | 44.8 Ų | 44.8 | 24% | 0.236 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.5 | -49.4 | 176.4 | 173 | 0 | 0 | 0 | 0 | 110.9 | M122 S123 M128 T129 C130 W238 | M122-V126 WeakPolarHBondContact O-CB 3.26Å; M122-V126 VanDerWaalsContact O-CG2 3.25Å; M122-V126 WeakPolarHBondContact O-CG2 3.17Å; M122-V126 PolarHBondContact O-N 2.85Å; S123-V126 PolarHBondContact O-N 2.86Å; V126-M128 PolarHBondContact O-N 3.02Å; V126-T129 PolarHBondContact O-N 3.34Å; V126-C130 WeakPolarHBondContact O-CB 3.49Å; V126-C130 PolarHBondContact O-N 2.86Å; V126-C130 PolarHBondContact O-SG 3.37Å; V126-C130 VanDerWaalsContact O-SG 3.36Å; V126-W238 HydrophobicContact CB-CH2 4.35Å; V126-W238 HydrophobicContact CB-CZ2 4.36Å; V126-W238 HydrophobicContact CG1-CH2 3.85Å; V126-W238 HydrophobicContact CG1-CZ2 4.23Å; V126-W238 HydrophobicContact CG1-CZ3 4.41Å; V126-W238 HydrophobicContact CG2-CD2 3.99Å; V126-W238 HydrophobicContact CG2-CE3 3.95Å; V126-W238 HydrophobicContact CG2-CH2 3.75Å; V126-W238 HydrophobicContact CG2-CZ2 3.77Å; V126-W238 HydrophobicContact CG2-CZ3 3.83Å |
| 127 | V | 93.2 | Very high | 90.6 | Very high | 75 Ų | 75 | 50.5 Ų | 50.5 | 46% | 0.455 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.6 | -45.1 | 179.4 | 169 | 0 | 0 | 0 | 0 | 111.4 | S123 V124 T129 C130 V131 | S123-V127 WeakPolarHBondContact O-CB 3.49Å; S123-V127 VanDerWaalsContact O-CG2 3.28Å; S123-V127 WeakPolarHBondContact O-CG2 3.24Å; S123-V127 PolarHBondContact O-N 3.45Å; V124-V127 PolarHBondContact O-N 3.2Å; V127-T129 VanDerWaalsContact C-N 3.34Å; V127-T129 PolarHBondContact O-N 3.04Å; V127-C130 PolarHBondContact O-N 3.36Å; V127-V131 HydrophobicContact CG1-CG2 4.42Å; V127-V131 WeakPolarHBondContact O-CG2 3.36Å; V127-V131 PolarHBondContact O-N 3.36Å |
| 128 | M | 90.3 | Very high | 90.4 | Very high | 97 Ų | 97 | 58.7 Ų | 58.7 | 48% | 0.478 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.7 | -36.6 | 178.4 | -68.6 | -64.9 | 162.3 | 0 | 0 | 112.2 | V124 V126 V131 L132 | V124-M128 HydrophobicContact CG1-CG 4.2Å; V124-M128 WeakPolarHBondContact O-CB 3.38Å; V124-M128 WeakPolarHBondContact O-CG 3.04Å; V124-M128 PolarHBondContact O-N 3.33Å; V126-M128 PolarHBondContact O-N 3.02Å; M128-V131 PolarHBondContact O-N 3.49Å; M128-L132 PolarHBondContact O-N 3.33Å |
| 129 | T | 89.4 | Confident | 90 | Very high | 38 Ų | 38 | 63.7 Ų | 63.7 | 23% | 0.233 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.9 | -47.3 | 173.1 | -54.7 | 0 | 0 | 0 | 0 | 110.6 | V125 V126 V127 V131 L132 V133 P249 | V125-T129 WeakPolarHBondContact O-CB 3.38Å; V125-T129 PolarHBondContact O-N 3.33Å; V125-T129 PolarHBondContact O-OG1 3.36Å; V126-T129 PolarHBondContact O-N 3.34Å; V127-T129 VanDerWaalsContact C-N 3.34Å; V127-T129 PolarHBondContact O-N 3.04Å; T129-V131 PolarHBondContact O-N 3.02Å; T129-L132 PolarHBondContact O-N 3Å; T129-V133 VanDerWaalsContact O-CG2 3.3Å; T129-V133 WeakPolarHBondContact O-CG2 3.11Å; T129-V133 PolarHBondContact O-N 2.92Å; T129-P249 HydrophobicContact CG2-CB 4.15Å; T129-P249 HydrophobicContact CG2-CG 4.18Å |
| 130 | C | 89.7 | Confident | 89.7 | Confident | 50 Ų | 50 | 60.6 Ų | 60.6 | 34% | 0.338 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.2 | -40 | 176.2 | -71.8 | 0 | 0 | 0 | 0 | 112.5 | V126 V127 V133 L134 | V126-C130 WeakPolarHBondContact O-CB 3.49Å; V126-C130 PolarHBondContact O-N 2.86Å; V126-C130 PolarHBondContact O-SG 3.37Å; V126-C130 VanDerWaalsContact O-SG 3.36Å; V127-C130 PolarHBondContact O-N 3.36Å; C130-V133 PolarHBondContact O-N 2.91Å; C130-L134 WeakPolarHBondContact O-CB 3.31Å; C130-L134 VanDerWaalsContact O-CG 3.24Å; C130-L134 WeakPolarHBondContact O-CG 3.28Å; C130-L134 PolarHBondContact O-N 3.17Å |
| 131 | V | 91.2 | Very high | 89.2 | Confident | 65 Ų | 65 | 60.9 Ų | 60.9 | 39% | 0.394 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.5 | -43.5 | 175.1 | 167 | 0 | 0 | 0 | 0 | 111.3 | V127 M128 T129 V133 L134 L135 | V127-V131 HydrophobicContact CG1-CG2 4.42Å; V127-V131 WeakPolarHBondContact O-CG2 3.36Å; V127-V131 PolarHBondContact O-N 3.36Å; M128-V131 PolarHBondContact O-N 3.49Å; T129-V131 PolarHBondContact O-N 3.02Å; V131-V133 PolarHBondContact O-N 3.3Å; V131-L134 PolarHBondContact O-N 3.12Å; V131-L135 HydrophobicContact CG1-CD1 3.8Å; V131-L135 HydrophobicContact CG1-CG 4.43Å; V131-L135 WeakPolarHBondContact O-CB 3.5Å; V131-L135 WeakPolarHBondContact O-CD1 3.25Å; V131-L135 VanDerWaalsContact O-CG 3.26Å; V131-L135 WeakPolarHBondContact O-CG 3.43Å; V131-L135 PolarHBondContact O-N 2.92Å |
| 132 | L | 87.6 | Confident | 89 | Confident | 56 Ų | 56 | 69.8 Ų | 69.8 | 29% | 0.293 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -61.3 | -44.8 | 176.2 | -170.4 | 158.2 | 0 | 0 | 0 | 111.5 | M128 T129 L135 F136 L253 | M128-L132 PolarHBondContact O-N 3.33Å; T129-L132 PolarHBondContact O-N 3Å; L132-L135 PolarHBondContact O-N 3.42Å; L132-F136 PolarHBondContact O-N 3.18Å; L132-L253 HydrophobicContact CD2-CD1 3.65Å; L132-L253 HydrophobicContact CD2-CD2 3.88Å; L132-L253 HydrophobicContact CD2-CG 4.45Å |
| 133 | V | 87.5 | Confident | 89 | Confident | 11 Ų | 11 | 73.9 Ų | 73.9 | 7% | 0.067 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 177.4 | 173.1 | 0 | 0 | 0 | 0 | 111.9 | T129 C130 V131 F136 K137 P249 L252 L253 M256 | T129-V133 VanDerWaalsContact O-CG2 3.3Å; T129-V133 WeakPolarHBondContact O-CG2 3.11Å; T129-V133 PolarHBondContact O-N 2.92Å; C130-V133 PolarHBondContact O-N 2.91Å; V131-V133 PolarHBondContact O-N 3.3Å; V133-F136 PolarHBondContact O-N 2.69Å; V133-K137 WeakPolarHBondContact O-CB 3.39Å; V133-K137 PolarHBondContact O-N 2.9Å; V133-P249 HydrophobicContact CG2-CB 4.04Å; V133-P249 WeakPolarHBondContact CG2-O 3.4Å; V133-L252 HydrophobicContact CG1-CD2 4Å; V133-L252 HydrophobicContact CG1-CG 4.48Å; V133-L253 HydrophobicContact CG2-CB 4.22Å; V133-L253 HydrophobicContact CG2-CD1 4.22Å; V133-M256 HydrophobicContact CG1-CE 4.16Å |
| 134 | L | 89.6 | Confident | 88.7 | Confident | 83 Ų | 83 | 70.8 Ų | 70.8 | 44% | 0.435 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63.8 | -45.3 | 175 | -74.2 | 169 | 0 | 0 | 0 | 111.5 | C130 V131 F136 K137 Y138 | C130-L134 WeakPolarHBondContact O-CB 3.31Å; C130-L134 VanDerWaalsContact O-CG 3.24Å; C130-L134 WeakPolarHBondContact O-CG 3.28Å; C130-L134 PolarHBondContact O-N 3.17Å; V131-L134 PolarHBondContact O-N 3.12Å; L134-F136 VanDerWaalsContact C-N 3.27Å; L134-F136 PolarHBondContact O-N 3.01Å; L134-K137 PolarHBondContact O-N 3.42Å; L134-Y138 HydrophobicContact CB-CD2 4.38Å; L134-Y138 HydrophobicContact CB-CE2 4.36Å; L134-Y138 HydrophobicContact CD2-CE2 4.18Å; L134-Y138 WeakPolarHBondContact O-CB 3.23Å; L134-Y138 WeakPolarHBondContact O-CD2 3.37Å; L134-Y138 PolarHBondContact O-N 3.47Å |
| 135 | L | 89.2 | Confident | 88.3 | Confident | 40 Ų | 40 | 76.2 Ų | 76.2 | 21% | 0.209 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -59.7 | -37.8 | 175.5 | -74 | 163.6 | 0 | 0 | 0 | 112 | V131 L132 Q139 C140 F143 I144 | V131-L135 HydrophobicContact CG1-CD1 3.8Å; V131-L135 HydrophobicContact CG1-CG 4.43Å; V131-L135 WeakPolarHBondContact O-CB 3.5Å; V131-L135 WeakPolarHBondContact O-CD1 3.25Å; V131-L135 VanDerWaalsContact O-CG 3.26Å; V131-L135 WeakPolarHBondContact O-CG 3.43Å; V131-L135 PolarHBondContact O-N 2.92Å; L132-L135 PolarHBondContact O-N 3.42Å; L135-Q139 PolarHBondContact O-N 3.36Å; L135-C140 HydrophobicContact CB-CB 4.44Å; L135-C140 HydrophobicContact CD2-CB 3.93Å; L135-C140 WeakPolarHBondContact O-CB 3.48Å; L135-C140 PolarHBondContact O-N 2.95Å; L135-F143 HydrophobicContact CD1-CD1 3.73Å; L135-F143 HydrophobicContact CD1-CE1 3.63Å; L135-F143 HydrophobicContact CD2-CD1 3.86Å; L135-F143 HydrophobicContact CD2-CE1 4.27Å; L135-F143 HydrophobicContact CD2-CG 4.47Å; L135-F143 HydrophobicContact CG-CD1 4.41Å; L135-I144 HydrophobicContact CB-CD1 4.11Å; L135-I144 HydrophobicContact CB-CG1 3.95Å |
| 136 | F | 84.5 | Confident | 88.3 | Confident | 9 Ų | 9 | 75.9 Ų | 75.9 | 4% | 0.039 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -67.3 | -45.4 | 175.2 | -161.9 | -84 | 0 | 0 | 0 | 111.3 | L132 V133 L134 Y138 Q139 Y141 I144 L253 M256 A257 F265 | L132-F136 PolarHBondContact O-N 3.18Å; V133-F136 PolarHBondContact O-N 2.69Å; L134-F136 VanDerWaalsContact C-N 3.27Å; L134-F136 PolarHBondContact O-N 3.01Å; F136-Y138 PolarHBondContact O-N 2.88Å; F136-Q139 PolarHBondContact O-N 2.96Å; F136-Y141 HydrophobicContact CE2-CE1 4.26Å; F136-Y141 HydrophobicContact CZ-CE1 4.39Å; F136-I144 HydrophobicContact CB-CD1 4.16Å; F136-I144 HydrophobicContact CD2-CD1 4.17Å; F136-L253 HydrophobicContact CB-CD1 4Å; F136-L253 HydrophobicContact CD1-CD1 4.49Å; F136-L253 HydrophobicContact CD2-CD1 4.09Å; F136-L253 HydrophobicContact CG-CD1 3.95Å; F136-M256 HydrophobicContact CB-CE 4.38Å; F136-M256 HydrophobicContact CD1-CB 4.15Å; F136-M256 HydrophobicContact CD1-CE 3.71Å; F136-M256 HydrophobicContact CD1-SD 4.31Å; F136-M256 HydrophobicContact CE1-CB 3.86Å; F136-M256 HydrophobicContact CE1-CE 4.49Å; F136-M256 HydrophobicContact CG-CE 4.41Å; F136-A257 HydrophobicContact CZ-CB 4.25Å; F136-F265 HydrophobicContact CD2-CE2 4.34Å; F136-F265 HydrophobicContact CD2-CZ 4.48Å; F136-F265 HydrophobicContact CE2-CE2 4.23Å; F136-F265 HydrophobicContact CE2-CZ 4.33Å |
| 137 | K | 86.8 | Confident | 88.3 | Confident | 136 Ų | 136 | 80.8 Ų | 80.8 | 59% | 0.591 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -62 | -38.4 | 176.6 | -174.1 | 172.7 | -178.5 | 173.2 | 0 | 112.8 | V133 L134 Q139 M256 | V133-K137 WeakPolarHBondContact O-CB 3.39Å; V133-K137 PolarHBondContact O-N 2.9Å; L134-K137 PolarHBondContact O-N 3.42Å; K137-Q139 PolarHBondContact O-N 3.39Å; K137-M256 HydrophobicContact CB-SD 4.28Å |
| 138 | Y | 88.4 | Confident | 88.1 | Confident | 173 Ų | 173 | 78.5 Ų | 78.5 | 68% | 0.678 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | 13.5 | 173.1 | -67.3 | -58.9 | 0 | 0 | 0 | 113.8 | L134 F136 C140 | L134-Y138 HydrophobicContact CB-CD2 4.38Å; L134-Y138 HydrophobicContact CB-CE2 4.36Å; L134-Y138 HydrophobicContact CD2-CE2 4.18Å; L134-Y138 WeakPolarHBondContact O-CB 3.23Å; L134-Y138 WeakPolarHBondContact O-CD2 3.37Å; L134-Y138 PolarHBondContact O-N 3.47Å; F136-Y138 PolarHBondContact O-N 2.88Å; Y138-C140 PolarHBondContact O-N 3.49Å; Y138-C140 PolarHBondContact O-SG 3.46Å; Y138-C140 VanDerWaalsContact O-SG 3.34Å |
| 139 | Q | 84.5 | Confident | 88.2 | Confident | 112 Ų | 112 | 76 Ų | 76 | 52% | 0.523 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54 | 28.9 | 175.2 | -60.1 | -169 | -29.9 | 0 | 0 | 114.6 | L135 F136 K137 Y141 | L135-Q139 PolarHBondContact O-N 3.36Å; F136-Q139 PolarHBondContact O-N 2.96Å; K137-Q139 PolarHBondContact O-N 3.39Å; Q139-Y141 HydrophobicContact CB-CD2 4.12Å; Q139-Y141 HydrophobicContact CB-CE2 3.6Å; Q139-Y141 HydrophobicContact CG-CE2 3.94Å; Q139-Y141 WeakPolarHBondContact O-CD2 3.42Å; Q139-Y141 PolarHBondContact O-N 3.44Å |
| 140 | C | 85.8 | Confident | 88.4 | Confident | 50 Ų | 50 | 80.4 Ų | 80.4 | 34% | 0.338 | 38% | 0.38 | S | S | . | . | trans | -77.8 | 41.5 | -177.3 | -69.5 | 0 | 0 | 0 | 0 | 112.4 | L135 Y138 K142 F143 I144 | L135-C140 HydrophobicContact CB-CB 4.44Å; L135-C140 HydrophobicContact CD2-CB 3.93Å; L135-C140 WeakPolarHBondContact O-CB 3.48Å; L135-C140 PolarHBondContact O-N 2.95Å; Y138-C140 PolarHBondContact O-N 3.49Å; Y138-C140 PolarHBondContact O-SG 3.46Å; Y138-C140 VanDerWaalsContact O-SG 3.34Å; C140-K142 PolarHBondContact O-N 3.18Å; C140-K142 VanDerWaalsContact O-N 3.08Å; C140-F143 HydrophobicContact CB-CB 4.33Å; C140-F143 WeakPolarHBondContact O-CA 3.39Å; C140-F143 WeakPolarHBondContact O-CB 3.36Å; C140-F143 PolarHBondContact O-N 2.96Å; C140-I144 PolarHBondContact O-N 3.25Å | ||
| 141 | Y | 82.7 | Confident | 88.5 | Confident | 69 Ų | 69 | 80.9 Ų | 80.9 | 27% | 0.271 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -54.3 | -33.1 | -172.6 | -56.8 | -67.4 | 0 | 0 | 0 | 113.8 | F136 Q139 R145 | F136-Y141 HydrophobicContact CE2-CE1 4.26Å; F136-Y141 HydrophobicContact CZ-CE1 4.39Å; Q139-Y141 HydrophobicContact CB-CD2 4.12Å; Q139-Y141 HydrophobicContact CB-CE2 3.6Å; Q139-Y141 HydrophobicContact CG-CE2 3.94Å; Q139-Y141 WeakPolarHBondContact O-CD2 3.42Å; Q139-Y141 PolarHBondContact O-N 3.44Å; Y141-R145 VanDerWaalsContact O-CB 3.23Å; Y141-R145 WeakPolarHBondContact O-CB 3.43Å; Y141-R145 PolarHBondContact O-N 2.92Å |
| 142 | K | 88.9 | Confident | 88.5 | Confident | 196 Ų | 196 | 78.2 Ų | 78.2 | 85% | 0.852 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -61.8 | -45.1 | 173.5 | -68.6 | -178.1 | -179.7 | 177 | 0 | 111.8 | C140 G146 | C140-K142 PolarHBondContact O-N 3.18Å; C140-K142 VanDerWaalsContact O-N 3.08Å; K142-G146 PolarHBondContact O-N 3.43Å |
| 143 | F | 90.9 | Very high | 88.8 | Confident | 108 Ų | 108 | 78.7 Ų | 78.7 | 47% | 0.474 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -68.3 | -46.7 | 177.4 | -176.3 | -87.6 | 0 | 0 | 0 | 110.9 | L135 C140 R145 G146 W147 | L135-F143 HydrophobicContact CD1-CD1 3.73Å; L135-F143 HydrophobicContact CD1-CE1 3.63Å; L135-F143 HydrophobicContact CD2-CD1 3.86Å; L135-F143 HydrophobicContact CD2-CE1 4.27Å; L135-F143 HydrophobicContact CD2-CG 4.47Å; L135-F143 HydrophobicContact CG-CD1 4.41Å; C140-F143 HydrophobicContact CB-CB 4.33Å; C140-F143 WeakPolarHBondContact O-CA 3.39Å; C140-F143 WeakPolarHBondContact O-CB 3.36Å; C140-F143 PolarHBondContact O-N 2.96Å; F143-R145 PolarHBondContact O-N 3.03Å; F143-G146 PolarHBondContact O-N 2.83Å; F143-W147 HydrophobicContact CE1-CB 4.38Å; F143-W147 HydrophobicContact CE1-CD2 4.42Å; F143-W147 AromaticContact CE1-CE3 3.85Å; F143-W147 HydrophobicContact CE1-CE3 3.85Å; F143-W147 AromaticContact CZ-CE3 3.76Å; F143-W147 HydrophobicContact CZ-CE3 3.76Å; F143-W147 HydrophobicContact CZ-CZ3 4.26Å; F143-W147 WeakPolarHBondContact O-CB 3.46Å; F143-W147 PolarHBondContact O-N 3.27Å |
| 144 | I | 87.2 | Confident | 89.1 | Confident | 6 Ų | 6 | 83.1 Ų | 83.1 | 3% | 0.031 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 179.7 | -54.7 | 167.8 | 0 | 0 | 0 | 110.9 | L135 F136 C140 G146 W147 I148 F265 | L135-I144 HydrophobicContact CB-CD1 4.11Å; L135-I144 HydrophobicContact CB-CG1 3.95Å; F136-I144 HydrophobicContact CB-CD1 4.16Å; F136-I144 HydrophobicContact CD2-CD1 4.17Å; C140-I144 PolarHBondContact O-N 3.25Å; I144-G146 PolarHBondContact O-N 3.05Å; I144-W147 PolarHBondContact O-N 2.91Å; I144-I148 HydrophobicContact CG2-CD1 3.78Å; I144-I148 HydrophobicContact CG2-CG1 4.37Å; I144-I148 WeakPolarHBondContact O-CG1 3.31Å; I144-I148 PolarHBondContact O-N 3.18Å; I144-F265 HydrophobicContact CB-CZ 4.3Å; I144-F265 HydrophobicContact CG2-CE1 4.02Å; I144-F265 HydrophobicContact CG2-CE2 3.81Å; I144-F265 HydrophobicContact CG2-CZ 3.43Å; I144-F265 VanDerWaalsContact CG2-CZ 3.43Å |
| 145 | R | 85.2 | Confident | 89.3 | Confident | 148 Ų | 148 | 80.1 Ų | 80.1 | 56% | 0.558 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -61.8 | -43.8 | 175.6 | -173.9 | -178.9 | -177.8 | -160.8 | 1.2 | 111.6 | Y141 F143 I149 | Y141-R145 VanDerWaalsContact O-CB 3.23Å; Y141-R145 WeakPolarHBondContact O-CB 3.43Å; Y141-R145 PolarHBondContact O-N 2.92Å; F143-R145 PolarHBondContact O-N 3.03Å; R145-I149 HydrophobicContact CG-CD1 3.91Å; R145-I149 WeakPolarHBondContact O-CB 3.32Å; R145-I149 WeakPolarHBondContact O-CD1 3.25Å; R145-I149 VanDerWaalsContact O-CG1 3.23Å; R145-I149 WeakPolarHBondContact O-CG1 3.23Å; R145-I149 PolarHBondContact O-N 3.45Å; R145-I149 VanDerWaalsContact O-N 3.09Å |
| 146 | G | 91.1 | Very high | 89.6 | Confident | 32 Ų | 32 | 78.2 Ų | 78.2 | 33% | 0.33 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | K142 F143 I144 I149 M150 | K142-G146 PolarHBondContact O-N 3.43Å; F143-G146 PolarHBondContact O-N 2.83Å; I144-G146 PolarHBondContact O-N 3.05Å; G146-I149 PolarHBondContact O-N 3.17Å; G146-M150 WeakPolarHBondContact O-CB 3.39Å; G146-M150 VanDerWaalsContact O-CG 3.26Å; G146-M150 WeakPolarHBondContact O-CG 3.42Å; G146-M150 PolarHBondContact O-N 3.44Å |
| 147 | W | 90.8 | Very high | 90.2 | Very high | 142 Ų | 142 | 79.8 Ų | 79.8 | 54% | 0.538 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -58.8 | -53 | 177.6 | -177.6 | -80.1 | 0 | 0 | 0 | 111.6 | F143 I144 I149 M150 T151 | F143-W147 HydrophobicContact CE1-CB 4.38Å; F143-W147 HydrophobicContact CE1-CD2 4.42Å; F143-W147 AromaticContact CE1-CE3 3.85Å; F143-W147 HydrophobicContact CE1-CE3 3.85Å; F143-W147 AromaticContact CZ-CE3 3.76Å; F143-W147 HydrophobicContact CZ-CE3 3.76Å; F143-W147 HydrophobicContact CZ-CZ3 4.26Å; F143-W147 WeakPolarHBondContact O-CB 3.46Å; F143-W147 PolarHBondContact O-N 3.27Å; I144-W147 PolarHBondContact O-N 2.91Å; W147-I149 VanDerWaalsContact C-N 3.34Å; W147-I149 PolarHBondContact O-N 3.44Å; W147-M150 PolarHBondContact O-N 2.98Å; W147-M150 VanDerWaalsContact O-N 3.15Å; W147-T151 PolarHBondContact O-N 3.31Å; W147-T151 PolarHBondContact O-OG1 3.08Å |
| 148 | I | 89 | Confident | 90.5 | Very high | 27 Ų | 27 | 78 Ų | 78 | 14% | 0.138 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -61.5 | -42.8 | -179.6 | -66.4 | 172.6 | 0 | 0 | 0 | 110.9 | I144 M150 T151 T152 F265 A267 | I144-I148 HydrophobicContact CG2-CD1 3.78Å; I144-I148 HydrophobicContact CG2-CG1 4.37Å; I144-I148 WeakPolarHBondContact O-CG1 3.31Å; I144-I148 PolarHBondContact O-N 3.18Å; I148-M150 PolarHBondContact O-N 3.04Å; I148-T151 PolarHBondContact O-N 3.24Å; I148-T152 PolarHBondContact O-N 3.15Å; I148-T152 PolarHBondContact O-OG1 2.88Å; I148-F265 HydrophobicContact CD1-CB 3.9Å; I148-F265 HydrophobicContact CD1-CD1 3.69Å; I148-F265 HydrophobicContact CD1-CD2 3.63Å; I148-F265 HydrophobicContact CD1-CE1 4.11Å; I148-F265 HydrophobicContact CD1-CE2 4.06Å; I148-F265 HydrophobicContact CD1-CG 3.44Å; I148-F265 VanDerWaalsContact CD1-CG 3.44Å; I148-F265 HydrophobicContact CD1-CZ 4.29Å; I148-A267 HydrophobicContact CG2-CB 4.04Å |
| 149 | I | 91.9 | Very high | 90.7 | Very high | 45 Ų | 45 | 71.1 Ų | 71.1 | 23% | 0.231 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.1 | -49 | 173.8 | -74.6 | 169.5 | 0 | 0 | 0 | 110.9 | R145 G146 W147 T151 T152 I153 M192 H196 | R145-I149 HydrophobicContact CG-CD1 3.91Å; R145-I149 WeakPolarHBondContact O-CB 3.32Å; R145-I149 WeakPolarHBondContact O-CD1 3.25Å; R145-I149 VanDerWaalsContact O-CG1 3.23Å; R145-I149 WeakPolarHBondContact O-CG1 3.23Å; R145-I149 PolarHBondContact O-N 3.45Å; R145-I149 VanDerWaalsContact O-N 3.09Å; G146-I149 PolarHBondContact O-N 3.17Å; W147-I149 VanDerWaalsContact C-N 3.34Å; W147-I149 PolarHBondContact O-N 3.44Å; I149-T151 PolarHBondContact O-N 2.93Å; I149-T152 PolarHBondContact O-N 2.9Å; I149-I153 HydrophobicContact CG2-CD1 3.74Å; I149-I153 HydrophobicContact CG2-CG1 4.47Å; I149-I153 VanDerWaalsContact O-CG1 3.28Å; I149-I153 WeakPolarHBondContact O-CG1 3.39Å; I149-I153 PolarHBondContact O-N 3.22Å; I149-M192 HydrophobicContact CG2-CE 3.95Å; I149-H196 VanDerWaalsContact CG1-CD2 3.46Å; I149-H196 WeakPolarHBondContact CG1-CD2 3.16Å |
| 150 | M | 93 | Very high | 91.2 | Very high | 131 Ų | 131 | 65.8 Ų | 65.8 | 65% | 0.645 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -63.3 | -41.4 | 179.6 | -72.8 | -64.9 | -74.7 | 0 | 0 | 112.4 | G146 W147 I148 I153 F154 | G146-M150 WeakPolarHBondContact O-CB 3.39Å; G146-M150 VanDerWaalsContact O-CG 3.26Å; G146-M150 WeakPolarHBondContact O-CG 3.42Å; G146-M150 PolarHBondContact O-N 3.44Å; W147-M150 PolarHBondContact O-N 2.98Å; W147-M150 VanDerWaalsContact O-N 3.15Å; I148-M150 PolarHBondContact O-N 3.04Å; M150-I153 PolarHBondContact O-N 2.83Å; M150-F154 WeakPolarHBondContact O-CB 3.28Å; M150-F154 PolarHBondContact O-N 3.05Å |
| 151 | T | 91.7 | Very high | 91.6 | Very high | 59 Ų | 59 | 67.7 Ų | 67.7 | 36% | 0.362 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63 | -43.4 | 174.7 | -54.3 | 0 | 0 | 0 | 0 | 111.5 | W147 I148 I149 F154 L155 | W147-T151 PolarHBondContact O-N 3.31Å; W147-T151 PolarHBondContact O-OG1 3.08Å; I148-T151 PolarHBondContact O-N 3.24Å; I149-T151 PolarHBondContact O-N 2.93Å; T151-F154 WeakPolarHBondContact O-CB 3.47Å; T151-F154 PolarHBondContact O-N 3.37Å; T151-L155 HydrophobicContact CG2-CD1 4.17Å; T151-L155 WeakPolarHBondContact O-CG 3.34Å; T151-L155 PolarHBondContact O-N 3.18Å |
| 152 | T | 92.4 | Very high | 92.1 | Very high | 10 Ų | 10 | 66.7 Ų | 66.7 | 6% | 0.061 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -69.5 | -36.2 | 178.3 | -52.5 | 0 | 0 | 0 | 0 | 112.2 | I148 I149 L155 L156 M192 I195 H196 I211 | I148-T152 PolarHBondContact O-N 3.15Å; I148-T152 PolarHBondContact O-OG1 2.88Å; I149-T152 PolarHBondContact O-N 2.9Å; T152-L155 PolarHBondContact O-N 2.88Å; T152-L156 HydrophobicContact CG2-CD1 3.86Å; T152-L156 HydrophobicContact CG2-CG 4.16Å; T152-L156 VanDerWaalsContact O-CB 3.29Å; T152-L156 WeakPolarHBondContact O-CB 3.41Å; T152-L156 WeakPolarHBondContact O-CG 3.28Å; T152-L156 PolarHBondContact O-N 3.25Å; T152-M192 HydrophobicContact CG2-SD 3.63Å; T152-I195 HydrophobicContact CG2-CD1 3.89Å; T152-I195 HydrophobicContact CG2-CG2 4.48Å; T152-H196 PolarHBondContact OG1-CE1 2.92Å; T152-I211 HydrophobicContact CG2-CD1 4.22Å |
| 153 | I | 94.5 | Very high | 92.4 | Very high | 65 Ų | 65 | 57.9 Ų | 57.9 | 33% | 0.333 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 170.9 | -69.4 | 168.2 | 0 | 0 | 0 | 110.1 | I149 M150 L155 L156 F157 M192 | I149-I153 HydrophobicContact CG2-CD1 3.74Å; I149-I153 HydrophobicContact CG2-CG1 4.47Å; I149-I153 VanDerWaalsContact O-CG1 3.28Å; I149-I153 WeakPolarHBondContact O-CG1 3.39Å; I149-I153 PolarHBondContact O-N 3.22Å; M150-I153 PolarHBondContact O-N 2.83Å; I153-L155 VanDerWaalsContact C-N 3.35Å; I153-L155 PolarHBondContact O-N 2.96Å; I153-L156 PolarHBondContact O-N 3.45Å; I153-F157 HydrophobicContact CG2-CD2 3.92Å; I153-F157 HydrophobicContact CG2-CE2 4.4Å; I153-F157 WeakPolarHBondContact O-CB 3.3Å; I153-F157 WeakPolarHBondContact O-CD2 3.16Å; I153-F157 PolarHBondContact O-N 2.92Å; I153-M192 HydrophobicContact CD1-CE 4.14Å; I153-M192 HydrophobicContact CG1-CE 3.65Å; I153-M192 HydrophobicContact CG1-CG 4.07Å; I153-M192 HydrophobicContact CG1-SD 3.65Å |
| 154 | F | 93.6 | Very high | 92.5 | Very high | 105 Ų | 105 | 55.5 Ų | 55.5 | 46% | 0.461 | 27% | 0.268 | S | S | . | . | I | π-helix | trans | -57.3 | -45.8 | 178 | 179.6 | -89.1 | 0 | 0 | 0 | 112.2 | M150 T151 L158 I159 | M150-F154 WeakPolarHBondContact O-CB 3.28Å; M150-F154 PolarHBondContact O-N 3.05Å; T151-F154 WeakPolarHBondContact O-CB 3.47Å; T151-F154 PolarHBondContact O-N 3.37Å; F154-L158 HydrophobicContact CD2-CD1 3.75Å; F154-L158 HydrophobicContact CE2-CD1 3.8Å; F154-L158 WeakPolarHBondContact O-CB 3.28Å; F154-L158 PolarHBondContact O-N 3.47Å; F154-I159 HydrophobicContact CD1-CG1 4.31Å; F154-I159 HydrophobicContact CE1-CD1 3.87Å; F154-I159 HydrophobicContact CE1-CG1 3.96Å; F154-I159 HydrophobicContact CZ-CD1 4.32Å; F154-I159 PolarHBondContact O-N 3.36Å |
| 155 | L | 94 | Very high | 92.8 | Very high | 20 Ų | 20 | 56.5 Ų | 56.5 | 11% | 0.105 | 28% | 0.277 | C | S | . | . | I | π-helix | trans | -68.5 | -47.3 | 178.2 | -65.7 | 171.4 | 0 | 0 | 0 | 112.7 | T151 T152 I153 F157 I159 S160 I211 I215 | T151-L155 HydrophobicContact CG2-CD1 4.17Å; T151-L155 WeakPolarHBondContact O-CG 3.34Å; T151-L155 PolarHBondContact O-N 3.18Å; T152-L155 PolarHBondContact O-N 2.88Å; I153-L155 VanDerWaalsContact C-N 3.35Å; I153-L155 PolarHBondContact O-N 2.96Å; L155-F157 PolarHBondContact O-N 2.89Å; L155-I159 HydrophobicContact CD2-CG1 3.97Å; L155-S160 PolarHBondContact O-N 2.81Å; L155-S160 PolarHBondContact O-OG 2.93Å; L155-I211 HydrophobicContact CD1-CG2 4.14Å; L155-I215 HydrophobicContact CD1-CD1 4.17Å; L155-I215 HydrophobicContact CD1-CG1 4.33Å; L155-I215 HydrophobicContact CD2-CG1 4.29Å |
| 156 | L | 95.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 26% | 0.257 | C | S | . | . | I | π-helix | trans | -73.2 | -24.4 | -176.5 | -78.4 | -178.6 | 0 | 0 | 0 | 114.6 | T152 I153 S160 F187 M192 I195 Y207 I211 | T152-L156 HydrophobicContact CG2-CD1 3.86Å; T152-L156 HydrophobicContact CG2-CG 4.16Å; T152-L156 VanDerWaalsContact O-CB 3.29Å; T152-L156 WeakPolarHBondContact O-CB 3.41Å; T152-L156 WeakPolarHBondContact O-CG 3.28Å; T152-L156 PolarHBondContact O-N 3.25Å; I153-L156 PolarHBondContact O-N 3.45Å; L156-S160 WeakPolarHBondContact O-CB 3.46Å; L156-S160 PolarHBondContact O-OG 2.96Å; L156-F187 HydrophobicContact CD2-CE1 3.89Å; L156-F187 HydrophobicContact CD2-CZ 4.41Å; L156-M192 HydrophobicContact CD1-CG 3.96Å; L156-M192 HydrophobicContact CD1-SD 4.04Å; L156-I195 HydrophobicContact CD1-CD1 4.17Å; L156-Y207 HydrophobicContact CD2-CD1 3.96Å; L156-Y207 HydrophobicContact CD2-CE1 4.34Å; L156-I211 HydrophobicContact CD2-CD1 3.93Å; L156-I211 HydrophobicContact CD2-CG1 4.05Å; L156-I211 HydrophobicContact CG-CD1 4.14Å |
| 157 | F | 95.7 | Very high | 93.3 | Very high | 42 Ų | 42 | 50.7 Ų | 50.7 | 18% | 0.184 | 25% | 0.25 | C | C | . | . | I | π-helix | trans | -103.3 | -56.9 | 177.9 | -72.1 | -93.7 | 0 | 0 | 0 | 112.2 | I153 L155 F161 W185 G188 V189 M192 | I153-F157 HydrophobicContact CG2-CD2 3.92Å; I153-F157 HydrophobicContact CG2-CE2 4.4Å; I153-F157 WeakPolarHBondContact O-CB 3.3Å; I153-F157 WeakPolarHBondContact O-CD2 3.16Å; I153-F157 PolarHBondContact O-N 2.92Å; L155-F157 PolarHBondContact O-N 2.89Å; F157-F161 WeakPolarHBondContact O-CB 3.26Å; F157-F161 PolarHBondContact O-N 3.42Å; F157-W185 HydrophobicContact CE1-CE3 4.05Å; F157-W185 HydrophobicContact CE1-CZ3 4.49Å; F157-G188 VanDerWaalsContact CZ-C 3.47Å; F157-V189 HydrophobicContact CZ-CG2 4.13Å; F157-M192 HydrophobicContact CE2-CG 4.31Å |
| 158 | L | 93.8 | Very high | 93.4 | Very high | 99 Ų | 99 | 45.8 Ų | 45.8 | 52% | 0.518 | 23% | 0.234 | S | C | . | . | I | π-helix | trans | -80.3 | -48.7 | -170.8 | -64.5 | 178.4 | 0 | 0 | 0 | 113.1 | F154 S160 F161 T162 | F154-L158 HydrophobicContact CD2-CD1 3.75Å; F154-L158 HydrophobicContact CE2-CD1 3.8Å; F154-L158 WeakPolarHBondContact O-CB 3.28Å; F154-L158 PolarHBondContact O-N 3.47Å; L158-S160 VanDerWaalsContact C-N 3.33Å; L158-S160 PolarHBondContact O-N 3.41Å; L158-F161 WeakPolarHBondContact O-CB 3.44Å; L158-F161 PolarHBondContact O-N 3.26Å; L158-T162 PolarHBondContact O-N 2.91Å; L158-T162 VanDerWaalsContact O-N 3.16Å; L158-T162 PolarHBondContact O-OG1 3.46Å |
| 159 | I | 93.8 | Very high | 93.5 | Very high | 27 Ų | 27 | 52.1 Ų | 52.1 | 14% | 0.138 | 26% | 0.256 | C | S | . | . | I | π-helix | trans | -67.1 | -39.3 | 177.6 | -55.5 | -54.5 | 0 | 0 | 0 | 110.6 | F154 L155 F161 T162 F163 Q214 | F154-I159 HydrophobicContact CD1-CG1 4.31Å; F154-I159 HydrophobicContact CE1-CD1 3.87Å; F154-I159 HydrophobicContact CE1-CG1 3.96Å; F154-I159 HydrophobicContact CZ-CD1 4.32Å; F154-I159 PolarHBondContact O-N 3.36Å; L155-I159 HydrophobicContact CD2-CG1 3.97Å; I159-F161 PolarHBondContact O-N 3.48Å; I159-T162 PolarHBondContact O-N 3.46Å; I159-F163 WeakPolarHBondContact O-CB 3.19Å; I159-F163 PolarHBondContact O-N 3.4Å; I159-Q214 HydrophobicContact CG2-CB 4.11Å |
| 160 | S | 94.9 | Very high | 93.5 | Very high | 1 Ų | 1 | 52.6 Ų | 52.6 | 1% | 0.007 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.5 | -35 | 176.4 | -54.4 | 0 | 0 | 0 | 0 | 112.7 | L155 L156 L158 F163 F164 | L155-S160 PolarHBondContact O-N 2.81Å; L155-S160 PolarHBondContact O-OG 2.93Å; L156-S160 WeakPolarHBondContact O-CB 3.46Å; L156-S160 PolarHBondContact O-OG 2.96Å; L158-S160 VanDerWaalsContact C-N 3.33Å; L158-S160 PolarHBondContact O-N 3.41Å; S160-F163 PolarHBondContact O-N 3.39Å; S160-F164 WeakPolarHBondContact O-CD2 3.44Å; S160-F164 WeakPolarHBondContact O-CG 3.28Å; S160-F164 PolarHBondContact O-N 3.28Å |
| 161 | F | 94.2 | Very high | 93.4 | Very high | 90 Ų | 90 | 52 Ų | 52 | 40% | 0.395 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -59.5 | -50.6 | 170.9 | 171.5 | -108.3 | 0 | 0 | 0 | 111.8 | F157 L158 I159 F163 F164 A165 V180 L184 | F157-F161 WeakPolarHBondContact O-CB 3.26Å; F157-F161 PolarHBondContact O-N 3.42Å; L158-F161 WeakPolarHBondContact O-CB 3.44Å; L158-F161 PolarHBondContact O-N 3.26Å; I159-F161 PolarHBondContact O-N 3.48Å; F161-F163 PolarHBondContact O-N 3.02Å; F161-F164 PolarHBondContact O-N 2.9Å; F161-A165 WeakPolarHBondContact O-CB 3.3Å; F161-A165 PolarHBondContact O-N 2.85Å; F161-V180 HydrophobicContact CD2-CG1 4.42Å; F161-V180 HydrophobicContact CE2-CG1 4.32Å; F161-L184 HydrophobicContact CB-CD1 4.29Å; F161-L184 HydrophobicContact CB-CD2 3.75Å; F161-L184 HydrophobicContact CD2-CD2 4.06Å; F161-L184 HydrophobicContact CG-CD2 4.3Å |
| 162 | T | 92.4 | Very high | 93.4 | Very high | 48 Ų | 48 | 51.6 Ų | 51.6 | 29% | 0.294 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -57.9 | -49.2 | 176.8 | -56.2 | 0 | 0 | 0 | 0 | 110.6 | F87 L158 I159 F164 A165 E166 | F87-T162 HydrophobicContact CZ-CG2 4.41Å; L158-T162 PolarHBondContact O-N 2.91Å; L158-T162 VanDerWaalsContact O-N 3.16Å; L158-T162 PolarHBondContact O-OG1 3.46Å; I159-T162 PolarHBondContact O-N 3.46Å; T162-F164 PolarHBondContact O-N 3.28Å; T162-A165 PolarHBondContact O-N 2.99Å; T162-E166 HydrophobicContact CG2-CG 4.43Å; T162-E166 WeakPolarHBondContact O-CG 3.36Å; T162-E166 PolarHBondContact O-N 2.9Å |
| 163 | F | 94.6 | Very high | 93.3 | Very high | 10 Ų | 10 | 54.6 Ų | 54.6 | 4% | 0.044 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -54.9 | -51.2 | 176.8 | 169.9 | -98.6 | 0 | 0 | 0 | 113 | F77 V81 I159 S160 F161 A165 E166 V167 F210 L217 | F77-F163 HydrophobicContact CE1-CE2 4.33Å; F77-F163 HydrophobicContact CE1-CZ 4.24Å; F77-F163 HydrophobicContact CE2-CZ 4.29Å; F77-F163 HydrophobicContact CZ-CE1 4.23Å; F77-F163 HydrophobicContact CZ-CE2 4.01Å; F77-F163 AromaticContact CZ-CZ 3.49Å; F77-F163 HydrophobicContact CZ-CZ 3.49Å; F77-F163 VanDerWaalsContact CZ-CZ 3.49Å; V81-F163 HydrophobicContact CG1-CE2 3.98Å; V81-F163 HydrophobicContact CG2-CE2 3.76Å; V81-F163 HydrophobicContact CG2-CZ 4.18Å; I159-F163 WeakPolarHBondContact O-CB 3.19Å; I159-F163 PolarHBondContact O-N 3.4Å; S160-F163 PolarHBondContact O-N 3.39Å; F161-F163 PolarHBondContact O-N 3.02Å; F163-A165 VanDerWaalsContact C-N 3.32Å; F163-A165 PolarHBondContact O-N 2.87Å; F163-E166 PolarHBondContact O-N 2.86Å; F163-V167 HydrophobicContact CD2-CG2 4.09Å; F163-V167 HydrophobicContact CE1-CG2 4.13Å; F163-V167 HydrophobicContact CE2-CG2 3.65Å; F163-V167 HydrophobicContact CZ-CG2 3.66Å; F163-V167 WeakPolarHBondContact O-CB 3.49Å; F163-V167 VanDerWaalsContact O-CG2 3.31Å; F163-V167 WeakPolarHBondContact O-CG2 3.39Å; F163-V167 PolarHBondContact O-N 2.85Å; F163-F210 HydrophobicContact CD1-CE2 4.17Å; F163-F210 AromaticContact CD1-CZ 3.78Å; F163-F210 HydrophobicContact CD1-CZ 3.78Å; F163-F210 AromaticContact CE1-CE2 3.78Å; F163-F210 HydrophobicContact CE1-CE2 3.78Å; F163-F210 AromaticContact CE1-CZ 3.88Å; F163-F210 HydrophobicContact CE1-CZ 3.88Å; F163-F210 HydrophobicContact CZ-CE2 4.35Å; F163-L217 HydrophobicContact CD2-CD1 4.28Å; F163-L217 HydrophobicContact CE2-CD1 4.24Å |
| 164 | F | 93.9 | Very high | 93.1 | Very high | 59 Ų | 59 | 61.5 Ų | 61.5 | 26% | 0.259 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65.2 | -35.4 | 179.7 | -68.3 | -52.3 | 0 | 0 | 0 | 112.1 | S160 F161 T162 L168 L184 F187 F210 | S160-F164 WeakPolarHBondContact O-CD2 3.44Å; S160-F164 WeakPolarHBondContact O-CG 3.28Å; S160-F164 PolarHBondContact O-N 3.28Å; F161-F164 PolarHBondContact O-N 2.9Å; T162-F164 PolarHBondContact O-N 3.28Å; F164-L168 WeakPolarHBondContact O-CB 3.48Å; F164-L168 WeakPolarHBondContact O-CG 3.43Å; F164-L168 PolarHBondContact O-N 3.08Å; F164-L184 HydrophobicContact CD2-CD1 4.16Å; F164-L184 HydrophobicContact CE2-CD1 4.34Å; F164-F187 HydrophobicContact CE2-CD1 4Å; F164-F187 HydrophobicContact CE2-CE1 4.25Å; F164-F187 HydrophobicContact CE2-CG 4.18Å; F164-F187 HydrophobicContact CZ-CD1 4.38Å; F164-F187 HydrophobicContact CZ-CD2 4.27Å; F164-F187 HydrophobicContact CZ-CE1 4.39Å; F164-F187 HydrophobicContact CZ-CE2 4.28Å; F164-F187 HydrophobicContact CZ-CG 4.32Å; F164-F187 HydrophobicContact CZ-CZ 4.35Å; F164-F210 HydrophobicContact CZ-CZ 4.15Å |
| 165 | A | 93.2 | Very high | 92.9 | Very high | 27 Ų | 27 | 59.1 Ų | 59.1 | 22% | 0.223 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.4 | -43 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | F161 T162 F163 R169 | F161-A165 WeakPolarHBondContact O-CB 3.3Å; F161-A165 PolarHBondContact O-N 2.85Å; T162-A165 PolarHBondContact O-N 2.99Å; F163-A165 VanDerWaalsContact C-N 3.32Å; F163-A165 PolarHBondContact O-N 2.87Å; A165-R169 WeakPolarHBondContact O-CB 3.16Å; A165-R169 PolarHBondContact O-N 3.24Å; A165-R169 VanDerWaalsContact O-N 3.08Å |
| 166 | E | 93.3 | Very high | 92.9 | Very high | 26 Ų | 26 | 61.9 Ų | 61.9 | 12% | 0.121 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -69.1 | -40.8 | 176.4 | -61.6 | -48.9 | 131.1 | 0 | 0 | 112.2 | V85 F87 T162 F163 R169 A170 | V85-E166 HydrophobicContact CG1-CB 3.8Å; F87-E166 HydrophobicContact CB-CB 4.44Å; F87-E166 HydrophobicContact CB-CG 4.16Å; F87-E166 HydrophobicContact CD1-CG 3.75Å; F87-E166 HydrophobicContact CD2-CG 4.01Å; F87-E166 WeakPolarHBondContact CD2-OE2 3.31Å; F87-E166 HydrophobicContact CE1-CG 4.05Å; F87-E166 HydrophobicContact CE2-CG 4.3Å; F87-E166 HydrophobicContact CG-CB 4.48Å; F87-E166 HydrophobicContact CG-CG 3.71Å; F87-E166 HydrophobicContact CZ-CG 4.31Å; T162-E166 HydrophobicContact CG2-CG 4.43Å; T162-E166 WeakPolarHBondContact O-CG 3.36Å; T162-E166 PolarHBondContact O-N 2.9Å; F163-E166 PolarHBondContact O-N 2.86Å; E166-R169 PolarHBondContact O-N 3.2Å; E166-R169 IonicContact OE1-CZ 3.8Å; E166-R169 IonicContact OE1-NH1 2.67Å; E166-R169 PolarHBondContact OE1-NH1 3.47Å; E166-R169 IonicContact OE2-CZ 3.89Å; E166-R169 IonicContact OE2-NH1 2.67Å; E166-R169 PolarHBondContact OE2-NH1 2.86Å; E166-A170 WeakPolarHBondContact O-CB 3.45Å; E166-A170 PolarHBondContact O-N 2.7Å |
| 167 | V | 93.4 | Very high | 92.8 | Very high | 31 Ų | 31 | 71.6 Ų | 71.6 | 19% | 0.188 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.1 | -43.7 | 176 | 169 | 0 | 0 | 0 | 0 | 111.8 | V85 F163 R169 A170 M171 | V85-V167 HydrophobicContact CG2-CG2 4.06Å; F163-V167 HydrophobicContact CD2-CG2 4.09Å; F163-V167 HydrophobicContact CE1-CG2 4.13Å; F163-V167 HydrophobicContact CE2-CG2 3.65Å; F163-V167 HydrophobicContact CZ-CG2 3.66Å; F163-V167 WeakPolarHBondContact O-CB 3.49Å; F163-V167 VanDerWaalsContact O-CG2 3.31Å; F163-V167 WeakPolarHBondContact O-CG2 3.39Å; F163-V167 PolarHBondContact O-N 2.85Å; V167-R169 VanDerWaalsContact C-N 3.31Å; V167-R169 PolarHBondContact O-N 2.94Å; V167-A170 PolarHBondContact O-N 3.3Å; V167-M171 HydrophobicContact CG1-CE 3.98Å; V167-M171 HydrophobicContact CG1-SD 4.3Å; V167-M171 WeakPolarHBondContact O-CG 3.34Å; V167-M171 PolarHBondContact O-N 3.44Å |
| 168 | L | 93.3 | Very high | 92.7 | Very high | 40 Ų | 40 | 76.1 Ų | 76.1 | 21% | 0.209 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63.2 | -38.2 | 175.7 | -73.5 | 172.4 | 0 | 0 | 0 | 112 | F164 M171 G172 V173 V175 V180 | F164-L168 WeakPolarHBondContact O-CB 3.48Å; F164-L168 WeakPolarHBondContact O-CG 3.43Å; F164-L168 PolarHBondContact O-N 3.08Å; L168-M171 HydrophobicContact CD2-CE 3.93Å; L168-G172 PolarHBondContact O-N 3.18Å; L168-V173 HydrophobicContact CD2-CB 4.34Å; L168-V173 PolarHBondContact O-N 2.97Å; L168-V175 HydrophobicContact CD1-CB 4.2Å; L168-V175 HydrophobicContact CD1-CG2 4.05Å; L168-V175 HydrophobicContact CD2-CG2 3.69Å; L168-V175 HydrophobicContact CG-CG2 4.45Å; L168-V180 HydrophobicContact CD1-CG2 3.88Å |
| 169 | R | 91.7 | Very high | 92.7 | Very high | 160 Ų | 160 | 74.9 Ų | 74.9 | 60% | 0.604 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -64.9 | -46.1 | 174.5 | -173.7 | 178.3 | -62.4 | 120.4 | 5.4 | 111.9 | A165 E166 V167 M171 G172 | A165-R169 WeakPolarHBondContact O-CB 3.16Å; A165-R169 PolarHBondContact O-N 3.24Å; A165-R169 VanDerWaalsContact O-N 3.08Å; E166-R169 PolarHBondContact O-N 3.2Å; E166-R169 IonicContact OE1-CZ 3.8Å; E166-R169 IonicContact OE1-NH1 2.67Å; E166-R169 PolarHBondContact OE1-NH1 3.47Å; E166-R169 IonicContact OE2-CZ 3.89Å; E166-R169 IonicContact OE2-NH1 2.67Å; E166-R169 PolarHBondContact OE2-NH1 2.86Å; V167-R169 VanDerWaalsContact C-N 3.31Å; V167-R169 PolarHBondContact O-N 2.94Å; R169-M171 PolarHBondContact O-N 3.02Å; R169-G172 PolarHBondContact O-N 3.34Å |
| 170 | A | 91.8 | Very high | 92.7 | Very high | 55 Ų | 55 | 74.7 Ų | 74.7 | 46% | 0.455 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.6 | -38 | 179 | 0 | 0 | 0 | 0 | 0 | 112.8 | V85 E166 V167 G172 | V85-A170 HydrophobicContact CB-CB 4.37Å; V85-A170 HydrophobicContact CG1-CB 4.3Å; V85-A170 HydrophobicContact CG2-CB 3.92Å; E166-A170 WeakPolarHBondContact O-CB 3.45Å; E166-A170 PolarHBondContact O-N 2.7Å; V167-A170 PolarHBondContact O-N 3.3Å; A170-G172 PolarHBondContact O-N 3.17Å |
| 171 | M | 91.1 | Very high | 92.7 | Very high | 119 Ų | 119 | 77.3 Ų | 77.3 | 59% | 0.586 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.9 | -5.7 | 173.2 | -63.8 | -172.5 | -53.6 | 0 | 0 | 113.8 | V167 L168 R169 V173 | V167-M171 HydrophobicContact CG1-CE 3.98Å; V167-M171 HydrophobicContact CG1-SD 4.3Å; V167-M171 WeakPolarHBondContact O-CG 3.34Å; V167-M171 PolarHBondContact O-N 3.44Å; L168-M171 HydrophobicContact CD2-CE 3.93Å; R169-M171 PolarHBondContact O-N 3.02Å; M171-V173 HydrophobicContact CB-CG2 3.8Å; M171-V173 HydrophobicContact CE-CG2 4.37Å; M171-V173 PolarHBondContact O-N 2.98Å |
| 172 | G | 90.8 | Very high | 92.7 | Very high | 50 Ų | 50 | 79.8 Ų | 79.8 | 52% | 0.515 | 42% | 0.419 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65.9 | 20.3 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | L168 R169 A170 | L168-G172 PolarHBondContact O-N 3.18Å; R169-G172 PolarHBondContact O-N 3.34Å; A170-G172 PolarHBondContact O-N 3.17Å |
| 173 | V | 91.2 | Very high | 92.8 | Very high | 73 Ų | 73 | 80.2 Ų | 80.2 | 44% | 0.442 | 43% | 0.427 | S | S | . | . | trans | -93.1 | 113.2 | -173.5 | -176.3 | 0 | 0 | 0 | 0 | 110.5 | L168 M171 V175 | L168-V173 HydrophobicContact CD2-CB 4.34Å; L168-V173 PolarHBondContact O-N 2.97Å; M171-V173 HydrophobicContact CB-CG2 3.8Å; M171-V173 HydrophobicContact CE-CG2 4.37Å; M171-V173 PolarHBondContact O-N 2.98Å; V173-V175 HydrophobicContact CG1-CG2 3.78Å; V173-V175 PolarHBondContact O-N 3.29Å | ||
| 174 | F | 89.8 | Confident | 92.9 | Very high | 209 Ų | 209 | 80.8 Ų | 80.8 | 92% | 0.917 | 43% | 0.43 | S | S | * | . | trans | -73.7 | 107.8 | 172.4 | -58 | -81.4 | 0 | 0 | 0 | 110.4 | ||||
| 175 | V | 90.1 | Very high | 93 | Very high | 56 Ų | 56 | 85.8 Ų | 85.8 | 34% | 0.339 | 45% | 0.447 | S | S | . | . | trans | -117.3 | 140.5 | 172.7 | -170.9 | 0 | 0 | 0 | 0 | 108.8 | L168 V173 T179 V180 | L168-V175 HydrophobicContact CD1-CB 4.2Å; L168-V175 HydrophobicContact CD1-CG2 4.05Å; L168-V175 HydrophobicContact CD2-CG2 3.69Å; L168-V175 HydrophobicContact CG-CG2 4.45Å; V173-V175 HydrophobicContact CG1-CG2 3.78Å; V173-V175 PolarHBondContact O-N 3.29Å; V175-T179 HydrophobicContact CG1-CG2 3.65Å; V175-V180 HydrophobicContact CB-CG2 4.05Å; V175-V180 HydrophobicContact CG1-CG2 3.76Å | ||
| 176 | D | 93.3 | Very high | 93.1 | Very high | 78 Ų | 78 | 87.8 Ų | 87.8 | 42% | 0.417 | 45% | 0.454 | S | S | . | . | trans | -75.2 | 154.4 | 177.6 | 73.1 | -82.1 | 0 | 0 | 0 | 112.3 | I178 T179 V180 | D176-I178 PolarHBondContact O-N 3.33Å; D176-I178 WeakPolarHBondContact OD2-CA 3.28Å; D176-I178 VanDerWaalsContact OD2-CB 3.24Å; D176-I178 WeakPolarHBondContact OD2-CB 3.37Å; D176-I178 PolarHBondContact OD2-N 3.39Å; D176-T179 PolarHBondContact O-N 3.01Å; D176-T179 WeakPolarHBondContact OD1-CB 3.3Å; D176-T179 PolarHBondContact OD1-OG1 3.44Å; D176-T179 PolarHBondContact OD2-N 3.21Å; D176-T179 PolarHBondContact OD2-OG1 2.89Å; D176-V180 WeakPolarHBondContact O-CG2 3.31Å; D176-V180 PolarHBondContact O-N 2.89Å; D176-V180 VanDerWaalsContact O-N 3.08Å | ||
| 177 | Y | 92.2 | Very high | 93.3 | Very high | 203 Ų | 203 | 88.4 Ų | 88.4 | 80% | 0.796 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -63.1 | -24.1 | -178.2 | -68.3 | -72.7 | 0 | 0 | 0 | 114.1 | A181 | Y177-A181 WeakPolarHBondContact O-CB 2.97Å; Y177-A181 PolarHBondContact O-N 3.44Å |
| 178 | I | 94.6 | Very high | 93.4 | Very high | 138 Ų | 138 | 87 Ų | 87 | 71% | 0.708 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -76.1 | -45.2 | -179.5 | -51.6 | 177.4 | 0 | 0 | 0 | 109.2 | D176 A181 F182 | D176-I178 PolarHBondContact O-N 3.33Å; D176-I178 WeakPolarHBondContact OD2-CA 3.28Å; D176-I178 VanDerWaalsContact OD2-CB 3.24Å; D176-I178 WeakPolarHBondContact OD2-CB 3.37Å; D176-I178 PolarHBondContact OD2-N 3.39Å; I178-A181 PolarHBondContact O-N 3.38Å; I178-F182 WeakPolarHBondContact O-CB 3.24Å; I178-F182 PolarHBondContact O-N 3.09Å |
| 179 | T | 94.2 | Very high | 93.5 | Very high | 73 Ų | 73 | 87.3 Ų | 87.3 | 45% | 0.448 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -60 | -45.7 | 173 | -62.5 | 0 | 0 | 0 | 0 | 111.4 | V175 D176 F182 A183 | V175-T179 HydrophobicContact CG1-CG2 3.65Å; D176-T179 PolarHBondContact O-N 3.01Å; D176-T179 WeakPolarHBondContact OD1-CB 3.3Å; D176-T179 PolarHBondContact OD1-OG1 3.44Å; D176-T179 PolarHBondContact OD2-N 3.21Å; D176-T179 PolarHBondContact OD2-OG1 2.89Å; T179-F182 PolarHBondContact O-N 3.45Å; T179-A183 VanDerWaalsContact O-CB 3.3Å; T179-A183 WeakPolarHBondContact O-CB 3.45Å; T179-A183 PolarHBondContact O-N 2.87Å |
| 180 | V | 93.2 | Very high | 93.7 | Very high | 23 Ų | 23 | 82.3 Ų | 82.3 | 14% | 0.139 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -62.7 | -45.9 | 176.5 | 176.6 | 0 | 0 | 0 | 0 | 111.4 | F161 L168 V175 D176 F182 A183 L184 | F161-V180 HydrophobicContact CD2-CG1 4.42Å; F161-V180 HydrophobicContact CE2-CG1 4.32Å; L168-V180 HydrophobicContact CD1-CG2 3.88Å; V175-V180 HydrophobicContact CB-CG2 4.05Å; V175-V180 HydrophobicContact CG1-CG2 3.76Å; D176-V180 WeakPolarHBondContact O-CG2 3.31Å; D176-V180 PolarHBondContact O-N 2.89Å; D176-V180 VanDerWaalsContact O-N 3.08Å; V180-F182 PolarHBondContact O-N 3.45Å; V180-A183 PolarHBondContact O-N 2.85Å; V180-L184 VanDerWaalsContact O-CB 3.28Å; V180-L184 WeakPolarHBondContact O-CB 3.41Å; V180-L184 PolarHBondContact O-N 2.92Å |
| 181 | A | 94.1 | Very high | 93.8 | Very high | 56 Ų | 56 | 79.7 Ų | 79.7 | 46% | 0.463 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.7 | -40.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y177 I178 W185 | Y177-A181 WeakPolarHBondContact O-CB 2.97Å; Y177-A181 PolarHBondContact O-N 3.44Å; I178-A181 PolarHBondContact O-N 3.38Å; A181-W185 VanDerWaalsContact O-CB 3.24Å; A181-W185 WeakPolarHBondContact O-CB 3.33Å; A181-W185 PolarHBondContact O-N 3.34Å |
| 182 | F | 95.6 | Very high | 94 | Very high | 142 Ų | 142 | 75.4 Ų | 75.4 | 62% | 0.623 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -67.7 | -43.8 | 176.8 | -177 | -101.3 | 0 | 0 | 0 | 112 | I178 T179 V180 W185 N186 | I178-F182 WeakPolarHBondContact O-CB 3.24Å; I178-F182 PolarHBondContact O-N 3.09Å; T179-F182 PolarHBondContact O-N 3.45Å; V180-F182 PolarHBondContact O-N 3.45Å; F182-W185 PolarHBondContact O-N 3.5Å; F182-N186 WeakPolarHBondContact CE1-ND2 3.02Å; F182-N186 WeakPolarHBondContact CE2-ND2 3.38Å; F182-N186 VanDerWaalsContact CZ-ND2 3.29Å; F182-N186 WeakPolarHBondContact CZ-ND2 3.28Å; F182-N186 PolarHBondContact O-N 2.96Å; F182-N186 PolarHBondContact O-ND2 3.4Å |
| 183 | A | 94.5 | Very high | 94 | Very high | 56 Ų | 56 | 77.3 Ų | 77.3 | 46% | 0.463 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -61.8 | -47.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | T179 V180 W185 N186 F187 | T179-A183 VanDerWaalsContact O-CB 3.3Å; T179-A183 WeakPolarHBondContact O-CB 3.45Å; T179-A183 PolarHBondContact O-N 2.87Å; V180-A183 PolarHBondContact O-N 2.85Å; A183-W185 PolarHBondContact O-N 2.88Å; A183-N186 PolarHBondContact O-N 2.86Å; A183-F187 WeakPolarHBondContact O-CB 3.41Å; A183-F187 PolarHBondContact O-N 2.92Å |
| 184 | L | 95.4 | Very high | 94.1 | Very high | 22 Ų | 22 | 74.1 Ų | 74.1 | 12% | 0.115 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 176.2 | -177.4 | 72.6 | 0 | 0 | 0 | 112.2 | F161 F164 V180 F187 G188 | F161-L184 HydrophobicContact CB-CD1 4.29Å; F161-L184 HydrophobicContact CB-CD2 3.75Å; F161-L184 HydrophobicContact CD2-CD2 4.06Å; F161-L184 HydrophobicContact CG-CD2 4.3Å; F164-L184 HydrophobicContact CD2-CD1 4.16Å; F164-L184 HydrophobicContact CE2-CD1 4.34Å; V180-L184 VanDerWaalsContact O-CB 3.28Å; V180-L184 WeakPolarHBondContact O-CB 3.41Å; V180-L184 PolarHBondContact O-N 2.92Å; L184-F187 PolarHBondContact O-N 2.89Å; L184-G188 PolarHBondContact O-N 2.63Å |
| 185 | W | 95.8 | Very high | 94.1 | Very high | 164 Ų | 164 | 64.3 Ų | 64.3 | 62% | 0.621 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -60.4 | -47.8 | 177.5 | 177.7 | -98.4 | 0 | 0 | 0 | 111.5 | F157 A181 F182 A183 V189 | F157-W185 HydrophobicContact CE1-CE3 4.05Å; F157-W185 HydrophobicContact CE1-CZ3 4.49Å; A181-W185 VanDerWaalsContact O-CB 3.24Å; A181-W185 WeakPolarHBondContact O-CB 3.33Å; A181-W185 PolarHBondContact O-N 3.34Å; F182-W185 PolarHBondContact O-N 3.5Å; A183-W185 PolarHBondContact O-N 2.88Å; W185-V189 HydrophobicContact CD2-CG2 4Å; W185-V189 HydrophobicContact CE3-CG2 4.42Å; W185-V189 HydrophobicContact CG-CG2 4.45Å; W185-V189 HydrophobicContact CH2-CG2 4.35Å; W185-V189 HydrophobicContact CZ2-CG2 3.91Å; W185-V189 VanDerWaalsContact O-CB 3.3Å; W185-V189 WeakPolarHBondContact O-CB 3.35Å; W185-V189 VanDerWaalsContact O-CG2 3.25Å; W185-V189 WeakPolarHBondContact O-CG2 3.3Å; W185-V189 PolarHBondContact O-N 3.43Å |
| 186 | N | 96.5 | Very high | 94 | Very high | 69 Ų | 69 | 63.8 Ų | 63.8 | 37% | 0.369 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 176.3 | -77.5 | -86.5 | 0 | 0 | 0 | 111.4 | F182 A183 V190 | F182-N186 WeakPolarHBondContact CE1-ND2 3.02Å; F182-N186 WeakPolarHBondContact CE2-ND2 3.38Å; F182-N186 VanDerWaalsContact CZ-ND2 3.29Å; F182-N186 WeakPolarHBondContact CZ-ND2 3.28Å; F182-N186 PolarHBondContact O-N 2.96Å; F182-N186 PolarHBondContact O-ND2 3.4Å; A183-N186 PolarHBondContact O-N 2.86Å; N186-V190 VanDerWaalsContact O-CB 3.27Å; N186-V190 WeakPolarHBondContact O-CB 3.42Å; N186-V190 WeakPolarHBondContact O-CG2 3.49Å; N186-V190 PolarHBondContact O-N 2.9Å |
| 187 | F | 96.4 | Very high | 93.6 | Very high | 40 Ų | 40 | 68.9 Ų | 68.9 | 18% | 0.175 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.9 | -51.9 | 177.4 | -179 | -97.2 | 0 | 0 | 0 | 112.4 | L156 F164 A183 L184 G191 Y207 F210 | L156-F187 HydrophobicContact CD2-CE1 3.89Å; L156-F187 HydrophobicContact CD2-CZ 4.41Å; F164-F187 HydrophobicContact CE2-CD1 4Å; F164-F187 HydrophobicContact CE2-CE1 4.25Å; F164-F187 HydrophobicContact CE2-CG 4.18Å; F164-F187 HydrophobicContact CZ-CD1 4.38Å; F164-F187 HydrophobicContact CZ-CD2 4.27Å; F164-F187 HydrophobicContact CZ-CE1 4.39Å; F164-F187 HydrophobicContact CZ-CE2 4.28Å; F164-F187 HydrophobicContact CZ-CG 4.32Å; F164-F187 HydrophobicContact CZ-CZ 4.35Å; A183-F187 WeakPolarHBondContact O-CB 3.41Å; A183-F187 PolarHBondContact O-N 2.92Å; L184-F187 PolarHBondContact O-N 2.89Å; F187-G191 PolarHBondContact O-N 3.38Å; F187-Y207 HydrophobicContact CD1-CE1 4.39Å; F187-Y207 AromaticContact CD2-CE1 3.74Å; F187-Y207 HydrophobicContact CD2-CE1 3.74Å; F187-Y207 HydrophobicContact CE1-CE1 4.11Å; F187-Y207 HydrophobicContact CE2-CD1 4.16Å; F187-Y207 AromaticContact CE2-CE1 3.42Å; F187-Y207 HydrophobicContact CE2-CE1 3.42Å; F187-Y207 VanDerWaalsContact CE2-CE1 3.42Å; F187-Y207 HydrophobicContact CG-CE1 4.22Å; F187-Y207 HydrophobicContact CZ-CD1 4.03Å; F187-Y207 AromaticContact CZ-CE1 3.61Å; F187-Y207 HydrophobicContact CZ-CE1 3.61Å; F187-Y207 WeakPolarHBondContact O-CE1 3.27Å; F187-Y207 PolarHBondContact O-OH 3.36Å; F187-F210 HydrophobicContact CE1-CD1 4.22Å; F187-F210 AromaticContact CE1-CE1 3.76Å; F187-F210 HydrophobicContact CE1-CE1 3.76Å; F187-F210 HydrophobicContact CE1-CZ 4.31Å; F187-F210 AromaticContact CZ-CD1 3.6Å; F187-F210 HydrophobicContact CZ-CD1 3.6Å; F187-F210 AromaticContact CZ-CE1 3.44Å; F187-F210 HydrophobicContact CZ-CE1 3.44Å; F187-F210 VanDerWaalsContact CZ-CE1 3.44Å; F187-F210 HydrophobicContact CZ-CE2 4.39Å; F187-F210 HydrophobicContact CZ-CG 4.14Å; F187-F210 AromaticContact CZ-CZ 3.85Å; F187-F210 HydrophobicContact CZ-CZ 3.85Å |
| 188 | G | 96 | Very high | 93.1 | Very high | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -66.6 | -41.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F157 L184 M192 | F157-G188 VanDerWaalsContact CZ-C 3.47Å; L184-G188 PolarHBondContact O-N 2.63Å; G188-M192 WeakPolarHBondContact O-CB 3.38Å; G188-M192 VanDerWaalsContact O-CG 3.29Å; G188-M192 WeakPolarHBondContact O-CG 3.3Å; G188-M192 PolarHBondContact O-N 2.86Å |
| 189 | V | 95.8 | Very high | 92.6 | Very high | 47 Ų | 47 | 61.4 Ų | 61.4 | 29% | 0.285 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -67.8 | -45.4 | 177.3 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | F157 W185 M192 I193 | F157-V189 HydrophobicContact CZ-CG2 4.13Å; W185-V189 HydrophobicContact CD2-CG2 4Å; W185-V189 HydrophobicContact CE3-CG2 4.42Å; W185-V189 HydrophobicContact CG-CG2 4.45Å; W185-V189 HydrophobicContact CH2-CG2 4.35Å; W185-V189 HydrophobicContact CZ2-CG2 3.91Å; W185-V189 VanDerWaalsContact O-CB 3.3Å; W185-V189 WeakPolarHBondContact O-CB 3.35Å; W185-V189 VanDerWaalsContact O-CG2 3.25Å; W185-V189 WeakPolarHBondContact O-CG2 3.3Å; W185-V189 PolarHBondContact O-N 3.43Å; V189-M192 PolarHBondContact O-N 3.27Å; V189-I193 HydrophobicContact CG1-CD1 3.77Å; V189-I193 HydrophobicContact CG1-CG1 4.48Å; V189-I193 VanDerWaalsContact O-CG1 3.29Å; V189-I193 WeakPolarHBondContact O-CG1 3.47Å; V189-I193 PolarHBondContact O-N 3.46Å |
| 190 | V | 95.8 | Very high | 92.4 | Very high | 55 Ų | 55 | 62 Ų | 62 | 33% | 0.333 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.5 | -44.8 | 177.7 | 173.1 | 0 | 0 | 0 | 0 | 110.6 | N186 M192 I193 V194 L203 Y207 | N186-V190 VanDerWaalsContact O-CB 3.27Å; N186-V190 WeakPolarHBondContact O-CB 3.42Å; N186-V190 WeakPolarHBondContact O-CG2 3.49Å; N186-V190 PolarHBondContact O-N 2.9Å; V190-M192 VanDerWaalsContact C-N 3.35Å; V190-M192 PolarHBondContact O-N 3.48Å; V190-I193 PolarHBondContact O-N 2.96Å; V190-V194 HydrophobicContact CG1-CG2 4.06Å; V190-V194 WeakPolarHBondContact O-CB 3.14Å; V190-V194 WeakPolarHBondContact O-CG2 3.28Å; V190-V194 PolarHBondContact O-N 3.08Å; V190-L203 HydrophobicContact CG1-CD2 4.09Å; V190-Y207 HydrophobicContact CG1-CE2 3.89Å |
| 191 | G | 94.5 | Very high | 92 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -58.2 | -44.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | F187 V194 I195 Y207 | F187-G191 PolarHBondContact O-N 3.38Å; G191-V194 PolarHBondContact O-N 3.21Å; G191-I195 WeakPolarHBondContact O-CB 3.18Å; G191-I195 VanDerWaalsContact O-CG1 3.25Å; G191-I195 WeakPolarHBondContact O-CG1 3.19Å; G191-I195 PolarHBondContact O-N 3.1Å; G191-Y207 VanDerWaalsContact CA-CE1 3.45Å |
| 192 | M | 93.6 | Very high | 91.7 | Very high | 30 Ų | 30 | 65.6 Ų | 65.6 | 15% | 0.148 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.6 | -44.2 | 176.3 | -78.7 | -57.5 | -60.6 | 0 | 0 | 112.9 | I149 T152 I153 L156 F157 G188 V189 V190 H196 | I149-M192 HydrophobicContact CG2-CE 3.95Å; T152-M192 HydrophobicContact CG2-SD 3.63Å; I153-M192 HydrophobicContact CD1-CE 4.14Å; I153-M192 HydrophobicContact CG1-CE 3.65Å; I153-M192 HydrophobicContact CG1-CG 4.07Å; I153-M192 HydrophobicContact CG1-SD 3.65Å; L156-M192 HydrophobicContact CD1-CG 3.96Å; L156-M192 HydrophobicContact CD1-SD 4.04Å; F157-M192 HydrophobicContact CE2-CG 4.31Å; G188-M192 WeakPolarHBondContact O-CB 3.38Å; G188-M192 VanDerWaalsContact O-CG 3.29Å; G188-M192 WeakPolarHBondContact O-CG 3.3Å; G188-M192 PolarHBondContact O-N 2.86Å; V189-M192 PolarHBondContact O-N 3.27Å; V190-M192 VanDerWaalsContact C-N 3.35Å; V190-M192 PolarHBondContact O-N 3.48Å; M192-H196 WeakPolarHBondContact CE-ND1 3.3Å; M192-H196 WeakPolarHBondContact O-CB 3.24Å; M192-H196 PolarHBondContact O-N 3.5Å |
| 193 | I | 92.5 | Very high | 91.6 | Very high | 90 Ų | 90 | 62 Ų | 62 | 46% | 0.462 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 176 | -69.2 | 166.2 | 0 | 0 | 0 | 110.7 | V189 V190 W197 | V189-I193 HydrophobicContact CG1-CD1 3.77Å; V189-I193 HydrophobicContact CG1-CG1 4.48Å; V189-I193 VanDerWaalsContact O-CG1 3.29Å; V189-I193 WeakPolarHBondContact O-CG1 3.47Å; V189-I193 PolarHBondContact O-N 3.46Å; V190-I193 PolarHBondContact O-N 2.96Å; I193-W197 HydrophobicContact CG2-CB 4.38Å; I193-W197 CarbonylContact O-C 3.57Å; I193-W197 WeakPolarHBondContact O-CA 3.34Å; I193-W197 WeakPolarHBondContact O-CB 3.45Å; I193-W197 PolarHBondContact O-N 2.86Å |
| 194 | V | 91.4 | Very high | 91.4 | Very high | 6 Ų | 6 | 61.1 Ų | 61.1 | 4% | 0.036 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -74.8 | -29.9 | -174.1 | 172 | 0 | 0 | 0 | 0 | 112.5 | V190 G191 L203 Q204 Y207 | V190-V194 HydrophobicContact CG1-CG2 4.06Å; V190-V194 WeakPolarHBondContact O-CB 3.14Å; V190-V194 WeakPolarHBondContact O-CG2 3.28Å; V190-V194 PolarHBondContact O-N 3.08Å; G191-V194 PolarHBondContact O-N 3.21Å; V194-L203 HydrophobicContact CG1-CB 4.23Å; V194-L203 HydrophobicContact CG1-CG 4.21Å; V194-L203 HydrophobicContact CG2-CD2 3.8Å; V194-L203 HydrophobicContact CG2-CG 4.17Å; V194-Q204 HydrophobicContact CG1-CB 3.63Å; V194-Q204 HydrophobicContact CG1-CG 4.28Å; V194-Q204 VanDerWaalsContact CG1-N 3.31Å; V194-Y207 HydrophobicContact CG1-CD2 4.44Å |
| 195 | I | 89.7 | Confident | 91.2 | Very high | 2 Ų | 2 | 61.4 Ų | 61.4 | 1% | 0.01 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -84.6 | -42.1 | 178.2 | -66 | 168.9 | 0 | 0 | 0 | 112.4 | T152 L156 G191 I211 A267 | T152-I195 HydrophobicContact CG2-CD1 3.89Å; T152-I195 HydrophobicContact CG2-CG2 4.48Å; L156-I195 HydrophobicContact CD1-CD1 4.17Å; G191-I195 WeakPolarHBondContact O-CB 3.18Å; G191-I195 VanDerWaalsContact O-CG1 3.25Å; G191-I195 WeakPolarHBondContact O-CG1 3.19Å; G191-I195 PolarHBondContact O-N 3.1Å; I195-I211 HydrophobicContact CD1-CD1 3.41Å; I195-I211 VanDerWaalsContact CD1-CD1 3.41Å; I195-A267 HydrophobicContact CG2-CB 3.49Å; I195-A267 VanDerWaalsContact CG2-CB 3.49Å |
| 196 | H | 88.2 | Confident | 91.1 | Very high | 46 Ų | 46 | 56 Ų | 56 | 21% | 0.213 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -100.6 | -9.5 | -173.6 | -71.6 | 89.3 | 0 | 0 | 0 | 114.6 | I149 T152 M192 | I149-H196 VanDerWaalsContact CG1-CD2 3.46Å; I149-H196 WeakPolarHBondContact CG1-CD2 3.16Å; T152-H196 PolarHBondContact OG1-CE1 2.92Å; M192-H196 WeakPolarHBondContact CE-ND1 3.3Å; M192-H196 WeakPolarHBondContact O-CB 3.24Å; M192-H196 PolarHBondContact O-N 3.5Å |
| 197 | W | 85.5 | Confident | 90.9 | Very high | 184 Ų | 184 | 53.8 Ų | 53.8 | 70% | 0.697 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -129.8 | -169.7 | 179.3 | -137.8 | -100.2 | 0 | 0 | 0 | 110.5 | I193 G199 | I193-W197 HydrophobicContact CG2-CB 4.38Å; I193-W197 CarbonylContact O-C 3.57Å; I193-W197 WeakPolarHBondContact O-CA 3.34Å; I193-W197 WeakPolarHBondContact O-CB 3.45Å; I193-W197 PolarHBondContact O-N 2.86Å; W197-G199 PolarHBondContact O-N 3.25Å; W197-G199 VanDerWaalsContact O-N 3.17Å |
| 198 | R | 82.6 | Confident | 90.7 | Very high | 164 Ų | 164 | 52.1 Ų | 52.1 | 62% | 0.619 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.3 | 89.9 | -177.6 | -171.7 | 172.7 | -172.1 | 73.8 | -0.5 | 111.7 | Y276 | R198-Y276 VanDerWaalsContact NH1-CE1 3.29Š|
| 199 | G | 82.9 | Confident | 90.6 | Very high | 20 Ų | 20 | 53.2 Ų | 53.2 | 21% | 0.206 | 28% | 0.275 | C | S | . | . | trans | -96.2 | 171.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | W197 | W197-G199 PolarHBondContact O-N 3.25Å; W197-G199 VanDerWaalsContact O-N 3.17Å | ||
| 200 | P | 89.8 | Confident | 90.6 | Very high | 85 Ų | 85 | 52.3 Ų | 52.3 | 55% | 0.552 | 27% | 0.267 | S | S | * | . | trans | -74.9 | 134.4 | 167.6 | 29 | -29 | 0 | 0 | 0 | 110.6 | V202 L203 Q204 | P200-V202 PolarHBondContact O-N 3.46Å; P200-L203 HydrophobicContact CG-CB 3.87Å; P200-L203 HydrophobicContact CG-CD2 4.14Å; P200-L203 WeakPolarHBondContact O-CB 3.44Å; P200-L203 PolarHBondContact O-N 2.96Å; P200-Q204 PolarHBondContact O-N 3.49Å; P200-Q204 VanDerWaalsContact O-N 3.14Å | ||
| 201 | L | 84.8 | Confident | 90.5 | Very high | 45 Ų | 45 | 50.2 Ų | 50.2 | 24% | 0.236 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57.8 | -41.7 | -167 | 173.9 | 144.1 | 0 | 0 | 0 | 114.1 | L203 Q204 Q205 T274 | L201-L203 VanDerWaalsContact C-N 3.29Å; L201-L203 PolarHBondContact O-N 3.3Å; L201-Q204 PolarHBondContact O-N 3.05Å; L201-Q205 HydrophobicContact CD2-CG 4.35Å; L201-Q205 WeakPolarHBondContact O-CG 3.37Å; L201-Q205 PolarHBondContact O-N 3.36Å; L201-T274 HydrophobicContact CB-CG2 4.33Å; L201-T274 HydrophobicContact CD1-CG2 3.75Å |
| 202 | V | 89.4 | Confident | 90.5 | Very high | 111 Ų | 111 | 50.3 Ų | 50.3 | 67% | 0.673 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -62.2 | -36.6 | 178.6 | -179.5 | 0 | 0 | 0 | 0 | 111.8 | P200 Q205 A206 | P200-V202 PolarHBondContact O-N 3.46Å; V202-Q205 PolarHBondContact O-N 3.2Å; V202-A206 WeakPolarHBondContact O-CB 3.38Å; V202-A206 PolarHBondContact O-N 3.42Å |
| 203 | L | 92.1 | Very high | 90.6 | Very high | 67 Ų | 67 | 48.9 Ų | 48.9 | 35% | 0.351 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -72.4 | -37.5 | 177.6 | -168.7 | 57.4 | 0 | 0 | 0 | 111 | V190 V194 P200 L201 A206 Y207 | V190-L203 HydrophobicContact CG1-CD2 4.09Å; V194-L203 HydrophobicContact CG1-CB 4.23Å; V194-L203 HydrophobicContact CG1-CG 4.21Å; V194-L203 HydrophobicContact CG2-CD2 3.8Å; V194-L203 HydrophobicContact CG2-CG 4.17Å; P200-L203 HydrophobicContact CG-CB 3.87Å; P200-L203 HydrophobicContact CG-CD2 4.14Å; P200-L203 WeakPolarHBondContact O-CB 3.44Å; P200-L203 PolarHBondContact O-N 2.96Å; L201-L203 VanDerWaalsContact C-N 3.29Å; L201-L203 PolarHBondContact O-N 3.3Å; L203-A206 PolarHBondContact O-N 3.18Å; L203-Y207 HydrophobicContact CD1-CD2 4.03Å; L203-Y207 HydrophobicContact CD1-CE2 3.74Å; L203-Y207 HydrophobicContact CD2-CE2 4.49Å; L203-Y207 HydrophobicContact CG-CD2 3.99Å; L203-Y207 HydrophobicContact CG-CE2 3.89Å; L203-Y207 WeakPolarHBondContact O-CD2 3.41Å; L203-Y207 PolarHBondContact O-N 3.04Å |
| 204 | Q | 90.9 | Very high | 90.7 | Very high | 36 Ų | 36 | 44.7 Ų | 44.7 | 17% | 0.168 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.5 | -44 | 173.4 | -170.4 | -175.5 | -7.8 | 0 | 0 | 111.2 | V194 P200 L201 A206 Y207 L208 P266 | V194-Q204 HydrophobicContact CG1-CB 3.63Å; V194-Q204 HydrophobicContact CG1-CG 4.28Å; V194-Q204 VanDerWaalsContact CG1-N 3.31Å; P200-Q204 PolarHBondContact O-N 3.49Å; P200-Q204 VanDerWaalsContact O-N 3.14Å; L201-Q204 PolarHBondContact O-N 3.05Å; Q204-A206 PolarHBondContact O-N 3.5Å; Q204-Y207 PolarHBondContact O-N 3.5Å; Q204-L208 HydrophobicContact CG-CD1 4.17Å; Q204-L208 WeakPolarHBondContact O-CB 3.35Å; Q204-L208 VanDerWaalsContact O-CG 3.25Å; Q204-L208 WeakPolarHBondContact O-CG 3.48Å; Q204-L208 PolarHBondContact O-N 2.78Å; Q204-P266 PolarHBondContact NE2-O 3.41Å |
| 205 | Q | 90.8 | Very high | 90.9 | Very high | 29 Ų | 29 | 45.9 Ų | 45.9 | 14% | 0.136 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59 | -46 | 173.9 | -72 | 176.4 | -23.1 | 0 | 0 | 111.8 | L201 V202 L208 I209 Y270 S271 | L201-Q205 HydrophobicContact CD2-CG 4.35Å; L201-Q205 WeakPolarHBondContact O-CG 3.37Å; L201-Q205 PolarHBondContact O-N 3.36Å; V202-Q205 PolarHBondContact O-N 3.2Å; Q205-L208 PolarHBondContact O-N 3.42Å; Q205-I209 WeakPolarHBondContact O-CB 3.25Å; Q205-I209 WeakPolarHBondContact O-CD1 3.5Å; Q205-I209 VanDerWaalsContact O-CG1 3.25Å; Q205-I209 WeakPolarHBondContact O-CG1 3.3Å; Q205-I209 PolarHBondContact O-N 2.91Å; Q205-Y270 HydrophobicContact CB-CE2 3.57Å; Q205-Y270 WeakPolarHBondContact CB-OH 3.49Å; Q205-Y270 HydrophobicContact CG-CD2 4.37Å; Q205-Y270 HydrophobicContact CG-CE1 4.25Å; Q205-Y270 HydrophobicContact CG-CE2 3.57Å; Q205-Y270 VanDerWaalsContact CG-CZ 3.49Å; Q205-Y270 WeakPolarHBondContact CG-OH 3.36Å; Q205-S271 PolarHBondContact NE2-O 2.9Å |
| 206 | A | 93.2 | Very high | 91.1 | Very high | 50 Ų | 50 | 45.8 Ų | 45.8 | 41% | 0.413 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61.1 | -45.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113 | V202 L203 Q204 I209 F210 | V202-A206 WeakPolarHBondContact O-CB 3.38Å; V202-A206 PolarHBondContact O-N 3.42Å; L203-A206 PolarHBondContact O-N 3.18Å; Q204-A206 PolarHBondContact O-N 3.5Å; A206-I209 PolarHBondContact O-N 2.95Å; A206-F210 WeakPolarHBondContact O-CB 3.22Å; A206-F210 PolarHBondContact O-N 3.48Å |
| 207 | Y | 93.9 | Very high | 91.4 | Very high | 23 Ų | 23 | 43.6 Ų | 43.6 | 9% | 0.09 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.9 | -36.4 | 175.8 | -85.7 | -76.2 | 0 | 0 | 0 | 112.7 | L156 F187 V190 G191 V194 L203 Q204 F210 I211 | L156-Y207 HydrophobicContact CD2-CD1 3.96Å; L156-Y207 HydrophobicContact CD2-CE1 4.34Å; F187-Y207 HydrophobicContact CD1-CE1 4.39Å; F187-Y207 AromaticContact CD2-CE1 3.74Å; F187-Y207 HydrophobicContact CD2-CE1 3.74Å; F187-Y207 HydrophobicContact CE1-CE1 4.11Å; F187-Y207 HydrophobicContact CE2-CD1 4.16Å; F187-Y207 AromaticContact CE2-CE1 3.42Å; F187-Y207 HydrophobicContact CE2-CE1 3.42Å; F187-Y207 VanDerWaalsContact CE2-CE1 3.42Å; F187-Y207 HydrophobicContact CG-CE1 4.22Å; F187-Y207 HydrophobicContact CZ-CD1 4.03Å; F187-Y207 AromaticContact CZ-CE1 3.61Å; F187-Y207 HydrophobicContact CZ-CE1 3.61Å; F187-Y207 WeakPolarHBondContact O-CE1 3.27Å; F187-Y207 PolarHBondContact O-OH 3.36Å; V190-Y207 HydrophobicContact CG1-CE2 3.89Å; G191-Y207 VanDerWaalsContact CA-CE1 3.45Å; V194-Y207 HydrophobicContact CG1-CD2 4.44Å; L203-Y207 HydrophobicContact CD1-CD2 4.03Å; L203-Y207 HydrophobicContact CD1-CE2 3.74Å; L203-Y207 HydrophobicContact CD2-CE2 4.49Å; L203-Y207 HydrophobicContact CG-CD2 3.99Å; L203-Y207 HydrophobicContact CG-CE2 3.89Å; L203-Y207 WeakPolarHBondContact O-CD2 3.41Å; L203-Y207 PolarHBondContact O-N 3.04Å; Q204-Y207 PolarHBondContact O-N 3.5Å; Y207-F210 PolarHBondContact O-N 2.88Å; Y207-I211 WeakPolarHBondContact O-CB 3.37Å; Y207-I211 VanDerWaalsContact O-CG1 3.3Å; Y207-I211 WeakPolarHBondContact O-CG1 3.34Å; Y207-I211 PolarHBondContact O-N 3.35Å |
| 208 | L | 92 | Very high | 91.7 | Very high | 5 Ų | 5 | 37 Ų | 37 | 3% | 0.026 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.7 | -43.4 | 175.4 | -70.5 | 172.4 | 0 | 0 | 0 | 111.9 | Q204 Q205 F210 I211 S212 A267 Y270 L412 | Q204-L208 HydrophobicContact CG-CD1 4.17Å; Q204-L208 WeakPolarHBondContact O-CB 3.35Å; Q204-L208 VanDerWaalsContact O-CG 3.25Å; Q204-L208 WeakPolarHBondContact O-CG 3.48Å; Q204-L208 PolarHBondContact O-N 2.78Å; Q205-L208 PolarHBondContact O-N 3.42Å; L208-F210 VanDerWaalsContact C-N 3.34Å; L208-F210 PolarHBondContact O-N 3.37Å; L208-I211 PolarHBondContact O-N 2.97Å; L208-S212 PolarHBondContact O-N 2.97Å; L208-S212 PolarHBondContact O-OG 2.89Å; L208-A267 WeakPolarHBondContact CD2-O 3.3Å; L208-Y270 HydrophobicContact CB-CD2 4.34Å; L208-Y270 HydrophobicContact CD1-CD2 4.43Å; L208-L412 HydrophobicContact CB-CD1 4.17Å; L208-L412 HydrophobicContact CD2-CD1 3.78Å |
| 209 | I | 93.8 | Very high | 92.2 | Very high | 22 Ų | 22 | 30.8 Ų | 30.8 | 11% | 0.113 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61.2 | -41.7 | 174.9 | -70.3 | 161 | 0 | 0 | 0 | 111.2 | P70 V73 C74 Q205 A206 S212 A213 Y270 | P70-I209 HydrophobicContact CB-CD1 3.62Å; P70-I209 HydrophobicContact CB-CG1 4.17Å; V73-I209 HydrophobicContact CG1-CG2 4.22Å; C74-I209 HydrophobicContact CB-CG2 3.92Å; C74-I209 PolarHBondContact SG-O 3.26Å; C74-I209 VanDerWaalsContact SG-O 3.33Å; Q205-I209 WeakPolarHBondContact O-CB 3.25Å; Q205-I209 WeakPolarHBondContact O-CD1 3.5Å; Q205-I209 VanDerWaalsContact O-CG1 3.25Å; Q205-I209 WeakPolarHBondContact O-CG1 3.3Å; Q205-I209 PolarHBondContact O-N 2.91Å; A206-I209 PolarHBondContact O-N 2.95Å; I209-S212 WeakPolarHBondContact CA-OG 3.23Å; I209-S212 PolarHBondContact O-OG 3.34Å; I209-A213 WeakPolarHBondContact O-CB 3.44Å; I209-A213 PolarHBondContact O-N 2.98Å; I209-Y270 HydrophobicContact CD1-CE2 3.98Å; I209-Y270 HydrophobicContact CG1-CE2 3.97Å |
| 210 | F | 95 | Very high | 92.7 | Very high | 28 Ų | 28 | 29.8 Ų | 29.8 | 12% | 0.123 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -65.3 | -43.9 | 175.4 | -175.9 | -88.8 | 0 | 0 | 0 | 111.4 | F77 F163 F164 F187 A206 Y207 L208 S212 A213 Q214 | F77-F210 HydrophobicContact CE1-CD2 4.44Å; F77-F210 HydrophobicContact CE2-CD2 4.47Å; F77-F210 AromaticContact CZ-CD2 3.89Å; F77-F210 HydrophobicContact CZ-CD2 3.89Å; F77-F210 AromaticContact CZ-CE2 3.8Å; F77-F210 HydrophobicContact CZ-CE2 3.8Å; F163-F210 HydrophobicContact CD1-CE2 4.17Å; F163-F210 AromaticContact CD1-CZ 3.78Å; F163-F210 HydrophobicContact CD1-CZ 3.78Å; F163-F210 AromaticContact CE1-CE2 3.78Å; F163-F210 HydrophobicContact CE1-CE2 3.78Å; F163-F210 AromaticContact CE1-CZ 3.88Å; F163-F210 HydrophobicContact CE1-CZ 3.88Å; F163-F210 HydrophobicContact CZ-CE2 4.35Å; F164-F210 HydrophobicContact CZ-CZ 4.15Å; F187-F210 HydrophobicContact CE1-CD1 4.22Å; F187-F210 AromaticContact CE1-CE1 3.76Å; F187-F210 HydrophobicContact CE1-CE1 3.76Å; F187-F210 HydrophobicContact CE1-CZ 4.31Å; F187-F210 AromaticContact CZ-CD1 3.6Å; F187-F210 HydrophobicContact CZ-CD1 3.6Å; F187-F210 AromaticContact CZ-CE1 3.44Å; F187-F210 HydrophobicContact CZ-CE1 3.44Å; F187-F210 VanDerWaalsContact CZ-CE1 3.44Å; F187-F210 HydrophobicContact CZ-CE2 4.39Å; F187-F210 HydrophobicContact CZ-CG 4.14Å; F187-F210 AromaticContact CZ-CZ 3.85Å; F187-F210 HydrophobicContact CZ-CZ 3.85Å; A206-F210 WeakPolarHBondContact O-CB 3.22Å; A206-F210 PolarHBondContact O-N 3.48Å; Y207-F210 PolarHBondContact O-N 2.88Å; L208-F210 VanDerWaalsContact C-N 3.34Å; L208-F210 PolarHBondContact O-N 3.37Å; F210-S212 PolarHBondContact O-N 3.5Å; F210-A213 WeakPolarHBondContact O-CB 3.48Å; F210-A213 PolarHBondContact O-N 3.46Å; F210-Q214 HydrophobicContact CD1-CG 3.78Å; F210-Q214 HydrophobicContact CE1-CG 3.45Å; F210-Q214 VanDerWaalsContact CE1-CG 3.45Å; F210-Q214 HydrophobicContact CZ-CG 4.02Å; F210-Q214 WeakPolarHBondContact O-CG 3.35Å; F210-Q214 PolarHBondContact O-N 2.88Å |
| 211 | I | 94 | Very high | 92.8 | Very high | 12 Ų | 12 | 26.1 Ų | 26.1 | 6% | 0.062 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.7 | -42.2 | 176.9 | -73.8 | 169.1 | 0 | 0 | 0 | 111.5 | T152 L155 L156 I195 Y207 L208 A213 Q214 I215 | T152-I211 HydrophobicContact CG2-CD1 4.22Å; L155-I211 HydrophobicContact CD1-CG2 4.14Å; L156-I211 HydrophobicContact CD2-CD1 3.93Å; L156-I211 HydrophobicContact CD2-CG1 4.05Å; L156-I211 HydrophobicContact CG-CD1 4.14Å; I195-I211 HydrophobicContact CD1-CD1 3.41Å; I195-I211 VanDerWaalsContact CD1-CD1 3.41Å; Y207-I211 WeakPolarHBondContact O-CB 3.37Å; Y207-I211 VanDerWaalsContact O-CG1 3.3Å; Y207-I211 WeakPolarHBondContact O-CG1 3.34Å; Y207-I211 PolarHBondContact O-N 3.35Å; L208-I211 PolarHBondContact O-N 2.97Å; I211-A213 VanDerWaalsContact C-N 3.31Å; I211-A213 PolarHBondContact O-N 3.47Å; I211-Q214 PolarHBondContact O-N 3.29Å; I211-I215 HydrophobicContact CG2-CD1 3.81Å; I211-I215 HydrophobicContact CG2-CG1 4.44Å; I211-I215 WeakPolarHBondContact O-CG1 3.23Å; I211-I215 PolarHBondContact O-N 3.08Å |
| 212 | S | 94.2 | Very high | 93 | Very high | 1 Ų | 1 | 27.2 Ų | 27.2 | 1% | 0.007 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.3 | -37.1 | 175.3 | 50.6 | 0 | 0 | 0 | 0 | 112.3 | C74 L208 I209 F210 I215 S216 F415 | C74-S212 PolarHBondContact SG-OG 2.92Å; L208-S212 PolarHBondContact O-N 2.97Å; L208-S212 PolarHBondContact O-OG 2.89Å; I209-S212 WeakPolarHBondContact CA-OG 3.23Å; I209-S212 PolarHBondContact O-OG 3.34Å; F210-S212 PolarHBondContact O-N 3.5Å; S212-I215 PolarHBondContact O-N 2.83Å; S212-S216 WeakPolarHBondContact O-CB 3.37Å; S212-S216 PolarHBondContact O-N 2.92Å; S212-F415 WeakPolarHBondContact OG-CB 3.48Å |
| 213 | A | 96.1 | Very high | 93 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.9 | -42 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F77 V78 I209 F210 I211 S216 L217 | F77-A213 HydrophobicContact CD1-CB 3.49Å; F77-A213 VanDerWaalsContact CD1-CB 3.49Å; F77-A213 HydrophobicContact CE1-CB 3.7Å; V78-A213 HydrophobicContact CG2-CB 3.57Å; I209-A213 WeakPolarHBondContact O-CB 3.44Å; I209-A213 PolarHBondContact O-N 2.98Å; F210-A213 WeakPolarHBondContact O-CB 3.48Å; F210-A213 PolarHBondContact O-N 3.46Å; I211-A213 VanDerWaalsContact C-N 3.31Å; I211-A213 PolarHBondContact O-N 3.47Å; A213-S216 WeakPolarHBondContact O-CB 3.45Å; A213-S216 PolarHBondContact O-N 2.99Å; A213-L217 WeakPolarHBondContact O-CB 3.4Å; A213-L217 VanDerWaalsContact O-CG 3.3Å; A213-L217 WeakPolarHBondContact O-CG 3.48Å; A213-L217 PolarHBondContact O-N 3.09Å |
| 214 | Q | 95 | Very high | 92.8 | Very high | 2 Ų | 2 | 19.7 Ų | 19.7 | 1% | 0.009 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -64.6 | -40.9 | 176.5 | -68.9 | -53.9 | -32.2 | 0 | 0 | 112.7 | I159 F210 I211 S216 L217 M218 | I159-Q214 HydrophobicContact CG2-CB 4.11Å; F210-Q214 HydrophobicContact CD1-CG 3.78Å; F210-Q214 HydrophobicContact CE1-CG 3.45Å; F210-Q214 VanDerWaalsContact CE1-CG 3.45Å; F210-Q214 HydrophobicContact CZ-CG 4.02Å; F210-Q214 WeakPolarHBondContact O-CG 3.35Å; F210-Q214 PolarHBondContact O-N 2.88Å; I211-Q214 PolarHBondContact O-N 3.29Å; Q214-S216 VanDerWaalsContact C-N 3.33Å; Q214-L217 PolarHBondContact O-N 3.07Å; Q214-M218 VanDerWaalsContact O-CB 3.22Å; Q214-M218 WeakPolarHBondContact O-CB 3.17Å; Q214-M218 PolarHBondContact O-N 2.67Å |
| 215 | I | 94.2 | Very high | 92.7 | Very high | 31 Ų | 31 | 23.2 Ų | 23.2 | 16% | 0.159 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -65.8 | -39.4 | 176.1 | -63.1 | 164.2 | 0 | 0 | 0 | 110.4 | L155 I211 S212 M218 F219 L412 V416 | L155-I215 HydrophobicContact CD1-CD1 4.17Å; L155-I215 HydrophobicContact CD1-CG1 4.33Å; L155-I215 HydrophobicContact CD2-CG1 4.29Å; I211-I215 HydrophobicContact CG2-CD1 3.81Å; I211-I215 HydrophobicContact CG2-CG1 4.44Å; I211-I215 WeakPolarHBondContact O-CG1 3.23Å; I211-I215 PolarHBondContact O-N 3.08Å; S212-I215 PolarHBondContact O-N 2.83Å; I215-M218 HydrophobicContact CG2-CE 4.3Å; I215-M218 PolarHBondContact O-N 3.39Å; I215-F219 HydrophobicContact CG2-CD2 4.07Å; I215-F219 HydrophobicContact CG2-CE2 3.67Å; I215-F219 HydrophobicContact CG2-CZ 4.27Å; I215-F219 WeakPolarHBondContact O-CD2 3.23Å; I215-F219 PolarHBondContact O-N 2.88Å; I215-L412 HydrophobicContact CD1-CD2 4.11Å; I215-V416 HydrophobicContact CB-CG1 4.27Å; I215-V416 HydrophobicContact CB-CG2 4.04Å; I215-V416 HydrophobicContact CD1-CG2 4.44Å; I215-V416 HydrophobicContact CG2-CG1 3.69Å; I215-V416 HydrophobicContact CG2-CG2 4.07Å |
| 216 | S | 95.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -59.9 | -52.8 | 172.4 | 170.5 | 0 | 0 | 0 | 0 | 111.9 | S212 A213 Q214 M218 F219 L220 S419 L420 | S212-S216 WeakPolarHBondContact O-CB 3.37Å; S212-S216 PolarHBondContact O-N 2.92Å; A213-S216 WeakPolarHBondContact O-CB 3.45Å; A213-S216 PolarHBondContact O-N 2.99Å; Q214-S216 VanDerWaalsContact C-N 3.33Å; S216-M218 VanDerWaalsContact C-N 3.3Å; S216-M218 PolarHBondContact O-N 2.95Å; S216-F219 PolarHBondContact O-N 3.43Å; S216-L220 WeakPolarHBondContact O-CB 3.24Å; S216-L220 PolarHBondContact O-N 2.82Å; S216-S419 WeakPolarHBondContact OG-CB 3.3Å; S216-S419 PolarHBondContact OG-O 3.22Å; S216-L420 VanDerWaalsContact OG-CA 3.28Å; S216-L420 WeakPolarHBondContact OG-CA 3.29Å; S216-L420 PolarHBondContact OG-N 3.17Å |
| 217 | L | 94.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -62.4 | -34.8 | 178.7 | -73.4 | 166.5 | 0 | 0 | 0 | 112.6 | F77 V78 V81 Y88 F163 A213 Q214 L220 K221 | F77-L217 HydrophobicContact CE1-CD1 4.36Å; V78-L217 HydrophobicContact CG1-CD2 4.06Å; V78-L217 HydrophobicContact CG1-CG 4.35Å; V78-L217 HydrophobicContact CG2-CG 4.24Å; V81-L217 HydrophobicContact CB-CD1 4.23Å; V81-L217 HydrophobicContact CB-CD2 4.18Å; V81-L217 HydrophobicContact CG1-CD1 3.82Å; V81-L217 HydrophobicContact CG1-CD2 3.75Å; V81-L217 HydrophobicContact CG1-CG 4.47Å; V81-L217 HydrophobicContact CG2-CD1 4.48Å; Y88-L217 HydrophobicContact CD1-CB 4.15Å; Y88-L217 HydrophobicContact CD1-CD2 4.07Å; Y88-L217 HydrophobicContact CD2-CD2 4.32Å; Y88-L217 HydrophobicContact CE1-CB 3.69Å; Y88-L217 HydrophobicContact CE1-CD2 4.2Å; Y88-L217 HydrophobicContact CE1-CG 4.43Å; Y88-L217 HydrophobicContact CE2-CD2 4.42Å; Y88-L217 HydrophobicContact CG-CD2 4.15Å; F163-L217 HydrophobicContact CD2-CD1 4.28Å; F163-L217 HydrophobicContact CE2-CD1 4.24Å; A213-L217 WeakPolarHBondContact O-CB 3.4Å; A213-L217 VanDerWaalsContact O-CG 3.3Å; A213-L217 WeakPolarHBondContact O-CG 3.48Å; A213-L217 PolarHBondContact O-N 3.09Å; Q214-L217 PolarHBondContact O-N 3.07Å; L217-L220 HydrophobicContact CD2-CD2 4.34Å; L217-L220 WeakPolarHBondContact O-CB 3.43Å; L217-L220 PolarHBondContact O-N 3.36Å; L217-K221 PolarHBondContact O-N 3.48Å |
| 218 | M | 92.4 | Very high | 92.5 | Very high | 47 Ų | 47 | 24.8 Ų | 24.8 | 23% | 0.232 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -62.4 | -48.9 | 172.7 | -179.3 | -170.5 | 73.9 | 0 | 0 | 111.4 | Q214 I215 S216 L220 K221 Y222 | Q214-M218 VanDerWaalsContact O-CB 3.22Å; Q214-M218 WeakPolarHBondContact O-CB 3.17Å; Q214-M218 PolarHBondContact O-N 2.67Å; I215-M218 HydrophobicContact CG2-CE 4.3Å; I215-M218 PolarHBondContact O-N 3.39Å; S216-M218 VanDerWaalsContact C-N 3.3Å; S216-M218 PolarHBondContact O-N 2.95Å; M218-L220 VanDerWaalsContact C-N 3.3Å; M218-L220 PolarHBondContact O-N 3.01Å; M218-K221 PolarHBondContact O-N 3.48Å; M218-Y222 HydrophobicContact CG-CD2 3.74Å; M218-Y222 HydrophobicContact CG-CE2 3.89Å; M218-Y222 WeakPolarHBondContact O-CD2 3.21Å; M218-Y222 PolarHBondContact O-N 3.35Å; M218-Y222 VanDerWaalsContact O-N 3.17Å |
| 219 | F | 92.5 | Very high | 92.6 | Very high | 32 Ų | 32 | 25.4 Ų | 25.4 | 14% | 0.14 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.9 | -34.9 | 174.9 | -70.5 | -39.1 | 0 | 0 | 0 | 112.3 | F121 I215 S216 L223 V416 L420 | F121-F219 HydrophobicContact CE2-CE1 4.03Å; F121-F219 HydrophobicContact CZ-CD1 4.38Å; F121-F219 AromaticContact CZ-CE1 3.74Å; F121-F219 HydrophobicContact CZ-CE1 3.74Å; F121-F219 HydrophobicContact CZ-CZ 4.09Å; I215-F219 HydrophobicContact CG2-CD2 4.07Å; I215-F219 HydrophobicContact CG2-CE2 3.67Å; I215-F219 HydrophobicContact CG2-CZ 4.27Å; I215-F219 WeakPolarHBondContact O-CD2 3.23Å; I215-F219 PolarHBondContact O-N 2.88Å; S216-F219 PolarHBondContact O-N 3.43Å; F219-L223 HydrophobicContact CB-CD1 4.05Å; F219-L223 HydrophobicContact CD1-CD1 4.44Å; F219-L223 HydrophobicContact CG-CD1 4.47Å; F219-L223 VanDerWaalsContact O-CB 3.31Å; F219-L223 WeakPolarHBondContact O-CB 3.14Å; F219-L223 WeakPolarHBondContact O-CG 3.49Å; F219-L223 PolarHBondContact O-N 3.45Å; F219-L223 VanDerWaalsContact O-N 3.15Å; F219-V416 HydrophobicContact CD2-CG1 4.19Å; F219-V416 HydrophobicContact CE2-CG1 4.19Å; F219-L420 HydrophobicContact CB-CD1 3.81Å; F219-L420 HydrophobicContact CB-CD2 3.75Å; F219-L420 HydrophobicContact CB-CG 4.43Å; F219-L420 HydrophobicContact CD2-CD2 4.08Å; F219-L420 HydrophobicContact CG-CD2 4.3Å |
| 220 | L | 93 | Very high | 92.6 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -63.1 | -40.9 | 176.9 | -166.7 | 64.2 | 0 | 0 | 0 | 112.3 | A82 S216 L217 M218 L420 R424 L427 | A82-L220 HydrophobicContact CB-CD2 4.06Å; S216-L220 WeakPolarHBondContact O-CB 3.24Å; S216-L220 PolarHBondContact O-N 2.82Å; L217-L220 HydrophobicContact CD2-CD2 4.34Å; L217-L220 WeakPolarHBondContact O-CB 3.43Å; L217-L220 PolarHBondContact O-N 3.36Å; M218-L220 VanDerWaalsContact C-N 3.3Å; M218-L220 PolarHBondContact O-N 3.01Å; L220-L420 HydrophobicContact CB-CD1 4.08Å; L220-L420 HydrophobicContact CD1-CD1 4.25Å; L220-R424 HydrophobicContact CD1-CB 4.11Å; L220-L427 HydrophobicContact CD1-CD1 3.74Å; L220-L427 HydrophobicContact CD2-CD1 3.7Å; L220-L427 HydrophobicContact CD2-CG 4.33Å; L220-L427 HydrophobicContact CG-CD1 3.56Å |
| 221 | K | 92 | Very high | 92.6 | Very high | 7 Ų | 7 | 26.4 Ų | 26.4 | 3% | 0.03 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -69.2 | -44.4 | 177.3 | -176.6 | 68.5 | 175 | 106.1 | 0 | 113.2 | F87 Y88 H90 T91 D92 L217 M218 | F87-K221 HydrophobicContact CD1-CD 3.78Å; F87-K221 HydrophobicContact CE1-CD 3.57Å; F87-K221 HydrophobicContact CE1-CG 3.99Å; F87-K221 HydrophobicContact CG-CD 4.43Å; F87-K221 HydrophobicContact CZ-CD 4.06Å; F87-K221 HydrophobicContact CZ-CG 4.46Å; F87-K221 WeakPolarHBondContact O-CD 3.49Å; F87-K221 WeakPolarHBondContact O-CE 3.42Å; F87-K221 PolarHBondContact O-NZ 3.41Å; Y88-K221 HydrophobicContact CD1-CB 4.1Å; H90-K221 PolarHBondContact O-NZ 3.5Å; T91-K221 WeakPolarHBondContact CG2-O 3.48Å; T91-K221 PolarHBondContact OG1-O 3.43Å; D92-K221 IonicContact OD2-NZ 2.7Å; D92-K221 PolarHBondContact OD2-NZ 2.95Å; L217-K221 PolarHBondContact O-N 3.48Å; M218-K221 PolarHBondContact O-N 3.48Å |
| 222 | Y | 89.8 | Confident | 92.5 | Very high | 68 Ų | 68 | 26 Ų | 26 | 27% | 0.267 | 12% | 0.116 | S | C | . | . | H | α-helix | trans | -100.3 | -6.9 | -164.3 | -64.6 | -59 | 0 | 0 | 0 | 115.7 | Q93 L95 M218 | Q93-Y222 HydrophobicContact CB-CE1 4.29Å; Q93-Y222 WeakPolarHBondContact O-CD1 3.31Å; L95-Y222 PolarHBondContact N-O 3.35Å; M218-Y222 HydrophobicContact CG-CD2 3.74Å; M218-Y222 HydrophobicContact CG-CE2 3.89Å; M218-Y222 WeakPolarHBondContact O-CD2 3.21Å; M218-Y222 PolarHBondContact O-N 3.35Å; M218-Y222 VanDerWaalsContact O-N 3.17Å |
| 223 | L | 88.6 | Confident | 92.5 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 13% | 0.13 | C | C | . | . | S | Bend | trans | -100.5 | 130.4 | 176.5 | -64.3 | 178.8 | 0 | 0 | 0 | 111.7 | L95 T98 F121 F219 T227 C228 V231 | L95-L223 HydrophobicContact CD1-CD2 4.4Å; T98-L223 HydrophobicContact CG2-CD2 4.12Å; F121-L223 HydrophobicContact CD2-CD2 4.49Å; F219-L223 HydrophobicContact CB-CD1 4.05Å; F219-L223 HydrophobicContact CD1-CD1 4.44Å; F219-L223 HydrophobicContact CG-CD1 4.47Å; F219-L223 VanDerWaalsContact O-CB 3.31Å; F219-L223 WeakPolarHBondContact O-CB 3.14Å; F219-L223 WeakPolarHBondContact O-CG 3.49Å; F219-L223 PolarHBondContact O-N 3.45Å; F219-L223 VanDerWaalsContact O-N 3.15Å; L223-T227 HydrophobicContact CD2-CG2 4.49Å; L223-C228 HydrophobicContact CB-CB 4.03Å; L223-C228 HydrophobicContact CD1-CB 4.41Å; L223-V231 HydrophobicContact CD1-CB 4.5Å; L223-V231 HydrophobicContact CD1-CG1 4.31Å |
| 224 | P | 88 | Confident | 92.4 | Very high | 21 Ų | 21 | 29 Ų | 29 | 14% | 0.136 | 14% | 0.141 | C | C | . | . | trans | -56 | 149.4 | 171.3 | -16.6 | 22.4 | 0 | 0 | 0 | 112.5 | Y94 W226 T227 C228 | Y94-P224 HydrophobicContact CD1-CG 3.75Å; Y94-P224 HydrophobicContact CE1-CB 4.19Å; Y94-P224 HydrophobicContact CE1-CG 3.76Å; P224-W226 PolarHBondContact O-N 3.36Å; P224-T227 CarbonylContact O-C 3.56Å; P224-T227 WeakPolarHBondContact O-CA 3.46Å; P224-T227 WeakPolarHBondContact O-CB 3.18Å; P224-T227 PolarHBondContact O-N 3.41Å; P224-C228 PolarHBondContact O-N 2.86Å | ||
| 225 | K | 88.7 | Confident | 92.2 | Very high | 110 Ų | 110 | 29.6 Ų | 29.6 | 48% | 0.478 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -40.3 | -65.6 | -175.7 | -61.6 | -150.5 | 165.2 | -150.1 | 0 | 113.6 | T227 C228 W229 D428 | K225-T227 PolarHBondContact O-N 3.06Å; K225-C228 PolarHBondContact O-N 3Å; K225-W229 VanDerWaalsContact O-CD1 3.23Å; K225-D428 WeakPolarHBondContact CD-OD1 3.46Å; K225-D428 WeakPolarHBondContact CE-OD1 3.25Å; K225-D428 IonicContact NZ-OD1 3.76Å; K225-D428 PolarHBondContact NZ-OD1 3.45Å |
| 226 | W | 90 | Very high | 92 | Very high | 133 Ų | 133 | 28.3 Ų | 28.3 | 50% | 0.504 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -67.2 | -31.4 | 179.8 | -71.3 | 113 | 0 | 0 | 0 | 114 | T114 P224 C228 W229 L230 F474 | T114-W226 HydrophobicContact CG2-CB 3.81Å; P224-W226 PolarHBondContact O-N 3.36Å; W226-C228 VanDerWaalsContact C-N 3.33Å; W226-C228 PolarHBondContact O-N 3.17Å; W226-W229 PolarHBondContact O-N 3.49Å; W226-L230 PolarHBondContact O-N 2.66Å; W226-F474 HydrophobicContact CZ3-CE1 4.43Å; W226-F474 HydrophobicContact CZ3-CZ 4.25Å |
| 227 | T | 92.2 | Very high | 91.8 | Very high | 1 Ų | 1 | 32.4 Ų | 32.4 | 1% | 0.006 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -65.9 | -37.4 | 177.1 | -56.2 | 0 | 0 | 0 | 0 | 110.9 | T98 N117 L223 P224 K225 L230 V231 | T98-T227 HydrophobicContact CG2-CG2 4.21Å; N117-T227 HydrophobicContact CB-CG2 3.92Å; L223-T227 HydrophobicContact CD2-CG2 4.49Å; P224-T227 CarbonylContact O-C 3.56Å; P224-T227 WeakPolarHBondContact O-CA 3.46Å; P224-T227 WeakPolarHBondContact O-CB 3.18Å; P224-T227 PolarHBondContact O-N 3.41Å; K225-T227 PolarHBondContact O-N 3.06Å; T227-L230 PolarHBondContact O-N 2.94Å; T227-V231 HydrophobicContact CG2-CG2 4.13Å; T227-V231 VanDerWaalsContact O-CB 3.23Å; T227-V231 WeakPolarHBondContact O-CB 3.45Å; T227-V231 WeakPolarHBondContact O-CG2 3.24Å; T227-V231 PolarHBondContact O-N 3.42Å |
| 228 | C | 92.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.6 | -47.5 | 175.2 | -172.6 | 0 | 0 | 0 | 0 | 112 | L223 P224 K225 W226 L230 V231 L232 | L223-C228 HydrophobicContact CB-CB 4.03Å; L223-C228 HydrophobicContact CD1-CB 4.41Å; P224-C228 PolarHBondContact O-N 2.86Å; K225-C228 PolarHBondContact O-N 3Å; W226-C228 VanDerWaalsContact C-N 3.33Å; W226-C228 PolarHBondContact O-N 3.17Å; C228-L230 PolarHBondContact O-N 2.94Å; C228-V231 PolarHBondContact O-N 2.96Å; C228-L232 WeakPolarHBondContact O-CG 3.47Å; C228-L232 PolarHBondContact O-N 3.2Å |
| 229 | W | 93.6 | Very high | 91.3 | Very high | 18 Ų | 18 | 34.3 Ų | 34.3 | 7% | 0.068 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.4 | -43.8 | 176 | -70.9 | 107.8 | 0 | 0 | 0 | 112.2 | K225 W226 L232 A233 L421 R424 D428 I470 Y473 F474 | K225-W229 VanDerWaalsContact O-CD1 3.23Å; W226-W229 PolarHBondContact O-N 3.49Å; W229-L232 PolarHBondContact O-N 3.02Å; W229-A233 PolarHBondContact O-N 3.07Å; W229-L421 HydrophobicContact CE3-CD1 4.25Å; W229-L421 HydrophobicContact CH2-CD1 3.93Å; W229-L421 HydrophobicContact CZ3-CD1 3.39Å; W229-R424 HydrophobicContact CD2-CG 4.2Å; W229-R424 VanDerWaalsContact CE2-CG 3.46Å; W229-R424 HydrophobicContact CH2-CG 4.4Å; W229-R424 HydrophobicContact CZ2-CB 4.16Å; W229-R424 HydrophobicContact CZ2-CG 3.57Å; W229-D428 PolarHBondContact NE1-OD2 3.46Å; W229-I470 HydrophobicContact CE3-CG1 4.21Å; W229-I470 HydrophobicContact CE3-CG2 4.4Å; W229-I470 HydrophobicContact CZ3-CG1 4.09Å; W229-Y473 AromaticContact CH2-CD1 3.22Å; W229-Y473 HydrophobicContact CH2-CD1 3.22Å; W229-Y473 AromaticContact CH2-CD2 3.95Å; W229-Y473 HydrophobicContact CH2-CD2 3.95Å; W229-Y473 AromaticContact CH2-CE1 3.54Å; W229-Y473 HydrophobicContact CH2-CE1 3.54Å; W229-Y473 HydrophobicContact CH2-CE2 4.2Å; W229-Y473 AromaticContact CH2-CG 3.45Å; W229-Y473 HydrophobicContact CH2-CG 3.45Å; W229-Y473 VanDerWaalsContact CH2-CG 3.45Å; W229-Y473 AromaticContact CZ2-CD1 3.59Å; W229-Y473 HydrophobicContact CZ2-CD1 3.59Å; W229-Y473 HydrophobicContact CZ2-CD2 4.37Å; W229-Y473 AromaticContact CZ2-CE1 3.35Å; W229-Y473 HydrophobicContact CZ2-CE1 3.35Å; W229-Y473 HydrophobicContact CZ2-CE2 4.15Å; W229-Y473 HydrophobicContact CZ2-CG 4.11Å; W229-Y473 AromaticContact CZ2-CZ 3.67Å; W229-Y473 AromaticContact CZ3-CD1 3.78Å; W229-Y473 HydrophobicContact CZ3-CD1 3.78Å; W229-Y473 HydrophobicContact CZ3-CE1 4.36Å; W229-Y473 HydrophobicContact CZ3-CG 4.14Å; W229-F474 HydrophobicContact CD2-CE2 4.41Å; W229-F474 HydrophobicContact CD2-CZ 4.27Å; W229-F474 HydrophobicContact CE3-CE2 4.12Å; W229-F474 HydrophobicContact CE3-CZ 4.44Å; W229-F474 HydrophobicContact CG-CZ 4.46Å |
| 230 | L | 94.1 | Very high | 91 | Very high | 70 Ų | 70 | 35.8 Ų | 35.8 | 37% | 0.366 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -71.3 | -34.3 | 178.7 | -154.6 | 77 | 0 | 0 | 0 | 112.6 | T114 I115 T118 W226 T227 C228 A233 A234 | T114-L230 HydrophobicContact CG2-CB 4.21Å; T114-L230 HydrophobicContact CG2-CD2 4.09Å; I115-L230 HydrophobicContact CG1-CD2 3.94Å; T118-L230 HydrophobicContact CG2-CB 4.33Å; T118-L230 HydrophobicContact CG2-CD2 4.07Å; T118-L230 HydrophobicContact CG2-CG 4.17Å; W226-L230 PolarHBondContact O-N 2.66Å; T227-L230 PolarHBondContact O-N 2.94Å; C228-L230 PolarHBondContact O-N 2.94Å; L230-A233 PolarHBondContact O-N 3.21Å; L230-A234 VanDerWaalsContact O-CB 3.24Å; L230-A234 WeakPolarHBondContact O-CB 3.38Å; L230-A234 PolarHBondContact O-N 3.17Å |
| 231 | V | 93.6 | Very high | 90.7 | Very high | 2 Ų | 2 | 38.8 Ų | 38.8 | 1% | 0.012 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66.5 | -41.5 | 173.8 | 164.6 | 0 | 0 | 0 | 0 | 111.4 | T118 F121 L223 T227 C228 A233 A234 L235 | T118-V231 HydrophobicContact CG2-CG2 3.88Å; F121-V231 HydrophobicContact CD1-CG1 3.89Å; F121-V231 HydrophobicContact CD1-CG2 3.9Å; F121-V231 HydrophobicContact CE1-CG1 3.62Å; F121-V231 HydrophobicContact CE1-CG2 4.44Å; F121-V231 HydrophobicContact CG-CG2 4.38Å; F121-V231 HydrophobicContact CZ-CG1 4.46Å; L223-V231 HydrophobicContact CD1-CB 4.5Å; L223-V231 HydrophobicContact CD1-CG1 4.31Å; T227-V231 HydrophobicContact CG2-CG2 4.13Å; T227-V231 VanDerWaalsContact O-CB 3.23Å; T227-V231 WeakPolarHBondContact O-CB 3.45Å; T227-V231 WeakPolarHBondContact O-CG2 3.24Å; T227-V231 PolarHBondContact O-N 3.42Å; C228-V231 PolarHBondContact O-N 2.96Å; V231-A233 VanDerWaalsContact C-N 3.33Å; V231-A233 PolarHBondContact O-N 2.9Å; V231-A234 PolarHBondContact O-N 3.37Å; V231-L235 HydrophobicContact CG1-CD1 3.56Å; V231-L235 HydrophobicContact CG1-CG 4.1Å; V231-L235 VanDerWaalsContact O-CB 3.31Å; V231-L235 WeakPolarHBondContact O-CB 3.32Å; V231-L235 VanDerWaalsContact O-CG 3.3Å; V231-L235 WeakPolarHBondContact O-CG 3.49Å; V231-L235 PolarHBondContact O-N 3.14Å |
| 232 | L | 93.5 | Very high | 90.4 | Very high | 3 Ų | 3 | 38.5 Ų | 38.5 | 2% | 0.016 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -59.6 | -42.8 | 174.9 | -78.6 | 165 | 0 | 0 | 0 | 111.9 | C228 W229 S236 F417 L420 L421 I470 | C228-L232 WeakPolarHBondContact O-CG 3.47Å; C228-L232 PolarHBondContact O-N 3.2Å; W229-L232 PolarHBondContact O-N 3.02Å; L232-S236 WeakPolarHBondContact O-CB 3.29Å; L232-S236 PolarHBondContact O-N 3.39Å; L232-S236 PolarHBondContact O-OG 3.15Å; L232-F417 HydrophobicContact CD2-CB 4.39Å; L232-L420 HydrophobicContact CD1-CG 4.35Å; L232-L420 HydrophobicContact CD2-CB 4.27Å; L232-L420 HydrophobicContact CD2-CD2 3.92Å; L232-L420 HydrophobicContact CD2-CG 4.09Å; L232-L420 HydrophobicContact CG-CD2 4.23Å; L232-L420 HydrophobicContact CG-CG 4.4Å; L232-L421 HydrophobicContact CD1-CB 4.1Å; L232-L421 HydrophobicContact CD1-CD1 4.13Å; L232-L421 HydrophobicContact CD2-CB 4.4Å; L232-I470 HydrophobicContact CB-CD1 4.25Å |
| 233 | A | 93 | Very high | 90 | Very high | 38 Ų | 38 | 36.9 Ų | 36.9 | 31% | 0.314 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -69.8 | -40.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | W229 L230 V231 S236 V237 I470 | W229-A233 PolarHBondContact O-N 3.07Å; L230-A233 PolarHBondContact O-N 3.21Å; V231-A233 VanDerWaalsContact C-N 3.33Å; V231-A233 PolarHBondContact O-N 2.9Å; A233-S236 PolarHBondContact O-N 3.43Å; A233-S236 PolarHBondContact O-OG 3.09Å; A233-V237 WeakPolarHBondContact O-CG2 3.46Å; A233-V237 PolarHBondContact O-N 2.91Å; A233-V237 VanDerWaalsContact O-N 3.12Å; A233-I470 HydrophobicContact CB-CD1 4.48Å |
| 234 | A | 93.5 | Very high | 89.8 | Confident | 27 Ų | 27 | 40.9 Ų | 40.9 | 22% | 0.223 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -69.3 | -39 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | T118 M122 L230 V231 W238 | T118-A234 HydrophobicContact CG2-CB 3.89Å; M122-A234 HydrophobicContact CE-CB 4.11Å; M122-A234 WeakPolarHBondContact CE-O 3.32Å; M122-A234 HydrophobicContact CG-CB 3.82Å; M122-A234 HydrophobicContact SD-CB 3.72Å; L230-A234 VanDerWaalsContact O-CB 3.24Å; L230-A234 WeakPolarHBondContact O-CB 3.38Å; L230-A234 PolarHBondContact O-N 3.17Å; V231-A234 PolarHBondContact O-N 3.37Å; A234-W238 VanDerWaalsContact O-CB 3.31Å; A234-W238 WeakPolarHBondContact O-CB 3.25Å; A234-W238 PolarHBondContact O-N 2.9Å |
| 235 | L | 91.1 | Very high | 89.6 | Confident | 13 Ų | 13 | 42.6 Ų | 42.6 | 7% | 0.068 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -68.2 | -35.3 | 174.8 | -72.3 | 172.4 | 0 | 0 | 0 | 112 | F121 M122 V125 V231 W238 D239 F417 | F121-L235 HydrophobicContact CE1-CD1 4.32Å; M122-L235 HydrophobicContact CE-CD2 3.96Å; M122-L235 HydrophobicContact CE-CG 4.45Å; M122-L235 HydrophobicContact SD-CD2 3.52Å; M122-L235 VanDerWaalsContact SD-CD2 3.52Å; M122-L235 HydrophobicContact SD-CG 3.72Å; V125-L235 HydrophobicContact CG1-CD2 4.04Å; V231-L235 HydrophobicContact CG1-CD1 3.56Å; V231-L235 HydrophobicContact CG1-CG 4.1Å; V231-L235 VanDerWaalsContact O-CB 3.31Å; V231-L235 WeakPolarHBondContact O-CB 3.32Å; V231-L235 VanDerWaalsContact O-CG 3.3Å; V231-L235 WeakPolarHBondContact O-CG 3.49Å; V231-L235 PolarHBondContact O-N 3.14Å; L235-W238 PolarHBondContact O-N 2.88Å; L235-D239 PolarHBondContact O-N 2.91Å; L235-F417 HydrophobicContact CD1-CD1 4.26Å; L235-F417 HydrophobicContact CD1-CE1 3.53Å; L235-F417 HydrophobicContact CD1-CZ 4.08Å |
| 236 | S | 90.7 | Very high | 89.2 | Confident | 4 Ų | 4 | 41.7 Ų | 41.7 | 3% | 0.028 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -71 | -36.8 | 178.7 | 77.3 | 0 | 0 | 0 | 0 | 112.9 | L232 A233 I240 L462 | L232-S236 WeakPolarHBondContact O-CB 3.29Å; L232-S236 PolarHBondContact O-N 3.39Å; L232-S236 PolarHBondContact O-OG 3.15Å; A233-S236 PolarHBondContact O-N 3.43Å; A233-S236 PolarHBondContact O-OG 3.09Å; S236-I240 PolarHBondContact O-N 2.84Å; S236-L462 VanDerWaalsContact CA-CD2 3.47Å |
| 237 | V | 90.5 | Very high | 88.7 | Confident | 87 Ų | 87 | 42.5 Ų | 42.5 | 53% | 0.527 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -67.7 | -39.2 | 168.7 | 174.2 | 0 | 0 | 0 | 0 | 111.4 | A233 D239 I240 V241 | A233-V237 WeakPolarHBondContact O-CG2 3.46Å; A233-V237 PolarHBondContact O-N 2.91Å; A233-V237 VanDerWaalsContact O-N 3.12Å; V237-D239 PolarHBondContact O-N 3.48Å; V237-I240 WeakPolarHBondContact O-CB 3.38Å; V237-I240 PolarHBondContact O-N 3.26Å; V237-V241 WeakPolarHBondContact O-CG2 3.38Å; V237-V241 PolarHBondContact O-N 3.35Å; V237-V241 VanDerWaalsContact O-N 3.1Å |
| 238 | W | 90 | Very high | 88.3 | Confident | 57 Ų | 57 | 42.6 Ų | 42.6 | 22% | 0.216 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.6 | -37.5 | 176.5 | 171.5 | -105.9 | 0 | 0 | 0 | 112.9 | M122 V126 A234 L235 V241 A242 P249 | M122-W238 HydrophobicContact CE-CB 3.53Å; M122-W238 HydrophobicContact CE-CG 3.97Å; V126-W238 HydrophobicContact CB-CH2 4.35Å; V126-W238 HydrophobicContact CB-CZ2 4.36Å; V126-W238 HydrophobicContact CG1-CH2 3.85Å; V126-W238 HydrophobicContact CG1-CZ2 4.23Å; V126-W238 HydrophobicContact CG1-CZ3 4.41Å; V126-W238 HydrophobicContact CG2-CD2 3.99Å; V126-W238 HydrophobicContact CG2-CE3 3.95Å; V126-W238 HydrophobicContact CG2-CH2 3.75Å; V126-W238 HydrophobicContact CG2-CZ2 3.77Å; V126-W238 HydrophobicContact CG2-CZ3 3.83Å; A234-W238 VanDerWaalsContact O-CB 3.31Å; A234-W238 WeakPolarHBondContact O-CB 3.25Å; A234-W238 PolarHBondContact O-N 2.9Å; L235-W238 PolarHBondContact O-N 2.88Å; W238-V241 HydrophobicContact CE3-CG1 4.47Å; W238-V241 HydrophobicContact CZ3-CG1 4.39Å; W238-V241 PolarHBondContact O-N 3.23Å; W238-V241 VanDerWaalsContact O-N 3.16Å; W238-A242 HydrophobicContact CD2-CB 4.43Å; W238-A242 HydrophobicContact CZ2-CB 4.08Å; W238-A242 VanDerWaalsContact O-CB 3.28Å; W238-A242 WeakPolarHBondContact O-CB 3.41Å; W238-A242 PolarHBondContact O-N 3.41Å; W238-P249 HydrophobicContact CH2-CG 4.04Å; W238-P249 HydrophobicContact CZ2-CG 3.79Å |
| 239 | D | 86.5 | Confident | 87.8 | Confident | 29 Ų | 29 | 43.5 Ų | 43.5 | 16% | 0.155 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64 | -39.6 | 176.2 | -167.7 | 52.1 | 0 | 0 | 0 | 111.9 | L235 V237 V241 V243 P460 L462 | L235-D239 PolarHBondContact O-N 2.91Å; V237-D239 PolarHBondContact O-N 3.48Å; D239-V241 PolarHBondContact O-N 2.95Å; D239-V243 WeakPolarHBondContact O-CB 3.34Å; D239-V243 VanDerWaalsContact O-CG2 3.28Å; D239-V243 WeakPolarHBondContact O-CG2 3.4Å; D239-V243 PolarHBondContact O-N 2.88Å; D239-V243 VanDerWaalsContact O-N 3.14Å; D239-P460 WeakPolarHBondContact OD2-CB 3.14Å; D239-L462 HydrophobicContact CB-CD1 4.03Å |
| 240 | I | 85.7 | Confident | 87 | Confident | 63 Ų | 63 | 45.7 Ų | 45.7 | 32% | 0.323 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -54.5 | -53.8 | 168 | -61.2 | 171.3 | 0 | 0 | 0 | 110.4 | S236 V237 A242 V243 L244 P460 P463 | S236-I240 PolarHBondContact O-N 2.84Å; V237-I240 WeakPolarHBondContact O-CB 3.38Å; V237-I240 PolarHBondContact O-N 3.26Å; I240-A242 PolarHBondContact O-N 2.94Å; I240-V243 PolarHBondContact O-N 3.37Å; I240-L244 HydrophobicContact CG2-CD1 4.2Å; I240-L244 HydrophobicContact CG2-CD2 4.03Å; I240-L244 WeakPolarHBondContact O-CB 3.47Å; I240-L244 WeakPolarHBondContact O-CD1 3.42Å; I240-L244 PolarHBondContact O-N 3.44Å; I240-P460 HydrophobicContact CG1-CG 4.29Å; I240-P463 HydrophobicContact CD1-CB 3.66Å; I240-P463 HydrophobicContact CD1-CG 4.01Å; I240-P463 HydrophobicContact CG1-CB 3.73Å; I240-P463 HydrophobicContact CG1-CG 3.61Å |
| 241 | V | 88.1 | Confident | 86.3 | Confident | 64 Ų | 64 | 46.8 Ų | 46.8 | 39% | 0.388 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -64.5 | -42.6 | -175.1 | 173.4 | 0 | 0 | 0 | 0 | 111.7 | V237 W238 D239 V243 C245 | V237-V241 WeakPolarHBondContact O-CG2 3.38Å; V237-V241 PolarHBondContact O-N 3.35Å; V237-V241 VanDerWaalsContact O-N 3.1Å; W238-V241 HydrophobicContact CE3-CG1 4.47Å; W238-V241 HydrophobicContact CZ3-CG1 4.39Å; W238-V241 PolarHBondContact O-N 3.23Å; W238-V241 VanDerWaalsContact O-N 3.16Å; D239-V241 PolarHBondContact O-N 2.95Å; V241-V243 VanDerWaalsContact C-N 3.29Å; V241-V243 PolarHBondContact O-N 3.3Å; V241-C245 VanDerWaalsContact O-CB 3.22Å; V241-C245 WeakPolarHBondContact O-CB 3.18Å; V241-C245 PolarHBondContact O-N 2.99Å; V241-C245 PolarHBondContact O-SG 2.88Å; V241-C245 VanDerWaalsContact O-SG 3.37Å |
| 242 | A | 85.9 | Confident | 85.8 | Confident | 1 Ų | 1 | 49.6 Ų | 49.6 | 1% | 0.008 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -73.2 | -18.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | W238 I240 G248 P249 L250 R251 | W238-A242 HydrophobicContact CD2-CB 4.43Å; W238-A242 HydrophobicContact CZ2-CB 4.08Å; W238-A242 VanDerWaalsContact O-CB 3.28Å; W238-A242 WeakPolarHBondContact O-CB 3.41Å; W238-A242 PolarHBondContact O-N 3.41Å; I240-A242 PolarHBondContact O-N 2.94Å; A242-G248 CarbonylContact O-C 3.59Å; A242-G248 WeakPolarHBondContact O-CA 3.44Å; A242-P249 HydrophobicContact CB-CG 4.46Å; A242-L250 HydrophobicContact CB-CB 4.02Å; A242-R251 PolarHBondContact O-N 2.9Å; A242-R251 VanDerWaalsContact O-N 3.15Å |
| 243 | V | 81.4 | Confident | 85.2 | Confident | 33 Ų | 33 | 50.8 Ų | 50.8 | 20% | 0.2 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -99.9 | -46 | 176.2 | 176.6 | 0 | 0 | 0 | 0 | 112.4 | D239 I240 V241 L250 P460 | D239-V243 WeakPolarHBondContact O-CB 3.34Å; D239-V243 VanDerWaalsContact O-CG2 3.28Å; D239-V243 WeakPolarHBondContact O-CG2 3.4Å; D239-V243 PolarHBondContact O-N 2.88Å; D239-V243 VanDerWaalsContact O-N 3.14Å; I240-V243 PolarHBondContact O-N 3.37Å; V241-V243 VanDerWaalsContact C-N 3.29Å; V241-V243 PolarHBondContact O-N 3.3Å; V243-L250 HydrophobicContact CG2-CD2 4.2Å; V243-P460 HydrophobicContact CB-CG 4.25Å; V243-P460 HydrophobicContact CG1-CG 4.44Å; V243-P460 HydrophobicContact CG2-CB 4.41Å |
| 244 | L | 83.5 | Confident | 84.4 | Confident | 84 Ų | 84 | 52.4 Ų | 52.4 | 44% | 0.44 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -78 | -35.2 | -174.6 | -85.7 | 67.4 | 0 | 0 | 0 | 113 | I240 P460 | I240-L244 HydrophobicContact CG2-CD1 4.2Å; I240-L244 HydrophobicContact CG2-CD2 4.03Å; I240-L244 WeakPolarHBondContact O-CB 3.47Å; I240-L244 WeakPolarHBondContact O-CD1 3.42Å; I240-L244 PolarHBondContact O-N 3.44Å; L244-P460 VanDerWaalsContact CD1-CD 3.44Å; L244-P460 HydrophobicContact CD1-CG 3.93Å |
| 245 | C | 83.9 | Confident | 83.8 | Confident | 58 Ų | 58 | 54.6 Ų | 54.6 | 39% | 0.392 | 30% | 0.296 | S | S | . | . | S | Bend | trans | -66 | 135.2 | 178.8 | -68.3 | 0 | 0 | 0 | 0 | 110.6 | V241 N247 G248 R251 | V241-C245 VanDerWaalsContact O-CB 3.22Å; V241-C245 WeakPolarHBondContact O-CB 3.18Å; V241-C245 PolarHBondContact O-N 2.99Å; V241-C245 PolarHBondContact O-SG 2.88Å; V241-C245 VanDerWaalsContact O-SG 3.37Å; C245-N247 PolarHBondContact O-N 3.3Å; C245-G248 PolarHBondContact O-N 3.13Å; C245-R251 WeakPolarHBondContact O-CD 3.48Å |
| 246 | P | 80.2 | Confident | 83.1 | Confident | 91 Ų | 91 | 55.3 Ų | 55.3 | 59% | 0.591 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | -27.5 | -177 | 25.7 | -34.7 | 0 | 0 | 0 | 112.9 | ||
| 247 | N | 80.6 | Confident | 82.2 | Confident | 150 Ų | 150 | 55.3 Ų | 55.3 | 80% | 0.802 | 30% | 0.3 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | 18.1 | 173.9 | -61.6 | -23 | 0 | 0 | 0 | 112.4 | C245 | C245-N247 PolarHBondContact O-N 3.3Š|
| 248 | G | 82.2 | Confident | 81.4 | Confident | 3 Ų | 3 | 58.8 Ų | 58.8 | 3% | 0.031 | 31% | 0.31 | C | S | . | . | trans | -62.6 | 134.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | A242 C245 L250 R251 L252 | A242-G248 CarbonylContact O-C 3.59Å; A242-G248 WeakPolarHBondContact O-CA 3.44Å; C245-G248 PolarHBondContact O-N 3.13Å; G248-L250 VanDerWaalsContact C-N 3.34Å; G248-L250 PolarHBondContact O-N 3.27Å; G248-R251 PolarHBondContact O-N 3.43Å; G248-L252 WeakPolarHBondContact O-CB 3.48Å; G248-L252 PolarHBondContact O-N 3.35Å | ||
| 249 | P | 82.3 | Confident | 80.7 | Confident | 19 Ų | 19 | 62.7 Ų | 62.7 | 12% | 0.123 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -66.3 | -36 | -172.7 | 25.4 | -33.8 | 0 | 0 | 0 | 112.3 | T129 V133 W238 A242 L253 | T129-P249 HydrophobicContact CG2-CB 4.15Å; T129-P249 HydrophobicContact CG2-CG 4.18Å; V133-P249 HydrophobicContact CG2-CB 4.04Å; V133-P249 WeakPolarHBondContact CG2-O 3.4Å; W238-P249 HydrophobicContact CH2-CG 4.04Å; W238-P249 HydrophobicContact CZ2-CG 3.79Å; A242-P249 HydrophobicContact CB-CG 4.46Å; P249-L253 PolarHBondContact O-N 3.12Å; P249-L253 VanDerWaalsContact O-N 3.08Å |
| 250 | L | 76.7 | Confident | 79.9 | Confident | 64 Ų | 64 | 68.2 Ų | 68.2 | 34% | 0.335 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -71 | -45.7 | 177.5 | -161.8 | 159.9 | 0 | 0 | 0 | 110.5 | A242 V243 G248 L252 L253 V254 | A242-L250 HydrophobicContact CB-CB 4.02Å; V243-L250 HydrophobicContact CG2-CD2 4.2Å; G248-L250 VanDerWaalsContact C-N 3.34Å; G248-L250 PolarHBondContact O-N 3.27Å; L250-L252 PolarHBondContact O-N 3.36Å; L250-L253 WeakPolarHBondContact O-CB 3.18Å; L250-L253 PolarHBondContact O-N 2.94Å; L250-L253 VanDerWaalsContact O-N 3.16Å; L250-V254 HydrophobicContact CD2-CG2 4.04Å; L250-V254 WeakPolarHBondContact O-CG2 3.36Å; L250-V254 PolarHBondContact O-N 3.07Å; L250-V254 VanDerWaalsContact O-N 3.08Å |
| 251 | R | 80.4 | Confident | 78.4 | Confident | 93 Ų | 93 | 73.9 Ų | 73.9 | 35% | 0.351 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -52.5 | -51.1 | 171.8 | -179 | -178.2 | 176.3 | 137.5 | 10.7 | 112 | A242 C245 G248 L253 V254 E255 | A242-R251 PolarHBondContact O-N 2.9Å; A242-R251 VanDerWaalsContact O-N 3.15Å; C245-R251 WeakPolarHBondContact O-CD 3.48Å; G248-R251 PolarHBondContact O-N 3.43Å; R251-L253 VanDerWaalsContact C-N 3.3Å; R251-L253 PolarHBondContact O-N 3.38Å; R251-V254 PolarHBondContact O-N 2.89Å; R251-V254 VanDerWaalsContact O-N 3.11Å; R251-E255 HydrophobicContact CG-CG 4.41Å; R251-E255 IonicContact CZ-OE1 3.31Å; R251-E255 VanDerWaalsContact CZ-OE1 3.26Å; R251-E255 IonicContact NE-OE1 2.75Å; R251-E255 PolarHBondContact NE-OE1 3.13Å; R251-E255 IonicContact NE-OE2 2.76Å; R251-E255 IonicContact NH2-OE1 2.86Å; R251-E255 PolarHBondContact NH2-OE1 3.01Å; R251-E255 PolarHBondContact O-N 3.27Å |
| 252 | L | 81.5 | Confident | 77 | Confident | 60 Ų | 60 | 75.1 Ų | 75.1 | 31% | 0.314 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.1 | -36.8 | 179.2 | -175 | 63.8 | 0 | 0 | 0 | 112.2 | V133 G248 L250 M256 | V133-L252 HydrophobicContact CG1-CD2 4Å; V133-L252 HydrophobicContact CG1-CG 4.48Å; G248-L252 WeakPolarHBondContact O-CB 3.48Å; G248-L252 PolarHBondContact O-N 3.35Å; L250-L252 PolarHBondContact O-N 3.36Å; L252-M256 HydrophobicContact CD1-CG 4.19Å; L252-M256 HydrophobicContact CD1-SD 4.45Å; L252-M256 HydrophobicContact CG-CE 4.04Å; L252-M256 HydrophobicContact CG-CG 4.39Å; L252-M256 HydrophobicContact CG-SD 4.25Å; L252-M256 VanDerWaalsContact O-CB 3.32Å; L252-M256 WeakPolarHBondContact O-CB 3.14Å; L252-M256 WeakPolarHBondContact O-CE 3.29Å; L252-M256 WeakPolarHBondContact O-CG 3.36Å; L252-M256 PolarHBondContact O-N 3.4Å |
| 253 | L | 80.8 | Confident | 75.5 | Confident | 28 Ų | 28 | 80.7 Ų | 80.7 | 15% | 0.147 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -61.9 | -43.9 | 174 | -167.5 | 75.5 | 0 | 0 | 0 | 112 | L132 V133 F136 P249 L250 R251 A257 | L132-L253 HydrophobicContact CD2-CD1 3.65Å; L132-L253 HydrophobicContact CD2-CD2 3.88Å; L132-L253 HydrophobicContact CD2-CG 4.45Å; V133-L253 HydrophobicContact CG2-CB 4.22Å; V133-L253 HydrophobicContact CG2-CD1 4.22Å; F136-L253 HydrophobicContact CB-CD1 4Å; F136-L253 HydrophobicContact CD1-CD1 4.49Å; F136-L253 HydrophobicContact CD2-CD1 4.09Å; F136-L253 HydrophobicContact CG-CD1 3.95Å; P249-L253 PolarHBondContact O-N 3.12Å; P249-L253 VanDerWaalsContact O-N 3.08Å; L250-L253 WeakPolarHBondContact O-CB 3.18Å; L250-L253 PolarHBondContact O-N 2.94Å; L250-L253 VanDerWaalsContact O-N 3.16Å; R251-L253 VanDerWaalsContact C-N 3.3Å; R251-L253 PolarHBondContact O-N 3.38Å; L253-A257 VanDerWaalsContact O-CB 3.29Å; L253-A257 WeakPolarHBondContact O-CB 3.26Å; L253-A257 PolarHBondContact O-N 2.82Å |
| 254 | V | 76.2 | Confident | 74.4 | Confident | 73 Ų | 73 | 82 Ų | 82 | 44% | 0.442 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -69.2 | -44.6 | -179.2 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | L250 R251 A257 H258 | L250-V254 HydrophobicContact CD2-CG2 4.04Å; L250-V254 WeakPolarHBondContact O-CG2 3.36Å; L250-V254 PolarHBondContact O-N 3.07Å; L250-V254 VanDerWaalsContact O-N 3.08Å; R251-V254 PolarHBondContact O-N 2.89Å; R251-V254 VanDerWaalsContact O-N 3.11Å; V254-A257 PolarHBondContact O-N 2.76Å; V254-H258 WeakPolarHBondContact O-CB 3.35Å; V254-H258 PolarHBondContact O-N 2.84Å |
| 255 | E | 82.1 | Confident | 73.4 | Confident | 73 Ų | 73 | 80.3 Ų | 80.3 | 34% | 0.341 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.2 | -51.3 | 176.9 | -71.9 | 173.1 | 164.6 | 0 | 0 | 110.8 | R251 A257 H258 E259 | R251-E255 HydrophobicContact CG-CG 4.41Å; R251-E255 IonicContact CZ-OE1 3.31Å; R251-E255 VanDerWaalsContact CZ-OE1 3.26Å; R251-E255 IonicContact NE-OE1 2.75Å; R251-E255 PolarHBondContact NE-OE1 3.13Å; R251-E255 IonicContact NE-OE2 2.76Å; R251-E255 IonicContact NH2-OE1 2.86Å; R251-E255 PolarHBondContact NH2-OE1 3.01Å; R251-E255 PolarHBondContact O-N 3.27Å; E255-A257 VanDerWaalsContact C-N 3.3Å; E255-A257 PolarHBondContact O-N 3.37Å; E255-H258 PolarHBondContact O-N 2.86Å; E255-H258 VanDerWaalsContact O-N 3.12Å; E255-E259 WeakPolarHBondContact O-CG 3.33Å; E255-E259 PolarHBondContact O-N 3.43Å |
| 256 | M | 76.5 | Confident | 72.1 | Confident | 27 Ų | 27 | 80.6 Ų | 80.6 | 13% | 0.133 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -60.4 | -34.4 | 176.7 | -71 | -173.2 | -57.3 | 0 | 0 | 113.4 | V133 F136 K137 L252 R260 | V133-M256 HydrophobicContact CG1-CE 4.16Å; F136-M256 HydrophobicContact CB-CE 4.38Å; F136-M256 HydrophobicContact CD1-CB 4.15Å; F136-M256 HydrophobicContact CD1-CE 3.71Å; F136-M256 HydrophobicContact CD1-SD 4.31Å; F136-M256 HydrophobicContact CE1-CB 3.86Å; F136-M256 HydrophobicContact CE1-CE 4.49Å; F136-M256 HydrophobicContact CG-CE 4.41Å; K137-M256 HydrophobicContact CB-SD 4.28Å; L252-M256 HydrophobicContact CD1-CG 4.19Å; L252-M256 HydrophobicContact CD1-SD 4.45Å; L252-M256 HydrophobicContact CG-CE 4.04Å; L252-M256 HydrophobicContact CG-CG 4.39Å; L252-M256 HydrophobicContact CG-SD 4.25Å; L252-M256 VanDerWaalsContact O-CB 3.32Å; L252-M256 WeakPolarHBondContact O-CB 3.14Å; L252-M256 WeakPolarHBondContact O-CE 3.29Å; L252-M256 WeakPolarHBondContact O-CG 3.36Å; L252-M256 PolarHBondContact O-N 3.4Å; M256-R260 VanDerWaalsContact O-CG 3.24Å; M256-R260 WeakPolarHBondContact O-CG 3.47Å; M256-R260 PolarHBondContact O-N 2.83Å |
| 257 | A | 72.1 | Confident | 71.1 | Confident | 5 Ų | 5 | 77.1 Ų | 77.1 | 4% | 0.041 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -71.1 | -37.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | F136 L253 V254 E255 Q261 Q262 L264 | F136-A257 HydrophobicContact CZ-CB 4.25Å; L253-A257 VanDerWaalsContact O-CB 3.29Å; L253-A257 WeakPolarHBondContact O-CB 3.26Å; L253-A257 PolarHBondContact O-N 2.82Å; V254-A257 PolarHBondContact O-N 2.76Å; E255-A257 VanDerWaalsContact C-N 3.3Å; E255-A257 PolarHBondContact O-N 3.37Å; A257-Q261 PolarHBondContact O-N 2.87Å; A257-Q262 PolarHBondContact O-N 3.03Å; A257-L264 HydrophobicContact CB-CD2 3.45Å; A257-L264 VanDerWaalsContact CB-CD2 3.45Å; A257-L264 HydrophobicContact CB-CG 3.92Å |
| 258 | H | 72.8 | Confident | 70.4 | Confident | 159 Ų | 159 | 74.5 Ų | 74.5 | 74% | 0.736 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -67.2 | -48.7 | 176.3 | -169.3 | 86.4 | 0 | 0 | 0 | 111.8 | V254 E255 R260 Q261 | V254-H258 WeakPolarHBondContact O-CB 3.35Å; V254-H258 PolarHBondContact O-N 2.84Å; E255-H258 PolarHBondContact O-N 2.86Å; E255-H258 VanDerWaalsContact O-N 3.12Å; H258-R260 PolarHBondContact O-N 3.5Å; H258-Q261 PolarHBondContact O-N 3.37Å |
| 259 | E | 75.7 | Confident | 69.8 | Low | 140 Ų | 140 | 76.1 Ų | 76.1 | 65% | 0.654 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -51.7 | -38.4 | 175.6 | -74.7 | -178.9 | 167.4 | 0 | 0 | 113 | E255 Q261 | E255-E259 WeakPolarHBondContact O-CG 3.33Å; E255-E259 PolarHBondContact O-N 3.43Å; E259-Q261 VanDerWaalsContact C-N 3.34Å |
| 260 | R | 68.6 | Low | 69.3 | Low | 144 Ų | 144 | 76 Ų | 76 | 54% | 0.543 | 38% | 0.377 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.3 | -1.8 | -177.1 | -60 | -63.5 | 172.4 | 168.3 | -3.3 | 113.7 | M256 H258 Q262 | M256-R260 VanDerWaalsContact O-CG 3.24Å; M256-R260 WeakPolarHBondContact O-CG 3.47Å; M256-R260 PolarHBondContact O-N 2.83Å; H258-R260 PolarHBondContact O-N 3.5Å; R260-Q262 HydrophobicContact CB-CG 4.19Å; R260-Q262 PolarHBondContact O-N 3.02Å |
| 261 | Q | 56 | Low | 69.3 | Low | 182 Ų | 182 | 74.2 Ų | 74.2 | 85% | 0.85 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.5 | 21.1 | -175.5 | -59 | -174.4 | -14.5 | 0 | 0 | 114.2 | A257 H258 E259 | A257-Q261 PolarHBondContact O-N 2.87Å; H258-Q261 PolarHBondContact O-N 3.37Å; E259-Q261 VanDerWaalsContact C-N 3.34Å |
| 262 | Q | 57.5 | Low | 68.4 | Low | 90 Ų | 90 | 70.8 Ų | 70.8 | 42% | 0.421 | 36% | 0.36 | S | S | . | . | P | Polyproline II helix | trans | -86.6 | 134.4 | -178.6 | -69.5 | -176.1 | 7.5 | 0 | 0 | 109.7 | A257 R260 L264 | A257-Q262 PolarHBondContact O-N 3.03Å; R260-Q262 HydrophobicContact CB-CG 4.19Å; R260-Q262 PolarHBondContact O-N 3.02Å; Q262-L264 PolarHBondContact O-N 2.91Å; Q262-L264 VanDerWaalsContact O-N 3.17Å |
| 263 | P | 55.4 | Low | 67.4 | Low | 119 Ų | 119 | 69.8 Ų | 69.8 | 77% | 0.773 | 36% | 0.356 | S | S | * | . | P | Polyproline II helix | trans | -63.7 | 121 | 172.7 | 26.8 | -32.7 | 0 | 0 | 0 | 109.3 | ||
| 264 | L | 58.6 | Low | 65.7 | Low | 59 Ų | 59 | 71 Ų | 71 | 31% | 0.309 | 37% | 0.365 | S | S | . | . | P | Polyproline II helix | trans | -49.7 | 146.1 | 169.4 | -77.1 | 169.5 | 0 | 0 | 0 | 110.6 | A257 Q262 L269 | A257-L264 HydrophobicContact CB-CD2 3.45Å; A257-L264 VanDerWaalsContact CB-CD2 3.45Å; A257-L264 HydrophobicContact CB-CG 3.92Å; Q262-L264 PolarHBondContact O-N 2.91Å; Q262-L264 VanDerWaalsContact O-N 3.17Å; L264-L269 HydrophobicContact CD1-CD1 4.27Å |
| 265 | F | 61.3 | Low | 64.2 | Low | 50 Ų | 50 | 71.7 Ų | 71.7 | 22% | 0.219 | 37% | 0.369 | C | S | . | . | P | Polyproline II helix | trans | -52.3 | 123.1 | -169 | -57.7 | -76.1 | 0 | 0 | 0 | 112.1 | F136 I144 I148 A267 L268 | F136-F265 HydrophobicContact CD2-CE2 4.34Å; F136-F265 HydrophobicContact CD2-CZ 4.48Å; F136-F265 HydrophobicContact CE2-CE2 4.23Å; F136-F265 HydrophobicContact CE2-CZ 4.33Å; I144-F265 HydrophobicContact CB-CZ 4.3Å; I144-F265 HydrophobicContact CG2-CE1 4.02Å; I144-F265 HydrophobicContact CG2-CE2 3.81Å; I144-F265 HydrophobicContact CG2-CZ 3.43Å; I144-F265 VanDerWaalsContact CG2-CZ 3.43Å; I148-F265 HydrophobicContact CD1-CB 3.9Å; I148-F265 HydrophobicContact CD1-CD1 3.69Å; I148-F265 HydrophobicContact CD1-CD2 3.63Å; I148-F265 HydrophobicContact CD1-CE1 4.11Å; I148-F265 HydrophobicContact CD1-CE2 4.06Å; I148-F265 HydrophobicContact CD1-CG 3.44Å; I148-F265 VanDerWaalsContact CD1-CG 3.44Å; I148-F265 HydrophobicContact CD1-CZ 4.29Å; F265-A267 PolarHBondContact O-N 3.48Å; F265-L268 PolarHBondContact O-N 3.15Å |
| 266 | P | 57.1 | Low | 62.3 | Low | 63 Ų | 63 | 74.8 Ų | 74.8 | 41% | 0.409 | 38% | 0.379 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -6.1 | -170.1 | 27.2 | -36.3 | 0 | 0 | 0 | 114.7 | Q204 | Q204-P266 PolarHBondContact NE2-O 3.41Š|
| 267 | A | 59.2 | Low | 60.4 | Low | 18 Ų | 18 | 79.1 Ų | 79.1 | 15% | 0.149 | 40% | 0.402 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85 | -19.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114 | I148 I195 L208 F265 | I148-A267 HydrophobicContact CG2-CB 4.04Å; I195-A267 HydrophobicContact CG2-CB 3.49Å; I195-A267 VanDerWaalsContact CG2-CB 3.49Å; L208-A267 WeakPolarHBondContact CD2-O 3.3Å; F265-A267 PolarHBondContact O-N 3.48Å |
| 268 | L | 66.1 | Low | 59.1 | Low | 96 Ų | 96 | 84.4 Ų | 84.4 | 50% | 0.503 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.4 | -11.9 | -170.4 | -169.8 | 135.1 | 0 | 0 | 0 | 113.3 | F265 L412 | F265-L268 PolarHBondContact O-N 3.15Å; L268-L412 WeakPolarHBondContact O-CB 3.29Å; L268-L412 PolarHBondContact O-N 3.47Å |
| 269 | L | 69.3 | Low | 57.4 | Low | 37 Ų | 37 | 86.6 Ų | 86.6 | 19% | 0.194 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.6 | 127.7 | -167.5 | -178.5 | 152.8 | 0 | 0 | 0 | 110.7 | L264 K409 | L264-L269 HydrophobicContact CD1-CD1 4.27Å; L269-K409 HydrophobicContact CD1-CB 4.2Å; L269-K409 HydrophobicContact CD1-CD 4.36Å; L269-K409 HydrophobicContact CD2-CB 3.84Å; L269-K409 HydrophobicContact CD2-CD 3.91Å; L269-K409 HydrophobicContact CD2-CG 3.8Å; L269-K409 HydrophobicContact CG-CB 4.27Å |
| 270 | Y | 72.1 | Confident | 55.4 | Low | 15 Ų | 15 | 88.3 Ų | 88.3 | 6% | 0.059 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 127.3 | 178.1 | -173.7 | -83.4 | 0 | 0 | 0 | 109.9 | P70 Q205 L208 I209 T272 K409 L410 F415 | P70-Y270 HydrophobicContact CB-CE1 4.15Å; P70-Y270 HydrophobicContact CB-CE2 4.03Å; P70-Y270 VanDerWaalsContact CB-OH 3.29Å; P70-Y270 WeakPolarHBondContact CB-OH 3.47Å; P70-Y270 HydrophobicContact CG-CE1 3.8Å; Q205-Y270 HydrophobicContact CB-CE2 3.57Å; Q205-Y270 WeakPolarHBondContact CB-OH 3.49Å; Q205-Y270 HydrophobicContact CG-CD2 4.37Å; Q205-Y270 HydrophobicContact CG-CE1 4.25Å; Q205-Y270 HydrophobicContact CG-CE2 3.57Å; Q205-Y270 VanDerWaalsContact CG-CZ 3.49Å; Q205-Y270 WeakPolarHBondContact CG-OH 3.36Å; L208-Y270 HydrophobicContact CB-CD2 4.34Å; L208-Y270 HydrophobicContact CD1-CD2 4.43Å; I209-Y270 HydrophobicContact CD1-CE2 3.98Å; I209-Y270 HydrophobicContact CG1-CE2 3.97Å; Y270-T272 HydrophobicContact CD1-CG2 4.33Å; Y270-T272 HydrophobicContact CE1-CG2 3.94Å; Y270-K409 CarbonylContact O-C 3.34Å; Y270-K409 WeakPolarHBondContact O-CA 3.46Å; Y270-L410 PolarHBondContact N-O 2.96Å; Y270-L410 PolarHBondContact O-N 3.49Å; Y270-F415 HydrophobicContact CD1-CZ 4.03Å; Y270-F415 HydrophobicContact CD2-CE2 4.41Å; Y270-F415 AromaticContact CD2-CZ 3.91Å; Y270-F415 HydrophobicContact CD2-CZ 3.91Å; Y270-F415 HydrophobicContact CE2-CZ 4.44Å; Y270-F415 HydrophobicContact CG-CE2 4.07Å; Y270-F415 AromaticContact CG-CZ 3.69Å; Y270-F415 HydrophobicContact CG-CZ 3.69Å |
| 271 | S | 75.1 | Confident | 53.9 | Low | 28 Ų | 28 | 89.9 Ų | 89.9 | 20% | 0.196 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.7 | 127.7 | -178.6 | -171.8 | 0 | 0 | 0 | 0 | 110.6 | Q205 T273 | Q205-S271 PolarHBondContact NE2-O 2.9Å; S271-T273 PolarHBondContact OG-O 2.9Å |
| 272 | T | 62.5 | Low | 52.7 | Low | 20 Ų | 20 | 89.7 Ų | 89.7 | 12% | 0.123 | 46% | 0.458 | C | S | . | . | trans | -82.8 | -38.8 | -177.7 | 63.6 | 0 | 0 | 0 | 0 | 113.8 | S66 Y270 V408 | S66-T272 VanDerWaalsContact OG-CB 3.28Å; S66-T272 WeakPolarHBondContact OG-CB 3.39Å; S66-T272 WeakPolarHBondContact OG-CG2 3.35Å; Y270-T272 HydrophobicContact CD1-CG2 4.33Å; Y270-T272 HydrophobicContact CE1-CG2 3.94Å; T272-V408 HydrophobicContact CG2-CB 3.98Å; T272-V408 PolarHBondContact N-O 2.93Å; T272-V408 PolarHBondContact OG1-N 3.27Å | ||
| 273 | T | 59.9 | Low | 51.5 | Low | 39 Ų | 39 | 91.4 Ų | 91.4 | 24% | 0.239 | 48% | 0.477 | C | S | . | . | S | Bend | trans | -104.2 | 155.2 | -175.7 | -51.9 | 0 | 0 | 0 | 0 | 112.8 | S271 V275 D404 S405 G407 | S271-T273 PolarHBondContact OG-O 2.9Å; T273-V275 PolarHBondContact O-N 2.76Å; T273-D404 PolarHBondContact OG1-O 3.3Å; T273-S405 WeakPolarHBondContact CG2-O 3.41Å; T273-G407 WeakPolarHBondContact OG1-CA 3.45Å |
| 274 | T | 46.7 | Very low | 50.6 | Low | 54 Ų | 54 | 92.1 Ų | 92.1 | 33% | 0.331 | 48% | 0.479 | S | S | . | . | trans | -79.8 | 88.3 | -179.6 | 45.3 | 0 | 0 | 0 | 0 | 113 | L201 Y276 L277 | L201-T274 HydrophobicContact CB-CG2 4.33Å; L201-T274 HydrophobicContact CD1-CG2 3.75Å; T274-Y276 PolarHBondContact O-N 3.45Å; T274-L277 PolarHBondContact O-N 3.42Å | ||
| 275 | V | 44.8 | Very low | 49.4 | Very low | 87 Ų | 87 | 97.5 Ų | 97.5 | 53% | 0.527 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.4 | -15.7 | 170.9 | -169.1 | 0 | 0 | 0 | 0 | 113.1 | T273 | T273-V275 PolarHBondContact O-N 2.76Š|
| 276 | Y | 40.2 | Very low | 47.9 | Very low | 138 Ų | 138 | 104.5 Ų | 104.5 | 54% | 0.541 | 53% | 0.533 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.6 | -14.8 | 177.4 | -60.9 | -56.4 | 0 | 0 | 0 | 116.5 | R198 T274 | R198-Y276 VanDerWaalsContact NH1-CE1 3.29Å; T274-Y276 PolarHBondContact O-N 3.45Å |
| 277 | L | 38.4 | Very low | 46.9 | Very low | 119 Ų | 119 | 107.7 Ų | 107.7 | 62% | 0.623 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -35.2 | -175.3 | -109 | 167.8 | 0 | 0 | 0 | 113.2 | T274 K279 K280 | T274-L277 PolarHBondContact O-N 3.42Å; L277-K279 PolarHBondContact O-N 3.49Å; L277-K280 PolarHBondContact O-N 3.32Å; L277-K280 VanDerWaalsContact O-N 3.15Å |
| 278 | V | 43 | Very low | 45.6 | Very low | 116 Ų | 116 | 115.4 Ų | 115.4 | 70% | 0.703 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -58.8 | -32.6 | -177.9 | -180 | 0 | 0 | 0 | 0 | 112.5 | K280 | V278-K280 PolarHBondContact O-N 2.94Å; V278-K280 VanDerWaalsContact O-N 3.15Å |
| 279 | K | 37.8 | Very low | 44 | Very low | 204 Ų | 204 | 118.3 Ų | 118.3 | 89% | 0.887 | 60% | 0.6 | S | S | * | * | G | 310 helix | trans | -80.2 | 14.4 | -179.1 | -146.9 | 176.8 | -176.8 | 176 | 0 | 114.7 | L277 | L277-K279 PolarHBondContact O-N 3.49Š|
| 280 | K | 34.8 | Very low | 42.1 | Very low | 177 Ų | 177 | 123.8 Ų | 123.8 | 77% | 0.77 | 63% | 0.629 | S | S | * | * | G | 310 helix | trans | -130.5 | 17.2 | 177.9 | -145.9 | -167.4 | 176.4 | -171.2 | 0 | 114.7 | L277 V278 | L277-K280 PolarHBondContact O-N 3.32Å; L277-K280 VanDerWaalsContact O-N 3.15Å; V278-K280 PolarHBondContact O-N 2.94Å; V278-K280 VanDerWaalsContact O-N 3.15Å |
| 281 | H | 35.7 | Very low | 40.3 | Very low | 176 Ų | 176 | 131.7 Ų | 131.7 | 82% | 0.815 | 67% | 0.667 | S | S | * | * | trans | -134.4 | 58.7 | 173 | -102.4 | 44.6 | 0 | 0 | 0 | 112.1 | ||||
| 282 | Q | 31.6 | Very low | 38.1 | Very low | 178 Ų | 178 | 139 Ų | 139 | 83% | 0.832 | 70% | 0.698 | S | S | * | * | trans | -112.6 | 112.8 | 148.5 | -82.6 | -176.1 | -36.5 | 0 | 0 | 107.3 | V284 | Q282-V284 PolarHBondContact O-N 3.02Š| ||
| 283 | P | 32.6 | Very low | 36.3 | Very low | 127 Ų | 127 | 147.4 Ų | 147.4 | 83% | 0.825 | 73% | 0.733 | S | S | * | * | trans | -70.2 | 112.3 | 164.8 | 29.2 | -30 | 0 | 0 | 0 | 107.7 | E285 | P283-E285 VanDerWaalsContact C-N 3.34Å; P283-E285 PolarHBondContact O-N 3.35Å | ||
| 284 | V | 35 | Very low | 34.9 | Very low | 133 Ų | 133 | 151.7 Ų | 151.7 | 81% | 0.806 | 76% | 0.759 | S | S | * | * | trans | -76 | 94.1 | 169 | 179.3 | 0 | 0 | 0 | 0 | 107 | Q282 K286 | Q282-V284 PolarHBondContact O-N 3.02Å; V284-K286 PolarHBondContact O-N 2.9Å | ||
| 285 | E | 35.1 | Very low | 33.9 | Very low | 172 Ų | 172 | 152.5 Ų | 152.5 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | -64.8 | 120 | 174.3 | -168.6 | 165 | -154 | 0 | 0 | 109.1 | P283 V287 | P283-E285 VanDerWaalsContact C-N 3.34Å; P283-E285 PolarHBondContact O-N 3.35Å; E285-V287 PolarHBondContact O-N 3.28Å | ||
| 286 | K | 29.1 | Very low | 33 | Very low | 198 Ų | 198 | 153.3 Ų | 153.3 | 86% | 0.861 | 79% | 0.787 | S | S | * | * | trans | -75.5 | 103.9 | 178.1 | -82.1 | -170.4 | 169.8 | -165.1 | 0 | 109.6 | V284 | V284-K286 PolarHBondContact O-N 2.9Š| ||
| 287 | V | 36.6 | Very low | 32.4 | Very low | 129 Ų | 129 | 153.4 Ų | 153.4 | 78% | 0.782 | 80% | 0.803 | S | S | * | * | trans | -111.3 | 119.3 | 155.1 | -178 | 0 | 0 | 0 | 0 | 107.9 | E285 | E285-V287 PolarHBondContact O-N 3.28Š| ||
| 288 | E | 30.9 | Very low | 32 | Very low | 180 Ų | 180 | 155.1 Ų | 155.1 | 84% | 0.841 | 81% | 0.811 | S | S | * | * | trans | -93.4 | 114.3 | -176.9 | -174.9 | 172.4 | 115.1 | 0 | 0 | 109.2 | ||||
| 289 | N | 33 | Very low | 31.2 | Very low | 158 Ų | 158 | 156 Ų | 156 | 85% | 0.845 | 82% | 0.817 | S | S | * | * | trans | -166.6 | 146.9 | 159.2 | -110.2 | -40.4 | 0 | 0 | 0 | 110.8 | ||||
| 290 | D | 29.3 | Very low | 30.6 | Very low | 151 Ų | 151 | 152.6 Ų | 152.6 | 81% | 0.807 | 82% | 0.817 | S | S | * | * | trans | -76.5 | 129.2 | -176.5 | -66 | -71.3 | 0 | 0 | 0 | 113 | ||||
| 291 | Q | 34 | Very low | 30.2 | Very low | 181 Ų | 181 | 149.5 Ų | 149.5 | 85% | 0.846 | 82% | 0.818 | S | S | * | * | 171.8 | 126.3 | 118.8 | -92.3 | 171.4 | 7.5 | 0 | 0 | 113.9 | |||||
| 292 | Q | 29.7 | Very low | 30.1 | Very low | 183 Ų | 183 | 148 Ų | 148 | 86% | 0.855 | 82% | 0.821 | S | S | * | * | trans | 37.1 | 94.5 | 144.4 | -104.5 | 164 | -34.1 | 0 | 0 | 121.4 | ||||
| 293 | F | 24.1 | Very low | 29.8 | Very low | 196 Ų | 196 | 147 Ų | 147 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | 16.9 | 103.5 | 127.8 | -174.3 | -92.1 | 0 | 0 | 0 | 118.6 | |||||
| 294 | V | 29.6 | Very low | 29.9 | Very low | 128 Ų | 128 | 145.7 Ų | 145.7 | 78% | 0.776 | 82% | 0.821 | S | S | * | * | -148.2 | 132.6 | 123.6 | 177.3 | 0 | 0 | 0 | 0 | 107.4 | |||||
| 295 | G | 25.7 | Very low | 29.8 | Very low | 71 Ų | 71 | 151 Ų | 151 | 73% | 0.732 | 83% | 0.827 | S | S | * | * | trans | -93.6 | 132.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 296 | S | 26.6 | Very low | 29.5 | Very low | 104 Ų | 104 | 150.3 Ų | 150.3 | 73% | 0.727 | 83% | 0.828 | S | S | * | * | trans | -138.4 | 121.5 | 177.8 | -74.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 297 | T | 27.6 | Very low | 29.8 | Very low | 140 Ų | 140 | 150.5 Ų | 150.5 | 86% | 0.859 | 83% | 0.832 | S | S | * | * | trans | -144.6 | 70.8 | 164.6 | -50.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 298 | I | 30.4 | Very low | 29.5 | Very low | 156 Ų | 156 | 149 Ų | 149 | 80% | 0.8 | 83% | 0.833 | S | S | * | * | trans | 32.1 | 109.1 | 138.7 | -53.8 | 168.4 | 0 | 0 | 0 | 116.7 | ||||
| 299 | T | 25.9 | Very low | 29.7 | Very low | 135 Ų | 135 | 149.1 Ų | 149.1 | 83% | 0.828 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 155.9 | 153.5 | 47.3 | 0 | 0 | 0 | 0 | 110.9 | ||
| 300 | C | 25.9 | Very low | 29.6 | Very low | 132 Ų | 132 | 148 Ų | 148 | 89% | 0.892 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 164.3 | -174.2 | -61.5 | 0 | 0 | 0 | 0 | 115 | ||
| 301 | S | 26.1 | Very low | 29.9 | Very low | 111 Ų | 111 | 148.8 Ų | 148.8 | 78% | 0.776 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 149.6 | -166.3 | 50.5 | 0 | 0 | 0 | 0 | 116.6 | ||
| 302 | V | 33.3 | Very low | 29.6 | Very low | 145 Ų | 145 | 146.8 Ų | 146.8 | 88% | 0.879 | 83% | 0.83 | S | S | * | * | trans | -138.5 | 139.8 | 147.7 | -180 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 303 | D | 26.2 | Very low | 29.6 | Very low | 157 Ų | 157 | 144 Ų | 144 | 84% | 0.84 | 83% | 0.829 | S | S | * | * | trans | -73.9 | 145.3 | -172.5 | -64.8 | -83.9 | 0 | 0 | 0 | 115.9 | ||||
| 304 | A | 34.2 | Very low | 29.8 | Very low | 100 Ų | 100 | 139.7 Ų | 139.7 | 83% | 0.826 | 82% | 0.819 | S | S | * | * | trans | -151.5 | 132.7 | 148.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 305 | R | 31.8 | Very low | 30 | Very low | 245 Ų | 245 | 139.8 Ų | 139.8 | 93% | 0.925 | 82% | 0.82 | S | S | * | * | trans | -55.5 | 155.3 | -173.7 | -87.6 | 173.7 | 150.2 | 98.4 | -5.6 | 115.9 | ||||
| 306 | N | 29.6 | Very low | 30.5 | Very low | 157 Ų | 157 | 145 Ų | 145 | 84% | 0.84 | 83% | 0.826 | S | S | * | * | trans | -34.6 | 140 | 160.4 | -53.2 | -6.1 | 0 | 0 | 0 | 114.8 | ||||
| 307 | E | 35.2 | Very low | 30.9 | Very low | 202 Ų | 202 | 145.6 Ų | 145.6 | 94% | 0.944 | 83% | 0.827 | S | S | * | * | -150.8 | 157.5 | 113.5 | -117.2 | 178.9 | 163.5 | 0 | 0 | 110.3 | |||||
| 308 | A | 31.1 | Very low | 31 | Very low | 97 Ų | 97 | 145.1 Ų | 145.1 | 80% | 0.802 | 83% | 0.828 | S | S | * | * | trans | -112.3 | 134.7 | -168.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 309 | L | 34.7 | Very low | 31.4 | Very low | 183 Ų | 183 | 142.7 Ų | 142.7 | 96% | 0.958 | 82% | 0.822 | S | S | * | * | trans | -152.6 | 159 | 161.3 | -112.8 | 163 | 0 | 0 | 0 | 111.2 | ||||
| 310 | N | 31.1 | Very low | 31.7 | Very low | 135 Ų | 135 | 142.3 Ų | 142.3 | 72% | 0.722 | 82% | 0.82 | S | S | * | * | trans | -128.4 | 117.7 | -153.4 | 169.2 | 26.7 | 0 | 0 | 0 | 111.1 | ||||
| 311 | I | 35.2 | Very low | 32.1 | Very low | 166 Ų | 166 | 141.7 Ų | 141.7 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | -136 | 119.7 | 166.9 | -58.2 | -177.7 | 0 | 0 | 0 | 109.3 | ||||
| 312 | N | 28.2 | Very low | 32.7 | Very low | 140 Ų | 140 | 140.8 Ų | 140.8 | 75% | 0.749 | 81% | 0.806 | S | S | * | * | trans | -100.1 | 142.8 | 176.7 | -144.9 | 2.8 | 0 | 0 | 0 | 109 | ||||
| 313 | C | 29 | Very low | 32.8 | Very low | 123 Ų | 123 | 141.4 Ų | 141.4 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | trans | -154.7 | 127.5 | 168.3 | -163.9 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 314 | T | 28.8 | Very low | 33.2 | Very low | 106 Ų | 106 | 140.3 Ų | 140.3 | 65% | 0.65 | 79% | 0.793 | S | S | * | * | trans | -148.5 | 141.4 | -173.2 | 14.7 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 315 | T | 32.9 | Very low | 33.4 | Very low | 130 Ų | 130 | 141.8 Ų | 141.8 | 80% | 0.798 | 79% | 0.791 | S | S | * | * | trans | 64.8 | 156 | 170.1 | 64.1 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 316 | Q | 36.1 | Very low | 33.7 | Very low | 181 Ų | 181 | 133.8 Ų | 133.8 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | cis | -161.9 | 158.8 | 30.3 | -153.9 | 166.7 | 16.7 | 0 | 0 | 111.8 | ||||
| 317 | P | 35.4 | Very low | 34.2 | Very low | 116 Ų | 116 | 132 Ų | 132 | 75% | 0.753 | 78% | 0.777 | S | S | * | * | trans | -110.6 | 164.4 | -179.2 | 40 | -33.5 | 0 | 0 | 0 | 115.7 | ||||
| 318 | C | 30.8 | Very low | 34.3 | Very low | 130 Ų | 130 | 128.5 Ų | 128.5 | 88% | 0.878 | 77% | 0.765 | S | S | * | * | trans | -153.9 | 166.9 | 174.4 | -100.4 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 319 | P | 37.7 | Very low | 34.7 | Very low | 105 Ų | 105 | 130.1 Ų | 130.1 | 68% | 0.682 | 76% | 0.76 | S | S | * | * | trans | -138.5 | -172 | -133.6 | 44.3 | -27.3 | 0 | 0 | 0 | 119.1 | ||||
| 320 | T | 31.9 | Very low | 34.9 | Very low | 127 Ų | 127 | 125.2 Ų | 125.2 | 78% | 0.779 | 74% | 0.742 | S | S | * | * | trans | 72 | 154.8 | 163.2 | 34.7 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 321 | T | 35 | Very low | 35.2 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 74% | 0.736 | 74% | 0.742 | S | S | * | * | cis | -155.1 | 161.7 | 27.5 | -30.4 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 322 | S | 38.3 | Very low | 35.5 | Very low | 91 Ų | 91 | 126.3 Ų | 126.3 | 64% | 0.636 | 74% | 0.743 | S | S | * | * | trans | 67.9 | 153.1 | 158.8 | -60.4 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 323 | E | 35.6 | Very low | 35.9 | Very low | 158 Ų | 158 | 125.3 Ų | 125.3 | 74% | 0.738 | 74% | 0.744 | S | S | * | * | cis | -173.9 | 170.6 | -14.7 | -103.6 | 163.8 | 70.3 | 0 | 0 | 106.8 | ||||
| 324 | L | 35.7 | Very low | 36.3 | Very low | 135 Ų | 135 | 128 Ų | 128 | 71% | 0.707 | 75% | 0.747 | S | S | * | * | cis | -159.4 | 166.3 | 3.6 | -154.3 | 70.4 | 0 | 0 | 0 | 110.3 | ||||
| 325 | V | 38 | Very low | 36.4 | Very low | 130 Ų | 130 | 129.3 Ų | 129.3 | 79% | 0.788 | 76% | 0.755 | S | S | * | * | trans | 35.8 | 137.9 | 141.3 | 154.5 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 326 | A | 38 | Very low | 36.7 | Very low | 78 Ų | 78 | 127.2 Ų | 127.2 | 65% | 0.645 | 76% | 0.759 | S | S | * | * | cis | -171.2 | -178.9 | -7.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 327 | S | 39.7 | Very low | 36.6 | Very low | 119 Ų | 119 | 126 Ų | 126 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | trans | 77.4 | 140 | 158.3 | -71 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 328 | D | 38 | Very low | 36.8 | Very low | 129 Ų | 129 | 124.2 Ų | 124.2 | 69% | 0.69 | 75% | 0.749 | S | S | * | * | cis | -161.3 | 161.5 | -9.8 | -168.6 | 27.6 | 0 | 0 | 0 | 113 | ||||
| 329 | N | 38.6 | Very low | 37.2 | Very low | 130 Ų | 130 | 128.7 Ų | 128.7 | 70% | 0.695 | 75% | 0.747 | S | S | * | * | trans | 28.4 | 150.8 | 156.4 | -79.1 | -44.5 | 0 | 0 | 0 | 123.5 | ||||
| 330 | S | 38.9 | Very low | 36.9 | Very low | 81 Ų | 81 | 131.5 Ų | 131.5 | 57% | 0.566 | 76% | 0.756 | S | S | * | * | cis | -176 | 170.2 | -19.2 | 56.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 331 | N | 37.3 | Very low | 37.3 | Very low | 138 Ų | 138 | 133.1 Ų | 133.1 | 74% | 0.738 | 76% | 0.757 | S | S | * | * | trans | 74.1 | 94.2 | 150.2 | -64 | -18.1 | 0 | 0 | 0 | 124.1 | ||||
| 332 | Q | 40.8 | Very low | 37.4 | Very low | 186 Ų | 186 | 134.1 Ų | 134.1 | 87% | 0.869 | 76% | 0.757 | S | S | * | * | 56.3 | 143.1 | 123.4 | -66.6 | -171.5 | -3 | 0 | 0 | 124.3 | |||||
| 333 | P | 37.1 | Very low | 37.3 | Very low | 119 Ų | 119 | 136 Ų | 136 | 77% | 0.773 | 76% | 0.76 | S | S | * | * | trans | -107.2 | 166.3 | 175.9 | 41.6 | -34.8 | 0 | 0 | 0 | 114.9 | ||||
| 334 | M | 37.1 | Very low | 37.5 | Very low | 179 Ų | 179 | 135.8 Ų | 135.8 | 88% | 0.882 | 76% | 0.762 | S | S | * | * | trans | -148.3 | 152.1 | 159.6 | -96.7 | -56.9 | 170.7 | 0 | 0 | 115.2 | ||||
| 335 | T | 32.6 | Very low | 37.7 | Very low | 134 Ų | 134 | 134.4 Ų | 134.4 | 82% | 0.822 | 76% | 0.762 | S | S | * | * | trans | -48.2 | 151.9 | -178.1 | 54.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 336 | G | 38.5 | Very low | 37.7 | Very low | 85 Ų | 85 | 135.9 Ų | 135.9 | 88% | 0.876 | 77% | 0.765 | S | S | * | * | trans | -159 | 122.7 | 159.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 337 | N | 32.7 | Very low | 37.5 | Very low | 155 Ų | 155 | 138.9 Ų | 138.9 | 83% | 0.829 | 77% | 0.77 | S | S | * | * | trans | -127 | 133.9 | -170.5 | 170.6 | 21 | 0 | 0 | 0 | 111.9 | ||||
| 338 | S | 40 | Very low | 37.4 | Very low | 80 Ų | 80 | 140.1 Ų | 140.1 | 56% | 0.559 | 77% | 0.773 | S | S | * | * | trans | -174.3 | 127.1 | 148.4 | -91.1 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 339 | R | 39.1 | Very low | 37.3 | Very low | 223 Ų | 223 | 139.1 Ų | 139.1 | 84% | 0.842 | 78% | 0.776 | S | S | * | * | 68.9 | 111 | 129.4 | -60.4 | 168.8 | -174.4 | 143.5 | 3.5 | 121.3 | |||||
| 340 | N | 32.2 | Very low | 37.1 | Very low | 165 Ų | 165 | 144.4 Ų | 144.4 | 88% | 0.882 | 79% | 0.786 | S | S | * | * | trans | -86.7 | 151.8 | 146.9 | -80.5 | -20.4 | 0 | 0 | 0 | 111.1 | ||||
| 341 | M | 40.2 | Very low | 36.9 | Very low | 161 Ų | 161 | 145.9 Ų | 145.9 | 79% | 0.793 | 79% | 0.792 | S | S | * | * | trans | -147 | 129.8 | 156.8 | -79.1 | -162 | 72.7 | 0 | 0 | 111.6 | ||||
| 342 | L | 36.3 | Very low | 36.9 | Very low | 140 Ų | 140 | 146.6 Ų | 146.6 | 73% | 0.733 | 80% | 0.796 | S | S | * | * | 27.1 | 138 | 117.9 | -79.1 | 149.9 | 0 | 0 | 0 | 117.9 | |||||
| 343 | N | 36.2 | Very low | 36.6 | Very low | 131 Ų | 131 | 142.2 Ų | 142.2 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | cis | -167.7 | -170 | 15.8 | -166.3 | 12.4 | 0 | 0 | 0 | 111.6 | ||||
| 344 | I | 40 | Very low | 36.5 | Very low | 153 Ų | 153 | 144.8 Ų | 144.8 | 79% | 0.785 | 80% | 0.797 | S | S | * | * | trans | 108 | 107.9 | 155.1 | -56.3 | 168.6 | 0 | 0 | 0 | 116 | ||||
| 345 | P | 41 | Very low | 36.4 | Very low | 107 Ų | 107 | 142.3 Ų | 142.3 | 70% | 0.695 | 79% | 0.792 | S | S | * | * | trans | -104.1 | 174.1 | 163.1 | 40.1 | -32.8 | 0 | 0 | 0 | 112.3 | ||||
| 346 | N | 38.3 | Very low | 36.7 | Very low | 160 Ų | 160 | 142 Ų | 142 | 86% | 0.856 | 79% | 0.79 | S | S | * | * | trans | -156 | 153 | 150.7 | -138.3 | -16.5 | 0 | 0 | 0 | 114.1 | ||||
| 347 | N | 32.5 | Very low | 36.7 | Very low | 142 Ų | 142 | 144.7 Ų | 144.7 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | trans | -89.7 | 165.7 | 179.3 | -71.8 | -33.1 | 0 | 0 | 0 | 112.3 | ||||
| 348 | T | 38.5 | Very low | 37.2 | Very low | 145 Ų | 145 | 143.1 Ų | 143.1 | 89% | 0.89 | 78% | 0.78 | S | S | * | * | -158.9 | 141.5 | 127.6 | -71.8 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 349 | S | 35.2 | Very low | 37.3 | Very low | 108 Ų | 108 | 144.2 Ų | 144.2 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | trans | -96.8 | 159.1 | -171.3 | -34 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 350 | R | 35.2 | Very low | 37.3 | Very low | 241 Ų | 241 | 140.7 Ų | 140.7 | 91% | 0.909 | 78% | 0.783 | S | S | * | * | trans | -152.6 | 150.3 | 130.9 | -141.3 | 168.6 | -176.1 | 133.9 | 2.2 | 112.7 | ||||
| 351 | T | 33.9 | Very low | 37.7 | Very low | 111 Ų | 111 | 139.5 Ų | 139.5 | 68% | 0.681 | 78% | 0.777 | S | S | * | * | trans | -91.2 | 166.3 | 177.9 | 48.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 352 | D | 37.6 | Very low | 37.6 | Very low | 153 Ų | 153 | 137.6 Ų | 137.6 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | -169 | 161 | 101.4 | -81.1 | -15.7 | 0 | 0 | 0 | 110.1 | |||||
| 353 | A | 33.4 | Very low | 37.6 | Very low | 95 Ų | 95 | 136 Ų | 136 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | trans | -143.7 | 152.9 | -167.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 354 | I | 36.9 | Very low | 37.9 | Very low | 173 Ų | 173 | 137.5 Ų | 137.5 | 89% | 0.887 | 77% | 0.772 | S | S | * | * | trans | -132.6 | 149.4 | 167.3 | -62.4 | -176.2 | 0 | 0 | 0 | 108.2 | ||||
| 355 | V | 33.6 | Very low | 37.8 | Very low | 127 Ų | 127 | 136.6 Ų | 136.6 | 77% | 0.77 | 77% | 0.769 | S | S | * | * | trans | -117.2 | -172.6 | -163.2 | 177.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 356 | V | 39.9 | Very low | 37.9 | Very low | 128 Ų | 128 | 138.1 Ų | 138.1 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | trans | 100 | 125.6 | 172.4 | -178.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 357 | D | 38.7 | Very low | 37.9 | Very low | 141 Ų | 141 | 137.1 Ų | 137.1 | 75% | 0.754 | 77% | 0.766 | S | S | * | * | cis | -138.8 | -165.4 | 2.8 | -141.7 | -43.5 | 0 | 0 | 0 | 113.5 | ||||
| 358 | T | 43.5 | Very low | 38.1 | Very low | 121 Ų | 121 | 135.1 Ų | 135.1 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | trans | -118.6 | -170.8 | -155.4 | -9.9 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 359 | P | 41.6 | Very low | 38.1 | Very low | 103 Ų | 103 | 139.1 Ų | 139.1 | 67% | 0.669 | 77% | 0.768 | S | S | * | * | trans | -127 | -133.8 | -137 | 41.6 | -18.1 | 0 | 0 | 0 | 115.4 | ||||
| 360 | D | 39 | Very low | 38.2 | Very low | 149 Ų | 149 | 141.2 Ų | 141.2 | 80% | 0.797 | 77% | 0.771 | S | S | * | * | trans | 81.5 | 151.5 | 179.5 | -49.1 | -26.8 | 0 | 0 | 0 | 115.6 | ||||
| 361 | D | 39.5 | Very low | 38.6 | Very low | 141 Ų | 141 | 136.6 Ų | 136.6 | 75% | 0.754 | 76% | 0.764 | S | S | * | * | cis | -145.2 | 176.5 | 11.1 | -164 | 19.9 | 0 | 0 | 0 | 114.6 | ||||
| 362 | N | 38.7 | Very low | 38.7 | Very low | 120 Ų | 120 | 139 Ų | 139 | 64% | 0.642 | 77% | 0.773 | S | S | * | * | trans | -32.7 | 135 | -177.8 | -87.3 | -75 | 0 | 0 | 0 | 123.3 | ||||
| 363 | T | 36.3 | Very low | 38.9 | Very low | 107 Ų | 107 | 141.1 Ų | 141.1 | 66% | 0.656 | 78% | 0.778 | S | S | * | * | 43.3 | 126.4 | 106.5 | -42.2 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 364 | I | 42.1 | Very low | 39 | Very low | 162 Ų | 162 | 143 Ų | 143 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | -174.1 | 144.8 | 124.6 | -96.3 | 155.6 | 0 | 0 | 0 | 110.9 | |||||
| 365 | N | 38.4 | Very low | 39.1 | Very low | 134 Ų | 134 | 142.9 Ų | 142.9 | 72% | 0.717 | 78% | 0.779 | S | S | * | * | trans | -93 | 166 | 176.8 | -63.1 | -41.2 | 0 | 0 | 0 | 111.8 | ||||
| 366 | N | 42.2 | Very low | 39.3 | Very low | 139 Ų | 139 | 141.4 Ų | 141.4 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | 171.9 | 138.4 | 114.2 | -84.2 | -4.9 | 0 | 0 | 0 | 114.9 | |||||
| 367 | D | 40 | Very low | 39 | Very low | 139 Ų | 139 | 144.2 Ų | 144.2 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | trans | 53.6 | 90.3 | 136.4 | -51.5 | -29.9 | 0 | 0 | 0 | 122.6 | ||||
| 368 | A | 36.7 | Very low | 38.9 | Very low | 101 Ų | 101 | 141.8 Ų | 141.8 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | 28.9 | 125.9 | 114.8 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 369 | R | 37.9 | Very low | 38.7 | Very low | 228 Ų | 228 | 142.1 Ų | 142.1 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | -150.5 | 124.6 | 143 | -169.1 | 158.6 | -178 | 155.9 | -0.4 | 112.9 | ||||
| 370 | N | 36.5 | Very low | 38.5 | Very low | 153 Ų | 153 | 145.5 Ų | 145.5 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | -73.4 | 153.4 | 166.7 | -77.1 | -18.3 | 0 | 0 | 0 | 111.2 | ||||
| 371 | N | 44.6 | Very low | 38.3 | Very low | 144 Ų | 144 | 148 Ų | 148 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -160.8 | 129.1 | 142.4 | -100 | -6 | 0 | 0 | 0 | 109.2 | ||||
| 372 | N | 35.4 | Very low | 38.3 | Very low | 162 Ų | 162 | 145.8 Ų | 145.8 | 87% | 0.866 | 79% | 0.788 | S | S | * | * | trans | -98.4 | 125.1 | 168.4 | -78.5 | -10.8 | 0 | 0 | 0 | 108.6 | ||||
| 373 | E | 42.9 | Very low | 37.9 | Very low | 197 Ų | 197 | 147.5 Ų | 147.5 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | trans | -136.7 | 144.3 | 154.6 | -74 | -161.2 | 99.9 | 0 | 0 | 110.4 | ||||
| 374 | T | 35 | Very low | 38 | Very low | 135 Ų | 135 | 149 Ų | 149 | 83% | 0.828 | 81% | 0.807 | S | S | * | * | trans | -101.5 | 127 | -171.6 | -57 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 375 | I | 39.7 | Very low | 37.8 | Very low | 170 Ų | 170 | 148.9 Ų | 148.9 | 87% | 0.872 | 81% | 0.806 | S | S | * | * | trans | -153.2 | 155.4 | 158 | -102.5 | 143.2 | 0 | 0 | 0 | 109.4 | ||||
| 376 | S | 35.9 | Very low | 37.9 | Very low | 95 Ų | 95 | 149.9 Ų | 149.9 | 66% | 0.664 | 82% | 0.817 | S | S | * | * | trans | -93.3 | 170.9 | -164.2 | -51.7 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 377 | Q | 35.1 | Very low | 37.9 | Very low | 188 Ų | 188 | 147.9 Ų | 147.9 | 88% | 0.879 | 82% | 0.82 | S | S | * | * | trans | 91.4 | 141.4 | 154.4 | -67.1 | 164 | -61.6 | 0 | 0 | 119.8 | ||||
| 378 | A | 35.9 | Very low | 38.1 | Very low | 90 Ų | 90 | 144.8 Ų | 144.8 | 74% | 0.744 | 82% | 0.821 | S | S | * | * | trans | 62.8 | 96.5 | 167.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 379 | P | 38.9 | Very low | 38.5 | Very low | 128 Ų | 128 | 151 Ų | 151 | 83% | 0.831 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 146.3 | 157 | 32.8 | -32.8 | 0 | 0 | 0 | 110.9 | ||
| 380 | H | 37.4 | Very low | 39.4 | Very low | 173 Ų | 173 | 144 Ų | 144 | 80% | 0.801 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 138.2 | -177.8 | -80.4 | -116 | 0 | 0 | 0 | 114.4 | ||
| 381 | E | 34.8 | Very low | 40.9 | Very low | 202 Ų | 202 | 140.8 Ų | 140.8 | 94% | 0.944 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 124 | 142.4 | -74.6 | -177.2 | 94.1 | 0 | 0 | 108.4 | ||
| 382 | T | 39.5 | Very low | 42.4 | Very low | 95 Ų | 95 | 141.1 Ų | 141.1 | 58% | 0.583 | 78% | 0.78 | S | S | * | * | trans | -135.4 | 113.7 | 170.6 | -45 | 0 | 0 | 0 | 0 | 109.4 | T384 | T382-T384 PolarHBondContact O-N 2.89Š| ||
| 383 | D | 30.9 | Very low | 44.2 | Very low | 155 Ų | 155 | 140.4 Ų | 140.4 | 83% | 0.829 | 77% | 0.765 | S | S | * | * | trans | 21.9 | 90.9 | 159.5 | -58.3 | -45.9 | 0 | 0 | 0 | 118.2 | ||||
| 384 | T | 37.9 | Very low | 45.7 | Very low | 140 Ų | 140 | 133.7 Ų | 133.7 | 86% | 0.859 | 73% | 0.734 | S | S | * | * | trans | -118.3 | 41.8 | 164.9 | 44.3 | 0 | 0 | 0 | 0 | 112.4 | T382 | T382-T384 PolarHBondContact O-N 2.89Š| ||
| 385 | L | 37.4 | Very low | 47.8 | Very low | 158 Ų | 158 | 131 Ų | 131 | 83% | 0.827 | 71% | 0.712 | S | S | * | * | trans | -112.5 | 152.1 | 165.6 | -69.4 | 171.9 | 0 | 0 | 0 | 109.5 | ||||
| 386 | V | 42.2 | Very low | 49.6 | Very low | 155 Ų | 155 | 124.4 Ų | 124.4 | 94% | 0.939 | 68% | 0.678 | S | S | * | * | trans | 71.3 | 59 | -174 | -160.7 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 387 | A | 41.5 | Very low | 51.5 | Low | 98 Ų | 98 | 120.7 Ų | 120.7 | 81% | 0.81 | 65% | 0.65 | S | S | * | * | trans | -116.8 | 112.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 388 | G | 44.3 | Very low | 53.5 | Low | 73 Ų | 73 | 114.5 Ų | 114.5 | 75% | 0.753 | 63% | 0.631 | S | S | * | * | trans | 51.3 | 74.1 | 155.2 | 0 | 0 | 0 | 0 | 0 | 119.4 | P390 | G388-P390 WeakPolarHBondContact O-CD 3.38Š| ||
| 389 | R | 45.8 | Very low | 55.5 | Low | 232 Ų | 232 | 113.1 Ų | 113.1 | 88% | 0.875 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 118.6 | 144.7 | 175.1 | 179.9 | -76.3 | -166.2 | -2.4 | 106.6 | N391 | R389-N391 PolarHBondContact O-N 3.45Š|
| 390 | P | 55.1 | Low | 57.2 | Low | 80 Ų | 80 | 107.8 Ų | 107.8 | 52% | 0.519 | 58% | 0.576 | S | S | . | * | P | Polyproline II helix | trans | -60 | 141.1 | 175.7 | 25.7 | -33.9 | 0 | 0 | 0 | 109.7 | G388 R392 | G388-P390 WeakPolarHBondContact O-CD 3.38Å; P390-R392 PolarHBondContact O-N 3.21Å; P390-R392 VanDerWaalsContact O-N 3.14Å |
| 391 | N | 68.5 | Low | 59 | Low | 86 Ų | 86 | 102.4 Ų | 102.4 | 46% | 0.46 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -64.2 | 121.1 | 178.5 | -67.4 | -63 | 0 | 0 | 0 | 108.8 | I51 R389 W393 Q394 E395 | I51-N391 HydrophobicContact CD1-CB 4.02Å; R389-N391 PolarHBondContact O-N 3.45Å; N391-W393 PolarHBondContact O-N 3.42Å; N391-Q394 HydrophobicContact CB-CB 4.4Å; N391-Q394 HydrophobicContact CB-CG 4.16Å; N391-Q394 PolarHBondContact ND2-OE1 2.99Å; N391-Q394 WeakPolarHBondContact O-CB 3.42Å; N391-Q394 PolarHBondContact O-N 3.32Å; N391-E395 PolarHBondContact O-N 3.35Å |
| 392 | R | 75.7 | Confident | 60.7 | Low | 151 Ų | 151 | 95.9 Ų | 95.9 | 57% | 0.57 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -48.1 | -28.8 | 177.6 | -178.5 | -178.3 | 173.6 | -166.8 | -1.3 | 112.9 | P390 L396 R456 | P390-R392 PolarHBondContact O-N 3.21Å; P390-R392 VanDerWaalsContact O-N 3.14Å; R392-L396 PolarHBondContact O-N 3.05Å; R392-L396 VanDerWaalsContact O-N 3.15Å; R392-R456 PolarHBondContact O-NH2 3.49Å |
| 393 | W | 74.4 | Confident | 62.2 | Low | 148 Ų | 148 | 96 Ų | 96 | 56% | 0.561 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -75 | -37.3 | 175.8 | -54.6 | 108.9 | 0 | 0 | 0 | 114.2 | I51 M56 N391 L396 Q397 | I51-W393 HydrophobicContact CD1-CB 3.77Å; I51-W393 HydrophobicContact CG1-CB 4.16Å; I51-W393 HydrophobicContact CG2-CB 3.99Å; M56-W393 HydrophobicContact CE-CE3 4.22Å; M56-W393 HydrophobicContact CE-CZ3 3.88Å; M56-W393 HydrophobicContact SD-CE3 3.87Å; M56-W393 HydrophobicContact SD-CZ3 4.14Å; N391-W393 PolarHBondContact O-N 3.42Å; W393-L396 PolarHBondContact O-N 2.85Å; W393-Q397 WeakPolarHBondContact O-CB 3.46Å; W393-Q397 PolarHBondContact O-N 3.38Å |
| 394 | Q | 75 | Confident | 63.9 | Low | 56 Ų | 56 | 90.5 Ų | 90.5 | 26% | 0.262 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65 | -42.2 | 172 | -73.3 | 176.4 | -82.7 | 0 | 0 | 110.5 | I51 N391 L396 Q397 A398 | I51-Q394 HydrophobicContact CD1-CG 4.06Å; I51-Q394 HydrophobicContact CG1-CG 3.51Å; N391-Q394 HydrophobicContact CB-CB 4.4Å; N391-Q394 HydrophobicContact CB-CG 4.16Å; N391-Q394 PolarHBondContact ND2-OE1 2.99Å; N391-Q394 WeakPolarHBondContact O-CB 3.42Å; N391-Q394 PolarHBondContact O-N 3.32Å; Q394-L396 VanDerWaalsContact C-N 3.28Å; Q394-L396 PolarHBondContact O-N 3.48Å; Q394-Q397 PolarHBondContact O-N 3.23Å; Q394-A398 WeakPolarHBondContact O-CB 3.31Å; Q394-A398 PolarHBondContact O-N 3.45Å |
| 395 | E | 78.8 | Confident | 64.9 | Low | 79 Ų | 79 | 86.9 Ų | 86.9 | 37% | 0.369 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -57 | -42.9 | 171.7 | -58.2 | 174.6 | 163.8 | 0 | 0 | 111.7 | N391 A398 D399 R456 | N391-E395 PolarHBondContact O-N 3.35Å; E395-A398 PolarHBondContact O-N 3.47Å; E395-D399 WeakPolarHBondContact O-CB 3.33Å; E395-D399 PolarHBondContact O-N 2.95Å; E395-R456 IonicContact OE2-CZ 3.44Å; E395-R456 IonicContact OE2-NH1 2.72Å; E395-R456 PolarHBondContact OE2-NH1 2.96Å; E395-R456 IonicContact OE2-NH2 3.18Å; E395-R456 PolarHBondContact OE2-NH2 2.67Å |
| 396 | L | 76 | Confident | 65.9 | Low | 30 Ų | 30 | 84.9 Ų | 84.9 | 16% | 0.157 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -71.9 | -39.4 | -178.1 | -157 | 88 | 0 | 0 | 0 | 111.9 | M56 R392 W393 Q394 A398 D399 L400 | M56-L396 HydrophobicContact CE-CD2 3.6Å; M56-L396 HydrophobicContact CG-CD2 4.36Å; M56-L396 HydrophobicContact SD-CD2 3.83Å; R392-L396 PolarHBondContact O-N 3.05Å; R392-L396 VanDerWaalsContact O-N 3.15Å; W393-L396 PolarHBondContact O-N 2.85Å; Q394-L396 VanDerWaalsContact C-N 3.28Å; Q394-L396 PolarHBondContact O-N 3.48Å; L396-A398 VanDerWaalsContact C-N 3.31Å; L396-D399 PolarHBondContact O-N 3.33Å; L396-L400 HydrophobicContact CD2-CD1 4.17Å; L396-L400 HydrophobicContact CG-CD1 4.2Å; L396-L400 WeakPolarHBondContact O-CB 3.28Å; L396-L400 WeakPolarHBondContact O-CD1 3.44Å; L396-L400 VanDerWaalsContact O-CG 3.23Å; L396-L400 WeakPolarHBondContact O-CG 3.4Å; L396-L400 PolarHBondContact O-N 2.96Å |
| 397 | Q | 76.7 | Confident | 66.7 | Low | 18 Ų | 18 | 78 Ų | 78 | 8% | 0.084 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -63.6 | -40 | 174.4 | -172.9 | 176.2 | -19.2 | 0 | 0 | 110.4 | W393 Q394 I401 | W393-Q397 WeakPolarHBondContact O-CB 3.46Å; W393-Q397 PolarHBondContact O-N 3.38Å; Q394-Q397 PolarHBondContact O-N 3.23Å; Q397-I401 HydrophobicContact CG-CD1 4.02Å; Q397-I401 WeakPolarHBondContact O-CB 3.42Å; Q397-I401 WeakPolarHBondContact O-CD1 3.34Å; Q397-I401 WeakPolarHBondContact O-CG1 3.42Å; Q397-I401 PolarHBondContact O-N 2.75Å |
| 398 | A | 77.5 | Confident | 67.7 | Low | 58 Ų | 58 | 74.5 Ų | 74.5 | 48% | 0.479 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -65 | -46.4 | 173 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q394 E395 L396 L400 I401 D402 | Q394-A398 WeakPolarHBondContact O-CB 3.31Å; Q394-A398 PolarHBondContact O-N 3.45Å; E395-A398 PolarHBondContact O-N 3.47Å; L396-A398 VanDerWaalsContact C-N 3.31Å; A398-L400 VanDerWaalsContact C-N 3.35Å; A398-L400 PolarHBondContact O-N 3.02Å; A398-I401 PolarHBondContact O-N 3.2Å; A398-D402 VanDerWaalsContact O-CB 3.23Å; A398-D402 WeakPolarHBondContact O-CB 3.33Å; A398-D402 PolarHBondContact O-N 3.25Å |
| 399 | D | 77.4 | Confident | 68.9 | Low | 60 Ų | 60 | 77 Ų | 77 | 32% | 0.321 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -58.5 | -44 | 175.1 | -178.5 | 64.2 | 0 | 0 | 0 | 111.6 | E395 L396 D402 R403 | E395-D399 WeakPolarHBondContact O-CB 3.33Å; E395-D399 PolarHBondContact O-N 2.95Å; L396-D399 PolarHBondContact O-N 3.33Å; D399-D402 PolarHBondContact O-N 2.91Å; D399-R403 VanDerWaalsContact O-CB 3.25Å; D399-R403 WeakPolarHBondContact O-CB 3.38Å; D399-R403 WeakPolarHBondContact O-CD 3.37Å; D399-R403 WeakPolarHBondContact O-CG 3.25Å; D399-R403 PolarHBondContact O-N 2.86Å; D399-R403 WeakPolarHBondContact OD1-CD 3.2Å; D399-R403 WeakPolarHBondContact OD2-CD 3.03Å; D399-R403 IonicContact OD2-CZ 2.78Å; D399-R403 IonicContact OD2-NE 2.67Å; D399-R403 IonicContact OD2-NH1 2.75Å; D399-R403 PolarHBondContact OD2-NH1 3.42Å |
| 400 | L | 75 | Confident | 70 | Confident | 17 Ų | 17 | 66.9 Ų | 66.9 | 9% | 0.089 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -67.4 | -40 | 179.1 | -72.6 | 166.3 | 0 | 0 | 0 | 112.7 | M56 L396 A398 R403 D404 | M56-L400 HydrophobicContact CB-CD1 4.44Å; M56-L400 HydrophobicContact CG-CD1 3.67Å; L396-L400 HydrophobicContact CD2-CD1 4.17Å; L396-L400 HydrophobicContact CG-CD1 4.2Å; L396-L400 WeakPolarHBondContact O-CB 3.28Å; L396-L400 WeakPolarHBondContact O-CD1 3.44Å; L396-L400 VanDerWaalsContact O-CG 3.23Å; L396-L400 WeakPolarHBondContact O-CG 3.4Å; L396-L400 PolarHBondContact O-N 2.96Å; A398-L400 VanDerWaalsContact C-N 3.35Å; A398-L400 PolarHBondContact O-N 3.02Å; L400-R403 PolarHBondContact O-N 3.44Å; L400-D404 WeakPolarHBondContact O-CB 3.4Å; L400-D404 PolarHBondContact O-N 2.88Å |
| 401 | I | 74.1 | Confident | 70.9 | Confident | 60 Ų | 60 | 64.6 Ų | 64.6 | 31% | 0.308 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66 | -42.5 | 174.2 | -71 | 164.9 | 0 | 0 | 0 | 110.9 | Y59 Q397 A398 D404 S405 | Y59-I401 HydrophobicContact CD2-CG1 3.75Å; Y59-I401 HydrophobicContact CE2-CD1 4.08Å; Y59-I401 HydrophobicContact CE2-CG1 3.42Å; Y59-I401 VanDerWaalsContact CE2-CG1 3.42Å; Y59-I401 HydrophobicContact CG-CG1 4.48Å; Q397-I401 HydrophobicContact CG-CD1 4.02Å; Q397-I401 WeakPolarHBondContact O-CB 3.42Å; Q397-I401 WeakPolarHBondContact O-CD1 3.34Å; Q397-I401 WeakPolarHBondContact O-CG1 3.42Å; Q397-I401 PolarHBondContact O-N 2.75Å; A398-I401 PolarHBondContact O-N 3.2Å; I401-D404 PolarHBondContact O-N 3.32Å; I401-S405 WeakPolarHBondContact O-CB 3.44Å; I401-S405 PolarHBondContact O-N 3.22Å; I401-S405 PolarHBondContact O-OG 3.03Å |
| 402 | D | 72.2 | Confident | 71.4 | Confident | 65 Ų | 65 | 61.4 Ų | 61.4 | 35% | 0.348 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.3 | -39.2 | 176.6 | 179.3 | 76.1 | 0 | 0 | 0 | 111.9 | A398 D399 S405 K406 | A398-D402 VanDerWaalsContact O-CB 3.23Å; A398-D402 WeakPolarHBondContact O-CB 3.33Å; A398-D402 PolarHBondContact O-N 3.25Å; D399-D402 PolarHBondContact O-N 2.91Å; D402-S405 WeakPolarHBondContact O-CB 3.47Å; D402-S405 PolarHBondContact O-N 3.22Å; D402-K406 WeakPolarHBondContact O-CB 3.42Å; D402-K406 WeakPolarHBondContact O-CG 3.39Å; D402-K406 PolarHBondContact O-N 3.48Å; D402-K406 WeakPolarHBondContact OD1-CE 3.3Å; D402-K406 IonicContact OD1-NZ 3.68Å; D402-K406 PolarHBondContact OD1-NZ 3.03Å; D402-K406 WeakPolarHBondContact OD2-CD 3.35Å; D402-K406 VanDerWaalsContact OD2-CE 3.3Å; D402-K406 WeakPolarHBondContact OD2-CE 3.4Å; D402-K406 IonicContact OD2-NZ 3.26Å; D402-K406 PolarHBondContact OD2-NZ 3.48Å |
| 403 | R | 69.4 | Low | 71.7 | Confident | 98 Ų | 98 | 55.6 Ų | 55.6 | 37% | 0.37 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -72.4 | -35.8 | 177 | -72.2 | 161 | 70.3 | 151.3 | 11.5 | 113.3 | Q63 D399 L400 S405 G407 | Q63-R403 VanDerWaalsContact NE2-NH2 3.16Å; D399-R403 VanDerWaalsContact O-CB 3.25Å; D399-R403 WeakPolarHBondContact O-CB 3.38Å; D399-R403 WeakPolarHBondContact O-CD 3.37Å; D399-R403 WeakPolarHBondContact O-CG 3.25Å; D399-R403 PolarHBondContact O-N 2.86Å; D399-R403 WeakPolarHBondContact OD1-CD 3.2Å; D399-R403 WeakPolarHBondContact OD2-CD 3.03Å; D399-R403 IonicContact OD2-CZ 2.78Å; D399-R403 IonicContact OD2-NE 2.67Å; D399-R403 IonicContact OD2-NH1 2.75Å; D399-R403 PolarHBondContact OD2-NH1 3.42Å; L400-R403 PolarHBondContact O-N 3.44Å; R403-S405 VanDerWaalsContact C-N 3.33Å; R403-G407 CarbonylContact O-C 3.58Å; R403-G407 VanDerWaalsContact O-CA 3.31Å; R403-G407 WeakPolarHBondContact O-CA 3.3Å; R403-G407 PolarHBondContact O-N 3.35Å |
| 404 | D | 68 | Low | 72.3 | Confident | 38 Ų | 38 | 49.6 Ų | 49.6 | 20% | 0.203 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 169.7 | -170 | 53.2 | 0 | 0 | 0 | 110.8 | Y59 K62 T273 L400 I401 G407 | Y59-D404 HydrophobicContact CD1-CB 3.75Å; Y59-D404 HydrophobicContact CE1-CB 4.14Å; Y59-D404 WeakPolarHBondContact CE1-OD2 3.28Å; K62-D404 VanDerWaalsContact CD-OD1 3.29Å; K62-D404 WeakPolarHBondContact CD-OD1 3.17Å; K62-D404 WeakPolarHBondContact CE-OD1 3.26Å; K62-D404 IonicContact NZ-OD1 3.74Å; K62-D404 PolarHBondContact NZ-OD1 2.87Å; K62-D404 IonicContact NZ-OD2 3.03Å; K62-D404 PolarHBondContact NZ-OD2 2.86Å; T273-D404 PolarHBondContact OG1-O 3.3Å; L400-D404 WeakPolarHBondContact O-CB 3.4Å; L400-D404 PolarHBondContact O-N 2.88Å; I401-D404 PolarHBondContact O-N 3.32Å; D404-G407 PolarHBondContact O-N 2.93Å |
| 405 | S | 58.8 | Low | 73.1 | Confident | 64 Ų | 64 | 47.1 Ų | 47.1 | 45% | 0.448 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -65.7 | -41.6 | 179.1 | -58.1 | 0 | 0 | 0 | 0 | 113.3 | T273 I401 D402 R403 | T273-S405 WeakPolarHBondContact CG2-O 3.41Å; I401-S405 WeakPolarHBondContact O-CB 3.44Å; I401-S405 PolarHBondContact O-N 3.22Å; I401-S405 PolarHBondContact O-OG 3.03Å; D402-S405 WeakPolarHBondContact O-CB 3.47Å; D402-S405 PolarHBondContact O-N 3.22Å; R403-S405 VanDerWaalsContact C-N 3.33Å |
| 406 | K | 57.2 | Low | 73.8 | Confident | 117 Ų | 117 | 43.6 Ų | 43.6 | 51% | 0.509 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -81.8 | -22.1 | 178 | -72 | 172.8 | -175.9 | 160.7 | 0 | 113.2 | D402 | D402-K406 WeakPolarHBondContact O-CB 3.42Å; D402-K406 WeakPolarHBondContact O-CG 3.39Å; D402-K406 PolarHBondContact O-N 3.48Å; D402-K406 WeakPolarHBondContact OD1-CE 3.3Å; D402-K406 IonicContact OD1-NZ 3.68Å; D402-K406 PolarHBondContact OD1-NZ 3.03Å; D402-K406 WeakPolarHBondContact OD2-CD 3.35Å; D402-K406 VanDerWaalsContact OD2-CE 3.3Å; D402-K406 WeakPolarHBondContact OD2-CE 3.4Å; D402-K406 IonicContact OD2-NZ 3.26Å; D402-K406 PolarHBondContact OD2-NZ 3.48Å |
| 407 | G | 60 | Low | 74.6 | Confident | 10 Ų | 10 | 43.8 Ų | 43.8 | 10% | 0.103 | 24% | 0.243 | C | C | . | . | trans | 83.3 | 150 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | T273 R403 D404 | T273-G407 WeakPolarHBondContact OG1-CA 3.45Å; R403-G407 CarbonylContact O-C 3.58Å; R403-G407 VanDerWaalsContact O-CA 3.31Å; R403-G407 WeakPolarHBondContact O-CA 3.3Å; R403-G407 PolarHBondContact O-N 3.35Å; D404-G407 PolarHBondContact O-N 2.93Å | ||
| 408 | V | 62.7 | Low | 75.5 | Confident | 24 Ų | 24 | 43.1 Ų | 43.1 | 15% | 0.145 | 24% | 0.239 | C | C | . | . | trans | -69.2 | 131.8 | 170.3 | -173.4 | 0 | 0 | 0 | 0 | 108.1 | Q63 L67 T272 | Q63-V408 HydrophobicContact CB-CG2 4.28Å; Q63-V408 HydrophobicContact CG-CG2 3.79Å; L67-V408 HydrophobicContact CD1-CG1 4.36Å; T272-V408 HydrophobicContact CG2-CB 3.98Å; T272-V408 PolarHBondContact N-O 2.93Å; T272-V408 PolarHBondContact OG1-N 3.27Å | ||
| 409 | K | 68.6 | Low | 76.3 | Confident | 126 Ų | 126 | 40.3 Ų | 40.3 | 55% | 0.548 | 22% | 0.217 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 103.3 | 177.6 | -72 | -168.9 | 173 | 179.9 | 0 | 108.6 | L269 Y270 | L269-K409 HydrophobicContact CD1-CB 4.2Å; L269-K409 HydrophobicContact CD1-CD 4.36Å; L269-K409 HydrophobicContact CD2-CB 3.84Å; L269-K409 HydrophobicContact CD2-CD 3.91Å; L269-K409 HydrophobicContact CD2-CG 3.8Å; L269-K409 HydrophobicContact CG-CB 4.27Å; Y270-K409 CarbonylContact O-C 3.34Å; Y270-K409 WeakPolarHBondContact O-CA 3.46Å |
| 410 | L | 69.7 | Low | 77.2 | Confident | 20 Ų | 20 | 37.5 Ų | 37.5 | 11% | 0.105 | 20% | 0.202 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 142.7 | 179.6 | -157.2 | 68.6 | 0 | 0 | 0 | 110.3 | L67 V71 Y270 D414 F415 | L67-L410 HydrophobicContact CD1-CD1 3.99Å; L67-L410 HydrophobicContact CD2-CD1 4.26Å; L67-L410 HydrophobicContact CD2-CD2 3.72Å; L67-L410 HydrophobicContact CG-CD1 4.06Å; L67-L410 HydrophobicContact CG-CD2 3.94Å; V71-L410 HydrophobicContact CG2-CD2 3.9Å; Y270-L410 PolarHBondContact N-O 2.96Å; Y270-L410 PolarHBondContact O-N 3.49Å; L410-D414 WeakPolarHBondContact CD1-OD2 3.35Å; L410-D414 HydrophobicContact CD2-CB 4.37Å; L410-D414 HydrophobicContact CG-CB 4.36Å; L410-D414 WeakPolarHBondContact CG-OD2 3.45Å; L410-F415 HydrophobicContact CB-CE2 4.06Å; L410-F415 HydrophobicContact CB-CZ 4.36Å; L410-F415 HydrophobicContact CD2-CD2 4.35Å; L410-F415 HydrophobicContact CD2-CE1 4.41Å; L410-F415 HydrophobicContact CD2-CE2 3.65Å; L410-F415 HydrophobicContact CD2-CZ 3.69Å; L410-F415 HydrophobicContact CG-CE2 4.08Å; L410-F415 HydrophobicContact CG-CZ 4.48Å |
| 411 | G | 72.5 | Confident | 78.2 | Confident | 32 Ų | 32 | 36.7 Ų | 36.7 | 33% | 0.33 | 20% | 0.197 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -71 | 137.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | G413 D414 F415 | G411-G413 PolarHBondContact O-N 3.29Å; G411-D414 PolarHBondContact O-N 3.5Å; G411-F415 WeakPolarHBondContact O-CD2 3.48Å |
| 412 | L | 79.3 | Confident | 79.3 | Confident | 19 Ų | 19 | 33.9 Ų | 33.9 | 10% | 0.099 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.8 | -25.2 | 177.2 | -171.2 | 139.9 | 0 | 0 | 0 | 112.1 | L208 I215 L268 D414 F415 V416 | L208-L412 HydrophobicContact CB-CD1 4.17Å; L208-L412 HydrophobicContact CD2-CD1 3.78Å; I215-L412 HydrophobicContact CD1-CD2 4.11Å; L268-L412 WeakPolarHBondContact O-CB 3.29Å; L268-L412 PolarHBondContact O-N 3.47Å; L412-D414 PolarHBondContact O-N 3.33Å; L412-F415 PolarHBondContact O-N 3.43Å; L412-V416 HydrophobicContact CD2-CG2 3.91Å; L412-V416 WeakPolarHBondContact O-CG2 3.15Å; L412-V416 PolarHBondContact O-N 2.93Å |
| 413 | G | 83 | Confident | 80.4 | Confident | 29 Ų | 29 | 30.8 Ų | 30.8 | 30% | 0.299 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -58.9 | -39.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | G411 F415 V416 F417 | G411-G413 PolarHBondContact O-N 3.29Å; G413-F415 VanDerWaalsContact C-N 3.32Å; G413-F415 PolarHBondContact O-N 2.97Å; G413-V416 WeakPolarHBondContact O-CB 3.19Å; G413-V416 PolarHBondContact O-N 2.98Å; G413-F417 WeakPolarHBondContact O-CD2 3.43Å; G413-F417 WeakPolarHBondContact O-CG 3.3Å; G413-F417 PolarHBondContact O-N 3.42Å |
| 414 | D | 86.6 | Confident | 81.7 | Confident | 22 Ų | 22 | 26.2 Ų | 26.2 | 12% | 0.118 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.1 | -48.8 | -179.7 | -65.8 | -33.5 | 0 | 0 | 0 | 110.8 | L410 G411 L412 V416 F417 Y418 | L410-D414 WeakPolarHBondContact CD1-OD2 3.35Å; L410-D414 HydrophobicContact CD2-CB 4.37Å; L410-D414 HydrophobicContact CG-CB 4.36Å; L410-D414 WeakPolarHBondContact CG-OD2 3.45Å; G411-D414 PolarHBondContact O-N 3.5Å; L412-D414 PolarHBondContact O-N 3.33Å; D414-V416 VanDerWaalsContact C-N 3.32Å; D414-V416 PolarHBondContact O-N 3.19Å; D414-F417 PolarHBondContact O-N 3.14Å; D414-Y418 HydrophobicContact CB-CD2 4.35Å; D414-Y418 HydrophobicContact CB-CE2 3.87Å; D414-Y418 WeakPolarHBondContact O-CD2 3.32Å; D414-Y418 VanDerWaalsContact O-CG 3.25Å; D414-Y418 PolarHBondContact O-N 2.91Å |
| 415 | F | 91.2 | Very high | 83 | Confident | 3 Ų | 3 | 24.4 Ų | 24.4 | 1% | 0.013 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -58.1 | -42.8 | 175.5 | -58 | -97.1 | 0 | 0 | 0 | 112.2 | P70 V71 C74 S212 Y270 L410 G411 L412 G413 S419 | P70-F415 HydrophobicContact CB-CE1 3.86Å; P70-F415 HydrophobicContact CB-CZ 4.48Å; P70-F415 HydrophobicContact CG-CE1 4.05Å; P70-F415 HydrophobicContact CG-CZ 4.38Å; V71-F415 HydrophobicContact CB-CD1 4.35Å; V71-F415 HydrophobicContact CB-CE1 4.39Å; V71-F415 HydrophobicContact CG2-CD1 3.64Å; V71-F415 HydrophobicContact CG2-CE1 3.5Å; V71-F415 VanDerWaalsContact CG2-CE1 3.5Å; V71-F415 HydrophobicContact CG2-CG 4.37Å; V71-F415 HydrophobicContact CG2-CZ 4.16Å; C74-F415 HydrophobicContact CB-CD1 4.27Å; S212-F415 WeakPolarHBondContact OG-CB 3.48Å; Y270-F415 HydrophobicContact CD1-CZ 4.03Å; Y270-F415 HydrophobicContact CD2-CE2 4.41Å; Y270-F415 AromaticContact CD2-CZ 3.91Å; Y270-F415 HydrophobicContact CD2-CZ 3.91Å; Y270-F415 HydrophobicContact CE2-CZ 4.44Å; Y270-F415 HydrophobicContact CG-CE2 4.07Å; Y270-F415 AromaticContact CG-CZ 3.69Å; Y270-F415 HydrophobicContact CG-CZ 3.69Å; L410-F415 HydrophobicContact CB-CE2 4.06Å; L410-F415 HydrophobicContact CB-CZ 4.36Å; L410-F415 HydrophobicContact CD2-CD2 4.35Å; L410-F415 HydrophobicContact CD2-CE1 4.41Å; L410-F415 HydrophobicContact CD2-CE2 3.65Å; L410-F415 HydrophobicContact CD2-CZ 3.69Å; L410-F415 HydrophobicContact CG-CE2 4.08Å; L410-F415 HydrophobicContact CG-CZ 4.48Å; G411-F415 WeakPolarHBondContact O-CD2 3.48Å; L412-F415 PolarHBondContact O-N 3.43Å; G413-F415 VanDerWaalsContact C-N 3.32Å; G413-F415 PolarHBondContact O-N 2.97Å; F415-S419 WeakPolarHBondContact O-CB 3.49Å; F415-S419 PolarHBondContact O-N 3.07Å; F415-S419 PolarHBondContact O-OG 3.18Å |
| 416 | V | 93.4 | Very high | 84.7 | Confident | 5 Ų | 5 | 22.6 Ų | 22.6 | 3% | 0.03 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.9 | -47.7 | 179.4 | 174.5 | 0 | 0 | 0 | 0 | 110.7 | I215 F219 L412 G413 D414 S419 L420 | I215-V416 HydrophobicContact CB-CG1 4.27Å; I215-V416 HydrophobicContact CB-CG2 4.04Å; I215-V416 HydrophobicContact CD1-CG2 4.44Å; I215-V416 HydrophobicContact CG2-CG1 3.69Å; I215-V416 HydrophobicContact CG2-CG2 4.07Å; F219-V416 HydrophobicContact CD2-CG1 4.19Å; F219-V416 HydrophobicContact CE2-CG1 4.19Å; L412-V416 HydrophobicContact CD2-CG2 3.91Å; L412-V416 WeakPolarHBondContact O-CG2 3.15Å; L412-V416 PolarHBondContact O-N 2.93Å; G413-V416 WeakPolarHBondContact O-CB 3.19Å; G413-V416 PolarHBondContact O-N 2.98Å; D414-V416 VanDerWaalsContact C-N 3.32Å; D414-V416 PolarHBondContact O-N 3.19Å; V416-S419 PolarHBondContact O-N 2.97Å; V416-L420 WeakPolarHBondContact O-CB 3.2Å; V416-L420 PolarHBondContact O-N 3.04Å |
| 417 | F | 93.7 | Very high | 86.5 | Confident | 34 Ų | 34 | 18.7 Ų | 18.7 | 15% | 0.149 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -74.3 | -38.9 | -174.7 | -57.8 | -51.3 | 0 | 0 | 0 | 112.9 | L232 L235 G413 D414 S419 L420 L421 L462 I466 | L232-F417 HydrophobicContact CD2-CB 4.39Å; L235-F417 HydrophobicContact CD1-CD1 4.26Å; L235-F417 HydrophobicContact CD1-CE1 3.53Å; L235-F417 HydrophobicContact CD1-CZ 4.08Å; G413-F417 WeakPolarHBondContact O-CD2 3.43Å; G413-F417 WeakPolarHBondContact O-CG 3.3Å; G413-F417 PolarHBondContact O-N 3.42Å; D414-F417 PolarHBondContact O-N 3.14Å; F417-S419 VanDerWaalsContact C-N 3.35Å; F417-L420 PolarHBondContact O-N 3.41Å; F417-L421 VanDerWaalsContact O-CB 3.31Å; F417-L421 WeakPolarHBondContact O-CB 3.36Å; F417-L421 PolarHBondContact O-N 3.41Å; F417-L462 HydrophobicContact CD2-CD1 3.34Å; F417-L462 HydrophobicContact CD2-CG 4.04Å; F417-L462 HydrophobicContact CE2-CD1 3.69Å; F417-L462 HydrophobicContact CG-CD1 4.34Å; F417-I466 HydrophobicContact CB-CD1 4.04Å |
| 418 | Y | 94.6 | Very high | 88 | Confident | 4 Ų | 4 | 20.5 Ų | 20.5 | 2% | 0.016 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -64.9 | -40.4 | 173.1 | -60.3 | -38 | 0 | 0 | 0 | 111.9 | V71 M75 D414 I422 I441 M445 A461 L462 S465 I466 | V71-Y418 HydrophobicContact CG1-CD2 3.84Å; M75-Y418 HydrophobicContact CE-CG 4.21Å; D414-Y418 HydrophobicContact CB-CD2 4.35Å; D414-Y418 HydrophobicContact CB-CE2 3.87Å; D414-Y418 WeakPolarHBondContact O-CD2 3.32Å; D414-Y418 VanDerWaalsContact O-CG 3.25Å; D414-Y418 PolarHBondContact O-N 2.91Å; Y418-I422 WeakPolarHBondContact O-CG2 3.45Å; Y418-I422 PolarHBondContact O-N 2.98Å; Y418-I422 VanDerWaalsContact O-N 3.07Å; Y418-I441 HydrophobicContact CD1-CG2 3.45Å; Y418-I441 VanDerWaalsContact CD1-CG2 3.45Å; Y418-I441 HydrophobicContact CD2-CG2 4.49Å; Y418-I441 HydrophobicContact CE1-CG2 3.94Å; Y418-I441 HydrophobicContact CG-CG2 3.79Å; Y418-M445 HydrophobicContact CD2-CE 4.47Å; Y418-M445 HydrophobicContact CD2-SD 3.81Å; Y418-M445 HydrophobicContact CE1-CG 4.48Å; Y418-M445 HydrophobicContact CE2-CE 4.01Å; Y418-M445 HydrophobicContact CE2-CG 4Å; Y418-M445 HydrophobicContact CE2-SD 3.52Å; Y418-M445 VanDerWaalsContact CE2-SD 3.52Å; Y418-M445 HydrophobicContact CG-SD 4.47Å; Y418-A461 PolarHBondContact OH-O 2.93Å; Y418-L462 WeakPolarHBondContact OH-CA 3.02Å; Y418-S465 VanDerWaalsContact CE1-CB 3.47Å; Y418-S465 WeakPolarHBondContact OH-CB 3.34Å; Y418-S465 PolarHBondContact OH-OG 3.2Å; Y418-I466 HydrophobicContact CD1-CD1 3.59Å; Y418-I466 HydrophobicContact CD1-CG1 4.18Å; Y418-I466 HydrophobicContact CE1-CD1 3.93Å; Y418-I466 HydrophobicContact CE1-CG1 3.99Å |
| 419 | S | 95.9 | Very high | 89.2 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -70 | -34.9 | 177.4 | -54.8 | 0 | 0 | 0 | 0 | 112.3 | C74 V78 S216 F415 V416 F417 I422 G423 | C74-S419 PolarHBondContact SG-OG 3.37Å; C74-S419 VanDerWaalsContact SG-OG 3.37Å; V78-S419 WeakPolarHBondContact CG1-O 3.4Å; S216-S419 WeakPolarHBondContact OG-CB 3.3Å; S216-S419 PolarHBondContact OG-O 3.22Å; F415-S419 WeakPolarHBondContact O-CB 3.49Å; F415-S419 PolarHBondContact O-N 3.07Å; F415-S419 PolarHBondContact O-OG 3.18Å; V416-S419 PolarHBondContact O-N 2.97Å; F417-S419 VanDerWaalsContact C-N 3.35Å; S419-I422 WeakPolarHBondContact O-CG2 3.5Å; S419-G423 PolarHBondContact O-N 2.86Å |
| 420 | L | 95.9 | Very high | 90.3 | Very high | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.005 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -69.7 | -41.9 | 176.4 | 177.8 | 60.2 | 0 | 0 | 0 | 111.1 | S216 F219 L220 L232 V416 F417 R424 | S216-L420 VanDerWaalsContact OG-CA 3.28Å; S216-L420 WeakPolarHBondContact OG-CA 3.29Å; S216-L420 PolarHBondContact OG-N 3.17Å; F219-L420 HydrophobicContact CB-CD1 3.81Å; F219-L420 HydrophobicContact CB-CD2 3.75Å; F219-L420 HydrophobicContact CB-CG 4.43Å; F219-L420 HydrophobicContact CD2-CD2 4.08Å; F219-L420 HydrophobicContact CG-CD2 4.3Å; L220-L420 HydrophobicContact CB-CD1 4.08Å; L220-L420 HydrophobicContact CD1-CD1 4.25Å; L232-L420 HydrophobicContact CD1-CG 4.35Å; L232-L420 HydrophobicContact CD2-CB 4.27Å; L232-L420 HydrophobicContact CD2-CD2 3.92Å; L232-L420 HydrophobicContact CD2-CG 4.09Å; L232-L420 HydrophobicContact CG-CD2 4.23Å; L232-L420 HydrophobicContact CG-CG 4.4Å; V416-L420 WeakPolarHBondContact O-CB 3.2Å; V416-L420 PolarHBondContact O-N 3.04Å; F417-L420 PolarHBondContact O-N 3.41Å; L420-R424 VanDerWaalsContact O-CB 3.26Å; L420-R424 WeakPolarHBondContact O-CB 3.26Å; L420-R424 PolarHBondContact O-N 3.05Å |
| 421 | L | 96.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.3 | -48.9 | 176 | 175.1 | 57.7 | 0 | 0 | 0 | 111.7 | W229 L232 F417 R424 A425 I441 I466 I470 | W229-L421 HydrophobicContact CE3-CD1 4.25Å; W229-L421 HydrophobicContact CH2-CD1 3.93Å; W229-L421 HydrophobicContact CZ3-CD1 3.39Å; L232-L421 HydrophobicContact CD1-CB 4.1Å; L232-L421 HydrophobicContact CD1-CD1 4.13Å; L232-L421 HydrophobicContact CD2-CB 4.4Å; F417-L421 VanDerWaalsContact O-CB 3.31Å; F417-L421 WeakPolarHBondContact O-CB 3.36Å; F417-L421 PolarHBondContact O-N 3.41Å; L421-R424 PolarHBondContact O-N 3.47Å; L421-A425 PolarHBondContact O-N 3.32Å; L421-I441 HydrophobicContact CB-CD1 4.48Å; L421-I441 HydrophobicContact CD2-CD1 3.79Å; L421-I441 HydrophobicContact CD2-CG1 3.96Å; L421-I441 HydrophobicContact CG-CD1 4.06Å; L421-I466 HydrophobicContact CB-CD1 4.17Å; L421-I466 HydrophobicContact CD2-CD1 3.65Å; L421-I466 HydrophobicContact CD2-CG2 4.49Å; L421-I470 HydrophobicContact CD1-CG1 3.65Å; L421-I470 HydrophobicContact CD2-CG1 4.3Å |
| 422 | I | 96.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -70.9 | -38 | 179.2 | -163.8 | 64.8 | 0 | 0 | 0 | 112.1 | M75 V79 Y418 S419 R424 A425 T426 V434 C437 I441 | M75-I422 HydrophobicContact CB-CG2 4.11Å; M75-I422 HydrophobicContact CG-CG2 4.21Å; V79-I422 HydrophobicContact CG2-CB 4.35Å; V79-I422 HydrophobicContact CG2-CG1 3.56Å; V79-I422 HydrophobicContact CG2-CG2 3.91Å; Y418-I422 WeakPolarHBondContact O-CG2 3.45Å; Y418-I422 PolarHBondContact O-N 2.98Å; Y418-I422 VanDerWaalsContact O-N 3.07Å; S419-I422 WeakPolarHBondContact O-CG2 3.5Å; I422-R424 VanDerWaalsContact C-N 3.31Å; I422-R424 PolarHBondContact O-N 3.4Å; I422-A425 WeakPolarHBondContact O-CB 3.14Å; I422-A425 PolarHBondContact O-N 3Å; I422-T426 PolarHBondContact O-N 3.18Å; I422-T426 PolarHBondContact O-OG1 3.26Å; I422-T426 VanDerWaalsContact O-OG1 3.07Å; I422-V434 HydrophobicContact CD1-CG1 3.72Å; I422-V434 VanDerWaalsContact CD1-O 3.24Å; I422-V434 WeakPolarHBondContact CD1-O 3.29Å; I422-V434 HydrophobicContact CG1-CG1 4.09Å; I422-C437 HydrophobicContact CD1-CB 3.89Å; I422-I441 HydrophobicContact CB-CD1 4.45Å |
| 423 | G | 96.3 | Very high | 93 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63 | -35.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | S419 T426 L427 | S419-G423 PolarHBondContact O-N 2.86Å; G423-T426 PolarHBondContact O-N 3.04Å; G423-L427 PolarHBondContact O-N 2.6Å |
| 424 | R | 95.1 | Very high | 93.6 | Very high | 2 Ų | 2 | 20.6 Ų | 20.6 | 1% | 0.008 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -66.3 | -42.6 | 172.8 | -169.3 | 71 | -129 | 156.6 | 12.1 | 111.6 | L220 W229 L420 L421 I422 T426 L427 D428 | L220-R424 HydrophobicContact CD1-CB 4.11Å; W229-R424 HydrophobicContact CD2-CG 4.2Å; W229-R424 VanDerWaalsContact CE2-CG 3.46Å; W229-R424 HydrophobicContact CH2-CG 4.4Å; W229-R424 HydrophobicContact CZ2-CB 4.16Å; W229-R424 HydrophobicContact CZ2-CG 3.57Å; L420-R424 VanDerWaalsContact O-CB 3.26Å; L420-R424 WeakPolarHBondContact O-CB 3.26Å; L420-R424 PolarHBondContact O-N 3.05Å; L421-R424 PolarHBondContact O-N 3.47Å; I422-R424 VanDerWaalsContact C-N 3.31Å; I422-R424 PolarHBondContact O-N 3.4Å; R424-T426 VanDerWaalsContact C-N 3.34Å; R424-T426 PolarHBondContact O-N 2.77Å; R424-L427 PolarHBondContact O-N 3.25Å; R424-D428 IonicContact CZ-OD1 3.66Å; R424-D428 IonicContact CZ-OD2 3.93Å; R424-D428 VanDerWaalsContact CZ-OD2 3.31Å; R424-D428 IonicContact NE-OD1 2.77Å; R424-D428 IonicContact NE-OD2 2.7Å; R424-D428 PolarHBondContact NE-OD2 3.29Å; R424-D428 IonicContact NH2-OD1 2.94Å; R424-D428 PolarHBondContact NH2-OD1 3.37Å; R424-D428 IonicContact NH2-OD2 2.73Å; R424-D428 PolarHBondContact NH2-OD2 2.81Å; R424-D428 PolarHBondContact O-N 2.82Å |
| 425 | A | 95.6 | Very high | 94 | Very high | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.1 | -43.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L421 I422 L427 D428 G429 V434 C437 Y473 | L421-A425 PolarHBondContact O-N 3.32Å; I422-A425 WeakPolarHBondContact O-CB 3.14Å; I422-A425 PolarHBondContact O-N 3Å; A425-L427 PolarHBondContact O-N 3.07Å; A425-D428 PolarHBondContact O-N 2.88Å; A425-G429 PolarHBondContact O-N 2.93Å; A425-V434 HydrophobicContact CB-CG2 4.42Å; A425-C437 HydrophobicContact CB-CB 4.47Å; A425-Y473 HydrophobicContact CB-CD2 3.62Å; A425-Y473 HydrophobicContact CB-CE2 3.8Å |
| 426 | T | 95.8 | Very high | 94.2 | Very high | 26 Ų | 26 | 25.3 Ų | 25.3 | 16% | 0.16 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.6 | -25.3 | 177.3 | -56.5 | 0 | 0 | 0 | 0 | 114.3 | V79 A82 I422 G423 R424 | V79-T426 HydrophobicContact CG1-CG2 4.38Å; A82-T426 HydrophobicContact CB-CG2 4.09Å; I422-T426 PolarHBondContact O-N 3.18Å; I422-T426 PolarHBondContact O-OG1 3.26Å; I422-T426 VanDerWaalsContact O-OG1 3.07Å; G423-T426 PolarHBondContact O-N 3.04Å; R424-T426 VanDerWaalsContact C-N 3.34Å; R424-T426 PolarHBondContact O-N 2.77Å |
| 427 | L | 94.2 | Very high | 94.2 | Very high | 36 Ų | 36 | 25.1 Ų | 25.1 | 19% | 0.188 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -96.1 | -9.1 | 178.6 | -64.8 | -176.3 | 0 | 0 | 0 | 114.7 | A82 Y88 L220 G423 R424 A425 | A82-L427 HydrophobicContact CB-CD2 4.29Å; A82-L427 HydrophobicContact CB-CG 4.48Å; A82-L427 WeakPolarHBondContact O-CD2 3.5Å; Y88-L427 WeakPolarHBondContact O-CD1 3.5Å; L220-L427 HydrophobicContact CD1-CD1 3.74Å; L220-L427 HydrophobicContact CD2-CD1 3.7Å; L220-L427 HydrophobicContact CD2-CG 4.33Å; L220-L427 HydrophobicContact CG-CD1 3.56Å; G423-L427 PolarHBondContact O-N 2.6Å; R424-L427 PolarHBondContact O-N 3.25Å; A425-L427 PolarHBondContact O-N 3.07Å |
| 428 | D | 91.5 | Very high | 94.3 | Very high | 47 Ų | 47 | 25.9 Ų | 25.9 | 25% | 0.251 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -121.3 | -15.8 | -176.6 | -75.4 | -27.8 | 0 | 0 | 0 | 114.2 | K225 W229 R424 A425 Y473 | K225-D428 WeakPolarHBondContact CD-OD1 3.46Å; K225-D428 WeakPolarHBondContact CE-OD1 3.25Å; K225-D428 IonicContact NZ-OD1 3.76Å; K225-D428 PolarHBondContact NZ-OD1 3.45Å; W229-D428 PolarHBondContact NE1-OD2 3.46Å; R424-D428 IonicContact CZ-OD1 3.66Å; R424-D428 IonicContact CZ-OD2 3.93Å; R424-D428 VanDerWaalsContact CZ-OD2 3.31Å; R424-D428 IonicContact NE-OD1 2.77Å; R424-D428 IonicContact NE-OD2 2.7Å; R424-D428 PolarHBondContact NE-OD2 3.29Å; R424-D428 IonicContact NH2-OD1 2.94Å; R424-D428 PolarHBondContact NH2-OD1 3.37Å; R424-D428 IonicContact NH2-OD2 2.73Å; R424-D428 PolarHBondContact NH2-OD2 2.81Å; R424-D428 PolarHBondContact O-N 2.82Å; A425-D428 PolarHBondContact O-N 2.88Å; D428-Y473 WeakPolarHBondContact CB-OH 3.41Å |
| 429 | G | 88.1 | Confident | 94.4 | Very high | 20 Ų | 20 | 29.2 Ų | 29.2 | 21% | 0.206 | 18% | 0.179 | C | C | . | . | S | Bend | trans | -150.5 | 168.8 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | A425 T433 | A425-G429 PolarHBondContact O-N 2.93Å; G429-T433 VanDerWaalsContact C-OG1 3.31Å |
| 430 | D | 91.5 | Very high | 94.3 | Very high | 76 Ų | 76 | 29.4 Ų | 29.4 | 41% | 0.406 | 18% | 0.18 | S | C | . | . | trans | -67.2 | 160.1 | -170.7 | -40.5 | -70.2 | 0 | 0 | 0 | 112.8 | V432 T433 V434 S481 | D430-V432 PolarHBondContact O-N 3.45Å; D430-T433 HydrophobicContact CB-CG2 4.41Å; D430-T433 PolarHBondContact N-OG1 3.39Å; D430-T433 WeakPolarHBondContact O-CA 3.14Å; D430-T433 WeakPolarHBondContact O-CB 3.47Å; D430-T433 PolarHBondContact O-N 3.49Å; D430-T433 PolarHBondContact O-OG1 2.9Å; D430-V434 PolarHBondContact O-N 2.95Å; D430-S481 VanDerWaalsContact OD2-CB 3.3Å; D430-S481 WeakPolarHBondContact OD2-CB 3.32Å; D430-S481 PolarHBondContact OD2-OG 3.36Å | ||
| 431 | A | 92.4 | Very high | 94.3 | Very high | 78 Ų | 78 | 29.4 Ų | 29.4 | 65% | 0.645 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -52 | -31 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | V435 | A431-V435 WeakPolarHBondContact O-CG2 3.36Å; A431-V435 PolarHBondContact O-N 3.48Å |
| 432 | V | 92.8 | Very high | 94.1 | Very high | 63 Ų | 63 | 30.7 Ų | 30.7 | 38% | 0.382 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -67.8 | -43.9 | 173.4 | -175.6 | 0 | 0 | 0 | 0 | 111.7 | D430 V434 V435 T436 I480 L484 | D430-V432 PolarHBondContact O-N 3.45Å; V432-V434 VanDerWaalsContact C-N 3.27Å; V432-V434 PolarHBondContact O-N 3.37Å; V432-V435 PolarHBondContact O-N 3.24Å; V432-T436 WeakPolarHBondContact O-CB 3.42Å; V432-T436 PolarHBondContact O-N 3.3Å; V432-T436 PolarHBondContact O-OG1 2.94Å; V432-T436 VanDerWaalsContact O-OG1 3.07Å; V432-I480 HydrophobicContact CG1-CG2 4.29Å; V432-L484 HydrophobicContact CB-CD1 4.35Å; V432-L484 HydrophobicContact CG1-CD1 3.74Å; V432-L484 HydrophobicContact CG2-CD1 4.14Å |
| 433 | T | 94 | Very high | 94 | Very high | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.006 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.1 | -36.8 | 176.7 | 74.9 | 0 | 0 | 0 | 0 | 111.3 | G429 D430 C437 S481 | G429-T433 VanDerWaalsContact C-OG1 3.31Å; D430-T433 HydrophobicContact CB-CG2 4.41Å; D430-T433 PolarHBondContact N-OG1 3.39Å; D430-T433 WeakPolarHBondContact O-CA 3.14Å; D430-T433 WeakPolarHBondContact O-CB 3.47Å; D430-T433 PolarHBondContact O-N 3.49Å; D430-T433 PolarHBondContact O-OG1 2.9Å; T433-C437 WeakPolarHBondContact O-CB 3.44Å; T433-C437 PolarHBondContact O-N 3.01Å; T433-S481 WeakPolarHBondContact CG2-OG 3.3Å |
| 434 | V | 95.4 | Very high | 93.7 | Very high | 15 Ų | 15 | 34.1 Ų | 34.1 | 9% | 0.091 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63.5 | -52.1 | 173.7 | -178.6 | 0 | 0 | 0 | 0 | 110.4 | V79 I422 A425 D430 V432 T436 C437 Y438 | V79-V434 HydrophobicContact CG1-CG1 4.35Å; V79-V434 HydrophobicContact CG2-CG1 4.32Å; I422-V434 HydrophobicContact CD1-CG1 3.72Å; I422-V434 VanDerWaalsContact CD1-O 3.24Å; I422-V434 WeakPolarHBondContact CD1-O 3.29Å; I422-V434 HydrophobicContact CG1-CG1 4.09Å; A425-V434 HydrophobicContact CB-CG2 4.42Å; D430-V434 PolarHBondContact O-N 2.95Å; V432-V434 VanDerWaalsContact C-N 3.27Å; V432-V434 PolarHBondContact O-N 3.37Å; V434-T436 PolarHBondContact O-N 2.95Å; V434-C437 PolarHBondContact O-N 3.44Å; V434-Y438 WeakPolarHBondContact O-CB 3.41Å; V434-Y438 PolarHBondContact O-N 3.03Å |
| 435 | V | 95 | Very high | 93.5 | Very high | 91 Ų | 91 | 34.3 Ų | 34.3 | 55% | 0.552 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -60.6 | -43.2 | 179 | 169.8 | 0 | 0 | 0 | 0 | 111.5 | A431 V432 Y438 V439 | A431-V435 WeakPolarHBondContact O-CG2 3.36Å; A431-V435 PolarHBondContact O-N 3.48Å; V432-V435 PolarHBondContact O-N 3.24Å; V435-Y438 PolarHBondContact O-N 3.15Å; V435-V439 WeakPolarHBondContact O-CG2 3.35Å; V435-V439 PolarHBondContact O-N 3.17Å |
| 436 | T | 94.4 | Very high | 93.1 | Very high | 33 Ų | 33 | 36.4 Ų | 36.4 | 20% | 0.202 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65.1 | -40.9 | 176.6 | -58.1 | 0 | 0 | 0 | 0 | 111.9 | V432 V434 V439 A440 F472 S476 | V432-T436 WeakPolarHBondContact O-CB 3.42Å; V432-T436 PolarHBondContact O-N 3.3Å; V432-T436 PolarHBondContact O-OG1 2.94Å; V432-T436 VanDerWaalsContact O-OG1 3.07Å; V434-T436 PolarHBondContact O-N 2.95Å; T436-V439 PolarHBondContact O-N 3.4Å; T436-A440 VanDerWaalsContact O-CB 3.24Å; T436-A440 WeakPolarHBondContact O-CB 3.39Å; T436-A440 PolarHBondContact O-N 2.98Å; T436-F472 HydrophobicContact CG2-CD1 3.93Å; T436-S476 WeakPolarHBondContact CG2-OG 3.49Å |
| 437 | C | 94.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.9 | -44.7 | 174.5 | -175.9 | 0 | 0 | 0 | 0 | 111.7 | I422 A425 T433 V434 V439 A440 I441 | I422-C437 HydrophobicContact CD1-CB 3.89Å; A425-C437 HydrophobicContact CB-CB 4.47Å; T433-C437 WeakPolarHBondContact O-CB 3.44Å; T433-C437 PolarHBondContact O-N 3.01Å; V434-C437 PolarHBondContact O-N 3.44Å; C437-V439 PolarHBondContact O-N 3.42Å; C437-A440 PolarHBondContact O-N 3.42Å; C437-I441 VanDerWaalsContact O-CG1 3.3Å; C437-I441 WeakPolarHBondContact O-CG1 3.49Å; C437-I441 PolarHBondContact O-N 2.94Å |
| 438 | Y | 95.5 | Very high | 92.5 | Very high | 50 Ų | 50 | 37.6 Ų | 37.6 | 20% | 0.196 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -58.8 | -47.8 | 176 | 171.5 | -98 | 0 | 0 | 0 | 111.9 | T72 M75 V434 V435 I441 L442 | T72-Y438 WeakPolarHBondContact CG2-OH 3.49Å; T72-Y438 PolarHBondContact OG1-OH 2.99Å; M75-Y438 HydrophobicContact CB-CD2 4.26Å; M75-Y438 HydrophobicContact CB-CE2 4.16Å; M75-Y438 HydrophobicContact SD-CD2 3.61Å; M75-Y438 HydrophobicContact SD-CE2 3.48Å; M75-Y438 WeakPolarHBondContact SD-CE2 3.29Å; V434-Y438 WeakPolarHBondContact O-CB 3.41Å; V434-Y438 PolarHBondContact O-N 3.03Å; V435-Y438 PolarHBondContact O-N 3.15Å; Y438-I441 PolarHBondContact O-N 3.34Å; Y438-L442 HydrophobicContact CD1-CD1 4.28Å; Y438-L442 HydrophobicContact CE1-CD1 3.6Å; Y438-L442 HydrophobicContact CE2-CD1 4.23Å; Y438-L442 PolarHBondContact O-N 2.98Å; Y438-L442 VanDerWaalsContact O-N 3.08Å |
| 439 | V | 95.5 | Very high | 92 | Very high | 75 Ų | 75 | 36.4 Ų | 36.4 | 46% | 0.455 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.3 | -41.9 | 175.2 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | V435 T436 C437 I441 L442 V443 | V435-V439 WeakPolarHBondContact O-CG2 3.35Å; V435-V439 PolarHBondContact O-N 3.17Å; T436-V439 PolarHBondContact O-N 3.4Å; C437-V439 PolarHBondContact O-N 3.42Å; V439-I441 VanDerWaalsContact C-N 3.35Å; V439-I441 PolarHBondContact O-N 3.39Å; V439-L442 PolarHBondContact O-N 3.33Å; V439-V443 HydrophobicContact CG1-CG2 4.09Å; V439-V443 WeakPolarHBondContact O-CB 3.38Å; V439-V443 VanDerWaalsContact O-CG2 3.3Å; V439-V443 WeakPolarHBondContact O-CG2 3.29Å; V439-V443 PolarHBondContact O-N 2.86Å |
| 440 | A | 95.3 | Very high | 91.9 | Very high | 4 Ų | 4 | 39.6 Ų | 39.6 | 3% | 0.033 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.4 | -36.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | T436 C437 G444 C468 F472 | T436-A440 VanDerWaalsContact O-CB 3.24Å; T436-A440 WeakPolarHBondContact O-CB 3.39Å; T436-A440 PolarHBondContact O-N 2.98Å; C437-A440 PolarHBondContact O-N 3.42Å; A440-G444 PolarHBondContact O-N 2.87Å; A440-C468 PolarHBondContact O-SG 2.63Å; A440-F472 HydrophobicContact CB-CB 3.48Å; A440-F472 VanDerWaalsContact CB-CB 3.48Å; A440-F472 HydrophobicContact CB-CD1 4.11Å; A440-F472 HydrophobicContact CB-CD2 4.03Å; A440-F472 HydrophobicContact CB-CG 3.6Å |
| 441 | I | 94.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67.3 | -48.3 | 173.3 | -61 | 161.5 | 0 | 0 | 0 | 110.1 | M75 Y418 L421 I422 C437 Y438 V439 V443 G444 M445 | M75-I441 HydrophobicContact CE-CB 3.94Å; M75-I441 HydrophobicContact CE-CD1 4.28Å; M75-I441 HydrophobicContact CE-CG2 3.39Å; Y418-I441 HydrophobicContact CD1-CG2 3.45Å; Y418-I441 VanDerWaalsContact CD1-CG2 3.45Å; Y418-I441 HydrophobicContact CD2-CG2 4.49Å; Y418-I441 HydrophobicContact CE1-CG2 3.94Å; Y418-I441 HydrophobicContact CG-CG2 3.79Å; L421-I441 HydrophobicContact CB-CD1 4.48Å; L421-I441 HydrophobicContact CD2-CD1 3.79Å; L421-I441 HydrophobicContact CD2-CG1 3.96Å; L421-I441 HydrophobicContact CG-CD1 4.06Å; I422-I441 HydrophobicContact CB-CD1 4.45Å; C437-I441 VanDerWaalsContact O-CG1 3.3Å; C437-I441 WeakPolarHBondContact O-CG1 3.49Å; C437-I441 PolarHBondContact O-N 2.94Å; Y438-I441 PolarHBondContact O-N 3.34Å; V439-I441 VanDerWaalsContact C-N 3.35Å; V439-I441 PolarHBondContact O-N 3.39Å; I441-V443 PolarHBondContact O-N 2.92Å; I441-G444 PolarHBondContact O-N 3.2Å; I441-M445 HydrophobicContact CG2-CG 4.37Å; I441-M445 HydrophobicContact CG2-SD 3.96Å; I441-M445 VanDerWaalsContact O-CG 3.31Å; I441-M445 WeakPolarHBondContact O-CG 3.29Å; I441-M445 PolarHBondContact O-N 2.94Å |
| 442 | L | 93.4 | Very high | 91 | Very high | 27 Ų | 27 | 36.7 Ų | 36.7 | 14% | 0.141 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.1 | -40.9 | 178.7 | -70.5 | -175.7 | 0 | 0 | 0 | 112.7 | F68 M75 Y438 V439 M445 C446 | F68-L442 HydrophobicContact CD2-CD2 3.98Å; F68-L442 HydrophobicContact CE2-CB 4.13Å; F68-L442 HydrophobicContact CE2-CD2 4.09Å; F68-L442 HydrophobicContact CG-CD2 4.5Å; F68-L442 VanDerWaalsContact CZ-O 3.28Å; F68-L442 WeakPolarHBondContact CZ-O 3.22Å; M75-L442 HydrophobicContact CE-CD2 4.46Å; M75-L442 HydrophobicContact SD-CD2 4.48Å; Y438-L442 HydrophobicContact CD1-CD1 4.28Å; Y438-L442 HydrophobicContact CE1-CD1 3.6Å; Y438-L442 HydrophobicContact CE2-CD1 4.23Å; Y438-L442 PolarHBondContact O-N 2.98Å; Y438-L442 VanDerWaalsContact O-N 3.08Å; V439-L442 PolarHBondContact O-N 3.33Å; L442-M445 HydrophobicContact CD2-SD 4.47Å; L442-M445 PolarHBondContact O-N 3.43Å; L442-C446 WeakPolarHBondContact O-CB 3.38Å; L442-C446 PolarHBondContact O-N 2.89Å |
| 443 | V | 92.8 | Very high | 90.2 | Very high | 71 Ų | 71 | 35.7 Ų | 35.7 | 43% | 0.43 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -66.5 | -42.5 | 174.8 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | V439 I441 M445 C446 I447 | V439-V443 HydrophobicContact CG1-CG2 4.09Å; V439-V443 WeakPolarHBondContact O-CB 3.38Å; V439-V443 VanDerWaalsContact O-CG2 3.3Å; V439-V443 WeakPolarHBondContact O-CG2 3.29Å; V439-V443 PolarHBondContact O-N 2.86Å; I441-V443 PolarHBondContact O-N 2.92Å; V443-M445 VanDerWaalsContact C-N 3.35Å; V443-M445 PolarHBondContact O-N 3.35Å; V443-C446 WeakPolarHBondContact O-CB 3.48Å; V443-C446 PolarHBondContact O-N 2.96Å; V443-C446 VanDerWaalsContact O-N 3.17Å; V443-I447 HydrophobicContact CG1-CD1 3.78Å; V443-I447 HydrophobicContact CG1-CG1 4.39Å; V443-I447 VanDerWaalsContact O-CG1 3.32Å; V443-I447 WeakPolarHBondContact O-CG1 3.18Å; V443-I447 PolarHBondContact O-N 3.29Å |
| 444 | G | 91.8 | Very high | 89.6 | Confident | 1 Ų | 1 | 41 Ų | 41 | 1% | 0.01 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.1 | -44.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A440 I441 T448 | A440-G444 PolarHBondContact O-N 2.87Å; I441-G444 PolarHBondContact O-N 3.2Å; G444-T448 VanDerWaalsContact O-CB 3.23Å; G444-T448 WeakPolarHBondContact O-CB 3.46Å; G444-T448 PolarHBondContact O-N 2.7Å; G444-T448 PolarHBondContact O-OG1 3.29Å |
| 445 | M | 89 | Confident | 88.9 | Confident | 7 Ų | 7 | 43.2 Ų | 43.2 | 3% | 0.034 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.4 | -39.7 | 174.2 | -70.8 | 171.6 | 62.3 | 0 | 0 | 112.1 | L67 F68 V71 Y418 I441 L442 V443 T448 V449 S465 | L67-M445 HydrophobicContact CD2-CE 3.34Å; F68-M445 HydrophobicContact CD1-CE 4.38Å; F68-M445 HydrophobicContact CE1-CB 4.03Å; F68-M445 HydrophobicContact CE1-CE 4.33Å; F68-M445 HydrophobicContact CZ-CB 4.14Å; V71-M445 HydrophobicContact CB-CE 4.17Å; V71-M445 HydrophobicContact CG1-CE 3.93Å; V71-M445 HydrophobicContact CG1-SD 4.02Å; V71-M445 HydrophobicContact CG2-CE 4.04Å; Y418-M445 HydrophobicContact CD2-CE 4.47Å; Y418-M445 HydrophobicContact CD2-SD 3.81Å; Y418-M445 HydrophobicContact CE1-CG 4.48Å; Y418-M445 HydrophobicContact CE2-CE 4.01Å; Y418-M445 HydrophobicContact CE2-CG 4Å; Y418-M445 HydrophobicContact CE2-SD 3.52Å; Y418-M445 VanDerWaalsContact CE2-SD 3.52Å; Y418-M445 HydrophobicContact CG-SD 4.47Å; I441-M445 HydrophobicContact CG2-CG 4.37Å; I441-M445 HydrophobicContact CG2-SD 3.96Å; I441-M445 VanDerWaalsContact O-CG 3.31Å; I441-M445 WeakPolarHBondContact O-CG 3.29Å; I441-M445 PolarHBondContact O-N 2.94Å; L442-M445 HydrophobicContact CD2-SD 4.47Å; L442-M445 PolarHBondContact O-N 3.43Å; V443-M445 VanDerWaalsContact C-N 3.35Å; V443-M445 PolarHBondContact O-N 3.35Å; M445-T448 WeakPolarHBondContact O-CB 3.33Å; M445-T448 PolarHBondContact O-N 2.73Å; M445-V449 WeakPolarHBondContact O-CG2 3.27Å; M445-V449 PolarHBondContact O-N 2.88Å; M445-S465 WeakPolarHBondContact CA-OG 3.47Å; M445-S465 PolarHBondContact N-OG 2.82Å |
| 446 | C | 88.9 | Confident | 87.7 | Confident | 43 Ų | 43 | 44.3 Ų | 44.3 | 29% | 0.291 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.4 | -52.7 | 177 | -167.7 | 0 | 0 | 0 | 0 | 111.3 | F68 L442 V443 T448 V449 I450 | F68-C446 HydrophobicContact CZ-CB 3.91Å; L442-C446 WeakPolarHBondContact O-CB 3.38Å; L442-C446 PolarHBondContact O-N 2.89Å; V443-C446 WeakPolarHBondContact O-CB 3.48Å; V443-C446 PolarHBondContact O-N 2.96Å; V443-C446 VanDerWaalsContact O-N 3.17Å; C446-T448 PolarHBondContact O-N 2.93Å; C446-V449 PolarHBondContact O-N 3.4Å; C446-I450 VanDerWaalsContact O-CG1 3.32Å; C446-I450 WeakPolarHBondContact O-CG1 3.21Å; C446-I450 PolarHBondContact O-N 3.47Å |
| 447 | I | 88.8 | Confident | 86.5 | Confident | 84 Ų | 84 | 48.9 Ų | 48.9 | 43% | 0.431 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -54.6 | -45 | 175.1 | -68.8 | 166.2 | 0 | 0 | 0 | 110 | V443 I450 V451 | V443-I447 HydrophobicContact CG1-CD1 3.78Å; V443-I447 HydrophobicContact CG1-CG1 4.39Å; V443-I447 VanDerWaalsContact O-CG1 3.32Å; V443-I447 WeakPolarHBondContact O-CG1 3.18Å; V443-I447 PolarHBondContact O-N 3.29Å; I447-I450 PolarHBondContact O-N 2.94Å; I447-V451 HydrophobicContact CG2-CG2 4.29Å; I447-V451 WeakPolarHBondContact O-CB 3.43Å; I447-V451 VanDerWaalsContact O-CG2 3.3Å; I447-V451 WeakPolarHBondContact O-CG2 3.3Å; I447-V451 PolarHBondContact O-N 2.99Å |
| 448 | T | 86.9 | Confident | 85.1 | Confident | 3 Ų | 3 | 53.3 Ų | 53.3 | 2% | 0.018 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61.1 | -47.5 | 179.4 | -63.5 | 0 | 0 | 0 | 0 | 112.4 | G444 M445 C446 I450 V451 L452 A461 | G444-T448 VanDerWaalsContact O-CB 3.23Å; G444-T448 WeakPolarHBondContact O-CB 3.46Å; G444-T448 PolarHBondContact O-N 2.7Å; G444-T448 PolarHBondContact O-OG1 3.29Å; M445-T448 WeakPolarHBondContact O-CB 3.33Å; M445-T448 PolarHBondContact O-N 2.73Å; C446-T448 PolarHBondContact O-N 2.93Å; T448-I450 VanDerWaalsContact C-N 3.31Å; T448-I450 PolarHBondContact O-N 3.27Å; T448-V451 PolarHBondContact O-N 3.16Å; T448-L452 HydrophobicContact CG2-CD1 4.18Å; T448-L452 WeakPolarHBondContact O-CB 3.31Å; T448-L452 VanDerWaalsContact O-CG 3.26Å; T448-L452 WeakPolarHBondContact O-CG 3.28Å; T448-L452 PolarHBondContact O-N 3.4Å; T448-A461 VanDerWaalsContact CG2-CA 3.47Å; T448-A461 HydrophobicContact CG2-CB 3.59Å |
| 449 | V | 82.8 | Confident | 83.9 | Confident | 22 Ų | 22 | 53.8 Ų | 53.8 | 13% | 0.133 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.1 | -35.7 | 177.3 | 176.6 | 0 | 0 | 0 | 0 | 111.6 | I64 L67 M445 C446 L452 G453 | I64-V449 HydrophobicContact CD1-CG1 4.3Å; I64-V449 HydrophobicContact CG1-CB 4.44Å; I64-V449 HydrophobicContact CG1-CG1 3.73Å; L67-V449 HydrophobicContact CD1-CG2 4.2Å; M445-V449 WeakPolarHBondContact O-CG2 3.27Å; M445-V449 PolarHBondContact O-N 2.88Å; C446-V449 PolarHBondContact O-N 3.4Å; V449-L452 PolarHBondContact O-N 3.33Å; V449-G453 PolarHBondContact O-N 3.39Å |
| 450 | I | 84.6 | Confident | 82.9 | Confident | 87 Ų | 87 | 51 Ų | 51 | 45% | 0.446 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.3 | -46.8 | 173.7 | -67.7 | 164.6 | 0 | 0 | 0 | 110.9 | C446 I447 T448 L452 G453 I454 | C446-I450 VanDerWaalsContact O-CG1 3.32Å; C446-I450 WeakPolarHBondContact O-CG1 3.21Å; C446-I450 PolarHBondContact O-N 3.47Å; I447-I450 PolarHBondContact O-N 2.94Å; T448-I450 VanDerWaalsContact C-N 3.31Å; T448-I450 PolarHBondContact O-N 3.27Å; I450-L452 PolarHBondContact O-N 2.93Å; I450-G453 PolarHBondContact O-N 3.16Å; I450-G453 VanDerWaalsContact O-N 3.17Å; I450-I454 HydrophobicContact CG2-CD1 3.77Å; I450-I454 WeakPolarHBondContact O-CG1 3.42Å; I450-I454 PolarHBondContact O-N 3.03Å |
| 451 | V | 85.6 | Confident | 81.9 | Confident | 49 Ų | 49 | 52 Ų | 52 | 30% | 0.297 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -62 | -41 | 177.1 | 168.6 | 0 | 0 | 0 | 0 | 111.5 | I447 T448 I454 T455 L459 | I447-V451 HydrophobicContact CG2-CG2 4.29Å; I447-V451 WeakPolarHBondContact O-CB 3.43Å; I447-V451 VanDerWaalsContact O-CG2 3.3Å; I447-V451 WeakPolarHBondContact O-CG2 3.3Å; I447-V451 PolarHBondContact O-N 2.99Å; T448-V451 PolarHBondContact O-N 3.16Å; V451-I454 PolarHBondContact O-N 3.29Å; V451-T455 HydrophobicContact CG1-CG2 4.18Å; V451-T455 WeakPolarHBondContact O-CB 3.46Å; V451-T455 WeakPolarHBondContact O-CG2 3.3Å; V451-T455 PolarHBondContact O-N 3.16Å; V451-T455 PolarHBondContact O-OG1 3.34Å; V451-L459 HydrophobicContact CG1-CD1 4.33Å |
| 452 | L | 79 | Confident | 81.1 | Confident | 44 Ų | 44 | 52.2 Ų | 52.2 | 23% | 0.23 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 173.3 | -71.4 | 170.5 | 0 | 0 | 0 | 111.8 | T448 V449 I450 R456 Q457 L459 | T448-L452 HydrophobicContact CG2-CD1 4.18Å; T448-L452 WeakPolarHBondContact O-CB 3.31Å; T448-L452 VanDerWaalsContact O-CG 3.26Å; T448-L452 WeakPolarHBondContact O-CG 3.28Å; T448-L452 PolarHBondContact O-N 3.4Å; V449-L452 PolarHBondContact O-N 3.33Å; I450-L452 PolarHBondContact O-N 2.93Å; L452-R456 WeakPolarHBondContact O-CA 3.22Å; L452-R456 PolarHBondContact O-N 3.49Å; L452-Q457 WeakPolarHBondContact CD2-O 3.49Å; L452-L459 HydrophobicContact CD2-CB 3.79Å; L452-L459 HydrophobicContact CD2-CG 4.44Å |
| 453 | G | 75.8 | Confident | 80.8 | Confident | 43 Ų | 43 | 51.4 Ų | 51.4 | 44% | 0.443 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64 | -38.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | V449 I450 | V449-G453 PolarHBondContact O-N 3.39Å; I450-G453 PolarHBondContact O-N 3.16Å; I450-G453 VanDerWaalsContact O-N 3.17Å |
| 454 | I | 83.1 | Confident | 80.5 | Confident | 113 Ų | 113 | 51.6 Ų | 51.6 | 58% | 0.579 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -73.9 | -47 | 179.1 | -68 | 167.1 | 0 | 0 | 0 | 111.5 | I450 V451 | I450-I454 HydrophobicContact CG2-CD1 3.77Å; I450-I454 WeakPolarHBondContact O-CG1 3.42Å; I450-I454 PolarHBondContact O-N 3.03Å; V451-I454 PolarHBondContact O-N 3.29Å |
| 455 | T | 80.4 | Confident | 80.5 | Confident | 61 Ų | 61 | 51.6 Ų | 51.6 | 37% | 0.374 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -79.6 | -23.9 | -173.6 | 57.6 | 0 | 0 | 0 | 0 | 113.9 | V451 Q457 | V451-T455 HydrophobicContact CG1-CG2 4.18Å; V451-T455 WeakPolarHBondContact O-CB 3.46Å; V451-T455 WeakPolarHBondContact O-CG2 3.3Å; V451-T455 PolarHBondContact O-N 3.16Å; V451-T455 PolarHBondContact O-OG1 3.34Å; T455-Q457 PolarHBondContact O-N 3.4Å; T455-Q457 VanDerWaalsContact O-N 3.09Å; T455-Q457 PolarHBondContact OG1-N 2.94Å |
| 456 | R | 69.6 | Low | 80.6 | Confident | 114 Ų | 114 | 51.2 Ų | 51.2 | 43% | 0.43 | 29% | 0.293 | S | S | . | . | trans | 53.7 | 15.9 | -168.9 | -70.5 | -169.7 | 175.5 | 173.3 | -0.4 | 114.4 | R392 E395 L452 | R392-R456 PolarHBondContact O-NH2 3.49Å; E395-R456 IonicContact OE2-CZ 3.44Å; E395-R456 IonicContact OE2-NH1 2.72Å; E395-R456 PolarHBondContact OE2-NH1 2.96Å; E395-R456 IonicContact OE2-NH2 3.18Å; E395-R456 PolarHBondContact OE2-NH2 2.67Å; L452-R456 WeakPolarHBondContact O-CA 3.22Å; L452-R456 PolarHBondContact O-N 3.49Å | ||
| 457 | Q | 68.8 | Low | 80.8 | Confident | 129 Ų | 129 | 53.1 Ų | 53.1 | 60% | 0.603 | 30% | 0.303 | S | S | * | . | S | Bend | trans | -98.6 | 141.4 | 175 | -68.3 | -174.5 | -2.2 | 0 | 0 | 110.4 | L452 T455 L459 | L452-Q457 WeakPolarHBondContact CD2-O 3.49Å; T455-Q457 PolarHBondContact O-N 3.4Å; T455-Q457 VanDerWaalsContact O-N 3.09Å; T455-Q457 PolarHBondContact OG1-N 2.94Å; Q457-L459 VanDerWaalsContact C-N 3.31Å; Q457-L459 PolarHBondContact O-N 3.47Å |
| 458 | A | 66.2 | Low | 80.9 | Confident | 93 Ų | 93 | 50.3 Ų | 50.3 | 77% | 0.769 | 29% | 0.29 | S | S | * | . | trans | -78.5 | 80 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 459 | L | 69.2 | Low | 81.2 | Confident | 59 Ų | 59 | 50.1 Ų | 50.1 | 31% | 0.309 | 29% | 0.29 | S | S | . | . | trans | -82.2 | 143.9 | 170 | -60.2 | 169.9 | 0 | 0 | 0 | 109.9 | V451 L452 Q457 A461 | V451-L459 HydrophobicContact CG1-CD1 4.33Å; L452-L459 HydrophobicContact CD2-CB 3.79Å; L452-L459 HydrophobicContact CD2-CG 4.44Å; Q457-L459 VanDerWaalsContact C-N 3.31Å; Q457-L459 PolarHBondContact O-N 3.47Å; L459-A461 PolarHBondContact O-N 3.46Å | ||
| 460 | P | 73.6 | Confident | 81.7 | Confident | 16 Ų | 16 | 50.4 Ų | 50.4 | 10% | 0.104 | 29% | 0.29 | C | S | . | . | trans | -62.8 | 135.2 | 170.5 | 19.6 | -23.8 | 0 | 0 | 0 | 110.3 | D239 I240 V243 L244 P463 | D239-P460 WeakPolarHBondContact OD2-CB 3.14Å; I240-P460 HydrophobicContact CG1-CG 4.29Å; V243-P460 HydrophobicContact CB-CG 4.25Å; V243-P460 HydrophobicContact CG1-CG 4.44Å; V243-P460 HydrophobicContact CG2-CB 4.41Å; L244-P460 VanDerWaalsContact CD1-CD 3.44Å; L244-P460 HydrophobicContact CD1-CG 3.93Å; P460-P463 HydrophobicContact CB-CG 4.31Å; P460-P463 HydrophobicContact CG-CG 4.22Å; P460-P463 WeakPolarHBondContact O-CD 3.02Å; P460-P463 WeakPolarHBondContact O-CG 3.2Å | ||
| 461 | A | 74.5 | Confident | 82.2 | Confident | 26 Ų | 26 | 51.1 Ų | 51.1 | 22% | 0.215 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -88.2 | -26.5 | -172 | 0 | 0 | 0 | 0 | 0 | 114 | Y418 T448 L459 S465 | Y418-A461 PolarHBondContact OH-O 2.93Å; T448-A461 VanDerWaalsContact CG2-CA 3.47Å; T448-A461 HydrophobicContact CG2-CB 3.59Å; L459-A461 PolarHBondContact O-N 3.46Å; A461-S465 PolarHBondContact O-OG 3.49Å |
| 462 | L | 78.7 | Confident | 82.6 | Confident | 5 Ų | 5 | 53.3 Ų | 53.3 | 3% | 0.026 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -51.6 | -54 | 176.5 | -173.8 | 176.6 | 0 | 0 | 0 | 114 | S236 D239 F417 Y418 I464 S465 I466 | S236-L462 VanDerWaalsContact CA-CD2 3.47Å; D239-L462 HydrophobicContact CB-CD1 4.03Å; F417-L462 HydrophobicContact CD2-CD1 3.34Å; F417-L462 HydrophobicContact CD2-CG 4.04Å; F417-L462 HydrophobicContact CE2-CD1 3.69Å; F417-L462 HydrophobicContact CG-CD1 4.34Å; Y418-L462 WeakPolarHBondContact OH-CA 3.02Å; L462-I464 PolarHBondContact O-N 3.32Å; L462-S465 PolarHBondContact O-N 3.21Å; L462-I466 HydrophobicContact CD2-CB 4.3Å; L462-I466 HydrophobicContact CD2-CG1 3.72Å; L462-I466 HydrophobicContact CG-CG1 4.26Å; L462-I466 WeakPolarHBondContact O-CB 3.4Å; L462-I466 WeakPolarHBondContact O-CG1 3Å; L462-I466 PolarHBondContact O-N 3.19Å |
| 463 | P | 86.3 | Confident | 83.3 | Confident | 10 Ų | 10 | 51.7 Ų | 51.7 | 7% | 0.065 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.1 | -44.9 | -166.7 | 22.7 | -36.7 | 0 | 0 | 0 | 115.8 | I240 P460 S465 T467 | I240-P463 HydrophobicContact CD1-CB 3.66Å; I240-P463 HydrophobicContact CD1-CG 4.01Å; I240-P463 HydrophobicContact CG1-CB 3.73Å; I240-P463 HydrophobicContact CG1-CG 3.61Å; P460-P463 HydrophobicContact CB-CG 4.31Å; P460-P463 HydrophobicContact CG-CG 4.22Å; P460-P463 WeakPolarHBondContact O-CD 3.02Å; P460-P463 WeakPolarHBondContact O-CG 3.2Å; P463-S465 VanDerWaalsContact C-N 3.32Å; P463-S465 PolarHBondContact O-N 2.93Å; P463-T467 VanDerWaalsContact O-CB 3.23Å; P463-T467 WeakPolarHBondContact O-CB 3.49Å; P463-T467 PolarHBondContact O-N 3.04Å; P463-T467 PolarHBondContact O-OG1 2.93Å |
| 464 | I | 87.1 | Confident | 84.2 | Confident | 75 Ų | 75 | 53.6 Ų | 53.6 | 39% | 0.385 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.6 | -45.4 | -179.5 | -61.6 | 173.1 | 0 | 0 | 0 | 109.2 | L462 T467 C468 | L462-I464 PolarHBondContact O-N 3.32Å; I464-T467 PolarHBondContact O-N 3.44Å; I464-C468 VanDerWaalsContact O-CB 3.25Å; I464-C468 WeakPolarHBondContact O-CB 3.25Å; I464-C468 PolarHBondContact O-N 2.93Å |
| 465 | S | 91.6 | Very high | 84.7 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.5 | -44.7 | -178.1 | -50.3 | 0 | 0 | 0 | 0 | 112.7 | Y418 M445 A461 L462 P463 G469 | Y418-S465 VanDerWaalsContact CE1-CB 3.47Å; Y418-S465 WeakPolarHBondContact OH-CB 3.34Å; Y418-S465 PolarHBondContact OH-OG 3.2Å; M445-S465 WeakPolarHBondContact CA-OG 3.47Å; M445-S465 PolarHBondContact N-OG 2.82Å; A461-S465 PolarHBondContact O-OG 3.49Å; L462-S465 PolarHBondContact O-N 3.21Å; P463-S465 VanDerWaalsContact C-N 3.32Å; P463-S465 PolarHBondContact O-N 2.93Å; S465-G469 PolarHBondContact O-N 2.95Å |
| 466 | I | 91.9 | Very high | 85.3 | Confident | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -67 | -43.3 | 174.7 | -69.7 | -64 | 0 | 0 | 0 | 111.3 | F417 Y418 L421 L462 C468 G469 I470 | F417-I466 HydrophobicContact CB-CD1 4.04Å; Y418-I466 HydrophobicContact CD1-CD1 3.59Å; Y418-I466 HydrophobicContact CD1-CG1 4.18Å; Y418-I466 HydrophobicContact CE1-CD1 3.93Å; Y418-I466 HydrophobicContact CE1-CG1 3.99Å; L421-I466 HydrophobicContact CB-CD1 4.17Å; L421-I466 HydrophobicContact CD2-CD1 3.65Å; L421-I466 HydrophobicContact CD2-CG2 4.49Å; L462-I466 HydrophobicContact CD2-CB 4.3Å; L462-I466 HydrophobicContact CD2-CG1 3.72Å; L462-I466 HydrophobicContact CG-CG1 4.26Å; L462-I466 WeakPolarHBondContact O-CB 3.4Å; L462-I466 WeakPolarHBondContact O-CG1 3Å; L462-I466 PolarHBondContact O-N 3.19Å; I466-C468 VanDerWaalsContact C-N 3.32Å; I466-C468 PolarHBondContact O-N 3.35Å; I466-G469 PolarHBondContact O-N 2.86Å; I466-I470 HydrophobicContact CG2-CD1 3.57Å; I466-I470 HydrophobicContact CG2-CG1 4.22Å; I466-I470 WeakPolarHBondContact O-CB 3.21Å; I466-I470 VanDerWaalsContact O-CG1 3.3Å; I466-I470 WeakPolarHBondContact O-CG1 3.44Å; I466-I470 PolarHBondContact O-N 3.11Å |
| 467 | T | 92.1 | Very high | 86.4 | Confident | 82 Ų | 82 | 45.4 Ų | 45.4 | 50% | 0.503 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 178.4 | -55.1 | 0 | 0 | 0 | 0 | 111.1 | P463 I464 L471 | P463-T467 VanDerWaalsContact O-CB 3.23Å; P463-T467 WeakPolarHBondContact O-CB 3.49Å; P463-T467 PolarHBondContact O-N 3.04Å; P463-T467 PolarHBondContact O-OG1 2.93Å; I464-T467 PolarHBondContact O-N 3.44Å; T467-L471 VanDerWaalsContact O-CB 3.23Å; T467-L471 WeakPolarHBondContact O-CB 3.3Å; T467-L471 PolarHBondContact O-N 2.93Å |
| 468 | C | 91.8 | Very high | 87.6 | Confident | 25 Ų | 25 | 42.8 Ų | 42.8 | 17% | 0.169 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.1 | -51.8 | 173.3 | -171.2 | 0 | 0 | 0 | 0 | 111.3 | A440 I464 I466 I470 L471 F472 | A440-C468 PolarHBondContact O-SG 2.63Å; I464-C468 VanDerWaalsContact O-CB 3.25Å; I464-C468 WeakPolarHBondContact O-CB 3.25Å; I464-C468 PolarHBondContact O-N 2.93Å; I466-C468 VanDerWaalsContact C-N 3.32Å; I466-C468 PolarHBondContact O-N 3.35Å; C468-I470 PolarHBondContact O-N 3.16Å; C468-L471 PolarHBondContact O-N 3.23Å; C468-F472 WeakPolarHBondContact O-CB 3.3Å; C468-F472 WeakPolarHBondContact O-CD2 3.47Å; C468-F472 PolarHBondContact O-N 2.67Å |
| 469 | G | 93.2 | Very high | 88.9 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.7 | -42.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | S465 I466 Y473 | S465-G469 PolarHBondContact O-N 2.95Å; I466-G469 PolarHBondContact O-N 2.86Å; G469-Y473 VanDerWaalsContact O-CB 3.27Å; G469-Y473 WeakPolarHBondContact O-CB 3.37Å; G469-Y473 PolarHBondContact O-N 3.21Å |
| 470 | I | 93.6 | Very high | 89.9 | Confident | 27 Ų | 27 | 42 Ų | 42 | 14% | 0.138 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.8 | -46.1 | 175.5 | -67.1 | 171.6 | 0 | 0 | 0 | 110.9 | W229 L232 A233 L421 I466 C468 Y473 F474 | W229-I470 HydrophobicContact CE3-CG1 4.21Å; W229-I470 HydrophobicContact CE3-CG2 4.4Å; W229-I470 HydrophobicContact CZ3-CG1 4.09Å; L232-I470 HydrophobicContact CB-CD1 4.25Å; A233-I470 HydrophobicContact CB-CD1 4.48Å; L421-I470 HydrophobicContact CD1-CG1 3.65Å; L421-I470 HydrophobicContact CD2-CG1 4.3Å; I466-I470 HydrophobicContact CG2-CD1 3.57Å; I466-I470 HydrophobicContact CG2-CG1 4.22Å; I466-I470 WeakPolarHBondContact O-CB 3.21Å; I466-I470 VanDerWaalsContact O-CG1 3.3Å; I466-I470 WeakPolarHBondContact O-CG1 3.44Å; I466-I470 PolarHBondContact O-N 3.11Å; C468-I470 PolarHBondContact O-N 3.16Å; I470-Y473 PolarHBondContact O-N 3.44Å; I470-F474 HydrophobicContact CG2-CD2 3.82Å; I470-F474 HydrophobicContact CG2-CE2 3.84Å; I470-F474 WeakPolarHBondContact O-CD2 3.41Å; I470-F474 PolarHBondContact O-N 2.91Å; I470-F474 VanDerWaalsContact O-N 3.09Å |
| 471 | L | 94 | Very high | 90.7 | Very high | 102 Ų | 102 | 41.8 Ų | 41.8 | 53% | 0.534 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -62 | -49.5 | 178.8 | 178.5 | 64.1 | 0 | 0 | 0 | 111.3 | T467 C468 Y473 F474 V475 | T467-L471 VanDerWaalsContact O-CB 3.23Å; T467-L471 WeakPolarHBondContact O-CB 3.3Å; T467-L471 PolarHBondContact O-N 2.93Å; C468-L471 PolarHBondContact O-N 3.23Å; L471-Y473 VanDerWaalsContact C-N 3.33Å; L471-Y473 PolarHBondContact O-N 2.67Å; L471-F474 PolarHBondContact O-N 3.48Å; L471-V475 HydrophobicContact CD1-CG2 4.15Å; L471-V475 HydrophobicContact CG-CG2 4.47Å; L471-V475 WeakPolarHBondContact O-CB 3.38Å; L471-V475 VanDerWaalsContact O-CG2 3.28Å; L471-V475 WeakPolarHBondContact O-CG2 3.37Å; L471-V475 PolarHBondContact O-N 3.37Å |
| 472 | F | 93.8 | Very high | 91.5 | Very high | 95 Ų | 95 | 43.5 Ų | 43.5 | 42% | 0.417 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -66.9 | -32.2 | 179.3 | -89.4 | -103.2 | 0 | 0 | 0 | 112.6 | T436 A440 C468 S476 | T436-F472 HydrophobicContact CG2-CD1 3.93Å; A440-F472 HydrophobicContact CB-CB 3.48Å; A440-F472 VanDerWaalsContact CB-CB 3.48Å; A440-F472 HydrophobicContact CB-CD1 4.11Å; A440-F472 HydrophobicContact CB-CD2 4.03Å; A440-F472 HydrophobicContact CB-CG 3.6Å; C468-F472 WeakPolarHBondContact O-CB 3.3Å; C468-F472 WeakPolarHBondContact O-CD2 3.47Å; C468-F472 PolarHBondContact O-N 2.67Å; F472-S476 WeakPolarHBondContact O-CB 3.46Å; F472-S476 PolarHBondContact O-N 3.38Å; F472-S476 PolarHBondContact O-OG 2.96Å |
| 473 | Y | 94.1 | Very high | 92 | Very high | 10 Ų | 10 | 48.6 Ų | 48.6 | 4% | 0.039 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.8 | -55.4 | 171.4 | 171 | -95.8 | 0 | 0 | 0 | 111.4 | W229 A425 D428 G469 I470 L471 V475 S476 S477 | W229-Y473 AromaticContact CH2-CD1 3.22Å; W229-Y473 HydrophobicContact CH2-CD1 3.22Å; W229-Y473 AromaticContact CH2-CD2 3.95Å; W229-Y473 HydrophobicContact CH2-CD2 3.95Å; W229-Y473 AromaticContact CH2-CE1 3.54Å; W229-Y473 HydrophobicContact CH2-CE1 3.54Å; W229-Y473 HydrophobicContact CH2-CE2 4.2Å; W229-Y473 AromaticContact CH2-CG 3.45Å; W229-Y473 HydrophobicContact CH2-CG 3.45Å; W229-Y473 VanDerWaalsContact CH2-CG 3.45Å; W229-Y473 AromaticContact CZ2-CD1 3.59Å; W229-Y473 HydrophobicContact CZ2-CD1 3.59Å; W229-Y473 HydrophobicContact CZ2-CD2 4.37Å; W229-Y473 AromaticContact CZ2-CE1 3.35Å; W229-Y473 HydrophobicContact CZ2-CE1 3.35Å; W229-Y473 HydrophobicContact CZ2-CE2 4.15Å; W229-Y473 HydrophobicContact CZ2-CG 4.11Å; W229-Y473 AromaticContact CZ2-CZ 3.67Å; W229-Y473 AromaticContact CZ3-CD1 3.78Å; W229-Y473 HydrophobicContact CZ3-CD1 3.78Å; W229-Y473 HydrophobicContact CZ3-CE1 4.36Å; W229-Y473 HydrophobicContact CZ3-CG 4.14Å; A425-Y473 HydrophobicContact CB-CD2 3.62Å; A425-Y473 HydrophobicContact CB-CE2 3.8Å; D428-Y473 WeakPolarHBondContact CB-OH 3.41Å; G469-Y473 VanDerWaalsContact O-CB 3.27Å; G469-Y473 WeakPolarHBondContact O-CB 3.37Å; G469-Y473 PolarHBondContact O-N 3.21Å; I470-Y473 PolarHBondContact O-N 3.44Å; L471-Y473 VanDerWaalsContact C-N 3.33Å; L471-Y473 PolarHBondContact O-N 2.67Å; Y473-V475 PolarHBondContact O-N 3.05Å; Y473-S476 PolarHBondContact O-N 2.94Å; Y473-S477 WeakPolarHBondContact O-CB 3.4Å; Y473-S477 PolarHBondContact O-N 3.36Å |
| 474 | F | 94.2 | Very high | 92.2 | Very high | 83 Ų | 83 | 51.1 Ų | 51.1 | 36% | 0.364 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65.3 | -38.3 | -178.4 | -79.6 | -65.4 | 0 | 0 | 0 | 112.6 | W226 W229 I470 L471 A478 | W226-F474 HydrophobicContact CZ3-CE1 4.43Å; W226-F474 HydrophobicContact CZ3-CZ 4.25Å; W229-F474 HydrophobicContact CD2-CE2 4.41Å; W229-F474 HydrophobicContact CD2-CZ 4.27Å; W229-F474 HydrophobicContact CE3-CE2 4.12Å; W229-F474 HydrophobicContact CE3-CZ 4.44Å; W229-F474 HydrophobicContact CG-CZ 4.46Å; I470-F474 HydrophobicContact CG2-CD2 3.82Å; I470-F474 HydrophobicContact CG2-CE2 3.84Å; I470-F474 WeakPolarHBondContact O-CD2 3.41Å; I470-F474 PolarHBondContact O-N 2.91Å; I470-F474 VanDerWaalsContact O-N 3.09Å; L471-F474 PolarHBondContact O-N 3.48Å; F474-A478 WeakPolarHBondContact O-CB 3.44Å; F474-A478 PolarHBondContact O-N 3.42Å |
| 475 | V | 94.5 | Very high | 92.3 | Very high | 67 Ų | 67 | 53.1 Ų | 53.1 | 41% | 0.406 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -63.8 | -44.7 | 173.1 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | L471 Y473 A478 T479 | L471-V475 HydrophobicContact CD1-CG2 4.15Å; L471-V475 HydrophobicContact CG-CG2 4.47Å; L471-V475 WeakPolarHBondContact O-CB 3.38Å; L471-V475 VanDerWaalsContact O-CG2 3.28Å; L471-V475 WeakPolarHBondContact O-CG2 3.37Å; L471-V475 PolarHBondContact O-N 3.37Å; Y473-V475 PolarHBondContact O-N 3.05Å; V475-A478 PolarHBondContact O-N 2.89Å; V475-T479 PolarHBondContact O-N 3.48Å; V475-T479 PolarHBondContact O-OG1 2.87Å |
| 476 | S | 93.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 31% | 0.313 | C | S | . | . | I | π-helix | trans | -62.8 | -45.9 | 179.1 | -59 | 0 | 0 | 0 | 0 | 112.1 | T436 F472 Y473 I480 S481 | T436-S476 WeakPolarHBondContact CG2-OG 3.49Å; F472-S476 WeakPolarHBondContact O-CB 3.46Å; F472-S476 PolarHBondContact O-N 3.38Å; F472-S476 PolarHBondContact O-OG 2.96Å; Y473-S476 PolarHBondContact O-N 2.94Å; S476-I480 CarbonylContact O-C 3.44Å; S476-I480 WeakPolarHBondContact O-CA 3.28Å; S476-I480 WeakPolarHBondContact O-CB 3.24Å; S476-I480 PolarHBondContact O-N 2.94Å; S476-S481 PolarHBondContact O-N 3.3Å |
| 477 | S | 92.3 | Very high | 92.2 | Very high | 50 Ų | 50 | 56.3 Ų | 56.3 | 35% | 0.35 | 32% | 0.317 | S | S | . | . | I | π-helix | trans | -64.4 | -39.5 | 177.9 | 175.6 | 0 | 0 | 0 | 0 | 112.1 | Y473 P482 | Y473-S477 WeakPolarHBondContact O-CB 3.4Å; Y473-S477 PolarHBondContact O-N 3.36Å; S477-P482 WeakPolarHBondContact O-CD 3.47Å |
| 478 | A | 93.1 | Very high | 92.1 | Very high | 73 Ų | 73 | 55.6 Ų | 55.6 | 60% | 0.603 | 32% | 0.32 | S | S | * | . | I | π-helix | trans | -82 | -24.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | F474 V475 | F474-A478 WeakPolarHBondContact O-CB 3.44Å; F474-A478 PolarHBondContact O-N 3.42Å; V475-A478 PolarHBondContact O-N 2.89Å |
| 479 | T | 93.9 | Very high | 92 | Very high | 81 Ų | 81 | 61.1 Ų | 61.1 | 50% | 0.497 | 35% | 0.347 | S | S | . | . | I | π-helix | trans | -127.8 | -42.5 | -176.5 | 70.9 | 0 | 0 | 0 | 0 | 114.4 | V475 F483 | V475-T479 PolarHBondContact O-N 3.48Å; V475-T479 PolarHBondContact O-OG1 2.87Å; T479-F483 WeakPolarHBondContact O-CB 3.36Å; T479-F483 PolarHBondContact O-N 2.94Å |
| 480 | I | 91.4 | Very high | 91.8 | Very high | 56 Ų | 56 | 68.3 Ų | 68.3 | 29% | 0.287 | 38% | 0.38 | S | S | . | . | I | π-helix | trans | -78.1 | -46.9 | -173 | -57.8 | -179.3 | 0 | 0 | 0 | 111.2 | V432 S476 F483 L484 | V432-I480 HydrophobicContact CG1-CG2 4.29Å; S476-I480 CarbonylContact O-C 3.44Å; S476-I480 WeakPolarHBondContact O-CA 3.28Å; S476-I480 WeakPolarHBondContact O-CB 3.24Å; S476-I480 PolarHBondContact O-N 2.94Å; I480-F483 PolarHBondContact O-N 2.91Å; I480-L484 HydrophobicContact CG2-CD1 3.64Å; I480-L484 HydrophobicContact CG2-CG 4.1Å; I480-L484 WeakPolarHBondContact O-CB 3.31Å; I480-L484 VanDerWaalsContact O-CG 3.29Å; I480-L484 WeakPolarHBondContact O-CG 3.2Å; I480-L484 PolarHBondContact O-N 3.36Å |
| 481 | S | 89.1 | Confident | 91.5 | Very high | 10 Ų | 10 | 76.8 Ų | 76.8 | 7% | 0.07 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -55.5 | -58.8 | 175.9 | -70.8 | 0 | 0 | 0 | 0 | 112.7 | D430 T433 S476 F483 L484 E485 | D430-S481 VanDerWaalsContact OD2-CB 3.3Å; D430-S481 WeakPolarHBondContact OD2-CB 3.32Å; D430-S481 PolarHBondContact OD2-OG 3.36Å; T433-S481 WeakPolarHBondContact CG2-OG 3.3Å; S476-S481 PolarHBondContact O-N 3.3Å; S481-F483 VanDerWaalsContact C-N 3.28Å; S481-F483 PolarHBondContact O-N 2.79Å; S481-L484 PolarHBondContact O-N 2.87Å; S481-L484 VanDerWaalsContact O-N 3.13Å; S481-E485 WeakPolarHBondContact O-CG 3.4Å; S481-E485 PolarHBondContact O-N 3.43Å |
| 482 | P | 90.8 | Very high | 91 | Very high | 62 Ų | 62 | 75 Ų | 75 | 40% | 0.403 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -65.4 | -29 | -177.7 | 25.2 | -35.1 | 0 | 0 | 0 | 113.5 | S477 A486 | S477-P482 WeakPolarHBondContact O-CD 3.47Å; P482-A486 WeakPolarHBondContact O-CB 3.29Å; P482-A486 PolarHBondContact O-N 3.42Å |
| 483 | F | 91 | Very high | 90.4 | Very high | 113 Ų | 113 | 79.4 Ų | 79.4 | 50% | 0.496 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -67.6 | -47.3 | 172.1 | 176.4 | -101.7 | 0 | 0 | 0 | 111.5 | T479 I480 S481 A486 T487 F494 | T479-F483 WeakPolarHBondContact O-CB 3.36Å; T479-F483 PolarHBondContact O-N 2.94Å; I480-F483 PolarHBondContact O-N 2.91Å; S481-F483 VanDerWaalsContact C-N 3.28Å; S481-F483 PolarHBondContact O-N 2.79Å; F483-A486 PolarHBondContact O-N 2.99Å; F483-T487 HydrophobicContact CD1-CG2 4.49Å; F483-T487 HydrophobicContact CD2-CG2 4.47Å; F483-T487 HydrophobicContact CE1-CG2 4.11Å; F483-T487 HydrophobicContact CE2-CG2 4.08Å; F483-T487 HydrophobicContact CZ-CG2 3.89Å; F483-T487 WeakPolarHBondContact O-CG2 3.48Å; F483-T487 PolarHBondContact O-N 3.35Å; F483-T487 PolarHBondContact O-OG1 2.95Å; F483-F494 HydrophobicContact CE1-CE2 4.24Å; F483-F494 HydrophobicContact CZ-CE2 4.03Å; F483-F494 HydrophobicContact CZ-CZ 4.11Å |
| 484 | L | 90.4 | Very high | 89.3 | Confident | 63 Ų | 63 | 89.2 Ų | 89.2 | 33% | 0.33 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.3 | -41 | 179.1 | -72.8 | 177.7 | 0 | 0 | 0 | 112 | V432 I480 S481 A486 T487 A488 | V432-L484 HydrophobicContact CB-CD1 4.35Å; V432-L484 HydrophobicContact CG1-CD1 3.74Å; V432-L484 HydrophobicContact CG2-CD1 4.14Å; I480-L484 HydrophobicContact CG2-CD1 3.64Å; I480-L484 HydrophobicContact CG2-CG 4.1Å; I480-L484 WeakPolarHBondContact O-CB 3.31Å; I480-L484 VanDerWaalsContact O-CG 3.29Å; I480-L484 WeakPolarHBondContact O-CG 3.2Å; I480-L484 PolarHBondContact O-N 3.36Å; S481-L484 PolarHBondContact O-N 2.87Å; S481-L484 VanDerWaalsContact O-N 3.13Å; L484-A486 PolarHBondContact O-N 3.45Å; L484-T487 WeakPolarHBondContact CA-OG1 3.19Å; L484-T487 PolarHBondContact O-N 3.48Å; L484-T487 PolarHBondContact O-OG1 2.89Å; L484-A488 WeakPolarHBondContact O-CB 3.36Å; L484-A488 PolarHBondContact O-N 3.21Å |
| 485 | E | 89 | Confident | 89 | Confident | 116 Ų | 116 | 89.6 Ų | 89.6 | 54% | 0.542 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -57 | -48.9 | 173.5 | -73.3 | -174.4 | 139.1 | 0 | 0 | 111.6 | S481 T487 A488 I489 | S481-E485 WeakPolarHBondContact O-CG 3.4Å; S481-E485 PolarHBondContact O-N 3.43Å; E485-T487 PolarHBondContact O-N 3.04Å; E485-A488 PolarHBondContact O-N 3.23Å; E485-I489 WeakPolarHBondContact O-CD1 3.34Å; E485-I489 VanDerWaalsContact O-CG1 3.29Å; E485-I489 WeakPolarHBondContact O-CG1 3.16Å; E485-I489 PolarHBondContact O-N 3.08Å |
| 486 | A | 89.7 | Confident | 88.8 | Confident | 51 Ų | 51 | 90.7 Ų | 90.7 | 42% | 0.421 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.6 | -47.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | P482 F483 L484 A488 I489 E490 | P482-A486 WeakPolarHBondContact O-CB 3.29Å; P482-A486 PolarHBondContact O-N 3.42Å; F483-A486 PolarHBondContact O-N 2.99Å; L484-A486 PolarHBondContact O-N 3.45Å; A486-A488 VanDerWaalsContact C-N 3.35Å; A486-A488 PolarHBondContact O-N 3.08Å; A486-I489 PolarHBondContact O-N 3.35Å; A486-E490 PolarHBondContact O-N 3.04Å |
| 487 | T | 90.4 | Very high | 88.5 | Confident | 16 Ų | 16 | 95.8 Ų | 95.8 | 10% | 0.098 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -68.7 | -32.2 | 179.7 | 60.3 | 0 | 0 | 0 | 0 | 113 | F483 L484 E485 E490 R491 V492 F494 | F483-T487 HydrophobicContact CD1-CG2 4.49Å; F483-T487 HydrophobicContact CD2-CG2 4.47Å; F483-T487 HydrophobicContact CE1-CG2 4.11Å; F483-T487 HydrophobicContact CE2-CG2 4.08Å; F483-T487 HydrophobicContact CZ-CG2 3.89Å; F483-T487 WeakPolarHBondContact O-CG2 3.48Å; F483-T487 PolarHBondContact O-N 3.35Å; F483-T487 PolarHBondContact O-OG1 2.95Å; L484-T487 WeakPolarHBondContact CA-OG1 3.19Å; L484-T487 PolarHBondContact O-N 3.48Å; L484-T487 PolarHBondContact O-OG1 2.89Å; E485-T487 PolarHBondContact O-N 3.04Å; T487-E490 CarbonylContact O-C 3.59Å; T487-E490 PolarHBondContact O-N 3.31Å; T487-R491 PolarHBondContact O-N 3.26Å; T487-V492 PolarHBondContact O-N 2.62Å; T487-F494 HydrophobicContact CG2-CE2 3.79Å |
| 488 | A | 89.9 | Confident | 88.3 | Confident | 67 Ų | 67 | 98.5 Ų | 98.5 | 55% | 0.554 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -71.2 | -34.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L484 E485 A486 R491 | L484-A488 WeakPolarHBondContact O-CB 3.36Å; L484-A488 PolarHBondContact O-N 3.21Å; E485-A488 PolarHBondContact O-N 3.23Å; A486-A488 VanDerWaalsContact C-N 3.35Å; A486-A488 PolarHBondContact O-N 3.08Å; A488-R491 PolarHBondContact O-N 3.44Å; A488-R491 VanDerWaalsContact O-N 3.16Å |
| 489 | I | 89.5 | Confident | 88 | Confident | 142 Ų | 142 | 100.1 Ų | 100.1 | 73% | 0.728 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.1 | -44.4 | 171.6 | -70.3 | 163 | 0 | 0 | 0 | 110.4 | E485 A486 R491 | E485-I489 WeakPolarHBondContact O-CD1 3.34Å; E485-I489 VanDerWaalsContact O-CG1 3.29Å; E485-I489 WeakPolarHBondContact O-CG1 3.16Å; E485-I489 PolarHBondContact O-N 3.08Å; A486-I489 PolarHBondContact O-N 3.35Å; I489-R491 PolarHBondContact O-N 2.85Å |
| 490 | E | 90.6 | Very high | 87.6 | Confident | 150 Ų | 150 | 101.3 Ų | 101.3 | 70% | 0.701 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -75.1 | -9.7 | 175 | -63.1 | -168.8 | 158 | 0 | 0 | 113.7 | A486 T487 V492 | A486-E490 PolarHBondContact O-N 3.04Å; T487-E490 CarbonylContact O-C 3.59Å; T487-E490 PolarHBondContact O-N 3.31Å; E490-V492 HydrophobicContact CB-CG2 3.89Å; E490-V492 PolarHBondContact O-N 3.34Å |
| 491 | R | 86 | Confident | 87.3 | Confident | 205 Ų | 205 | 104.6 Ų | 104.6 | 77% | 0.774 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57 | 31.8 | -172 | -54 | -178.3 | 178.4 | -173.4 | -1.2 | 113.7 | T487 A488 I489 F493 | T487-R491 PolarHBondContact O-N 3.26Å; A488-R491 PolarHBondContact O-N 3.44Å; A488-R491 VanDerWaalsContact O-N 3.16Å; I489-R491 PolarHBondContact O-N 2.85Å; R491-F493 HydrophobicContact CB-CE2 4.44Å; R491-F493 VanDerWaalsContact O-CD2 3.29Å; R491-F493 WeakPolarHBondContact O-CD2 3.24Å; R491-F493 WeakPolarHBondContact O-CE2 3.33Å |
| 492 | V | 85.2 | Confident | 87.2 | Confident | 64 Ų | 64 | 111.8 Ų | 111.8 | 39% | 0.388 | 56% | 0.555 | S | S | . | * | trans | -82.7 | 122.7 | 171.7 | 178.1 | 0 | 0 | 0 | 0 | 108.3 | T487 E490 F494 | T487-V492 PolarHBondContact O-N 2.62Å; E490-V492 HydrophobicContact CB-CG2 3.89Å; E490-V492 PolarHBondContact O-N 3.34Å; V492-F494 HydrophobicContact CG1-CE2 3.9Å; V492-F494 HydrophobicContact CG1-CZ 4.07Å | ||
| 493 | F | 79.8 | Confident | 86.9 | Confident | 188 Ų | 188 | 116 Ų | 116 | 83% | 0.825 | 57% | 0.567 | S | S | * | * | trans | -106.5 | 150.4 | 175.7 | -59.7 | -84.9 | 0 | 0 | 0 | 110.1 | R491 | R491-F493 HydrophobicContact CB-CE2 4.44Å; R491-F493 VanDerWaalsContact O-CD2 3.29Å; R491-F493 WeakPolarHBondContact O-CD2 3.24Å; R491-F493 WeakPolarHBondContact O-CE2 3.33Å | ||
| 494 | F | 71 | Confident | 86.5 | Confident | 217 Ų | 217 | 116.3 Ų | 116.3 | 95% | 0.952 | 57% | 0.574 | S | S | * | * | trans | -122 | 0 | 177.7 | -68.4 | -86.7 | 0 | 0 | 0 | 110.5 | F483 T487 V492 | F483-F494 HydrophobicContact CE1-CE2 4.24Å; F483-F494 HydrophobicContact CZ-CE2 4.03Å; F483-F494 HydrophobicContact CZ-CZ 4.11Å; T487-F494 HydrophobicContact CG2-CE2 3.79Å; V492-F494 HydrophobicContact CG1-CE2 3.9Å; V492-F494 HydrophobicContact CG1-CZ 4.07Å |
Retrieved 494 of 494 residues in 175.5 ms
(Link to these results)