| 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 | K | 35.5 | Very low | 32.2 | Very low | 259 Ų | 259 | 165 Ų | 165 | 100% | 1.126 | 84% | 0.837 | S | S | * | * | 0 | 89.4 | 0 | -78.1 | -177.6 | 172.4 | -179.8 | 0 | 106.7 | |||||
| 2 | M | 30.8 | Very low | 32 | Very low | 168 Ų | 168 | 159.4 Ų | 159.4 | 83% | 0.828 | 84% | 0.835 | S | S | * | * | 58.7 | 103.2 | 107.5 | -90.3 | -176.9 | 166.9 | 0 | 0 | 112.2 | |||||
| 3 | E | 33 | Very low | 31.7 | Very low | 143 Ų | 143 | 161.1 Ų | 161.1 | 67% | 0.668 | 84% | 0.839 | S | S | * | * | 94 | 141.4 | 112.6 | -83.3 | -165.5 | 140.9 | 0 | 0 | 110.3 | |||||
| 4 | K | 33.4 | Very low | 32.3 | Very low | 174 Ų | 174 | 157.5 Ų | 157.5 | 76% | 0.757 | 83% | 0.831 | S | S | * | * | cis | -167.5 | 150.4 | 33.1 | -134.3 | 159.6 | -172.5 | 165 | 0 | 110.7 | ||||
| 5 | K | 35.9 | Very low | 32 | Very low | 180 Ų | 180 | 153.9 Ų | 153.9 | 78% | 0.783 | 82% | 0.824 | S | S | * | * | trans | -61.2 | 153.5 | 161.7 | -79.5 | 176.1 | 164.8 | -173.1 | 0 | 111.8 | ||||
| 6 | S | 31.5 | Very low | 31.8 | Very low | 117 Ų | 117 | 151.3 Ų | 151.3 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | -160.6 | 117.6 | 126.7 | 60.4 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 7 | E | 34.3 | Very low | 32.1 | Very low | 157 Ų | 157 | 148.5 Ų | 148.5 | 73% | 0.734 | 82% | 0.823 | S | S | * | * | trans | -59.2 | 161.2 | 159.4 | -65.1 | 158.3 | 144.5 | 0 | 0 | 110.8 | ||||
| 8 | I | 32.3 | Very low | 32.1 | Very low | 173 Ų | 173 | 146.6 Ų | 146.6 | 89% | 0.887 | 82% | 0.822 | S | S | * | * | -165.9 | 128.8 | 127.1 | -90.3 | 147.2 | 0 | 0 | 0 | 109.8 | |||||
| 9 | N | 28.8 | Very low | 32.1 | Very low | 164 Ų | 164 | 146.7 Ų | 146.7 | 88% | 0.877 | 83% | 0.827 | S | S | * | * | trans | -63.3 | 161.5 | 172.7 | -76.5 | -40.1 | 0 | 0 | 0 | 113.9 | ||||
| 10 | G | 28.1 | Very low | 32 | Very low | 77 Ų | 77 | 144.1 Ų | 144.1 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | trans | 169.6 | 93.3 | 154.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 11 | H | 30.9 | Very low | 32 | Very low | 203 Ų | 203 | 148.5 Ų | 148.5 | 94% | 0.94 | 83% | 0.828 | S | S | * | * | trans | -50.6 | 142.8 | 164.2 | -94.7 | -58.5 | 0 | 0 | 0 | 114 | ||||
| 12 | A | 29.1 | Very low | 31.8 | Very low | 98 Ų | 98 | 145.1 Ų | 145.1 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | 170.7 | 116.5 | 121.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 13 | M | 28.7 | Very low | 32 | Very low | 181 Ų | 181 | 145.4 Ų | 145.4 | 89% | 0.892 | 82% | 0.822 | S | S | * | * | trans | -77.9 | 166.1 | 147.1 | -84.4 | -96.4 | -155.2 | 0 | 0 | 108.1 | ||||
| 14 | P | 40.3 | Very low | 32 | Very low | 111 Ų | 111 | 147.1 Ų | 147.1 | 72% | 0.721 | 83% | 0.83 | S | S | * | * | cis | -145.1 | 174.5 | 25.9 | 38.4 | -16.8 | 0 | 0 | 0 | 117.4 | ||||
| 15 | S | 27.9 | Very low | 31.9 | Very low | 104 Ų | 104 | 146.3 Ų | 146.3 | 73% | 0.727 | 83% | 0.834 | S | S | * | * | trans | 114.6 | 140 | 132.7 | 82.2 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 16 | S | 28.4 | Very low | 31.9 | Very low | 112 Ų | 112 | 142.8 Ų | 142.8 | 78% | 0.783 | 83% | 0.832 | S | S | * | * | trans | 84 | 85.1 | 161 | 75.5 | 0 | 0 | 0 | 0 | 117.9 | S18 | S16-S18 PolarHBondContact O-N 3.48Š| ||
| 17 | A | 36.9 | Very low | 32.3 | Very low | 103 Ų | 103 | 145.2 Ų | 145.2 | 85% | 0.851 | 83% | 0.831 | S | S | * | * | trans | -53.8 | 124.7 | 146.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 18 | S | 32.1 | Very low | 32.6 | Very low | 115 Ų | 115 | 145.2 Ų | 145.2 | 80% | 0.804 | 83% | 0.831 | S | S | * | * | trans | 177.6 | 58.4 | 137.7 | -167.1 | 0 | 0 | 0 | 0 | 110.6 | S16 | S16-S18 PolarHBondContact O-N 3.48Š| ||
| 19 | T | 31.5 | Very low | 33 | Very low | 148 Ų | 148 | 141.5 Ų | 141.5 | 91% | 0.908 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -154.7 | 12.7 | 163.2 | -23.7 | 0 | 0 | 0 | 0 | 113.7 | ||
| 20 | A | 31.1 | Very low | 33.7 | Very low | 94 Ų | 94 | 137.6 Ų | 137.6 | 78% | 0.777 | 80% | 0.799 | S | S | * | * | trans | -108.9 | 62.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 21 | R | 32.1 | Very low | 34.5 | Very low | 237 Ų | 237 | 140.4 Ų | 140.4 | 89% | 0.894 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -158.8 | 89.9 | 165.2 | -81.1 | -164.7 | 178.7 | 158.5 | -1.2 | 106.9 | ||
| 22 | M | 30.7 | Very low | 35.1 | Very low | 189 Ų | 189 | 137.3 Ų | 137.3 | 93% | 0.931 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -179.8 | 4.5 | 152.7 | -86.4 | -121.5 | 162.4 | 0 | 0 | 113.9 | ||
| 23 | L | 34.5 | Very low | 35.8 | Very low | 174 Ų | 174 | 137.1 Ų | 137.1 | 91% | 0.911 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -132.5 | 14.3 | 178.2 | -70.1 | 175.1 | 0 | 0 | 0 | 116.1 | ||
| 24 | E | 32.7 | Very low | 36.6 | Very low | 178 Ų | 178 | 133.7 Ų | 133.7 | 83% | 0.832 | 75% | 0.745 | S | S | * | * | trans | -110.2 | 92.5 | 167.5 | -94.6 | 171.7 | 158 | 0 | 0 | 107.7 | ||||
| 25 | N | 32.5 | Very low | 36.8 | Very low | 158 Ų | 158 | 134.4 Ų | 134.4 | 85% | 0.845 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -170.1 | 39.5 | 160.7 | -104.4 | -3.5 | 0 | 0 | 0 | 113 | ||
| 26 | S | 36.4 | Very low | 37.7 | Very low | 106 Ų | 106 | 135.3 Ų | 135.3 | 74% | 0.741 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -144.9 | 8.9 | 175.8 | 43.1 | 0 | 0 | 0 | 0 | 116.6 | ||
| 27 | E | 39 | Very low | 38.7 | Very low | 168 Ų | 168 | 134.7 Ų | 134.7 | 79% | 0.785 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -117.6 | -2.4 | 178.7 | -74.1 | -172.6 | 144.8 | 0 | 0 | 115.7 | P29 | E27-P29 VanDerWaalsContact C-CD 3.4Š|
| 28 | E | 41 | Very low | 39.2 | Very low | 157 Ų | 157 | 136 Ų | 136 | 73% | 0.734 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -81.5 | -8.9 | -173.7 | -74.5 | -172.1 | 157.9 | 0 | 0 | 119.1 | ||
| 29 | P | 40 | Very low | 40.2 | Very low | 94 Ų | 94 | 137.3 Ų | 137.3 | 61% | 0.61 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -84.7 | -8.5 | 176.9 | 32.9 | -31.6 | 0 | 0 | 0 | 113.8 | E27 | E27-P29 VanDerWaalsContact C-CD 3.4Å |
| 30 | V | 44.6 | Very low | 41.2 | Very low | 82 Ų | 82 | 135.3 Ų | 135.3 | 50% | 0.497 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -95.8 | -30.6 | -172.6 | -177.7 | 0 | 0 | 0 | 0 | 112.8 | Q34 | V30-Q34 WeakPolarHBondContact O-CB 3.23Å; V30-Q34 VanDerWaalsContact O-CG 3.23Å; V30-Q34 WeakPolarHBondContact O-CG 3.43Å; V30-Q34 PolarHBondContact O-N 3.01Å |
| 31 | E | 43.6 | Very low | 42.1 | Very low | 137 Ų | 137 | 137.4 Ų | 137.4 | 64% | 0.64 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -77.8 | -36.4 | 179.9 | -76.3 | -166.1 | 143.4 | 0 | 0 | 113.3 | Q34 Q35 | E31-Q34 PolarHBondContact O-N 3.2Å; E31-Q35 WeakPolarHBondContact O-CB 3.38Å; E31-Q35 WeakPolarHBondContact O-CG 3.27Å; E31-Q35 PolarHBondContact O-N 2.94Å |
| 32 | E | 43.6 | Very low | 43 | Very low | 138 Ų | 138 | 134 Ų | 134 | 65% | 0.645 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -67 | -39.8 | 175.5 | -72.1 | -166.6 | 154.8 | 0 | 0 | 112.1 | Q35 Q36 | E32-Q35 PolarHBondContact O-N 2.9Å; E32-Q36 WeakPolarHBondContact O-CB 3.46Å; E32-Q36 WeakPolarHBondContact O-CG 3.39Å; E32-Q36 PolarHBondContact O-N 3.27Å |
| 33 | D | 45.2 | Very low | 44 | Very low | 93 Ų | 93 | 133.3 Ų | 133.3 | 50% | 0.497 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -67.8 | -35.6 | 176.4 | -112.5 | -10.1 | 0 | 0 | 0 | 111.8 | Q37 | D33-Q37 VanDerWaalsContact O-CB 3.27Å; D33-Q37 WeakPolarHBondContact O-CB 3.4Å; D33-Q37 WeakPolarHBondContact O-CG 3.41Å; D33-Q37 PolarHBondContact O-N 3.4Å |
| 34 | Q | 43.9 | Very low | 44.9 | Very low | 110 Ų | 110 | 131 Ų | 131 | 51% | 0.514 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -72.6 | -35.1 | 175.5 | -75.2 | -176.4 | 24.2 | 0 | 0 | 112.8 | V30 E31 Q38 | V30-Q34 WeakPolarHBondContact O-CB 3.23Å; V30-Q34 VanDerWaalsContact O-CG 3.23Å; V30-Q34 WeakPolarHBondContact O-CG 3.43Å; V30-Q34 PolarHBondContact O-N 3.01Å; E31-Q34 PolarHBondContact O-N 3.2Å; Q34-Q38 WeakPolarHBondContact O-CB 3.35Å; Q34-Q38 WeakPolarHBondContact O-CG 3.19Å; Q34-Q38 PolarHBondContact O-N 3Å |
| 35 | Q | 45.7 | Very low | 45.8 | Very low | 126 Ų | 126 | 131.4 Ų | 131.4 | 59% | 0.589 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -70.8 | -41.8 | 174.2 | -75.7 | -178.9 | 9.3 | 0 | 0 | 111.8 | E31 E32 Q38 E39 | E31-Q35 WeakPolarHBondContact O-CB 3.38Å; E31-Q35 WeakPolarHBondContact O-CG 3.27Å; E31-Q35 PolarHBondContact O-N 2.94Å; E32-Q35 PolarHBondContact O-N 2.9Å; Q35-Q38 PolarHBondContact O-N 2.86Å; Q35-E39 PolarHBondContact O-N 2.91Å |
| 36 | Q | 47 | Very low | 47.5 | Very low | 122 Ų | 122 | 125.1 Ų | 125.1 | 57% | 0.57 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -64.5 | -40 | 173.3 | -74.9 | -176.9 | 13.1 | 0 | 0 | 112.1 | E32 E39 E40 | E32-Q36 WeakPolarHBondContact O-CB 3.46Å; E32-Q36 WeakPolarHBondContact O-CG 3.39Å; E32-Q36 PolarHBondContact O-N 3.27Å; Q36-E39 PolarHBondContact O-N 2.87Å; Q36-E40 WeakPolarHBondContact O-CB 3.44Å; Q36-E40 PolarHBondContact O-N 3.39Å |
| 37 | Q | 49.3 | Very low | 49 | Very low | 100 Ų | 100 | 124 Ų | 124 | 47% | 0.467 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -68.6 | -32.4 | 174.3 | -75.7 | -180 | 25.3 | 0 | 0 | 113.1 | D33 K41 | D33-Q37 VanDerWaalsContact O-CB 3.27Å; D33-Q37 WeakPolarHBondContact O-CB 3.4Å; D33-Q37 WeakPolarHBondContact O-CG 3.41Å; D33-Q37 PolarHBondContact O-N 3.4Å; Q37-K41 VanDerWaalsContact O-CB 3.24Å; Q37-K41 WeakPolarHBondContact O-CB 3.38Å; Q37-K41 WeakPolarHBondContact O-CG 3.42Å; Q37-K41 PolarHBondContact O-N 3.46Å |
| 38 | Q | 47.5 | Very low | 50.6 | Low | 131 Ų | 131 | 123.2 Ų | 123.2 | 61% | 0.612 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -73.6 | -37.7 | 173.9 | -84.1 | -174.5 | 2.6 | 0 | 0 | 112.6 | Q34 Q35 K41 K42 | Q34-Q38 WeakPolarHBondContact O-CB 3.35Å; Q34-Q38 WeakPolarHBondContact O-CG 3.19Å; Q34-Q38 PolarHBondContact O-N 3Å; Q35-Q38 PolarHBondContact O-N 2.86Å; Q38-K41 PolarHBondContact O-N 2.94Å; Q38-K42 WeakPolarHBondContact O-CB 3.2Å; Q38-K42 PolarHBondContact O-N 2.95Å |
| 39 | E | 51.6 | Low | 52.4 | Low | 141 Ų | 141 | 120.4 Ų | 120.4 | 66% | 0.659 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -67.5 | -42.1 | 172.2 | -80.7 | -160.8 | 140.5 | 0 | 0 | 112.1 | Q35 Q36 K41 K42 K43 | Q35-E39 PolarHBondContact O-N 2.91Å; Q36-E39 PolarHBondContact O-N 2.87Å; E39-K41 PolarHBondContact O-N 2.95Å; E39-K42 PolarHBondContact O-N 3.44Å; E39-K43 WeakPolarHBondContact O-CB 3.38Å; E39-K43 PolarHBondContact O-N 2.86Å |
| 40 | E | 53.4 | Low | 54 | Low | 107 Ų | 107 | 124.9 Ų | 124.9 | 50% | 0.5 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -60.6 | -43.6 | 171.3 | -91.1 | -146.3 | 151.3 | 0 | 0 | 111.8 | Q36 K43 K44 | Q36-E40 WeakPolarHBondContact O-CB 3.44Å; Q36-E40 PolarHBondContact O-N 3.39Å; E40-K43 PolarHBondContact O-N 3.48Å; E40-K44 VanDerWaalsContact O-CB 3.23Å; E40-K44 WeakPolarHBondContact O-CB 3.27Å; E40-K44 VanDerWaalsContact O-CG 3.27Å; E40-K44 WeakPolarHBondContact O-CG 3.23Å; E40-K44 PolarHBondContact O-N 3.1Å; E40-K44 IonicContact OE1-NZ 2.71Å; E40-K44 IonicContact OE2-NZ 3.72Å; E40-K44 PolarHBondContact OE2-NZ 2.86Å |
| 41 | K | 50.6 | Low | 55.5 | Low | 137 Ų | 137 | 125.5 Ų | 125.5 | 60% | 0.596 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66.9 | -35.4 | 177.1 | -79.6 | 172.3 | -179.7 | 168.9 | 0 | 112 | Q37 Q38 E39 R45 | Q37-K41 VanDerWaalsContact O-CB 3.24Å; Q37-K41 WeakPolarHBondContact O-CB 3.38Å; Q37-K41 WeakPolarHBondContact O-CG 3.42Å; Q37-K41 PolarHBondContact O-N 3.46Å; Q38-K41 PolarHBondContact O-N 2.94Å; E39-K41 PolarHBondContact O-N 2.95Å; K41-R45 WeakPolarHBondContact O-CB 3.24Å; K41-R45 PolarHBondContact O-N 3.5Å |
| 42 | K | 50.8 | Low | 57.1 | Low | 166 Ų | 166 | 122.8 Ų | 122.8 | 72% | 0.722 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.9 | -43.1 | 171.6 | -92.3 | 179.7 | 175.2 | 173.4 | 0 | 112.1 | Q38 E39 R45 G46 | Q38-K42 WeakPolarHBondContact O-CB 3.2Å; Q38-K42 PolarHBondContact O-N 2.95Å; E39-K42 PolarHBondContact O-N 3.44Å; K42-R45 PolarHBondContact O-N 2.79Å; K42-G46 PolarHBondContact O-N 3.39Å |
| 43 | K | 51.6 | Low | 58.6 | Low | 174 Ų | 174 | 123.2 Ų | 123.2 | 76% | 0.757 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62 | -43.6 | 172.6 | -106.4 | 177.5 | 176.3 | 170.7 | 0 | 111.8 | E39 E40 G46 C47 | E39-K43 WeakPolarHBondContact O-CB 3.38Å; E39-K43 PolarHBondContact O-N 2.86Å; E40-K43 PolarHBondContact O-N 3.48Å; K43-G46 PolarHBondContact O-N 2.82Å; K43-C47 VanDerWaalsContact O-CB 3.3Å; K43-C47 WeakPolarHBondContact O-CB 3.32Å; K43-C47 PolarHBondContact O-N 2.87Å |
| 44 | K | 52.4 | Low | 60 | Low | 125 Ų | 125 | 124.7 Ų | 124.7 | 54% | 0.543 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.6 | -38.4 | 176.5 | -77.9 | 166.7 | 176.4 | 159 | 0 | 112 | E40 C47 K48 | E40-K44 VanDerWaalsContact O-CB 3.23Å; E40-K44 WeakPolarHBondContact O-CB 3.27Å; E40-K44 VanDerWaalsContact O-CG 3.27Å; E40-K44 WeakPolarHBondContact O-CG 3.23Å; E40-K44 PolarHBondContact O-N 3.1Å; E40-K44 IonicContact OE1-NZ 2.71Å; E40-K44 IonicContact OE2-NZ 3.72Å; E40-K44 PolarHBondContact OE2-NZ 2.86Å; K44-C47 PolarHBondContact O-N 3.41Å; K44-K48 VanDerWaalsContact O-CB 3.29Å; K44-K48 WeakPolarHBondContact O-CB 3.3Å; K44-K48 PolarHBondContact O-N 3.31Å |
| 45 | R | 53 | Low | 61.5 | Low | 187 Ų | 187 | 122.9 Ų | 122.9 | 71% | 0.706 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.9 | -47 | 170.7 | -98.6 | -178.7 | 160.3 | 173.1 | -5.7 | 111.7 | K41 K42 C47 K48 E49 | K41-R45 WeakPolarHBondContact O-CB 3.24Å; K41-R45 PolarHBondContact O-N 3.5Å; K42-R45 PolarHBondContact O-N 2.79Å; R45-C47 VanDerWaalsContact C-N 3.34Å; R45-C47 PolarHBondContact O-N 2.92Å; R45-K48 PolarHBondContact O-N 3.06Å; R45-E49 WeakPolarHBondContact O-CB 3.15Å; R45-E49 VanDerWaalsContact O-CG 3.31Å; R45-E49 WeakPolarHBondContact O-CG 3.29Å; R45-E49 PolarHBondContact O-N 3.24Å |
| 46 | G | 67.6 | Low | 62.8 | Low | 26 Ų | 26 | 120.8 Ų | 120.8 | 27% | 0.268 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62.8 | -37.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | K42 K43 R50 | K42-G46 PolarHBondContact O-N 3.39Å; K43-G46 PolarHBondContact O-N 2.82Å; G46-R50 VanDerWaalsContact O-CB 3.28Å; G46-R50 WeakPolarHBondContact O-CB 3.33Å; G46-R50 WeakPolarHBondContact O-CG 2.92Å; G46-R50 PolarHBondContact O-N 3.22Å |
| 47 | C | 67.3 | Low | 63.7 | Low | 82 Ų | 82 | 125.2 Ų | 125.2 | 55% | 0.554 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -69.1 | -44.6 | 175.5 | -172.4 | 0 | 0 | 0 | 0 | 111.7 | K43 K44 R45 R50 L51 | K43-C47 VanDerWaalsContact O-CB 3.3Å; K43-C47 WeakPolarHBondContact O-CB 3.32Å; K43-C47 PolarHBondContact O-N 2.87Å; K44-C47 PolarHBondContact O-N 3.41Å; R45-C47 VanDerWaalsContact C-N 3.34Å; R45-C47 PolarHBondContact O-N 2.92Å; C47-R50 PolarHBondContact O-N 2.8Å; C47-L51 VanDerWaalsContact O-CB 3.22Å; C47-L51 WeakPolarHBondContact O-CB 3.24Å; C47-L51 PolarHBondContact O-N 3.44Å |
| 48 | K | 74 | Confident | 64.7 | Low | 152 Ų | 152 | 122.4 Ų | 122.4 | 66% | 0.661 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66.2 | -38.4 | 177.5 | -160 | 176.1 | -175.7 | -179.4 | 0 | 111.9 | K44 R45 L51 T52 | K44-K48 VanDerWaalsContact O-CB 3.29Å; K44-K48 WeakPolarHBondContact O-CB 3.3Å; K44-K48 PolarHBondContact O-N 3.31Å; R45-K48 PolarHBondContact O-N 3.06Å; K48-L51 PolarHBondContact O-N 2.83Å; K48-T52 WeakPolarHBondContact O-CG2 3.34Å; K48-T52 PolarHBondContact O-N 2.87Å; K48-T52 PolarHBondContact O-OG1 3.23Å; K48-T52 VanDerWaalsContact O-OG1 3.06Å |
| 49 | E | 77.7 | Confident | 66.2 | Low | 99 Ų | 99 | 119.4 Ų | 119.4 | 46% | 0.463 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -71.7 | -31.7 | 174.6 | -75.4 | 173.1 | -165.4 | 0 | 0 | 113.7 | R45 T52 R53 | R45-E49 WeakPolarHBondContact O-CB 3.15Å; R45-E49 VanDerWaalsContact O-CG 3.31Å; R45-E49 WeakPolarHBondContact O-CG 3.29Å; R45-E49 PolarHBondContact O-N 3.24Å; E49-T52 WeakPolarHBondContact CA-OG1 3.31Å; E49-T52 PolarHBondContact O-OG1 3.32Å; E49-R53 WeakPolarHBondContact O-CB 3.28Å; E49-R53 PolarHBondContact O-N 3.44Å; E49-R53 VanDerWaalsContact O-N 3.14Å; E49-R53 PolarHBondContact O-NE 3.36Å |
| 50 | R | 73.8 | Confident | 67 | Low | 187 Ų | 187 | 115.2 Ų | 115.2 | 71% | 0.706 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.9 | -41.4 | 169.9 | -78.4 | 173.7 | -174.4 | -172.5 | 2 | 110.6 | G46 C47 R53 F54 | G46-R50 VanDerWaalsContact O-CB 3.28Å; G46-R50 WeakPolarHBondContact O-CB 3.33Å; G46-R50 WeakPolarHBondContact O-CG 2.92Å; G46-R50 PolarHBondContact O-N 3.22Å; C47-R50 PolarHBondContact O-N 2.8Å; R50-R53 PolarHBondContact O-N 3.21Å; R50-F54 VanDerWaalsContact O-CB 3.27Å; R50-F54 WeakPolarHBondContact O-CB 3.35Å; R50-F54 PolarHBondContact O-N 3.06Å |
| 51 | L | 75.7 | Confident | 67.6 | Low | 95 Ų | 95 | 112 Ų | 112 | 50% | 0.497 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.8 | -47.4 | 177.4 | -175.8 | 63.8 | 0 | 0 | 0 | 111 | C47 K48 R53 F54 L55 | C47-L51 VanDerWaalsContact O-CB 3.22Å; C47-L51 WeakPolarHBondContact O-CB 3.24Å; C47-L51 PolarHBondContact O-N 3.44Å; K48-L51 PolarHBondContact O-N 2.83Å; L51-R53 VanDerWaalsContact C-N 3.35Å; L51-R53 PolarHBondContact O-N 3.18Å; L51-F54 WeakPolarHBondContact O-CB 3.47Å; L51-F54 PolarHBondContact O-N 3.43Å; L51-F54 VanDerWaalsContact O-N 3.12Å; L51-L55 HydrophobicContact CD1-CD1 3.68Å; L51-L55 HydrophobicContact CD2-CD1 4.41Å; L51-L55 HydrophobicContact CG-CD1 3.57Å; L51-L55 WeakPolarHBondContact O-CB 3.33Å; L51-L55 VanDerWaalsContact O-CD1 3.24Å; L51-L55 WeakPolarHBondContact O-CD1 3.44Å; L51-L55 PolarHBondContact O-N 2.86Å |
| 52 | T | 77.8 | Confident | 68.9 | Low | 80 Ų | 80 | 108.5 Ų | 108.5 | 49% | 0.491 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.2 | -39.9 | 176.3 | 51.5 | 0 | 0 | 0 | 0 | 112 | K48 E49 F54 L55 S56 | K48-T52 WeakPolarHBondContact O-CG2 3.34Å; K48-T52 PolarHBondContact O-N 2.87Å; K48-T52 PolarHBondContact O-OG1 3.23Å; K48-T52 VanDerWaalsContact O-OG1 3.06Å; E49-T52 WeakPolarHBondContact CA-OG1 3.31Å; E49-T52 PolarHBondContact O-OG1 3.32Å; T52-F54 VanDerWaalsContact C-N 3.33Å; T52-F54 PolarHBondContact O-N 3.37Å; T52-L55 PolarHBondContact O-N 2.87Å; T52-S56 WeakPolarHBondContact O-CB 3.45Å; T52-S56 PolarHBondContact O-N 3.34Å; T52-S56 PolarHBondContact O-OG 2.95Å |
| 53 | R | 74.9 | Confident | 70.3 | Confident | 148 Ų | 148 | 103.6 Ų | 103.6 | 56% | 0.558 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.2 | -37.7 | 171.6 | -91.9 | -178.6 | -78.4 | -180 | -14.1 | 113 | E49 R50 L51 S56 R57 | E49-R53 WeakPolarHBondContact O-CB 3.28Å; E49-R53 PolarHBondContact O-N 3.44Å; E49-R53 VanDerWaalsContact O-N 3.14Å; E49-R53 PolarHBondContact O-NE 3.36Å; R50-R53 PolarHBondContact O-N 3.21Å; L51-R53 VanDerWaalsContact C-N 3.35Å; L51-R53 PolarHBondContact O-N 3.18Å; R53-S56 WeakPolarHBondContact CA-OG 3.21Å; R53-S56 PolarHBondContact O-OG 3.14Å; R53-S56 VanDerWaalsContact O-OG 3.06Å; R53-R57 WeakPolarHBondContact O-CB 3.37Å; R53-R57 VanDerWaalsContact O-CG 3.22Å; R53-R57 WeakPolarHBondContact O-CG 3.22Å; R53-R57 PolarHBondContact O-N 3.2Å; R53-R57 VanDerWaalsContact O-N 3.13Å |
| 54 | F | 74.4 | Confident | 71.3 | Confident | 123 Ų | 123 | 96.1 Ų | 96.1 | 54% | 0.539 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.9 | -45.7 | 176.8 | 178.7 | -93.3 | 0 | 0 | 0 | 111.2 | R50 L51 T52 R57 N58 | R50-F54 VanDerWaalsContact O-CB 3.27Å; R50-F54 WeakPolarHBondContact O-CB 3.35Å; R50-F54 PolarHBondContact O-N 3.06Å; L51-F54 WeakPolarHBondContact O-CB 3.47Å; L51-F54 PolarHBondContact O-N 3.43Å; L51-F54 VanDerWaalsContact O-N 3.12Å; T52-F54 VanDerWaalsContact C-N 3.33Å; T52-F54 PolarHBondContact O-N 3.37Å; F54-R57 PolarHBondContact O-N 3.11Å; F54-N58 WeakPolarHBondContact CE2-ND2 3.36Å; F54-N58 PolarHBondContact O-N 3.29Å; F54-N58 VanDerWaalsContact O-N 3.09Å; F54-N58 PolarHBondContact O-ND2 3.42Å |
| 55 | L | 75.3 | Confident | 72.4 | Confident | 73 Ų | 73 | 92 Ų | 92 | 38% | 0.382 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 175.5 | -91.8 | 118.4 | 0 | 0 | 0 | 111.8 | L51 T52 R57 N58 L59 I62 | L51-L55 HydrophobicContact CD1-CD1 3.68Å; L51-L55 HydrophobicContact CD2-CD1 4.41Å; L51-L55 HydrophobicContact CG-CD1 3.57Å; L51-L55 WeakPolarHBondContact O-CB 3.33Å; L51-L55 VanDerWaalsContact O-CD1 3.24Å; L51-L55 WeakPolarHBondContact O-CD1 3.44Å; L51-L55 PolarHBondContact O-N 2.86Å; T52-L55 PolarHBondContact O-N 2.87Å; L55-R57 VanDerWaalsContact C-N 3.33Å; L55-R57 PolarHBondContact O-N 2.75Å; L55-N58 CarbonylContact O-C 3.58Å; L55-N58 PolarHBondContact O-N 3.19Å; L55-L59 WeakPolarHBondContact O-CA 3.24Å; L55-L59 WeakPolarHBondContact O-CB 3.49Å; L55-L59 PolarHBondContact O-N 3.48Å; L55-I62 HydrophobicContact CD2-CD1 4.34Å; L55-I62 HydrophobicContact CG-CD1 4.18Å |
| 56 | S | 72.9 | Confident | 73.8 | Confident | 82 Ų | 82 | 85.4 Ų | 85.4 | 57% | 0.573 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -67.6 | -33.1 | 179.9 | 65.5 | 0 | 0 | 0 | 0 | 112.5 | T52 R53 | T52-S56 WeakPolarHBondContact O-CB 3.45Å; T52-S56 PolarHBondContact O-N 3.34Å; T52-S56 PolarHBondContact O-OG 2.95Å; R53-S56 WeakPolarHBondContact CA-OG 3.21Å; R53-S56 PolarHBondContact O-OG 3.14Å; R53-S56 VanDerWaalsContact O-OG 3.06Å |
| 57 | R | 67.1 | Low | 74.5 | Confident | 215 Ų | 215 | 84.5 Ų | 84.5 | 81% | 0.811 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -75.7 | -31.9 | 178.1 | -73.5 | 176.4 | 81.9 | 176.8 | 6 | 113.2 | R53 F54 L55 | R53-R57 WeakPolarHBondContact O-CB 3.37Å; R53-R57 VanDerWaalsContact O-CG 3.22Å; R53-R57 WeakPolarHBondContact O-CG 3.22Å; R53-R57 PolarHBondContact O-N 3.2Å; R53-R57 VanDerWaalsContact O-N 3.13Å; F54-R57 PolarHBondContact O-N 3.11Å; L55-R57 VanDerWaalsContact C-N 3.33Å; L55-R57 PolarHBondContact O-N 2.75Å |
| 58 | N | 70 | Confident | 74.9 | Confident | 40 Ų | 40 | 81.6 Ų | 81.6 | 21% | 0.214 | 40% | 0.395 | C | S | . | . | S | Bend | trans | -110.2 | 18.8 | -177.3 | -58.9 | -72 | 0 | 0 | 0 | 112.6 | F54 L55 L60 V61 I62 | F54-N58 WeakPolarHBondContact CE2-ND2 3.36Å; F54-N58 PolarHBondContact O-N 3.29Å; F54-N58 VanDerWaalsContact O-N 3.09Å; F54-N58 PolarHBondContact O-ND2 3.42Å; L55-N58 CarbonylContact O-C 3.58Å; L55-N58 PolarHBondContact O-N 3.19Å; N58-L60 VanDerWaalsContact C-N 3.34Å; N58-L60 PolarHBondContact O-N 3.39Å; N58-V61 PolarHBondContact O-N 3.06Å; N58-V61 VanDerWaalsContact O-N 3.15Å; N58-I62 HydrophobicContact CB-CD1 4.12Å; N58-I62 HydrophobicContact CB-CG1 4.4Å; N58-I62 WeakPolarHBondContact O-CG1 3.27Å; N58-I62 PolarHBondContact O-N 3.44Å |
| 59 | L | 78 | Confident | 75.3 | Confident | 68 Ų | 68 | 80.1 Ų | 80.1 | 36% | 0.356 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -56.2 | -47.9 | -170.4 | 179.8 | 60.9 | 0 | 0 | 0 | 111.8 | L55 V61 I62 L63 W281 | L55-L59 WeakPolarHBondContact O-CA 3.24Å; L55-L59 WeakPolarHBondContact O-CB 3.49Å; L55-L59 PolarHBondContact O-N 3.48Å; L59-V61 VanDerWaalsContact C-N 3.32Å; L59-V61 PolarHBondContact O-N 3.41Å; L59-I62 PolarHBondContact O-N 2.84Å; L59-L63 HydrophobicContact CD1-CD1 4.03Å; L59-L63 HydrophobicContact CD1-CG 4.05Å; L59-L63 HydrophobicContact CG-CD1 3.86Å; L59-L63 HydrophobicContact CG-CG 4.31Å; L59-L63 WeakPolarHBondContact O-CB 3.22Å; L59-L63 VanDerWaalsContact O-CG 3.26Å; L59-L63 WeakPolarHBondContact O-CG 3.42Å; L59-L63 PolarHBondContact O-N 2.85Å; L59-W281 HydrophobicContact CD2-CH2 4.01Å; L59-W281 HydrophobicContact CD2-CZ3 4.04Å |
| 60 | L | 68.7 | Low | 75.8 | Confident | 53 Ų | 53 | 79 Ų | 79 | 28% | 0.277 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.5 | -44 | -179 | -175.4 | 65 | 0 | 0 | 0 | 111.7 | N58 L63 T64 M280 P284 | N58-L60 VanDerWaalsContact C-N 3.34Å; N58-L60 PolarHBondContact O-N 3.39Å; L60-L63 PolarHBondContact O-N 3.43Å; L60-T64 PolarHBondContact O-N 2.8Å; L60-T64 PolarHBondContact O-OG1 2.8Å; L60-M280 WeakPolarHBondContact CD1-O 3.45Å; L60-M280 HydrophobicContact CD2-CB 4.29Å; L60-M280 HydrophobicContact CD2-CE 3.94Å; L60-P284 HydrophobicContact CD1-CG 4.23Å |
| 61 | V | 66.3 | Low | 76.4 | Confident | 39 Ų | 39 | 70.1 Ų | 70.1 | 24% | 0.236 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -64 | -47.4 | 178.5 | 179.1 | 0 | 0 | 0 | 0 | 111.1 | N58 L59 L63 T64 V65 | N58-V61 PolarHBondContact O-N 3.06Å; N58-V61 VanDerWaalsContact O-N 3.15Å; L59-V61 VanDerWaalsContact C-N 3.32Å; L59-V61 PolarHBondContact O-N 3.41Å; V61-L63 VanDerWaalsContact C-N 3.3Å; V61-L63 PolarHBondContact O-N 3.15Å; V61-T64 PolarHBondContact O-N 3.49Å; V61-V65 HydrophobicContact CG1-CG2 4.43Å; V61-V65 WeakPolarHBondContact O-CG2 3.22Å; V61-V65 PolarHBondContact O-N 2.8Å |
| 62 | I | 77.4 | Confident | 76.8 | Confident | 64 Ų | 64 | 67.9 Ų | 67.9 | 33% | 0.328 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 179.4 | -66.2 | 165.9 | 0 | 0 | 0 | 109.8 | L55 N58 L59 V65 S66 | L55-I62 HydrophobicContact CD2-CD1 4.34Å; L55-I62 HydrophobicContact CG-CD1 4.18Å; N58-I62 HydrophobicContact CB-CD1 4.12Å; N58-I62 HydrophobicContact CB-CG1 4.4Å; N58-I62 WeakPolarHBondContact O-CG1 3.27Å; N58-I62 PolarHBondContact O-N 3.44Å; L59-I62 PolarHBondContact O-N 2.84Å; I62-V65 PolarHBondContact O-N 3.48Å; I62-S66 VanDerWaalsContact O-CB 3.26Å; I62-S66 WeakPolarHBondContact O-CB 3.45Å; I62-S66 PolarHBondContact O-N 3.13Å; I62-S66 PolarHBondContact O-OG 3.45Å; I62-S66 VanDerWaalsContact O-OG 3.13Å |
| 63 | L | 80.7 | Confident | 77.3 | Confident | 64 Ų | 64 | 65.8 Ų | 65.8 | 34% | 0.335 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.4 | -47 | 176.2 | -73.5 | 173.6 | 0 | 0 | 0 | 111.1 | L59 L60 V61 S66 G67 W281 P284 | L59-L63 HydrophobicContact CD1-CD1 4.03Å; L59-L63 HydrophobicContact CD1-CG 4.05Å; L59-L63 HydrophobicContact CG-CD1 3.86Å; L59-L63 HydrophobicContact CG-CG 4.31Å; L59-L63 WeakPolarHBondContact O-CB 3.22Å; L59-L63 VanDerWaalsContact O-CG 3.26Å; L59-L63 WeakPolarHBondContact O-CG 3.42Å; L59-L63 PolarHBondContact O-N 2.85Å; L60-L63 PolarHBondContact O-N 3.43Å; V61-L63 VanDerWaalsContact C-N 3.3Å; V61-L63 PolarHBondContact O-N 3.15Å; L63-S66 WeakPolarHBondContact CA-OG 3.42Å; L63-S66 PolarHBondContact O-N 3.06Å; L63-S66 PolarHBondContact O-OG 3.47Å; L63-G67 PolarHBondContact O-N 3.13Å; L63-W281 HydrophobicContact CD1-CZ3 4.39Å; L63-P284 HydrophobicContact CB-CB 3.82Å; L63-P284 HydrophobicContact CB-CG 3.7Å |
| 64 | T | 71.7 | Confident | 78 | Confident | 16 Ų | 16 | 61.7 Ų | 61.7 | 10% | 0.098 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.5 | -47.3 | 178.8 | -57.7 | 0 | 0 | 0 | 0 | 112.3 | L60 V61 S66 G67 V68 I287 W467 | L60-T64 PolarHBondContact O-N 2.8Å; L60-T64 PolarHBondContact O-OG1 2.8Å; V61-T64 PolarHBondContact O-N 3.49Å; T64-S66 VanDerWaalsContact C-N 3.33Å; T64-S66 PolarHBondContact O-N 2.84Å; T64-G67 PolarHBondContact O-N 3.25Å; T64-G67 VanDerWaalsContact O-N 3.14Å; T64-V68 WeakPolarHBondContact O-CG2 3.44Å; T64-V68 PolarHBondContact O-N 2.9Å; T64-I287 HydrophobicContact CG2-CD1 3.94Å; T64-W467 HydrophobicContact CG2-CB 4.25Å |
| 65 | V | 76.2 | Confident | 78.5 | Confident | 40 Ų | 40 | 55.8 Ų | 55.8 | 24% | 0.242 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.7 | -44 | 177.2 | 173.4 | 0 | 0 | 0 | 0 | 110.6 | V61 I62 G67 V68 L69 W467 | V61-V65 HydrophobicContact CG1-CG2 4.43Å; V61-V65 WeakPolarHBondContact O-CG2 3.22Å; V61-V65 PolarHBondContact O-N 2.8Å; I62-V65 PolarHBondContact O-N 3.48Å; V65-G67 VanDerWaalsContact C-N 3.31Å; V65-G67 PolarHBondContact O-N 3.12Å; V65-V68 PolarHBondContact O-N 2.85Å; V65-L69 HydrophobicContact CG1-CD1 4.29Å; V65-L69 WeakPolarHBondContact O-CG 3.39Å; V65-L69 PolarHBondContact O-N 2.88Å; V65-W467 HydrophobicContact CG2-CD2 4.02Å; V65-W467 HydrophobicContact CG2-CE3 3.64Å; V65-W467 HydrophobicContact CG2-CH2 3.88Å; V65-W467 HydrophobicContact CG2-CZ2 4.23Å; V65-W467 HydrophobicContact CG2-CZ3 3.57Å |
| 66 | S | 81.6 | Confident | 79.1 | Confident | 48 Ų | 48 | 57.6 Ų | 57.6 | 34% | 0.336 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.4 | -38.1 | 175.3 | 72.9 | 0 | 0 | 0 | 0 | 112 | I62 L63 T64 L69 V70 | I62-S66 VanDerWaalsContact O-CB 3.26Å; I62-S66 WeakPolarHBondContact O-CB 3.45Å; I62-S66 PolarHBondContact O-N 3.13Å; I62-S66 PolarHBondContact O-OG 3.45Å; I62-S66 VanDerWaalsContact O-OG 3.13Å; L63-S66 WeakPolarHBondContact CA-OG 3.42Å; L63-S66 PolarHBondContact O-N 3.06Å; L63-S66 PolarHBondContact O-OG 3.47Å; T64-S66 VanDerWaalsContact C-N 3.33Å; T64-S66 PolarHBondContact O-N 2.84Å; S66-L69 PolarHBondContact O-N 3.4Å; S66-V70 WeakPolarHBondContact O-CB 3.41Å; S66-V70 WeakPolarHBondContact O-CG2 3.36Å; S66-V70 PolarHBondContact O-N 3.44Å |
| 67 | G | 82.8 | Confident | 79.8 | Confident | 6 Ų | 6 | 59.1 Ų | 59.1 | 6% | 0.062 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L63 T64 V65 G71 M288 | L63-G67 PolarHBondContact O-N 3.13Å; T64-G67 PolarHBondContact O-N 3.25Å; T64-G67 VanDerWaalsContact O-N 3.14Å; V65-G67 VanDerWaalsContact C-N 3.31Å; V65-G67 PolarHBondContact O-N 3.12Å; G67-G71 WeakPolarHBondContact O-CA 3.39Å; G67-G71 PolarHBondContact O-N 3.4Å; G67-M288 WeakPolarHBondContact O-CA 3.38Å; G67-M288 WeakPolarHBondContact O-CB 3.32Å |
| 68 | V | 75.4 | Confident | 80.8 | Confident | 22 Ų | 22 | 49.7 Ų | 49.7 | 13% | 0.133 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.9 | -50.2 | 172.7 | 175.5 | 0 | 0 | 0 | 0 | 110.7 | T64 V65 V70 G71 V72 I287 | T64-V68 WeakPolarHBondContact O-CG2 3.44Å; T64-V68 PolarHBondContact O-N 2.9Å; V65-V68 PolarHBondContact O-N 2.85Å; V68-V70 PolarHBondContact O-N 3.34Å; V68-G71 PolarHBondContact O-N 3.14Å; V68-V72 HydrophobicContact CG1-CG2 4.45Å; V68-V72 VanDerWaalsContact O-CG2 3.3Å; V68-V72 WeakPolarHBondContact O-CG2 3.44Å; V68-V72 PolarHBondContact O-N 3.42Å; V68-I287 HydrophobicContact CG2-CG2 3.51Å |
| 69 | L | 82.4 | Confident | 81.3 | Confident | 121 Ų | 121 | 52 Ų | 52 | 63% | 0.634 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -61.8 | -44 | -178.9 | -68.2 | 174.1 | 0 | 0 | 0 | 112.3 | V65 S66 V72 G73 | V65-L69 HydrophobicContact CG1-CD1 4.29Å; V65-L69 WeakPolarHBondContact O-CG 3.39Å; V65-L69 PolarHBondContact O-N 2.88Å; S66-L69 PolarHBondContact O-N 3.4Å; L69-V72 PolarHBondContact O-N 2.98Å; L69-G73 PolarHBondContact O-N 2.91Å |
| 70 | V | 89.8 | Confident | 81.5 | Confident | 75 Ų | 75 | 51.9 Ų | 51.9 | 46% | 0.455 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -66 | -40.8 | 175.6 | 174.8 | 0 | 0 | 0 | 0 | 110.4 | S66 V68 V72 G73 L74 M288 | S66-V70 WeakPolarHBondContact O-CB 3.41Å; S66-V70 WeakPolarHBondContact O-CG2 3.36Å; S66-V70 PolarHBondContact O-N 3.44Å; V68-V70 PolarHBondContact O-N 3.34Å; V70-V72 VanDerWaalsContact C-N 3.35Å; V70-V72 PolarHBondContact O-N 3.31Å; V70-G73 PolarHBondContact O-N 3.02Å; V70-L74 VanDerWaalsContact O-CB 3.24Å; V70-L74 WeakPolarHBondContact O-CB 3.19Å; V70-L74 PolarHBondContact O-N 3.3Å; V70-M288 HydrophobicContact CB-CG 4.29Å; V70-M288 HydrophobicContact CB-SD 4.19Å; V70-M288 HydrophobicContact CG1-CG 4.01Å; V70-M288 HydrophobicContact CG1-SD 3.52Å; V70-M288 VanDerWaalsContact CG1-SD 3.52Å |
| 71 | G | 86.3 | Confident | 82.2 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.4 | -42.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G67 V68 L74 G75 M288 G292 | G67-G71 WeakPolarHBondContact O-CA 3.39Å; G67-G71 PolarHBondContact O-N 3.4Å; V68-G71 PolarHBondContact O-N 3.14Å; G71-L74 PolarHBondContact O-N 2.84Å; G71-G75 PolarHBondContact O-N 3.41Å; G71-M288 WeakPolarHBondContact CA-O 3.46Å; G71-G292 WeakPolarHBondContact O-CA 3.26Å |
| 72 | V | 82.9 | Confident | 82.8 | Confident | 49 Ų | 49 | 60.6 Ų | 60.6 | 30% | 0.297 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.8 | -50.1 | 173.5 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | V68 L69 V70 L74 G75 M76 V291 I295 | V68-V72 HydrophobicContact CG1-CG2 4.45Å; V68-V72 VanDerWaalsContact O-CG2 3.3Å; V68-V72 WeakPolarHBondContact O-CG2 3.44Å; V68-V72 PolarHBondContact O-N 3.42Å; L69-V72 PolarHBondContact O-N 2.98Å; V70-V72 VanDerWaalsContact C-N 3.35Å; V70-V72 PolarHBondContact O-N 3.31Å; V72-L74 PolarHBondContact O-N 3.04Å; V72-G75 PolarHBondContact O-N 2.81Å; V72-M76 HydrophobicContact CG1-CE 4.11Å; V72-M76 WeakPolarHBondContact O-CG 3.23Å; V72-M76 PolarHBondContact O-N 3.31Å; V72-V291 HydrophobicContact CG2-CG1 3.79Å; V72-I295 HydrophobicContact CB-CD1 3.96Å; V72-I295 HydrophobicContact CG1-CD1 4.08Å; V72-I295 HydrophobicContact CG2-CD1 3.74Å |
| 73 | G | 88 | Confident | 82.9 | Confident | 35 Ų | 35 | 60.1 Ų | 60.1 | 36% | 0.361 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.5 | -43.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L69 V70 M76 L77 | L69-G73 PolarHBondContact O-N 2.91Å; V70-G73 PolarHBondContact O-N 3.02Å; G73-M76 PolarHBondContact O-N 3.43Å; G73-L77 PolarHBondContact O-N 3.28Å; G73-L77 VanDerWaalsContact O-N 3.09Å |
| 74 | L | 89.6 | Confident | 83 | Confident | 62 Ų | 62 | 60.3 Ų | 60.3 | 33% | 0.325 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -71.2 | -38.5 | -179.1 | -162.3 | 141 | 0 | 0 | 0 | 111.6 | V70 G71 V72 L77 V78 F91 | V70-L74 VanDerWaalsContact O-CB 3.24Å; V70-L74 WeakPolarHBondContact O-CB 3.19Å; V70-L74 PolarHBondContact O-N 3.3Å; G71-L74 PolarHBondContact O-N 2.84Å; V72-L74 PolarHBondContact O-N 3.04Å; L74-L77 PolarHBondContact O-N 3.36Å; L74-V78 HydrophobicContact CD2-CG2 3.86Å; L74-V78 HydrophobicContact CG-CG2 4.48Å; L74-V78 WeakPolarHBondContact O-CB 3.5Å; L74-V78 WeakPolarHBondContact O-CG2 3.34Å; L74-V78 PolarHBondContact O-N 3.43Å; L74-F91 HydrophobicContact CD2-CD2 4.43Å; L74-F91 HydrophobicContact CD2-CE1 4.41Å; L74-F91 HydrophobicContact CD2-CE2 3.16Å; L74-F91 HydrophobicContact CD2-CZ 3.16Å |
| 75 | G | 86.4 | Confident | 83.4 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -60.7 | -43.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G71 V72 L77 V78 R79 G292 V296 | G71-G75 PolarHBondContact O-N 3.41Å; V72-G75 PolarHBondContact O-N 2.81Å; G75-L77 VanDerWaalsContact C-N 3.35Å; G75-L77 PolarHBondContact O-N 2.99Å; G75-V78 PolarHBondContact O-N 3.27Å; G75-R79 VanDerWaalsContact O-CB 3.26Å; G75-R79 WeakPolarHBondContact O-CB 3.25Å; G75-R79 PolarHBondContact O-N 2.97Å; G75-G292 WeakPolarHBondContact CA-O 3.2Å; G75-V296 VanDerWaalsContact O-CG2 3.28Å; G75-V296 WeakPolarHBondContact O-CG2 3.23Å |
| 76 | M | 85.9 | Confident | 83.8 | Confident | 110 Ų | 110 | 66.4 Ų | 66.4 | 54% | 0.542 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.9 | -38.5 | 175.4 | -70.9 | -168.4 | -62.6 | 0 | 0 | 112.6 | V72 G73 G80 I295 | V72-M76 HydrophobicContact CG1-CE 4.11Å; V72-M76 WeakPolarHBondContact O-CG 3.23Å; V72-M76 PolarHBondContact O-N 3.31Å; G73-M76 PolarHBondContact O-N 3.43Å; M76-G80 PolarHBondContact O-N 3.23Å; M76-I295 HydrophobicContact CG-CG2 4.24Å |
| 77 | L | 89 | Confident | 84 | Confident | 115 Ų | 115 | 69.1 Ų | 69.1 | 60% | 0.602 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -66.4 | -48.6 | 177.1 | -174.5 | 148.8 | 0 | 0 | 0 | 111.6 | G73 L74 G75 R79 G80 M81 | G73-L77 PolarHBondContact O-N 3.28Å; G73-L77 VanDerWaalsContact O-N 3.09Å; L74-L77 PolarHBondContact O-N 3.36Å; G75-L77 VanDerWaalsContact C-N 3.35Å; G75-L77 PolarHBondContact O-N 2.99Å; L77-R79 VanDerWaalsContact C-N 3.29Å; L77-R79 PolarHBondContact O-N 2.95Å; L77-G80 PolarHBondContact O-N 3.17Å; L77-G80 VanDerWaalsContact O-N 3.11Å; L77-M81 HydrophobicContact CD2-SD 3.88Å |
| 78 | V | 87.9 | Confident | 83.9 | Confident | 16 Ų | 16 | 71.2 Ų | 71.2 | 10% | 0.097 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -63.5 | -36.3 | 179.6 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | L74 G75 G80 M81 L83 F91 V296 | L74-V78 HydrophobicContact CD2-CG2 3.86Å; L74-V78 HydrophobicContact CG-CG2 4.48Å; L74-V78 WeakPolarHBondContact O-CB 3.5Å; L74-V78 WeakPolarHBondContact O-CG2 3.34Å; L74-V78 PolarHBondContact O-N 3.43Å; G75-V78 PolarHBondContact O-N 3.27Å; V78-G80 PolarHBondContact O-N 2.82Å; V78-M81 WeakPolarHBondContact O-CB 3.44Å; V78-M81 PolarHBondContact O-N 3.13Å; V78-L83 HydrophobicContact CB-CD1 4.4Å; V78-L83 HydrophobicContact CG1-CD1 3.38Å; V78-L83 WeakPolarHBondContact O-CD1 3.21Å; V78-F91 HydrophobicContact CG1-CD1 4.41Å; V78-F91 HydrophobicContact CG1-CE1 4.43Å; V78-F91 HydrophobicContact CG2-CE2 4.39Å; V78-F91 HydrophobicContact CG2-CZ 4.35Å; V78-V296 HydrophobicContact CB-CG2 3.94Å; V78-V296 HydrophobicContact CG1-CG1 4.36Å; V78-V296 HydrophobicContact CG1-CG2 3.7Å |
| 79 | R | 81.4 | Confident | 84.2 | Confident | 90 Ų | 90 | 73.6 Ų | 73.6 | 34% | 0.34 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.1 | -35.3 | 174 | -178.9 | 175.4 | 169.1 | 152.2 | 2.1 | 112.6 | G75 L77 M81 V296 M298 E299 | G75-R79 VanDerWaalsContact O-CB 3.26Å; G75-R79 WeakPolarHBondContact O-CB 3.25Å; G75-R79 PolarHBondContact O-N 2.97Å; L77-R79 VanDerWaalsContact C-N 3.29Å; L77-R79 PolarHBondContact O-N 2.95Å; R79-M81 PolarHBondContact O-N 2.84Å; R79-V296 HydrophobicContact CB-CG2 4.33Å; R79-M298 PolarHBondContact NH1-O 3.13Å; R79-E299 PolarHBondContact NH2-O 3.11Å |
| 80 | G | 80.6 | Confident | 84.5 | Confident | 64 Ų | 64 | 74.5 Ų | 74.5 | 66% | 0.66 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | -13.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | M76 L77 V78 | M76-G80 PolarHBondContact O-N 3.23Å; L77-G80 PolarHBondContact O-N 3.17Å; L77-G80 VanDerWaalsContact O-N 3.11Å; V78-G80 PolarHBondContact O-N 2.82Å |
| 81 | M | 83.9 | Confident | 84.4 | Confident | 125 Ų | 125 | 72.5 Ų | 72.5 | 62% | 0.616 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.2 | 0.3 | -174 | -60.5 | 177.4 | 70.9 | 0 | 0 | 114.3 | L77 V78 R79 L83 | L77-M81 HydrophobicContact CD2-SD 3.88Å; V78-M81 WeakPolarHBondContact O-CB 3.44Å; V78-M81 PolarHBondContact O-N 3.13Å; R79-M81 PolarHBondContact O-N 2.84Å; M81-L83 HydrophobicContact CB-CD1 3.78Å; M81-L83 PolarHBondContact O-N 3.5Å |
| 82 | N | 78.7 | Confident | 84.2 | Confident | 150 Ų | 150 | 73.7 Ų | 73.7 | 80% | 0.802 | 41% | 0.412 | S | S | * | . | trans | 45.7 | 56.2 | 177.7 | -70.2 | -26.8 | 0 | 0 | 0 | 114.2 | ||||
| 83 | L | 79.3 | Confident | 84.4 | Confident | 54 Ų | 54 | 76.4 Ų | 76.4 | 28% | 0.283 | 42% | 0.42 | S | S | . | . | trans | -69.3 | 152.7 | -177.9 | -70 | 93.3 | 0 | 0 | 0 | 113.2 | V78 M81 Q87 | V78-L83 HydrophobicContact CB-CD1 4.4Å; V78-L83 HydrophobicContact CG1-CD1 3.38Å; V78-L83 WeakPolarHBondContact O-CD1 3.21Å; M81-L83 HydrophobicContact CB-CD1 3.78Å; M81-L83 PolarHBondContact O-N 3.5Å; L83-Q87 HydrophobicContact CB-CB 4.18Å; L83-Q87 HydrophobicContact CD2-CB 3.75Å | ||
| 84 | S | 83.9 | Confident | 84.4 | Confident | 68 Ų | 68 | 75.8 Ų | 75.8 | 48% | 0.476 | 41% | 0.41 | S | S | . | . | trans | -66.2 | 151.2 | 168.7 | 169.5 | 0 | 0 | 0 | 0 | 111.8 | A86 Q87 M88 | S84-A86 PolarHBondContact O-N 3.1Å; S84-A86 VanDerWaalsContact O-N 3.15Å; S84-A86 PolarHBondContact OG-N 3.47Å; S84-Q87 VanDerWaalsContact N-OE1 3.1Å; S84-Q87 PolarHBondContact O-N 3.46Å; S84-M88 PolarHBondContact O-N 2.96Å | ||
| 85 | K | 79.3 | Confident | 83.6 | Confident | 128 Ų | 128 | 72.9 Ų | 72.9 | 56% | 0.557 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -50.9 | -38.5 | 174.9 | -68.4 | -171.4 | 175.4 | -172.7 | 0 | 112.9 | M88 S89 S168 | K85-M88 PolarHBondContact O-N 3Å; K85-S89 PolarHBondContact O-N 3.13Å; K85-S89 VanDerWaalsContact O-N 3.08Å; K85-S168 PolarHBondContact NZ-O 3.45Å; K85-S168 PolarHBondContact NZ-OG 3.19Å |
| 86 | A | 83.9 | Confident | 83.1 | Confident | 57 Ų | 57 | 76.1 Ų | 76.1 | 47% | 0.471 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.5 | -42.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | S84 M88 S89 H90 | S84-A86 PolarHBondContact O-N 3.1Å; S84-A86 VanDerWaalsContact O-N 3.15Å; S84-A86 PolarHBondContact OG-N 3.47Å; A86-M88 VanDerWaalsContact C-N 3.32Å; A86-S89 PolarHBondContact O-N 3.01Å; A86-H90 PolarHBondContact O-CE1 3.44Å; A86-H90 PolarHBondContact O-N 3.15Å; A86-H90 PolarHBondContact O-ND1 2.99Å |
| 87 | Q | 86.1 | Confident | 82.8 | Confident | 105 Ų | 105 | 73.3 Ų | 73.3 | 49% | 0.491 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -69.9 | -32.8 | 177.9 | -63.3 | 171.2 | -57.3 | 0 | 0 | 111.5 | L83 S84 H90 F91 | L83-Q87 HydrophobicContact CB-CB 4.18Å; L83-Q87 HydrophobicContact CD2-CB 3.75Å; S84-Q87 VanDerWaalsContact N-OE1 3.1Å; S84-Q87 PolarHBondContact O-N 3.46Å; Q87-H90 PolarHBondContact O-N 2.98Å; Q87-F91 WeakPolarHBondContact O-CB 3.26Å; Q87-F91 PolarHBondContact O-N 3.41Å |
| 88 | M | 80.9 | Confident | 82.2 | Confident | 49 Ų | 49 | 67.9 Ų | 67.9 | 24% | 0.241 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.9 | -41.2 | 173.6 | -169.5 | 179.2 | -62.5 | 0 | 0 | 111.9 | S84 K85 A86 F91 A92 V296 E297 | S84-M88 PolarHBondContact O-N 2.96Å; K85-M88 PolarHBondContact O-N 3Å; A86-M88 VanDerWaalsContact C-N 3.32Å; M88-F91 WeakPolarHBondContact O-CB 3.41Å; M88-F91 PolarHBondContact O-N 3.41Å; M88-A92 PolarHBondContact O-N 3.44Å; M88-V296 HydrophobicContact CE-CB 4.49Å; M88-V296 HydrophobicContact CE-CG1 3.5Å; M88-V296 VanDerWaalsContact CE-CG1 3.5Å; M88-V296 HydrophobicContact SD-CG1 4.38Å; M88-E297 HydrophobicContact SD-CB 4.46Å |
| 89 | S | 81.8 | Confident | 81.2 | Confident | 72 Ų | 72 | 69.4 Ų | 69.4 | 50% | 0.503 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.6 | -43.6 | 174.2 | 175.8 | 0 | 0 | 0 | 0 | 112.1 | K85 A86 F91 A92 F93 | K85-S89 PolarHBondContact O-N 3.13Å; K85-S89 VanDerWaalsContact O-N 3.08Å; A86-S89 PolarHBondContact O-N 3.01Å; S89-F91 VanDerWaalsContact C-N 3.29Å; S89-F91 PolarHBondContact O-N 2.94Å; S89-A92 PolarHBondContact O-N 3.44Å; S89-F93 PolarHBondContact O-N 2.85Å |
| 90 | H | 88.8 | Confident | 80.9 | Confident | 141 Ų | 141 | 72.1 Ų | 72.1 | 65% | 0.653 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -62.7 | -36.4 | 174.8 | -64.7 | 110.7 | 0 | 0 | 0 | 112.6 | A86 Q87 F93 | A86-H90 PolarHBondContact O-CE1 3.44Å; A86-H90 PolarHBondContact O-N 3.15Å; A86-H90 PolarHBondContact O-ND1 2.99Å; Q87-H90 PolarHBondContact O-N 2.98Å; H90-F93 VanDerWaalsContact O-CB 3.32Å; H90-F93 WeakPolarHBondContact O-CB 3.37Å; H90-F93 PolarHBondContact O-N 3.48Å |
| 91 | F | 87.3 | Confident | 80.7 | Confident | 32 Ų | 32 | 71.9 Ų | 71.9 | 14% | 0.14 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -67.3 | -38.4 | 176.8 | 176.2 | -111.6 | 0 | 0 | 0 | 112.5 | L74 V78 Q87 M88 S89 F93 P94 F289 | L74-F91 HydrophobicContact CD2-CD2 4.43Å; L74-F91 HydrophobicContact CD2-CE1 4.41Å; L74-F91 HydrophobicContact CD2-CE2 3.16Å; L74-F91 HydrophobicContact CD2-CZ 3.16Å; V78-F91 HydrophobicContact CG1-CD1 4.41Å; V78-F91 HydrophobicContact CG1-CE1 4.43Å; V78-F91 HydrophobicContact CG2-CE2 4.39Å; V78-F91 HydrophobicContact CG2-CZ 4.35Å; Q87-F91 WeakPolarHBondContact O-CB 3.26Å; Q87-F91 PolarHBondContact O-N 3.41Å; M88-F91 WeakPolarHBondContact O-CB 3.41Å; M88-F91 PolarHBondContact O-N 3.41Å; S89-F91 VanDerWaalsContact C-N 3.29Å; S89-F91 PolarHBondContact O-N 2.94Å; F91-F93 VanDerWaalsContact C-N 3.28Å; F91-F93 PolarHBondContact O-N 2.89Å; F91-P94 WeakPolarHBondContact O-CD 3.41Å; F91-F289 HydrophobicContact CD2-CD1 4Å; F91-F289 HydrophobicContact CD2-CE1 4.16Å; F91-F289 AromaticContact CE2-CD1 3.57Å; F91-F289 HydrophobicContact CE2-CD1 3.57Å; F91-F289 AromaticContact CE2-CE1 3.75Å; F91-F289 HydrophobicContact CE2-CE1 3.75Å; F91-F289 HydrophobicContact CZ-CD1 4.1Å; F91-F289 WeakPolarHBondContact O-CD1 3.38Å |
| 92 | A | 82.3 | Confident | 79.8 | Confident | 25 Ų | 25 | 67.2 Ų | 67.2 | 21% | 0.207 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -74.6 | -14.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114 | M88 S89 G95 E96 | M88-A92 PolarHBondContact O-N 3.44Å; S89-A92 PolarHBondContact O-N 3.44Å; A92-G95 WeakPolarHBondContact O-CA 3.42Å; A92-G95 PolarHBondContact O-N 3.47Å; A92-E96 PolarHBondContact O-N 3.32Å |
| 93 | F | 87.9 | Confident | 79.1 | Confident | 106 Ų | 106 | 65.6 Ų | 65.6 | 47% | 0.465 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -53 | -44.3 | -170.3 | -179.3 | -97.7 | 0 | 0 | 0 | 115.1 | S89 H90 F91 G95 E96 M97 | S89-F93 PolarHBondContact O-N 2.85Å; H90-F93 VanDerWaalsContact O-CB 3.32Å; H90-F93 WeakPolarHBondContact O-CB 3.37Å; H90-F93 PolarHBondContact O-N 3.48Å; F91-F93 VanDerWaalsContact C-N 3.28Å; F91-F93 PolarHBondContact O-N 2.89Å; F93-G95 VanDerWaalsContact C-N 3.26Å; F93-G95 PolarHBondContact O-N 3.04Å; F93-E96 WeakPolarHBondContact O-CB 3.38Å; F93-E96 PolarHBondContact O-N 2.96Å; F93-E96 VanDerWaalsContact O-N 3.15Å; F93-M97 HydrophobicContact CD1-CG 4.2Å; F93-M97 HydrophobicContact CD2-CE 4.26Å; F93-M97 HydrophobicContact CE1-CG 3.75Å; F93-M97 HydrophobicContact CE1-SD 4.37Å; F93-M97 HydrophobicContact CE2-CE 3.55Å; F93-M97 HydrophobicContact CE2-CG 4.38Å; F93-M97 HydrophobicContact CE2-SD 4.39Å; F93-M97 HydrophobicContact CZ-CE 3.69Å; F93-M97 HydrophobicContact CZ-CG 3.85Å; F93-M97 HydrophobicContact CZ-SD 3.91Å; F93-M97 WeakPolarHBondContact O-CG 3.23Å; F93-M97 PolarHBondContact O-N 3.03Å |
| 94 | P | 86.9 | Confident | 79.2 | Confident | 22 Ų | 22 | 68.8 Ų | 68.8 | 14% | 0.143 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.7 | -34 | 177.2 | -23.4 | 35.7 | 0 | 0 | 0 | 113.3 | F91 L98 Y282 F285 F289 | F91-P94 WeakPolarHBondContact O-CD 3.41Å; P94-L98 PolarHBondContact O-N 3.44Å; P94-Y282 WeakPolarHBondContact CA-OH 3.46Å; P94-Y282 PolarHBondContact O-OH 3.32Å; P94-F285 HydrophobicContact CB-CD1 4.33Å; P94-F285 HydrophobicContact CB-CE1 3.8Å; P94-F285 HydrophobicContact CG-CE1 4.39Å; P94-F289 HydrophobicContact CB-CB 4.03Å; P94-F289 HydrophobicContact CB-CD2 3.58Å; P94-F289 HydrophobicContact CB-CE2 4.21Å; P94-F289 HydrophobicContact CB-CG 3.85Å; P94-F289 HydrophobicContact CG-CB 4.28Å; P94-F289 HydrophobicContact CG-CD1 4.12Å; P94-F289 HydrophobicContact CG-CD2 3.75Å; P94-F289 HydrophobicContact CG-CE1 4.41Å; P94-F289 HydrophobicContact CG-CE2 4.06Å; P94-F289 HydrophobicContact CG-CG 3.78Å; P94-F289 HydrophobicContact CG-CZ 4.39Å |
| 95 | G | 73.6 | Confident | 78.9 | Confident | 1 Ų | 1 | 65.9 Ų | 65.9 | 1% | 0.01 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -70.4 | -39.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A92 F93 L98 L99 G286 | A92-G95 WeakPolarHBondContact O-CA 3.42Å; A92-G95 PolarHBondContact O-N 3.47Å; F93-G95 VanDerWaalsContact C-N 3.26Å; F93-G95 PolarHBondContact O-N 3.04Å; G95-L98 WeakPolarHBondContact O-CB 3.11Å; G95-L98 PolarHBondContact O-N 2.74Å; G95-L99 PolarHBondContact O-N 3.29Å; G95-L99 VanDerWaalsContact O-N 3.15Å; G95-G286 WeakPolarHBondContact CA-O 3.23Å |
| 96 | E | 75.1 | Confident | 78.5 | Confident | 68 Ų | 68 | 60.2 Ų | 60.2 | 32% | 0.318 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.2 | -41.4 | 173.7 | -166.1 | -166.7 | 150.2 | 0 | 0 | 111.9 | A92 F93 L98 L99 R100 | A92-E96 PolarHBondContact O-N 3.32Å; F93-E96 WeakPolarHBondContact O-CB 3.38Å; F93-E96 PolarHBondContact O-N 2.96Å; F93-E96 VanDerWaalsContact O-N 3.15Å; E96-L98 VanDerWaalsContact C-N 3.27Å; E96-L98 PolarHBondContact O-N 2.91Å; E96-L99 WeakPolarHBondContact O-CB 3.41Å; E96-L99 PolarHBondContact O-N 3.01Å; E96-L99 VanDerWaalsContact O-N 3.11Å; E96-R100 WeakPolarHBondContact O-CG 3.34Å; E96-R100 PolarHBondContact O-N 3.37Å; E96-R100 IonicContact OE1-CZ 2.71Å; E96-R100 IonicContact OE1-NE 2.88Å; E96-R100 PolarHBondContact OE1-NE 2.99Å; E96-R100 IonicContact OE1-NH2 3.78Å; E96-R100 PolarHBondContact OE1-NH2 3.09Å |
| 97 | M | 81.4 | Confident | 78.4 | Confident | 51 Ų | 51 | 60.3 Ų | 60.3 | 25% | 0.251 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -58.3 | -40.5 | 174.2 | -74.3 | -61.4 | 107.2 | 0 | 0 | 111.7 | F93 L99 R100 M101 Y282 | F93-M97 HydrophobicContact CD1-CG 4.2Å; F93-M97 HydrophobicContact CD2-CE 4.26Å; F93-M97 HydrophobicContact CE1-CG 3.75Å; F93-M97 HydrophobicContact CE1-SD 4.37Å; F93-M97 HydrophobicContact CE2-CE 3.55Å; F93-M97 HydrophobicContact CE2-CG 4.38Å; F93-M97 HydrophobicContact CE2-SD 4.39Å; F93-M97 HydrophobicContact CZ-CE 3.69Å; F93-M97 HydrophobicContact CZ-CG 3.85Å; F93-M97 HydrophobicContact CZ-SD 3.91Å; F93-M97 WeakPolarHBondContact O-CG 3.23Å; F93-M97 PolarHBondContact O-N 3.03Å; M97-L99 PolarHBondContact O-N 3.38Å; M97-R100 PolarHBondContact O-N 2.78Å; M97-M101 VanDerWaalsContact O-CB 3.26Å; M97-M101 WeakPolarHBondContact O-CB 3.09Å; M97-M101 VanDerWaalsContact O-CG 3.25Å; M97-M101 WeakPolarHBondContact O-CG 3.3Å; M97-M101 PolarHBondContact O-N 3.36Å; M97-Y282 HydrophobicContact CB-CE1 4.49Å |
| 98 | L | 75.1 | Confident | 78.2 | Confident | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.005 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.6 | -47.5 | 173.9 | 173.3 | 61.7 | 0 | 0 | 0 | 111.1 | P94 G95 E96 R100 M101 L102 I279 Y282 I283 I287 | P94-L98 PolarHBondContact O-N 3.44Å; G95-L98 WeakPolarHBondContact O-CB 3.11Å; G95-L98 PolarHBondContact O-N 2.74Å; E96-L98 VanDerWaalsContact C-N 3.27Å; E96-L98 PolarHBondContact O-N 2.91Å; L98-R100 VanDerWaalsContact C-N 3.35Å; L98-R100 PolarHBondContact O-N 2.87Å; L98-M101 WeakPolarHBondContact O-CB 3.43Å; L98-M101 PolarHBondContact O-N 3.47Å; L98-L102 HydrophobicContact CD1-CD1 4.15Å; L98-L102 HydrophobicContact CD1-CG 4.15Å; L98-L102 HydrophobicContact CG-CD1 4.21Å; L98-L102 WeakPolarHBondContact O-CG 3.15Å; L98-L102 PolarHBondContact O-N 3.48Å; L98-I279 HydrophobicContact CD1-CG2 4.23Å; L98-Y282 HydrophobicContact CB-CD1 4.15Å; L98-Y282 HydrophobicContact CB-CE1 3.81Å; L98-Y282 HydrophobicContact CD1-CD1 4.09Å; L98-I283 HydrophobicContact CD1-CG1 3.79Å; L98-I287 HydrophobicContact CD2-CG1 3.98Å |
| 99 | L | 66.5 | Low | 78 | Confident | 48 Ų | 48 | 55 Ų | 55 | 25% | 0.251 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 178.9 | -65.7 | 177.5 | 0 | 0 | 0 | 112.4 | G95 E96 M97 L102 K103 L290 L463 | G95-L99 PolarHBondContact O-N 3.29Å; G95-L99 VanDerWaalsContact O-N 3.15Å; E96-L99 WeakPolarHBondContact O-CB 3.41Å; E96-L99 PolarHBondContact O-N 3.01Å; E96-L99 VanDerWaalsContact O-N 3.11Å; M97-L99 PolarHBondContact O-N 3.38Å; L99-L102 PolarHBondContact O-N 3.21Å; L99-K103 WeakPolarHBondContact O-CB 3.19Å; L99-K103 WeakPolarHBondContact O-CG 3.02Å; L99-K103 PolarHBondContact O-N 2.82Å; L99-L290 HydrophobicContact CD1-CD1 4.09Å; L99-L290 HydrophobicContact CD2-CD1 3.93Å; L99-L290 HydrophobicContact CG-CD1 3.86Å; L99-L463 HydrophobicContact CD2-CD1 3.2Å |
| 100 | R | 75.5 | Confident | 77.5 | Confident | 147 Ų | 147 | 51.8 Ų | 51.8 | 56% | 0.555 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -65.5 | -42.9 | 177.3 | -69.4 | -178.8 | -177.3 | -143.3 | 1.4 | 112 | E96 M97 L98 L102 K103 M104 | E96-R100 WeakPolarHBondContact O-CG 3.34Å; E96-R100 PolarHBondContact O-N 3.37Å; E96-R100 IonicContact OE1-CZ 2.71Å; E96-R100 IonicContact OE1-NE 2.88Å; E96-R100 PolarHBondContact OE1-NE 2.99Å; E96-R100 IonicContact OE1-NH2 3.78Å; E96-R100 PolarHBondContact OE1-NH2 3.09Å; M97-R100 PolarHBondContact O-N 2.78Å; L98-R100 VanDerWaalsContact C-N 3.35Å; L98-R100 PolarHBondContact O-N 2.87Å; R100-L102 VanDerWaalsContact C-N 3.34Å; R100-L102 PolarHBondContact O-N 3.05Å; R100-K103 PolarHBondContact O-N 3Å; R100-M104 WeakPolarHBondContact O-CB 3.44Å; R100-M104 PolarHBondContact O-N 2.93Å |
| 101 | M | 76.3 | Confident | 77.2 | Confident | 60 Ų | 60 | 46.4 Ų | 46.4 | 30% | 0.296 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -58.6 | -44.2 | 175.1 | -82.9 | 177.5 | 76.2 | 0 | 0 | 111.7 | M97 L98 I279 Y282 | M97-M101 VanDerWaalsContact O-CB 3.26Å; M97-M101 WeakPolarHBondContact O-CB 3.09Å; M97-M101 VanDerWaalsContact O-CG 3.25Å; M97-M101 WeakPolarHBondContact O-CG 3.3Å; M97-M101 PolarHBondContact O-N 3.36Å; L98-M101 WeakPolarHBondContact O-CB 3.43Å; L98-M101 PolarHBondContact O-N 3.47Å; M101-I279 HydrophobicContact CB-CD1 4.02Å; M101-I279 HydrophobicContact CB-CG2 4.29Å; M101-I279 HydrophobicContact CE-CB 4.2Å; M101-I279 HydrophobicContact CE-CD1 4.12Å; M101-I279 HydrophobicContact CE-CG1 3.66Å; M101-I279 HydrophobicContact CE-CG2 4.09Å; M101-Y282 HydrophobicContact CE-CD1 4.42Å; M101-Y282 HydrophobicContact SD-CD1 3.94Å; M101-Y282 HydrophobicContact SD-CE1 4.16Å; M101-Y282 HydrophobicContact SD-CG 4.43Å |
| 102 | L | 65.8 | Low | 77.1 | Confident | 27 Ų | 27 | 45.2 Ų | 45.2 | 14% | 0.141 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.4 | -48.5 | 174.2 | -66.6 | 174.4 | 0 | 0 | 0 | 111.4 | L98 L99 R100 M104 I105 I106 I279 I443 L463 | L98-L102 HydrophobicContact CD1-CD1 4.15Å; L98-L102 HydrophobicContact CD1-CG 4.15Å; L98-L102 HydrophobicContact CG-CD1 4.21Å; L98-L102 WeakPolarHBondContact O-CG 3.15Å; L98-L102 PolarHBondContact O-N 3.48Å; L99-L102 PolarHBondContact O-N 3.21Å; R100-L102 VanDerWaalsContact C-N 3.34Å; R100-L102 PolarHBondContact O-N 3.05Å; L102-M104 VanDerWaalsContact C-N 3.27Å; L102-M104 PolarHBondContact O-N 2.96Å; L102-I105 PolarHBondContact O-N 3.25Å; L102-I105 VanDerWaalsContact O-N 3.12Å; L102-I106 VanDerWaalsContact O-CG1 3.28Å; L102-I106 WeakPolarHBondContact O-CG1 3.35Å; L102-I106 PolarHBondContact O-N 3.22Å; L102-I279 HydrophobicContact CD2-CG2 4.07Å; L102-I443 HydrophobicContact CD2-CD1 4.43Å; L102-L463 HydrophobicContact CD1-CD2 4.21Å |
| 103 | K | 64.6 | Low | 76.8 | Confident | 116 Ų | 116 | 44.5 Ų | 44.5 | 50% | 0.504 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -56.7 | -37.8 | 178.7 | -77.8 | -176.7 | 178.5 | -171.1 | 0 | 113.3 | L99 R100 I105 I106 | L99-K103 WeakPolarHBondContact O-CB 3.19Å; L99-K103 WeakPolarHBondContact O-CG 3.02Å; L99-K103 PolarHBondContact O-N 2.82Å; R100-K103 PolarHBondContact O-N 3Å; K103-I105 VanDerWaalsContact C-N 3.32Å; K103-I105 PolarHBondContact O-N 3.44Å; K103-I106 HydrophobicContact CB-CD1 4.46Å; K103-I106 HydrophobicContact CG-CD1 4.28Å; K103-I106 PolarHBondContact O-N 2.8Å |
| 104 | M | 81.4 | Confident | 76.2 | Confident | 121 Ų | 121 | 39.7 Ų | 39.7 | 60% | 0.596 | 19% | 0.194 | S | C | * | . | H | α-helix | trans | -62.1 | -37.3 | 178.1 | -179.7 | -171.2 | 71 | 0 | 0 | 112.8 | R100 L102 P108 | R100-M104 WeakPolarHBondContact O-CB 3.44Å; R100-M104 PolarHBondContact O-N 2.93Å; L102-M104 VanDerWaalsContact C-N 3.27Å; L102-M104 PolarHBondContact O-N 2.96Å; M104-P108 WeakPolarHBondContact O-CD 3.34Å |
| 105 | I | 77.4 | Confident | 76.1 | Confident | 6 Ų | 6 | 38.7 Ų | 38.7 | 3% | 0.031 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -78.9 | -22.5 | -177.6 | -69.2 | -162.1 | 0 | 0 | 0 | 112.5 | L102 K103 L107 P108 L109 T272 L275 V276 I279 | L102-I105 PolarHBondContact O-N 3.25Å; L102-I105 VanDerWaalsContact O-N 3.12Å; K103-I105 VanDerWaalsContact C-N 3.32Å; K103-I105 PolarHBondContact O-N 3.44Å; I105-L107 PolarHBondContact O-N 3.2Å; I105-P108 VanDerWaalsContact O-CD 3.24Å; I105-P108 WeakPolarHBondContact O-CD 3.44Å; I105-P108 VanDerWaalsContact O-CG 3.28Å; I105-P108 WeakPolarHBondContact O-CG 3.21Å; I105-L109 HydrophobicContact CG2-CB 4.05Å; I105-L109 HydrophobicContact CG2-CD2 4.29Å; I105-L109 WeakPolarHBondContact O-CB 3.28Å; I105-L109 PolarHBondContact O-N 3.4Å; I105-L109 VanDerWaalsContact O-N 3.08Å; I105-T272 HydrophobicContact CG2-CG2 3.76Å; I105-L275 HydrophobicContact CD1-CB 3.84Å; I105-V276 HydrophobicContact CD1-CB 4.44Å; I105-V276 HydrophobicContact CD1-CG2 3.71Å; I105-V276 HydrophobicContact CG2-CG2 3.68Å; I105-I279 HydrophobicContact CD1-CD1 3.24Å; I105-I279 HydrophobicContact CD1-CG1 4.18Å; I105-I279 HydrophobicContact CG1-CD1 3.84Å |
| 106 | I | 70.7 | Confident | 76.3 | Confident | 10 Ų | 10 | 39 Ų | 39 | 5% | 0.051 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -55 | -53.3 | -173.8 | -54 | -177.3 | 0 | 0 | 0 | 111.6 | L102 K103 L109 V110 M235 I237 I443 | L102-I106 VanDerWaalsContact O-CG1 3.28Å; L102-I106 WeakPolarHBondContact O-CG1 3.35Å; L102-I106 PolarHBondContact O-N 3.22Å; K103-I106 HydrophobicContact CB-CD1 4.46Å; K103-I106 HydrophobicContact CG-CD1 4.28Å; K103-I106 PolarHBondContact O-N 2.8Å; I106-L109 PolarHBondContact O-N 2.92Å; I106-V110 HydrophobicContact CG2-CG2 3.95Å; I106-V110 WeakPolarHBondContact O-CB 3.36Å; I106-V110 VanDerWaalsContact O-CG2 3.24Å; I106-V110 WeakPolarHBondContact O-CG2 3.28Å; I106-V110 PolarHBondContact O-N 2.93Å; I106-M235 HydrophobicContact CB-CE 3.91Å; I106-M235 HydrophobicContact CG2-CE 3.64Å; I106-I237 HydrophobicContact CG2-CD1 4.2Å; I106-I443 HydrophobicContact CB-CG2 4.02Å; I106-I443 HydrophobicContact CD1-CB 4.21Å; I106-I443 HydrophobicContact CD1-CG1 4.12Å; I106-I443 HydrophobicContact CD1-CG2 3.65Å; I106-I443 HydrophobicContact CG1-CB 4.24Å; I106-I443 HydrophobicContact CG1-CD1 4.32Å; I106-I443 HydrophobicContact CG1-CG1 4.02Å; I106-I443 HydrophobicContact CG1-CG2 3.42Å; I106-I443 VanDerWaalsContact CG1-CG2 3.42Å; I106-I443 HydrophobicContact CG2-CG2 3.68Å |
| 107 | L | 80.4 | Confident | 76.3 | Confident | 59 Ų | 59 | 36.3 Ų | 36.3 | 31% | 0.309 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -57.6 | -57.5 | -176.2 | 176.7 | 65.1 | 0 | 0 | 0 | 113.2 | I105 L109 V111 A200 M235 L240 | I105-L107 PolarHBondContact O-N 3.2Å; L107-L109 VanDerWaalsContact C-N 3.31Å; L107-L109 PolarHBondContact O-N 3.09Å; L107-V111 HydrophobicContact CD1-CG2 4.16Å; L107-V111 WeakPolarHBondContact O-CG2 3.4Å; L107-V111 PolarHBondContact O-N 3.23Å; L107-A200 HydrophobicContact CD1-CB 4.11Å; L107-A200 HydrophobicContact CD2-CB 3.78Å; L107-M235 HydrophobicContact CB-CE 4.42Å; L107-M235 HydrophobicContact CB-SD 3.74Å; L107-M235 HydrophobicContact CD1-SD 3.79Å; L107-M235 HydrophobicContact CG-SD 4.25Å; L107-L240 HydrophobicContact CD1-CD1 3.5Å; L107-L240 VanDerWaalsContact CD1-CD1 3.5Å |
| 108 | P | 83.1 | Confident | 76.1 | Confident | 34 Ų | 34 | 34.3 Ų | 34.3 | 22% | 0.221 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.2 | -39.5 | -179.8 | 21 | -31.5 | 0 | 0 | 0 | 112.3 | M104 I105 C112 F268 T272 | M104-P108 WeakPolarHBondContact O-CD 3.34Å; I105-P108 VanDerWaalsContact O-CD 3.24Å; I105-P108 WeakPolarHBondContact O-CD 3.44Å; I105-P108 VanDerWaalsContact O-CG 3.28Å; I105-P108 WeakPolarHBondContact O-CG 3.21Å; P108-C112 VanDerWaalsContact O-CB 3.24Å; P108-C112 WeakPolarHBondContact O-CB 3.31Å; P108-C112 PolarHBondContact O-N 3.33Å; P108-C112 VanDerWaalsContact O-N 3.07Å; P108-C112 PolarHBondContact O-SG 3.36Å; P108-F268 HydrophobicContact CB-CE1 3.57Å; P108-F268 HydrophobicContact CB-CZ 4.31Å; P108-T272 HydrophobicContact CB-CG2 4.42Å; P108-T272 HydrophobicContact CG-CG2 4.33Å |
| 109 | L | 76 | Confident | 76.3 | Confident | 7 Ų | 7 | 34.3 Ų | 34.3 | 4% | 0.037 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -66.2 | -51.9 | -178.2 | -174.3 | 71.2 | 0 | 0 | 0 | 111.5 | I105 I106 L107 V111 S113 N269 T272 M273 A435 I437 | I105-L109 HydrophobicContact CG2-CB 4.05Å; I105-L109 HydrophobicContact CG2-CD2 4.29Å; I105-L109 WeakPolarHBondContact O-CB 3.28Å; I105-L109 PolarHBondContact O-N 3.4Å; I105-L109 VanDerWaalsContact O-N 3.08Å; I106-L109 PolarHBondContact O-N 2.92Å; L107-L109 VanDerWaalsContact C-N 3.31Å; L107-L109 PolarHBondContact O-N 3.09Å; L109-V111 PolarHBondContact O-N 3.43Å; L109-S113 WeakPolarHBondContact O-CB 3.41Å; L109-S113 PolarHBondContact O-N 3.3Å; L109-N269 WeakPolarHBondContact CD1-OD1 3.44Å; L109-T272 HydrophobicContact CB-CG2 4.15Å; L109-T272 HydrophobicContact CD1-CG2 4.23Å; L109-M273 HydrophobicContact CD1-SD 4.03Å; L109-A435 HydrophobicContact CD1-CB 4.18Å; L109-A435 HydrophobicContact CD2-CB 4.19Å; L109-A435 HydrophobicContact CG-CB 4.32Å; L109-I437 HydrophobicContact CD2-CD1 3.65Å |
| 110 | V | 72.2 | Confident | 76.5 | Confident | 6 Ų | 6 | 34.9 Ų | 34.9 | 4% | 0.036 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.4 | -48.9 | -176.9 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | I106 L114 I237 V241 | I106-V110 HydrophobicContact CG2-CG2 3.95Å; I106-V110 WeakPolarHBondContact O-CB 3.36Å; I106-V110 VanDerWaalsContact O-CG2 3.24Å; I106-V110 WeakPolarHBondContact O-CG2 3.28Å; I106-V110 PolarHBondContact O-N 2.93Å; V110-L114 HydrophobicContact CG1-CD1 3.79Å; V110-L114 WeakPolarHBondContact O-CB 3.27Å; V110-L114 VanDerWaalsContact O-CG 3.31Å; V110-L114 WeakPolarHBondContact O-CG 3.38Å; V110-L114 PolarHBondContact O-N 3.04Å; V110-I237 HydrophobicContact CG1-CG2 4.26Å; V110-V241 HydrophobicContact CG1-CG2 3.55Å |
| 111 | V | 82.1 | Confident | 76.1 | Confident | 28 Ų | 28 | 29.4 Ų | 29.4 | 17% | 0.17 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65 | -50.3 | -178 | 175.7 | 0 | 0 | 0 | 0 | 110.8 | L107 L109 V115 L240 | L107-V111 HydrophobicContact CD1-CG2 4.16Å; L107-V111 WeakPolarHBondContact O-CG2 3.4Å; L107-V111 PolarHBondContact O-N 3.23Å; L109-V111 PolarHBondContact O-N 3.43Å; V111-V115 HydrophobicContact CG1-CG2 4.41Å; V111-V115 WeakPolarHBondContact O-CB 3.41Å; V111-V115 VanDerWaalsContact O-CG2 3.23Å; V111-V115 WeakPolarHBondContact O-CG2 3.24Å; V111-V115 PolarHBondContact O-N 3Å; V111-L240 HydrophobicContact CG2-CB 4.37Å |
| 112 | C | 84.1 | Confident | 75.5 | Confident | 7 Ų | 7 | 27.9 Ų | 27.9 | 5% | 0.047 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -70.8 | -42.8 | -174.8 | -57.9 | 0 | 0 | 0 | 0 | 112 | P108 L114 V115 S116 F265 F268 N269 | P108-C112 VanDerWaalsContact O-CB 3.24Å; P108-C112 WeakPolarHBondContact O-CB 3.31Å; P108-C112 PolarHBondContact O-N 3.33Å; P108-C112 VanDerWaalsContact O-N 3.07Å; P108-C112 PolarHBondContact O-SG 3.36Å; C112-L114 VanDerWaalsContact C-N 3.34Å; C112-L114 PolarHBondContact O-N 3.43Å; C112-V115 PolarHBondContact O-N 3.43Å; C112-S116 VanDerWaalsContact O-CB 3.25Å; C112-S116 WeakPolarHBondContact O-CB 3.47Å; C112-S116 PolarHBondContact O-N 3.06Å; C112-S116 PolarHBondContact O-OG 3.32Å; C112-F265 HydrophobicContact CB-CD1 3.99Å; C112-F268 HydrophobicContact CB-CD1 4.23Å; C112-F268 WeakPolarHBondContact SG-CD1 3.44Å; C112-N269 HydrophobicContact CB-CB 4.17Å |
| 113 | S | 76.3 | Confident | 75.3 | Confident | 10 Ų | 10 | 31 Ų | 31 | 7% | 0.07 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.1 | -39.9 | 177.7 | -171.3 | 0 | 0 | 0 | 0 | 111.8 | L109 G117 | L109-S113 WeakPolarHBondContact O-CB 3.41Å; L109-S113 PolarHBondContact O-N 3.3Å; S113-G117 WeakPolarHBondContact O-CA 3.44Å; S113-G117 PolarHBondContact O-N 3.01Å |
| 114 | L | 75.2 | Confident | 74.9 | Confident | 5 Ų | 5 | 36.7 Ų | 36.7 | 3% | 0.026 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -73.8 | -39.8 | 178.3 | -78.2 | 173.5 | 0 | 0 | 0 | 113.4 | V110 C112 G117 A118 V241 A244 M245 V432 G433 | V110-L114 HydrophobicContact CG1-CD1 3.79Å; V110-L114 WeakPolarHBondContact O-CB 3.27Å; V110-L114 VanDerWaalsContact O-CG 3.31Å; V110-L114 WeakPolarHBondContact O-CG 3.38Å; V110-L114 PolarHBondContact O-N 3.04Å; C112-L114 VanDerWaalsContact C-N 3.34Å; C112-L114 PolarHBondContact O-N 3.43Å; L114-G117 PolarHBondContact O-N 2.99Å; L114-A118 WeakPolarHBondContact O-CB 3.44Å; L114-A118 PolarHBondContact O-N 2.95Å; L114-V241 HydrophobicContact CD1-CB 3.8Å; L114-V241 HydrophobicContact CD1-CG1 3.67Å; L114-V241 HydrophobicContact CD1-CG2 3.62Å; L114-A244 HydrophobicContact CB-CB 3.7Å; L114-A244 HydrophobicContact CD1-CB 4.37Å; L114-M245 HydrophobicContact CD2-CG 4.07Å; L114-V432 HydrophobicContact CD2-CG1 4.07Å; L114-G433 VanDerWaalsContact CD2-CA 3.46Å |
| 115 | V | 84.7 | Confident | 73.5 | Confident | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.7 | -49.7 | 174.8 | 171.4 | 0 | 0 | 0 | 0 | 109.6 | V111 C112 A119 A244 F247 G248 L251 F265 | V111-V115 HydrophobicContact CG1-CG2 4.41Å; V111-V115 WeakPolarHBondContact O-CB 3.41Å; V111-V115 VanDerWaalsContact O-CG2 3.23Å; V111-V115 WeakPolarHBondContact O-CG2 3.24Å; V111-V115 PolarHBondContact O-N 3Å; C112-V115 PolarHBondContact O-N 3.43Å; V115-A119 WeakPolarHBondContact O-CB 3.34Å; V115-A119 PolarHBondContact O-N 3.22Å; V115-A244 HydrophobicContact CG2-CB 3.83Å; V115-A244 WeakPolarHBondContact CG2-O 3.49Å; V115-F247 HydrophobicContact CG1-CD1 4.09Å; V115-F247 HydrophobicContact CG2-CD1 3.96Å; V115-G248 WeakPolarHBondContact O-CA 3.34Å; V115-L251 HydrophobicContact CG1-CD1 3.69Å; V115-F265 HydrophobicContact CB-CD1 4.26Å; V115-F265 HydrophobicContact CB-CD2 4.29Å; V115-F265 HydrophobicContact CB-CG 4.11Å; V115-F265 HydrophobicContact CG1-CB 4.27Å; V115-F265 HydrophobicContact CG1-CD1 4.3Å; V115-F265 HydrophobicContact CG1-CD2 3.47Å; V115-F265 VanDerWaalsContact CG1-CD2 3.47Å; V115-F265 HydrophobicContact CG1-CE2 3.85Å; V115-F265 HydrophobicContact CG1-CG 3.75Å; V115-F265 HydrophobicContact CG1-CZ 4.37Å; V115-F265 HydrophobicContact CG2-CE1 4.42Å |
| 116 | S | 79.3 | Confident | 72.4 | Confident | 9 Ų | 9 | 35.3 Ų | 35.3 | 6% | 0.063 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.1 | -45.4 | 176.4 | -74.4 | 0 | 0 | 0 | 0 | 112.9 | C112 A119 S120 F265 N266 | C112-S116 VanDerWaalsContact O-CB 3.25Å; C112-S116 WeakPolarHBondContact O-CB 3.47Å; C112-S116 PolarHBondContact O-N 3.06Å; C112-S116 PolarHBondContact O-OG 3.32Å; S116-A119 PolarHBondContact O-N 2.99Å; S116-S120 WeakPolarHBondContact O-CB 3.46Å; S116-S120 PolarHBondContact O-N 3.49Å; S116-F265 WeakPolarHBondContact OG-CB 3.26Å; S116-N266 WeakPolarHBondContact CB-OD1 3.41Å; S116-N266 PolarHBondContact OG-N 3.01Å; S116-N266 PolarHBondContact OG-OD1 3.47Å |
| 117 | G | 74.1 | Confident | 72.3 | Confident | 11 Ų | 11 | 37.4 Ų | 37.4 | 11% | 0.113 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.4 | -50.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | S113 L114 A119 S120 L121 | S113-G117 WeakPolarHBondContact O-CA 3.44Å; S113-G117 PolarHBondContact O-N 3.01Å; L114-G117 PolarHBondContact O-N 2.99Å; G117-A119 VanDerWaalsContact C-N 3.34Å; G117-A119 PolarHBondContact O-N 3.44Å; G117-S120 PolarHBondContact O-N 3.18Å; G117-S120 PolarHBondContact O-OG 3.49Å; G117-L121 PolarHBondContact O-N 3.33Å |
| 118 | A | 77.1 | Confident | 72.2 | Confident | 8 Ų | 8 | 41.2 Ų | 41.2 | 7% | 0.066 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -66.3 | -34.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | L114 S120 L121 M245 V249 | L114-A118 WeakPolarHBondContact O-CB 3.44Å; L114-A118 PolarHBondContact O-N 2.95Å; A118-S120 VanDerWaalsContact C-N 3.34Å; A118-L121 WeakPolarHBondContact O-CB 3.45Å; A118-L121 PolarHBondContact O-N 3.35Å; A118-M245 HydrophobicContact CB-CB 4.46Å; A118-M245 WeakPolarHBondContact CB-O 3.41Å; A118-V249 HydrophobicContact CB-CG2 4.28Å |
| 119 | A | 80.3 | Confident | 71.9 | Confident | 2 Ų | 2 | 41.2 Ų | 41.2 | 2% | 0.017 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -71.3 | -28.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | V115 S116 G117 L121 G248 R252 I262 | V115-A119 WeakPolarHBondContact O-CB 3.34Å; V115-A119 PolarHBondContact O-N 3.22Å; S116-A119 PolarHBondContact O-N 2.99Å; G117-A119 VanDerWaalsContact C-N 3.34Å; G117-A119 PolarHBondContact O-N 3.44Å; A119-L121 PolarHBondContact O-N 3.13Å; A119-G248 WeakPolarHBondContact CA-O 3.41Å; A119-G248 WeakPolarHBondContact CB-O 3.27Å; A119-R252 WeakPolarHBondContact O-CD 3.39Å; A119-I262 HydrophobicContact CB-CD1 3.73Å; A119-I262 HydrophobicContact CB-CG1 3.68Å; A119-I262 HydrophobicContact CB-CG2 4.25Å |
| 120 | S | 70.1 | Confident | 72 | Confident | 59 Ų | 59 | 40.9 Ų | 40.9 | 41% | 0.413 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -70.5 | -17.7 | 174.9 | 77.2 | 0 | 0 | 0 | 0 | 113.2 | S116 G117 A118 D122 | S116-S120 WeakPolarHBondContact O-CB 3.46Å; S116-S120 PolarHBondContact O-N 3.49Å; G117-S120 PolarHBondContact O-N 3.18Å; G117-S120 PolarHBondContact O-OG 3.49Å; A118-S120 VanDerWaalsContact C-N 3.34Å; S120-D122 VanDerWaalsContact C-N 3.33Å; S120-D122 PolarHBondContact O-N 3.03Å |
| 121 | L | 67.8 | Low | 72.4 | Confident | 33 Ų | 33 | 42.7 Ų | 42.7 | 17% | 0.173 | 25% | 0.248 | C | C | . | . | trans | -76.8 | 83.5 | 172.3 | -61.9 | 171.2 | 0 | 0 | 0 | 109.5 | G117 A118 A119 T123 V134 I387 | G117-L121 PolarHBondContact O-N 3.33Å; A118-L121 WeakPolarHBondContact O-CB 3.45Å; A118-L121 PolarHBondContact O-N 3.35Å; A119-L121 PolarHBondContact O-N 3.13Å; L121-T123 PolarHBondContact O-N 2.97Å; L121-V134 HydrophobicContact CD2-CG2 4.2Å; L121-I387 HydrophobicContact CD2-CD1 4.27Å; L121-I387 HydrophobicContact CD2-CG2 3.58Å | ||
| 122 | D | 63.7 | Low | 72.6 | Confident | 27 Ų | 27 | 43.8 Ų | 43.8 | 14% | 0.144 | 25% | 0.252 | C | S | . | . | trans | -70.8 | 78.8 | 176.6 | -172.9 | 10.8 | 0 | 0 | 0 | 114.1 | S120 R124 S125 L126 R252 | S120-D122 VanDerWaalsContact C-N 3.33Å; S120-D122 PolarHBondContact O-N 3.03Å; D122-R124 PolarHBondContact O-N 3.09Å; D122-R124 PolarHBondContact OD1-N 2.89Å; D122-S125 WeakPolarHBondContact CB-OG 3.3Å; D122-S125 PolarHBondContact O-N 3.33Å; D122-S125 VanDerWaalsContact O-N 3.12Å; D122-S125 PolarHBondContact OD1-N 3.17Å; D122-S125 WeakPolarHBondContact OD2-CB 3.43Å; D122-S125 PolarHBondContact OD2-OG 2.51Å; D122-L126 HydrophobicContact CB-CD1 3.96Å; D122-L126 WeakPolarHBondContact O-CA 3.1Å; D122-L126 WeakPolarHBondContact O-CB 3.38Å; D122-L126 WeakPolarHBondContact O-CD1 3.35Å; D122-L126 PolarHBondContact O-N 3.3Å; D122-R252 VanDerWaalsContact CG-NE 3.3Å; D122-R252 IonicContact OD1-CZ 3.61Å; D122-R252 IonicContact OD1-NE 3.9Å; D122-R252 PolarHBondContact OD1-NE 2.88Å; D122-R252 VanDerWaalsContact OD1-NE 3.14Å; D122-R252 IonicContact OD1-NH2 2.84Å; D122-R252 PolarHBondContact OD1-NH2 3.28Å; D122-R252 IonicContact OD2-CZ 3.61Å; D122-R252 IonicContact OD2-NE 3.2Å; D122-R252 IonicContact OD2-NH2 3.96Å; D122-R252 PolarHBondContact OD2-NH2 2.86Å | ||
| 123 | T | 59.7 | Low | 72.7 | Confident | 92 Ų | 92 | 43.7 Ų | 43.7 | 56% | 0.564 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.6 | -20.4 | -177.2 | 57 | 0 | 0 | 0 | 0 | 114.5 | L121 | L121-T123 PolarHBondContact O-N 2.97Š|
| 124 | R | 56.9 | Low | 73.1 | Confident | 236 Ų | 236 | 45.3 Ų | 45.3 | 89% | 0.891 | 26% | 0.261 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.8 | -36.3 | -178.9 | -136 | 176.9 | -174 | -177.5 | 1.3 | 113.4 | D122 | D122-R124 PolarHBondContact O-N 3.09Å; D122-R124 PolarHBondContact OD1-N 2.89Å |
| 125 | S | 52.8 | Low | 73.7 | Confident | 82 Ų | 82 | 47.5 Ų | 47.5 | 57% | 0.573 | 28% | 0.28 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94 | -16.9 | 171.6 | 74.6 | 0 | 0 | 0 | 0 | 113.6 | D122 G127 | D122-S125 WeakPolarHBondContact CB-OG 3.3Å; D122-S125 PolarHBondContact O-N 3.33Å; D122-S125 VanDerWaalsContact O-N 3.12Å; D122-S125 PolarHBondContact OD1-N 3.17Å; D122-S125 WeakPolarHBondContact OD2-CB 3.43Å; D122-S125 PolarHBondContact OD2-OG 2.51Å; S125-G127 PolarHBondContact O-N 2.87Å; S125-G127 VanDerWaalsContact O-N 3.11Å |
| 126 | L | 54.3 | Low | 74.1 | Confident | 17 Ų | 17 | 48.4 Ų | 48.4 | 9% | 0.089 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -57.7 | -25.6 | 177.9 | -108 | 78.4 | 0 | 0 | 0 | 112.1 | D122 L129 G130 F383 | D122-L126 HydrophobicContact CB-CD1 3.96Å; D122-L126 WeakPolarHBondContact O-CA 3.1Å; D122-L126 WeakPolarHBondContact O-CB 3.38Å; D122-L126 WeakPolarHBondContact O-CD1 3.35Å; D122-L126 PolarHBondContact O-N 3.3Å; L126-L129 PolarHBondContact O-N 3.11Å; L126-G130 PolarHBondContact O-N 3.45Å; L126-F383 HydrophobicContact CD1-CE2 3.83Å; L126-F383 HydrophobicContact CD1-CZ 3.44Å; L126-F383 VanDerWaalsContact CD1-CZ 3.44Å; L126-F383 HydrophobicContact CD2-CZ 4.37Å; L126-F383 HydrophobicContact CG-CE1 4.38Å; L126-F383 HydrophobicContact CG-CE2 4.43Å; L126-F383 HydrophobicContact CG-CZ 3.62Å |
| 127 | G | 68.8 | Low | 74.6 | Confident | 53 Ų | 53 | 48.2 Ų | 48.2 | 55% | 0.546 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | 49.9 | -152.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S125 L129 | S125-G127 PolarHBondContact O-N 2.87Å; S125-G127 VanDerWaalsContact O-N 3.11Å; G127-L129 VanDerWaalsContact C-N 3.35Å |
| 128 | K | 77.5 | Confident | 75.4 | Confident | 139 Ų | 139 | 52 Ų | 52 | 60% | 0.604 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -68.7 | -33.6 | 175.5 | -174.1 | 178.2 | 170 | -167.6 | 0 | 112.6 | G131 I132 E495 | K128-G131 PolarHBondContact O-N 3.31Å; K128-I132 HydrophobicContact CG-CD1 4.24Å; K128-I132 WeakPolarHBondContact O-CG1 3.48Å; K128-I132 PolarHBondContact O-N 2.71Å; K128-E495 WeakPolarHBondContact CD-OE1 3.27Å; K128-E495 IonicContact NZ-OE1 2.68Å; K128-E495 PolarHBondContact NZ-OE1 3.03Å |
| 129 | L | 76.9 | Confident | 76.1 | Confident | 34 Ų | 34 | 55.6 Ų | 55.6 | 18% | 0.178 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -68.3 | -42 | -173 | -170 | 65.7 | 0 | 0 | 0 | 112.3 | L126 G127 I132 A133 I380 L488 N492 | L126-L129 PolarHBondContact O-N 3.11Å; G127-L129 VanDerWaalsContact C-N 3.35Å; L129-I132 PolarHBondContact O-N 2.96Å; L129-A133 PolarHBondContact O-N 3.25Å; L129-A133 VanDerWaalsContact O-N 3.09Å; L129-I380 HydrophobicContact CD2-CD1 4.28Å; L129-I380 HydrophobicContact CD2-CG1 4.17Å; L129-L488 HydrophobicContact CD1-CB 4.12Å; L129-L488 HydrophobicContact CD1-CD2 3.94Å; L129-L488 HydrophobicContact CD1-CG 3.85Å; L129-L488 HydrophobicContact CG-CD2 3.96Å; L129-L488 HydrophobicContact CG-CG 4.42Å; L129-L488 WeakPolarHBondContact O-CD2 3.47Å; L129-N492 HydrophobicContact CD1-CB 4.18Å; L129-N492 HydrophobicContact CD2-CB 4.44Å |
| 130 | G | 77.6 | Confident | 76.9 | Confident | 1 Ų | 1 | 55.5 Ų | 55.5 | 1% | 0.01 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68.6 | -35.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114 | L126 I132 A133 V134 | L126-G130 PolarHBondContact O-N 3.45Å; G130-I132 VanDerWaalsContact C-N 3.28Å; G130-I132 PolarHBondContact O-N 3.46Å; G130-A133 VanDerWaalsContact O-CB 3.32Å; G130-A133 WeakPolarHBondContact O-CB 3.41Å; G130-A133 PolarHBondContact O-N 3.43Å; G130-A133 VanDerWaalsContact O-N 3.12Å; G130-V134 PolarHBondContact O-N 3.32Å |
| 131 | G | 81.6 | Confident | 78 | Confident | 44 Ų | 44 | 52.8 Ų | 52.8 | 45% | 0.454 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -60.7 | -39 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | K128 A135 | K128-G131 PolarHBondContact O-N 3.31Å; G131-A135 WeakPolarHBondContact O-CB 3.47Å; G131-A135 PolarHBondContact O-N 3.47Å |
| 132 | I | 86.4 | Confident | 79.2 | Confident | 50 Ų | 50 | 55.1 Ų | 55.1 | 26% | 0.256 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.5 | -38.5 | 173.7 | -62.7 | 166.3 | 0 | 0 | 0 | 110.9 | K128 L129 G130 A135 Y136 L488 I491 | K128-I132 HydrophobicContact CG-CD1 4.24Å; K128-I132 WeakPolarHBondContact O-CG1 3.48Å; K128-I132 PolarHBondContact O-N 2.71Å; L129-I132 PolarHBondContact O-N 2.96Å; G130-I132 VanDerWaalsContact C-N 3.28Å; G130-I132 PolarHBondContact O-N 3.46Å; I132-A135 PolarHBondContact O-N 2.97Å; I132-Y136 WeakPolarHBondContact O-CB 3.44Å; I132-Y136 PolarHBondContact O-N 3.16Å; I132-L488 HydrophobicContact CG2-CD1 4.04Å; I132-L488 HydrophobicContact CG2-CG 4.49Å; I132-I491 HydrophobicContact CD1-CG2 4.23Å; I132-I491 HydrophobicContact CG2-CD1 4.03Å |
| 133 | A | 85.4 | Confident | 80.7 | Confident | 5 Ų | 5 | 57 Ų | 57 | 4% | 0.041 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.2 | -50.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L129 G130 A135 Y136 F137 L488 | L129-A133 PolarHBondContact O-N 3.25Å; L129-A133 VanDerWaalsContact O-N 3.09Å; G130-A133 VanDerWaalsContact O-CB 3.32Å; G130-A133 WeakPolarHBondContact O-CB 3.41Å; G130-A133 PolarHBondContact O-N 3.43Å; G130-A133 VanDerWaalsContact O-N 3.12Å; A133-A135 VanDerWaalsContact C-N 3.35Å; A133-A135 PolarHBondContact O-N 2.89Å; A133-Y136 WeakPolarHBondContact O-CB 3.39Å; A133-Y136 PolarHBondContact O-N 3.39Å; A133-F137 WeakPolarHBondContact O-CD2 3.41Å; A133-F137 WeakPolarHBondContact O-CG 3.32Å; A133-F137 PolarHBondContact O-N 3.33Å; A133-L488 HydrophobicContact CB-CD2 3.49Å; A133-L488 VanDerWaalsContact CB-CD2 3.49Å |
| 134 | V | 83.9 | Confident | 82.5 | Confident | 44 Ų | 44 | 52.6 Ų | 52.6 | 27% | 0.267 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.8 | -42 | 179.6 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | L121 G130 Y136 F137 L138 | L121-V134 HydrophobicContact CD2-CG2 4.2Å; G130-V134 PolarHBondContact O-N 3.32Å; V134-Y136 VanDerWaalsContact C-N 3.33Å; V134-Y136 PolarHBondContact O-N 3.27Å; V134-F137 PolarHBondContact O-N 3.31Å; V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.47Å; V134-L138 WeakPolarHBondContact O-CG 3.11Å; V134-L138 PolarHBondContact O-N 3.39Å |
| 135 | A | 89.1 | Confident | 84.3 | Confident | 51 Ų | 51 | 41.4 Ų | 41.4 | 42% | 0.421 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -61.6 | -41.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | G131 I132 A133 V139 | G131-A135 WeakPolarHBondContact O-CB 3.47Å; G131-A135 PolarHBondContact O-N 3.47Å; I132-A135 PolarHBondContact O-N 2.97Å; A133-A135 VanDerWaalsContact C-N 3.35Å; A133-A135 PolarHBondContact O-N 2.89Å; A135-V139 WeakPolarHBondContact O-CB 3.35Å; A135-V139 VanDerWaalsContact O-CG2 3.23Å; A135-V139 WeakPolarHBondContact O-CG2 3.42Å; A135-V139 PolarHBondContact O-N 3.48Å |
| 136 | Y | 92.7 | Very high | 86.3 | Confident | 20 Ų | 20 | 38.9 Ų | 38.9 | 8% | 0.078 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.5 | -52 | 174.5 | 167.2 | -96.3 | 0 | 0 | 0 | 111 | I132 A133 V134 L138 V139 T140 I330 G480 G484 I487 | I132-Y136 WeakPolarHBondContact O-CB 3.44Å; I132-Y136 PolarHBondContact O-N 3.16Å; A133-Y136 WeakPolarHBondContact O-CB 3.39Å; A133-Y136 PolarHBondContact O-N 3.39Å; V134-Y136 VanDerWaalsContact C-N 3.33Å; V134-Y136 PolarHBondContact O-N 3.27Å; Y136-L138 PolarHBondContact O-N 3.39Å; Y136-V139 PolarHBondContact O-N 3.09Å; Y136-T140 HydrophobicContact CD2-CG2 3.93Å; Y136-T140 HydrophobicContact CE1-CG2 4.24Å; Y136-T140 HydrophobicContact CE2-CG2 3.54Å; Y136-T140 HydrophobicContact CG-CG2 4.44Å; Y136-T140 WeakPolarHBondContact O-CG2 3.28Å; Y136-T140 PolarHBondContact O-N 3.42Å; Y136-T140 PolarHBondContact O-OG1 3.31Å; Y136-I330 HydrophobicContact CE2-CG2 4.11Å; Y136-G480 PolarHBondContact OH-O 3.39Å; Y136-G484 PolarHBondContact OH-N 3.3Å; Y136-I487 HydrophobicContact CD2-CD1 4.2Å; Y136-I487 HydrophobicContact CE2-CD1 3.59Å |
| 137 | F | 90.7 | Very high | 88.3 | Confident | 5 Ų | 5 | 39.4 Ų | 39.4 | 2% | 0.022 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59 | -45.8 | -180 | -62.9 | -30.1 | 0 | 0 | 0 | 113.1 | A133 V134 V139 T140 T141 I384 I387 V391 N392 | A133-F137 WeakPolarHBondContact O-CD2 3.41Å; A133-F137 WeakPolarHBondContact O-CG 3.32Å; A133-F137 PolarHBondContact O-N 3.33Å; V134-F137 PolarHBondContact O-N 3.31Å; F137-V139 VanDerWaalsContact C-N 3.34Å; F137-V139 PolarHBondContact O-N 3.43Å; F137-T140 PolarHBondContact O-OG1 3.07Å; F137-T140 VanDerWaalsContact O-OG1 3.1Å; F137-T141 VanDerWaalsContact O-CB 3.28Å; F137-T141 WeakPolarHBondContact O-CB 3.42Å; F137-T141 PolarHBondContact O-N 3.43Å; F137-T141 PolarHBondContact O-OG1 3.25Å; F137-I384 HydrophobicContact CE1-CG2 4.38Å; F137-I384 HydrophobicContact CZ-CG2 3.67Å; F137-I387 HydrophobicContact CE2-CG2 4.25Å; F137-V391 HydrophobicContact CD2-CG1 4.19Å; F137-N392 HydrophobicContact CB-CB 4.03Å; F137-N392 HydrophobicContact CD1-CB 3.38Å; F137-N392 HydrophobicContact CD2-CB 4.16Å; F137-N392 HydrophobicContact CE1-CB 3.71Å; F137-N392 HydrophobicContact CE2-CB 4.43Å; F137-N392 HydrophobicContact CG-CB 3.63Å; F137-N392 HydrophobicContact CZ-CB 4.21Å |
| 138 | L | 89.2 | Confident | 89.6 | Confident | 90 Ų | 90 | 36.9 Ų | 36.9 | 47% | 0.471 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -62.7 | -41.7 | 178.3 | -73.5 | 173.1 | 0 | 0 | 0 | 111.9 | V134 Y136 L142 | V134-L138 HydrophobicContact CG1-CD1 4.06Å; V134-L138 HydrophobicContact CG1-CG 4.47Å; V134-L138 WeakPolarHBondContact O-CG 3.11Å; V134-L138 PolarHBondContact O-N 3.39Å; Y136-L138 PolarHBondContact O-N 3.39Å; L138-L142 VanDerWaalsContact O-CB 3.28Å; L138-L142 WeakPolarHBondContact O-CB 3.28Å; L138-L142 PolarHBondContact O-N 3.38Å |
| 139 | V | 93.5 | Very high | 90.4 | Very high | 83 Ų | 83 | 30.9 Ų | 30.9 | 50% | 0.503 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -70 | -45.1 | -179.4 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | A135 Y136 F137 T141 L142 I143 | A135-V139 WeakPolarHBondContact O-CB 3.35Å; A135-V139 VanDerWaalsContact O-CG2 3.23Å; A135-V139 WeakPolarHBondContact O-CG2 3.42Å; A135-V139 PolarHBondContact O-N 3.48Å; Y136-V139 PolarHBondContact O-N 3.09Å; F137-V139 VanDerWaalsContact C-N 3.34Å; F137-V139 PolarHBondContact O-N 3.43Å; V139-T141 VanDerWaalsContact C-N 3.35Å; V139-T141 PolarHBondContact O-N 3.07Å; V139-L142 PolarHBondContact O-N 2.93Å; V139-I143 HydrophobicContact CG1-CD1 3.78Å; V139-I143 HydrophobicContact CG1-CG1 4.49Å; V139-I143 VanDerWaalsContact O-CG1 3.25Å; V139-I143 WeakPolarHBondContact O-CG1 3.3Å; V139-I143 PolarHBondContact O-N 3.29Å |
| 140 | T | 95.2 | Very high | 91.3 | Very high | 1 Ų | 1 | 31.5 Ų | 31.5 | 1% | 0.006 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.5 | -42.8 | 178.6 | 53.7 | 0 | 0 | 0 | 0 | 111.3 | Y136 F137 L142 I143 A144 L327 I330 N392 D394 | Y136-T140 HydrophobicContact CD2-CG2 3.93Å; Y136-T140 HydrophobicContact CE1-CG2 4.24Å; Y136-T140 HydrophobicContact CE2-CG2 3.54Å; Y136-T140 HydrophobicContact CG-CG2 4.44Å; Y136-T140 WeakPolarHBondContact O-CG2 3.28Å; Y136-T140 PolarHBondContact O-N 3.42Å; Y136-T140 PolarHBondContact O-OG1 3.31Å; F137-T140 PolarHBondContact O-OG1 3.07Å; F137-T140 VanDerWaalsContact O-OG1 3.1Å; T140-L142 PolarHBondContact O-N 2.91Å; T140-I143 PolarHBondContact O-N 3.02Å; T140-A144 VanDerWaalsContact O-CB 3.3Å; T140-A144 WeakPolarHBondContact O-CB 3.45Å; T140-A144 PolarHBondContact O-N 3.39Å; T140-L327 HydrophobicContact CG2-CD2 3.84Å; T140-I330 HydrophobicContact CG2-CD1 4.15Å; T140-N392 PolarHBondContact OG1-OD1 3.26Å; T140-D394 VanDerWaalsContact C-OD1 3.27Å; T140-D394 PolarHBondContact OG1-OD1 3.11Å |
| 141 | T | 93.3 | Very high | 92.1 | Very high | 2 Ų | 2 | 32.4 Ų | 32.4 | 1% | 0.012 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -66.3 | -39.1 | 179.8 | -59.2 | 0 | 0 | 0 | 0 | 111.4 | F137 V139 A144 S145 D394 A397 T428 S431 | F137-T141 VanDerWaalsContact O-CB 3.28Å; F137-T141 WeakPolarHBondContact O-CB 3.42Å; F137-T141 PolarHBondContact O-N 3.43Å; F137-T141 PolarHBondContact O-OG1 3.25Å; V139-T141 VanDerWaalsContact C-N 3.35Å; V139-T141 PolarHBondContact O-N 3.07Å; T141-A144 WeakPolarHBondContact O-CB 3.26Å; T141-A144 PolarHBondContact O-N 3.28Å; T141-S145 WeakPolarHBondContact O-CB 3.49Å; T141-S145 PolarHBondContact O-N 2.99Å; T141-S145 PolarHBondContact O-OG 3.31Å; T141-D394 WeakPolarHBondContact CA-OD1 3.41Å; T141-D394 PolarHBondContact N-OD1 3.42Å; T141-D394 PolarHBondContact OG1-OD1 3.47Å; T141-D394 VanDerWaalsContact OG1-OD1 3.12Å; T141-A397 HydrophobicContact CG2-CB 3.76Å; T141-T428 HydrophobicContact CG2-CG2 3.81Å; T141-S431 WeakPolarHBondContact CG2-OG 3.44Å |
| 142 | L | 93.9 | Very high | 92.7 | Very high | 82 Ų | 82 | 30.3 Ų | 30.3 | 43% | 0.429 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -66.6 | -40.9 | 176.7 | -171.2 | 68.3 | 0 | 0 | 0 | 111.8 | L138 V139 T140 S145 G146 L424 | L138-L142 VanDerWaalsContact O-CB 3.28Å; L138-L142 WeakPolarHBondContact O-CB 3.28Å; L138-L142 PolarHBondContact O-N 3.38Å; V139-L142 PolarHBondContact O-N 2.93Å; T140-L142 PolarHBondContact O-N 2.91Å; L142-S145 PolarHBondContact O-N 2.93Å; L142-G146 PolarHBondContact O-N 3.42Å; L142-L424 HydrophobicContact CD1-CD2 3.79Å; L142-L424 HydrophobicContact CD1-CG 3.86Å |
| 143 | I | 96 | Very high | 92.9 | Very high | 66 Ų | 66 | 31.4 Ų | 31.4 | 34% | 0.338 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.7 | -45.3 | 173.7 | -68.4 | 167.2 | 0 | 0 | 0 | 110.3 | V139 T140 S145 G146 I147 V326 I330 | V139-I143 HydrophobicContact CG1-CD1 3.78Å; V139-I143 HydrophobicContact CG1-CG1 4.49Å; V139-I143 VanDerWaalsContact O-CG1 3.25Å; V139-I143 WeakPolarHBondContact O-CG1 3.3Å; V139-I143 PolarHBondContact O-N 3.29Å; T140-I143 PolarHBondContact O-N 3.02Å; I143-S145 PolarHBondContact O-N 2.7Å; I143-G146 PolarHBondContact O-N 2.85Å; I143-I147 HydrophobicContact CG2-CD1 3.85Å; I143-I147 HydrophobicContact CG2-CG1 4.49Å; I143-I147 WeakPolarHBondContact O-CG1 3.1Å; I143-I147 PolarHBondContact O-N 3.45Å; I143-V326 HydrophobicContact CG2-CG1 3.83Å; I143-I330 HydrophobicContact CD1-CD1 4.36Å |
| 144 | A | 96.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.9 | -48.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | T140 T141 G146 I147 G148 D394 I398 | T140-A144 VanDerWaalsContact O-CB 3.3Å; T140-A144 WeakPolarHBondContact O-CB 3.45Å; T140-A144 PolarHBondContact O-N 3.39Å; T141-A144 WeakPolarHBondContact O-CB 3.26Å; T141-A144 PolarHBondContact O-N 3.28Å; A144-G146 VanDerWaalsContact C-N 3.32Å; A144-G146 PolarHBondContact O-N 3.39Å; A144-I147 PolarHBondContact O-N 2.97Å; A144-G148 PolarHBondContact O-N 3.15Å; A144-D394 HydrophobicContact CB-CB 3.95Å; A144-I398 HydrophobicContact CB-CD1 3.91Å; A144-I398 HydrophobicContact CB-CG1 3.76Å; A144-I398 WeakPolarHBondContact O-CG1 3.34Å |
| 145 | S | 94.5 | Very high | 93.8 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57.9 | -43.5 | 175.4 | -56.6 | 0 | 0 | 0 | 0 | 111.8 | T141 L142 I143 I147 G148 V149 A397 L424 T428 | T141-S145 WeakPolarHBondContact O-CB 3.49Å; T141-S145 PolarHBondContact O-N 2.99Å; T141-S145 PolarHBondContact O-OG 3.31Å; L142-S145 PolarHBondContact O-N 2.93Å; I143-S145 PolarHBondContact O-N 2.7Å; S145-I147 PolarHBondContact O-N 3.44Å; S145-G148 PolarHBondContact O-N 2.98Å; S145-V149 WeakPolarHBondContact O-CG2 3.39Å; S145-V149 PolarHBondContact O-N 3.17Å; S145-A397 WeakPolarHBondContact OG-CB 3.42Å; S145-L424 VanDerWaalsContact C-CD1 3.49Å; S145-L424 VanDerWaalsContact CB-CD1 3.43Å; S145-T428 PolarHBondContact OG-OG1 2.84Å |
| 146 | G | 95.4 | Very high | 93.9 | Very high | 30 Ų | 30 | 40.2 Ų | 40.2 | 31% | 0.309 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -62.6 | -41.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L142 I143 A144 A150 L424 | L142-G146 PolarHBondContact O-N 3.42Å; I143-G146 PolarHBondContact O-N 2.85Å; A144-G146 VanDerWaalsContact C-N 3.32Å; A144-G146 PolarHBondContact O-N 3.39Å; G146-A150 VanDerWaalsContact O-CB 3.31Å; G146-A150 WeakPolarHBondContact O-CB 3.44Å; G146-A150 PolarHBondContact O-N 3.07Å; G146-L424 VanDerWaalsContact N-CD1 3.33Å |
| 147 | I | 96.3 | Very high | 93.6 | Very high | 27 Ų | 27 | 39.2 Ų | 39.2 | 14% | 0.138 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.2 | -44.5 | 173.8 | -67.3 | 162.6 | 0 | 0 | 0 | 110.4 | I143 A144 S145 A150 L151 I321 H322 V326 | I143-I147 HydrophobicContact CG2-CD1 3.85Å; I143-I147 HydrophobicContact CG2-CG1 4.49Å; I143-I147 WeakPolarHBondContact O-CG1 3.1Å; I143-I147 PolarHBondContact O-N 3.45Å; A144-I147 PolarHBondContact O-N 2.97Å; S145-I147 PolarHBondContact O-N 3.44Å; I147-A150 PolarHBondContact O-N 2.91Å; I147-L151 HydrophobicContact CG2-CD1 3.69Å; I147-L151 HydrophobicContact CG2-CG 4.24Å; I147-L151 WeakPolarHBondContact O-CB 3.21Å; I147-L151 WeakPolarHBondContact O-CG 3.49Å; I147-L151 PolarHBondContact O-N 3.05Å; I147-I321 HydrophobicContact CG2-CG2 4.35Å; I147-H322 HydrophobicContact CD1-CB 4.34Å; I147-V326 HydrophobicContact CD1-CG2 3.79Å |
| 148 | G | 95.7 | Very high | 93 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.2 | -50.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | A144 S145 A152 I402 | A144-G148 PolarHBondContact O-N 3.15Å; S145-G148 PolarHBondContact O-N 2.98Å; G148-A152 WeakPolarHBondContact O-CB 3.43Å; G148-A152 PolarHBondContact O-N 2.99Å; G148-I402 VanDerWaalsContact O-CG1 3.22Å; G148-I402 WeakPolarHBondContact O-CG1 3.46Å |
| 149 | V | 94.8 | Very high | 92.5 | Very high | 13 Ų | 13 | 38.6 Ų | 38.6 | 8% | 0.079 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.8 | -48.8 | 176.2 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | S145 L151 A152 F153 C401 I420 I423 | S145-V149 WeakPolarHBondContact O-CG2 3.39Å; S145-V149 PolarHBondContact O-N 3.17Å; V149-L151 PolarHBondContact O-N 3.37Å; V149-A152 PolarHBondContact O-N 3.44Å; V149-F153 HydrophobicContact CG1-CD2 3.73Å; V149-F153 HydrophobicContact CG1-CE2 3.7Å; V149-F153 VanDerWaalsContact O-CD2 3.3Å; V149-F153 WeakPolarHBondContact O-CD2 3.41Å; V149-F153 PolarHBondContact O-N 2.71Å; V149-F153 VanDerWaalsContact O-N 3.11Å; V149-C401 HydrophobicContact CG2-CB 3.77Å; V149-I420 HydrophobicContact CG1-CG2 3.87Å; V149-I423 HydrophobicContact CG2-CG2 4.17Å |
| 150 | A | 95.3 | Very high | 91.1 | Very high | 48 Ų | 48 | 36.6 Ų | 36.6 | 40% | 0.397 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.7 | -47.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112 | G146 I147 A152 F153 I154 | G146-A150 VanDerWaalsContact O-CB 3.31Å; G146-A150 WeakPolarHBondContact O-CB 3.44Å; G146-A150 PolarHBondContact O-N 3.07Å; I147-A150 PolarHBondContact O-N 2.91Å; A150-A152 VanDerWaalsContact C-N 3.34Å; A150-A152 PolarHBondContact O-N 3.47Å; A150-F153 PolarHBondContact O-N 2.87Å; A150-I154 WeakPolarHBondContact O-CD1 3.33Å; A150-I154 VanDerWaalsContact O-CG1 3.26Å; A150-I154 WeakPolarHBondContact O-CG1 3.06Å; A150-I154 PolarHBondContact O-N 3.39Å |
| 151 | L | 95.4 | Very high | 89.5 | Confident | 20 Ų | 20 | 36.6 Ų | 36.6 | 11% | 0.105 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63 | -39.3 | 178.2 | -74 | 173.4 | 0 | 0 | 0 | 112.2 | I147 V149 F153 I154 I155 L317 I321 | I147-L151 HydrophobicContact CG2-CD1 3.69Å; I147-L151 HydrophobicContact CG2-CG 4.24Å; I147-L151 WeakPolarHBondContact O-CB 3.21Å; I147-L151 WeakPolarHBondContact O-CG 3.49Å; I147-L151 PolarHBondContact O-N 3.05Å; V149-L151 PolarHBondContact O-N 3.37Å; L151-F153 VanDerWaalsContact C-N 3.32Å; L151-F153 PolarHBondContact O-N 3.18Å; L151-I154 PolarHBondContact O-N 3.45Å; L151-I155 WeakPolarHBondContact O-CB 3.36Å; L151-I155 WeakPolarHBondContact O-CG1 3.44Å; L151-I155 PolarHBondContact O-N 3.32Å; L151-L317 HydrophobicContact CD2-CD2 4.35Å; L151-I321 HydrophobicContact CD1-CD1 4.13Å; L151-I321 HydrophobicContact CD2-CD1 4.1Å |
| 152 | A | 93.1 | Very high | 87.6 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.6 | -34.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | G148 V149 A150 K156 P157 I402 V405 Q409 | G148-A152 WeakPolarHBondContact O-CB 3.43Å; G148-A152 PolarHBondContact O-N 2.99Å; V149-A152 PolarHBondContact O-N 3.44Å; A150-A152 VanDerWaalsContact C-N 3.34Å; A150-A152 PolarHBondContact O-N 3.47Å; A152-K156 WeakPolarHBondContact O-CA 3.46Å; A152-K156 PolarHBondContact O-N 3.45Å; A152-P157 VanDerWaalsContact O-CD 3.32Å; A152-P157 WeakPolarHBondContact O-CD 3.37Å; A152-I402 HydrophobicContact CB-CB 4.49Å; A152-I402 HydrophobicContact CB-CG1 4.32Å; A152-I402 HydrophobicContact CB-CG2 4.43Å; A152-V405 HydrophobicContact CB-CB 3.65Å; A152-V405 HydrophobicContact CB-CG1 3.56Å; A152-V405 HydrophobicContact CB-CG2 4.21Å; A152-Q409 PolarHBondContact O-NE2 3.26Å |
| 153 | F | 92.6 | Very high | 85.4 | Confident | 73 Ų | 73 | 36.9 Ų | 36.9 | 32% | 0.32 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -77 | -28 | 173.8 | -80.9 | -68.5 | 0 | 0 | 0 | 113.9 | V149 A150 L151 K156 V405 L415 I420 | V149-F153 HydrophobicContact CG1-CD2 3.73Å; V149-F153 HydrophobicContact CG1-CE2 3.7Å; V149-F153 VanDerWaalsContact O-CD2 3.3Å; V149-F153 WeakPolarHBondContact O-CD2 3.41Å; V149-F153 PolarHBondContact O-N 2.71Å; V149-F153 VanDerWaalsContact O-N 3.11Å; A150-F153 PolarHBondContact O-N 2.87Å; L151-F153 VanDerWaalsContact C-N 3.32Å; L151-F153 PolarHBondContact O-N 3.18Å; F153-K156 VanDerWaalsContact O-CE 3.28Å; F153-K156 WeakPolarHBondContact O-CE 3.36Å; F153-K156 WeakPolarHBondContact O-CG 3.35Å; F153-V405 HydrophobicContact CD2-CG1 4.46Å; F153-V405 HydrophobicContact CE1-CG1 4.41Å; F153-V405 HydrophobicContact CE2-CG1 4.3Å; F153-V405 HydrophobicContact CE2-CG2 4.19Å; F153-V405 HydrophobicContact CZ-CG1 4.27Å; F153-L415 HydrophobicContact CZ-CB 4.25Å; F153-L415 HydrophobicContact CZ-CD1 4.09Å; F153-I420 HydrophobicContact CE2-CD1 3.74Å; F153-I420 HydrophobicContact CE2-CG1 4.02Å; F153-I420 HydrophobicContact CZ-CD1 3.69Å; F153-I420 HydrophobicContact CZ-CG1 4.05Å |
| 154 | I | 94.1 | Very high | 83.1 | Confident | 132 Ų | 132 | 34.3 Ų | 34.3 | 68% | 0.677 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -75.1 | -49.4 | 175.5 | -68.7 | 164.7 | 0 | 0 | 0 | 110.5 | A150 L151 | A150-I154 WeakPolarHBondContact O-CD1 3.33Å; A150-I154 VanDerWaalsContact O-CG1 3.26Å; A150-I154 WeakPolarHBondContact O-CG1 3.06Å; A150-I154 PolarHBondContact O-N 3.39Å; L151-I154 PolarHBondContact O-N 3.45Å |
| 155 | I | 93 | Very high | 80.9 | Confident | 41 Ų | 41 | 36.8 Ų | 36.8 | 21% | 0.21 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -78.6 | -31.6 | -174.7 | -64.4 | 169.7 | 0 | 0 | 0 | 111.4 | L151 K310 F313 A314 L317 | L151-I155 WeakPolarHBondContact O-CB 3.36Å; L151-I155 WeakPolarHBondContact O-CG1 3.44Å; L151-I155 PolarHBondContact O-N 3.32Å; I155-K310 HydrophobicContact CG2-CB 4.42Å; I155-F313 HydrophobicContact CD1-CD1 4.31Å; I155-F313 HydrophobicContact CD1-CE1 4.36Å; I155-A314 HydrophobicContact CB-CB 4.46Å; I155-A314 HydrophobicContact CD1-CB 3.5Å; I155-A314 VanDerWaalsContact CD1-CB 3.5Å; I155-A314 HydrophobicContact CG2-CB 4.33Å; I155-L317 HydrophobicContact CD1-CD2 4.2Å |
| 156 | K | 90.6 | Very high | 78.2 | Confident | 111 Ų | 111 | 40.9 Ų | 40.9 | 48% | 0.483 | 25% | 0.251 | S | S | . | . | trans | 50.9 | 58.9 | -177.2 | -60.4 | -175 | 178 | 179.3 | 0 | 112.7 | A152 F153 G158 V159 | A152-K156 WeakPolarHBondContact O-CA 3.46Å; A152-K156 PolarHBondContact O-N 3.45Å; F153-K156 VanDerWaalsContact O-CE 3.28Å; F153-K156 WeakPolarHBondContact O-CE 3.36Å; F153-K156 WeakPolarHBondContact O-CG 3.35Å; K156-G158 VanDerWaalsContact C-N 3.27Å; K156-G158 PolarHBondContact O-N 3.17Å; K156-V159 HydrophobicContact CB-CB 4.1Å; K156-V159 HydrophobicContact CB-CG2 3.76Å; K156-V159 HydrophobicContact CD-CG2 4.26Å; K156-V159 HydrophobicContact CG-CG2 4.36Å; K156-V159 PolarHBondContact O-N 3.48Å | ||
| 157 | P | 87.1 | Confident | 75.7 | Confident | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.1 | -27.8 | -172.7 | 26.2 | -34 | 0 | 0 | 0 | 114 | A152 S307 K310 F406 Q409 | A152-P157 VanDerWaalsContact O-CD 3.32Å; A152-P157 WeakPolarHBondContact O-CD 3.37Å; P157-S307 WeakPolarHBondContact O-CB 3.2Å; P157-S307 PolarHBondContact O-OG 3.1Å; P157-K310 HydrophobicContact CB-CB 3.77Å; P157-F406 HydrophobicContact CB-CD2 3.75Å; P157-F406 HydrophobicContact CB-CE2 4.28Å; P157-F406 HydrophobicContact CG-CB 4.22Å; P157-F406 HydrophobicContact CG-CD2 3.87Å; P157-Q409 VanDerWaalsContact CD-OE1 3.3Å |
| 158 | G | 78.9 | Confident | 72.8 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.3 | -12.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | K156 G160 A161 | K156-G158 VanDerWaalsContact C-N 3.27Å; K156-G158 PolarHBondContact O-N 3.17Å; G158-G160 PolarHBondContact O-N 3.15Å; G158-A161 PolarHBondContact O-N 3.34Å |
| 159 | V | 78.1 | Confident | 69.8 | Low | 81 Ų | 81 | 54.9 Ų | 54.9 | 49% | 0.491 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | 126 | -177.8 | 177.2 | 0 | 0 | 0 | 0 | 110.3 | K156 Q409 | K156-V159 HydrophobicContact CB-CB 4.1Å; K156-V159 HydrophobicContact CB-CG2 3.76Å; K156-V159 HydrophobicContact CD-CG2 4.26Å; K156-V159 HydrophobicContact CG-CG2 4.36Å; K156-V159 PolarHBondContact O-N 3.48Å; V159-Q409 HydrophobicContact CG2-CB 4.29Å; V159-Q409 HydrophobicContact CG2-CG 4.15Å |
| 160 | G | 64.6 | Low | 66.8 | Low | 42 Ų | 42 | 58.6 Ų | 58.6 | 43% | 0.433 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 102.7 | -29.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | G158 G162 L303 | G158-G160 PolarHBondContact O-N 3.15Å; G160-G162 VanDerWaalsContact C-N 3.3Å; G160-G162 PolarHBondContact O-N 2.93Å; G160-L303 WeakPolarHBondContact O-CD2 3.35Å |
| 161 | A | 60.8 | Low | 63.8 | Low | 1 Ų | 1 | 63.7 Ų | 63.7 | 1% | 0.008 | 38% | 0.384 | C | S | . | . | G | 310 helix | trans | -79.3 | -11 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | G158 A163 L164 S307 L410 | G158-A161 PolarHBondContact O-N 3.34Å; A161-A163 PolarHBondContact O-N 3.4Å; A161-L164 HydrophobicContact CB-CD1 4.15Å; A161-L164 VanDerWaalsContact O-CB 3.24Å; A161-L164 WeakPolarHBondContact O-CB 3.16Å; A161-L164 WeakPolarHBondContact O-CG 3.32Å; A161-L164 PolarHBondContact O-N 3.29Å; A161-L164 VanDerWaalsContact O-N 3.09Å; A161-S307 WeakPolarHBondContact CB-OG 3.49Å; A161-L410 HydrophobicContact CB-CD2 3.57Å; A161-L410 HydrophobicContact CB-CG 4.44Å |
| 162 | G | 53.5 | Low | 60.6 | Low | 8 Ų | 8 | 71.2 Ų | 71.2 | 8% | 0.082 | 42% | 0.419 | C | S | . | . | G | 310 helix | trans | -69.3 | -8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | G160 L164 L410 N412 | G160-G162 VanDerWaalsContact C-N 3.3Å; G160-G162 PolarHBondContact O-N 2.93Å; G162-L164 PolarHBondContact O-N 3.38Å; G162-L410 WeakPolarHBondContact CA-O 3.42Å; G162-N412 PolarHBondContact O-ND2 2.96Å |
| 163 | A | 46.7 | Very low | 57.9 | Low | 82 Ų | 82 | 75.5 Ų | 75.5 | 68% | 0.678 | 45% | 0.449 | S | S | * | . | G | 310 helix | trans | -76.6 | -3 | 168.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A161 | A161-A163 PolarHBondContact O-N 3.4Š|
| 164 | L | 49.6 | Very low | 55.2 | Low | 12 Ų | 12 | 77.3 Ų | 77.3 | 6% | 0.063 | 47% | 0.465 | C | S | . | . | G | 310 helix | trans | -98.5 | -13.3 | -173.5 | -54 | 176.5 | 0 | 0 | 0 | 114.5 | A161 G162 T166 M298 D300 L303 L304 | A161-L164 HydrophobicContact CB-CD1 4.15Å; A161-L164 VanDerWaalsContact O-CB 3.24Å; A161-L164 WeakPolarHBondContact O-CB 3.16Å; A161-L164 WeakPolarHBondContact O-CG 3.32Å; A161-L164 PolarHBondContact O-N 3.29Å; A161-L164 VanDerWaalsContact O-N 3.09Å; G162-L164 PolarHBondContact O-N 3.38Å; L164-T166 PolarHBondContact O-N 2.93Å; L164-M298 HydrophobicContact CB-CE 4.44Å; L164-M298 HydrophobicContact CB-SD 3.81Å; L164-M298 HydrophobicContact CD1-SD 3.86Å; L164-M298 HydrophobicContact CG-SD 4.46Å; L164-D300 HydrophobicContact CD2-CB 3.56Å; L164-L303 HydrophobicContact CD1-CB 4.05Å; L164-L303 HydrophobicContact CD1-CD2 3.92Å; L164-L303 HydrophobicContact CD1-CG 3.98Å; L164-L303 HydrophobicContact CD2-CD2 3.87Å; L164-L303 HydrophobicContact CG-CD2 3.93Å; L164-L304 HydrophobicContact CD1-CB 4.34Å |
| 165 | N | 48.7 | Very low | 52.5 | Low | 52 Ų | 52 | 75.3 Ų | 75.3 | 28% | 0.278 | 46% | 0.463 | S | S | . | . | trans | -91.8 | 78.3 | 176 | -85.4 | -14.6 | 0 | 0 | 0 | 110.1 | N167 N411 | N165-N167 PolarHBondContact O-N 2.99Å; N165-N167 VanDerWaalsContact O-N 3.17Å; N165-N411 PolarHBondContact ND2-OD1 2.9Å | ||
| 166 | T | 38.2 | Very low | 50.3 | Low | 85 Ų | 85 | 75 Ų | 75 | 52% | 0.521 | 47% | 0.465 | S | S | . | . | trans | -75.8 | 100.6 | 161.2 | 56.9 | 0 | 0 | 0 | 0 | 108.4 | L164 S168 | L164-T166 PolarHBondContact O-N 2.93Å; T166-S168 VanDerWaalsContact C-N 3.33Å; T166-S168 PolarHBondContact O-N 3.35Å | ||
| 167 | N | 43.2 | Very low | 48.5 | Very low | 144 Ų | 144 | 76.2 Ų | 76.2 | 77% | 0.77 | 48% | 0.477 | S | S | * | . | trans | -45.6 | 88.2 | 168.3 | -71 | -31 | 0 | 0 | 0 | 111.9 | N165 | N165-N167 PolarHBondContact O-N 2.99Å; N165-N167 VanDerWaalsContact O-N 3.17Å | ||
| 168 | S | 34.6 | Very low | 47 | Very low | 67 Ų | 67 | 79.7 Ų | 79.7 | 47% | 0.469 | 49% | 0.492 | S | S | . | . | trans | -118.3 | 13.4 | 178.6 | 91.3 | 0 | 0 | 0 | 0 | 114.4 | K85 T166 | K85-S168 PolarHBondContact NZ-O 3.45Å; K85-S168 PolarHBondContact NZ-OG 3.19Å; T166-S168 VanDerWaalsContact C-N 3.33Å; T166-S168 PolarHBondContact O-N 3.35Å | ||
| 169 | L | 33.8 | Very low | 46.5 | Very low | 141 Ų | 141 | 84.6 Ų | 84.6 | 74% | 0.738 | 52% | 0.515 | S | S | * | . | S | Bend | trans | -114.7 | 107.5 | 157.6 | -79.6 | 161.2 | 0 | 0 | 0 | 106.2 | L171 | L169-L171 PolarHBondContact O-N 3.23Š|
| 170 | G | 30.4 | Very low | 45.8 | Very low | 90 Ų | 90 | 83.4 Ų | 83.4 | 93% | 0.928 | 51% | 0.508 | S | S | * | . | trans | -67.1 | 61.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 171 | L | 33.1 | Very low | 46 | Very low | 155 Ų | 155 | 85.3 Ų | 85.3 | 81% | 0.812 | 51% | 0.511 | S | S | * | . | trans | -91.5 | 108 | 157.2 | -151.1 | 74.8 | 0 | 0 | 0 | 105.2 | L169 S173 | L169-L171 PolarHBondContact O-N 3.23Å; L171-S173 PolarHBondContact O-N 3.48Å | ||
| 172 | E | 28.8 | Very low | 46.5 | Very low | 178 Ų | 178 | 86.1 Ų | 86.1 | 83% | 0.832 | 52% | 0.515 | S | S | * | . | trans | -47.9 | 110.3 | 175.9 | -69.3 | -176.5 | 158 | 0 | 0 | 108.5 | V174 | E172-V174 VanDerWaalsContact C-N 3.3Å; E172-V174 PolarHBondContact O-N 2.64Å | ||
| 173 | S | 34.8 | Very low | 47 | Very low | 91 Ų | 91 | 87.4 Ų | 87.4 | 64% | 0.636 | 52% | 0.523 | S | S | * | . | trans | -61.8 | 103 | 165.2 | 53.8 | 0 | 0 | 0 | 0 | 105.4 | L171 S175 | L171-S173 PolarHBondContact O-N 3.48Å; S173-S175 PolarHBondContact O-N 3.43Å | ||
| 174 | V | 36.5 | Very low | 47.9 | Very low | 110 Ų | 110 | 87.5 Ų | 87.5 | 67% | 0.667 | 51% | 0.508 | S | S | * | . | trans | -66.4 | 72.1 | 165.8 | -175.8 | 0 | 0 | 0 | 0 | 106.6 | E172 S176 | E172-V174 VanDerWaalsContact C-N 3.3Å; E172-V174 PolarHBondContact O-N 2.64Å; V174-S176 PolarHBondContact O-N 3.04Å | ||
| 175 | S | 38.6 | Very low | 49.2 | Very low | 90 Ų | 90 | 90.4 Ų | 90.4 | 63% | 0.629 | 52% | 0.523 | S | S | * | . | trans | -77.1 | 65 | 161.2 | -179.6 | 0 | 0 | 0 | 0 | 106.4 | S173 N177 | S173-S175 PolarHBondContact O-N 3.43Å; S175-N177 PolarHBondContact O-N 3.43Å; S175-N177 VanDerWaalsContact O-N 3.12Å | ||
| 176 | S | 45.9 | Very low | 50.3 | Low | 35 Ų | 35 | 88.3 Ų | 88.3 | 25% | 0.245 | 51% | 0.512 | C | S | . | . | trans | -64.5 | 112.7 | 160 | 64.3 | 0 | 0 | 0 | 0 | 104.9 | V174 K178 | V174-S176 PolarHBondContact O-N 3.04Å; S176-K178 PolarHBondContact O-N 3.47Å; S176-K178 WeakPolarHBondContact OG-CG 3.45Å | ||
| 177 | N | 51.8 | Low | 51.8 | Low | 137 Ų | 137 | 85.3 Ų | 85.3 | 73% | 0.733 | 49% | 0.493 | S | S | * | . | trans | -59.3 | 84.5 | 165.4 | -76 | -46.3 | 0 | 0 | 0 | 107.3 | S175 K225 | S175-N177 PolarHBondContact O-N 3.43Å; S175-N177 VanDerWaalsContact O-N 3.12Å; N177-K225 PolarHBondContact O-NZ 2.77Å | ||
| 178 | K | 57.3 | Low | 53.4 | Low | 72 Ų | 72 | 80.9 Ų | 80.9 | 31% | 0.313 | 48% | 0.476 | S | S | . | . | trans | -69 | 134.9 | 176.2 | -72.7 | -165.8 | -178.5 | -165.4 | 0 | 107.9 | S176 D186 T206 Y208 | S176-K178 PolarHBondContact O-N 3.47Å; S176-K178 WeakPolarHBondContact OG-CG 3.45Å; K178-D186 IonicContact NZ-OD2 2.95Å; K178-D186 PolarHBondContact NZ-OD2 2.83Å; K178-T206 WeakPolarHBondContact CE-O 3.38Å; K178-T206 PolarHBondContact NZ-O 3.41Å; K178-Y208 HydrophobicContact CG-CE2 4.27Å | ||
| 179 | E | 67.8 | Low | 55.7 | Low | 104 Ų | 104 | 82.1 Ų | 82.1 | 49% | 0.486 | 47% | 0.471 | S | S | . | . | trans | -64.3 | 144.8 | 169.1 | -67.4 | -176.6 | -164.9 | 0 | 0 | 108.8 | T181 D182 S183 Y208 | E179-T181 PolarHBondContact O-N 3Å; E179-D182 PolarHBondContact O-N 3.09Å; E179-D182 VanDerWaalsContact O-N 3.17Å; E179-S183 PolarHBondContact O-N 3.31Å; E179-S183 VanDerWaalsContact O-N 3.11Å; E179-S183 PolarHBondContact O-OG 3.28Å; E179-Y208 PolarHBondContact N-OH 3.2Å | ||
| 180 | T | 62.8 | Low | 57.7 | Low | 56 Ų | 56 | 76.5 Ų | 76.5 | 34% | 0.344 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -55.5 | -39.5 | 178.6 | 46 | 0 | 0 | 0 | 0 | 111.4 | S183 F184 N416 | T180-S183 WeakPolarHBondContact O-CB 3.36Å; T180-S183 PolarHBondContact O-N 2.72Å; T180-F184 WeakPolarHBondContact O-CD2 3.48Å; T180-F184 PolarHBondContact O-N 2.68Å; T180-F184 VanDerWaalsContact O-N 3.1Å; T180-N416 HydrophobicContact CG2-CB 4.15Å; T180-N416 WeakPolarHBondContact CG2-ND2 3.29Å |
| 181 | T | 69.7 | Low | 60.1 | Low | 82 Ų | 82 | 74.7 Ų | 74.7 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.5 | -46.9 | 179.7 | -48.1 | 0 | 0 | 0 | 0 | 111.1 | E179 S183 F184 L185 | E179-T181 PolarHBondContact O-N 3Å; T181-S183 VanDerWaalsContact C-N 3.28Å; T181-S183 PolarHBondContact O-N 3.25Å; T181-F184 PolarHBondContact O-N 3.24Å; T181-L185 HydrophobicContact CG2-CD1 4.31Å; T181-L185 VanDerWaalsContact O-CG 3.32Å; T181-L185 WeakPolarHBondContact O-CG 3.46Å; T181-L185 PolarHBondContact O-N 3.22Å |
| 182 | D | 71 | Confident | 62.7 | Low | 18 Ų | 18 | 74.9 Ų | 74.9 | 10% | 0.096 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -66.7 | -31.3 | 178.7 | -71.7 | -37.7 | 0 | 0 | 0 | 112.2 | E179 L185 D186 T206 Y208 | E179-D182 PolarHBondContact O-N 3.09Å; E179-D182 VanDerWaalsContact O-N 3.17Å; D182-L185 PolarHBondContact O-N 3.02Å; D182-D186 VanDerWaalsContact O-CB 3.3Å; D182-D186 WeakPolarHBondContact O-CB 3.14Å; D182-D186 PolarHBondContact O-N 3.08Å; D182-T206 HydrophobicContact CB-CG2 4.36Å; D182-Y208 WeakPolarHBondContact OD2-CE1 3.3Å; D182-Y208 VanDerWaalsContact OD2-CZ 3.29Å; D182-Y208 PolarHBondContact OD2-OH 3.33Å |
| 183 | S | 64.6 | Low | 65.5 | Low | 35 Ų | 35 | 68 Ų | 68 | 25% | 0.245 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.7 | -40.8 | 173.9 | -54.6 | 0 | 0 | 0 | 0 | 112.1 | E179 T180 T181 L187 | E179-S183 PolarHBondContact O-N 3.31Å; E179-S183 VanDerWaalsContact O-N 3.11Å; E179-S183 PolarHBondContact O-OG 3.28Å; T180-S183 WeakPolarHBondContact O-CB 3.36Å; T180-S183 PolarHBondContact O-N 2.72Å; T181-S183 VanDerWaalsContact C-N 3.28Å; T181-S183 PolarHBondContact O-N 3.25Å; S183-L187 PolarHBondContact O-N 3.12Å |
| 184 | F | 64.9 | Low | 68.1 | Low | 83 Ų | 83 | 69.1 Ų | 69.1 | 36% | 0.364 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -66.6 | -39.4 | 172.8 | -82.1 | -74 | 0 | 0 | 0 | 112.5 | T180 T181 L187 A188 F421 | T180-F184 WeakPolarHBondContact O-CD2 3.48Å; T180-F184 PolarHBondContact O-N 2.68Å; T180-F184 VanDerWaalsContact O-N 3.1Å; T181-F184 PolarHBondContact O-N 3.24Å; F184-L187 WeakPolarHBondContact O-CB 3.38Å; F184-L187 PolarHBondContact O-N 3.35Å; F184-A188 PolarHBondContact O-N 3.46Å; F184-A188 VanDerWaalsContact O-N 3.1Å; F184-F421 HydrophobicContact CE1-CB 4.5Å; F184-F421 AromaticContact CE1-CD1 3.83Å; F184-F421 HydrophobicContact CE1-CD1 3.83Å; F184-F421 HydrophobicContact CE1-CG 4.45Å |
| 185 | L | 76.3 | Confident | 70.9 | Confident | 73 Ų | 73 | 67.9 Ų | 67.9 | 38% | 0.382 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -68.8 | -38 | 177.3 | -65.8 | 175.7 | 0 | 0 | 0 | 111.4 | T181 D182 L187 A188 R189 | T181-L185 HydrophobicContact CG2-CD1 4.31Å; T181-L185 VanDerWaalsContact O-CG 3.32Å; T181-L185 WeakPolarHBondContact O-CG 3.46Å; T181-L185 PolarHBondContact O-N 3.22Å; D182-L185 PolarHBondContact O-N 3.02Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L185-A188 PolarHBondContact O-N 3.2Å; L185-R189 VanDerWaalsContact CB-NH1 3.34Å; L185-R189 VanDerWaalsContact O-CG 3.27Å; L185-R189 WeakPolarHBondContact O-CG 3.25Å; L185-R189 PolarHBondContact O-N 3.42Å |
| 186 | D | 72.4 | Confident | 73.4 | Confident | 9 Ų | 9 | 67 Ų | 67 | 5% | 0.048 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.8 | -40.4 | 172.5 | -77.6 | -3.6 | 0 | 0 | 0 | 111.1 | K178 D182 A188 R189 N190 T206 | K178-D186 IonicContact NZ-OD2 2.95Å; K178-D186 PolarHBondContact NZ-OD2 2.83Å; D182-D186 VanDerWaalsContact O-CB 3.3Å; D182-D186 WeakPolarHBondContact O-CB 3.14Å; D182-D186 PolarHBondContact O-N 3.08Å; D186-A188 PolarHBondContact O-N 2.95Å; D186-R189 PolarHBondContact O-N 2.96Å; D186-R189 IonicContact OD1-NH1 3.06Å; D186-R189 PolarHBondContact OD1-NH1 2.98Å; D186-N190 WeakPolarHBondContact O-CB 3.39Å; D186-N190 PolarHBondContact O-N 3.06Å; D186-N190 PolarHBondContact O-ND2 3.44Å; D186-T206 WeakPolarHBondContact OD1-CB 3.45Å; D186-T206 PolarHBondContact OD1-N 3.41Å; D186-T206 PolarHBondContact OD1-OG1 2.99Å; D186-T206 WeakPolarHBondContact OD2-CB 3.38Å; D186-T206 PolarHBondContact OD2-N 3.5Å |
| 187 | L | 69.9 | Low | 75.7 | Confident | 22 Ų | 22 | 70.5 Ų | 70.5 | 12% | 0.115 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -58.2 | -48.9 | 173.2 | -178.4 | 68.3 | 0 | 0 | 0 | 111.4 | S183 F184 L185 R189 N190 L191 L238 T422 T426 | S183-L187 PolarHBondContact O-N 3.12Å; F184-L187 WeakPolarHBondContact O-CB 3.38Å; F184-L187 PolarHBondContact O-N 3.35Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L187-R189 VanDerWaalsContact C-N 3.35Å; L187-R189 PolarHBondContact O-N 3.43Å; L187-N190 PolarHBondContact O-N 3.28Å; L187-L191 PolarHBondContact O-N 3.2Å; L187-L238 HydrophobicContact CD1-CD2 3.35Å; L187-L238 HydrophobicContact CG-CD2 4.41Å; L187-T422 HydrophobicContact CD1-CG2 3.77Å; L187-T422 HydrophobicContact CD2-CG2 4.13Å; L187-T426 HydrophobicContact CD1-CG2 4.26Å |
| 188 | A | 77.3 | Confident | 77.6 | Confident | 50 Ų | 50 | 64.9 Ų | 64.9 | 41% | 0.413 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63 | -39.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | F184 L185 D186 L191 | F184-A188 PolarHBondContact O-N 3.46Å; F184-A188 VanDerWaalsContact O-N 3.1Å; L185-A188 PolarHBondContact O-N 3.2Å; D186-A188 PolarHBondContact O-N 2.95Å; A188-L191 PolarHBondContact O-N 3.39Å |
| 189 | R | 82.3 | Confident | 78.9 | Confident | 94 Ų | 94 | 61.6 Ų | 61.6 | 36% | 0.355 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -66.7 | -38.3 | 175.3 | -69.9 | 171.2 | -167.6 | 123.5 | -0.8 | 111.9 | L185 D186 L187 L191 F192 Y204 T206 | L185-R189 VanDerWaalsContact CB-NH1 3.34Å; L185-R189 VanDerWaalsContact O-CG 3.27Å; L185-R189 WeakPolarHBondContact O-CG 3.25Å; L185-R189 PolarHBondContact O-N 3.42Å; D186-R189 PolarHBondContact O-N 2.96Å; D186-R189 IonicContact OD1-NH1 3.06Å; D186-R189 PolarHBondContact OD1-NH1 2.98Å; L187-R189 VanDerWaalsContact C-N 3.35Å; L187-R189 PolarHBondContact O-N 3.43Å; R189-L191 VanDerWaalsContact C-N 3.35Å; R189-F192 CarbonylContact O-C 3.6Å; R189-F192 PolarHBondContact O-N 3.01Å; R189-F192 VanDerWaalsContact O-O 3.1Å; R189-Y204 HydrophobicContact CB-CD1 4.05Å; R189-Y204 HydrophobicContact CB-CE1 4.48Å; R189-Y204 HydrophobicContact CB-CG 4.3Å; R189-Y204 HydrophobicContact CG-CE1 4.46Å; R189-T206 PolarHBondContact NH1-OG1 2.92Å |
| 190 | N | 75.7 | Confident | 79.7 | Confident | 22 Ų | 22 | 57.9 Ų | 57.9 | 12% | 0.118 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -72.1 | -26.4 | 177.9 | -79.1 | -57.2 | 0 | 0 | 0 | 113.1 | D186 L187 F192 Y204 N236 G239 | D186-N190 WeakPolarHBondContact O-CB 3.39Å; D186-N190 PolarHBondContact O-N 3.06Å; D186-N190 PolarHBondContact O-ND2 3.44Å; L187-N190 PolarHBondContact O-N 3.28Å; N190-F192 PolarHBondContact O-N 3.44Å; N190-Y204 PolarHBondContact ND2-O 2.97Å; N190-Y204 WeakPolarHBondContact OD1-CB 3.34Å; N190-Y204 PolarHBondContact OD1-N 3.41Å; N190-N236 PolarHBondContact O-ND2 2.89Å; N190-N236 PolarHBondContact O-OD1 2.88Å; N190-N236 PolarHBondContact OD1-ND2 3.48Å; N190-G239 WeakPolarHBondContact O-CA 3.38Å; N190-G239 PolarHBondContact O-N 3.13Å |
| 191 | L | 81.1 | Confident | 80.6 | Confident | 53 Ų | 53 | 60.3 Ų | 60.3 | 28% | 0.277 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -59.9 | -35.6 | 171.1 | -78.7 | 166.1 | 0 | 0 | 0 | 112.2 | L187 A188 R189 P193 L238 L242 | L187-L191 PolarHBondContact O-N 3.2Å; A188-L191 PolarHBondContact O-N 3.39Å; R189-L191 VanDerWaalsContact C-N 3.35Å; L191-P193 WeakPolarHBondContact O-CD 3.49Å; L191-L238 HydrophobicContact CD2-CD1 3.92Å; L191-L238 HydrophobicContact CD2-CD2 3.97Å; L191-L238 HydrophobicContact CD2-CG 3.79Å; L191-L238 HydrophobicContact CG-CD2 4.04Å; L191-L238 HydrophobicContact CG-CG 4.33Å; L191-L242 HydrophobicContact CB-CD2 4.04Å; L191-L242 HydrophobicContact CD2-CB 4.47Å; L191-L242 HydrophobicContact CD2-CD2 4.01Å; L191-L242 WeakPolarHBondContact O-CD2 3.38Å |
| 192 | F | 88.1 | Confident | 81.1 | Confident | 158 Ų | 158 | 61.1 Ų | 61.1 | 69% | 0.693 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -118.2 | 79.7 | -179.5 | -60 | -78.9 | 0 | 0 | 0 | 110.9 | R189 N190 L242 | R189-F192 CarbonylContact O-C 3.6Å; R189-F192 PolarHBondContact O-N 3.01Å; R189-F192 VanDerWaalsContact O-O 3.1Å; N190-F192 PolarHBondContact O-N 3.44Å; F192-L242 HydrophobicContact CD1-CD2 4.33Å; F192-L242 HydrophobicContact CE1-CD2 3.87Å; F192-L242 HydrophobicContact CZ-CD2 3.99Å |
| 193 | P | 86.4 | Confident | 81.2 | Confident | 33 Ų | 33 | 61.5 Ų | 61.5 | 21% | 0.214 | 33% | 0.33 | C | S | . | . | trans | -62.4 | 139.6 | -179.1 | 25.3 | -32.9 | 0 | 0 | 0 | 111.2 | L191 N195 L196 A199 | L191-P193 WeakPolarHBondContact O-CD 3.49Å; P193-N195 PolarHBondContact O-N 2.65Å; P193-L196 HydrophobicContact CG-CD2 4.18Å; P193-A199 HydrophobicContact CB-CB 3.75Å; P193-A199 HydrophobicContact CG-CB 4.12Å | ||
| 194 | S | 90.8 | Very high | 81.9 | Confident | 116 Ų | 116 | 63.7 Ų | 63.7 | 81% | 0.811 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -65 | -24.9 | 176.7 | 55.8 | 0 | 0 | 0 | 0 | 113 | ||
| 195 | N | 93.9 | Very high | 82.3 | Confident | 84 Ų | 84 | 60.6 Ų | 60.6 | 45% | 0.449 | 32% | 0.324 | S | S | . | . | trans | -150.4 | 127.1 | 178.2 | -176.2 | -48.8 | 0 | 0 | 0 | 110.7 | P193 V197 A198 A199 | P193-N195 PolarHBondContact O-N 2.65Å; N195-V197 WeakPolarHBondContact OD1-CA 3.3Å; N195-V197 WeakPolarHBondContact OD1-CB 3.02Å; N195-V197 PolarHBondContact OD1-N 3.34Å; N195-A198 HydrophobicContact CB-CB 3.87Å; N195-A198 PolarHBondContact O-N 3.48Å; N195-A198 PolarHBondContact OD1-N 3.39Å; N195-A199 WeakPolarHBondContact O-CB 3.43Å; N195-A199 PolarHBondContact O-N 2.66Å | ||
| 196 | L | 91.9 | Very high | 82.5 | Confident | 71 Ų | 71 | 57.3 Ų | 57.3 | 37% | 0.372 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -69.2 | -35.2 | -178.2 | -66 | 172.4 | 0 | 0 | 0 | 113.6 | P193 A199 A200 F243 | P193-L196 HydrophobicContact CG-CD2 4.18Å; L196-A199 PolarHBondContact O-N 3.42Å; L196-A200 PolarHBondContact O-N 2.94Å; L196-F243 HydrophobicContact CD1-CD1 4.09Å; L196-F243 HydrophobicContact CD1-CD2 3.9Å; L196-F243 HydrophobicContact CD1-CE1 3.72Å; L196-F243 HydrophobicContact CD1-CE2 3.51Å; L196-F243 HydrophobicContact CD1-CG 4.18Å; L196-F243 HydrophobicContact CD1-CZ 3.41Å; L196-F243 VanDerWaalsContact CD1-CZ 3.41Å; L196-F243 HydrophobicContact CD2-CB 3.95Å; L196-F243 HydrophobicContact CD2-CD1 3.84Å; L196-F243 HydrophobicContact CD2-CD2 3.8Å; L196-F243 HydrophobicContact CD2-CE1 4.33Å; L196-F243 HydrophobicContact CD2-CE2 4.3Å; L196-F243 HydrophobicContact CD2-CG 3.55Å; L196-F243 HydrophobicContact CG-CD2 4.47Å |
| 197 | V | 94.2 | Very high | 82.9 | Confident | 109 Ų | 109 | 60.2 Ų | 60.2 | 66% | 0.661 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -70.2 | -43.7 | 177.5 | -177 | 0 | 0 | 0 | 0 | 109.5 | N195 A199 A200 F201 | N195-V197 WeakPolarHBondContact OD1-CA 3.3Å; N195-V197 WeakPolarHBondContact OD1-CB 3.02Å; N195-V197 PolarHBondContact OD1-N 3.34Å; V197-A199 VanDerWaalsContact C-N 3.32Å; V197-A199 PolarHBondContact O-N 3Å; V197-A200 VanDerWaalsContact O-CB 3.28Å; V197-A200 WeakPolarHBondContact O-CB 3.25Å; V197-A200 PolarHBondContact O-N 3.23Å; V197-F201 HydrophobicContact CG1-CE1 4.44Å; V197-F201 VanDerWaalsContact O-CD1 3.24Å; V197-F201 WeakPolarHBondContact O-CD1 3.15Å; V197-F201 WeakPolarHBondContact O-CE1 3.5Å |
| 198 | A | 90.6 | Very high | 83.4 | Confident | 18 Ų | 18 | 60.9 Ų | 60.9 | 15% | 0.149 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.7 | -40.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | N195 A200 F201 R202 | N195-A198 HydrophobicContact CB-CB 3.87Å; N195-A198 PolarHBondContact O-N 3.48Å; N195-A198 PolarHBondContact OD1-N 3.39Å; A198-A200 PolarHBondContact O-N 2.9Å; A198-A200 VanDerWaalsContact O-N 3.08Å; A198-F201 CarbonylContact O-C 3.58Å; A198-F201 PolarHBondContact O-N 2.88Å; A198-R202 PolarHBondContact O-N 3.49Å |
| 199 | A | 86 | Confident | 83.7 | Confident | 3 Ų | 3 | 64.8 Ų | 64.8 | 3% | 0.025 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -57.7 | -23.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | P193 N195 L196 V197 F201 R202 M235 N236 L240 | P193-A199 HydrophobicContact CB-CB 3.75Å; P193-A199 HydrophobicContact CG-CB 4.12Å; N195-A199 WeakPolarHBondContact O-CB 3.43Å; N195-A199 PolarHBondContact O-N 2.66Å; L196-A199 PolarHBondContact O-N 3.42Å; V197-A199 VanDerWaalsContact C-N 3.32Å; V197-A199 PolarHBondContact O-N 3Å; A199-F201 PolarHBondContact O-N 2.77Å; A199-R202 WeakPolarHBondContact CA-O 3.36Å; A199-M235 CarbonylContact O-C 3.51Å; A199-N236 HydrophobicContact CB-CB 4.15Å; A199-N236 PolarHBondContact O-N 3.37Å; A199-L240 HydrophobicContact CB-CD2 4.2Å; A199-L240 HydrophobicContact CB-CG 4.3Å |
| 200 | A | 84.3 | Confident | 83.7 | Confident | 27 Ų | 27 | 65.5 Ų | 65.5 | 22% | 0.223 | 34% | 0.34 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -17.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | L107 L196 V197 A198 M235 | L107-A200 HydrophobicContact CD1-CB 4.11Å; L107-A200 HydrophobicContact CD2-CB 3.78Å; L196-A200 PolarHBondContact O-N 2.94Å; V197-A200 VanDerWaalsContact O-CB 3.28Å; V197-A200 WeakPolarHBondContact O-CB 3.25Å; V197-A200 PolarHBondContact O-N 3.23Å; A198-A200 PolarHBondContact O-N 2.9Å; A198-A200 VanDerWaalsContact O-N 3.08Å; A200-M235 WeakPolarHBondContact O-CG 2.92Å |
| 201 | F | 81.4 | Confident | 84.2 | Confident | 106 Ų | 106 | 67.4 Ų | 67.4 | 47% | 0.465 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -142.7 | -4.2 | -178.4 | 61.7 | -87.8 | 0 | 0 | 0 | 115.1 | V197 A198 A199 G234 | V197-F201 HydrophobicContact CG1-CE1 4.44Å; V197-F201 VanDerWaalsContact O-CD1 3.24Å; V197-F201 WeakPolarHBondContact O-CD1 3.15Å; V197-F201 WeakPolarHBondContact O-CE1 3.5Å; A198-F201 CarbonylContact O-C 3.58Å; A198-F201 PolarHBondContact O-N 2.88Å; A199-F201 PolarHBondContact O-N 2.77Å; F201-G234 CarbonylContact C-O 3.58Å; F201-G234 VanDerWaalsContact C-O 3.29Å; F201-G234 CarbonylContact O-C 3.32Å; F201-G234 PolarHBondContact O-N 3.12Å |
| 202 | R | 80.6 | Confident | 84.2 | Confident | 100 Ų | 100 | 67.7 Ų | 67.7 | 38% | 0.377 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 148.9 | 177.2 | -69.8 | 179.3 | -178.8 | 175.7 | 2.8 | 112.4 | A198 A199 E231 A232 G234 N236 | A198-R202 PolarHBondContact O-N 3.49Å; A199-R202 WeakPolarHBondContact CA-O 3.36Å; R202-E231 HydrophobicContact CB-CB 4.42Å; R202-E231 WeakPolarHBondContact CD-OE2 3.37Å; R202-E231 IonicContact CZ-OE2 3.17Å; R202-E231 IonicContact NE-OE2 3.65Å; R202-E231 IonicContact NH1-OE2 3.93Å; R202-E231 PolarHBondContact NH1-OE2 2.86Å; R202-A232 WeakPolarHBondContact CA-O 3.22Å; R202-G234 CarbonylContact C-O 3.58Å; R202-G234 WeakPolarHBondContact CA-O 3.38Å; R202-G234 PolarHBondContact N-O 3.34Å; R202-G234 VanDerWaalsContact N-O 3.1Å; R202-N236 WeakPolarHBondContact O-CB 3.5Å |
| 203 | S | 72.8 | Confident | 83.8 | Confident | 26 Ų | 26 | 64.5 Ų | 64.5 | 18% | 0.182 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.3 | 154.5 | 175.5 | 59.1 | 0 | 0 | 0 | 0 | 111 | E231 A232 G234 | S203-E231 CarbonylContact O-C 3.51Å; S203-E231 WeakPolarHBondContact O-CA 3.39Å; S203-A232 PolarHBondContact N-O 2.85Å; S203-A232 PolarHBondContact O-N 3.46Å; S203-G234 PolarHBondContact N-O 3.2Å |
| 204 | Y | 79.3 | Confident | 83.3 | Confident | 81 Ų | 81 | 64.5 Ų | 64.5 | 32% | 0.318 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 130.3 | 178.9 | -169.9 | -85 | 0 | 0 | 0 | 110.3 | R189 N190 G229 | R189-Y204 HydrophobicContact CB-CD1 4.05Å; R189-Y204 HydrophobicContact CB-CE1 4.48Å; R189-Y204 HydrophobicContact CB-CG 4.3Å; R189-Y204 HydrophobicContact CG-CE1 4.46Å; N190-Y204 PolarHBondContact ND2-O 2.97Å; N190-Y204 WeakPolarHBondContact OD1-CB 3.34Å; N190-Y204 PolarHBondContact OD1-N 3.41Å; Y204-G229 WeakPolarHBondContact OH-CA 3.15Å |
| 205 | A | 74.1 | Confident | 82.6 | Confident | 18 Ų | 18 | 64.6 Ų | 64.6 | 15% | 0.149 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 132.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | T230 A232 | A205-T230 PolarHBondContact N-O 2.87Å; A205-T230 CarbonylContact O-C 2.85Å; A205-T230 WeakPolarHBondContact O-CA 3.37Å; A205-T230 PolarHBondContact O-N 2.89Å; A205-T230 PolarHBondContact O-OG1 3.39Å; A205-A232 HydrophobicContact CB-CB 4.1Å |
| 206 | T | 79.8 | Confident | 81.6 | Confident | 4 Ų | 4 | 63.9 Ų | 63.9 | 3% | 0.025 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.7 | 120.8 | 167.9 | -63.2 | 0 | 0 | 0 | 0 | 109.7 | K178 D182 D186 R189 P227 I228 | K178-T206 WeakPolarHBondContact CE-O 3.38Å; K178-T206 PolarHBondContact NZ-O 3.41Å; D182-T206 HydrophobicContact CB-CG2 4.36Å; D186-T206 WeakPolarHBondContact OD1-CB 3.45Å; D186-T206 PolarHBondContact OD1-N 3.41Å; D186-T206 PolarHBondContact OD1-OG1 2.99Å; D186-T206 WeakPolarHBondContact OD2-CB 3.38Å; D186-T206 PolarHBondContact OD2-N 3.5Å; R189-T206 PolarHBondContact NH1-OG1 2.92Å; T206-P227 HydrophobicContact CG2-CB 3.41Å; T206-P227 VanDerWaalsContact CG2-CB 3.41Å; T206-I228 WeakPolarHBondContact CA-O 2.95Å |
| 207 | D | 79.9 | Confident | 80.7 | Confident | 69 Ų | 69 | 67 Ų | 67 | 37% | 0.369 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.4 | 170.3 | 168.2 | -163.3 | 5.2 | 0 | 0 | 0 | 109.6 | P227 I228 T230 | D207-P227 CarbonylContact O-C 3.55Å; D207-P227 WeakPolarHBondContact O-CA 3.27Å; D207-I228 PolarHBondContact N-O 3.27Å; D207-I228 PolarHBondContact O-N 3.45Å; D207-T230 HydrophobicContact CB-CG2 3.96Å |
| 208 | Y | 81.8 | Confident | 79.9 | Confident | 36 Ų | 36 | 68.2 Ų | 68.2 | 14% | 0.141 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 129.9 | 180 | -59.7 | -85.7 | 0 | 0 | 0 | 112.1 | K178 E179 D182 K225 V226 P227 | K178-Y208 HydrophobicContact CG-CE2 4.27Å; E179-Y208 PolarHBondContact N-OH 3.2Å; D182-Y208 WeakPolarHBondContact OD2-CE1 3.3Å; D182-Y208 VanDerWaalsContact OD2-CZ 3.29Å; D182-Y208 PolarHBondContact OD2-OH 3.33Å; Y208-K225 HydrophobicContact CD1-CD 3.98Å; Y208-K225 HydrophobicContact CD1-CG 3.7Å; Y208-K225 HydrophobicContact CE1-CD 4.43Å; Y208-K225 HydrophobicContact CG-CD 4.12Å; Y208-K225 HydrophobicContact CG-CG 3.93Å; Y208-V226 WeakPolarHBondContact CA-O 3.16Å; Y208-P227 HydrophobicContact CD1-CB 4.12Å; Y208-P227 HydrophobicContact CE1-CB 3.97Å |
| 209 | K | 83.6 | Confident | 79.1 | Confident | 132 Ų | 132 | 69.8 Ų | 69.8 | 57% | 0.574 | 39% | 0.392 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -109.7 | 134.3 | 169.9 | -168.1 | 173.1 | -179 | 177.5 | 0 | 109.5 | V211 V226 I228 | K209-V211 HydrophobicContact CG-CG2 4.5Å; K209-V211 PolarHBondContact O-N 3.49Å; K209-V226 PolarHBondContact N-O 2.95Å; K209-V226 PolarHBondContact O-N 3.17Å; K209-I228 HydrophobicContact CB-CD1 3.43Å; K209-I228 VanDerWaalsContact CB-CD1 3.43Å; K209-I228 HydrophobicContact CB-CG1 4.23Å; K209-I228 HydrophobicContact CD-CD1 3.77Å; K209-I228 HydrophobicContact CG-CD1 4.25Å |
| 210 | M | 82.6 | Confident | 78.6 | Confident | 110 Ų | 110 | 73.8 Ų | 73.8 | 54% | 0.542 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.8 | 110.7 | 169.8 | -60.7 | -60.5 | -88.1 | 0 | 0 | 107.9 | Y223 K225 | M210-Y223 HydrophobicContact CB-CD1 4.3Å; M210-K225 HydrophobicContact SD-CB 3.75Å; M210-K225 HydrophobicContact SD-CG 4.12Å |
| 211 | V | 84.2 | Confident | 78.3 | Confident | 61 Ų | 61 | 76.1 Ų | 76.1 | 37% | 0.37 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 134.2 | 177.5 | -176.4 | 0 | 0 | 0 | 0 | 108.2 | K209 V213 Y223 Q224 V226 | K209-V211 HydrophobicContact CG-CG2 4.5Å; K209-V211 PolarHBondContact O-N 3.49Å; V211-V213 PolarHBondContact O-N 3.14Å; V211-Y223 WeakPolarHBondContact O-CA 3.37Å; V211-Q224 PolarHBondContact N-O 3.45Å; V211-Q224 PolarHBondContact O-N 3.23Å; V211-V226 HydrophobicContact CB-CG2 4.29Å; V211-V226 HydrophobicContact CG2-CB 4.34Å; V211-V226 HydrophobicContact CG2-CG2 4.11Å |
| 212 | A | 82.2 | Confident | 78.2 | Confident | 60 Ų | 60 | 75.6 Ų | 75.6 | 50% | 0.496 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72 | 120.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | I221 L222 Y223 | A212-I221 HydrophobicContact CB-CG2 3.61Å; A212-L222 WeakPolarHBondContact CA-O 3.23Å; A212-Y223 HydrophobicContact CB-CD1 4.49Å; A212-Y223 HydrophobicContact CB-CE1 4.41Å |
| 213 | V | 79.4 | Confident | 78.2 | Confident | 90 Ų | 90 | 77.7 Ų | 77.7 | 55% | 0.545 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.1 | -15.4 | -173.6 | 177.1 | 0 | 0 | 0 | 0 | 112.7 | V211 L222 Q224 | V211-V213 PolarHBondContact O-N 3.14Å; V213-L222 PolarHBondContact N-O 3.24Å; V213-Q224 HydrophobicContact CB-CB 4.26Å; V213-Q224 HydrophobicContact CG2-CB 3.31Å; V213-Q224 HydrophobicContact CG2-CG 4.35Å |
| 214 | G | 75.8 | Confident | 78.7 | Confident | 34 Ų | 34 | 81.7 Ų | 81.7 | 35% | 0.351 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 165.3 | -178.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.4 | L222 | G214-L222 PolarHBondContact O-N 3.24Å |
| 215 | N | 76.6 | Confident | 78.8 | Confident | 117 Ų | 117 | 81.7 Ų | 81.7 | 63% | 0.626 | 45% | 0.452 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 134 | 170.1 | -74.2 | 1.7 | 0 | 0 | 0 | 109.3 | T220 I221 | N215-T220 WeakPolarHBondContact CA-O 3.45Å; N215-I221 WeakPolarHBondContact OD1-CG1 3.26Å |
| 216 | D | 72.9 | Confident | 79.3 | Confident | 69 Ų | 69 | 83.4 Ų | 83.4 | 37% | 0.369 | 46% | 0.46 | S | S | . | . | trans | -65.6 | 161.8 | 164.8 | -168.6 | 9.1 | 0 | 0 | 0 | 110.1 | N218 G219 T220 L222 | D216-N218 PolarHBondContact O-N 3.4Å; D216-G219 PolarHBondContact O-N 2.96Å; D216-T220 PolarHBondContact N-O 3.29Å; D216-L222 HydrophobicContact CB-CD1 4.38Å; D216-L222 HydrophobicContact CB-CD2 4.48Å; D216-L222 HydrophobicContact CB-CG 4.31Å | ||
| 217 | T | 73.4 | Confident | 79.6 | Confident | 136 Ų | 136 | 86.4 Ų | 86.4 | 83% | 0.834 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.6 | -21.8 | 176.5 | 49.6 | 0 | 0 | 0 | 0 | 113.9 | ||
| 218 | N | 77 | Confident | 80 | Confident | 136 Ų | 136 | 86.4 Ų | 86.4 | 73% | 0.727 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.3 | 9.1 | 174.9 | -68.4 | -30.4 | 0 | 0 | 0 | 114.5 | D216 T220 | D216-N218 PolarHBondContact O-N 3.4Å; N218-T220 VanDerWaalsContact C-N 3.32Å; N218-T220 PolarHBondContact O-N 3.18Å |
| 219 | G | 72.9 | Confident | 80.1 | Confident | 51 Ų | 51 | 86.6 Ų | 86.6 | 53% | 0.526 | 49% | 0.492 | S | S | . | . | S | Bend | trans | 76.8 | 11.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | D216 | D216-G219 PolarHBondContact O-N 2.96Š|
| 220 | T | 77.3 | Confident | 80.1 | Confident | 86 Ų | 86 | 82.9 Ų | 82.9 | 53% | 0.528 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -84.4 | 128.1 | 176.1 | -53.4 | 0 | 0 | 0 | 0 | 109.8 | N215 D216 N218 L222 | N215-T220 WeakPolarHBondContact CA-O 3.45Å; D216-T220 PolarHBondContact N-O 3.29Å; N218-T220 VanDerWaalsContact C-N 3.32Å; N218-T220 PolarHBondContact O-N 3.18Å; T220-L222 PolarHBondContact O-N 3.34Å |
| 221 | I | 77.1 | Confident | 80 | Confident | 77 Ų | 77 | 82.3 Ų | 82.3 | 40% | 0.395 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 119.8 | 177.9 | -59.8 | 171.9 | 0 | 0 | 0 | 108.8 | A212 N215 Y223 | A212-I221 HydrophobicContact CB-CG2 3.61Å; N215-I221 WeakPolarHBondContact OD1-CG1 3.26Å; I221-Y223 HydrophobicContact CB-CE2 4.18Å; I221-Y223 HydrophobicContact CG2-CD2 4.47Å; I221-Y223 HydrophobicContact CG2-CE1 4.22Å; I221-Y223 HydrophobicContact CG2-CE2 4.02Å; I221-Y223 WeakPolarHBondContact O-CD2 3.5Å |
| 222 | L | 78.3 | Confident | 79.5 | Confident | 94 Ų | 94 | 81.1 Ų | 81.1 | 49% | 0.492 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 124.4 | 173.5 | -64.8 | 176.3 | 0 | 0 | 0 | 109.4 | A212 V213 G214 D216 T220 | A212-L222 WeakPolarHBondContact CA-O 3.23Å; V213-L222 PolarHBondContact N-O 3.24Å; G214-L222 PolarHBondContact O-N 3.24Å; D216-L222 HydrophobicContact CB-CD1 4.38Å; D216-L222 HydrophobicContact CB-CD2 4.48Å; D216-L222 HydrophobicContact CB-CG 4.31Å; T220-L222 PolarHBondContact O-N 3.34Å |
| 223 | Y | 80.9 | Confident | 79 | Confident | 145 Ų | 145 | 85.1 Ų | 85.1 | 57% | 0.569 | 49% | 0.486 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -100.3 | 128.6 | 174.6 | -64.1 | -86.1 | 0 | 0 | 0 | 109.8 | M210 V211 A212 I221 | M210-Y223 HydrophobicContact CB-CD1 4.3Å; V211-Y223 WeakPolarHBondContact O-CA 3.37Å; A212-Y223 HydrophobicContact CB-CD1 4.49Å; A212-Y223 HydrophobicContact CB-CE1 4.41Å; I221-Y223 HydrophobicContact CB-CE2 4.18Å; I221-Y223 HydrophobicContact CG2-CD2 4.47Å; I221-Y223 HydrophobicContact CG2-CE1 4.22Å; I221-Y223 HydrophobicContact CG2-CE2 4.02Å; I221-Y223 WeakPolarHBondContact O-CD2 3.5Å |
| 224 | Q | 83.4 | Confident | 78.3 | Confident | 109 Ų | 109 | 81.8 Ų | 81.8 | 51% | 0.509 | 47% | 0.47 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 133.4 | 170.6 | -171.7 | 172.7 | -1.8 | 0 | 0 | 109.5 | V211 V213 V226 | V211-Q224 PolarHBondContact N-O 3.45Å; V211-Q224 PolarHBondContact O-N 3.23Å; V213-Q224 HydrophobicContact CB-CB 4.26Å; V213-Q224 HydrophobicContact CG2-CB 3.31Å; V213-Q224 HydrophobicContact CG2-CG 4.35Å; Q224-V226 HydrophobicContact CG-CG2 4.36Å; Q224-V226 PolarHBondContact O-N 3.06Å |
| 225 | K | 82.1 | Confident | 78 | Confident | 81 Ų | 81 | 81.6 Ų | 81.6 | 35% | 0.352 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.5 | 117.8 | 171.5 | -170.9 | -176.4 | 177.4 | -165.9 | 0 | 108.3 | N177 Y208 M210 | N177-K225 PolarHBondContact O-NZ 2.77Å; Y208-K225 HydrophobicContact CD1-CD 3.98Å; Y208-K225 HydrophobicContact CD1-CG 3.7Å; Y208-K225 HydrophobicContact CE1-CD 4.43Å; Y208-K225 HydrophobicContact CG-CD 4.12Å; Y208-K225 HydrophobicContact CG-CG 3.93Å; M210-K225 HydrophobicContact SD-CB 3.75Å; M210-K225 HydrophobicContact SD-CG 4.12Å |
| 226 | V | 85.4 | Confident | 77.7 | Confident | 54 Ų | 54 | 76.5 Ų | 76.5 | 33% | 0.327 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 130.2 | 178.1 | -174.8 | 0 | 0 | 0 | 0 | 109.1 | Y208 K209 V211 Q224 | Y208-V226 WeakPolarHBondContact CA-O 3.16Å; K209-V226 PolarHBondContact N-O 2.95Å; K209-V226 PolarHBondContact O-N 3.17Å; V211-V226 HydrophobicContact CB-CG2 4.29Å; V211-V226 HydrophobicContact CG2-CB 4.34Å; V211-V226 HydrophobicContact CG2-CG2 4.11Å; Q224-V226 HydrophobicContact CG-CG2 4.36Å; Q224-V226 PolarHBondContact O-N 3.06Å |
| 227 | P | 86.1 | Confident | 77.5 | Confident | 67 Ų | 67 | 73.6 Ų | 73.6 | 44% | 0.435 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70 | 135.4 | 175 | 28 | -33 | 0 | 0 | 0 | 110.8 | T206 D207 Y208 | T206-P227 HydrophobicContact CG2-CB 3.41Å; T206-P227 VanDerWaalsContact CG2-CB 3.41Å; D207-P227 CarbonylContact O-C 3.55Å; D207-P227 WeakPolarHBondContact O-CA 3.27Å; Y208-P227 HydrophobicContact CD1-CB 4.12Å; Y208-P227 HydrophobicContact CE1-CB 3.97Å |
| 228 | I | 87.3 | Confident | 77.1 | Confident | 70 Ų | 70 | 68 Ų | 68 | 36% | 0.359 | 38% | 0.382 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 130.6 | 176 | -61.2 | -173.3 | 0 | 0 | 0 | 108.4 | T206 D207 K209 T230 | T206-I228 WeakPolarHBondContact CA-O 2.95Å; D207-I228 PolarHBondContact N-O 3.27Å; D207-I228 PolarHBondContact O-N 3.45Å; K209-I228 HydrophobicContact CB-CD1 3.43Å; K209-I228 VanDerWaalsContact CB-CD1 3.43Å; K209-I228 HydrophobicContact CB-CG1 4.23Å; K209-I228 HydrophobicContact CD-CD1 3.77Å; K209-I228 HydrophobicContact CG-CD1 4.25Å; I228-T230 PolarHBondContact O-N 3.35Å |
| 229 | G | 84 | Confident | 77.1 | Confident | 39 Ų | 39 | 61.5 Ų | 61.5 | 40% | 0.402 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70 | 126.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y204 | Y204-G229 WeakPolarHBondContact OH-CA 3.15Å |
| 230 | T | 84 | Confident | 77.5 | Confident | 54 Ų | 54 | 59.6 Ų | 59.6 | 33% | 0.331 | 33% | 0.325 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 148.5 | 174.7 | 61.2 | 0 | 0 | 0 | 0 | 109.6 | A205 D207 I228 | A205-T230 PolarHBondContact N-O 2.87Å; A205-T230 CarbonylContact O-C 2.85Å; A205-T230 WeakPolarHBondContact O-CA 3.37Å; A205-T230 PolarHBondContact O-N 2.89Å; A205-T230 PolarHBondContact O-OG1 3.39Å; D207-T230 HydrophobicContact CB-CG2 3.96Å; I228-T230 PolarHBondContact O-N 3.35Å |
| 231 | E | 80.8 | Confident | 77.5 | Confident | 99 Ų | 99 | 55.8 Ų | 55.8 | 46% | 0.463 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 113.5 | 169.2 | -66.2 | -175.8 | 171.4 | 0 | 0 | 108 | R202 S203 | R202-E231 HydrophobicContact CB-CB 4.42Å; R202-E231 WeakPolarHBondContact CD-OE2 3.37Å; R202-E231 IonicContact CZ-OE2 3.17Å; R202-E231 IonicContact NE-OE2 3.65Å; R202-E231 IonicContact NH1-OE2 3.93Å; R202-E231 PolarHBondContact NH1-OE2 2.86Å; S203-E231 CarbonylContact O-C 3.51Å; S203-E231 WeakPolarHBondContact O-CA 3.39Å |
| 232 | A | 73.6 | Confident | 77.6 | Confident | 36 Ų | 36 | 54.1 Ų | 54.1 | 30% | 0.298 | 29% | 0.293 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.3 | 142.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | R202 S203 A205 G234 | R202-A232 WeakPolarHBondContact CA-O 3.22Å; S203-A232 PolarHBondContact N-O 2.85Å; S203-A232 PolarHBondContact O-N 3.46Å; A205-A232 HydrophobicContact CB-CB 4.1Å; A232-G234 PolarHBondContact O-N 2.87Å |
| 233 | D | 71.1 | Confident | 78.1 | Confident | 143 Ų | 143 | 53.3 Ų | 53.3 | 77% | 0.765 | 29% | 0.286 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 123.4 | 173.3 | -73 | -29.8 | 0 | 0 | 0 | 109.6 | ||
| 234 | G | 65.3 | Low | 78.3 | Confident | 21 Ų | 21 | 46.4 Ų | 46.4 | 22% | 0.216 | 26% | 0.259 | C | S | . | . | S | Bend | trans | 148.1 | 137.7 | -171.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | F201 R202 S203 A232 N236 | F201-G234 CarbonylContact C-O 3.58Å; F201-G234 VanDerWaalsContact C-O 3.29Å; F201-G234 CarbonylContact O-C 3.32Å; F201-G234 PolarHBondContact O-N 3.12Å; R202-G234 CarbonylContact C-O 3.58Å; R202-G234 WeakPolarHBondContact CA-O 3.38Å; R202-G234 PolarHBondContact N-O 3.34Å; R202-G234 VanDerWaalsContact N-O 3.1Å; S203-G234 PolarHBondContact N-O 3.2Å; A232-G234 PolarHBondContact O-N 2.87Å; G234-N236 PolarHBondContact O-N 3.39Å |
| 235 | M | 68.1 | Low | 78.1 | Confident | 30 Ų | 30 | 43.6 Ų | 43.6 | 15% | 0.148 | 25% | 0.247 | C | C | . | . | trans | -70.1 | 125.4 | -174.7 | -179.2 | 164.9 | 53.9 | 0 | 0 | 110.4 | I106 L107 A199 A200 I237 L240 | I106-M235 HydrophobicContact CB-CE 3.91Å; I106-M235 HydrophobicContact CG2-CE 3.64Å; L107-M235 HydrophobicContact CB-CE 4.42Å; L107-M235 HydrophobicContact CB-SD 3.74Å; L107-M235 HydrophobicContact CD1-SD 3.79Å; L107-M235 HydrophobicContact CG-SD 4.25Å; A199-M235 CarbonylContact O-C 3.51Å; A200-M235 WeakPolarHBondContact O-CG 2.92Å; M235-I237 HydrophobicContact CB-CG1 3.98Å; M235-I237 HydrophobicContact CE-CD1 3.52Å; M235-I237 HydrophobicContact CE-CG1 3.53Å; M235-I237 HydrophobicContact CG-CD1 4.46Å; M235-I237 HydrophobicContact CG-CG1 3.58Å; M235-I237 PolarHBondContact O-N 3.44Å; M235-I237 HydrophobicContact SD-CG1 4.09Å; M235-L240 HydrophobicContact CG-CD1 3.92Å; M235-L240 HydrophobicContact SD-CD1 4.16Å | ||
| 236 | N | 71.6 | Confident | 78.4 | Confident | 10 Ų | 10 | 45.8 Ų | 45.8 | 5% | 0.053 | 26% | 0.26 | C | S | . | . | trans | -76.7 | 77 | 170.9 | -179.7 | 9.2 | 0 | 0 | 0 | 110.7 | N190 A199 R202 G234 L238 G239 L240 | N190-N236 PolarHBondContact O-ND2 2.89Å; N190-N236 PolarHBondContact O-OD1 2.88Å; N190-N236 PolarHBondContact OD1-ND2 3.48Å; A199-N236 HydrophobicContact CB-CB 4.15Å; A199-N236 PolarHBondContact O-N 3.37Å; R202-N236 WeakPolarHBondContact O-CB 3.5Å; G234-N236 PolarHBondContact O-N 3.39Å; N236-L238 VanDerWaalsContact C-N 3.32Å; N236-L238 PolarHBondContact O-N 2.76Å; N236-G239 PolarHBondContact O-N 3.25Å; N236-G239 PolarHBondContact OD1-N 3.48Å; N236-L240 WeakPolarHBondContact O-CG 3.21Å; N236-L240 PolarHBondContact O-N 2.92Å | ||
| 237 | I | 67.6 | Low | 78.7 | Confident | 7 Ų | 7 | 46.4 Ų | 46.4 | 4% | 0.036 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.1 | -36.1 | -176.7 | -55.3 | 168.2 | 0 | 0 | 0 | 110.9 | I106 V110 M235 G239 L240 V241 I447 | I106-I237 HydrophobicContact CG2-CD1 4.2Å; V110-I237 HydrophobicContact CG1-CG2 4.26Å; M235-I237 HydrophobicContact CB-CG1 3.98Å; M235-I237 HydrophobicContact CE-CD1 3.52Å; M235-I237 HydrophobicContact CE-CG1 3.53Å; M235-I237 HydrophobicContact CG-CD1 4.46Å; M235-I237 HydrophobicContact CG-CG1 3.58Å; M235-I237 PolarHBondContact O-N 3.44Å; M235-I237 HydrophobicContact SD-CG1 4.09Å; I237-G239 PolarHBondContact O-N 2.76Å; I237-L240 PolarHBondContact O-N 3.14Å; I237-V241 HydrophobicContact CG2-CG2 3.97Å; I237-V241 WeakPolarHBondContact O-CB 3.45Å; I237-V241 VanDerWaalsContact O-CG2 3.22Å; I237-V241 WeakPolarHBondContact O-CG2 3.4Å; I237-V241 PolarHBondContact O-N 2.62Å; I237-I447 HydrophobicContact CB-CB 4.34Å; I237-I447 HydrophobicContact CB-CD1 4.09Å; I237-I447 HydrophobicContact CB-CG1 3.67Å; I237-I447 HydrophobicContact CB-CG2 4.02Å; I237-I447 HydrophobicContact CD1-CB 4.43Å; I237-I447 HydrophobicContact CD1-CD1 4.3Å; I237-I447 HydrophobicContact CD1-CG1 3.43Å; I237-I447 VanDerWaalsContact CD1-CG1 3.43Å; I237-I447 HydrophobicContact CG1-CG1 4.09Å; I237-I447 HydrophobicContact CG2-CB 4.47Å; I237-I447 HydrophobicContact CG2-CD1 3.32Å; I237-I447 HydrophobicContact CG2-CG1 3.5Å; I237-I447 VanDerWaalsContact CG2-CG1 3.5Å; I237-I447 HydrophobicContact CG2-CG2 4.22Å |
| 238 | L | 66.3 | Low | 78.8 | Confident | 19 Ų | 19 | 43.2 Ų | 43.2 | 10% | 0.099 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57.4 | -46.8 | 178.4 | 179.9 | 63.8 | 0 | 0 | 0 | 112.2 | L187 L191 N236 V241 L242 T426 | L187-L238 HydrophobicContact CD1-CD2 3.35Å; L187-L238 HydrophobicContact CG-CD2 4.41Å; L191-L238 HydrophobicContact CD2-CD1 3.92Å; L191-L238 HydrophobicContact CD2-CD2 3.97Å; L191-L238 HydrophobicContact CD2-CG 3.79Å; L191-L238 HydrophobicContact CG-CD2 4.04Å; L191-L238 HydrophobicContact CG-CG 4.33Å; N236-L238 VanDerWaalsContact C-N 3.32Å; N236-L238 PolarHBondContact O-N 2.76Å; L238-V241 PolarHBondContact O-N 3.14Å; L238-L242 PolarHBondContact O-N 3.37Å; L238-L242 VanDerWaalsContact O-N 3.09Å; L238-T426 HydrophobicContact CD1-CG2 4.29Å; L238-T426 HydrophobicContact CD2-CG2 4.38Å |
| 239 | G | 77.1 | Confident | 78.7 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64.7 | -39.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | N190 N236 I237 F243 | N190-G239 WeakPolarHBondContact O-CA 3.38Å; N190-G239 PolarHBondContact O-N 3.13Å; N236-G239 PolarHBondContact O-N 3.25Å; N236-G239 PolarHBondContact OD1-N 3.48Å; I237-G239 PolarHBondContact O-N 2.76Å; G239-F243 VanDerWaalsContact O-CB 3.3Å; G239-F243 WeakPolarHBondContact O-CB 3.46Å; G239-F243 PolarHBondContact O-N 3.33Å |
| 240 | L | 80.3 | Confident | 79 | Confident | 11 Ų | 11 | 42.3 Ų | 42.3 | 6% | 0.058 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.5 | -38.6 | 176.3 | -68 | 170.3 | 0 | 0 | 0 | 112.3 | L107 V111 A199 M235 N236 I237 A244 | L107-L240 HydrophobicContact CD1-CD1 3.5Å; L107-L240 VanDerWaalsContact CD1-CD1 3.5Å; V111-L240 HydrophobicContact CG2-CB 4.37Å; A199-L240 HydrophobicContact CB-CD2 4.2Å; A199-L240 HydrophobicContact CB-CG 4.3Å; M235-L240 HydrophobicContact CG-CD1 3.92Å; M235-L240 HydrophobicContact SD-CD1 4.16Å; N236-L240 WeakPolarHBondContact O-CG 3.21Å; N236-L240 PolarHBondContact O-N 2.92Å; I237-L240 PolarHBondContact O-N 3.14Å; L240-A244 WeakPolarHBondContact O-CB 3.45Å; L240-A244 PolarHBondContact O-N 3.35Å |
| 241 | V | 76.4 | Confident | 79.4 | Confident | 5 Ų | 5 | 40 Ų | 40 | 3% | 0.03 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63 | -50.5 | 176.3 | 163.6 | 0 | 0 | 0 | 0 | 110.7 | V110 L114 I237 L238 F243 A244 M245 | V110-V241 HydrophobicContact CG1-CG2 3.55Å; L114-V241 HydrophobicContact CD1-CB 3.8Å; L114-V241 HydrophobicContact CD1-CG1 3.67Å; L114-V241 HydrophobicContact CD1-CG2 3.62Å; I237-V241 HydrophobicContact CG2-CG2 3.97Å; I237-V241 WeakPolarHBondContact O-CB 3.45Å; I237-V241 VanDerWaalsContact O-CG2 3.22Å; I237-V241 WeakPolarHBondContact O-CG2 3.4Å; I237-V241 PolarHBondContact O-N 2.62Å; L238-V241 PolarHBondContact O-N 3.14Å; V241-F243 PolarHBondContact O-N 3.18Å; V241-A244 PolarHBondContact O-N 2.75Å; V241-M245 HydrophobicContact CG1-CE 3.73Å; V241-M245 WeakPolarHBondContact O-CG 3.38Å; V241-M245 PolarHBondContact O-N 2.9Å |
| 242 | L | 79.6 | Confident | 79.6 | Confident | 42 Ų | 42 | 38.9 Ų | 38.9 | 22% | 0.22 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.8 | -45.9 | 178.3 | -176 | 69 | 0 | 0 | 0 | 111.3 | L191 F192 L238 M245 M246 | L191-L242 HydrophobicContact CB-CD2 4.04Å; L191-L242 HydrophobicContact CD2-CB 4.47Å; L191-L242 HydrophobicContact CD2-CD2 4.01Å; L191-L242 WeakPolarHBondContact O-CD2 3.38Å; F192-L242 HydrophobicContact CD1-CD2 4.33Å; F192-L242 HydrophobicContact CE1-CD2 3.87Å; F192-L242 HydrophobicContact CZ-CD2 3.99Å; L238-L242 PolarHBondContact O-N 3.37Å; L238-L242 VanDerWaalsContact O-N 3.09Å; L242-M245 HydrophobicContact CD1-CE 4.48Å; L242-M245 PolarHBondContact O-N 3.49Å; L242-M246 HydrophobicContact CD1-CG 4.49Å; L242-M246 WeakPolarHBondContact O-CG 3.33Å; L242-M246 PolarHBondContact O-N 3.35Å |
| 243 | F | 89.1 | Confident | 80.3 | Confident | 77 Ų | 77 | 43 Ų | 43 | 34% | 0.338 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -58.9 | -49.3 | 176.7 | 171.5 | -98.9 | 0 | 0 | 0 | 111.6 | L196 G239 V241 M245 M246 F247 | L196-F243 HydrophobicContact CD1-CD1 4.09Å; L196-F243 HydrophobicContact CD1-CD2 3.9Å; L196-F243 HydrophobicContact CD1-CE1 3.72Å; L196-F243 HydrophobicContact CD1-CE2 3.51Å; L196-F243 HydrophobicContact CD1-CG 4.18Å; L196-F243 HydrophobicContact CD1-CZ 3.41Å; L196-F243 VanDerWaalsContact CD1-CZ 3.41Å; L196-F243 HydrophobicContact CD2-CB 3.95Å; L196-F243 HydrophobicContact CD2-CD1 3.84Å; L196-F243 HydrophobicContact CD2-CD2 3.8Å; L196-F243 HydrophobicContact CD2-CE1 4.33Å; L196-F243 HydrophobicContact CD2-CE2 4.3Å; L196-F243 HydrophobicContact CD2-CG 3.55Å; L196-F243 HydrophobicContact CG-CD2 4.47Å; G239-F243 VanDerWaalsContact O-CB 3.3Å; G239-F243 WeakPolarHBondContact O-CB 3.46Å; G239-F243 PolarHBondContact O-N 3.33Å; V241-F243 PolarHBondContact O-N 3.18Å; F243-M245 VanDerWaalsContact C-N 3.33Å; F243-M245 PolarHBondContact O-N 3.47Å; F243-M246 PolarHBondContact O-N 3.25Å; F243-F247 HydrophobicContact CE1-CB 4.32Å; F243-F247 HydrophobicContact CE1-CG 4.44Å; F243-F247 HydrophobicContact CE2-CB 4.47Å; F243-F247 HydrophobicContact CZ-CB 4.19Å; F243-F247 HydrophobicContact CZ-CD2 4.22Å; F243-F247 HydrophobicContact CZ-CG 4.14Å; F243-F247 WeakPolarHBondContact O-CB 3.45Å; F243-F247 PolarHBondContact O-N 3.11Å |
| 244 | A | 85.1 | Confident | 81.2 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.6 | -42.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L114 V115 L240 V241 F247 G248 | L114-A244 HydrophobicContact CB-CB 3.7Å; L114-A244 HydrophobicContact CD1-CB 4.37Å; V115-A244 HydrophobicContact CG2-CB 3.83Å; V115-A244 WeakPolarHBondContact CG2-O 3.49Å; L240-A244 WeakPolarHBondContact O-CB 3.45Å; L240-A244 PolarHBondContact O-N 3.35Å; V241-A244 PolarHBondContact O-N 2.75Å; A244-F247 PolarHBondContact O-N 3.5Å; A244-G248 PolarHBondContact O-N 3.26Å |
| 245 | M | 80.4 | Confident | 82.2 | Confident | 51 Ų | 51 | 41.3 Ų | 41.3 | 25% | 0.251 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -63.6 | -50.6 | 175.6 | -75.3 | -170.3 | -68.4 | 0 | 0 | 112 | L114 A118 V241 L242 F243 F247 G248 V249 V432 | L114-M245 HydrophobicContact CD2-CG 4.07Å; A118-M245 HydrophobicContact CB-CB 4.46Å; A118-M245 WeakPolarHBondContact CB-O 3.41Å; V241-M245 HydrophobicContact CG1-CE 3.73Å; V241-M245 WeakPolarHBondContact O-CG 3.38Å; V241-M245 PolarHBondContact O-N 2.9Å; L242-M245 HydrophobicContact CD1-CE 4.48Å; L242-M245 PolarHBondContact O-N 3.49Å; F243-M245 VanDerWaalsContact C-N 3.33Å; F243-M245 PolarHBondContact O-N 3.47Å; M245-F247 VanDerWaalsContact C-N 3.28Å; M245-F247 PolarHBondContact O-N 3.03Å; M245-G248 PolarHBondContact O-N 3.12Å; M245-V249 WeakPolarHBondContact O-CG2 3.27Å; M245-V249 PolarHBondContact O-N 2.99Å; M245-V432 HydrophobicContact SD-CG1 4.49Å |
| 246 | M | 86.9 | Confident | 83.2 | Confident | 126 Ų | 126 | 48.9 Ų | 48.9 | 62% | 0.621 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -62.5 | -38.3 | 179.1 | -70.1 | -61.1 | -63.5 | 0 | 0 | 111.7 | L242 F243 A250 | L242-M246 HydrophobicContact CD1-CG 4.49Å; L242-M246 WeakPolarHBondContact O-CG 3.33Å; L242-M246 PolarHBondContact O-N 3.35Å; F243-M246 PolarHBondContact O-N 3.25Å; M246-A250 WeakPolarHBondContact O-CB 3.46Å; M246-A250 PolarHBondContact O-N 3.27Å |
| 247 | F | 92.1 | Very high | 84.1 | Confident | 67 Ų | 67 | 56 Ų | 56 | 29% | 0.294 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -68.5 | -42.6 | 177.6 | -171 | -113.7 | 0 | 0 | 0 | 111.8 | V115 F243 A244 M245 V249 A250 L251 F265 | V115-F247 HydrophobicContact CG1-CD1 4.09Å; V115-F247 HydrophobicContact CG2-CD1 3.96Å; F243-F247 HydrophobicContact CE1-CB 4.32Å; F243-F247 HydrophobicContact CE1-CG 4.44Å; F243-F247 HydrophobicContact CE2-CB 4.47Å; F243-F247 HydrophobicContact CZ-CB 4.19Å; F243-F247 HydrophobicContact CZ-CD2 4.22Å; F243-F247 HydrophobicContact CZ-CG 4.14Å; F243-F247 WeakPolarHBondContact O-CB 3.45Å; F243-F247 PolarHBondContact O-N 3.11Å; A244-F247 PolarHBondContact O-N 3.5Å; M245-F247 VanDerWaalsContact C-N 3.28Å; M245-F247 PolarHBondContact O-N 3.03Å; F247-V249 PolarHBondContact O-N 3.45Å; F247-A250 WeakPolarHBondContact O-CB 3.48Å; F247-A250 PolarHBondContact O-N 3.36Å; F247-L251 HydrophobicContact CD1-CD1 4.05Å; F247-L251 HydrophobicContact CD1-CG 4.3Å; F247-L251 HydrophobicContact CE1-CD1 3.73Å; F247-L251 HydrophobicContact CE1-CD2 4.24Å; F247-L251 HydrophobicContact CE1-CG 4.04Å; F247-L251 HydrophobicContact CE2-CD2 4.42Å; F247-L251 HydrophobicContact CZ-CD1 4.31Å; F247-L251 HydrophobicContact CZ-CD2 3.96Å; F247-L251 HydrophobicContact CZ-CG 4.19Å; F247-L251 WeakPolarHBondContact O-CG 3.41Å; F247-L251 PolarHBondContact O-N 2.9Å; F247-F265 HydrophobicContact CD1-CE2 4.45Å; F247-F265 AromaticContact CE1-CE2 3.8Å; F247-F265 HydrophobicContact CE1-CE2 3.8Å; F247-F265 HydrophobicContact CE1-CZ 4.07Å |
| 248 | G | 87.4 | Confident | 85.2 | Confident | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.2 | -44.2 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | V115 A119 A244 M245 A250 L251 R252 | V115-G248 WeakPolarHBondContact O-CA 3.34Å; A119-G248 WeakPolarHBondContact CA-O 3.41Å; A119-G248 WeakPolarHBondContact CB-O 3.27Å; A244-G248 PolarHBondContact O-N 3.26Å; M245-G248 PolarHBondContact O-N 3.12Å; G248-A250 VanDerWaalsContact C-N 3.34Å; G248-A250 PolarHBondContact O-N 3.38Å; G248-L251 PolarHBondContact O-N 2.95Å; G248-R252 PolarHBondContact O-N 3.37Å |
| 249 | V | 85.6 | Confident | 86.3 | Confident | 51 Ų | 51 | 59.3 Ų | 59.3 | 31% | 0.309 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62 | -42.3 | 173.5 | 175.1 | 0 | 0 | 0 | 0 | 111.1 | A118 M245 F247 R252 I253 | A118-V249 HydrophobicContact CB-CG2 4.28Å; M245-V249 WeakPolarHBondContact O-CG2 3.27Å; M245-V249 PolarHBondContact O-N 2.99Å; F247-V249 PolarHBondContact O-N 3.45Å; V249-R252 PolarHBondContact O-N 3.2Å; V249-I253 HydrophobicContact CG1-CD1 3.97Å; V249-I253 WeakPolarHBondContact O-CG1 3.49Å; V249-I253 PolarHBondContact O-N 3.49Å |
| 250 | A | 90.9 | Very high | 87.1 | Confident | 39 Ų | 39 | 65.8 Ų | 65.8 | 32% | 0.322 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | M246 F247 G248 R252 I253 L254 | M246-A250 WeakPolarHBondContact O-CB 3.46Å; M246-A250 PolarHBondContact O-N 3.27Å; F247-A250 WeakPolarHBondContact O-CB 3.48Å; F247-A250 PolarHBondContact O-N 3.36Å; G248-A250 VanDerWaalsContact C-N 3.34Å; G248-A250 PolarHBondContact O-N 3.38Å; A250-R252 PolarHBondContact O-N 3.11Å; A250-I253 WeakPolarHBondContact O-CB 3.31Å; A250-I253 PolarHBondContact O-N 3.26Å; A250-L254 WeakPolarHBondContact O-CD1 3.5Å; A250-L254 PolarHBondContact O-N 2.99Å |
| 251 | L | 91.5 | Very high | 87.8 | Confident | 5 Ų | 5 | 69 Ų | 69 | 3% | 0.026 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -57.2 | -38.8 | 175.5 | -70 | -179 | 0 | 0 | 0 | 111.8 | V115 F247 G248 L254 L261 I262 F265 | V115-L251 HydrophobicContact CG1-CD1 3.69Å; F247-L251 HydrophobicContact CD1-CD1 4.05Å; F247-L251 HydrophobicContact CD1-CG 4.3Å; F247-L251 HydrophobicContact CE1-CD1 3.73Å; F247-L251 HydrophobicContact CE1-CD2 4.24Å; F247-L251 HydrophobicContact CE1-CG 4.04Å; F247-L251 HydrophobicContact CE2-CD2 4.42Å; F247-L251 HydrophobicContact CZ-CD1 4.31Å; F247-L251 HydrophobicContact CZ-CD2 3.96Å; F247-L251 HydrophobicContact CZ-CG 4.19Å; F247-L251 WeakPolarHBondContact O-CG 3.41Å; F247-L251 PolarHBondContact O-N 2.9Å; G248-L251 PolarHBondContact O-N 2.95Å; L251-L254 PolarHBondContact O-N 3.18Å; L251-L261 HydrophobicContact CD1-CB 4Å; L251-L261 HydrophobicContact CD2-CB 3.95Å; L251-L261 HydrophobicContact CD2-CD1 3.59Å; L251-L261 HydrophobicContact CD2-CG 4.43Å; L251-I262 HydrophobicContact CB-CD1 4.16Å; L251-I262 HydrophobicContact CB-CG1 3.96Å; L251-I262 HydrophobicContact CD1-CG1 4.15Å; L251-F265 HydrophobicContact CD1-CD2 4.22Å; L251-F265 HydrophobicContact CD1-CE2 4.23Å |
| 252 | R | 85.2 | Confident | 88.4 | Confident | 76 Ų | 76 | 69.2 Ų | 69.2 | 29% | 0.287 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66 | -38.8 | 175.8 | -175.7 | 56 | -178.9 | -179.5 | 2.4 | 112.5 | A119 D122 G248 V249 A250 L254 G255 E259 | A119-R252 WeakPolarHBondContact O-CD 3.39Å; D122-R252 VanDerWaalsContact CG-NE 3.3Å; D122-R252 IonicContact OD1-CZ 3.61Å; D122-R252 IonicContact OD1-NE 3.9Å; D122-R252 PolarHBondContact OD1-NE 2.88Å; D122-R252 VanDerWaalsContact OD1-NE 3.14Å; D122-R252 IonicContact OD1-NH2 2.84Å; D122-R252 PolarHBondContact OD1-NH2 3.28Å; D122-R252 IonicContact OD2-CZ 3.61Å; D122-R252 IonicContact OD2-NE 3.2Å; D122-R252 IonicContact OD2-NH2 3.96Å; D122-R252 PolarHBondContact OD2-NH2 2.86Å; G248-R252 PolarHBondContact O-N 3.37Å; V249-R252 PolarHBondContact O-N 3.2Å; A250-R252 PolarHBondContact O-N 3.11Å; R252-L254 VanDerWaalsContact C-N 3.28Å; R252-L254 PolarHBondContact O-N 3.28Å; R252-G255 PolarHBondContact O-N 3.1Å; R252-E259 IonicContact NH1-OE2 3.67Å |
| 253 | I | 87.9 | Confident | 89 | Confident | 122 Ų | 122 | 75.3 Ų | 75.3 | 63% | 0.626 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -65.8 | -32.3 | 177.7 | -67.4 | 166.4 | 0 | 0 | 0 | 111.5 | V249 A250 G255 | V249-I253 HydrophobicContact CG1-CD1 3.97Å; V249-I253 WeakPolarHBondContact O-CG1 3.49Å; V249-I253 PolarHBondContact O-N 3.49Å; A250-I253 WeakPolarHBondContact O-CB 3.31Å; A250-I253 PolarHBondContact O-N 3.26Å; I253-G255 PolarHBondContact O-N 2.97Å |
| 254 | L | 90.1 | Very high | 89.3 | Confident | 94 Ų | 94 | 77.1 Ų | 77.1 | 49% | 0.492 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -16.3 | 176.4 | -92.1 | 73.5 | 0 | 0 | 0 | 113.5 | A250 L251 R252 E256 | A250-L254 WeakPolarHBondContact O-CD1 3.5Å; A250-L254 PolarHBondContact O-N 2.99Å; L251-L254 PolarHBondContact O-N 3.18Å; R252-L254 VanDerWaalsContact C-N 3.28Å; R252-L254 PolarHBondContact O-N 3.28Å; L254-E256 PolarHBondContact O-N 2.84Å |
| 255 | G | 86.9 | Confident | 89.5 | Confident | 35 Ų | 35 | 78.5 Ų | 78.5 | 36% | 0.361 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66.8 | -125.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | R252 I253 E257 G258 E259 | R252-G255 PolarHBondContact O-N 3.1Å; I253-G255 PolarHBondContact O-N 2.97Å; G255-E257 VanDerWaalsContact C-N 3.3Å; G255-E257 PolarHBondContact O-N 3.42Å; G255-G258 PolarHBondContact O-N 2.87Å; G255-G258 VanDerWaalsContact O-N 3.09Å; G255-E259 PolarHBondContact O-N 3.06Å |
| 256 | E | 88.8 | Confident | 89.8 | Confident | 189 Ų | 189 | 79.7 Ų | 79.7 | 88% | 0.883 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -61 | -35.4 | -174.2 | -64.3 | -171.3 | 167.3 | 0 | 0 | 113.3 | L254 G258 E259 | L254-E256 PolarHBondContact O-N 2.84Å; E256-G258 VanDerWaalsContact C-N 3.29Å; E256-G258 PolarHBondContact O-N 3.45Å; E256-E259 PolarHBondContact O-N 3.21Å |
| 257 | E | 91.3 | Very high | 89.9 | Confident | 160 Ų | 160 | 76.7 Ų | 76.7 | 75% | 0.748 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -67.5 | -31.5 | 177.6 | -64.6 | -174 | 176.1 | 0 | 0 | 112.3 | G255 | G255-E257 VanDerWaalsContact C-N 3.3Å; G255-E257 PolarHBondContact O-N 3.42Å |
| 258 | G | 90.7 | Very high | 89.8 | Confident | 0 Ų | 0 | 77.7 Ų | 77.7 | 0% | 0 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -79.1 | -22.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | G255 E256 E260 L261 I262 | G255-G258 PolarHBondContact O-N 2.87Å; G255-G258 VanDerWaalsContact O-N 3.09Å; E256-G258 VanDerWaalsContact C-N 3.29Å; E256-G258 PolarHBondContact O-N 3.45Å; G258-E260 VanDerWaalsContact C-N 3.33Å; G258-E260 PolarHBondContact O-N 2.93Å; G258-L261 PolarHBondContact O-N 3.25Å; G258-I262 VanDerWaalsContact O-CG1 3.3Å; G258-I262 WeakPolarHBondContact O-CG1 3.3Å; G258-I262 PolarHBondContact O-N 3.01Å |
| 259 | E | 89.8 | Confident | 89.5 | Confident | 96 Ų | 96 | 79 Ų | 79 | 45% | 0.449 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.8 | -38.1 | -173.1 | -166 | 66 | -158.2 | 0 | 0 | 112.6 | R252 G255 E256 L261 I262 R263 | R252-E259 IonicContact NH1-OE2 3.67Å; G255-E259 PolarHBondContact O-N 3.06Å; E256-E259 PolarHBondContact O-N 3.21Å; E259-L261 PolarHBondContact O-N 2.71Å; E259-I262 PolarHBondContact O-N 2.86Å; E259-R263 WeakPolarHBondContact O-CB 3.44Å; E259-R263 PolarHBondContact O-N 3.48Å |
| 260 | E | 93.1 | Very high | 89.2 | Confident | 135 Ų | 135 | 82.8 Ų | 82.8 | 63% | 0.631 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -65.5 | -39.6 | 178.8 | -167.1 | 63.1 | -163.4 | 0 | 0 | 111.6 | G258 R263 F264 | G258-E260 VanDerWaalsContact C-N 3.33Å; G258-E260 PolarHBondContact O-N 2.93Å; E260-R263 PolarHBondContact O-N 3.25Å; E260-F264 PolarHBondContact O-N 3.45Å |
| 261 | L | 94.6 | Very high | 89 | Confident | 78 Ų | 78 | 83.6 Ų | 83.6 | 41% | 0.408 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -69.7 | -41 | 175.1 | -74.4 | 176.5 | 0 | 0 | 0 | 111.6 | L251 G258 E259 R263 F264 F265 | L251-L261 HydrophobicContact CD1-CB 4Å; L251-L261 HydrophobicContact CD2-CB 3.95Å; L251-L261 HydrophobicContact CD2-CD1 3.59Å; L251-L261 HydrophobicContact CD2-CG 4.43Å; G258-L261 PolarHBondContact O-N 3.25Å; E259-L261 PolarHBondContact O-N 2.71Å; L261-R263 VanDerWaalsContact C-N 3.26Å; L261-R263 PolarHBondContact O-N 3.12Å; L261-F264 WeakPolarHBondContact O-CB 3.33Å; L261-F264 PolarHBondContact O-N 3.03Å; L261-F264 VanDerWaalsContact O-N 3.16Å; L261-F265 WeakPolarHBondContact O-CD2 3.49Å; L261-F265 PolarHBondContact O-N 3.31Å |
| 262 | I | 89.8 | Confident | 88.4 | Confident | 10 Ų | 10 | 83.7 Ų | 83.7 | 5% | 0.051 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -58.6 | -43.4 | 174.7 | -66.5 | 165 | 0 | 0 | 0 | 110 | A119 L251 G258 E259 F264 F265 N266 | A119-I262 HydrophobicContact CB-CD1 3.73Å; A119-I262 HydrophobicContact CB-CG1 3.68Å; A119-I262 HydrophobicContact CB-CG2 4.25Å; L251-I262 HydrophobicContact CB-CD1 4.16Å; L251-I262 HydrophobicContact CB-CG1 3.96Å; L251-I262 HydrophobicContact CD1-CG1 4.15Å; G258-I262 VanDerWaalsContact O-CG1 3.3Å; G258-I262 WeakPolarHBondContact O-CG1 3.3Å; G258-I262 PolarHBondContact O-N 3.01Å; E259-I262 PolarHBondContact O-N 2.86Å; I262-F264 PolarHBondContact O-N 3.24Å; I262-F265 PolarHBondContact O-N 2.9Å; I262-N266 WeakPolarHBondContact O-CB 3.34Å; I262-N266 VanDerWaalsContact O-CG 3.29Å; I262-N266 PolarHBondContact O-N 3.04Å; I262-N266 PolarHBondContact O-ND2 3.28Å |
| 263 | R | 91.8 | Very high | 87.7 | Confident | 171 Ų | 171 | 82.1 Ų | 82.1 | 65% | 0.645 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -63.1 | -40.6 | 176.2 | -169.8 | 179.2 | -176.6 | -176.5 | 1.9 | 112.3 | E259 E260 L261 N266 A267 | E259-R263 WeakPolarHBondContact O-CB 3.44Å; E259-R263 PolarHBondContact O-N 3.48Å; E260-R263 PolarHBondContact O-N 3.25Å; L261-R263 VanDerWaalsContact C-N 3.26Å; L261-R263 PolarHBondContact O-N 3.12Å; R263-N266 PolarHBondContact O-N 2.89Å; R263-A267 WeakPolarHBondContact O-CB 3.3Å; R263-A267 PolarHBondContact O-N 2.8Å |
| 264 | F | 94.6 | Very high | 87.3 | Confident | 114 Ų | 114 | 79.5 Ų | 79.5 | 50% | 0.5 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -58.4 | -51.5 | 173.1 | 167.5 | -94 | 0 | 0 | 0 | 111.6 | E260 L261 I262 N266 A267 F268 | E260-F264 PolarHBondContact O-N 3.45Å; L261-F264 WeakPolarHBondContact O-CB 3.33Å; L261-F264 PolarHBondContact O-N 3.03Å; L261-F264 VanDerWaalsContact O-N 3.16Å; I262-F264 PolarHBondContact O-N 3.24Å; F264-N266 VanDerWaalsContact C-N 3.33Å; F264-N266 PolarHBondContact O-N 3.42Å; F264-A267 PolarHBondContact O-N 3.49Å; F264-F268 HydrophobicContact CZ-CD2 4.24Å; F264-F268 WeakPolarHBondContact O-CB 3.34Å; F264-F268 PolarHBondContact O-N 2.86Å |
| 265 | F | 90.4 | Very high | 86.9 | Confident | 29 Ų | 29 | 78.3 Ų | 78.3 | 13% | 0.127 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.7 | -38.8 | 179.5 | -77.8 | -70.8 | 0 | 0 | 0 | 112.3 | C112 V115 S116 F247 L251 L261 I262 F268 N269 | C112-F265 HydrophobicContact CB-CD1 3.99Å; V115-F265 HydrophobicContact CB-CD1 4.26Å; V115-F265 HydrophobicContact CB-CD2 4.29Å; V115-F265 HydrophobicContact CB-CG 4.11Å; V115-F265 HydrophobicContact CG1-CB 4.27Å; V115-F265 HydrophobicContact CG1-CD1 4.3Å; V115-F265 HydrophobicContact CG1-CD2 3.47Å; V115-F265 VanDerWaalsContact CG1-CD2 3.47Å; V115-F265 HydrophobicContact CG1-CE2 3.85Å; V115-F265 HydrophobicContact CG1-CG 3.75Å; V115-F265 HydrophobicContact CG1-CZ 4.37Å; V115-F265 HydrophobicContact CG2-CE1 4.42Å; S116-F265 WeakPolarHBondContact OG-CB 3.26Å; F247-F265 HydrophobicContact CD1-CE2 4.45Å; F247-F265 AromaticContact CE1-CE2 3.8Å; F247-F265 HydrophobicContact CE1-CE2 3.8Å; F247-F265 HydrophobicContact CE1-CZ 4.07Å; L251-F265 HydrophobicContact CD1-CD2 4.22Å; L251-F265 HydrophobicContact CD1-CE2 4.23Å; L261-F265 WeakPolarHBondContact O-CD2 3.49Å; L261-F265 PolarHBondContact O-N 3.31Å; I262-F265 PolarHBondContact O-N 2.9Å; F265-F268 PolarHBondContact O-N 3.41Å; F265-N269 VanDerWaalsContact O-CB 3.3Å; F265-N269 WeakPolarHBondContact O-CB 2.85Å; F265-N269 PolarHBondContact O-N 3.08Å |
| 266 | N | 85.5 | Confident | 86.1 | Confident | 77 Ų | 77 | 77.4 Ų | 77.4 | 41% | 0.412 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.7 | -49.1 | 173.7 | -76.6 | -25.8 | 0 | 0 | 0 | 112.2 | S116 I262 R263 F264 F268 N269 E270 | S116-N266 WeakPolarHBondContact CB-OD1 3.41Å; S116-N266 PolarHBondContact OG-N 3.01Å; S116-N266 PolarHBondContact OG-OD1 3.47Å; I262-N266 WeakPolarHBondContact O-CB 3.34Å; I262-N266 VanDerWaalsContact O-CG 3.29Å; I262-N266 PolarHBondContact O-N 3.04Å; I262-N266 PolarHBondContact O-ND2 3.28Å; R263-N266 PolarHBondContact O-N 2.89Å; F264-N266 VanDerWaalsContact C-N 3.33Å; F264-N266 PolarHBondContact O-N 3.42Å; N266-F268 VanDerWaalsContact C-N 3.32Å; N266-F268 PolarHBondContact O-N 3.41Å; N266-N269 PolarHBondContact O-N 3.04Å; N266-E270 PolarHBondContact O-N 3.46Å |
| 267 | A | 89.8 | Confident | 85.5 | Confident | 62 Ų | 62 | 71.5 Ų | 71.5 | 51% | 0.512 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.3 | -38.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | R263 F264 E270 A271 | R263-A267 WeakPolarHBondContact O-CB 3.3Å; R263-A267 PolarHBondContact O-N 2.8Å; F264-A267 PolarHBondContact O-N 3.49Å; A267-E270 PolarHBondContact O-N 2.83Å; A267-A271 WeakPolarHBondContact O-CB 3.38Å; A267-A271 PolarHBondContact O-N 3.42Å |
| 268 | F | 89.5 | Confident | 85.2 | Confident | 88 Ų | 88 | 72 Ų | 72 | 39% | 0.386 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -68.3 | -38.8 | 177.3 | -165.3 | -84.9 | 0 | 0 | 0 | 112.2 | P108 C112 F264 F265 N266 A271 T272 | P108-F268 HydrophobicContact CB-CE1 3.57Å; P108-F268 HydrophobicContact CB-CZ 4.31Å; C112-F268 HydrophobicContact CB-CD1 4.23Å; C112-F268 WeakPolarHBondContact SG-CD1 3.44Å; F264-F268 HydrophobicContact CZ-CD2 4.24Å; F264-F268 WeakPolarHBondContact O-CB 3.34Å; F264-F268 PolarHBondContact O-N 2.86Å; F265-F268 PolarHBondContact O-N 3.41Å; N266-F268 VanDerWaalsContact C-N 3.32Å; N266-F268 PolarHBondContact O-N 3.41Å; F268-A271 PolarHBondContact O-N 2.8Å; F268-T272 WeakPolarHBondContact O-CB 3.33Å; F268-T272 PolarHBondContact O-N 3.11Å; F268-T272 PolarHBondContact O-OG1 3.48Å |
| 269 | N | 81.1 | Confident | 84.5 | Confident | 29 Ų | 29 | 72.5 Ų | 72.5 | 16% | 0.155 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.4 | -49.2 | 172.9 | -169.5 | 37.2 | 0 | 0 | 0 | 110.7 | L109 C112 F265 N266 A271 T272 M273 | L109-N269 WeakPolarHBondContact CD1-OD1 3.44Å; C112-N269 HydrophobicContact CB-CB 4.17Å; F265-N269 VanDerWaalsContact O-CB 3.3Å; F265-N269 WeakPolarHBondContact O-CB 2.85Å; F265-N269 PolarHBondContact O-N 3.08Å; N266-N269 PolarHBondContact O-N 3.04Å; N269-A271 VanDerWaalsContact C-N 3.35Å; N269-A271 PolarHBondContact O-N 3.45Å; N269-T272 WeakPolarHBondContact O-CA 3.45Å; N269-T272 WeakPolarHBondContact O-CB 3.19Å; N269-T272 PolarHBondContact O-N 3.07Å; N269-M273 VanDerWaalsContact O-CG 3.25Å; N269-M273 WeakPolarHBondContact O-CG 3.37Å; N269-M273 PolarHBondContact O-N 2.97Å |
| 270 | E | 79.4 | Confident | 83.8 | Confident | 130 Ų | 130 | 69.4 Ų | 69.4 | 61% | 0.607 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -61 | -41.6 | 178.2 | -167.3 | 62.7 | -151 | 0 | 0 | 112.2 | N266 A267 T272 M273 V274 | N266-E270 PolarHBondContact O-N 3.46Å; A267-E270 PolarHBondContact O-N 2.83Å; E270-T272 VanDerWaalsContact C-N 3.31Å; E270-T272 PolarHBondContact O-N 2.98Å; E270-M273 WeakPolarHBondContact O-CB 3.44Å; E270-M273 PolarHBondContact O-N 2.86Å; E270-V274 PolarHBondContact O-N 2.89Å |
| 271 | A | 86.8 | Confident | 83.2 | Confident | 56 Ų | 56 | 70.6 Ų | 70.6 | 46% | 0.463 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.2 | -40 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A267 F268 N269 M273 V274 L275 | A267-A271 WeakPolarHBondContact O-CB 3.38Å; A267-A271 PolarHBondContact O-N 3.42Å; F268-A271 PolarHBondContact O-N 2.8Å; N269-A271 VanDerWaalsContact C-N 3.35Å; N269-A271 PolarHBondContact O-N 3.45Å; A271-M273 VanDerWaalsContact C-N 3.31Å; A271-M273 PolarHBondContact O-N 3.31Å; A271-V274 WeakPolarHBondContact O-CB 3.32Å; A271-V274 PolarHBondContact O-N 3.02Å; A271-L275 PolarHBondContact O-N 3.35Å |
| 272 | T | 79.1 | Confident | 82.7 | Confident | 6 Ų | 6 | 69.6 Ų | 69.6 | 4% | 0.037 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.3 | -35.6 | 176.6 | -56.1 | 0 | 0 | 0 | 0 | 111.4 | I105 P108 L109 F268 N269 E270 V274 L275 V276 | I105-T272 HydrophobicContact CG2-CG2 3.76Å; P108-T272 HydrophobicContact CB-CG2 4.42Å; P108-T272 HydrophobicContact CG-CG2 4.33Å; L109-T272 HydrophobicContact CB-CG2 4.15Å; L109-T272 HydrophobicContact CD1-CG2 4.23Å; F268-T272 WeakPolarHBondContact O-CB 3.33Å; F268-T272 PolarHBondContact O-N 3.11Å; F268-T272 PolarHBondContact O-OG1 3.48Å; N269-T272 WeakPolarHBondContact O-CA 3.45Å; N269-T272 WeakPolarHBondContact O-CB 3.19Å; N269-T272 PolarHBondContact O-N 3.07Å; E270-T272 VanDerWaalsContact C-N 3.31Å; E270-T272 PolarHBondContact O-N 2.98Å; T272-V274 VanDerWaalsContact C-N 3.32Å; T272-V274 PolarHBondContact O-N 3.49Å; T272-L275 WeakPolarHBondContact O-CB 3.36Å; T272-L275 PolarHBondContact O-N 3.48Å; T272-L275 VanDerWaalsContact O-N 3.12Å; T272-V276 PolarHBondContact O-N 2.85Å |
| 273 | M | 70.4 | Confident | 82.1 | Confident | 44 Ų | 44 | 69.8 Ų | 69.8 | 22% | 0.217 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.7 | -32.2 | 176 | -66.9 | -72.9 | -67.5 | 0 | 0 | 113.2 | L109 N269 E270 A271 L275 V276 S277 I437 | L109-M273 HydrophobicContact CD1-SD 4.03Å; N269-M273 VanDerWaalsContact O-CG 3.25Å; N269-M273 WeakPolarHBondContact O-CG 3.37Å; N269-M273 PolarHBondContact O-N 2.97Å; E270-M273 WeakPolarHBondContact O-CB 3.44Å; E270-M273 PolarHBondContact O-N 2.86Å; A271-M273 VanDerWaalsContact C-N 3.31Å; A271-M273 PolarHBondContact O-N 3.31Å; M273-L275 VanDerWaalsContact C-N 3.35Å; M273-V276 PolarHBondContact O-N 3.04Å; M273-S277 PolarHBondContact O-N 3.19Å; M273-S277 PolarHBondContact O-OG 2.83Å; M273-I437 HydrophobicContact CE-CG2 3.06Å; M273-I437 HydrophobicContact SD-CG2 3.44Å; M273-I437 WeakPolarHBondContact SD-CG2 3.09Å |
| 274 | V | 80.7 | Confident | 81.6 | Confident | 66 Ų | 66 | 62.3 Ų | 62.3 | 40% | 0.4 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 171 | 176.8 | 0 | 0 | 0 | 0 | 110.6 | E270 A271 T272 S277 W278 | E270-V274 PolarHBondContact O-N 2.89Å; A271-V274 WeakPolarHBondContact O-CB 3.32Å; A271-V274 PolarHBondContact O-N 3.02Å; T272-V274 VanDerWaalsContact C-N 3.32Å; T272-V274 PolarHBondContact O-N 3.49Å; V274-S277 WeakPolarHBondContact O-CB 3.48Å; V274-S277 PolarHBondContact O-N 2.93Å; V274-W278 HydrophobicContact CG1-CZ2 3.84Å; V274-W278 PolarHBondContact O-N 3.45Å |
| 275 | L | 81.3 | Confident | 81.3 | Confident | 69 Ų | 69 | 61.7 Ų | 61.7 | 36% | 0.361 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -61 | -47.9 | 174.5 | -60.9 | 178.3 | 0 | 0 | 0 | 110.9 | I105 A271 T272 M273 S277 W278 I279 | I105-L275 HydrophobicContact CD1-CB 3.84Å; A271-L275 PolarHBondContact O-N 3.35Å; T272-L275 WeakPolarHBondContact O-CB 3.36Å; T272-L275 PolarHBondContact O-N 3.48Å; T272-L275 VanDerWaalsContact O-N 3.12Å; M273-L275 VanDerWaalsContact C-N 3.35Å; L275-S277 PolarHBondContact O-N 3.05Å; L275-W278 HydrophobicContact CD2-CE3 3.72Å; L275-W278 HydrophobicContact CD2-CH2 4.33Å; L275-W278 HydrophobicContact CD2-CZ3 3.51Å; L275-W278 WeakPolarHBondContact O-CB 3.4Å; L275-W278 PolarHBondContact O-N 3.04Å; L275-I279 WeakPolarHBondContact O-CG1 3.47Å; L275-I279 PolarHBondContact O-N 3.05Å; L275-I279 VanDerWaalsContact O-N 3.08Å |
| 276 | V | 70.1 | Confident | 80.8 | Confident | 17 Ų | 17 | 60.3 Ų | 60.3 | 10% | 0.103 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -51 | -46.3 | 174.9 | 172.4 | 0 | 0 | 0 | 0 | 110.5 | I105 T272 M273 W278 I279 M280 I437 | I105-V276 HydrophobicContact CD1-CB 4.44Å; I105-V276 HydrophobicContact CD1-CG2 3.71Å; I105-V276 HydrophobicContact CG2-CG2 3.68Å; T272-V276 PolarHBondContact O-N 2.85Å; M273-V276 PolarHBondContact O-N 3.04Å; V276-W278 VanDerWaalsContact C-N 3.28Å; V276-W278 PolarHBondContact O-N 3.43Å; V276-I279 CarbonylContact O-C 3.6Å; V276-I279 WeakPolarHBondContact O-CA 3.38Å; V276-I279 WeakPolarHBondContact O-CB 3.46Å; V276-I279 PolarHBondContact O-N 3.06Å; V276-M280 HydrophobicContact CG1-CG 4.22Å; V276-M280 WeakPolarHBondContact O-CG 3.47Å; V276-M280 PolarHBondContact O-N 3.29Å; V276-I437 HydrophobicContact CG1-CD1 4.19Å; V276-I437 HydrophobicContact CG2-CD1 4.36Å |
| 277 | S | 75.1 | Confident | 80.4 | Confident | 65 Ų | 65 | 57 Ų | 57 | 46% | 0.455 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -59.2 | -36.3 | -179.9 | -60.1 | 0 | 0 | 0 | 0 | 113 | M273 V274 L275 | M273-S277 PolarHBondContact O-N 3.19Å; M273-S277 PolarHBondContact O-OG 2.83Å; V274-S277 WeakPolarHBondContact O-CB 3.48Å; V274-S277 PolarHBondContact O-N 2.93Å; L275-S277 PolarHBondContact O-N 3.05Å |
| 278 | W | 85.1 | Confident | 80 | Confident | 171 Ų | 171 | 55.6 Ų | 55.6 | 65% | 0.648 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -69.3 | -40.5 | 173.4 | -59.3 | -16.4 | 0 | 0 | 0 | 112.1 | V274 L275 V276 M280 W281 | V274-W278 HydrophobicContact CG1-CZ2 3.84Å; V274-W278 PolarHBondContact O-N 3.45Å; L275-W278 HydrophobicContact CD2-CE3 3.72Å; L275-W278 HydrophobicContact CD2-CH2 4.33Å; L275-W278 HydrophobicContact CD2-CZ3 3.51Å; L275-W278 WeakPolarHBondContact O-CB 3.4Å; L275-W278 PolarHBondContact O-N 3.04Å; V276-W278 VanDerWaalsContact C-N 3.28Å; V276-W278 PolarHBondContact O-N 3.43Å; W278-M280 VanDerWaalsContact C-N 3.3Å; W278-M280 PolarHBondContact O-N 3.35Å; W278-W281 PolarHBondContact O-N 3.45Å |
| 279 | I | 77.5 | Confident | 79.8 | Confident | 9 Ų | 9 | 53.3 Ų | 53.3 | 5% | 0.046 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.5 | -38 | 176.3 | -55.9 | -169.7 | 0 | 0 | 0 | 110.8 | L98 M101 L102 I105 L275 V276 W281 Y282 I283 | L98-I279 HydrophobicContact CD1-CG2 4.23Å; M101-I279 HydrophobicContact CB-CD1 4.02Å; M101-I279 HydrophobicContact CB-CG2 4.29Å; M101-I279 HydrophobicContact CE-CB 4.2Å; M101-I279 HydrophobicContact CE-CD1 4.12Å; M101-I279 HydrophobicContact CE-CG1 3.66Å; M101-I279 HydrophobicContact CE-CG2 4.09Å; L102-I279 HydrophobicContact CD2-CG2 4.07Å; I105-I279 HydrophobicContact CD1-CD1 3.24Å; I105-I279 HydrophobicContact CD1-CG1 4.18Å; I105-I279 HydrophobicContact CG1-CD1 3.84Å; L275-I279 WeakPolarHBondContact O-CG1 3.47Å; L275-I279 PolarHBondContact O-N 3.05Å; L275-I279 VanDerWaalsContact O-N 3.08Å; V276-I279 CarbonylContact O-C 3.6Å; V276-I279 WeakPolarHBondContact O-CA 3.38Å; V276-I279 WeakPolarHBondContact O-CB 3.46Å; V276-I279 PolarHBondContact O-N 3.06Å; I279-W281 PolarHBondContact O-N 3.49Å; I279-Y282 WeakPolarHBondContact O-CA 3Å; I279-Y282 WeakPolarHBondContact O-CB 3.16Å; I279-Y282 PolarHBondContact O-N 2.83Å; I279-I283 PolarHBondContact O-N 2.9Å; I279-I283 VanDerWaalsContact O-N 3.1Å |
| 280 | M | 73.4 | Confident | 79.5 | Confident | 31 Ų | 31 | 52.2 Ų | 52.2 | 15% | 0.153 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -55.1 | -36.3 | 176.2 | -68.7 | -60.8 | -63.7 | 0 | 0 | 112.2 | L60 V276 W278 Y282 I283 P284 P438 | L60-M280 WeakPolarHBondContact CD1-O 3.45Å; L60-M280 HydrophobicContact CD2-CB 4.29Å; L60-M280 HydrophobicContact CD2-CE 3.94Å; V276-M280 HydrophobicContact CG1-CG 4.22Å; V276-M280 WeakPolarHBondContact O-CG 3.47Å; V276-M280 PolarHBondContact O-N 3.29Å; W278-M280 VanDerWaalsContact C-N 3.3Å; W278-M280 PolarHBondContact O-N 3.35Å; M280-Y282 VanDerWaalsContact C-N 3.29Å; M280-Y282 PolarHBondContact O-N 2.96Å; M280-I283 HydrophobicContact CE-CD1 3.86Å; M280-I283 HydrophobicContact CG-CD1 4.44Å; M280-I283 WeakPolarHBondContact O-CB 3.17Å; M280-I283 PolarHBondContact O-N 2.84Å; M280-I283 HydrophobicContact SD-CD1 3.3Å; M280-I283 WeakPolarHBondContact SD-CD1 3.42Å; M280-P284 WeakPolarHBondContact O-CD 3.25Å; M280-P438 HydrophobicContact CE-CB 3.53Å; M280-P438 HydrophobicContact CE-CG 4.04Å; M280-P438 HydrophobicContact SD-CB 4.25Å |
| 281 | W | 81.9 | Confident | 79.2 | Confident | 160 Ų | 160 | 46.4 Ų | 46.4 | 61% | 0.606 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -70 | -24.2 | 175.6 | -74.9 | 101.7 | 0 | 0 | 0 | 113.8 | L59 L63 W278 I279 | L59-W281 HydrophobicContact CD2-CH2 4.01Å; L59-W281 HydrophobicContact CD2-CZ3 4.04Å; L63-W281 HydrophobicContact CD1-CZ3 4.39Å; W278-W281 PolarHBondContact O-N 3.45Å; I279-W281 PolarHBondContact O-N 3.49Å |
| 282 | Y | 83.8 | Confident | 78.8 | Confident | 58 Ų | 58 | 43.8 Ų | 43.8 | 23% | 0.227 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -81 | -24.2 | 173.8 | -176.1 | -102.3 | 0 | 0 | 0 | 112.7 | P94 M97 L98 M101 I279 M280 F285 G286 | P94-Y282 WeakPolarHBondContact CA-OH 3.46Å; P94-Y282 PolarHBondContact O-OH 3.32Å; M97-Y282 HydrophobicContact CB-CE1 4.49Å; L98-Y282 HydrophobicContact CB-CD1 4.15Å; L98-Y282 HydrophobicContact CB-CE1 3.81Å; L98-Y282 HydrophobicContact CD1-CD1 4.09Å; M101-Y282 HydrophobicContact CE-CD1 4.42Å; M101-Y282 HydrophobicContact SD-CD1 3.94Å; M101-Y282 HydrophobicContact SD-CE1 4.16Å; M101-Y282 HydrophobicContact SD-CG 4.43Å; I279-Y282 WeakPolarHBondContact O-CA 3Å; I279-Y282 WeakPolarHBondContact O-CB 3.16Å; I279-Y282 PolarHBondContact O-N 2.83Å; M280-Y282 VanDerWaalsContact C-N 3.29Å; M280-Y282 PolarHBondContact O-N 2.96Å; Y282-F285 HydrophobicContact CD2-CD1 4.24Å; Y282-F285 AromaticContact CE2-CD1 3.55Å; Y282-F285 HydrophobicContact CE2-CD1 3.55Å; Y282-F285 HydrophobicContact CE2-CE1 4.1Å; Y282-F285 AromaticContact CZ-CD1 3.91Å; Y282-F285 WeakPolarHBondContact O-CB 3.24Å; Y282-F285 PolarHBondContact O-N 3.08Å; Y282-F285 VanDerWaalsContact O-N 3.11Å; Y282-G286 PolarHBondContact O-N 2.81Å |
| 283 | I | 77.3 | Confident | 78.7 | Confident | 13 Ų | 13 | 44 Ų | 44 | 7% | 0.067 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -50.4 | -49.4 | -177 | -73.4 | 179.4 | 0 | 0 | 0 | 113.8 | L98 I279 M280 F285 G286 I287 | L98-I283 HydrophobicContact CD1-CG1 3.79Å; I279-I283 PolarHBondContact O-N 2.9Å; I279-I283 VanDerWaalsContact O-N 3.1Å; M280-I283 HydrophobicContact CE-CD1 3.86Å; M280-I283 HydrophobicContact CG-CD1 4.44Å; M280-I283 WeakPolarHBondContact O-CB 3.17Å; M280-I283 PolarHBondContact O-N 2.84Å; M280-I283 HydrophobicContact SD-CD1 3.3Å; M280-I283 WeakPolarHBondContact SD-CD1 3.42Å; I283-F285 PolarHBondContact O-N 3.08Å; I283-G286 PolarHBondContact O-N 3.17Å; I283-I287 HydrophobicContact CG2-CD1 3.33Å; I283-I287 HydrophobicContact CG2-CG1 3.88Å; I283-I287 WeakPolarHBondContact O-CB 3.45Å; I283-I287 WeakPolarHBondContact O-CG1 3.42Å; I283-I287 PolarHBondContact O-N 2.9Å |
| 284 | P | 81.6 | Confident | 78.7 | Confident | 14 Ų | 14 | 43.6 Ų | 43.6 | 9% | 0.091 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -56.7 | -38.6 | -178.5 | -26.4 | 34.5 | 0 | 0 | 0 | 113.1 | L60 L63 M280 M288 | L60-P284 HydrophobicContact CD1-CG 4.23Å; L63-P284 HydrophobicContact CB-CB 3.82Å; L63-P284 HydrophobicContact CB-CG 3.7Å; M280-P284 WeakPolarHBondContact O-CD 3.25Å; P284-M288 PolarHBondContact O-N 3.29Å |
| 285 | F | 86.7 | Confident | 78.5 | Confident | 101 Ų | 101 | 41 Ų | 41 | 44% | 0.443 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -73.6 | -46 | 178.4 | -177.6 | -103 | 0 | 0 | 0 | 111.5 | P94 Y282 I283 M288 F289 | P94-F285 HydrophobicContact CB-CD1 4.33Å; P94-F285 HydrophobicContact CB-CE1 3.8Å; P94-F285 HydrophobicContact CG-CE1 4.39Å; Y282-F285 HydrophobicContact CD2-CD1 4.24Å; Y282-F285 AromaticContact CE2-CD1 3.55Å; Y282-F285 HydrophobicContact CE2-CD1 3.55Å; Y282-F285 HydrophobicContact CE2-CE1 4.1Å; Y282-F285 AromaticContact CZ-CD1 3.91Å; Y282-F285 WeakPolarHBondContact O-CB 3.24Å; Y282-F285 PolarHBondContact O-N 3.08Å; Y282-F285 VanDerWaalsContact O-N 3.11Å; I283-F285 PolarHBondContact O-N 3.08Å; F285-M288 HydrophobicContact CD2-CE 4.13Å; F285-M288 HydrophobicContact CE2-CE 4.23Å; F285-M288 WeakPolarHBondContact O-CB 3.45Å; F285-M288 PolarHBondContact O-N 2.87Å; F285-F289 HydrophobicContact CD2-CE2 4.11Å; F285-F289 HydrophobicContact CE1-CD2 4.35Å; F285-F289 HydrophobicContact CE1-CE2 4.07Å; F285-F289 HydrophobicContact CE2-CD2 4.37Å; F285-F289 AromaticContact CE2-CE2 3.53Å; F285-F289 HydrophobicContact CE2-CE2 3.53Å; F285-F289 HydrophobicContact CE2-CZ 4.41Å; F285-F289 HydrophobicContact CZ-CD2 4.23Å; F285-F289 AromaticContact CZ-CE2 3.51Å; F285-F289 HydrophobicContact CZ-CE2 3.51Å; F285-F289 HydrophobicContact CZ-CZ 4.35Å; F285-F289 WeakPolarHBondContact O-CD2 3.08Å |
| 286 | G | 81.4 | Confident | 78.3 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63 | -43.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | G95 Y282 I283 M288 F289 L290 | G95-G286 WeakPolarHBondContact CA-O 3.23Å; Y282-G286 PolarHBondContact O-N 2.81Å; I283-G286 PolarHBondContact O-N 3.17Å; G286-M288 VanDerWaalsContact C-N 3.33Å; G286-M288 PolarHBondContact O-N 3.18Å; G286-F289 PolarHBondContact O-N 2.95Å; G286-L290 VanDerWaalsContact O-CB 3.24Å; G286-L290 WeakPolarHBondContact O-CB 3.48Å; G286-L290 PolarHBondContact O-N 2.95Å |
| 287 | I | 75.9 | Confident | 78.4 | Confident | 7 Ų | 7 | 42.8 Ų | 42.8 | 4% | 0.036 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.2 | -40 | 177.9 | -72.8 | -177.6 | 0 | 0 | 0 | 111.1 | T64 V68 L98 I283 F289 L290 V291 | T64-I287 HydrophobicContact CG2-CD1 3.94Å; V68-I287 HydrophobicContact CG2-CG2 3.51Å; L98-I287 HydrophobicContact CD2-CG1 3.98Å; I283-I287 HydrophobicContact CG2-CD1 3.33Å; I283-I287 HydrophobicContact CG2-CG1 3.88Å; I283-I287 WeakPolarHBondContact O-CB 3.45Å; I283-I287 WeakPolarHBondContact O-CG1 3.42Å; I283-I287 PolarHBondContact O-N 2.9Å; I287-F289 VanDerWaalsContact C-N 3.33Å; I287-F289 PolarHBondContact O-N 3.39Å; I287-L290 PolarHBondContact O-N 3.04Å; I287-V291 HydrophobicContact CG2-CG2 3.74Å; I287-V291 WeakPolarHBondContact O-CB 3.35Å; I287-V291 VanDerWaalsContact O-CG2 3.23Å; I287-V291 WeakPolarHBondContact O-CG2 3.29Å; I287-V291 PolarHBondContact O-N 3.18Å |
| 288 | M | 82.9 | Confident | 78 | Confident | 34 Ų | 34 | 40.1 Ų | 40.1 | 17% | 0.167 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -54.1 | -48.8 | 177.8 | -178.4 | -175.2 | 70.1 | 0 | 0 | 112 | G67 V70 G71 P284 F285 G286 G292 | G67-M288 WeakPolarHBondContact O-CA 3.38Å; G67-M288 WeakPolarHBondContact O-CB 3.32Å; V70-M288 HydrophobicContact CB-CG 4.29Å; V70-M288 HydrophobicContact CB-SD 4.19Å; V70-M288 HydrophobicContact CG1-CG 4.01Å; V70-M288 HydrophobicContact CG1-SD 3.52Å; V70-M288 VanDerWaalsContact CG1-SD 3.52Å; G71-M288 WeakPolarHBondContact CA-O 3.46Å; P284-M288 PolarHBondContact O-N 3.29Å; F285-M288 HydrophobicContact CD2-CE 4.13Å; F285-M288 HydrophobicContact CE2-CE 4.23Å; F285-M288 WeakPolarHBondContact O-CB 3.45Å; F285-M288 PolarHBondContact O-N 2.87Å; G286-M288 VanDerWaalsContact C-N 3.33Å; G286-M288 PolarHBondContact O-N 3.18Å; M288-G292 PolarHBondContact O-N 2.99Å |
| 289 | F | 84.5 | Confident | 77.1 | Confident | 39 Ų | 39 | 38 Ų | 38 | 17% | 0.171 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -74.4 | -36.5 | 178.3 | -74.2 | -81.4 | 0 | 0 | 0 | 112.9 | F91 P94 F285 G286 I287 G292 S293 | F91-F289 HydrophobicContact CD2-CD1 4Å; F91-F289 HydrophobicContact CD2-CE1 4.16Å; F91-F289 AromaticContact CE2-CD1 3.57Å; F91-F289 HydrophobicContact CE2-CD1 3.57Å; F91-F289 AromaticContact CE2-CE1 3.75Å; F91-F289 HydrophobicContact CE2-CE1 3.75Å; F91-F289 HydrophobicContact CZ-CD1 4.1Å; F91-F289 WeakPolarHBondContact O-CD1 3.38Å; P94-F289 HydrophobicContact CB-CB 4.03Å; P94-F289 HydrophobicContact CB-CD2 3.58Å; P94-F289 HydrophobicContact CB-CE2 4.21Å; P94-F289 HydrophobicContact CB-CG 3.85Å; P94-F289 HydrophobicContact CG-CB 4.28Å; P94-F289 HydrophobicContact CG-CD1 4.12Å; P94-F289 HydrophobicContact CG-CD2 3.75Å; P94-F289 HydrophobicContact CG-CE1 4.41Å; P94-F289 HydrophobicContact CG-CE2 4.06Å; P94-F289 HydrophobicContact CG-CG 3.78Å; P94-F289 HydrophobicContact CG-CZ 4.39Å; F285-F289 HydrophobicContact CD2-CE2 4.11Å; F285-F289 HydrophobicContact CE1-CD2 4.35Å; F285-F289 HydrophobicContact CE1-CE2 4.07Å; F285-F289 HydrophobicContact CE2-CD2 4.37Å; F285-F289 AromaticContact CE2-CE2 3.53Å; F285-F289 HydrophobicContact CE2-CE2 3.53Å; F285-F289 HydrophobicContact CE2-CZ 4.41Å; F285-F289 HydrophobicContact CZ-CD2 4.23Å; F285-F289 AromaticContact CZ-CE2 3.51Å; F285-F289 HydrophobicContact CZ-CE2 3.51Å; F285-F289 HydrophobicContact CZ-CZ 4.35Å; F285-F289 WeakPolarHBondContact O-CD2 3.08Å; G286-F289 PolarHBondContact O-N 2.95Å; I287-F289 VanDerWaalsContact C-N 3.33Å; I287-F289 PolarHBondContact O-N 3.39Å; F289-G292 PolarHBondContact O-N 3.1Å; F289-S293 WeakPolarHBondContact O-CB 3.4Å; F289-S293 PolarHBondContact O-N 3.2Å; F289-S293 PolarHBondContact O-OG 2.8Å |
| 290 | L | 74.3 | Confident | 76.8 | Confident | 6 Ų | 6 | 40.8 Ų | 40.8 | 3% | 0.031 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.2 | -45.8 | 179.9 | -172 | 150.2 | 0 | 0 | 0 | 111.7 | L99 G286 I287 S293 K294 S460 L463 | L99-L290 HydrophobicContact CD1-CD1 4.09Å; L99-L290 HydrophobicContact CD2-CD1 3.93Å; L99-L290 HydrophobicContact CG-CD1 3.86Å; G286-L290 VanDerWaalsContact O-CB 3.24Å; G286-L290 WeakPolarHBondContact O-CB 3.48Å; G286-L290 PolarHBondContact O-N 2.95Å; I287-L290 PolarHBondContact O-N 3.04Å; L290-S293 PolarHBondContact O-OG 3.49Å; L290-K294 WeakPolarHBondContact O-CG 3.39Å; L290-K294 PolarHBondContact O-N 3.09Å; L290-S460 WeakPolarHBondContact CD2-O 3.46Å; L290-L463 HydrophobicContact CD1-CD1 4.25Å; L290-L463 HydrophobicContact CD2-CB 4.44Å |
| 291 | V | 74.2 | Confident | 76.7 | Confident | 9 Ų | 9 | 40.9 Ų | 40.9 | 6% | 0.055 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.2 | -47.4 | 173.5 | 174.9 | 0 | 0 | 0 | 0 | 110.4 | V72 I287 S293 K294 I295 A464 | V72-V291 HydrophobicContact CG2-CG1 3.79Å; I287-V291 HydrophobicContact CG2-CG2 3.74Å; I287-V291 WeakPolarHBondContact O-CB 3.35Å; I287-V291 VanDerWaalsContact O-CG2 3.23Å; I287-V291 WeakPolarHBondContact O-CG2 3.29Å; I287-V291 PolarHBondContact O-N 3.18Å; V291-S293 PolarHBondContact O-N 3.19Å; V291-K294 PolarHBondContact O-N 2.77Å; V291-I295 HydrophobicContact CG1-CD1 3.8Å; V291-I295 WeakPolarHBondContact O-CG1 3.46Å; V291-I295 PolarHBondContact O-N 2.84Å; V291-I295 VanDerWaalsContact O-N 3.1Å; V291-A464 HydrophobicContact CG2-CB 3.5Å; V291-A464 VanDerWaalsContact CG2-CB 3.5Å |
| 292 | G | 78.3 | Confident | 76.6 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57.1 | -47.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | G71 G75 M288 F289 K294 I295 V296 | G71-G292 WeakPolarHBondContact O-CA 3.26Å; G75-G292 WeakPolarHBondContact CA-O 3.2Å; M288-G292 PolarHBondContact O-N 2.99Å; F289-G292 PolarHBondContact O-N 3.1Å; G292-K294 VanDerWaalsContact C-N 3.33Å; G292-K294 PolarHBondContact O-N 2.91Å; G292-I295 PolarHBondContact O-N 3.27Å; G292-V296 WeakPolarHBondContact O-CG2 3.19Å; G292-V296 PolarHBondContact O-N 3.06Å |
| 293 | S | 76.3 | Confident | 76.2 | Confident | 12 Ų | 12 | 37.9 Ų | 37.9 | 8% | 0.084 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.9 | -37.4 | -178.9 | 58.2 | 0 | 0 | 0 | 0 | 112.2 | F289 L290 V291 V296 E297 | F289-S293 WeakPolarHBondContact O-CB 3.4Å; F289-S293 PolarHBondContact O-N 3.2Å; F289-S293 PolarHBondContact O-OG 2.8Å; L290-S293 PolarHBondContact O-OG 3.49Å; V291-S293 PolarHBondContact O-N 3.19Å; S293-V296 PolarHBondContact O-N 3.38Å; S293-E297 PolarHBondContact O-N 2.83Å |
| 294 | K | 70.9 | Confident | 76.1 | Confident | 35 Ų | 35 | 38.2 Ų | 38.2 | 15% | 0.152 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -69.5 | -33.8 | 178.7 | -73.4 | -56.2 | -170.5 | -176.8 | 0 | 113.5 | L290 V291 G292 V296 E297 M298 S460 L461 | L290-K294 WeakPolarHBondContact O-CG 3.39Å; L290-K294 PolarHBondContact O-N 3.09Å; V291-K294 PolarHBondContact O-N 2.77Å; G292-K294 VanDerWaalsContact C-N 3.33Å; G292-K294 PolarHBondContact O-N 2.91Å; K294-V296 VanDerWaalsContact C-N 3.27Å; K294-V296 PolarHBondContact O-N 3.31Å; K294-E297 VanDerWaalsContact CD-OE2 3.29Å; K294-E297 WeakPolarHBondContact CD-OE2 3.13Å; K294-E297 IonicContact NZ-OE2 3.89Å; K294-E297 PolarHBondContact NZ-OE2 3.37Å; K294-E297 PolarHBondContact O-N 3.2Å; K294-M298 WeakPolarHBondContact O-CB 3.47Å; K294-M298 VanDerWaalsContact O-CG 3.28Å; K294-M298 WeakPolarHBondContact O-CG 3.48Å; K294-M298 PolarHBondContact O-N 3.46Å; K294-S460 WeakPolarHBondContact CE-OG 3.37Å; K294-L461 HydrophobicContact CB-CD2 3.87Å; K294-L461 HydrophobicContact CD-CD2 4.15Å; K294-L461 HydrophobicContact CG-CD2 3.88Å |
| 295 | I | 76.3 | Confident | 75.9 | Confident | 11 Ų | 11 | 41.7 Ų | 41.7 | 6% | 0.056 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -66.5 | -32.4 | 174.1 | -72.9 | 165.7 | 0 | 0 | 0 | 112 | V72 M76 V291 G292 V301 | V72-I295 HydrophobicContact CB-CD1 3.96Å; V72-I295 HydrophobicContact CG1-CD1 4.08Å; V72-I295 HydrophobicContact CG2-CD1 3.74Å; M76-I295 HydrophobicContact CG-CG2 4.24Å; V291-I295 HydrophobicContact CG1-CD1 3.8Å; V291-I295 WeakPolarHBondContact O-CG1 3.46Å; V291-I295 PolarHBondContact O-N 2.84Å; V291-I295 VanDerWaalsContact O-N 3.1Å; G292-I295 PolarHBondContact O-N 3.27Å; I295-V301 HydrophobicContact CG2-CG2 4Å |
| 296 | V | 77.3 | Confident | 75.8 | Confident | 22 Ų | 22 | 40.1 Ų | 40.1 | 13% | 0.133 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -74.8 | -38.1 | 176.8 | -178.3 | 0 | 0 | 0 | 0 | 111.1 | G75 V78 R79 M88 G292 S293 K294 M298 | G75-V296 VanDerWaalsContact O-CG2 3.28Å; G75-V296 WeakPolarHBondContact O-CG2 3.23Å; V78-V296 HydrophobicContact CB-CG2 3.94Å; V78-V296 HydrophobicContact CG1-CG1 4.36Å; V78-V296 HydrophobicContact CG1-CG2 3.7Å; R79-V296 HydrophobicContact CB-CG2 4.33Å; M88-V296 HydrophobicContact CE-CB 4.49Å; M88-V296 HydrophobicContact CE-CG1 3.5Å; M88-V296 VanDerWaalsContact CE-CG1 3.5Å; M88-V296 HydrophobicContact SD-CG1 4.38Å; G292-V296 WeakPolarHBondContact O-CG2 3.19Å; G292-V296 PolarHBondContact O-N 3.06Å; S293-V296 PolarHBondContact O-N 3.38Å; K294-V296 VanDerWaalsContact C-N 3.27Å; K294-V296 PolarHBondContact O-N 3.31Å; V296-M298 VanDerWaalsContact C-N 3.3Å; V296-M298 PolarHBondContact O-N 3.44Å |
| 297 | E | 72.1 | Confident | 75.9 | Confident | 101 Ų | 101 | 40.2 Ų | 40.2 | 47% | 0.472 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -67.9 | -28.9 | 179.8 | -168.4 | 174.2 | -166.4 | 0 | 0 | 112.8 | M88 S293 K294 | M88-E297 HydrophobicContact SD-CB 4.46Å; S293-E297 PolarHBondContact O-N 2.83Å; K294-E297 VanDerWaalsContact CD-OE2 3.29Å; K294-E297 WeakPolarHBondContact CD-OE2 3.13Å; K294-E297 IonicContact NZ-OE2 3.89Å; K294-E297 PolarHBondContact NZ-OE2 3.37Å; K294-E297 PolarHBondContact O-N 3.2Å |
| 298 | M | 66.4 | Low | 76.3 | Confident | 10 Ų | 10 | 40.7 Ų | 40.7 | 5% | 0.049 | 22% | 0.218 | C | C | . | . | trans | -88.9 | 127.3 | -173.5 | -74.5 | -107.3 | 164 | 0 | 0 | 113.7 | R79 L164 K294 V296 L304 L461 | R79-M298 PolarHBondContact NH1-O 3.13Å; L164-M298 HydrophobicContact CB-CE 4.44Å; L164-M298 HydrophobicContact CB-SD 3.81Å; L164-M298 HydrophobicContact CD1-SD 3.86Å; L164-M298 HydrophobicContact CG-SD 4.46Å; K294-M298 WeakPolarHBondContact O-CB 3.47Å; K294-M298 VanDerWaalsContact O-CG 3.28Å; K294-M298 WeakPolarHBondContact O-CG 3.48Å; K294-M298 PolarHBondContact O-N 3.46Å; V296-M298 VanDerWaalsContact C-N 3.3Å; V296-M298 PolarHBondContact O-N 3.44Å; M298-L304 HydrophobicContact CB-CD1 4.49Å; M298-L304 HydrophobicContact CE-CD1 3.77Å; M298-L304 HydrophobicContact CG-CD1 3.69Å; M298-L304 HydrophobicContact SD-CB 4.21Å; M298-L304 HydrophobicContact SD-CD1 3.23Å; M298-L304 WeakPolarHBondContact SD-CD1 3.12Å; M298-L304 HydrophobicContact SD-CG 4.33Å; M298-L461 HydrophobicContact CE-CD1 4.04Å | ||
| 299 | E | 65.8 | Low | 76.5 | Confident | 126 Ų | 126 | 40.9 Ų | 40.9 | 59% | 0.589 | 23% | 0.228 | S | C | * | . | S | Bend | trans | -70.3 | -31.2 | -179.8 | -65.2 | -169.7 | 166.9 | 0 | 0 | 113.7 | R79 | R79-E299 PolarHBondContact NH2-O 3.11Š|
| 300 | D | 71.7 | Confident | 76.8 | Confident | 67 Ų | 67 | 43 Ų | 43 | 36% | 0.358 | 24% | 0.237 | S | C | . | . | trans | -126.8 | 103.5 | 176.9 | -168.7 | -14.8 | 0 | 0 | 0 | 112 | L164 V302 L303 L304 | L164-D300 HydrophobicContact CD2-CB 3.56Å; D300-V302 VanDerWaalsContact C-N 3.35Å; D300-V302 WeakPolarHBondContact OD1-CB 3.32Å; D300-V302 PolarHBondContact OD1-N 3.32Å; D300-L303 HydrophobicContact CB-CB 4.08Å; D300-L303 PolarHBondContact OD1-N 3.02Å; D300-L304 PolarHBondContact O-N 3.06Å | ||
| 301 | V | 72.3 | Confident | 77.5 | Confident | 34 Ų | 34 | 42.7 Ų | 42.7 | 21% | 0.206 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -70.6 | -31.9 | 179 | 169.5 | 0 | 0 | 0 | 0 | 111.7 | I295 L303 L304 V305 | I295-V301 HydrophobicContact CG2-CG2 4Å; V301-L303 VanDerWaalsContact C-N 3.35Å; V301-L304 PolarHBondContact O-N 2.77Å; V301-V305 HydrophobicContact CG1-CG2 4.13Å; V301-V305 WeakPolarHBondContact O-CB 3.44Å; V301-V305 VanDerWaalsContact O-CG2 3.25Å; V301-V305 WeakPolarHBondContact O-CG2 3.33Å; V301-V305 PolarHBondContact O-N 3.36Å |
| 302 | V | 78.1 | Confident | 78.3 | Confident | 106 Ų | 106 | 43.9 Ų | 43.9 | 64% | 0.642 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -68.3 | -42.1 | -177.7 | 179.6 | 0 | 0 | 0 | 0 | 109.6 | D300 T306 | D300-V302 VanDerWaalsContact C-N 3.35Å; D300-V302 WeakPolarHBondContact OD1-CB 3.32Å; D300-V302 PolarHBondContact OD1-N 3.32Å; V302-T306 WeakPolarHBondContact O-CB 3.34Å; V302-T306 PolarHBondContact O-N 3.05Å; V302-T306 PolarHBondContact O-OG1 3.49Å |
| 303 | L | 75.8 | Confident | 79.1 | Confident | 49 Ų | 49 | 49.8 Ų | 49.8 | 26% | 0.257 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -66.1 | -43.1 | 177.4 | -172.5 | 58.4 | 0 | 0 | 0 | 111.9 | G160 L164 D300 V301 T306 S307 | G160-L303 WeakPolarHBondContact O-CD2 3.35Å; L164-L303 HydrophobicContact CD1-CB 4.05Å; L164-L303 HydrophobicContact CD1-CD2 3.92Å; L164-L303 HydrophobicContact CD1-CG 3.98Å; L164-L303 HydrophobicContact CD2-CD2 3.87Å; L164-L303 HydrophobicContact CG-CD2 3.93Å; D300-L303 HydrophobicContact CB-CB 4.08Å; D300-L303 PolarHBondContact OD1-N 3.02Å; V301-L303 VanDerWaalsContact C-N 3.35Å; L303-T306 PolarHBondContact O-N 3.21Å; L303-S307 PolarHBondContact O-N 3.28Å |
| 304 | L | 74.9 | Confident | 79.9 | Confident | 19 Ų | 19 | 49.2 Ų | 49.2 | 10% | 0.099 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.9 | -48.4 | 175.2 | 175.5 | 133.3 | 0 | 0 | 0 | 112.2 | L164 M298 D300 V301 T306 S307 L308 L461 | L164-L304 HydrophobicContact CD1-CB 4.34Å; M298-L304 HydrophobicContact CB-CD1 4.49Å; M298-L304 HydrophobicContact CE-CD1 3.77Å; M298-L304 HydrophobicContact CG-CD1 3.69Å; M298-L304 HydrophobicContact SD-CB 4.21Å; M298-L304 HydrophobicContact SD-CD1 3.23Å; M298-L304 WeakPolarHBondContact SD-CD1 3.12Å; M298-L304 HydrophobicContact SD-CG 4.33Å; D300-L304 PolarHBondContact O-N 3.06Å; V301-L304 PolarHBondContact O-N 2.77Å; L304-T306 VanDerWaalsContact C-N 3.26Å; L304-T306 PolarHBondContact O-N 3.12Å; L304-S307 PolarHBondContact O-N 3.02Å; L304-L308 HydrophobicContact CD2-CD1 3.61Å; L304-L308 HydrophobicContact CG-CD1 3.98Å; L304-L308 HydrophobicContact CG-CG 4.43Å; L304-L308 WeakPolarHBondContact O-CB 3.48Å; L304-L308 WeakPolarHBondContact O-CG 3.48Å; L304-L308 PolarHBondContact O-N 3.15Å; L304-L461 HydrophobicContact CD1-CD2 3.91Å |
| 305 | V | 78.6 | Confident | 81 | Confident | 88 Ų | 88 | 47.6 Ų | 47.6 | 53% | 0.533 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.6 | -38.3 | 178.1 | 170.8 | 0 | 0 | 0 | 0 | 110.7 | V301 G309 | V301-V305 HydrophobicContact CG1-CG2 4.13Å; V301-V305 WeakPolarHBondContact O-CB 3.44Å; V301-V305 VanDerWaalsContact O-CG2 3.25Å; V301-V305 WeakPolarHBondContact O-CG2 3.33Å; V301-V305 PolarHBondContact O-N 3.36Å; V305-G309 PolarHBondContact O-N 3.35Å |
| 306 | T | 83.8 | Confident | 81.9 | Confident | 67 Ų | 67 | 49.2 Ų | 49.2 | 41% | 0.411 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -64.9 | -45.7 | 176.5 | -58.2 | 0 | 0 | 0 | 0 | 111.6 | V302 L303 L304 G309 K310 | V302-T306 WeakPolarHBondContact O-CB 3.34Å; V302-T306 PolarHBondContact O-N 3.05Å; V302-T306 PolarHBondContact O-OG1 3.49Å; L303-T306 PolarHBondContact O-N 3.21Å; L304-T306 VanDerWaalsContact C-N 3.26Å; L304-T306 PolarHBondContact O-N 3.12Å; T306-G309 PolarHBondContact O-N 3.32Å; T306-K310 WeakPolarHBondContact O-CG 3.47Å; T306-K310 PolarHBondContact O-N 3.01Å |
| 307 | S | 84.1 | Confident | 82.8 | Confident | 3 Ų | 3 | 50.7 Ų | 50.7 | 2% | 0.021 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -66.7 | -42.2 | 178.2 | -87.9 | 0 | 0 | 0 | 0 | 112.9 | P157 A161 L303 L304 G309 K310 Y311 | P157-S307 WeakPolarHBondContact O-CB 3.2Å; P157-S307 PolarHBondContact O-OG 3.1Å; A161-S307 WeakPolarHBondContact CB-OG 3.49Å; L303-S307 PolarHBondContact O-N 3.28Å; L304-S307 PolarHBondContact O-N 3.02Å; S307-G309 VanDerWaalsContact C-N 3.32Å; S307-G309 PolarHBondContact O-N 3.43Å; S307-K310 PolarHBondContact O-N 2.78Å; S307-Y311 PolarHBondContact O-N 3.31Å |
| 308 | L | 83.8 | Confident | 84 | Confident | 17 Ų | 17 | 45.9 Ų | 45.9 | 9% | 0.089 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64 | -37.6 | 172.4 | -73.4 | 176.2 | 0 | 0 | 0 | 111.8 | L304 Y311 I312 F406 V465 | L304-L308 HydrophobicContact CD2-CD1 3.61Å; L304-L308 HydrophobicContact CG-CD1 3.98Å; L304-L308 HydrophobicContact CG-CG 4.43Å; L304-L308 WeakPolarHBondContact O-CB 3.48Å; L304-L308 WeakPolarHBondContact O-CG 3.48Å; L304-L308 PolarHBondContact O-N 3.15Å; L308-Y311 WeakPolarHBondContact O-CB 3.41Å; L308-Y311 PolarHBondContact O-N 2.9Å; L308-I312 VanDerWaalsContact O-CG1 3.32Å; L308-I312 WeakPolarHBondContact O-CG1 3.32Å; L308-I312 PolarHBondContact O-N 3.23Å; L308-F406 HydrophobicContact CD2-CE1 4.25Å; L308-F406 HydrophobicContact CD2-CZ 4.01Å; L308-V465 HydrophobicContact CB-CG1 4.28Å; L308-V465 HydrophobicContact CD1-CG1 4.09Å; L308-V465 HydrophobicContact CD2-CG1 4.28Å; L308-V465 HydrophobicContact CD2-CG2 4.2Å; L308-V465 HydrophobicContact CG-CG1 4.46Å |
| 309 | G | 87.4 | Confident | 85.4 | Confident | 37 Ų | 37 | 45.7 Ų | 45.7 | 38% | 0.381 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -61.5 | -44.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | V305 T306 S307 Y311 I312 F313 | V305-G309 PolarHBondContact O-N 3.35Å; T306-G309 PolarHBondContact O-N 3.32Å; S307-G309 VanDerWaalsContact C-N 3.32Å; S307-G309 PolarHBondContact O-N 3.43Å; G309-Y311 VanDerWaalsContact C-N 3.31Å; G309-Y311 PolarHBondContact O-N 3.31Å; G309-I312 PolarHBondContact O-N 3.31Å; G309-F313 VanDerWaalsContact O-CB 3.31Å; G309-F313 WeakPolarHBondContact O-CB 3.08Å; G309-F313 PolarHBondContact O-N 2.85Å |
| 310 | K | 90.4 | Very high | 86.8 | Confident | 83 Ų | 83 | 44.5 Ų | 44.5 | 36% | 0.361 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62 | -39.2 | 173.4 | -71 | 176.1 | -176.1 | 175.3 | 0 | 112 | I155 P157 T306 S307 F313 A314 | I155-K310 HydrophobicContact CG2-CB 4.42Å; P157-K310 HydrophobicContact CB-CB 3.77Å; T306-K310 WeakPolarHBondContact O-CG 3.47Å; T306-K310 PolarHBondContact O-N 3.01Å; S307-K310 PolarHBondContact O-N 2.78Å; K310-F313 PolarHBondContact O-N 3.44Å; K310-A314 WeakPolarHBondContact O-CB 3.47Å; K310-A314 PolarHBondContact O-N 3.25Å |
| 311 | Y | 90.4 | Very high | 88 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.2 | -52.7 | 175.8 | 164.6 | -99.6 | 0 | 0 | 0 | 111.6 | S307 L308 G309 F313 A314 S315 F399 I402 A403 F406 M462 V465 V469 | S307-Y311 PolarHBondContact O-N 3.31Å; L308-Y311 WeakPolarHBondContact O-CB 3.41Å; L308-Y311 PolarHBondContact O-N 2.9Å; G309-Y311 VanDerWaalsContact C-N 3.31Å; G309-Y311 PolarHBondContact O-N 3.31Å; Y311-F313 VanDerWaalsContact C-N 3.27Å; Y311-F313 PolarHBondContact O-N 3.04Å; Y311-A314 WeakPolarHBondContact O-CB 3.37Å; Y311-A314 PolarHBondContact O-N 3.24Å; Y311-A314 VanDerWaalsContact O-N 3.12Å; Y311-S315 PolarHBondContact O-N 3.34Å; Y311-S315 PolarHBondContact O-OG 3.38Å; Y311-F399 VanDerWaalsContact OH-CD2 3.28Å; Y311-F399 WeakPolarHBondContact OH-CD2 3.4Å; Y311-F399 WeakPolarHBondContact OH-CE2 3.23Å; Y311-I402 HydrophobicContact CD2-CG2 3.8Å; Y311-I402 HydrophobicContact CE2-CG2 3.87Å; Y311-A403 HydrophobicContact CE2-CB 4.18Å; Y311-F406 HydrophobicContact CD2-CB 4.05Å; Y311-F406 HydrophobicContact CD2-CD1 4.25Å; Y311-F406 HydrophobicContact CD2-CD2 4.43Å; Y311-F406 AromaticContact CD2-CG 4Å; Y311-F406 HydrophobicContact CD2-CG 4Å; Y311-F406 HydrophobicContact CG-CG 4.44Å; Y311-M462 HydrophobicContact CE2-CE 4.2Å; Y311-V465 HydrophobicContact CD1-CG2 3.99Å; Y311-V465 HydrophobicContact CE1-CG2 3.78Å; Y311-V469 HydrophobicContact CE1-CG2 4.49Å |
| 312 | I | 90.8 | Very high | 89.2 | Confident | 35 Ų | 35 | 42 Ų | 42 | 18% | 0.179 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -56.7 | -45.4 | 176.9 | -66.5 | 165 | 0 | 0 | 0 | 110.2 | L308 G309 A314 S315 I316 V465 I468 V469 | L308-I312 VanDerWaalsContact O-CG1 3.32Å; L308-I312 WeakPolarHBondContact O-CG1 3.32Å; L308-I312 PolarHBondContact O-N 3.23Å; G309-I312 PolarHBondContact O-N 3.31Å; I312-A314 PolarHBondContact O-N 3.44Å; I312-S315 PolarHBondContact O-N 3.41Å; I312-I316 HydrophobicContact CG2-CD1 3.66Å; I312-I316 HydrophobicContact CG2-CG1 4.34Å; I312-I316 WeakPolarHBondContact O-CG1 3.36Å; I312-I316 PolarHBondContact O-N 3.47Å; I312-V465 HydrophobicContact CD1-CB 3.88Å; I312-V465 HydrophobicContact CD1-CG1 3.92Å; I312-V465 HydrophobicContact CG1-CB 4.06Å; I312-V465 HydrophobicContact CG1-CG2 4.45Å; I312-I468 HydrophobicContact CD1-CG2 4.16Å; I312-I468 HydrophobicContact CG1-CG2 4.3Å; I312-I468 HydrophobicContact CG2-CG2 4.04Å; I312-V469 HydrophobicContact CG1-CG2 4.21Å; I312-V469 HydrophobicContact CG2-CG2 4.37Å |
| 313 | F | 93.6 | Very high | 90 | Very high | 124 Ų | 124 | 37 Ų | 37 | 54% | 0.544 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -59.9 | -46.3 | 177.4 | 176.1 | -101 | 0 | 0 | 0 | 112 | I155 G309 K310 Y311 S315 L317 | I155-F313 HydrophobicContact CD1-CD1 4.31Å; I155-F313 HydrophobicContact CD1-CE1 4.36Å; G309-F313 VanDerWaalsContact O-CB 3.31Å; G309-F313 WeakPolarHBondContact O-CB 3.08Å; G309-F313 PolarHBondContact O-N 2.85Å; K310-F313 PolarHBondContact O-N 3.44Å; Y311-F313 VanDerWaalsContact C-N 3.27Å; Y311-F313 PolarHBondContact O-N 3.04Å; F313-S315 PolarHBondContact O-N 3.47Å; F313-L317 HydrophobicContact CE1-CD2 4Å; F313-L317 HydrophobicContact CZ-CD2 4.14Å; F313-L317 WeakPolarHBondContact O-CB 3.47Å; F313-L317 PolarHBondContact O-N 2.95Å |
| 314 | A | 94.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.8 | -43.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I155 K310 Y311 I312 G318 I402 | I155-A314 HydrophobicContact CB-CB 4.46Å; I155-A314 HydrophobicContact CD1-CB 3.5Å; I155-A314 VanDerWaalsContact CD1-CB 3.5Å; I155-A314 HydrophobicContact CG2-CB 4.33Å; K310-A314 WeakPolarHBondContact O-CB 3.47Å; K310-A314 PolarHBondContact O-N 3.25Å; Y311-A314 WeakPolarHBondContact O-CB 3.37Å; Y311-A314 PolarHBondContact O-N 3.24Å; Y311-A314 VanDerWaalsContact O-N 3.12Å; I312-A314 PolarHBondContact O-N 3.44Å; A314-G318 PolarHBondContact O-N 3Å; A314-I402 HydrophobicContact CB-CG2 4.1Å |
| 315 | S | 93.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.4 | -50.9 | 178.5 | -61.7 | 0 | 0 | 0 | 0 | 112.3 | Y311 I312 F313 L317 G318 H319 | Y311-S315 PolarHBondContact O-N 3.34Å; Y311-S315 PolarHBondContact O-OG 3.38Å; I312-S315 PolarHBondContact O-N 3.41Å; F313-S315 PolarHBondContact O-N 3.47Å; S315-L317 VanDerWaalsContact C-N 3.31Å; S315-L317 PolarHBondContact O-N 3.42Å; S315-G318 PolarHBondContact O-N 3.02Å; S315-G318 VanDerWaalsContact O-N 3.16Å; S315-H319 VanDerWaalsContact O-CG 3.29Å; S315-H319 PolarHBondContact O-N 3.37Å; S315-H319 PolarHBondContact O-ND1 3.48Å |
| 316 | I | 94.5 | Very high | 92.8 | Very high | 46 Ų | 46 | 37.3 Ų | 37.3 | 24% | 0.236 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.7 | -40.6 | 178.7 | -66.9 | 174.6 | 0 | 0 | 0 | 110.6 | I312 G318 H319 I320 T472 | I312-I316 HydrophobicContact CG2-CD1 3.66Å; I312-I316 HydrophobicContact CG2-CG1 4.34Å; I312-I316 WeakPolarHBondContact O-CG1 3.36Å; I312-I316 PolarHBondContact O-N 3.47Å; I316-G318 VanDerWaalsContact C-N 3.34Å; I316-G318 PolarHBondContact O-N 3.33Å; I316-H319 PolarHBondContact O-N 2.92Å; I316-I320 HydrophobicContact CG2-CD1 3.78Å; I316-I320 HydrophobicContact CG2-CG1 4.38Å; I316-I320 VanDerWaalsContact O-CG1 3.29Å; I316-I320 WeakPolarHBondContact O-CG1 3.33Å; I316-I320 PolarHBondContact O-N 3.42Å; I316-T472 HydrophobicContact CG1-CG2 4.47Å |
| 317 | L | 96.3 | Very high | 93.3 | Very high | 53 Ų | 53 | 34.1 Ų | 34.1 | 28% | 0.277 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -62.6 | -41.8 | 176 | -177.8 | 62.4 | 0 | 0 | 0 | 111.5 | L151 I155 F313 S315 I320 I321 | L151-L317 HydrophobicContact CD2-CD2 4.35Å; I155-L317 HydrophobicContact CD1-CD2 4.2Å; F313-L317 HydrophobicContact CE1-CD2 4Å; F313-L317 HydrophobicContact CZ-CD2 4.14Å; F313-L317 WeakPolarHBondContact O-CB 3.47Å; F313-L317 PolarHBondContact O-N 2.95Å; S315-L317 VanDerWaalsContact C-N 3.31Å; S315-L317 PolarHBondContact O-N 3.42Å; L317-I320 PolarHBondContact O-N 3.12Å; L317-I321 HydrophobicContact CD1-CD1 4.03Å; L317-I321 HydrophobicContact CD1-CG1 4.28Å; L317-I321 HydrophobicContact CD2-CD1 4.49Å; L317-I321 HydrophobicContact CG-CD1 3.83Å; L317-I321 HydrophobicContact CG-CG1 4.46Å; L317-I321 WeakPolarHBondContact O-CB 3.18Å; L317-I321 VanDerWaalsContact O-CG1 3.27Å; L317-I321 WeakPolarHBondContact O-CG1 3.45Å; L317-I321 PolarHBondContact O-N 3.09Å |
| 318 | G | 96.5 | Very high | 93.9 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.8 | -44.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A314 S315 I316 I321 H322 | A314-G318 PolarHBondContact O-N 3Å; S315-G318 PolarHBondContact O-N 3.02Å; S315-G318 VanDerWaalsContact O-N 3.16Å; I316-G318 VanDerWaalsContact C-N 3.34Å; I316-G318 PolarHBondContact O-N 3.33Å; G318-I321 PolarHBondContact O-N 3.17Å; G318-H322 WeakPolarHBondContact O-CB 3.28Å; G318-H322 PolarHBondContact O-N 3.5Å |
| 319 | H | 96 | Very high | 94.5 | Very high | 5 Ų | 5 | 38.7 Ų | 38.7 | 2% | 0.023 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.1 | -43.8 | 174.6 | -64.6 | 150.5 | 0 | 0 | 0 | 112.2 | S315 I316 G323 G395 T472 T473 V476 | S315-H319 VanDerWaalsContact O-CG 3.29Å; S315-H319 PolarHBondContact O-N 3.37Å; S315-H319 PolarHBondContact O-ND1 3.48Å; I316-H319 PolarHBondContact O-N 2.92Å; H319-G323 PolarHBondContact O-N 3.31Å; H319-G395 PolarHBondContact NE2-O 3.43Å; H319-G395 VanDerWaalsContact NE2-O 3.09Å; H319-T472 PolarHBondContact CE1-OG1 2.97Å; H319-T472 WeakPolarHBondContact ND1-CB 3.34Å; H319-T472 PolarHBondContact ND1-OG1 3.36Å; H319-T473 PolarHBondContact CE1-N 2.76Å; H319-T473 PolarHBondContact CE1-OG1 3.38Å; H319-T473 PolarHBondContact NE2-OG1 3.2Å; H319-V476 HydrophobicContact CB-CG2 3.74Å |
| 320 | I | 96.3 | Very high | 94.9 | Very high | 102 Ų | 102 | 38 Ų | 38 | 52% | 0.523 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -65.6 | -41.8 | 177.4 | -69.3 | 168.3 | 0 | 0 | 0 | 111.4 | I316 L317 G324 | I316-I320 HydrophobicContact CG2-CD1 3.78Å; I316-I320 HydrophobicContact CG2-CG1 4.38Å; I316-I320 VanDerWaalsContact O-CG1 3.29Å; I316-I320 WeakPolarHBondContact O-CG1 3.33Å; I316-I320 PolarHBondContact O-N 3.42Å; L317-I320 PolarHBondContact O-N 3.12Å; I320-G324 WeakPolarHBondContact O-CA 3.27Å; I320-G324 PolarHBondContact O-N 3.28Å |
| 321 | I | 97.3 | Very high | 95.2 | Very high | 48 Ų | 48 | 34.8 Ų | 34.8 | 25% | 0.246 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -65.8 | -47.1 | 178.6 | -71 | 168.6 | 0 | 0 | 0 | 110.1 | I147 L151 L317 G318 I325 V326 | I147-I321 HydrophobicContact CG2-CG2 4.35Å; L151-I321 HydrophobicContact CD1-CD1 4.13Å; L151-I321 HydrophobicContact CD2-CD1 4.1Å; L317-I321 HydrophobicContact CD1-CD1 4.03Å; L317-I321 HydrophobicContact CD1-CG1 4.28Å; L317-I321 HydrophobicContact CD2-CD1 4.49Å; L317-I321 HydrophobicContact CG-CD1 3.83Å; L317-I321 HydrophobicContact CG-CG1 4.46Å; L317-I321 WeakPolarHBondContact O-CB 3.18Å; L317-I321 VanDerWaalsContact O-CG1 3.27Å; L317-I321 WeakPolarHBondContact O-CG1 3.45Å; L317-I321 PolarHBondContact O-N 3.09Å; G318-I321 PolarHBondContact O-N 3.17Å; I321-I325 WeakPolarHBondContact O-CA 3.29Å; I321-I325 VanDerWaalsContact O-CB 3.26Å; I321-I325 WeakPolarHBondContact O-CB 3.46Å; I321-I325 PolarHBondContact O-N 3.36Å; I321-I325 VanDerWaalsContact O-N 3.08Å; I321-V326 HydrophobicContact CG2-CG2 4.43Å; I321-V326 PolarHBondContact O-N 3.44Å; I321-V326 VanDerWaalsContact O-N 3.08Å |
| 322 | H | 97.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 21% | 0.205 | C | C | . | . | I | π-helix | trans | -70 | -53.5 | -177.9 | -171.1 | 71.1 | 0 | 0 | 0 | 112.2 | I147 G318 V326 L327 D394 I398 | I147-H322 HydrophobicContact CD1-CB 4.34Å; G318-H322 WeakPolarHBondContact O-CB 3.28Å; G318-H322 PolarHBondContact O-N 3.5Å; H322-V326 WeakPolarHBondContact O-CB 3.42Å; H322-V326 PolarHBondContact O-N 2.89Å; H322-V326 VanDerWaalsContact O-N 3.17Å; H322-L327 PolarHBondContact O-N 2.94Å; H322-D394 IonicContact CD2-OD2 4Å; H322-D394 IonicContact CE1-OD2 3.1Å; H322-D394 WeakPolarHBondContact NE2-CB 3.36Å; H322-D394 VanDerWaalsContact NE2-CG 3.3Å; H322-D394 IonicContact NE2-OD2 3.5Å; H322-D394 PolarHBondContact NE2-OD2 3.38Å; H322-I398 HydrophobicContact CB-CD1 3.49Å; H322-I398 VanDerWaalsContact CB-CD1 3.49Å |
| 323 | G | 94.6 | Very high | 95.7 | Very high | 2 Ų | 2 | 40.5 Ų | 40.5 | 2% | 0.021 | 22% | 0.218 | C | C | . | . | I | π-helix | trans | -70.7 | -40.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | H319 P328 E479 | H319-G323 PolarHBondContact O-N 3.31Å; G323-P328 WeakPolarHBondContact O-CD 3.28Å; G323-P328 VanDerWaalsContact O-CG 3.22Å; G323-P328 WeakPolarHBondContact O-CG 3.47Å; G323-E479 VanDerWaalsContact CA-OE2 3.27Å; G323-E479 WeakPolarHBondContact CA-OE2 3.15Å |
| 324 | G | 94.3 | Very high | 95.6 | Very high | 33 Ų | 33 | 40.3 Ų | 40.3 | 34% | 0.34 | 22% | 0.218 | S | C | . | . | I | π-helix | trans | -84.6 | -23.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | I320 | I320-G324 WeakPolarHBondContact O-CA 3.27Å; I320-G324 PolarHBondContact O-N 3.28Å |
| 325 | I | 95.8 | Very high | 95.6 | Very high | 100 Ų | 100 | 40.5 Ų | 40.5 | 51% | 0.513 | 22% | 0.219 | S | C | . | . | I | π-helix | trans | -123 | -57 | -174.6 | -51.5 | 176.2 | 0 | 0 | 0 | 111.2 | I321 L329 | I321-I325 WeakPolarHBondContact O-CA 3.29Å; I321-I325 VanDerWaalsContact O-CB 3.26Å; I321-I325 WeakPolarHBondContact O-CB 3.46Å; I321-I325 PolarHBondContact O-N 3.36Å; I321-I325 VanDerWaalsContact O-N 3.08Å; I325-L329 WeakPolarHBondContact O-CB 3.23Å; I325-L329 PolarHBondContact O-N 3.49Å |
| 326 | V | 97.1 | Very high | 95.6 | Very high | 29 Ų | 29 | 49.7 Ų | 49.7 | 18% | 0.176 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -69.4 | -52.9 | -169.3 | 177.5 | 0 | 0 | 0 | 0 | 111.9 | I143 I147 I321 H322 L329 I330 | I143-V326 HydrophobicContact CG2-CG1 3.83Å; I147-V326 HydrophobicContact CD1-CG2 3.79Å; I321-V326 HydrophobicContact CG2-CG2 4.43Å; I321-V326 PolarHBondContact O-N 3.44Å; I321-V326 VanDerWaalsContact O-N 3.08Å; H322-V326 WeakPolarHBondContact O-CB 3.42Å; H322-V326 PolarHBondContact O-N 2.89Å; H322-V326 VanDerWaalsContact O-N 3.17Å; V326-L329 PolarHBondContact O-N 2.85Å; V326-I330 HydrophobicContact CG1-CD1 3.92Å; V326-I330 WeakPolarHBondContact O-CG1 3.33Å; V326-I330 PolarHBondContact O-N 3.31Å |
| 327 | L | 96.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 179 | -70.8 | 178.1 | 0 | 0 | 0 | 112.3 | T140 H322 L329 I330 Y331 E479 L483 | T140-L327 HydrophobicContact CG2-CD2 3.84Å; H322-L327 PolarHBondContact O-N 2.94Å; L327-L329 VanDerWaalsContact C-N 3.32Å; L327-L329 PolarHBondContact O-N 2.8Å; L327-I330 PolarHBondContact O-N 3.39Å; L327-Y331 PolarHBondContact O-N 3.22Å; L327-E479 HydrophobicContact CD1-CG 4.36Å; L327-L483 HydrophobicContact CB-CD1 3.63Å |
| 328 | P | 96.1 | Very high | 95.3 | Very high | 4 Ų | 4 | 55 Ų | 55 | 3% | 0.026 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -58.7 | -38.4 | 171.5 | -31.9 | 38.7 | 0 | 0 | 0 | 113.8 | G323 Y331 F332 P339 F340 L343 | G323-P328 WeakPolarHBondContact O-CD 3.28Å; G323-P328 VanDerWaalsContact O-CG 3.22Å; G323-P328 WeakPolarHBondContact O-CG 3.47Å; P328-Y331 PolarHBondContact O-N 3.4Å; P328-F332 WeakPolarHBondContact O-CB 3.42Å; P328-F332 PolarHBondContact O-N 3.4Å; P328-P339 HydrophobicContact CB-CB 3.8Å; P328-P339 HydrophobicContact CB-CG 3.68Å; P328-F340 HydrophobicContact CB-CZ 4.44Å; P328-L343 HydrophobicContact CG-CD1 4.19Å |
| 329 | L | 96.2 | Very high | 95.2 | Very high | 111 Ų | 111 | 55.5 Ų | 55.5 | 58% | 0.581 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -68 | -41.2 | 177.9 | -175.1 | 147.2 | 0 | 0 | 0 | 111.4 | I325 V326 L327 F332 A333 | I325-L329 WeakPolarHBondContact O-CB 3.23Å; I325-L329 PolarHBondContact O-N 3.49Å; V326-L329 PolarHBondContact O-N 2.85Å; L327-L329 VanDerWaalsContact C-N 3.32Å; L327-L329 PolarHBondContact O-N 2.8Å; L329-F332 PolarHBondContact O-N 3.45Å; L329-A333 WeakPolarHBondContact O-CB 3.44Å; L329-A333 PolarHBondContact O-N 3.28Å |
| 330 | I | 95.6 | Very high | 95.1 | Very high | 24 Ų | 24 | 61.1 Ų | 61.1 | 12% | 0.123 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -60.7 | -48.3 | 172.5 | -67.6 | 168.9 | 0 | 0 | 0 | 109.7 | Y136 T140 I143 V326 L327 F332 A333 F334 I487 | Y136-I330 HydrophobicContact CE2-CG2 4.11Å; T140-I330 HydrophobicContact CG2-CD1 4.15Å; I143-I330 HydrophobicContact CD1-CD1 4.36Å; V326-I330 HydrophobicContact CG1-CD1 3.92Å; V326-I330 WeakPolarHBondContact O-CG1 3.33Å; V326-I330 PolarHBondContact O-N 3.31Å; L327-I330 PolarHBondContact O-N 3.39Å; I330-F332 VanDerWaalsContact C-N 3.34Å; I330-F332 PolarHBondContact O-N 3.09Å; I330-A333 PolarHBondContact O-N 3.02Å; I330-F334 HydrophobicContact CG2-CD2 3.95Å; I330-F334 HydrophobicContact CG2-CE2 3.98Å; I330-F334 VanDerWaalsContact O-CD2 3.31Å; I330-F334 WeakPolarHBondContact O-CD2 3.35Å; I330-F334 PolarHBondContact O-N 3.01Å; I330-I487 HydrophobicContact CG2-CD1 4.12Å |
| 331 | Y | 96.1 | Very high | 95 | Very high | 14 Ų | 14 | 60 Ų | 60 | 6% | 0.055 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -57.6 | -45.6 | 176.6 | -177.6 | -85.7 | 0 | 0 | 0 | 112.2 | L327 P328 F334 T335 K337 P339 F342 L483 I487 | L327-Y331 PolarHBondContact O-N 3.22Å; P328-Y331 PolarHBondContact O-N 3.4Å; Y331-F334 PolarHBondContact O-N 3.47Å; Y331-T335 HydrophobicContact CD1-CG2 4.37Å; Y331-T335 VanDerWaalsContact CD1-OG1 3.3Å; Y331-T335 WeakPolarHBondContact CD1-OG1 3.28Å; Y331-T335 HydrophobicContact CD2-CG2 4.17Å; Y331-T335 HydrophobicContact CE1-CG2 4.13Å; Y331-T335 WeakPolarHBondContact CE1-OG1 3.43Å; Y331-T335 HydrophobicContact CE2-CG2 3.89Å; Y331-T335 HydrophobicContact CG-CG2 4.39Å; Y331-T335 WeakPolarHBondContact O-CB 3.45Å; Y331-T335 WeakPolarHBondContact O-CG2 3.36Å; Y331-T335 PolarHBondContact O-N 2.82Å; Y331-T335 PolarHBondContact O-OG1 3.42Å; Y331-K337 HydrophobicContact CE1-CB 4.29Å; Y331-P339 HydrophobicContact CD1-CB 3.66Å; Y331-P339 HydrophobicContact CE1-CB 4.38Å; Y331-P339 HydrophobicContact CG-CB 4.21Å; Y331-F342 HydrophobicContact CE2-CD2 4.28Å; Y331-F342 HydrophobicContact CE2-CG 4.32Å; Y331-F342 WeakPolarHBondContact OH-CD2 3.25Å; Y331-L483 HydrophobicContact CD2-CB 4.35Å; Y331-L483 HydrophobicContact CD2-CD2 3.61Å; Y331-L483 HydrophobicContact CE2-CD2 4.21Å; Y331-L483 HydrophobicContact CG-CD2 3.93Å; Y331-I487 HydrophobicContact CD2-CD1 4.33Å; Y331-I487 HydrophobicContact CD2-CG1 3.73Å; Y331-I487 HydrophobicContact CE2-CG1 4.38Å; Y331-I487 HydrophobicContact CG-CG1 4.43Å |
| 332 | F | 96.4 | Very high | 94.8 | Very high | 100 Ų | 100 | 58.5 Ų | 58.5 | 44% | 0.439 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -65.2 | -39.3 | 177.9 | -179.8 | -102.2 | 0 | 0 | 0 | 112.1 | P328 L329 I330 F334 R336 K337 | P328-F332 WeakPolarHBondContact O-CB 3.42Å; P328-F332 PolarHBondContact O-N 3.4Å; L329-F332 PolarHBondContact O-N 3.45Å; I330-F332 VanDerWaalsContact C-N 3.34Å; I330-F332 PolarHBondContact O-N 3.09Å; F332-F334 VanDerWaalsContact C-N 3.34Å; F332-F334 PolarHBondContact O-N 3.45Å; F332-R336 WeakPolarHBondContact O-CA 3.24Å; F332-R336 PolarHBondContact O-N 3.33Å; F332-K337 WeakPolarHBondContact CD2-O 3.26Å |
| 333 | A | 95.1 | Very high | 94.6 | Very high | 56 Ų | 56 | 59.4 Ų | 59.4 | 46% | 0.463 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 179 | 0 | 0 | 0 | 0 | 0 | 112.1 | L329 I330 | L329-A333 WeakPolarHBondContact O-CB 3.44Å; L329-A333 PolarHBondContact O-N 3.28Å; I330-A333 PolarHBondContact O-N 3.02Å |
| 334 | F | 93.6 | Very high | 94.5 | Very high | 120 Ų | 120 | 62.6 Ų | 62.6 | 53% | 0.526 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -83.3 | -42.6 | -179.6 | -75.4 | -75.7 | 0 | 0 | 0 | 114 | I330 Y331 F332 I487 H490 | I330-F334 HydrophobicContact CG2-CD2 3.95Å; I330-F334 HydrophobicContact CG2-CE2 3.98Å; I330-F334 VanDerWaalsContact O-CD2 3.31Å; I330-F334 WeakPolarHBondContact O-CD2 3.35Å; I330-F334 PolarHBondContact O-N 3.01Å; Y331-F334 PolarHBondContact O-N 3.47Å; F332-F334 VanDerWaalsContact C-N 3.34Å; F332-F334 PolarHBondContact O-N 3.45Å; F334-I487 HydrophobicContact CB-CG2 3.99Å; F334-I487 HydrophobicContact CD2-CG2 4.45Å; F334-I487 HydrophobicContact CG-CG2 4.18Å; F334-H490 PolarHBondContact O-CD2 3.02Å |
| 335 | T | 93.1 | Very high | 94.1 | Very high | 4 Ų | 4 | 61.7 Ų | 61.7 | 3% | 0.025 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -95 | -18.4 | -172.1 | 69.4 | 0 | 0 | 0 | 0 | 114 | Y331 K337 I487 H490 | Y331-T335 HydrophobicContact CD1-CG2 4.37Å; Y331-T335 VanDerWaalsContact CD1-OG1 3.3Å; Y331-T335 WeakPolarHBondContact CD1-OG1 3.28Å; Y331-T335 HydrophobicContact CD2-CG2 4.17Å; Y331-T335 HydrophobicContact CE1-CG2 4.13Å; Y331-T335 WeakPolarHBondContact CE1-OG1 3.43Å; Y331-T335 HydrophobicContact CE2-CG2 3.89Å; Y331-T335 HydrophobicContact CG-CG2 4.39Å; Y331-T335 WeakPolarHBondContact O-CB 3.45Å; Y331-T335 WeakPolarHBondContact O-CG2 3.36Å; Y331-T335 PolarHBondContact O-N 2.82Å; Y331-T335 PolarHBondContact O-OG1 3.42Å; T335-K337 PolarHBondContact O-N 3.49Å; T335-K337 PolarHBondContact OG1-N 2.94Å; T335-I487 HydrophobicContact CG2-CG1 4.21Å; T335-H490 HydrophobicContact CG2-CB 3.86Å |
| 336 | R | 93.1 | Very high | 93.9 | Very high | 192 Ų | 192 | 57 Ų | 57 | 73% | 0.725 | 29% | 0.291 | S | S | * | . | trans | 51.7 | 20.8 | -170.8 | -59.4 | -65.7 | -170.5 | 135.7 | 3.2 | 113.9 | F332 | F332-R336 WeakPolarHBondContact O-CA 3.24Å; F332-R336 PolarHBondContact O-N 3.33Å | ||
| 337 | K | 91.8 | Very high | 93.5 | Very high | 114 Ų | 114 | 60.4 Ų | 60.4 | 50% | 0.496 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -107.8 | 157 | 176.8 | -70.4 | -179.4 | -178.2 | -177.1 | 0 | 110.5 | Y331 F332 T335 P339 | Y331-K337 HydrophobicContact CE1-CB 4.29Å; F332-K337 WeakPolarHBondContact CD2-O 3.26Å; T335-K337 PolarHBondContact O-N 3.49Å; T335-K337 PolarHBondContact OG1-N 2.94Å; K337-P339 VanDerWaalsContact O-CD 3.23Å; K337-P339 WeakPolarHBondContact O-CD 3.28Å |
| 338 | N | 93.9 | Very high | 92.7 | Very high | 98 Ų | 98 | 64.5 Ų | 64.5 | 52% | 0.524 | 33% | 0.333 | S | S | . | . | trans | -66.9 | 113.2 | 178.9 | -176.1 | -5.2 | 0 | 0 | 0 | 111.1 | F340 S341 | N338-F340 VanDerWaalsContact C-N 3.33Å; N338-F340 PolarHBondContact O-N 3.5Å; N338-F340 PolarHBondContact OD1-N 2.95Å; N338-S341 PolarHBondContact O-N 3.41Å | ||
| 339 | P | 94.3 | Very high | 92.1 | Very high | 9 Ų | 9 | 64.3 Ų | 64.3 | 6% | 0.058 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -66.1 | -33.2 | -178.7 | 26.5 | -34.6 | 0 | 0 | 0 | 112.7 | P328 Y331 K337 S341 F342 L343 | P328-P339 HydrophobicContact CB-CB 3.8Å; P328-P339 HydrophobicContact CB-CG 3.68Å; Y331-P339 HydrophobicContact CD1-CB 3.66Å; Y331-P339 HydrophobicContact CE1-CB 4.38Å; Y331-P339 HydrophobicContact CG-CB 4.21Å; K337-P339 VanDerWaalsContact O-CD 3.23Å; K337-P339 WeakPolarHBondContact O-CD 3.28Å; P339-S341 VanDerWaalsContact C-N 3.26Å; P339-S341 PolarHBondContact O-N 2.88Å; P339-F342 WeakPolarHBondContact O-CA 3.38Å; P339-F342 VanDerWaalsContact O-CB 3.28Å; P339-F342 WeakPolarHBondContact O-CB 3.24Å; P339-F342 PolarHBondContact O-N 3.31Å; P339-L343 WeakPolarHBondContact O-CG 3.31Å; P339-L343 PolarHBondContact O-N 3.31Å |
| 340 | F | 93.6 | Very high | 91.7 | Very high | 123 Ų | 123 | 60.5 Ų | 60.5 | 54% | 0.539 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -68.8 | -27.5 | -177 | -64.3 | -73.4 | 0 | 0 | 0 | 112.7 | P328 N338 F342 L343 S344 | P328-F340 HydrophobicContact CB-CZ 4.44Å; N338-F340 VanDerWaalsContact C-N 3.33Å; N338-F340 PolarHBondContact O-N 3.5Å; N338-F340 PolarHBondContact OD1-N 2.95Å; F340-F342 VanDerWaalsContact C-N 3.31Å; F340-L343 HydrophobicContact CD1-CD1 4.18Å; F340-L343 PolarHBondContact O-N 3.35Å; F340-S344 WeakPolarHBondContact O-CB 3.44Å; F340-S344 PolarHBondContact O-N 2.93Å |
| 341 | S | 93.1 | Very high | 90.7 | Very high | 79 Ų | 79 | 63.7 Ų | 63.7 | 55% | 0.552 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -65.1 | -39.6 | 170.5 | -169.4 | 0 | 0 | 0 | 0 | 110.9 | N338 P339 S344 | N338-S341 PolarHBondContact O-N 3.41Å; P339-S341 VanDerWaalsContact C-N 3.26Å; P339-S341 PolarHBondContact O-N 2.88Å; S341-S344 PolarHBondContact O-OG 2.94Å |
| 342 | F | 93.8 | Very high | 89.5 | Confident | 17 Ų | 17 | 65.1 Ų | 65.1 | 8% | 0.075 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -66.7 | -46.2 | 176.1 | -173 | -84.8 | 0 | 0 | 0 | 111 | Y331 P339 F340 S344 G345 L346 N374 V376 A482 L483 | Y331-F342 HydrophobicContact CE2-CD2 4.28Å; Y331-F342 HydrophobicContact CE2-CG 4.32Å; Y331-F342 WeakPolarHBondContact OH-CD2 3.25Å; P339-F342 WeakPolarHBondContact O-CA 3.38Å; P339-F342 VanDerWaalsContact O-CB 3.28Å; P339-F342 WeakPolarHBondContact O-CB 3.24Å; P339-F342 PolarHBondContact O-N 3.31Å; F340-F342 VanDerWaalsContact C-N 3.31Å; F342-S344 VanDerWaalsContact C-N 3.3Å; F342-S344 PolarHBondContact O-N 3.16Å; F342-G345 PolarHBondContact O-N 2.91Å; F342-L346 HydrophobicContact CD1-CD1 4.01Å; F342-L346 HydrophobicContact CE1-CD1 3.71Å; F342-N374 VanDerWaalsContact CD1-ND2 3.3Å; F342-N374 WeakPolarHBondContact CD1-ND2 3.47Å; F342-N374 HydrophobicContact CD2-CB 3.95Å; F342-N374 WeakPolarHBondContact CD2-ND2 3.32Å; F342-N374 WeakPolarHBondContact CE1-ND2 3.43Å; F342-N374 HydrophobicContact CE2-CB 3.64Å; F342-N374 WeakPolarHBondContact CE2-ND2 3.45Å; F342-N374 WeakPolarHBondContact CG-ND2 3.4Å; F342-N374 HydrophobicContact CZ-CB 4.24Å; F342-N374 VanDerWaalsContact CZ-ND2 3.35Å; F342-N374 WeakPolarHBondContact CZ-ND2 3.46Å; F342-N374 PolarHBondContact O-ND2 3.49Å; F342-V376 HydrophobicContact CE2-CG2 4.05Å; F342-V376 HydrophobicContact CZ-CG2 4.39Å; F342-A482 HydrophobicContact CE1-CB 4.28Å; F342-A482 WeakPolarHBondContact CE1-O 3.17Å; F342-A482 VanDerWaalsContact CZ-O 3.28Å; F342-A482 WeakPolarHBondContact CZ-O 3.33Å; F342-L483 HydrophobicContact CD1-CD2 3.73Å; F342-L483 HydrophobicContact CE1-CD2 4.11Å |
| 343 | L | 93.3 | Very high | 88.6 | Confident | 19 Ų | 19 | 60.3 Ų | 60.3 | 10% | 0.099 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -63.1 | -34 | 178.1 | -66.5 | 174.9 | 0 | 0 | 0 | 112.9 | P328 P339 F340 G345 L346 F350 E479 L483 | P328-L343 HydrophobicContact CG-CD1 4.19Å; P339-L343 WeakPolarHBondContact O-CG 3.31Å; P339-L343 PolarHBondContact O-N 3.31Å; F340-L343 HydrophobicContact CD1-CD1 4.18Å; F340-L343 PolarHBondContact O-N 3.35Å; L343-G345 PolarHBondContact O-N 3.36Å; L343-L346 PolarHBondContact O-N 2.88Å; L343-F350 HydrophobicContact CB-CE2 4.47Å; L343-F350 HydrophobicContact CD2-CE2 3.99Å; L343-F350 HydrophobicContact CD2-CZ 3.82Å; L343-E479 WeakPolarHBondContact CD1-OE1 3.2Å; L343-E479 HydrophobicContact CD2-CG 3.91Å; L343-E479 VanDerWaalsContact CD2-OE1 3.28Å; L343-E479 WeakPolarHBondContact CD2-OE1 3.47Å; L343-L483 HydrophobicContact CD2-CD1 4.28Å; L343-L483 HydrophobicContact CD2-CD2 4.08Å; L343-L483 HydrophobicContact CD2-CG 4.23Å |
| 344 | S | 91.5 | Very high | 87.9 | Confident | 69 Ų | 69 | 62.4 Ų | 62.4 | 48% | 0.483 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.8 | -29.1 | 177.8 | 75.5 | 0 | 0 | 0 | 0 | 113.3 | F340 S341 F342 L346 I347 | F340-S344 WeakPolarHBondContact O-CB 3.44Å; F340-S344 PolarHBondContact O-N 2.93Å; S341-S344 PolarHBondContact O-OG 2.94Å; F342-S344 VanDerWaalsContact C-N 3.3Å; F342-S344 PolarHBondContact O-N 3.16Å; S344-L346 PolarHBondContact O-N 3.48Å; S344-I347 WeakPolarHBondContact O-CD1 3.41Å; S344-I347 WeakPolarHBondContact O-CG1 3.14Å |
| 345 | G | 87.4 | Confident | 86.5 | Confident | 14 Ų | 14 | 58.7 Ų | 58.7 | 14% | 0.144 | 31% | 0.31 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.5 | -9.4 | 174 | 0 | 0 | 0 | 0 | 0 | 114.3 | F342 L343 N373 | F342-G345 PolarHBondContact O-N 2.91Å; L343-G345 PolarHBondContact O-N 3.36Å; G345-N373 PolarHBondContact O-ND2 3.23Å |
| 346 | L | 91.6 | Very high | 85.2 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 33% | 0.325 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -114.3 | 11.8 | -171.8 | -56 | 177.2 | 0 | 0 | 0 | 113.8 | F342 L343 S344 T348 P349 F350 M366 C369 V370 A482 | F342-L346 HydrophobicContact CD1-CD1 4.01Å; F342-L346 HydrophobicContact CE1-CD1 3.71Å; L343-L346 PolarHBondContact O-N 2.88Å; S344-L346 PolarHBondContact O-N 3.48Å; L346-T348 PolarHBondContact O-N 3.06Å; L346-P349 HydrophobicContact CB-CG 4.13Å; L346-P349 HydrophobicContact CD2-CG 4.36Å; L346-P349 WeakPolarHBondContact O-CD 3.16Å; L346-P349 WeakPolarHBondContact O-CG 3.16Å; L346-F350 HydrophobicContact CB-CD2 4.21Å; L346-F350 HydrophobicContact CB-CE1 4.15Å; L346-F350 HydrophobicContact CB-CE2 3.75Å; L346-F350 HydrophobicContact CB-CZ 3.72Å; L346-F350 HydrophobicContact CD1-CZ 4.01Å; L346-F350 WeakPolarHBondContact O-CD2 3.38Å; L346-F350 VanDerWaalsContact O-CG 3.23Å; L346-F350 WeakPolarHBondContact O-CG 3.43Å; L346-F350 PolarHBondContact O-N 2.91Å; L346-M366 HydrophobicContact CD1-SD 4.44Å; L346-M366 HydrophobicContact CD2-SD 3.94Å; L346-C369 HydrophobicContact CD2-CB 3.9Å; L346-V370 HydrophobicContact CD2-CG2 3.67Å; L346-A482 HydrophobicContact CD1-CB 3.45Å; L346-A482 VanDerWaalsContact CD1-CB 3.45Å |
| 347 | I | 88.3 | Confident | 84.3 | Confident | 102 Ų | 102 | 52.5 Ų | 52.5 | 52% | 0.523 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -57.4 | -38.4 | -179.1 | -66.2 | 168.8 | 0 | 0 | 0 | 112.1 | S344 F350 T351 | S344-I347 WeakPolarHBondContact O-CD1 3.41Å; S344-I347 WeakPolarHBondContact O-CG1 3.14Å; I347-F350 PolarHBondContact O-N 3.4Å; I347-T351 WeakPolarHBondContact O-CB 3.32Å; I347-T351 PolarHBondContact O-N 3.43Å; I347-T351 PolarHBondContact O-OG1 3.23Å |
| 348 | T | 79.8 | Confident | 83.6 | Confident | 86 Ų | 86 | 47.8 Ų | 47.8 | 53% | 0.528 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63.7 | -54 | 179.6 | -54.6 | 0 | 0 | 0 | 0 | 112.9 | L346 F350 T351 T352 | L346-T348 PolarHBondContact O-N 3.06Å; T348-F350 VanDerWaalsContact C-N 3.33Å; T348-F350 PolarHBondContact O-N 2.83Å; T348-T351 PolarHBondContact O-N 3.5Å; T348-T352 PolarHBondContact O-N 3.47Å; T348-T352 PolarHBondContact O-OG1 2.86Å |
| 349 | P | 83 | Confident | 83 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.7 | -34.9 | 175.1 | 20.7 | -30.5 | 0 | 0 | 0 | 112.8 | L346 T352 A353 M366 C369 | L346-P349 HydrophobicContact CB-CG 4.13Å; L346-P349 HydrophobicContact CD2-CG 4.36Å; L346-P349 WeakPolarHBondContact O-CD 3.16Å; L346-P349 WeakPolarHBondContact O-CG 3.16Å; P349-T352 WeakPolarHBondContact O-CB 3.47Å; P349-T352 PolarHBondContact O-N 3.38Å; P349-A353 WeakPolarHBondContact O-CB 3.3Å; P349-A353 PolarHBondContact O-N 3.44Å; P349-M366 HydrophobicContact CB-CB 4.22Å; P349-M366 HydrophobicContact CB-CE 4.38Å; P349-M366 HydrophobicContact CB-SD 4.07Å; P349-M366 HydrophobicContact CG-SD 3.91Å; P349-C369 HydrophobicContact CG-CB 4.13Å |
| 350 | F | 87.3 | Confident | 82.2 | Confident | 31 Ų | 31 | 45.2 Ų | 45.2 | 14% | 0.136 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.4 | -43.5 | 174.4 | -65 | -22.9 | 0 | 0 | 0 | 113 | L343 L346 I347 T348 T352 A353 F354 M366 V475 V478 E479 | L343-F350 HydrophobicContact CB-CE2 4.47Å; L343-F350 HydrophobicContact CD2-CE2 3.99Å; L343-F350 HydrophobicContact CD2-CZ 3.82Å; L346-F350 HydrophobicContact CB-CD2 4.21Å; L346-F350 HydrophobicContact CB-CE1 4.15Å; L346-F350 HydrophobicContact CB-CE2 3.75Å; L346-F350 HydrophobicContact CB-CZ 3.72Å; L346-F350 HydrophobicContact CD1-CZ 4.01Å; L346-F350 WeakPolarHBondContact O-CD2 3.38Å; L346-F350 VanDerWaalsContact O-CG 3.23Å; L346-F350 WeakPolarHBondContact O-CG 3.43Å; L346-F350 PolarHBondContact O-N 2.91Å; I347-F350 PolarHBondContact O-N 3.4Å; T348-F350 VanDerWaalsContact C-N 3.33Å; T348-F350 PolarHBondContact O-N 2.83Å; F350-T352 PolarHBondContact O-N 2.94Å; F350-A353 PolarHBondContact O-N 2.84Å; F350-F354 WeakPolarHBondContact O-CB 3.22Å; F350-F354 PolarHBondContact O-N 3.04Å; F350-M366 HydrophobicContact CD1-CE 4.48Å; F350-M366 HydrophobicContact CE1-CE 4.04Å; F350-V475 HydrophobicContact CB-CG1 4.48Å; F350-V475 HydrophobicContact CD1-CG1 4.46Å; F350-V475 HydrophobicContact CG-CG1 4.47Å; F350-V478 HydrophobicContact CD1-CG2 3.87Å; F350-V478 HydrophobicContact CE1-CG2 4.11Å; F350-E479 HydrophobicContact CE1-CB 3.9Å; F350-E479 HydrophobicContact CZ-CB 4Å; F350-E479 HydrophobicContact CZ-CG 4.12Å |
| 351 | T | 74.6 | Confident | 80.9 | Confident | 90 Ų | 90 | 42.1 Ų | 42.1 | 55% | 0.552 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -62.8 | -37.4 | 175.1 | -55.3 | 0 | 0 | 0 | 0 | 110.9 | I347 T348 A355 | I347-T351 WeakPolarHBondContact O-CB 3.32Å; I347-T351 PolarHBondContact O-N 3.43Å; I347-T351 PolarHBondContact O-OG1 3.23Å; T348-T351 PolarHBondContact O-N 3.5Å; T351-A355 WeakPolarHBondContact O-CB 3.27Å; T351-A355 PolarHBondContact O-N 2.96Å |
| 352 | T | 70.1 | Confident | 80.1 | Confident | 44 Ų | 44 | 38.5 Ų | 38.5 | 27% | 0.27 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -66.2 | -46 | 176 | -54 | 0 | 0 | 0 | 0 | 110.7 | T348 P349 F350 F354 A355 T356 T362 | T348-T352 PolarHBondContact O-N 3.47Å; T348-T352 PolarHBondContact O-OG1 2.86Å; P349-T352 WeakPolarHBondContact O-CB 3.47Å; P349-T352 PolarHBondContact O-N 3.38Å; F350-T352 PolarHBondContact O-N 2.94Å; T352-F354 VanDerWaalsContact C-N 3.35Å; T352-F354 PolarHBondContact O-N 3.48Å; T352-A355 PolarHBondContact O-N 3.04Å; T352-T356 HydrophobicContact CG2-CG2 4.07Å; T352-T356 WeakPolarHBondContact O-CG2 3.41Å; T352-T356 PolarHBondContact O-N 3.35Å; T352-T356 PolarHBondContact O-OG1 2.95Å; T352-T362 HydrophobicContact CG2-CG2 4.04Å |
| 353 | A | 78.9 | Confident | 79.3 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61 | -43.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | P349 F350 A355 C357 T362 T474 V475 V478 | P349-A353 WeakPolarHBondContact O-CB 3.3Å; P349-A353 PolarHBondContact O-N 3.44Å; F350-A353 PolarHBondContact O-N 2.84Å; A353-A355 VanDerWaalsContact C-N 3.29Å; A353-A355 PolarHBondContact O-N 2.8Å; A353-C357 WeakPolarHBondContact O-CA 3.24Å; A353-C357 PolarHBondContact O-N 3.18Å; A353-T362 HydrophobicContact CB-CG2 3.59Å; A353-T474 HydrophobicContact CB-CG2 3.97Å; A353-V475 HydrophobicContact CB-CG2 4.29Å; A353-V478 HydrophobicContact CB-CG1 4.37Å; A353-V478 HydrophobicContact CB-CG2 3.83Å |
| 354 | F | 79.1 | Confident | 78.4 | Confident | 100 Ų | 100 | 43 Ų | 43 | 44% | 0.439 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.8 | -35.7 | 174.1 | -173 | -89.9 | 0 | 0 | 0 | 112.6 | F350 T352 R471 T472 V475 | F350-F354 WeakPolarHBondContact O-CB 3.22Å; F350-F354 PolarHBondContact O-N 3.04Å; T352-F354 VanDerWaalsContact C-N 3.35Å; T352-F354 PolarHBondContact O-N 3.48Å; F354-R471 HydrophobicContact CD2-CB 3.75Å; F354-R471 HydrophobicContact CE2-CB 3.68Å; F354-R471 HydrophobicContact CG-CB 4.35Å; F354-R471 HydrophobicContact CZ-CB 4.23Å; F354-R471 WeakPolarHBondContact O-CG 3.13Å; F354-T472 HydrophobicContact CE2-CG2 4.4Å; F354-V475 HydrophobicContact CB-CG2 3.82Å; F354-V475 HydrophobicContact CD2-CG2 4.23Å |
| 355 | A | 64.6 | Low | 77.6 | Confident | 41 Ų | 41 | 41.4 Ų | 41.4 | 34% | 0.339 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -77.7 | -41 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T351 T352 A353 | T351-A355 WeakPolarHBondContact O-CB 3.27Å; T351-A355 PolarHBondContact O-N 2.96Å; T352-A355 PolarHBondContact O-N 3.04Å; A353-A355 VanDerWaalsContact C-N 3.29Å; A353-A355 PolarHBondContact O-N 2.8Å |
| 356 | T | 66.1 | Low | 77.6 | Confident | 57 Ų | 57 | 41 Ų | 41 | 35% | 0.35 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -89.5 | -21.2 | -173.9 | 60.6 | 0 | 0 | 0 | 0 | 113.9 | T352 S358 | T352-T356 HydrophobicContact CG2-CG2 4.07Å; T352-T356 WeakPolarHBondContact O-CG2 3.41Å; T352-T356 PolarHBondContact O-N 3.35Å; T352-T356 PolarHBondContact O-OG1 2.95Å; T356-S358 PolarHBondContact O-N 3.35Å; T356-S358 PolarHBondContact OG1-N 2.84Å |
| 357 | C | 74.3 | Confident | 77.2 | Confident | 9 Ų | 9 | 42.5 Ų | 42.5 | 6% | 0.061 | 26% | 0.258 | C | S | . | . | trans | 53.7 | 31.3 | -170.5 | -56.9 | 0 | 0 | 0 | 0 | 113.2 | A353 P438 R471 T474 | A353-C357 WeakPolarHBondContact O-CA 3.24Å; A353-C357 PolarHBondContact O-N 3.18Å; C357-P438 HydrophobicContact CB-CB 4.08Å; C357-P438 HydrophobicContact CB-CG 4.29Å; C357-P438 VanDerWaalsContact O-CA 3.3Å; C357-P438 WeakPolarHBondContact O-CA 3.34Å; C357-P438 WeakPolarHBondContact O-CG 3.32Å; C357-R471 WeakPolarHBondContact SG-CG 3.23Å; C357-T474 WeakPolarHBondContact CA-OG1 3.26Å | ||
| 358 | S | 77.3 | Confident | 76.7 | Confident | 15 Ų | 15 | 43.2 Ų | 43.2 | 11% | 0.105 | 26% | 0.257 | C | S | . | . | trans | -141.5 | 117.4 | -178 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | T356 A361 T362 G436 | T356-S358 PolarHBondContact O-N 3.35Å; T356-S358 PolarHBondContact OG1-N 2.84Å; S358-A361 PolarHBondContact O-N 3.25Å; S358-A361 WeakPolarHBondContact OG-CB 2.83Å; S358-A361 PolarHBondContact OG-N 3.19Å; S358-A361 VanDerWaalsContact OG-N 3.13Å; S358-T362 WeakPolarHBondContact O-CG2 3.28Å; S358-T362 PolarHBondContact O-N 3.41Å; S358-G436 WeakPolarHBondContact CA-O 3.33Å; S358-G436 WeakPolarHBondContact CB-O 3.45Å; S358-G436 PolarHBondContact OG-O 3.35Å | ||
| 359 | S | 82 | Confident | 77.1 | Confident | 4 Ų | 4 | 39.7 Ų | 39.7 | 3% | 0.028 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.1 | -44.4 | 175 | -55.5 | 0 | 0 | 0 | 0 | 110.8 | A361 T362 L363 G436 | S359-A361 PolarHBondContact O-N 3.07Å; S359-T362 PolarHBondContact O-N 2.82Å; S359-T362 VanDerWaalsContact O-N 3.09Å; S359-T362 PolarHBondContact O-OG1 3.48Å; S359-L363 PolarHBondContact O-N 3.35Å; S359-G436 PolarHBondContact N-O 2.95Å |
| 360 | S | 75.8 | Confident | 77.5 | Confident | 49 Ų | 49 | 39.7 Ų | 39.7 | 34% | 0.343 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.8 | -37.5 | -179.8 | -51.4 | 0 | 0 | 0 | 0 | 112.7 | T362 L363 G436 | S360-T362 PolarHBondContact O-N 3.43Å; S360-L363 WeakPolarHBondContact O-CB 3.26Å; S360-L363 PolarHBondContact O-N 2.98Å; S360-G436 PolarHBondContact N-O 3.35Å |
| 361 | A | 67 | Low | 77.7 | Confident | 59 Ų | 59 | 39.6 Ų | 39.6 | 49% | 0.488 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -66.9 | -23 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S358 S359 | S358-A361 PolarHBondContact O-N 3.25Å; S358-A361 WeakPolarHBondContact OG-CB 2.83Å; S358-A361 PolarHBondContact OG-N 3.19Å; S358-A361 VanDerWaalsContact OG-N 3.13Å; S359-A361 PolarHBondContact O-N 3.07Å |
| 362 | T | 75.7 | Confident | 78.4 | Confident | 2 Ų | 2 | 41.5 Ų | 41.5 | 1% | 0.012 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -90.7 | -15.8 | -177.6 | 68.8 | 0 | 0 | 0 | 0 | 113.5 | T352 A353 S358 S359 S360 P364 S365 M366 V478 | T352-T362 HydrophobicContact CG2-CG2 4.04Å; A353-T362 HydrophobicContact CB-CG2 3.59Å; S358-T362 WeakPolarHBondContact O-CG2 3.28Å; S358-T362 PolarHBondContact O-N 3.41Å; S359-T362 PolarHBondContact O-N 2.82Å; S359-T362 VanDerWaalsContact O-N 3.09Å; S359-T362 PolarHBondContact O-OG1 3.48Å; S360-T362 PolarHBondContact O-N 3.43Å; T362-P364 VanDerWaalsContact C-CD 3.48Å; T362-S365 PolarHBondContact O-N 3.22Å; T362-M366 PolarHBondContact O-N 3.34Å; T362-V478 WeakPolarHBondContact OG1-CG1 3.29Å |
| 363 | L | 77.3 | Confident | 79.5 | Confident | 37 Ų | 37 | 44 Ų | 44 | 19% | 0.194 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -51.4 | -44.3 | -172.2 | -179.1 | 64.4 | 0 | 0 | 0 | 113.8 | S359 S360 S365 M366 I367 L385 P386 | S359-L363 PolarHBondContact O-N 3.35Å; S360-L363 WeakPolarHBondContact O-CB 3.26Å; S360-L363 PolarHBondContact O-N 2.98Å; L363-S365 PolarHBondContact O-N 2.85Å; L363-M366 PolarHBondContact O-N 2.89Å; L363-I367 HydrophobicContact CD1-CD1 3.96Å; L363-I367 HydrophobicContact CD1-CG1 4.13Å; L363-I367 HydrophobicContact CG-CD1 3.94Å; L363-I367 WeakPolarHBondContact O-CG1 3.17Å; L363-I367 PolarHBondContact O-N 3.48Å; L363-L385 HydrophobicContact CD1-CB 3.68Å; L363-P386 HydrophobicContact CD1-CG 4.26Å; L363-P386 HydrophobicContact CD2-CB 3.95Å; L363-P386 HydrophobicContact CD2-CG 4.09Å |
| 364 | P | 74.8 | Confident | 80 | Confident | 95 Ų | 95 | 45.7 Ų | 45.7 | 62% | 0.617 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -64.3 | -39.7 | 178.6 | -21.7 | 34.1 | 0 | 0 | 0 | 113.2 | T362 M366 K368 | T362-P364 VanDerWaalsContact C-CD 3.48Å; P364-M366 VanDerWaalsContact C-N 3.34Å; P364-K368 PolarHBondContact O-N 3.35Å |
| 365 | S | 74.5 | Confident | 80.6 | Confident | 35 Ų | 35 | 43.3 Ų | 43.3 | 25% | 0.245 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -69.5 | -36 | 176.3 | -173.5 | 0 | 0 | 0 | 0 | 111.3 | T362 L363 C369 | T362-S365 PolarHBondContact O-N 3.22Å; L363-S365 PolarHBondContact O-N 2.85Å; S365-C369 PolarHBondContact O-N 3.3Å; S365-C369 VanDerWaalsContact O-N 3.13Å; S365-C369 PolarHBondContact O-SG 3.04Å |
| 366 | M | 86.9 | Confident | 81.9 | Confident | 4 Ų | 4 | 41.7 Ų | 41.7 | 2% | 0.02 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.9 | -50.6 | 178.5 | -175.5 | 61.5 | 99.7 | 0 | 0 | 111.2 | L346 P349 F350 T362 L363 P364 K368 C369 V370 L385 V478 A482 | L346-M366 HydrophobicContact CD1-SD 4.44Å; L346-M366 HydrophobicContact CD2-SD 3.94Å; P349-M366 HydrophobicContact CB-CB 4.22Å; P349-M366 HydrophobicContact CB-CE 4.38Å; P349-M366 HydrophobicContact CB-SD 4.07Å; P349-M366 HydrophobicContact CG-SD 3.91Å; F350-M366 HydrophobicContact CD1-CE 4.48Å; F350-M366 HydrophobicContact CE1-CE 4.04Å; T362-M366 PolarHBondContact O-N 3.34Å; L363-M366 PolarHBondContact O-N 2.89Å; P364-M366 VanDerWaalsContact C-N 3.34Å; M366-K368 VanDerWaalsContact C-N 3.28Å; M366-K368 PolarHBondContact O-N 2.85Å; M366-C369 PolarHBondContact O-N 3.01Å; M366-V370 HydrophobicContact CG-CG2 4.22Å; M366-V370 WeakPolarHBondContact O-CB 3.36Å; M366-V370 VanDerWaalsContact O-CG2 3.31Å; M366-V370 WeakPolarHBondContact O-CG2 3.14Å; M366-V370 PolarHBondContact O-N 3.4Å; M366-V370 HydrophobicContact SD-CG2 3.89Å; M366-L385 HydrophobicContact CG-CD1 4.09Å; M366-L385 HydrophobicContact CG-CD2 4.12Å; M366-V478 HydrophobicContact CE-CB 3.64Å; M366-V478 HydrophobicContact CE-CG2 3.94Å; M366-V478 WeakPolarHBondContact CE-O 3.46Å; M366-A482 HydrophobicContact CE-CB 3.72Å; M366-A482 HydrophobicContact SD-CB 3.77Å |
| 367 | I | 83.2 | Confident | 82.9 | Confident | 33 Ų | 33 | 40.9 Ų | 40.9 | 17% | 0.169 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -54.4 | -46.9 | 177.6 | -69.8 | 166.2 | 0 | 0 | 0 | 110.5 | L363 V370 E371 R382 L385 | L363-I367 HydrophobicContact CD1-CD1 3.96Å; L363-I367 HydrophobicContact CD1-CG1 4.13Å; L363-I367 HydrophobicContact CG-CD1 3.94Å; L363-I367 WeakPolarHBondContact O-CG1 3.17Å; L363-I367 PolarHBondContact O-N 3.48Å; I367-V370 PolarHBondContact O-N 3.43Å; I367-E371 HydrophobicContact CG2-CG 4.39Å; I367-E371 WeakPolarHBondContact CG2-OE1 3.21Å; I367-E371 WeakPolarHBondContact O-CB 3.24Å; I367-E371 VanDerWaalsContact O-CG 3.32Å; I367-E371 WeakPolarHBondContact O-CG 3.45Å; I367-E371 PolarHBondContact O-N 3.42Å; I367-R382 HydrophobicContact CG2-CG 4.23Å; I367-L385 HydrophobicContact CB-CD1 4.35Å; I367-L385 HydrophobicContact CG1-CB 4.25Å; I367-L385 HydrophobicContact CG1-CD1 3.72Å |
| 368 | K | 78.7 | Confident | 83.2 | Confident | 116 Ų | 116 | 46.2 Ų | 46.2 | 50% | 0.504 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -60.3 | -50.7 | 179.9 | -174 | 179.3 | 177.5 | 179.9 | 0 | 112.3 | P364 M366 E371 E372 | P364-K368 PolarHBondContact O-N 3.35Å; M366-K368 VanDerWaalsContact C-N 3.28Å; M366-K368 PolarHBondContact O-N 2.85Å; K368-E371 PolarHBondContact O-N 2.97Å; K368-E372 VanDerWaalsContact CE-CD 3.4Å; K368-E372 VanDerWaalsContact CE-OE1 3.24Å; K368-E372 WeakPolarHBondContact CE-OE1 3.34Å; K368-E372 WeakPolarHBondContact CE-OE2 3.35Å; K368-E372 HydrophobicContact CG-CG 4.32Å; K368-E372 IonicContact NZ-OE2 2.8Å; K368-E372 WeakPolarHBondContact O-CB 3.46Å; K368-E372 WeakPolarHBondContact O-CG 3.3Å; K368-E372 PolarHBondContact O-N 3.15Å |
| 369 | C | 87.7 | Confident | 83.2 | Confident | 13 Ų | 13 | 54.5 Ų | 54.5 | 9% | 0.088 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.6 | -37.7 | -178.9 | -70.8 | 0 | 0 | 0 | 0 | 112.3 | L346 P349 S365 M366 N373 N374 | L346-C369 HydrophobicContact CD2-CB 3.9Å; P349-C369 HydrophobicContact CG-CB 4.13Å; S365-C369 PolarHBondContact O-N 3.3Å; S365-C369 VanDerWaalsContact O-N 3.13Å; S365-C369 PolarHBondContact O-SG 3.04Å; M366-C369 PolarHBondContact O-N 3.01Å; C369-N373 WeakPolarHBondContact O-CA 3.46Å; C369-N373 WeakPolarHBondContact O-CB 3.25Å; C369-N373 PolarHBondContact O-N 3.15Å; C369-N374 PolarHBondContact O-N 3.47Å |
| 370 | V | 91.8 | Very high | 83.3 | Confident | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65.4 | -39.4 | 176.8 | 168.3 | 0 | 0 | 0 | 0 | 111.8 | L346 M366 I367 G375 V376 L385 A482 | L346-V370 HydrophobicContact CD2-CG2 3.67Å; M366-V370 HydrophobicContact CG-CG2 4.22Å; M366-V370 WeakPolarHBondContact O-CB 3.36Å; M366-V370 VanDerWaalsContact O-CG2 3.31Å; M366-V370 WeakPolarHBondContact O-CG2 3.14Å; M366-V370 PolarHBondContact O-N 3.4Å; M366-V370 HydrophobicContact SD-CG2 3.89Å; I367-V370 PolarHBondContact O-N 3.43Å; V370-G375 PolarHBondContact O-N 3.03Å; V370-V376 HydrophobicContact CG1-CB 3.56Å; V370-V376 HydrophobicContact CG1-CG1 3.92Å; V370-V376 HydrophobicContact CG1-CG2 3.75Å; V370-V376 PolarHBondContact O-N 2.64Å; V370-V376 VanDerWaalsContact O-N 3.14Å; V370-L385 HydrophobicContact CB-CD1 4.19Å; V370-L385 HydrophobicContact CG1-CD1 4.27Å; V370-L385 HydrophobicContact CG2-CD1 4.18Å; V370-A482 HydrophobicContact CG2-CB 4.17Å |
| 371 | E | 90.9 | Very high | 83.5 | Confident | 28 Ų | 28 | 52.3 Ų | 52.3 | 13% | 0.131 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -73.6 | -48.2 | 176.6 | -71.6 | -178.9 | -172.7 | 0 | 0 | 112.5 | I367 K368 G375 K378 S381 R382 | I367-E371 HydrophobicContact CG2-CG 4.39Å; I367-E371 WeakPolarHBondContact CG2-OE1 3.21Å; I367-E371 WeakPolarHBondContact O-CB 3.24Å; I367-E371 VanDerWaalsContact O-CG 3.32Å; I367-E371 WeakPolarHBondContact O-CG 3.45Å; I367-E371 PolarHBondContact O-N 3.42Å; K368-E371 PolarHBondContact O-N 2.97Å; E371-G375 WeakPolarHBondContact O-CA 3.11Å; E371-G375 PolarHBondContact O-N 3.28Å; E371-K378 HydrophobicContact CG-CG 4.06Å; E371-K378 WeakPolarHBondContact OE2-CE 3.4Å; E371-S381 WeakPolarHBondContact CG-OG 3.14Å; E371-S381 PolarHBondContact OE1-OG 3.32Å; E371-R382 WeakPolarHBondContact OE1-CG 3.44Å; E371-R382 IonicContact OE1-CZ 3.14Å; E371-R382 IonicContact OE1-NE 2.68Å; E371-R382 PolarHBondContact OE1-NE 3.19Å; E371-R382 IonicContact OE1-NH2 2.84Å; E371-R382 IonicContact OE2-CZ 3.82Å; E371-R382 IonicContact OE2-NE 3.46Å; E371-R382 IonicContact OE2-NH2 2.72Å; E371-R382 PolarHBondContact OE2-NH2 2.96Å |
| 372 | E | 90.9 | Very high | 84 | Confident | 131 Ų | 131 | 56.3 Ų | 56.3 | 61% | 0.612 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -86.2 | -44.8 | -170.8 | -66.2 | 178.4 | -177.3 | 0 | 0 | 113.3 | K368 | K368-E372 VanDerWaalsContact CE-CD 3.4Å; K368-E372 VanDerWaalsContact CE-OE1 3.24Å; K368-E372 WeakPolarHBondContact CE-OE1 3.34Å; K368-E372 WeakPolarHBondContact CE-OE2 3.35Å; K368-E372 HydrophobicContact CG-CG 4.32Å; K368-E372 IonicContact NZ-OE2 2.8Å; K368-E372 WeakPolarHBondContact O-CB 3.46Å; K368-E372 WeakPolarHBondContact O-CG 3.3Å; K368-E372 PolarHBondContact O-N 3.15Å |
| 373 | N | 91.5 | Very high | 84 | Confident | 95 Ų | 95 | 59.2 Ų | 59.2 | 51% | 0.508 | 29% | 0.292 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | -38.7 | -175.1 | -59.8 | -7.7 | 0 | 0 | 0 | 111.5 | G345 C369 | G345-N373 PolarHBondContact O-ND2 3.23Å; C369-N373 WeakPolarHBondContact O-CA 3.46Å; C369-N373 WeakPolarHBondContact O-CB 3.25Å; C369-N373 PolarHBondContact O-N 3.15Å |
| 374 | N | 90.9 | Very high | 84.3 | Confident | 36 Ų | 36 | 57.6 Ų | 57.6 | 19% | 0.193 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -103.1 | -9.1 | -172.4 | -64.4 | 30.8 | 0 | 0 | 0 | 112.9 | F342 C369 V376 | F342-N374 VanDerWaalsContact CD1-ND2 3.3Å; F342-N374 WeakPolarHBondContact CD1-ND2 3.47Å; F342-N374 HydrophobicContact CD2-CB 3.95Å; F342-N374 WeakPolarHBondContact CD2-ND2 3.32Å; F342-N374 WeakPolarHBondContact CE1-ND2 3.43Å; F342-N374 HydrophobicContact CE2-CB 3.64Å; F342-N374 WeakPolarHBondContact CE2-ND2 3.45Å; F342-N374 WeakPolarHBondContact CG-ND2 3.4Å; F342-N374 HydrophobicContact CZ-CB 4.24Å; F342-N374 VanDerWaalsContact CZ-ND2 3.35Å; F342-N374 WeakPolarHBondContact CZ-ND2 3.46Å; F342-N374 PolarHBondContact O-ND2 3.49Å; C369-N374 PolarHBondContact O-N 3.47Å; N374-V376 VanDerWaalsContact C-N 3.32Å; N374-V376 HydrophobicContact CB-CG2 4.48Å; N374-V376 PolarHBondContact O-N 2.78Å |
| 375 | G | 90.4 | Very high | 84.7 | Confident | 50 Ų | 50 | 53.1 Ų | 53.1 | 52% | 0.515 | 26% | 0.255 | S | S | . | . | trans | 68.6 | 25.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | V370 E371 | V370-G375 PolarHBondContact O-N 3.03Å; E371-G375 WeakPolarHBondContact O-CA 3.11Å; E371-G375 PolarHBondContact O-N 3.28Å | ||
| 376 | V | 91.8 | Very high | 84.8 | Confident | 7 Ų | 7 | 53.8 Ų | 53.8 | 4% | 0.042 | 26% | 0.258 | C | S | . | . | trans | -72 | 140.8 | 177.8 | 171.5 | 0 | 0 | 0 | 0 | 110.4 | F342 V370 N374 K378 I380 H489 | F342-V376 HydrophobicContact CE2-CG2 4.05Å; F342-V376 HydrophobicContact CZ-CG2 4.39Å; V370-V376 HydrophobicContact CG1-CB 3.56Å; V370-V376 HydrophobicContact CG1-CG1 3.92Å; V370-V376 HydrophobicContact CG1-CG2 3.75Å; V370-V376 PolarHBondContact O-N 2.64Å; V370-V376 VanDerWaalsContact O-N 3.14Å; N374-V376 VanDerWaalsContact C-N 3.32Å; N374-V376 HydrophobicContact CB-CG2 4.48Å; N374-V376 PolarHBondContact O-N 2.78Å; V376-K378 PolarHBondContact O-N 3.27Å; V376-I380 HydrophobicContact CG1-CB 4.44Å; V376-I380 HydrophobicContact CG1-CG2 4.4Å; V376-H489 HydrophobicContact CG1-CB 4.04Å; V376-H489 HydrophobicContact CG2-CB 4.42Å | ||
| 377 | D | 87.8 | Confident | 84.4 | Confident | 40 Ų | 40 | 54.3 Ų | 54.3 | 21% | 0.214 | 26% | 0.261 | C | S | . | . | trans | -58.1 | 129.9 | 178.9 | -172.5 | -62 | 0 | 0 | 0 | 110.9 | R379 I380 S381 H489 | D377-R379 PolarHBondContact O-N 3.45Å; D377-R379 WeakPolarHBondContact OD1-CB 3.45Å; D377-R379 WeakPolarHBondContact OD1-CG 3.49Å; D377-R379 IonicContact OD1-CZ 3.97Å; D377-R379 PolarHBondContact OD1-N 3.14Å; D377-R379 IonicContact OD1-NE 2.84Å; D377-R379 PolarHBondContact OD1-NE 3.37Å; D377-R379 VanDerWaalsContact OD1-NE 3.1Å; D377-R379 IonicContact OD1-NH2 3.98Å; D377-R379 IonicContact OD2-CZ 3.98Å; D377-R379 IonicContact OD2-NE 3.2Å; D377-R379 PolarHBondContact OD2-NE 3.29Å; D377-R379 IonicContact OD2-NH2 3.85Å; D377-R379 PolarHBondContact OD2-NH2 3.48Å; D377-I380 HydrophobicContact CB-CB 4.49Å; D377-I380 HydrophobicContact CB-CD1 4.16Å; D377-I380 HydrophobicContact CB-CG1 4.22Å; D377-I380 WeakPolarHBondContact O-CB 3.16Å; D377-I380 PolarHBondContact O-N 3.22Å; D377-S381 PolarHBondContact O-N 2.89Å; D377-S381 PolarHBondContact O-OG 2.82Å; D377-H489 PolarHBondContact N-CE1 3.44Å; D377-H489 PolarHBondContact N-ND1 3.22Å | ||
| 378 | K | 80.7 | Confident | 84.2 | Confident | 121 Ų | 121 | 52.7 Ų | 52.7 | 53% | 0.526 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -57.6 | -31.7 | -176.6 | -60.2 | -170.8 | 171.5 | 174.8 | 0 | 113.4 | E371 V376 I380 S381 R382 | E371-K378 HydrophobicContact CG-CG 4.06Å; E371-K378 WeakPolarHBondContact OE2-CE 3.4Å; V376-K378 PolarHBondContact O-N 3.27Å; K378-I380 VanDerWaalsContact C-N 3.3Å; K378-S381 WeakPolarHBondContact CA-OG 3.48Å; K378-S381 PolarHBondContact O-OG 2.89Å; K378-R382 VanDerWaalsContact O-CB 3.23Å; K378-R382 WeakPolarHBondContact O-CB 3.34Å; K378-R382 WeakPolarHBondContact O-CD 3.43Å; K378-R382 WeakPolarHBondContact O-CG 3.43Å; K378-R382 PolarHBondContact O-N 2.84Å; K378-R382 VanDerWaalsContact O-N 3.13Å |
| 379 | R | 77.8 | Confident | 84.2 | Confident | 190 Ų | 190 | 47.4 Ų | 47.4 | 72% | 0.717 | 23% | 0.231 | S | C | * | . | H | α-helix | trans | -67.8 | -35.3 | 177.8 | -63.9 | 171.3 | -74.1 | -169.6 | -2.3 | 110.9 | D377 F383 | D377-R379 PolarHBondContact O-N 3.45Å; D377-R379 WeakPolarHBondContact OD1-CB 3.45Å; D377-R379 WeakPolarHBondContact OD1-CG 3.49Å; D377-R379 IonicContact OD1-CZ 3.97Å; D377-R379 PolarHBondContact OD1-N 3.14Å; D377-R379 IonicContact OD1-NE 2.84Å; D377-R379 PolarHBondContact OD1-NE 3.37Å; D377-R379 VanDerWaalsContact OD1-NE 3.1Å; D377-R379 IonicContact OD1-NH2 3.98Å; D377-R379 IonicContact OD2-CZ 3.98Å; D377-R379 IonicContact OD2-NE 3.2Å; D377-R379 PolarHBondContact OD2-NE 3.29Å; D377-R379 IonicContact OD2-NH2 3.85Å; D377-R379 PolarHBondContact OD2-NH2 3.48Å; R379-F383 WeakPolarHBondContact O-CB 3.28Å |
| 380 | I | 83.6 | Confident | 83.5 | Confident | 6 Ų | 6 | 48.5 Ų | 48.5 | 3% | 0.031 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -79 | -49 | -179.5 | -62 | -179.3 | 0 | 0 | 0 | 110.1 | L129 V376 D377 K378 F383 I384 L488 H489 N492 | L129-I380 HydrophobicContact CD2-CD1 4.28Å; L129-I380 HydrophobicContact CD2-CG1 4.17Å; V376-I380 HydrophobicContact CG1-CB 4.44Å; V376-I380 HydrophobicContact CG1-CG2 4.4Å; D377-I380 HydrophobicContact CB-CB 4.49Å; D377-I380 HydrophobicContact CB-CD1 4.16Å; D377-I380 HydrophobicContact CB-CG1 4.22Å; D377-I380 WeakPolarHBondContact O-CB 3.16Å; D377-I380 PolarHBondContact O-N 3.22Å; K378-I380 VanDerWaalsContact C-N 3.3Å; I380-F383 PolarHBondContact O-N 3.11Å; I380-I384 HydrophobicContact CG2-CD1 3.39Å; I380-I384 HydrophobicContact CG2-CG1 4.29Å; I380-I384 WeakPolarHBondContact O-CB 3.48Å; I380-I384 WeakPolarHBondContact O-CG1 3.49Å; I380-I384 PolarHBondContact O-N 2.91Å; I380-L488 HydrophobicContact CG2-CB 4.17Å; I380-H489 HydrophobicContact CD1-CB 4.2Å; I380-N492 HydrophobicContact CD1-CB 3.87Å |
| 381 | S | 80.4 | Confident | 82.9 | Confident | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.8 | -46.6 | -178.7 | 58.1 | 0 | 0 | 0 | 0 | 112.5 | E371 D377 K378 F383 L385 | E371-S381 WeakPolarHBondContact CG-OG 3.14Å; E371-S381 PolarHBondContact OE1-OG 3.32Å; D377-S381 PolarHBondContact O-N 2.89Å; D377-S381 PolarHBondContact O-OG 2.82Å; K378-S381 WeakPolarHBondContact CA-OG 3.48Å; K378-S381 PolarHBondContact O-OG 2.89Å; S381-F383 PolarHBondContact O-N 2.97Å; S381-L385 VanDerWaalsContact O-CB 3.27Å; S381-L385 WeakPolarHBondContact O-CB 3.24Å; S381-L385 VanDerWaalsContact O-CG 3.27Å; S381-L385 WeakPolarHBondContact O-CG 2.99Å; S381-L385 PolarHBondContact O-N 3.25Å; S381-L385 VanDerWaalsContact O-N 3.09Å |
| 382 | R | 76.8 | Confident | 82.7 | Confident | 143 Ų | 143 | 47.9 Ų | 47.9 | 54% | 0.54 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -73.3 | -15.2 | -178.5 | -64.2 | 175 | -172.7 | -159.5 | -5.7 | 113.5 | I367 E371 K378 P386 | I367-R382 HydrophobicContact CG2-CG 4.23Å; E371-R382 WeakPolarHBondContact OE1-CG 3.44Å; E371-R382 IonicContact OE1-CZ 3.14Å; E371-R382 IonicContact OE1-NE 2.68Å; E371-R382 PolarHBondContact OE1-NE 3.19Å; E371-R382 IonicContact OE1-NH2 2.84Å; E371-R382 IonicContact OE2-CZ 3.82Å; E371-R382 IonicContact OE2-NE 3.46Å; E371-R382 IonicContact OE2-NH2 2.72Å; E371-R382 PolarHBondContact OE2-NH2 2.96Å; K378-R382 VanDerWaalsContact O-CB 3.23Å; K378-R382 WeakPolarHBondContact O-CB 3.34Å; K378-R382 WeakPolarHBondContact O-CD 3.43Å; K378-R382 WeakPolarHBondContact O-CG 3.43Å; K378-R382 PolarHBondContact O-N 2.84Å; K378-R382 VanDerWaalsContact O-N 3.13Å; R382-P386 WeakPolarHBondContact O-CD 3.4Å; R382-P386 WeakPolarHBondContact O-CG 3.47Å |
| 383 | F | 76 | Confident | 82.7 | Confident | 63 Ų | 63 | 41.9 Ų | 41.9 | 28% | 0.276 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -90.8 | -53.4 | 175.6 | 174.1 | -105.8 | 0 | 0 | 0 | 110.9 | L126 R379 I380 S381 I387 | L126-F383 HydrophobicContact CD1-CE2 3.83Å; L126-F383 HydrophobicContact CD1-CZ 3.44Å; L126-F383 VanDerWaalsContact CD1-CZ 3.44Å; L126-F383 HydrophobicContact CD2-CZ 4.37Å; L126-F383 HydrophobicContact CG-CE1 4.38Å; L126-F383 HydrophobicContact CG-CE2 4.43Å; L126-F383 HydrophobicContact CG-CZ 3.62Å; R379-F383 WeakPolarHBondContact O-CB 3.28Å; I380-F383 PolarHBondContact O-N 3.11Å; S381-F383 PolarHBondContact O-N 2.97Å; F383-I387 HydrophobicContact CD2-CD1 4.01Å; F383-I387 HydrophobicContact CE1-CD1 4.19Å; F383-I387 HydrophobicContact CE2-CD1 3.5Å; F383-I387 HydrophobicContact CZ-CD1 3.56Å; F383-I387 VanDerWaalsContact O-CD1 3.3Å; F383-I387 WeakPolarHBondContact O-CD1 3.33Å; F383-I387 WeakPolarHBondContact O-CG1 3.24Å |
| 384 | I | 82.8 | Confident | 82.8 | Confident | 3 Ų | 3 | 37.3 Ų | 37.3 | 2% | 0.015 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -75.1 | -45.3 | -172.4 | -63.3 | 172.8 | 0 | 0 | 0 | 112.2 | F137 I380 I387 G388 A485 L488 | F137-I384 HydrophobicContact CE1-CG2 4.38Å; F137-I384 HydrophobicContact CZ-CG2 3.67Å; I380-I384 HydrophobicContact CG2-CD1 3.39Å; I380-I384 HydrophobicContact CG2-CG1 4.29Å; I380-I384 WeakPolarHBondContact O-CB 3.48Å; I380-I384 WeakPolarHBondContact O-CG1 3.49Å; I380-I384 PolarHBondContact O-N 2.91Å; I384-I387 PolarHBondContact O-N 3.31Å; I384-G388 PolarHBondContact O-N 2.9Å; I384-A485 HydrophobicContact CG2-CB 4.47Å; I384-L488 HydrophobicContact CD1-CB 3.64Å; I384-L488 HydrophobicContact CD1-CD2 3.3Å; I384-L488 HydrophobicContact CD1-CG 4.01Å; I384-L488 HydrophobicContact CG1-CD2 4.2Å |
| 385 | L | 83.1 | Confident | 82.9 | Confident | 1 Ų | 1 | 35.6 Ų | 35.6 | 1% | 0.005 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.6 | -41.8 | -170.7 | -62.8 | 171.1 | 0 | 0 | 0 | 113 | L363 M366 I367 V370 S381 I387 G388 A389 D481 A485 | L363-L385 HydrophobicContact CD1-CB 3.68Å; M366-L385 HydrophobicContact CG-CD1 4.09Å; M366-L385 HydrophobicContact CG-CD2 4.12Å; I367-L385 HydrophobicContact CB-CD1 4.35Å; I367-L385 HydrophobicContact CG1-CB 4.25Å; I367-L385 HydrophobicContact CG1-CD1 3.72Å; V370-L385 HydrophobicContact CB-CD1 4.19Å; V370-L385 HydrophobicContact CG1-CD1 4.27Å; V370-L385 HydrophobicContact CG2-CD1 4.18Å; S381-L385 VanDerWaalsContact O-CB 3.27Å; S381-L385 WeakPolarHBondContact O-CB 3.24Å; S381-L385 VanDerWaalsContact O-CG 3.27Å; S381-L385 WeakPolarHBondContact O-CG 2.99Å; S381-L385 PolarHBondContact O-N 3.25Å; S381-L385 VanDerWaalsContact O-N 3.09Å; L385-I387 VanDerWaalsContact C-N 3.33Å; L385-I387 PolarHBondContact O-N 2.79Å; L385-G388 PolarHBondContact O-N 3.46Å; L385-A389 WeakPolarHBondContact O-CB 3.22Å; L385-A389 PolarHBondContact O-N 3.39Å; L385-D481 HydrophobicContact CD2-CB 3.94Å; L385-A485 HydrophobicContact CD2-CB 4.13Å; L385-A485 HydrophobicContact CG-CB 4.42Å |
| 386 | P | 76.4 | Confident | 82.8 | Confident | 49 Ų | 49 | 33.4 Ų | 33.4 | 32% | 0.318 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -65.2 | -35.2 | 175.6 | -23.3 | 35.6 | 0 | 0 | 0 | 113.5 | L363 R382 | L363-P386 HydrophobicContact CD1-CG 4.26Å; L363-P386 HydrophobicContact CD2-CB 3.95Å; L363-P386 HydrophobicContact CD2-CG 4.09Å; R382-P386 WeakPolarHBondContact O-CD 3.4Å; R382-P386 WeakPolarHBondContact O-CG 3.47Å |
| 387 | I | 78.5 | Confident | 82.9 | Confident | 15 Ų | 15 | 33 Ų | 33 | 8% | 0.077 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -71.7 | -42.9 | 176.7 | -64.2 | 171.8 | 0 | 0 | 0 | 110.2 | L121 F137 F383 I384 L385 A389 T390 V391 | L121-I387 HydrophobicContact CD2-CD1 4.27Å; L121-I387 HydrophobicContact CD2-CG2 3.58Å; F137-I387 HydrophobicContact CE2-CG2 4.25Å; F383-I387 HydrophobicContact CD2-CD1 4.01Å; F383-I387 HydrophobicContact CE1-CD1 4.19Å; F383-I387 HydrophobicContact CE2-CD1 3.5Å; F383-I387 HydrophobicContact CZ-CD1 3.56Å; F383-I387 VanDerWaalsContact O-CD1 3.3Å; F383-I387 WeakPolarHBondContact O-CD1 3.33Å; F383-I387 WeakPolarHBondContact O-CG1 3.24Å; I384-I387 PolarHBondContact O-N 3.31Å; L385-I387 VanDerWaalsContact C-N 3.33Å; L385-I387 PolarHBondContact O-N 2.79Å; I387-A389 VanDerWaalsContact C-N 3.32Å; I387-A389 PolarHBondContact O-N 3.4Å; I387-T390 PolarHBondContact O-N 3.18Å; I387-T390 PolarHBondContact O-OG1 3.48Å; I387-V391 HydrophobicContact CG2-CB 4.46Å; I387-V391 HydrophobicContact CG2-CG2 3.97Å; I387-V391 WeakPolarHBondContact O-CB 3.45Å; I387-V391 WeakPolarHBondContact O-CG2 3.3Å; I387-V391 PolarHBondContact O-N 3Å |
| 388 | G | 80.6 | Confident | 83.2 | Confident | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -60.6 | -41.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | I384 L385 T390 V391 N392 D481 | I384-G388 PolarHBondContact O-N 2.9Å; L385-G388 PolarHBondContact O-N 3.46Å; G388-T390 PolarHBondContact O-N 3.09Å; G388-V391 PolarHBondContact O-N 2.85Å; G388-N392 PolarHBondContact O-N 3.36Å; G388-D481 VanDerWaalsContact C-CG 3.46Å; G388-D481 VanDerWaalsContact C-OD1 3.31Å; G388-D481 VanDerWaalsContact CA-OD1 3.26Å; G388-D481 WeakPolarHBondContact CA-OD1 3.17Å |
| 389 | A | 77.8 | Confident | 83.7 | Confident | 5 Ų | 5 | 25.4 Ų | 25.4 | 4% | 0.041 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -60 | -15 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | L385 I387 M393 D481 | L385-A389 WeakPolarHBondContact O-CB 3.22Å; L385-A389 PolarHBondContact O-N 3.39Å; I387-A389 VanDerWaalsContact C-N 3.32Å; I387-A389 PolarHBondContact O-N 3.4Å; A389-M393 WeakPolarHBondContact O-CE 3.28Å; A389-D481 PolarHBondContact N-OD2 2.89Å; A389-D481 VanDerWaalsContact N-OD2 3.17Å |
| 390 | T | 73.3 | Confident | 84.3 | Confident | 35 Ų | 35 | 16.4 Ų | 16.4 | 22% | 0.215 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -111.4 | -41.4 | 173.4 | 56.8 | 0 | 0 | 0 | 0 | 112.5 | I387 G388 V432 | I387-T390 PolarHBondContact O-N 3.18Å; I387-T390 PolarHBondContact O-OG1 3.48Å; G388-T390 PolarHBondContact O-N 3.09Å; T390-V432 VanDerWaalsContact O-O 3.05Å |
| 391 | V | 78.4 | Confident | 84.8 | Confident | 16 Ų | 16 | 16.1 Ų | 16.1 | 10% | 0.097 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -87.6 | -40.1 | -171.7 | 177 | 0 | 0 | 0 | 0 | 112.7 | F137 I387 G388 M393 V432 | F137-V391 HydrophobicContact CD2-CG1 4.19Å; I387-V391 HydrophobicContact CG2-CB 4.46Å; I387-V391 HydrophobicContact CG2-CG2 3.97Å; I387-V391 WeakPolarHBondContact O-CB 3.45Å; I387-V391 WeakPolarHBondContact O-CG2 3.3Å; I387-V391 PolarHBondContact O-N 3Å; G388-V391 PolarHBondContact O-N 2.85Å; V391-M393 PolarHBondContact O-N 2.96Å; V391-V432 HydrophobicContact CB-CG1 4.38Å; V391-V432 HydrophobicContact CG1-CG1 4.01Å; V391-V432 HydrophobicContact CG1-CG2 4.18Å; V391-V432 HydrophobicContact CG2-CG1 4.35Å; V391-V432 WeakPolarHBondContact O-CA 3.32Å; V391-V432 WeakPolarHBondContact O-CG2 3.39Å |
| 392 | N | 88.1 | Confident | 85.5 | Confident | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 8% | 0.078 | C | C | . | . | trans | -101.8 | 89.5 | -168.4 | -179.4 | 54.5 | 0 | 0 | 0 | 111.1 | F137 T140 G388 D394 D481 | F137-N392 HydrophobicContact CB-CB 4.03Å; F137-N392 HydrophobicContact CD1-CB 3.38Å; F137-N392 HydrophobicContact CD2-CB 4.16Å; F137-N392 HydrophobicContact CE1-CB 3.71Å; F137-N392 HydrophobicContact CE2-CB 4.43Å; F137-N392 HydrophobicContact CG-CB 3.63Å; F137-N392 HydrophobicContact CZ-CB 4.21Å; T140-N392 PolarHBondContact OG1-OD1 3.26Å; G388-N392 PolarHBondContact O-N 3.36Å; N392-D394 PolarHBondContact OD1-OD1 3.3Å; N392-D481 WeakPolarHBondContact CB-OD1 3.28Å; N392-D481 PolarHBondContact ND2-N 2.91Å; N392-D481 PolarHBondContact ND2-OD1 2.85Å | ||
| 393 | M | 89.8 | Confident | 86.1 | Confident | 4 Ų | 4 | 9.3 Ų | 9.3 | 2% | 0.02 | 5% | 0.052 | C | C | . | . | trans | -118.9 | 63.4 | -178.3 | -60 | -157.1 | 177.6 | 0 | 0 | 113.1 | A389 V391 G395 A396 A397 S431 A434 N477 | A389-M393 WeakPolarHBondContact O-CE 3.28Å; V391-M393 PolarHBondContact O-N 2.96Å; M393-G395 VanDerWaalsContact C-N 3.31Å; M393-G395 PolarHBondContact O-N 3.43Å; M393-A396 HydrophobicContact CB-CB 3.79Å; M393-A396 WeakPolarHBondContact O-CB 3.25Å; M393-A396 PolarHBondContact O-N 3.32Å; M393-A396 VanDerWaalsContact O-N 3.11Å; M393-A397 PolarHBondContact O-N 2.83Å; M393-S431 WeakPolarHBondContact CB-O 3.19Å; M393-S431 WeakPolarHBondContact CG-O 3.36Å; M393-A434 WeakPolarHBondContact CE-O 3.44Å; M393-A434 HydrophobicContact SD-CB 3.51Å; M393-A434 VanDerWaalsContact SD-CB 3.51Å; M393-N477 WeakPolarHBondContact CA-OD1 3.4Å | ||
| 394 | D | 93.9 | Very high | 86.8 | Confident | 0 Ų | 0 | 6.3 Ų | 6.3 | 0% | 0 | 4% | 0.039 | C | C | . | . | H | α-helix | trans | -51.9 | -45.8 | 177.9 | -71.4 | -13.2 | 0 | 0 | 0 | 113.3 | T140 T141 A144 H322 N392 A396 A397 I398 V476 N477 | T140-D394 VanDerWaalsContact C-OD1 3.27Å; T140-D394 PolarHBondContact OG1-OD1 3.11Å; T141-D394 WeakPolarHBondContact CA-OD1 3.41Å; T141-D394 PolarHBondContact N-OD1 3.42Å; T141-D394 PolarHBondContact OG1-OD1 3.47Å; T141-D394 VanDerWaalsContact OG1-OD1 3.12Å; A144-D394 HydrophobicContact CB-CB 3.95Å; H322-D394 IonicContact CD2-OD2 4Å; H322-D394 IonicContact CE1-OD2 3.1Å; H322-D394 WeakPolarHBondContact NE2-CB 3.36Å; H322-D394 VanDerWaalsContact NE2-CG 3.3Å; H322-D394 IonicContact NE2-OD2 3.5Å; H322-D394 PolarHBondContact NE2-OD2 3.38Å; N392-D394 PolarHBondContact OD1-OD1 3.3Å; D394-A396 VanDerWaalsContact C-N 3.32Å; D394-A396 PolarHBondContact O-N 3.48Å; D394-A397 PolarHBondContact O-N 3.36Å; D394-I398 WeakPolarHBondContact O-CG1 3.39Å; D394-I398 PolarHBondContact O-N 3.45Å; D394-V476 HydrophobicContact CB-CG1 4.16Å; D394-N477 PolarHBondContact N-OD1 3.27Å |
| 395 | G | 92.3 | Very high | 87.2 | Confident | 0 Ų | 0 | 6.2 Ų | 6.2 | 0% | 0 | 4% | 0.038 | C | C | . | . | H | α-helix | trans | -64.3 | -37.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | H319 M393 F399 N477 | H319-G395 PolarHBondContact NE2-O 3.43Å; H319-G395 VanDerWaalsContact NE2-O 3.09Å; M393-G395 VanDerWaalsContact C-N 3.31Å; M393-G395 PolarHBondContact O-N 3.43Å; G395-F399 VanDerWaalsContact O-CB 3.28Å; G395-F399 WeakPolarHBondContact O-CB 3.31Å; G395-F399 PolarHBondContact O-N 2.83Å; G395-N477 VanDerWaalsContact CA-OD1 3.27Å; G395-N477 WeakPolarHBondContact CA-OD1 3.33Å; G395-N477 PolarHBondContact N-OD1 3.48Å |
| 396 | A | 89.9 | Confident | 87.5 | Confident | 3 Ų | 3 | 6.3 Ų | 6.3 | 3% | 0.025 | 4% | 0.039 | C | C | . | . | H | α-helix | trans | -68 | -40.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | M393 D394 F399 Q400 T473 N477 | M393-A396 HydrophobicContact CB-CB 3.79Å; M393-A396 WeakPolarHBondContact O-CB 3.25Å; M393-A396 PolarHBondContact O-N 3.32Å; M393-A396 VanDerWaalsContact O-N 3.11Å; D394-A396 VanDerWaalsContact C-N 3.32Å; D394-A396 PolarHBondContact O-N 3.48Å; A396-F399 PolarHBondContact O-N 3.47Å; A396-Q400 WeakPolarHBondContact O-CB 3.43Å; A396-Q400 WeakPolarHBondContact O-CG 3.41Å; A396-Q400 PolarHBondContact O-N 2.87Å; A396-T473 HydrophobicContact CB-CG2 4.22Å; A396-N477 PolarHBondContact N-OD1 2.89Å |
| 397 | A | 92.8 | Very high | 87.9 | Confident | 0 Ų | 0 | 4 Ų | 4 | 0% | 0 | 2% | 0.024 | C | C | . | . | H | α-helix | trans | -64.3 | -44.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | T141 S145 M393 D394 F399 Q400 C401 | T141-A397 HydrophobicContact CG2-CB 3.76Å; S145-A397 WeakPolarHBondContact OG-CB 3.42Å; M393-A397 PolarHBondContact O-N 2.83Å; D394-A397 PolarHBondContact O-N 3.36Å; A397-F399 PolarHBondContact O-N 2.95Å; A397-Q400 PolarHBondContact O-N 2.92Å; A397-C401 WeakPolarHBondContact O-CB 3.49Å; A397-C401 PolarHBondContact O-N 3.25Å; A397-C401 PolarHBondContact O-SG 2.86Å; A397-C401 VanDerWaalsContact O-SG 3.35Å |
| 398 | I | 94.6 | Very high | 88.3 | Confident | 0 Ų | 0 | 3.3 Ų | 3.3 | 0% | 0 | 2% | 0.02 | C | C | . | . | H | α-helix | trans | -57.2 | -51 | 172.7 | -70.8 | 159.6 | 0 | 0 | 0 | 110.6 | A144 H322 D394 Q400 C401 I402 | A144-I398 HydrophobicContact CB-CD1 3.91Å; A144-I398 HydrophobicContact CB-CG1 3.76Å; A144-I398 WeakPolarHBondContact O-CG1 3.34Å; H322-I398 HydrophobicContact CB-CD1 3.49Å; H322-I398 VanDerWaalsContact CB-CD1 3.49Å; D394-I398 WeakPolarHBondContact O-CG1 3.39Å; D394-I398 PolarHBondContact O-N 3.45Å; I398-Q400 PolarHBondContact O-N 3.44Å; I398-C401 PolarHBondContact O-N 3.27Å; I398-I402 HydrophobicContact CG2-CD1 3.67Å; I398-I402 VanDerWaalsContact O-CG1 3.29Å; I398-I402 WeakPolarHBondContact O-CG1 3.32Å; I398-I402 PolarHBondContact O-N 3.12Å |
| 399 | F | 91.4 | Very high | 88.6 | Confident | 1 Ų | 1 | 4.3 Ų | 4.3 | 0% | 0.004 | 3% | 0.025 | C | C | . | . | H | α-helix | trans | -58.8 | -48.4 | -179.1 | 163.3 | -104.9 | 0 | 0 | 0 | 111.9 | Y311 G395 A396 A397 I402 A403 I442 I445 D466 V469 | Y311-F399 VanDerWaalsContact OH-CD2 3.28Å; Y311-F399 WeakPolarHBondContact OH-CD2 3.4Å; Y311-F399 WeakPolarHBondContact OH-CE2 3.23Å; G395-F399 VanDerWaalsContact O-CB 3.28Å; G395-F399 WeakPolarHBondContact O-CB 3.31Å; G395-F399 PolarHBondContact O-N 2.83Å; A396-F399 PolarHBondContact O-N 3.47Å; A397-F399 PolarHBondContact O-N 2.95Å; F399-I402 PolarHBondContact O-N 3.3Å; F399-A403 WeakPolarHBondContact O-CB 3.42Å; F399-A403 PolarHBondContact O-N 3.35Å; F399-I442 HydrophobicContact CE1-CG1 4.15Å; F399-I442 HydrophobicContact CZ-CG1 3.81Å; F399-I445 HydrophobicContact CD1-CD1 4.01Å; F399-I445 HydrophobicContact CE1-CD1 3.28Å; F399-I445 HydrophobicContact CE1-CG1 4.18Å; F399-I445 HydrophobicContact CZ-CD1 3.6Å; F399-D466 WeakPolarHBondContact CE2-OD1 3.44Å; F399-D466 WeakPolarHBondContact CZ-OD1 3.18Å; F399-V469 HydrophobicContact CD2-CB 4.36Å; F399-V469 HydrophobicContact CD2-CG1 3.54Å; F399-V469 HydrophobicContact CE2-CB 4.36Å; F399-V469 HydrophobicContact CE2-CG1 4.01Å; F399-V469 HydrophobicContact CG-CG1 4.5Å |
| 400 | Q | 90.9 | Very high | 88.7 | Confident | 0 Ų | 0 | 4.4 Ų | 4.4 | 0% | 0 | 3% | 0.025 | C | C | . | . | H | α-helix | trans | -61.6 | -45.2 | 179.1 | -80 | 169.1 | 9.8 | 0 | 0 | 112.5 | A396 A397 I398 A403 A404 A427 T444 I445 I448 | A396-Q400 WeakPolarHBondContact O-CB 3.43Å; A396-Q400 WeakPolarHBondContact O-CG 3.41Å; A396-Q400 PolarHBondContact O-N 2.87Å; A397-Q400 PolarHBondContact O-N 2.92Å; I398-Q400 PolarHBondContact O-N 3.44Å; Q400-A403 WeakPolarHBondContact O-CB 3.22Å; Q400-A403 PolarHBondContact O-N 3.1Å; Q400-A404 WeakPolarHBondContact O-CB 3.19Å; Q400-A404 PolarHBondContact O-N 2.88Å; Q400-A427 HydrophobicContact CB-CB 4.36Å; Q400-A427 PolarHBondContact OE1-O 3.47Å; Q400-T444 VanDerWaalsContact NE2-CB 3.28Å; Q400-T444 PolarHBondContact NE2-OG1 2.73Å; Q400-I445 HydrophobicContact CB-CG1 4.3Å; Q400-I445 HydrophobicContact CG-CG1 3.85Å; Q400-I448 HydrophobicContact CB-CD1 3.56Å; Q400-I448 HydrophobicContact CG-CD1 3.95Å |
| 401 | C | 93.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 4.6 Ų | 4.6 | 0% | 0 | 3% | 0.025 | C | C | . | . | H | α-helix | trans | -64.2 | -45.4 | 177.9 | -73.4 | 0 | 0 | 0 | 0 | 112.1 | V149 A397 I398 A403 A404 V405 I423 A427 | V149-C401 HydrophobicContact CG2-CB 3.77Å; A397-C401 WeakPolarHBondContact O-CB 3.49Å; A397-C401 PolarHBondContact O-N 3.25Å; A397-C401 PolarHBondContact O-SG 2.86Å; A397-C401 VanDerWaalsContact O-SG 3.35Å; I398-C401 PolarHBondContact O-N 3.27Å; C401-A403 VanDerWaalsContact C-N 3.29Å; C401-A403 PolarHBondContact O-N 3.29Å; C401-A404 PolarHBondContact O-N 2.99Å; C401-V405 WeakPolarHBondContact O-CG2 3.35Å; C401-V405 PolarHBondContact O-N 2.91Å; C401-V405 VanDerWaalsContact O-N 3.14Å; C401-I423 HydrophobicContact CB-CG2 4.38Å; C401-A427 WeakPolarHBondContact SG-CB 3.28Å |
| 402 | I | 94.1 | Very high | 88.9 | Confident | 0 Ų | 0 | 9.3 Ų | 9.3 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -63.2 | -40.9 | 177.9 | -66.9 | 168.6 | 0 | 0 | 0 | 110.3 | G148 A152 Y311 A314 I398 F399 F406 | G148-I402 VanDerWaalsContact O-CG1 3.22Å; G148-I402 WeakPolarHBondContact O-CG1 3.46Å; A152-I402 HydrophobicContact CB-CB 4.49Å; A152-I402 HydrophobicContact CB-CG1 4.32Å; A152-I402 HydrophobicContact CB-CG2 4.43Å; Y311-I402 HydrophobicContact CD2-CG2 3.8Å; Y311-I402 HydrophobicContact CE2-CG2 3.87Å; A314-I402 HydrophobicContact CB-CG2 4.1Å; I398-I402 HydrophobicContact CG2-CD1 3.67Å; I398-I402 VanDerWaalsContact O-CG1 3.29Å; I398-I402 WeakPolarHBondContact O-CG1 3.32Å; I398-I402 PolarHBondContact O-N 3.12Å; F399-I402 PolarHBondContact O-N 3.3Å; I402-F406 WeakPolarHBondContact O-CB 3.34Å; I402-F406 PolarHBondContact O-N 3.42Å |
| 403 | A | 90.1 | Very high | 88.4 | Confident | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -60.9 | -51.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y311 F399 Q400 C401 V405 F406 I407 I445 M462 | Y311-A403 HydrophobicContact CE2-CB 4.18Å; F399-A403 WeakPolarHBondContact O-CB 3.42Å; F399-A403 PolarHBondContact O-N 3.35Å; Q400-A403 WeakPolarHBondContact O-CB 3.22Å; Q400-A403 PolarHBondContact O-N 3.1Å; C401-A403 VanDerWaalsContact C-N 3.29Å; C401-A403 PolarHBondContact O-N 3.29Å; A403-V405 VanDerWaalsContact C-N 3.32Å; A403-V405 PolarHBondContact O-N 3.43Å; A403-F406 WeakPolarHBondContact O-CB 3.43Å; A403-F406 PolarHBondContact O-N 3.48Å; A403-F406 VanDerWaalsContact O-N 3.15Å; A403-I407 PolarHBondContact O-N 3.18Å; A403-I445 HydrophobicContact CB-CD1 3.39Å; A403-I445 HydrophobicContact CB-CG1 4.02Å; A403-I445 HydrophobicContact CB-CG2 4.29Å; A403-M462 HydrophobicContact CB-CE 3.37Å; A403-M462 HydrophobicContact CB-SD 3.4Å; A403-M462 WeakPolarHBondContact CB-SD 3.37Å; A403-M462 VanDerWaalsContact O-CE 3.29Å; A403-M462 WeakPolarHBondContact O-CE 3.32Å |
| 404 | A | 89.8 | Confident | 88 | Confident | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -58.6 | -44.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q400 C401 I407 A408 I423 I448 L449 | Q400-A404 WeakPolarHBondContact O-CB 3.19Å; Q400-A404 PolarHBondContact O-N 2.88Å; C401-A404 PolarHBondContact O-N 2.99Å; A404-I407 PolarHBondContact O-N 3.33Å; A404-A408 WeakPolarHBondContact O-CB 3.21Å; A404-A408 PolarHBondContact O-N 3.06Å; A404-I423 HydrophobicContact CB-CD1 4.24Å; A404-I423 HydrophobicContact CB-CG1 4.28Å; A404-I423 HydrophobicContact CB-CG2 4.2Å; A404-I448 HydrophobicContact CB-CG2 3.75Å; A404-L449 HydrophobicContact CB-CD2 4.45Å |
| 405 | V | 91.8 | Very high | 87.4 | Confident | 1 Ų | 1 | 21.7 Ų | 21.7 | 1% | 0.006 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -67.8 | -37.7 | 177.1 | 177.3 | 0 | 0 | 0 | 0 | 111.6 | A152 F153 C401 A403 A408 Q409 L415 I423 | A152-V405 HydrophobicContact CB-CB 3.65Å; A152-V405 HydrophobicContact CB-CG1 3.56Å; A152-V405 HydrophobicContact CB-CG2 4.21Å; F153-V405 HydrophobicContact CD2-CG1 4.46Å; F153-V405 HydrophobicContact CE1-CG1 4.41Å; F153-V405 HydrophobicContact CE2-CG1 4.3Å; F153-V405 HydrophobicContact CE2-CG2 4.19Å; F153-V405 HydrophobicContact CZ-CG1 4.27Å; C401-V405 WeakPolarHBondContact O-CG2 3.35Å; C401-V405 PolarHBondContact O-N 2.91Å; C401-V405 VanDerWaalsContact O-N 3.14Å; A403-V405 VanDerWaalsContact C-N 3.32Å; A403-V405 PolarHBondContact O-N 3.43Å; V405-A408 PolarHBondContact O-N 3.21Å; V405-Q409 HydrophobicContact CG1-CG 4.42Å; V405-Q409 WeakPolarHBondContact O-CB 3.49Å; V405-Q409 VanDerWaalsContact O-CG 3.25Å; V405-Q409 WeakPolarHBondContact O-CG 3.42Å; V405-Q409 PolarHBondContact O-N 3.35Å; V405-L415 HydrophobicContact CB-CD1 4.38Å; V405-L415 HydrophobicContact CG1-CD1 4.43Å; V405-L415 HydrophobicContact CG2-CD1 3.96Å; V405-I423 HydrophobicContact CG2-CD1 4.47Å |
| 406 | F | 90.2 | Very high | 87 | Confident | 3 Ų | 3 | 25.5 Ų | 25.5 | 1% | 0.013 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.8 | -45 | 175.3 | 171.3 | -103.8 | 0 | 0 | 0 | 112.2 | P157 L308 Y311 I402 A403 Q409 L410 M462 | P157-F406 HydrophobicContact CB-CD2 3.75Å; P157-F406 HydrophobicContact CB-CE2 4.28Å; P157-F406 HydrophobicContact CG-CB 4.22Å; P157-F406 HydrophobicContact CG-CD2 3.87Å; L308-F406 HydrophobicContact CD2-CE1 4.25Å; L308-F406 HydrophobicContact CD2-CZ 4.01Å; Y311-F406 HydrophobicContact CD2-CB 4.05Å; Y311-F406 HydrophobicContact CD2-CD1 4.25Å; Y311-F406 HydrophobicContact CD2-CD2 4.43Å; Y311-F406 AromaticContact CD2-CG 4Å; Y311-F406 HydrophobicContact CD2-CG 4Å; Y311-F406 HydrophobicContact CG-CG 4.44Å; I402-F406 WeakPolarHBondContact O-CB 3.34Å; I402-F406 PolarHBondContact O-N 3.42Å; A403-F406 WeakPolarHBondContact O-CB 3.43Å; A403-F406 PolarHBondContact O-N 3.48Å; A403-F406 VanDerWaalsContact O-N 3.15Å; F406-Q409 PolarHBondContact O-N 2.97Å; F406-L410 HydrophobicContact CD1-CD1 3.8Å; F406-L410 HydrophobicContact CE1-CD1 3.21Å; F406-L410 HydrophobicContact CE1-CG 4.29Å; F406-L410 HydrophobicContact CE2-CD1 4.11Å; F406-L410 HydrophobicContact CE2-CG 4.4Å; F406-L410 HydrophobicContact CZ-CD1 3.4Å; F406-L410 HydrophobicContact CZ-CG 4.12Å; F406-L410 WeakPolarHBondContact O-CB 3.31Å; F406-L410 PolarHBondContact O-N 2.99Å; F406-M462 HydrophobicContact CB-CE 4.38Å; F406-M462 HydrophobicContact CD1-CE 3.45Å; F406-M462 VanDerWaalsContact CD1-CE 3.45Å; F406-M462 HydrophobicContact CE1-CE 4.19Å; F406-M462 HydrophobicContact CG-CE 4.36Å |
| 407 | I | 85.3 | Confident | 86.6 | Confident | 1 Ų | 1 | 28.8 Ų | 28.8 | 1% | 0.005 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -66.6 | -38.9 | 177.9 | -70.7 | 169.9 | 0 | 0 | 0 | 111.2 | A403 A404 Q409 L410 N411 L449 L454 D458 M462 | A403-I407 PolarHBondContact O-N 3.18Å; A404-I407 PolarHBondContact O-N 3.33Å; I407-Q409 VanDerWaalsContact C-N 3.34Å; I407-Q409 PolarHBondContact O-N 3.38Å; I407-L410 WeakPolarHBondContact O-CB 2.98Å; I407-L410 PolarHBondContact O-N 3.43Å; I407-N411 PolarHBondContact O-N 3.45Å; I407-N411 PolarHBondContact O-ND2 3.14Å; I407-L449 HydrophobicContact CB-CD2 4.02Å; I407-L449 HydrophobicContact CD1-CD1 3.56Å; I407-L449 HydrophobicContact CD1-CD2 4.03Å; I407-L449 HydrophobicContact CD1-CG 4.38Å; I407-L449 HydrophobicContact CG2-CD1 4.47Å; I407-L449 HydrophobicContact CG2-CD2 3.91Å; I407-L454 HydrophobicContact CG2-CD1 4.43Å; I407-D458 HydrophobicContact CG1-CB 4.36Å; I407-D458 HydrophobicContact CG2-CB 4.31Å; I407-M462 HydrophobicContact CD1-CE 3.44Å; I407-M462 VanDerWaalsContact CD1-CE 3.44Å; I407-M462 HydrophobicContact CD1-SD 3.93Å; I407-M462 HydrophobicContact CG1-CE 3.46Å; I407-M462 VanDerWaalsContact CG1-CE 3.46Å |
| 408 | A | 86.1 | Confident | 85.7 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.4 | -46.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | A404 V405 N411 N412 T413 L415 L454 | A404-A408 WeakPolarHBondContact O-CB 3.21Å; A404-A408 PolarHBondContact O-N 3.06Å; V405-A408 PolarHBondContact O-N 3.21Å; A408-N411 CarbonylContact O-C 3.29Å; A408-N411 PolarHBondContact O-N 3.38Å; A408-N412 PolarHBondContact O-N 3.02Å; A408-T413 PolarHBondContact O-N 2.8Å; A408-L415 HydrophobicContact CB-CD1 3.67Å; A408-L415 HydrophobicContact CB-CD2 3.76Å; A408-L415 HydrophobicContact CB-CG 3.63Å; A408-L454 HydrophobicContact CB-CD1 3.62Å |
| 409 | Q | 87 | Confident | 85 | Confident | 22 Ų | 22 | 30.9 Ų | 30.9 | 10% | 0.103 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.3 | -38.8 | 177.4 | -71.3 | 172.6 | 6.2 | 0 | 0 | 112.4 | A152 P157 V159 V405 F406 I407 N411 N412 | A152-Q409 PolarHBondContact O-NE2 3.26Å; P157-Q409 VanDerWaalsContact CD-OE1 3.3Å; V159-Q409 HydrophobicContact CG2-CB 4.29Å; V159-Q409 HydrophobicContact CG2-CG 4.15Å; V405-Q409 HydrophobicContact CG1-CG 4.42Å; V405-Q409 WeakPolarHBondContact O-CB 3.49Å; V405-Q409 VanDerWaalsContact O-CG 3.25Å; V405-Q409 WeakPolarHBondContact O-CG 3.42Å; V405-Q409 PolarHBondContact O-N 3.35Å; F406-Q409 PolarHBondContact O-N 2.97Å; I407-Q409 VanDerWaalsContact C-N 3.34Å; I407-Q409 PolarHBondContact O-N 3.38Å; Q409-N411 VanDerWaalsContact C-N 3.29Å; Q409-N411 PolarHBondContact O-N 3.09Å; Q409-N412 PolarHBondContact O-N 3.19Å; Q409-N412 VanDerWaalsContact O-N 3.16Å |
| 410 | L | 79.8 | Confident | 84.8 | Confident | 7 Ų | 7 | 33.1 Ų | 33.1 | 4% | 0.037 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60.2 | -38.8 | 174.8 | -106.1 | 168.6 | 0 | 0 | 0 | 112 | A161 G162 F406 I407 N412 L461 | A161-L410 HydrophobicContact CB-CD2 3.57Å; A161-L410 HydrophobicContact CB-CG 4.44Å; G162-L410 WeakPolarHBondContact CA-O 3.42Å; F406-L410 HydrophobicContact CD1-CD1 3.8Å; F406-L410 HydrophobicContact CE1-CD1 3.21Å; F406-L410 HydrophobicContact CE1-CG 4.29Å; F406-L410 HydrophobicContact CE2-CD1 4.11Å; F406-L410 HydrophobicContact CE2-CG 4.4Å; F406-L410 HydrophobicContact CZ-CD1 3.4Å; F406-L410 HydrophobicContact CZ-CG 4.12Å; F406-L410 WeakPolarHBondContact O-CB 3.31Å; F406-L410 PolarHBondContact O-N 2.99Å; I407-L410 WeakPolarHBondContact O-CB 2.98Å; I407-L410 PolarHBondContact O-N 3.43Å; L410-N412 VanDerWaalsContact C-N 3.25Å; L410-N412 PolarHBondContact O-N 2.9Å; L410-L461 HydrophobicContact CD1-CD1 4.29Å |
| 411 | N | 77.1 | Confident | 84.6 | Confident | 39 Ų | 39 | 38.4 Ų | 38.4 | 21% | 0.209 | 21% | 0.205 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88 | 13.2 | 178.5 | -72.2 | -58.9 | 0 | 0 | 0 | 113.5 | N165 I407 A408 Q409 T413 D458 | N165-N411 PolarHBondContact ND2-OD1 2.9Å; I407-N411 PolarHBondContact O-N 3.45Å; I407-N411 PolarHBondContact O-ND2 3.14Å; A408-N411 CarbonylContact O-C 3.29Å; A408-N411 PolarHBondContact O-N 3.38Å; Q409-N411 VanDerWaalsContact C-N 3.29Å; Q409-N411 PolarHBondContact O-N 3.09Å; N411-T413 PolarHBondContact O-N 2.91Å; N411-T413 PolarHBondContact O-OG1 3.43Å; N411-D458 PolarHBondContact ND2-OD2 3.44Å; N411-D458 PolarHBondContact OD1-OD2 3.37Å |
| 412 | N | 78.4 | Confident | 83.8 | Confident | 115 Ų | 115 | 38.7 Ų | 38.7 | 62% | 0.615 | 21% | 0.207 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 49.5 | 30.5 | -175.3 | -55 | -60.1 | 0 | 0 | 0 | 113.3 | G162 A408 Q409 L410 | G162-N412 PolarHBondContact O-ND2 2.96Å; A408-N412 PolarHBondContact O-N 3.02Å; Q409-N412 PolarHBondContact O-N 3.19Å; Q409-N412 VanDerWaalsContact O-N 3.16Å; L410-N412 VanDerWaalsContact C-N 3.25Å; L410-N412 PolarHBondContact O-N 2.9Å |
| 413 | T | 78.2 | Confident | 83.5 | Confident | 55 Ų | 55 | 38.7 Ų | 38.7 | 34% | 0.337 | 21% | 0.207 | S | C | . | . | P | Polyproline II helix | trans | -94.5 | 118.4 | 179.5 | -56.2 | 0 | 0 | 0 | 0 | 108.9 | A408 N411 L415 L454 | A408-T413 PolarHBondContact O-N 2.8Å; N411-T413 PolarHBondContact O-N 2.91Å; N411-T413 PolarHBondContact O-OG1 3.43Å; T413-L415 PolarHBondContact O-N 3.01Å; T413-L454 HydrophobicContact CG2-CD2 3.96Å |
| 414 | E | 80.8 | Confident | 83.5 | Confident | 183 Ų | 183 | 40.6 Ų | 40.6 | 86% | 0.855 | 22% | 0.217 | S | C | * | . | P | Polyproline II helix | trans | -74.7 | 123.8 | 174.1 | -65.2 | -170.2 | 169.3 | 0 | 0 | 110 | ||
| 415 | L | 82.6 | Confident | 83.2 | Confident | 25 Ų | 25 | 43.5 Ų | 43.5 | 13% | 0.131 | 24% | 0.235 | C | C | . | . | P | Polyproline II helix | trans | -82.2 | 123.8 | 177.5 | -67 | 172.4 | 0 | 0 | 0 | 110.3 | F153 V405 A408 T413 Q419 I420 I423 I452 | F153-L415 HydrophobicContact CZ-CB 4.25Å; F153-L415 HydrophobicContact CZ-CD1 4.09Å; V405-L415 HydrophobicContact CB-CD1 4.38Å; V405-L415 HydrophobicContact CG1-CD1 4.43Å; V405-L415 HydrophobicContact CG2-CD1 3.96Å; A408-L415 HydrophobicContact CB-CD1 3.67Å; A408-L415 HydrophobicContact CB-CD2 3.76Å; A408-L415 HydrophobicContact CB-CG 3.63Å; T413-L415 PolarHBondContact O-N 3.01Å; L415-Q419 HydrophobicContact CD2-CB 4.11Å; L415-I420 HydrophobicContact CB-CG1 4.12Å; L415-I423 HydrophobicContact CD1-CD1 3.79Å; L415-I423 HydrophobicContact CD2-CD1 4.25Å; L415-I452 HydrophobicContact CD2-CD1 4.25Å |
| 416 | N | 83.3 | Confident | 82.5 | Confident | 80 Ų | 80 | 43.6 Ų | 43.6 | 43% | 0.428 | 24% | 0.235 | S | C | . | . | P | Polyproline II helix | trans | -75.9 | 159.4 | 172.3 | -157.4 | -50 | 0 | 0 | 0 | 111.1 | T180 G418 Q419 I420 | T180-N416 HydrophobicContact CG2-CB 4.15Å; T180-N416 WeakPolarHBondContact CG2-ND2 3.29Å; N416-G418 PolarHBondContact O-N 3.39Å; N416-G418 VanDerWaalsContact O-N 3.12Å; N416-Q419 PolarHBondContact O-N 2.94Å; N416-I420 WeakPolarHBondContact O-CG1 3.38Å; N416-I420 PolarHBondContact O-N 3.21Å |
| 417 | A | 81.5 | Confident | 82.4 | Confident | 73 Ų | 73 | 43.5 Ų | 43.5 | 60% | 0.603 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -50.8 | -36.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | I420 F421 | A417-I420 PolarHBondContact O-N 3.26Å; A417-F421 PolarHBondContact O-N 3.18Å |
| 418 | G | 74.2 | Confident | 82.4 | Confident | 6 Ų | 6 | 44.1 Ų | 44.1 | 6% | 0.062 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -66.7 | -43.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114 | N416 I420 F421 T422 | N416-G418 PolarHBondContact O-N 3.39Å; N416-G418 VanDerWaalsContact O-N 3.12Å; G418-I420 VanDerWaalsContact C-N 3.32Å; G418-I420 PolarHBondContact O-N 2.98Å; G418-F421 PolarHBondContact O-N 3.37Å; G418-T422 PolarHBondContact O-N 3.29Å; G418-T422 PolarHBondContact O-OG1 3.25Å; G418-T422 VanDerWaalsContact O-OG1 3.04Å |
| 419 | Q | 79.6 | Confident | 82 | Confident | 37 Ų | 37 | 45.4 Ų | 45.4 | 17% | 0.173 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66.3 | -36 | 175.3 | -69.1 | 168 | -54.3 | 0 | 0 | 111.4 | L415 N416 T422 I423 I452 | L415-Q419 HydrophobicContact CD2-CB 4.11Å; N416-Q419 PolarHBondContact O-N 2.94Å; Q419-T422 WeakPolarHBondContact O-CB 3.37Å; Q419-T422 PolarHBondContact O-N 3.39Å; Q419-I423 VanDerWaalsContact O-CG1 3.26Å; Q419-I423 WeakPolarHBondContact O-CG1 3.4Å; Q419-I423 PolarHBondContact O-N 3.49Å; Q419-I452 HydrophobicContact CB-CB 4.47Å; Q419-I452 HydrophobicContact CB-CG2 4.15Å; Q419-I452 HydrophobicContact CG-CB 4.4Å; Q419-I452 HydrophobicContact CG-CG2 4.45Å; Q419-I452 PolarHBondContact NE2-O 3.33Å |
| 420 | I | 87.7 | Confident | 81.5 | Confident | 49 Ų | 49 | 44.5 Ų | 44.5 | 25% | 0.251 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -62.5 | -45.3 | 174.5 | -65.9 | 169.6 | 0 | 0 | 0 | 110.9 | V149 F153 L415 N416 A417 G418 T422 I423 L424 | V149-I420 HydrophobicContact CG1-CG2 3.87Å; F153-I420 HydrophobicContact CE2-CD1 3.74Å; F153-I420 HydrophobicContact CE2-CG1 4.02Å; F153-I420 HydrophobicContact CZ-CD1 3.69Å; F153-I420 HydrophobicContact CZ-CG1 4.05Å; L415-I420 HydrophobicContact CB-CG1 4.12Å; N416-I420 WeakPolarHBondContact O-CG1 3.38Å; N416-I420 PolarHBondContact O-N 3.21Å; A417-I420 PolarHBondContact O-N 3.26Å; G418-I420 VanDerWaalsContact C-N 3.32Å; G418-I420 PolarHBondContact O-N 2.98Å; I420-T422 VanDerWaalsContact C-N 3.34Å; I420-I423 PolarHBondContact O-N 3Å; I420-L424 PolarHBondContact O-N 2.87Å |
| 421 | F | 84.8 | Confident | 81.5 | Confident | 110 Ų | 110 | 44.2 Ų | 44.2 | 48% | 0.482 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.3 | -44.2 | 174.9 | 179.2 | -95.3 | 0 | 0 | 0 | 111.5 | F184 A417 G418 I423 L424 V425 | F184-F421 HydrophobicContact CE1-CB 4.5Å; F184-F421 AromaticContact CE1-CD1 3.83Å; F184-F421 HydrophobicContact CE1-CD1 3.83Å; F184-F421 HydrophobicContact CE1-CG 4.45Å; A417-F421 PolarHBondContact O-N 3.18Å; G418-F421 PolarHBondContact O-N 3.37Å; F421-I423 PolarHBondContact O-N 3.21Å; F421-L424 PolarHBondContact O-N 3.31Å; F421-V425 HydrophobicContact CD1-CG2 4.27Å; F421-V425 HydrophobicContact CD2-CG2 4.47Å; F421-V425 HydrophobicContact CE1-CG2 3.78Å; F421-V425 HydrophobicContact CE2-CG2 4Å; F421-V425 HydrophobicContact CZ-CG2 3.64Å; F421-V425 PolarHBondContact O-N 3.42Å |
| 422 | T | 78.1 | Confident | 81.3 | Confident | 6 Ų | 6 | 43.5 Ų | 43.5 | 4% | 0.037 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -57.3 | -47.2 | 174 | -59.5 | 0 | 0 | 0 | 0 | 111.2 | L187 G418 Q419 I420 L424 V425 T426 A451 I452 | L187-T422 HydrophobicContact CD1-CG2 3.77Å; L187-T422 HydrophobicContact CD2-CG2 4.13Å; G418-T422 PolarHBondContact O-N 3.29Å; G418-T422 PolarHBondContact O-OG1 3.25Å; G418-T422 VanDerWaalsContact O-OG1 3.04Å; Q419-T422 WeakPolarHBondContact O-CB 3.37Å; Q419-T422 PolarHBondContact O-N 3.39Å; I420-T422 VanDerWaalsContact C-N 3.34Å; T422-L424 VanDerWaalsContact C-N 3.31Å; T422-L424 PolarHBondContact O-N 3.05Å; T422-V425 PolarHBondContact O-N 2.68Å; T422-T426 HydrophobicContact CG2-CG2 3.85Å; T422-T426 VanDerWaalsContact O-CB 3.24Å; T422-T426 WeakPolarHBondContact O-CB 3.48Å; T422-T426 WeakPolarHBondContact O-CG2 3.29Å; T422-T426 PolarHBondContact O-N 2.94Å; T422-T426 PolarHBondContact O-OG1 2.92Å; T422-A451 HydrophobicContact CG2-CB 3.99Å; T422-I452 HydrophobicContact CG2-CG2 3.92Å |
| 423 | I | 88.3 | Confident | 80.4 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -56.5 | -46 | 176.3 | -70.4 | 163.6 | 0 | 0 | 0 | 110.7 | V149 C401 A404 V405 L415 Q419 I420 F421 T426 A427 I448 I452 | V149-I423 HydrophobicContact CG2-CG2 4.17Å; C401-I423 HydrophobicContact CB-CG2 4.38Å; A404-I423 HydrophobicContact CB-CD1 4.24Å; A404-I423 HydrophobicContact CB-CG1 4.28Å; A404-I423 HydrophobicContact CB-CG2 4.2Å; V405-I423 HydrophobicContact CG2-CD1 4.47Å; L415-I423 HydrophobicContact CD1-CD1 3.79Å; L415-I423 HydrophobicContact CD2-CD1 4.25Å; Q419-I423 VanDerWaalsContact O-CG1 3.26Å; Q419-I423 WeakPolarHBondContact O-CG1 3.4Å; Q419-I423 PolarHBondContact O-N 3.49Å; I420-I423 PolarHBondContact O-N 3Å; F421-I423 PolarHBondContact O-N 3.21Å; I423-T426 PolarHBondContact O-OG1 3.03Å; I423-A427 WeakPolarHBondContact O-CB 3.47Å; I423-A427 PolarHBondContact O-N 3.36Å; I423-I448 HydrophobicContact CB-CG2 4.3Å; I423-I448 HydrophobicContact CG1-CG2 3.94Å; I423-I448 HydrophobicContact CG2-CG2 4.2Å; I423-I452 HydrophobicContact CD1-CD1 3.81Å; I423-I452 HydrophobicContact CD1-CG2 4.46Å; I423-I452 HydrophobicContact CG1-CD1 3.9Å; I423-I452 HydrophobicContact CG1-CG2 3.85Å |
| 424 | L | 89.4 | Confident | 79.8 | Confident | 40 Ų | 40 | 35.7 Ų | 35.7 | 21% | 0.209 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.6 | -48.4 | -177.1 | -167 | 77.9 | 0 | 0 | 0 | 112.1 | L142 S145 G146 I420 F421 T422 T428 | L142-L424 HydrophobicContact CD1-CD2 3.79Å; L142-L424 HydrophobicContact CD1-CG 3.86Å; S145-L424 VanDerWaalsContact C-CD1 3.49Å; S145-L424 VanDerWaalsContact CB-CD1 3.43Å; G146-L424 VanDerWaalsContact N-CD1 3.33Å; I420-L424 PolarHBondContact O-N 2.87Å; F421-L424 PolarHBondContact O-N 3.31Å; T422-L424 VanDerWaalsContact C-N 3.31Å; T422-L424 PolarHBondContact O-N 3.05Å; L424-T428 WeakPolarHBondContact O-CB 3.21Å; L424-T428 PolarHBondContact O-N 2.61Å; L424-T428 VanDerWaalsContact O-N 3.14Å; L424-T428 PolarHBondContact O-OG1 2.87Å |
| 425 | V | 82.5 | Confident | 78.7 | Confident | 62 Ų | 62 | 27.4 Ų | 27.4 | 38% | 0.376 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -71.5 | -43.7 | -178.6 | 175.6 | 0 | 0 | 0 | 0 | 111.1 | F421 T422 T428 A429 | F421-V425 HydrophobicContact CD1-CG2 4.27Å; F421-V425 HydrophobicContact CD2-CG2 4.47Å; F421-V425 HydrophobicContact CE1-CG2 3.78Å; F421-V425 HydrophobicContact CE2-CG2 4Å; F421-V425 HydrophobicContact CZ-CG2 3.64Å; F421-V425 PolarHBondContact O-N 3.42Å; T422-V425 PolarHBondContact O-N 2.68Å; V425-T428 PolarHBondContact O-N 2.85Å; V425-A429 WeakPolarHBondContact O-CB 3.37Å; V425-A429 PolarHBondContact O-N 3.45Å |
| 426 | T | 78.3 | Confident | 77.6 | Confident | 3 Ų | 3 | 26.4 Ų | 26.4 | 2% | 0.018 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -68.3 | -37.9 | -179.9 | 55.9 | 0 | 0 | 0 | 0 | 111.9 | L187 L238 T422 I423 A429 S430 A451 | L187-T426 HydrophobicContact CD1-CG2 4.26Å; L238-T426 HydrophobicContact CD1-CG2 4.29Å; L238-T426 HydrophobicContact CD2-CG2 4.38Å; T422-T426 HydrophobicContact CG2-CG2 3.85Å; T422-T426 VanDerWaalsContact O-CB 3.24Å; T422-T426 WeakPolarHBondContact O-CB 3.48Å; T422-T426 WeakPolarHBondContact O-CG2 3.29Å; T422-T426 PolarHBondContact O-N 2.94Å; T422-T426 PolarHBondContact O-OG1 2.92Å; I423-T426 PolarHBondContact O-OG1 3.03Å; T426-A429 PolarHBondContact O-N 2.77Å; T426-S430 WeakPolarHBondContact O-CA 3.46Å; T426-S430 WeakPolarHBondContact O-CB 3.44Å; T426-S430 PolarHBondContact O-N 3.1Å; T426-A451 HydrophobicContact CG2-CB 3.97Å |
| 427 | A | 87.4 | Confident | 76.6 | Confident | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.9 | -45.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q400 C401 I423 A429 S430 S431 I448 | Q400-A427 HydrophobicContact CB-CB 4.36Å; Q400-A427 PolarHBondContact OE1-O 3.47Å; C401-A427 WeakPolarHBondContact SG-CB 3.28Å; I423-A427 WeakPolarHBondContact O-CB 3.47Å; I423-A427 PolarHBondContact O-N 3.36Å; A427-A429 PolarHBondContact O-N 3.41Å; A427-S430 PolarHBondContact O-N 3Å; A427-S431 WeakPolarHBondContact O-CB 3.5Å; A427-S431 PolarHBondContact O-N 2.96Å; A427-S431 PolarHBondContact O-OG 2.78Å; A427-I448 HydrophobicContact CB-CD1 3.81Å |
| 428 | T | 85.9 | Confident | 75.7 | Confident | 14 Ų | 14 | 21.3 Ų | 21.3 | 9% | 0.086 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -63.4 | -42 | 177.5 | -57.1 | 0 | 0 | 0 | 0 | 112.1 | T141 S145 L424 V425 S431 | T141-T428 HydrophobicContact CG2-CG2 3.81Å; S145-T428 PolarHBondContact OG-OG1 2.84Å; L424-T428 WeakPolarHBondContact O-CB 3.21Å; L424-T428 PolarHBondContact O-N 2.61Å; L424-T428 VanDerWaalsContact O-N 3.14Å; L424-T428 PolarHBondContact O-OG1 2.87Å; V425-T428 PolarHBondContact O-N 2.85Å; T428-S431 PolarHBondContact O-OG 3.03Å |
| 429 | A | 76.2 | Confident | 75.2 | Confident | 27 Ų | 27 | 21.8 Ų | 21.8 | 22% | 0.223 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -70.6 | -37.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V425 T426 A427 | V425-A429 WeakPolarHBondContact O-CB 3.37Å; V425-A429 PolarHBondContact O-N 3.45Å; T426-A429 PolarHBondContact O-N 2.77Å; A427-A429 PolarHBondContact O-N 3.41Å |
| 430 | S | 76.8 | Confident | 74.4 | Confident | 4 Ų | 4 | 20.2 Ų | 20.2 | 3% | 0.028 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -74.1 | -29.2 | -178.4 | -173.7 | 0 | 0 | 0 | 0 | 113 | T426 A427 V432 G433 A434 T444 I447 | T426-S430 WeakPolarHBondContact O-CA 3.46Å; T426-S430 WeakPolarHBondContact O-CB 3.44Å; T426-S430 PolarHBondContact O-N 3.1Å; A427-S430 PolarHBondContact O-N 3Å; S430-V432 VanDerWaalsContact C-N 3.29Å; S430-G433 PolarHBondContact O-N 2.98Å; S430-A434 PolarHBondContact O-N 3.04Å; S430-A434 VanDerWaalsContact O-N 3.09Å; S430-T444 WeakPolarHBondContact OG-CB 2.99Å; S430-T444 VanDerWaalsContact OG-CG2 3.24Å; S430-T444 WeakPolarHBondContact OG-CG2 3.4Å; S430-I447 WeakPolarHBondContact OG-CD1 3.44Å |
| 431 | S | 79.8 | Confident | 73.4 | Confident | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -67.7 | -31 | 177.1 | 64.3 | 0 | 0 | 0 | 0 | 111.8 | T141 M393 A427 T428 G433 A434 | T141-S431 WeakPolarHBondContact CG2-OG 3.44Å; M393-S431 WeakPolarHBondContact CB-O 3.19Å; M393-S431 WeakPolarHBondContact CG-O 3.36Å; A427-S431 WeakPolarHBondContact O-CB 3.5Å; A427-S431 PolarHBondContact O-N 2.96Å; A427-S431 PolarHBondContact O-OG 2.78Å; T428-S431 PolarHBondContact O-OG 3.03Å; S431-G433 VanDerWaalsContact C-N 3.26Å; S431-G433 PolarHBondContact O-N 3.3Å; S431-A434 PolarHBondContact O-N 3.39Å |
| 432 | V | 72.9 | Confident | 72.6 | Confident | 24 Ų | 24 | 13.1 Ų | 13.1 | 15% | 0.145 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -66.3 | -29.2 | 171.7 | 177.4 | 0 | 0 | 0 | 0 | 112.2 | L114 M245 T390 V391 S430 | L114-V432 HydrophobicContact CD2-CG1 4.07Å; M245-V432 HydrophobicContact SD-CG1 4.49Å; T390-V432 VanDerWaalsContact O-O 3.05Å; V391-V432 HydrophobicContact CB-CG1 4.38Å; V391-V432 HydrophobicContact CG1-CG1 4.01Å; V391-V432 HydrophobicContact CG1-CG2 4.18Å; V391-V432 HydrophobicContact CG2-CG1 4.35Å; V391-V432 WeakPolarHBondContact O-CA 3.32Å; V391-V432 WeakPolarHBondContact O-CG2 3.39Å; S430-V432 VanDerWaalsContact C-N 3.29Å |
| 433 | G | 59.6 | Low | 72 | Confident | 3 Ų | 3 | 13.6 Ų | 13.6 | 3% | 0.031 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -92.7 | -6.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | L114 S430 S431 A435 | L114-G433 VanDerWaalsContact CD2-CA 3.46Å; S430-G433 PolarHBondContact O-N 2.98Å; S431-G433 VanDerWaalsContact C-N 3.26Å; S431-G433 PolarHBondContact O-N 3.3Å; G433-A435 PolarHBondContact O-N 3.45Å |
| 434 | A | 65.4 | Low | 71.4 | Confident | 4 Ų | 4 | 13.8 Ų | 13.8 | 3% | 0.033 | 9% | 0.091 | C | C | . | . | S | Bend | trans | -70.8 | 119.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 107.8 | M393 S430 S431 T444 | M393-A434 WeakPolarHBondContact CE-O 3.44Å; M393-A434 HydrophobicContact SD-CB 3.51Å; M393-A434 VanDerWaalsContact SD-CB 3.51Å; S430-A434 PolarHBondContact O-N 3.04Å; S430-A434 VanDerWaalsContact O-N 3.09Å; S431-A434 PolarHBondContact O-N 3.39Å; A434-T444 HydrophobicContact CB-CG2 4.16Å |
| 435 | A | 59.1 | Low | 70.9 | Confident | 9 Ų | 9 | 11.9 Ų | 11.9 | 7% | 0.074 | 8% | 0.081 | C | C | . | . | trans | -67.1 | 150.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | L109 G433 I437 | L109-A435 HydrophobicContact CD1-CB 4.18Å; L109-A435 HydrophobicContact CD2-CB 4.19Å; L109-A435 HydrophobicContact CG-CB 4.32Å; G433-A435 PolarHBondContact O-N 3.45Å; A435-I437 HydrophobicContact CB-CD1 4.28Å; A435-I437 HydrophobicContact CB-CG1 4.04Å; A435-I437 HydrophobicContact CB-CG2 4.25Å; A435-I437 PolarHBondContact O-N 3.42Å | ||
| 436 | G | 59.5 | Low | 70.2 | Confident | 4 Ų | 4 | 9.3 Ų | 9.3 | 4% | 0.041 | 7% | 0.066 | C | C | . | . | S | Bend | trans | -71.5 | 45.4 | -179 | 0 | 0 | 0 | 0 | 0 | 113.4 | S358 S359 S360 | S358-G436 WeakPolarHBondContact CA-O 3.33Å; S358-G436 WeakPolarHBondContact CB-O 3.45Å; S358-G436 PolarHBondContact OG-O 3.35Å; S359-G436 PolarHBondContact N-O 2.95Å; S360-G436 PolarHBondContact N-O 3.35Å |
| 437 | I | 62.3 | Low | 69.6 | Low | 13 Ų | 13 | 9.5 Ų | 9.5 | 7% | 0.067 | 7% | 0.067 | C | C | . | . | S | Bend | trans | -109.9 | 153.2 | -174.1 | 57.5 | 173.1 | 0 | 0 | 0 | 111.8 | L109 M273 V276 A435 G440 | L109-I437 HydrophobicContact CD2-CD1 3.65Å; M273-I437 HydrophobicContact CE-CG2 3.06Å; M273-I437 HydrophobicContact SD-CG2 3.44Å; M273-I437 WeakPolarHBondContact SD-CG2 3.09Å; V276-I437 HydrophobicContact CG1-CD1 4.19Å; V276-I437 HydrophobicContact CG2-CD1 4.36Å; A435-I437 HydrophobicContact CB-CD1 4.28Å; A435-I437 HydrophobicContact CB-CG1 4.04Å; A435-I437 HydrophobicContact CB-CG2 4.25Å; A435-I437 PolarHBondContact O-N 3.42Å; I437-G440 PolarHBondContact O-N 2.83Å |
| 438 | P | 61.7 | Low | 69.2 | Low | 32 Ų | 32 | 9.5 Ų | 9.5 | 21% | 0.208 | 7% | 0.067 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | 140.7 | 173.8 | -21.9 | 34 | 0 | 0 | 0 | 111.7 | M280 C357 G440 D470 | M280-P438 HydrophobicContact CE-CB 3.53Å; M280-P438 HydrophobicContact CE-CG 4.04Å; M280-P438 HydrophobicContact SD-CB 4.25Å; C357-P438 HydrophobicContact CB-CB 4.08Å; C357-P438 HydrophobicContact CB-CG 4.29Å; C357-P438 VanDerWaalsContact O-CA 3.3Å; C357-P438 WeakPolarHBondContact O-CA 3.34Å; C357-P438 WeakPolarHBondContact O-CG 3.32Å; P438-G440 PolarHBondContact O-N 3.38Å; P438-D470 WeakPolarHBondContact CA-OD2 3.41Å |
| 439 | A | 64.7 | Low | 68.6 | Low | 17 Ų | 17 | 8.8 Ų | 8.8 | 14% | 0.14 | 6% | 0.063 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 57.4 | 12.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | G441 I442 D470 | A439-G441 PolarHBondContact O-N 3.08Å; A439-I442 PolarHBondContact O-N 3.2Å; A439-D470 PolarHBondContact N-OD2 3.31Å |
| 440 | G | 61.3 | Low | 68.1 | Low | 4 Ų | 4 | 10.7 Ų | 10.7 | 4% | 0.041 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -61.2 | -32.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | I437 P438 I442 I443 T444 | I437-G440 PolarHBondContact O-N 2.83Å; P438-G440 PolarHBondContact O-N 3.38Å; G440-I442 VanDerWaalsContact C-N 3.29Å; G440-I442 PolarHBondContact O-N 3.48Å; G440-I443 PolarHBondContact O-N 2.9Å; G440-T444 PolarHBondContact O-OG1 3.03Å |
| 441 | G | 66.6 | Low | 67.4 | Low | 6 Ų | 6 | 12.2 Ų | 12.2 | 6% | 0.062 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -61.4 | -31.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | A439 T444 I445 | A439-G441 PolarHBondContact O-N 3.08Å; G441-T444 VanDerWaalsContact CA-OG1 3.29Å; G441-T444 WeakPolarHBondContact CA-OG1 3.21Å; G441-T444 PolarHBondContact O-N 3.48Å; G441-T444 PolarHBondContact O-OG1 2.95Å; G441-I445 WeakPolarHBondContact O-CG1 3.33Å; G441-I445 PolarHBondContact O-N 3.36Å |
| 442 | I | 69.3 | Low | 67 | Low | 3 Ų | 3 | 12.9 Ų | 12.9 | 2% | 0.015 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -70.2 | -44.3 | -179.4 | -73.2 | -176 | 0 | 0 | 0 | 111.9 | F399 A439 G440 T444 I445 L459 L463 D466 | F399-I442 HydrophobicContact CE1-CG1 4.15Å; F399-I442 HydrophobicContact CZ-CG1 3.81Å; A439-I442 PolarHBondContact O-N 3.2Å; G440-I442 VanDerWaalsContact C-N 3.29Å; G440-I442 PolarHBondContact O-N 3.48Å; I442-T444 PolarHBondContact O-N 3.3Å; I442-I445 WeakPolarHBondContact O-CB 3.24Å; I442-I445 PolarHBondContact O-N 3.28Å; I442-L459 HydrophobicContact CG2-CD1 3.8Å; I442-L459 HydrophobicContact CG2-CD2 3.82Å; I442-L459 HydrophobicContact CG2-CG 3.71Å; I442-L463 HydrophobicContact CB-CD2 4.43Å; I442-L463 HydrophobicContact CD1-CB 4.25Å; I442-L463 HydrophobicContact CD1-CD2 3.4Å; I442-L463 VanDerWaalsContact CD1-CD2 3.4Å; I442-L463 HydrophobicContact CD1-CG 3.69Å; I442-L463 HydrophobicContact CG2-CD1 4.46Å; I442-L463 HydrophobicContact CG2-CD2 3.88Å; I442-L463 HydrophobicContact CG2-CG 3.89Å; I442-D466 HydrophobicContact CD1-CB 3.26Å; I442-D466 VanDerWaalsContact CD1-OD2 3.23Å; I442-D466 WeakPolarHBondContact CD1-OD2 3.23Å; I442-D466 HydrophobicContact CG1-CB 4.14Å |
| 443 | I | 64.3 | Low | 66.6 | Low | 17 Ų | 17 | 14.9 Ų | 14.9 | 9% | 0.087 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -53.4 | -41.9 | 178.1 | -81.9 | 167.6 | 0 | 0 | 0 | 110 | L102 I106 G440 A446 | L102-I443 HydrophobicContact CD2-CD1 4.43Å; I106-I443 HydrophobicContact CB-CG2 4.02Å; I106-I443 HydrophobicContact CD1-CB 4.21Å; I106-I443 HydrophobicContact CD1-CG1 4.12Å; I106-I443 HydrophobicContact CD1-CG2 3.65Å; I106-I443 HydrophobicContact CG1-CB 4.24Å; I106-I443 HydrophobicContact CG1-CD1 4.32Å; I106-I443 HydrophobicContact CG1-CG1 4.02Å; I106-I443 HydrophobicContact CG1-CG2 3.42Å; I106-I443 VanDerWaalsContact CG1-CG2 3.42Å; I106-I443 HydrophobicContact CG2-CG2 3.68Å; G440-I443 PolarHBondContact O-N 2.9Å; I443-A446 PolarHBondContact O-N 3.31Å |
| 444 | T | 75.3 | Confident | 67 | Low | 3 Ų | 3 | 15.3 Ų | 15.3 | 2% | 0.018 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -74.4 | -21 | -179.8 | 42.9 | 0 | 0 | 0 | 0 | 114.9 | Q400 S430 A434 G440 G441 I442 A446 I447 | Q400-T444 VanDerWaalsContact NE2-CB 3.28Å; Q400-T444 PolarHBondContact NE2-OG1 2.73Å; S430-T444 WeakPolarHBondContact OG-CB 2.99Å; S430-T444 VanDerWaalsContact OG-CG2 3.24Å; S430-T444 WeakPolarHBondContact OG-CG2 3.4Å; A434-T444 HydrophobicContact CB-CG2 4.16Å; G440-T444 PolarHBondContact O-OG1 3.03Å; G441-T444 VanDerWaalsContact CA-OG1 3.29Å; G441-T444 WeakPolarHBondContact CA-OG1 3.21Å; G441-T444 PolarHBondContact O-N 3.48Å; G441-T444 PolarHBondContact O-OG1 2.95Å; I442-T444 PolarHBondContact O-N 3.3Å; T444-A446 VanDerWaalsContact C-N 3.27Å; T444-A446 PolarHBondContact O-N 2.71Å; T444-I447 HydrophobicContact CG2-CD1 3.96Å; T444-I447 VanDerWaalsContact O-CB 3.24Å; T444-I447 WeakPolarHBondContact O-CB 3.45Å; T444-I447 WeakPolarHBondContact O-CG1 3.33Å; T444-I447 PolarHBondContact O-N 2.93Å |
| 445 | I | 79.6 | Confident | 67.1 | Low | 0 Ų | 0 | 17.8 Ų | 17.8 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -64.2 | -35.5 | 174.8 | -70.8 | 165.3 | 0 | 0 | 0 | 110.9 | F399 Q400 A403 G441 I442 I447 I448 L449 L459 M462 | F399-I445 HydrophobicContact CD1-CD1 4.01Å; F399-I445 HydrophobicContact CE1-CD1 3.28Å; F399-I445 HydrophobicContact CE1-CG1 4.18Å; F399-I445 HydrophobicContact CZ-CD1 3.6Å; Q400-I445 HydrophobicContact CB-CG1 4.3Å; Q400-I445 HydrophobicContact CG-CG1 3.85Å; A403-I445 HydrophobicContact CB-CD1 3.39Å; A403-I445 HydrophobicContact CB-CG1 4.02Å; A403-I445 HydrophobicContact CB-CG2 4.29Å; G441-I445 WeakPolarHBondContact O-CG1 3.33Å; G441-I445 PolarHBondContact O-N 3.36Å; I442-I445 WeakPolarHBondContact O-CB 3.24Å; I442-I445 PolarHBondContact O-N 3.28Å; I445-I447 PolarHBondContact O-N 3.22Å; I445-I448 PolarHBondContact O-N 2.94Å; I445-L449 HydrophobicContact CG2-CD1 3.85Å; I445-L449 HydrophobicContact CG2-CG 3.93Å; I445-L449 WeakPolarHBondContact O-CG 3.15Å; I445-L449 PolarHBondContact O-N 3.31Å; I445-L459 HydrophobicContact CB-CD1 3.79Å; I445-L459 HydrophobicContact CD1-CD1 4.4Å; I445-L459 HydrophobicContact CG2-CD1 3.7Å; I445-M462 HydrophobicContact CD1-SD 3.89Å |
| 446 | A | 67.9 | Low | 67.4 | Low | 8 Ų | 8 | 18.7 Ų | 18.7 | 7% | 0.066 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -55.8 | -37.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | I443 T444 I448 L449 E450 T456 L459 | I443-A446 PolarHBondContact O-N 3.31Å; T444-A446 VanDerWaalsContact C-N 3.27Å; T444-A446 PolarHBondContact O-N 2.71Å; A446-I448 VanDerWaalsContact C-N 3.31Å; A446-I448 PolarHBondContact O-N 2.94Å; A446-L449 PolarHBondContact O-N 3.45Å; A446-E450 WeakPolarHBondContact O-CB 3.36Å; A446-E450 WeakPolarHBondContact O-CG 3.12Å; A446-E450 PolarHBondContact O-N 3.28Å; A446-T456 HydrophobicContact CB-CG2 4.27Å; A446-L459 HydrophobicContact CB-CD2 4.34Å |
| 447 | I | 66.5 | Low | 67.7 | Low | 7 Ų | 7 | 23.9 Ų | 23.9 | 4% | 0.036 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -56.9 | -47.4 | 176.2 | -53.1 | 171.6 | 0 | 0 | 0 | 110.7 | I237 S430 T444 I445 A451 | I237-I447 HydrophobicContact CB-CB 4.34Å; I237-I447 HydrophobicContact CB-CD1 4.09Å; I237-I447 HydrophobicContact CB-CG1 3.67Å; I237-I447 HydrophobicContact CB-CG2 4.02Å; I237-I447 HydrophobicContact CD1-CB 4.43Å; I237-I447 HydrophobicContact CD1-CD1 4.3Å; I237-I447 HydrophobicContact CD1-CG1 3.43Å; I237-I447 VanDerWaalsContact CD1-CG1 3.43Å; I237-I447 HydrophobicContact CG1-CG1 4.09Å; I237-I447 HydrophobicContact CG2-CB 4.47Å; I237-I447 HydrophobicContact CG2-CD1 3.32Å; I237-I447 HydrophobicContact CG2-CG1 3.5Å; I237-I447 VanDerWaalsContact CG2-CG1 3.5Å; I237-I447 HydrophobicContact CG2-CG2 4.22Å; S430-I447 WeakPolarHBondContact OG-CD1 3.44Å; T444-I447 HydrophobicContact CG2-CD1 3.96Å; T444-I447 VanDerWaalsContact O-CB 3.24Å; T444-I447 WeakPolarHBondContact O-CB 3.45Å; T444-I447 WeakPolarHBondContact O-CG1 3.33Å; T444-I447 PolarHBondContact O-N 2.93Å; I445-I447 PolarHBondContact O-N 3.22Å; I447-A451 WeakPolarHBondContact O-CB 3.24Å; I447-A451 PolarHBondContact O-N 3.25Å |
| 448 | I | 78.4 | Confident | 67.9 | Low | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -70.7 | -42.8 | -175.4 | -59.6 | 167 | 0 | 0 | 0 | 109.9 | Q400 A404 I423 A427 I445 A446 A451 I452 | Q400-I448 HydrophobicContact CB-CD1 3.56Å; Q400-I448 HydrophobicContact CG-CD1 3.95Å; A404-I448 HydrophobicContact CB-CG2 3.75Å; I423-I448 HydrophobicContact CB-CG2 4.3Å; I423-I448 HydrophobicContact CG1-CG2 3.94Å; I423-I448 HydrophobicContact CG2-CG2 4.2Å; A427-I448 HydrophobicContact CB-CD1 3.81Å; I445-I448 PolarHBondContact O-N 2.94Å; A446-I448 VanDerWaalsContact C-N 3.31Å; A446-I448 PolarHBondContact O-N 2.94Å; I448-A451 PolarHBondContact O-N 3.01Å; I448-I452 WeakPolarHBondContact O-CG1 3.35Å; I448-I452 PolarHBondContact O-N 3.44Å |
| 449 | L | 74.1 | Confident | 68.2 | Low | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.7 | -45.2 | 177.9 | -64.9 | 176.6 | 0 | 0 | 0 | 111.6 | A404 I407 I445 A446 A451 I452 G453 L454 T456 | A404-L449 HydrophobicContact CB-CD2 4.45Å; I407-L449 HydrophobicContact CB-CD2 4.02Å; I407-L449 HydrophobicContact CD1-CD1 3.56Å; I407-L449 HydrophobicContact CD1-CD2 4.03Å; I407-L449 HydrophobicContact CD1-CG 4.38Å; I407-L449 HydrophobicContact CG2-CD1 4.47Å; I407-L449 HydrophobicContact CG2-CD2 3.91Å; I445-L449 HydrophobicContact CG2-CD1 3.85Å; I445-L449 HydrophobicContact CG2-CG 3.93Å; I445-L449 WeakPolarHBondContact O-CG 3.15Å; I445-L449 PolarHBondContact O-N 3.31Å; A446-L449 PolarHBondContact O-N 3.45Å; L449-A451 VanDerWaalsContact C-N 3.33Å; L449-A451 PolarHBondContact O-N 2.9Å; L449-I452 CarbonylContact O-C 3.6Å; L449-I452 WeakPolarHBondContact O-CG1 3.43Å; L449-I452 PolarHBondContact O-N 2.98Å; L449-G453 PolarHBondContact O-N 2.98Å; L449-L454 HydrophobicContact CB-CB 4.28Å; L449-L454 HydrophobicContact CD2-CB 4.01Å; L449-L454 HydrophobicContact CD2-CD1 4.04Å; L449-L454 PolarHBondContact O-N 2.86Å; L449-T456 HydrophobicContact CB-CG2 4.15Å; L449-T456 HydrophobicContact CD1-CG2 4.33Å |
| 450 | E | 64.6 | Low | 68.3 | Low | 67 Ų | 67 | 22.7 Ų | 22.7 | 31% | 0.313 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -62.6 | -41.3 | 175.8 | -73.8 | 173.4 | -177.2 | 0 | 0 | 111.1 | A446 I452 G453 T456 | A446-E450 WeakPolarHBondContact O-CB 3.36Å; A446-E450 WeakPolarHBondContact O-CG 3.12Å; A446-E450 PolarHBondContact O-N 3.28Å; E450-I452 PolarHBondContact O-N 3.43Å; E450-G453 PolarHBondContact O-N 3.26Å; E450-G453 VanDerWaalsContact O-N 3.1Å; E450-T456 HydrophobicContact CG-CG2 4.03Å |
| 451 | A | 63 | Low | 68.7 | Low | 35 Ų | 35 | 22.8 Ų | 22.8 | 29% | 0.289 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -62.8 | -26.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | T422 T426 I447 I448 L449 | T422-A451 HydrophobicContact CG2-CB 3.99Å; T426-A451 HydrophobicContact CG2-CB 3.97Å; I447-A451 WeakPolarHBondContact O-CB 3.24Å; I447-A451 PolarHBondContact O-N 3.25Å; I448-A451 PolarHBondContact O-N 3.01Å; L449-A451 VanDerWaalsContact C-N 3.33Å; L449-A451 PolarHBondContact O-N 2.9Å |
| 452 | I | 71.6 | Confident | 69 | Low | 14 Ų | 14 | 22.5 Ų | 22.5 | 7% | 0.072 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -102.7 | 0.4 | 175.8 | 64.7 | -175.2 | 0 | 0 | 0 | 113.9 | L415 Q419 T422 I423 I448 L449 E450 L454 | L415-I452 HydrophobicContact CD2-CD1 4.25Å; Q419-I452 HydrophobicContact CB-CB 4.47Å; Q419-I452 HydrophobicContact CB-CG2 4.15Å; Q419-I452 HydrophobicContact CG-CB 4.4Å; Q419-I452 HydrophobicContact CG-CG2 4.45Å; Q419-I452 PolarHBondContact NE2-O 3.33Å; T422-I452 HydrophobicContact CG2-CG2 3.92Å; I423-I452 HydrophobicContact CD1-CD1 3.81Å; I423-I452 HydrophobicContact CD1-CG2 4.46Å; I423-I452 HydrophobicContact CG1-CD1 3.9Å; I423-I452 HydrophobicContact CG1-CG2 3.85Å; I448-I452 WeakPolarHBondContact O-CG1 3.35Å; I448-I452 PolarHBondContact O-N 3.44Å; L449-I452 CarbonylContact O-C 3.6Å; L449-I452 WeakPolarHBondContact O-CG1 3.43Å; L449-I452 PolarHBondContact O-N 2.98Å; E450-I452 PolarHBondContact O-N 3.43Å; I452-L454 HydrophobicContact CD1-CD1 3.52Å; I452-L454 HydrophobicContact CD1-CG 4Å; I452-L454 HydrophobicContact CG1-CB 4.24Å; I452-L454 HydrophobicContact CG1-CD1 4.02Å; I452-L454 HydrophobicContact CG1-CG 3.9Å |
| 453 | G | 63.7 | Low | 69.1 | Low | 66 Ų | 66 | 22.9 Ų | 22.9 | 68% | 0.68 | 15% | 0.146 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 76.4 | 26.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | L449 E450 | L449-G453 PolarHBondContact O-N 2.98Å; E450-G453 PolarHBondContact O-N 3.26Å; E450-G453 VanDerWaalsContact O-N 3.1Å |
| 454 | L | 69 | Low | 69.2 | Low | 12 Ų | 12 | 22.7 Ų | 22.7 | 6% | 0.063 | 15% | 0.147 | C | C | . | . | trans | -93.1 | 147.7 | 176.3 | -73.2 | -178.5 | 0 | 0 | 0 | 112.5 | I407 A408 T413 L449 I452 | I407-L454 HydrophobicContact CG2-CD1 4.43Å; A408-L454 HydrophobicContact CB-CD1 3.62Å; T413-L454 HydrophobicContact CG2-CD2 3.96Å; L449-L454 HydrophobicContact CB-CB 4.28Å; L449-L454 HydrophobicContact CD2-CB 4.01Å; L449-L454 HydrophobicContact CD2-CD1 4.04Å; L449-L454 PolarHBondContact O-N 2.86Å; I452-L454 HydrophobicContact CD1-CD1 3.52Å; I452-L454 HydrophobicContact CD1-CG 4Å; I452-L454 HydrophobicContact CG1-CB 4.24Å; I452-L454 HydrophobicContact CG1-CD1 4.02Å; I452-L454 HydrophobicContact CG1-CG 3.9Å | ||
| 455 | P | 67.7 | Low | 69.1 | Low | 56 Ų | 56 | 23.3 Ų | 23.3 | 36% | 0.364 | 15% | 0.151 | S | C | . | . | trans | -66.2 | 136.7 | 178.6 | 27.4 | -33.9 | 0 | 0 | 0 | 111.7 | N457 | P455-N457 VanDerWaalsContact C-N 3.35Š| ||
| 456 | T | 65.4 | Low | 69 | Low | 29 Ų | 29 | 23.6 Ų | 23.6 | 18% | 0.178 | 15% | 0.152 | C | C | . | . | G | 310 helix | trans | -87.8 | -1.1 | -180 | 56.8 | 0 | 0 | 0 | 0 | 113.8 | A446 L449 E450 D458 L459 | A446-T456 HydrophobicContact CB-CG2 4.27Å; L449-T456 HydrophobicContact CB-CG2 4.15Å; L449-T456 HydrophobicContact CD1-CG2 4.33Å; E450-T456 HydrophobicContact CG-CG2 4.03Å; T456-D458 PolarHBondContact O-N 2.9Å; T456-L459 WeakPolarHBondContact O-CB 3.26Å; T456-L459 PolarHBondContact O-N 3.26Å |
| 457 | N | 64.4 | Low | 69.3 | Low | 113 Ų | 113 | 26.9 Ų | 26.9 | 60% | 0.604 | 16% | 0.163 | S | C | * | . | G | 310 helix | trans | -62.6 | -31.6 | -178.2 | -63.8 | -28.4 | 0 | 0 | 0 | 112.6 | P455 L459 S460 | P455-N457 VanDerWaalsContact C-N 3.35Å; N457-L459 VanDerWaalsContact C-N 3.25Å; N457-L459 PolarHBondContact O-N 2.99Å; N457-S460 PolarHBondContact O-OG 3.37Å |
| 458 | D | 67.8 | Low | 69.9 | Low | 12 Ų | 12 | 29.2 Ų | 29.2 | 6% | 0.064 | 18% | 0.175 | C | C | . | . | G | 310 helix | trans | -79.1 | -6.6 | -178.1 | -60.4 | -32.8 | 0 | 0 | 0 | 113.3 | I407 N411 T456 S460 L461 | I407-D458 HydrophobicContact CG1-CB 4.36Å; I407-D458 HydrophobicContact CG2-CB 4.31Å; N411-D458 PolarHBondContact ND2-OD2 3.44Å; N411-D458 PolarHBondContact OD1-OD2 3.37Å; T456-D458 PolarHBondContact O-N 2.9Å; D458-S460 PolarHBondContact O-N 3.29Å; D458-L461 WeakPolarHBondContact O-CB 3.44Å; D458-L461 PolarHBondContact O-N 3.46Å |
| 459 | L | 67.8 | Low | 70.4 | Confident | 17 Ų | 17 | 29.2 Ų | 29.2 | 9% | 0.089 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.5 | -29 | 174 | -169.4 | 67.5 | 0 | 0 | 0 | 112 | I442 I445 A446 T456 N457 L461 M462 L463 | I442-L459 HydrophobicContact CG2-CD1 3.8Å; I442-L459 HydrophobicContact CG2-CD2 3.82Å; I442-L459 HydrophobicContact CG2-CG 3.71Å; I445-L459 HydrophobicContact CB-CD1 3.79Å; I445-L459 HydrophobicContact CD1-CD1 4.4Å; I445-L459 HydrophobicContact CG2-CD1 3.7Å; A446-L459 HydrophobicContact CB-CD2 4.34Å; T456-L459 WeakPolarHBondContact O-CB 3.26Å; T456-L459 PolarHBondContact O-N 3.26Å; N457-L459 VanDerWaalsContact C-N 3.25Å; N457-L459 PolarHBondContact O-N 2.99Å; L459-L461 PolarHBondContact O-N 3.28Å; L459-M462 HydrophobicContact CD1-SD 4.42Å; L459-M462 WeakPolarHBondContact O-CB 3.33Å; L459-M462 PolarHBondContact O-N 3.44Å; L459-M462 VanDerWaalsContact O-N 3.09Å; L459-L463 PolarHBondContact O-N 3.21Å |
| 460 | S | 66.2 | Low | 71 | Confident | 7 Ų | 7 | 29.8 Ų | 29.8 | 5% | 0.049 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -58 | -34.6 | 174.2 | 56.7 | 0 | 0 | 0 | 0 | 112.9 | L290 K294 N457 D458 M462 L463 | L290-S460 WeakPolarHBondContact CD2-O 3.46Å; K294-S460 WeakPolarHBondContact CE-OG 3.37Å; N457-S460 PolarHBondContact O-OG 3.37Å; D458-S460 PolarHBondContact O-N 3.29Å; S460-M462 VanDerWaalsContact C-N 3.27Å; S460-M462 PolarHBondContact O-N 3.05Å; S460-L463 PolarHBondContact O-N 3.32Å |
| 461 | L | 69.4 | Low | 72.1 | Confident | 7 Ų | 7 | 27.7 Ų | 27.7 | 4% | 0.037 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.4 | -31.5 | 176.8 | -63 | 176.1 | 0 | 0 | 0 | 112.1 | K294 M298 L304 L410 D458 L459 A464 | K294-L461 HydrophobicContact CB-CD2 3.87Å; K294-L461 HydrophobicContact CD-CD2 4.15Å; K294-L461 HydrophobicContact CG-CD2 3.88Å; M298-L461 HydrophobicContact CE-CD1 4.04Å; L304-L461 HydrophobicContact CD1-CD2 3.91Å; L410-L461 HydrophobicContact CD1-CD1 4.29Å; D458-L461 WeakPolarHBondContact O-CB 3.44Å; D458-L461 PolarHBondContact O-N 3.46Å; L459-L461 PolarHBondContact O-N 3.28Å; L461-A464 WeakPolarHBondContact O-CB 3.41Å |
| 462 | M | 74.3 | Confident | 73.4 | Confident | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -75.8 | -39.3 | 177.6 | -66.2 | -175.9 | 175 | 0 | 0 | 112.5 | Y311 A403 F406 I407 I445 L459 S460 A464 V465 D466 | Y311-M462 HydrophobicContact CE2-CE 4.2Å; A403-M462 HydrophobicContact CB-CE 3.37Å; A403-M462 HydrophobicContact CB-SD 3.4Å; A403-M462 WeakPolarHBondContact CB-SD 3.37Å; A403-M462 VanDerWaalsContact O-CE 3.29Å; A403-M462 WeakPolarHBondContact O-CE 3.32Å; F406-M462 HydrophobicContact CB-CE 4.38Å; F406-M462 HydrophobicContact CD1-CE 3.45Å; F406-M462 VanDerWaalsContact CD1-CE 3.45Å; F406-M462 HydrophobicContact CE1-CE 4.19Å; F406-M462 HydrophobicContact CG-CE 4.36Å; I407-M462 HydrophobicContact CD1-CE 3.44Å; I407-M462 VanDerWaalsContact CD1-CE 3.44Å; I407-M462 HydrophobicContact CD1-SD 3.93Å; I407-M462 HydrophobicContact CG1-CE 3.46Å; I407-M462 VanDerWaalsContact CG1-CE 3.46Å; I445-M462 HydrophobicContact CD1-SD 3.89Å; L459-M462 HydrophobicContact CD1-SD 4.42Å; L459-M462 WeakPolarHBondContact O-CB 3.33Å; L459-M462 PolarHBondContact O-N 3.44Å; L459-M462 VanDerWaalsContact O-N 3.09Å; S460-M462 VanDerWaalsContact C-N 3.27Å; S460-M462 PolarHBondContact O-N 3.05Å; M462-A464 PolarHBondContact O-N 2.86Å; M462-A464 VanDerWaalsContact O-N 3.07Å; M462-V465 VanDerWaalsContact O-CG2 3.26Å; M462-V465 WeakPolarHBondContact O-CG2 3.37Å; M462-V465 PolarHBondContact O-N 3.15Å; M462-D466 WeakPolarHBondContact O-CB 3.48Å; M462-D466 PolarHBondContact O-N 3.19Å |
| 463 | L | 69.5 | Low | 74.5 | Confident | 10 Ų | 10 | 26.9 Ų | 26.9 | 5% | 0.052 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -52.5 | -32.9 | 175.8 | -83.2 | 163.8 | 0 | 0 | 0 | 112.9 | L99 L102 L290 I442 L459 S460 V465 | L99-L463 HydrophobicContact CD2-CD1 3.2Å; L102-L463 HydrophobicContact CD1-CD2 4.21Å; L290-L463 HydrophobicContact CD1-CD1 4.25Å; L290-L463 HydrophobicContact CD2-CB 4.44Å; I442-L463 HydrophobicContact CB-CD2 4.43Å; I442-L463 HydrophobicContact CD1-CB 4.25Å; I442-L463 HydrophobicContact CD1-CD2 3.4Å; I442-L463 VanDerWaalsContact CD1-CD2 3.4Å; I442-L463 HydrophobicContact CD1-CG 3.69Å; I442-L463 HydrophobicContact CG2-CD1 4.46Å; I442-L463 HydrophobicContact CG2-CD2 3.88Å; I442-L463 HydrophobicContact CG2-CG 3.89Å; L459-L463 PolarHBondContact O-N 3.21Å; S460-L463 PolarHBondContact O-N 3.32Å; L463-V465 VanDerWaalsContact C-N 3.31Å; L463-V465 PolarHBondContact O-N 3.11Å |
| 464 | A | 67.3 | Low | 75.8 | Confident | 13 Ų | 13 | 23.9 Ų | 23.9 | 11% | 0.107 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -63.3 | -34.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | V291 L461 M462 W467 | V291-A464 HydrophobicContact CG2-CB 3.5Å; V291-A464 VanDerWaalsContact CG2-CB 3.5Å; L461-A464 WeakPolarHBondContact O-CB 3.41Å; M462-A464 PolarHBondContact O-N 2.86Å; M462-A464 VanDerWaalsContact O-N 3.07Å; A464-W467 VanDerWaalsContact O-CD1 3.28Å |
| 465 | V | 73.3 | Confident | 77 | Confident | 17 Ų | 17 | 24.8 Ų | 24.8 | 10% | 0.103 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -109.8 | -13.3 | -172 | -64.3 | 0 | 0 | 0 | 0 | 112.9 | L308 Y311 I312 M462 L463 W467 I468 | L308-V465 HydrophobicContact CB-CG1 4.28Å; L308-V465 HydrophobicContact CD1-CG1 4.09Å; L308-V465 HydrophobicContact CD2-CG1 4.28Å; L308-V465 HydrophobicContact CD2-CG2 4.2Å; L308-V465 HydrophobicContact CG-CG1 4.46Å; Y311-V465 HydrophobicContact CD1-CG2 3.99Å; Y311-V465 HydrophobicContact CE1-CG2 3.78Å; I312-V465 HydrophobicContact CD1-CB 3.88Å; I312-V465 HydrophobicContact CD1-CG1 3.92Å; I312-V465 HydrophobicContact CG1-CB 4.06Å; I312-V465 HydrophobicContact CG1-CG2 4.45Å; M462-V465 VanDerWaalsContact O-CG2 3.26Å; M462-V465 WeakPolarHBondContact O-CG2 3.37Å; M462-V465 PolarHBondContact O-N 3.15Å; L463-V465 VanDerWaalsContact C-N 3.31Å; L463-V465 PolarHBondContact O-N 3.11Å; V465-W467 PolarHBondContact O-N 3.35Å; V465-I468 WeakPolarHBondContact O-CG2 3.28Å; V465-I468 PolarHBondContact O-N 2.77Å |
| 466 | D | 77.9 | Confident | 78.3 | Confident | 6 Ų | 6 | 22.4 Ų | 22.4 | 3% | 0.032 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.8 | -28.8 | -175.7 | -179.6 | 62.9 | 0 | 0 | 0 | 113.7 | F399 I442 M462 I468 V469 D470 | F399-D466 WeakPolarHBondContact CE2-OD1 3.44Å; F399-D466 WeakPolarHBondContact CZ-OD1 3.18Å; I442-D466 HydrophobicContact CD1-CB 3.26Å; I442-D466 VanDerWaalsContact CD1-OD2 3.23Å; I442-D466 WeakPolarHBondContact CD1-OD2 3.23Å; I442-D466 HydrophobicContact CG1-CB 4.14Å; M462-D466 WeakPolarHBondContact O-CB 3.48Å; M462-D466 PolarHBondContact O-N 3.19Å; D466-I468 PolarHBondContact O-N 3.44Å; D466-V469 PolarHBondContact O-N 3.25Å; D466-D470 WeakPolarHBondContact O-CB 3.26Å; D466-D470 PolarHBondContact O-N 2.71Å |
| 467 | W | 72.8 | Confident | 79.6 | Confident | 77 Ų | 77 | 21.3 Ų | 21.3 | 29% | 0.292 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -52.9 | -36.3 | 176.6 | 73.9 | -89 | 0 | 0 | 0 | 112.3 | T64 V65 A464 V465 R471 | T64-W467 HydrophobicContact CG2-CB 4.25Å; V65-W467 HydrophobicContact CG2-CD2 4.02Å; V65-W467 HydrophobicContact CG2-CE3 3.64Å; V65-W467 HydrophobicContact CG2-CH2 3.88Å; V65-W467 HydrophobicContact CG2-CZ2 4.23Å; V65-W467 HydrophobicContact CG2-CZ3 3.57Å; A464-W467 VanDerWaalsContact O-CD1 3.28Å; V465-W467 PolarHBondContact O-N 3.35Å; W467-R471 WeakPolarHBondContact O-CD 3.5Å; W467-R471 WeakPolarHBondContact O-CG 3.3Å; W467-R471 PolarHBondContact O-NH1 2.96Å |
| 468 | I | 80.8 | Confident | 81 | Confident | 56 Ų | 56 | 16 Ų | 16 | 29% | 0.287 | 8% | 0.083 | S | C | . | . | H | α-helix | trans | -79.6 | -38.1 | 177.1 | -172.6 | 165.7 | 0 | 0 | 0 | 112.1 | I312 V465 D466 | I312-I468 HydrophobicContact CD1-CG2 4.16Å; I312-I468 HydrophobicContact CG1-CG2 4.3Å; I312-I468 HydrophobicContact CG2-CG2 4.04Å; V465-I468 WeakPolarHBondContact O-CG2 3.28Å; V465-I468 PolarHBondContact O-N 2.77Å; D466-I468 PolarHBondContact O-N 3.44Å |
| 469 | V | 88.5 | Confident | 82.4 | Confident | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -76.6 | -37.9 | -174.2 | -174.4 | 0 | 0 | 0 | 0 | 111.8 | Y311 I312 F399 D466 R471 T472 T473 | Y311-V469 HydrophobicContact CE1-CG2 4.49Å; I312-V469 HydrophobicContact CG1-CG2 4.21Å; I312-V469 HydrophobicContact CG2-CG2 4.37Å; F399-V469 HydrophobicContact CD2-CB 4.36Å; F399-V469 HydrophobicContact CD2-CG1 3.54Å; F399-V469 HydrophobicContact CE2-CB 4.36Å; F399-V469 HydrophobicContact CE2-CG1 4.01Å; F399-V469 HydrophobicContact CG-CG1 4.5Å; D466-V469 PolarHBondContact O-N 3.25Å; V469-R471 PolarHBondContact O-N 3.37Å; V469-T472 PolarHBondContact O-N 3.36Å; V469-T472 VanDerWaalsContact O-N 3.14Å; V469-T472 PolarHBondContact O-OG1 3.5Å; V469-T473 WeakPolarHBondContact O-CB 3.5Å; V469-T473 PolarHBondContact O-N 2.92Å; V469-T473 PolarHBondContact O-OG1 2.98Å; V469-T473 VanDerWaalsContact O-OG1 3.1Å |
| 470 | D | 86 | Confident | 83.7 | Confident | 12 Ų | 12 | 15.5 Ų | 15.5 | 6% | 0.064 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -60.3 | -29 | 179.6 | -166.6 | 37.5 | 0 | 0 | 0 | 112.4 | P438 A439 D466 T473 T474 | P438-D470 WeakPolarHBondContact CA-OD2 3.41Å; A439-D470 PolarHBondContact N-OD2 3.31Å; D466-D470 WeakPolarHBondContact O-CB 3.26Å; D466-D470 PolarHBondContact O-N 2.71Å; D470-T473 WeakPolarHBondContact O-CB 3.42Å; D470-T474 WeakPolarHBondContact O-CB 3.46Å; D470-T474 PolarHBondContact O-N 3.41Å; D470-T474 PolarHBondContact O-OG1 3.04Å |
| 471 | R | 86.9 | Confident | 85 | Confident | 22 Ų | 22 | 15.4 Ų | 15.4 | 8% | 0.083 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -64.5 | -49.8 | 174.7 | -69.4 | 173.1 | 156.2 | 67.3 | 23.7 | 112.2 | F354 C357 W467 V469 T474 V475 | F354-R471 HydrophobicContact CD2-CB 3.75Å; F354-R471 HydrophobicContact CE2-CB 3.68Å; F354-R471 HydrophobicContact CG-CB 4.35Å; F354-R471 HydrophobicContact CZ-CB 4.23Å; F354-R471 WeakPolarHBondContact O-CG 3.13Å; C357-R471 WeakPolarHBondContact SG-CG 3.23Å; W467-R471 WeakPolarHBondContact O-CD 3.5Å; W467-R471 WeakPolarHBondContact O-CG 3.3Å; W467-R471 PolarHBondContact O-NH1 2.96Å; V469-R471 PolarHBondContact O-N 3.37Å; R471-T474 PolarHBondContact O-N 3.28Å; R471-V475 WeakPolarHBondContact O-CG2 3.48Å; R471-V475 PolarHBondContact O-N 3.3Å |
| 472 | T | 92.3 | Very high | 86.2 | Confident | 29 Ų | 29 | 15.1 Ų | 15.1 | 18% | 0.178 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -72.3 | -34.3 | 178.8 | 53.4 | 0 | 0 | 0 | 0 | 110.9 | I316 H319 F354 V469 T474 V475 V476 | I316-T472 HydrophobicContact CG1-CG2 4.47Å; H319-T472 PolarHBondContact CE1-OG1 2.97Å; H319-T472 WeakPolarHBondContact ND1-CB 3.34Å; H319-T472 PolarHBondContact ND1-OG1 3.36Å; F354-T472 HydrophobicContact CE2-CG2 4.4Å; V469-T472 PolarHBondContact O-N 3.36Å; V469-T472 VanDerWaalsContact O-N 3.14Å; V469-T472 PolarHBondContact O-OG1 3.5Å; T472-T474 PolarHBondContact O-N 2.84Å; T472-V475 PolarHBondContact O-N 2.99Å; T472-V476 WeakPolarHBondContact O-CG2 3.35Å; T472-V476 PolarHBondContact O-N 3.08Å; T472-V476 VanDerWaalsContact O-N 3.12Å |
| 473 | T | 93.1 | Very high | 87.2 | Confident | 3 Ų | 3 | 15.1 Ų | 15.1 | 2% | 0.018 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -53.6 | -52.7 | 169.6 | -68.4 | 0 | 0 | 0 | 0 | 111.4 | H319 A396 V469 D470 V475 V476 N477 | H319-T473 PolarHBondContact CE1-N 2.76Å; H319-T473 PolarHBondContact CE1-OG1 3.38Å; H319-T473 PolarHBondContact NE2-OG1 3.2Å; A396-T473 HydrophobicContact CB-CG2 4.22Å; V469-T473 WeakPolarHBondContact O-CB 3.5Å; V469-T473 PolarHBondContact O-N 2.92Å; V469-T473 PolarHBondContact O-OG1 2.98Å; V469-T473 VanDerWaalsContact O-OG1 3.1Å; D470-T473 WeakPolarHBondContact O-CB 3.42Å; T473-V475 VanDerWaalsContact C-N 3.31Å; T473-V475 PolarHBondContact O-N 3.1Å; T473-V476 PolarHBondContact O-N 3.15Å; T473-N477 VanDerWaalsContact O-CG 3.23Å; T473-N477 PolarHBondContact O-N 3.46Å; T473-N477 PolarHBondContact O-OD1 3Å |
| 474 | T | 90.9 | Very high | 88.4 | Confident | 4 Ų | 4 | 14.6 Ų | 14.6 | 3% | 0.025 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61.9 | -40.7 | -177.8 | -53.7 | 0 | 0 | 0 | 0 | 111.3 | A353 C357 D470 R471 T472 V476 N477 V478 | A353-T474 HydrophobicContact CB-CG2 3.97Å; C357-T474 WeakPolarHBondContact CA-OG1 3.26Å; D470-T474 WeakPolarHBondContact O-CB 3.46Å; D470-T474 PolarHBondContact O-N 3.41Å; D470-T474 PolarHBondContact O-OG1 3.04Å; R471-T474 PolarHBondContact O-N 3.28Å; T472-T474 PolarHBondContact O-N 2.84Å; T474-V476 PolarHBondContact O-N 3.46Å; T474-N477 PolarHBondContact O-N 3.31Å; T474-V478 WeakPolarHBondContact O-CG2 3.37Å; T474-V478 PolarHBondContact O-N 2.92Å; T474-V478 VanDerWaalsContact O-N 3.11Å |
| 475 | V | 93.9 | Very high | 89.6 | Confident | 30 Ų | 30 | 14 Ų | 14 | 18% | 0.182 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -60.7 | -45.9 | 178 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | F350 A353 F354 R471 T472 T473 V478 E479 | F350-V475 HydrophobicContact CB-CG1 4.48Å; F350-V475 HydrophobicContact CD1-CG1 4.46Å; F350-V475 HydrophobicContact CG-CG1 4.47Å; A353-V475 HydrophobicContact CB-CG2 4.29Å; F354-V475 HydrophobicContact CB-CG2 3.82Å; F354-V475 HydrophobicContact CD2-CG2 4.23Å; R471-V475 WeakPolarHBondContact O-CG2 3.48Å; R471-V475 PolarHBondContact O-N 3.3Å; T472-V475 PolarHBondContact O-N 2.99Å; T473-V475 VanDerWaalsContact C-N 3.31Å; T473-V475 PolarHBondContact O-N 3.1Å; V475-V478 WeakPolarHBondContact O-CG2 3.42Å; V475-V478 PolarHBondContact O-N 3.23Å; V475-E479 VanDerWaalsContact O-CB 3.27Å; V475-E479 WeakPolarHBondContact O-CB 3.36Å; V475-E479 PolarHBondContact O-N 3.1Å |
| 476 | V | 95.8 | Very high | 90.6 | Very high | 6 Ų | 6 | 13.3 Ų | 13.3 | 4% | 0.036 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -66.9 | -37.1 | 179.4 | 175.4 | 0 | 0 | 0 | 0 | 111.8 | H319 D394 T472 T473 T474 E479 G480 | H319-V476 HydrophobicContact CB-CG2 3.74Å; D394-V476 HydrophobicContact CB-CG1 4.16Å; T472-V476 WeakPolarHBondContact O-CG2 3.35Å; T472-V476 PolarHBondContact O-N 3.08Å; T472-V476 VanDerWaalsContact O-N 3.12Å; T473-V476 PolarHBondContact O-N 3.15Å; T474-V476 PolarHBondContact O-N 3.46Å; V476-E479 PolarHBondContact O-N 3.27Å; V476-G480 PolarHBondContact O-N 2.84Å |
| 477 | N | 93.8 | Very high | 91.4 | Very high | 6 Ų | 6 | 13.2 Ų | 13.2 | 3% | 0.032 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -58.9 | -53.4 | 175.5 | -66 | -13.6 | 0 | 0 | 0 | 110.9 | M393 D394 G395 A396 T473 T474 E479 G480 D481 | M393-N477 WeakPolarHBondContact CA-OD1 3.4Å; D394-N477 PolarHBondContact N-OD1 3.27Å; G395-N477 VanDerWaalsContact CA-OD1 3.27Å; G395-N477 WeakPolarHBondContact CA-OD1 3.33Å; G395-N477 PolarHBondContact N-OD1 3.48Å; A396-N477 PolarHBondContact N-OD1 2.89Å; T473-N477 VanDerWaalsContact O-CG 3.23Å; T473-N477 PolarHBondContact O-N 3.46Å; T473-N477 PolarHBondContact O-OD1 3Å; T474-N477 PolarHBondContact O-N 3.31Å; N477-E479 VanDerWaalsContact C-N 3.29Å; N477-E479 PolarHBondContact O-N 3.49Å; N477-G480 PolarHBondContact O-N 3.46Å; N477-D481 PolarHBondContact O-N 2.97Å |
| 478 | V | 93.7 | Very high | 92.3 | Very high | 3 Ų | 3 | 9.6 Ų | 9.6 | 2% | 0.018 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -68.3 | -30.1 | -178.7 | -57 | 0 | 0 | 0 | 0 | 112.2 | F350 A353 T362 M366 T474 V475 D481 A482 | F350-V478 HydrophobicContact CD1-CG2 3.87Å; F350-V478 HydrophobicContact CE1-CG2 4.11Å; A353-V478 HydrophobicContact CB-CG1 4.37Å; A353-V478 HydrophobicContact CB-CG2 3.83Å; T362-V478 WeakPolarHBondContact OG1-CG1 3.29Å; M366-V478 HydrophobicContact CE-CB 3.64Å; M366-V478 HydrophobicContact CE-CG2 3.94Å; M366-V478 WeakPolarHBondContact CE-O 3.46Å; T474-V478 WeakPolarHBondContact O-CG2 3.37Å; T474-V478 PolarHBondContact O-N 2.92Å; T474-V478 VanDerWaalsContact O-N 3.11Å; V475-V478 WeakPolarHBondContact O-CG2 3.42Å; V475-V478 PolarHBondContact O-N 3.23Å; V478-D481 PolarHBondContact O-N 3.19Å; V478-A482 PolarHBondContact O-N 3.31Å; V478-A482 VanDerWaalsContact O-N 3.15Å |
| 479 | E | 96.1 | Very high | 92.9 | Very high | 17 Ų | 17 | 8.4 Ų | 8.4 | 8% | 0.079 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -63.5 | -46.1 | 173.6 | 177.8 | 172 | -147.9 | 0 | 0 | 111.9 | G323 L327 L343 F350 V475 V476 N477 D481 A482 L483 | G323-E479 VanDerWaalsContact CA-OE2 3.27Å; G323-E479 WeakPolarHBondContact CA-OE2 3.15Å; L327-E479 HydrophobicContact CD1-CG 4.36Å; L343-E479 WeakPolarHBondContact CD1-OE1 3.2Å; L343-E479 HydrophobicContact CD2-CG 3.91Å; L343-E479 VanDerWaalsContact CD2-OE1 3.28Å; L343-E479 WeakPolarHBondContact CD2-OE1 3.47Å; F350-E479 HydrophobicContact CE1-CB 3.9Å; F350-E479 HydrophobicContact CZ-CB 4Å; F350-E479 HydrophobicContact CZ-CG 4.12Å; V475-E479 VanDerWaalsContact O-CB 3.27Å; V475-E479 WeakPolarHBondContact O-CB 3.36Å; V475-E479 PolarHBondContact O-N 3.1Å; V476-E479 PolarHBondContact O-N 3.27Å; N477-E479 VanDerWaalsContact C-N 3.29Å; N477-E479 PolarHBondContact O-N 3.49Å; E479-D481 VanDerWaalsContact C-N 3.28Å; E479-D481 PolarHBondContact O-N 3.02Å; E479-A482 PolarHBondContact O-N 3.26Å; E479-L483 HydrophobicContact CG-CD1 3.93Å; E479-L483 HydrophobicContact CG-CG 4.49Å; E479-L483 WeakPolarHBondContact O-CG 3.22Å; E479-L483 PolarHBondContact O-N 3.34Å |
| 480 | G | 95 | Very high | 93.1 | Very high | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -56.5 | -41.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y136 V476 N477 G484 | Y136-G480 PolarHBondContact OH-O 3.39Å; V476-G480 PolarHBondContact O-N 2.84Å; N477-G480 PolarHBondContact O-N 3.46Å; G480-G484 PolarHBondContact O-N 3.49Å |
| 481 | D | 93.8 | Very high | 93.3 | Very high | 6 Ų | 6 | 11.3 Ų | 11.3 | 3% | 0.032 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -64.9 | -45.7 | 178.3 | -62.7 | -18.6 | 0 | 0 | 0 | 112.2 | L385 G388 A389 N392 N477 V478 E479 G484 A485 | L385-D481 HydrophobicContact CD2-CB 3.94Å; G388-D481 VanDerWaalsContact C-CG 3.46Å; G388-D481 VanDerWaalsContact C-OD1 3.31Å; G388-D481 VanDerWaalsContact CA-OD1 3.26Å; G388-D481 WeakPolarHBondContact CA-OD1 3.17Å; A389-D481 PolarHBondContact N-OD2 2.89Å; A389-D481 VanDerWaalsContact N-OD2 3.17Å; N392-D481 WeakPolarHBondContact CB-OD1 3.28Å; N392-D481 PolarHBondContact ND2-N 2.91Å; N392-D481 PolarHBondContact ND2-OD1 2.85Å; N477-D481 PolarHBondContact O-N 2.97Å; V478-D481 PolarHBondContact O-N 3.19Å; E479-D481 VanDerWaalsContact C-N 3.28Å; E479-D481 PolarHBondContact O-N 3.02Å; D481-G484 PolarHBondContact O-N 2.8Å; D481-A485 PolarHBondContact O-N 2.85Å |
| 482 | A | 94.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 12.2 Ų | 12.2 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -68.7 | -41.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112 | F342 L346 M366 V370 V478 E479 G484 A485 G486 | F342-A482 HydrophobicContact CE1-CB 4.28Å; F342-A482 WeakPolarHBondContact CE1-O 3.17Å; F342-A482 VanDerWaalsContact CZ-O 3.28Å; F342-A482 WeakPolarHBondContact CZ-O 3.33Å; L346-A482 HydrophobicContact CD1-CB 3.45Å; L346-A482 VanDerWaalsContact CD1-CB 3.45Å; M366-A482 HydrophobicContact CE-CB 3.72Å; M366-A482 HydrophobicContact SD-CB 3.77Å; V370-A482 HydrophobicContact CG2-CB 4.17Å; V478-A482 PolarHBondContact O-N 3.31Å; V478-A482 VanDerWaalsContact O-N 3.15Å; E479-A482 PolarHBondContact O-N 3.26Å; A482-G484 VanDerWaalsContact C-N 3.35Å; A482-A485 PolarHBondContact O-N 3.43Å; A482-G486 PolarHBondContact O-N 2.86Å |
| 483 | L | 96.1 | Very high | 93.2 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -66 | -39.1 | 174.2 | -70.2 | 173.7 | 0 | 0 | 0 | 111.2 | L327 Y331 F342 L343 E479 A485 G486 I487 | L327-L483 HydrophobicContact CB-CD1 3.63Å; Y331-L483 HydrophobicContact CD2-CB 4.35Å; Y331-L483 HydrophobicContact CD2-CD2 3.61Å; Y331-L483 HydrophobicContact CE2-CD2 4.21Å; Y331-L483 HydrophobicContact CG-CD2 3.93Å; F342-L483 HydrophobicContact CD1-CD2 3.73Å; F342-L483 HydrophobicContact CE1-CD2 4.11Å; L343-L483 HydrophobicContact CD2-CD1 4.28Å; L343-L483 HydrophobicContact CD2-CD2 4.08Å; L343-L483 HydrophobicContact CD2-CG 4.23Å; E479-L483 HydrophobicContact CG-CD1 3.93Å; E479-L483 HydrophobicContact CG-CG 4.49Å; E479-L483 WeakPolarHBondContact O-CG 3.22Å; E479-L483 PolarHBondContact O-N 3.34Å; L483-A485 PolarHBondContact O-N 2.91Å; L483-G486 PolarHBondContact O-N 2.88Å; L483-G486 VanDerWaalsContact O-N 3.17Å; L483-I487 WeakPolarHBondContact O-CG1 3.33Å; L483-I487 PolarHBondContact O-N 2.69Å |
| 484 | G | 94.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -57.5 | -46.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y136 G480 D481 A482 G486 I487 L488 | Y136-G484 PolarHBondContact OH-N 3.3Å; G480-G484 PolarHBondContact O-N 3.49Å; D481-G484 PolarHBondContact O-N 2.8Å; A482-G484 VanDerWaalsContact C-N 3.35Å; G484-G486 VanDerWaalsContact C-N 3.32Å; G484-G486 PolarHBondContact O-N 3.33Å; G484-I487 PolarHBondContact O-N 3.39Å; G484-L488 PolarHBondContact O-N 3.34Å |
| 485 | A | 92.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.5 | -40.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I384 L385 D481 A482 L483 H489 | I384-A485 HydrophobicContact CG2-CB 4.47Å; L385-A485 HydrophobicContact CD2-CB 4.13Å; L385-A485 HydrophobicContact CG-CB 4.42Å; D481-A485 PolarHBondContact O-N 2.85Å; A482-A485 PolarHBondContact O-N 3.43Å; L483-A485 PolarHBondContact O-N 2.91Å; A485-H489 VanDerWaalsContact O-CB 3.28Å; A485-H489 WeakPolarHBondContact O-CB 3.24Å; A485-H489 PolarHBondContact O-N 3.27Å |
| 486 | G | 94.1 | Very high | 92.1 | Very high | 3 Ų | 3 | 24.4 Ų | 24.4 | 3% | 0.031 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -67.2 | -39.6 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | A482 L483 G484 H490 | A482-G486 PolarHBondContact O-N 2.86Å; L483-G486 PolarHBondContact O-N 2.88Å; L483-G486 VanDerWaalsContact O-N 3.17Å; G484-G486 VanDerWaalsContact C-N 3.32Å; G484-G486 PolarHBondContact O-N 3.33Å; G486-H490 PolarHBondContact O-N 3.09Å |
| 487 | I | 94.7 | Very high | 91.6 | Very high | 4 Ų | 4 | 29.9 Ų | 29.9 | 2% | 0.021 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -65.4 | -49.7 | 176.3 | -69 | 163.8 | 0 | 0 | 0 | 110.1 | Y136 I330 Y331 F334 T335 L483 G484 H489 H490 I491 | Y136-I487 HydrophobicContact CD2-CD1 4.2Å; Y136-I487 HydrophobicContact CE2-CD1 3.59Å; I330-I487 HydrophobicContact CG2-CD1 4.12Å; Y331-I487 HydrophobicContact CD2-CD1 4.33Å; Y331-I487 HydrophobicContact CD2-CG1 3.73Å; Y331-I487 HydrophobicContact CE2-CG1 4.38Å; Y331-I487 HydrophobicContact CG-CG1 4.43Å; F334-I487 HydrophobicContact CB-CG2 3.99Å; F334-I487 HydrophobicContact CD2-CG2 4.45Å; F334-I487 HydrophobicContact CG-CG2 4.18Å; T335-I487 HydrophobicContact CG2-CG1 4.21Å; L483-I487 WeakPolarHBondContact O-CG1 3.33Å; L483-I487 PolarHBondContact O-N 2.69Å; G484-I487 PolarHBondContact O-N 3.39Å; I487-H489 VanDerWaalsContact C-N 3.27Å; I487-H489 PolarHBondContact O-N 3.16Å; I487-H490 WeakPolarHBondContact O-CB 3.49Å; I487-H490 PolarHBondContact O-N 3.07Å; I487-I491 HydrophobicContact CG2-CD1 3.81Å; I487-I491 HydrophobicContact CG2-CG1 4.43Å; I487-I491 WeakPolarHBondContact O-CG1 3.1Å; I487-I491 PolarHBondContact O-N 3.43Å |
| 488 | L | 91.9 | Very high | 91.2 | Very high | 1 Ų | 1 | 35.5 Ų | 35.5 | 1% | 0.005 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63.4 | -36.3 | 179.9 | -97.8 | 71 | 0 | 0 | 0 | 112.1 | L129 I132 A133 I380 I384 G484 H490 I491 N492 | L129-L488 HydrophobicContact CD1-CB 4.12Å; L129-L488 HydrophobicContact CD1-CD2 3.94Å; L129-L488 HydrophobicContact CD1-CG 3.85Å; L129-L488 HydrophobicContact CG-CD2 3.96Å; L129-L488 HydrophobicContact CG-CG 4.42Å; L129-L488 WeakPolarHBondContact O-CD2 3.47Å; I132-L488 HydrophobicContact CG2-CD1 4.04Å; I132-L488 HydrophobicContact CG2-CG 4.49Å; A133-L488 HydrophobicContact CB-CD2 3.49Å; A133-L488 VanDerWaalsContact CB-CD2 3.49Å; I380-L488 HydrophobicContact CG2-CB 4.17Å; I384-L488 HydrophobicContact CD1-CB 3.64Å; I384-L488 HydrophobicContact CD1-CD2 3.3Å; I384-L488 HydrophobicContact CD1-CG 4.01Å; I384-L488 HydrophobicContact CG1-CD2 4.2Å; G484-L488 PolarHBondContact O-N 3.34Å; L488-H490 VanDerWaalsContact C-N 3.31Å; L488-H490 PolarHBondContact O-N 3.28Å; L488-I491 PolarHBondContact O-N 3.2Å; L488-N492 VanDerWaalsContact O-CB 3.32Å; L488-N492 WeakPolarHBondContact O-CB 3.25Å; L488-N492 PolarHBondContact O-N 3.33Å |
| 489 | H | 92.5 | Very high | 90.6 | Very high | 30 Ų | 30 | 40.4 Ų | 40.4 | 14% | 0.139 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58 | -43.7 | 172 | 179.7 | 67.8 | 0 | 0 | 0 | 112.5 | V376 D377 I380 A485 I487 Q493 | V376-H489 HydrophobicContact CG1-CB 4.04Å; V376-H489 HydrophobicContact CG2-CB 4.42Å; D377-H489 PolarHBondContact N-CE1 3.44Å; D377-H489 PolarHBondContact N-ND1 3.22Å; I380-H489 HydrophobicContact CD1-CB 4.2Å; A485-H489 VanDerWaalsContact O-CB 3.28Å; A485-H489 WeakPolarHBondContact O-CB 3.24Å; A485-H489 PolarHBondContact O-N 3.27Å; I487-H489 VanDerWaalsContact C-N 3.27Å; I487-H489 PolarHBondContact O-N 3.16Å; H489-Q493 PolarHBondContact CE1-NE2 3.44Å; H489-Q493 VanDerWaalsContact CE1-NE2 3.31Å; H489-Q493 PolarHBondContact NE2-NE2 3.23Å; H489-Q493 WeakPolarHBondContact O-CG 3.49Å; H489-Q493 PolarHBondContact O-N 3.3Å |
| 490 | H | 92 | Very high | 89.9 | Confident | 34 Ų | 34 | 46 Ų | 46 | 16% | 0.157 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.9 | -45.1 | 177.4 | -173.1 | 64.9 | 0 | 0 | 0 | 112.4 | F334 T335 G486 I487 L488 N492 Q493 L494 | F334-H490 PolarHBondContact O-CD2 3.02Å; T335-H490 HydrophobicContact CG2-CB 3.86Å; G486-H490 PolarHBondContact O-N 3.09Å; I487-H490 WeakPolarHBondContact O-CB 3.49Å; I487-H490 PolarHBondContact O-N 3.07Å; L488-H490 VanDerWaalsContact C-N 3.31Å; L488-H490 PolarHBondContact O-N 3.28Å; H490-N492 VanDerWaalsContact C-N 3.33Å; H490-N492 PolarHBondContact O-N 3.41Å; H490-Q493 PolarHBondContact O-N 3.33Å; H490-L494 WeakPolarHBondContact O-CG 3.39Å; H490-L494 PolarHBondContact O-N 2.98Å |
| 491 | I | 90.8 | Very high | 89.2 | Confident | 39 Ų | 39 | 52 Ų | 52 | 20% | 0.2 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -59.5 | -46.1 | 178 | -66.4 | 171.9 | 0 | 0 | 0 | 110.5 | I132 I487 L488 Q493 L494 E495 | I132-I491 HydrophobicContact CD1-CG2 4.23Å; I132-I491 HydrophobicContact CG2-CD1 4.03Å; I487-I491 HydrophobicContact CG2-CD1 3.81Å; I487-I491 HydrophobicContact CG2-CG1 4.43Å; I487-I491 WeakPolarHBondContact O-CG1 3.1Å; I487-I491 PolarHBondContact O-N 3.43Å; L488-I491 PolarHBondContact O-N 3.2Å; I491-Q493 VanDerWaalsContact C-N 3.34Å; I491-Q493 PolarHBondContact O-N 3.47Å; I491-L494 PolarHBondContact O-N 3.04Å; I491-E495 PolarHBondContact O-N 2.81Å |
| 492 | N | 88.3 | Confident | 88.7 | Confident | 41 Ų | 41 | 54.7 Ų | 54.7 | 22% | 0.219 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.8 | -37.6 | 178.3 | -172.3 | 62.5 | 0 | 0 | 0 | 112.4 | L129 I380 L488 H490 E495 M496 | L129-N492 HydrophobicContact CD1-CB 4.18Å; L129-N492 HydrophobicContact CD2-CB 4.44Å; I380-N492 HydrophobicContact CD1-CB 3.87Å; L488-N492 VanDerWaalsContact O-CB 3.32Å; L488-N492 WeakPolarHBondContact O-CB 3.25Å; L488-N492 PolarHBondContact O-N 3.33Å; H490-N492 VanDerWaalsContact C-N 3.33Å; H490-N492 PolarHBondContact O-N 3.41Å; N492-E495 PolarHBondContact O-N 3.49Å; N492-M496 WeakPolarHBondContact O-CB 3.43Å; N492-M496 VanDerWaalsContact O-CG 3.24Å; N492-M496 WeakPolarHBondContact O-CG 3.21Å; N492-M496 PolarHBondContact O-N 2.89Å |
| 493 | Q | 88.1 | Confident | 88.1 | Confident | 71 Ų | 71 | 57.7 Ų | 57.7 | 33% | 0.332 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63.9 | -39.3 | 173.5 | -76.8 | -167.6 | 10.5 | 0 | 0 | 112.7 | H489 H490 I491 M496 K497 | H489-Q493 PolarHBondContact CE1-NE2 3.44Å; H489-Q493 VanDerWaalsContact CE1-NE2 3.31Å; H489-Q493 PolarHBondContact NE2-NE2 3.23Å; H489-Q493 WeakPolarHBondContact O-CG 3.49Å; H489-Q493 PolarHBondContact O-N 3.3Å; H490-Q493 PolarHBondContact O-N 3.33Å; I491-Q493 VanDerWaalsContact C-N 3.34Å; I491-Q493 PolarHBondContact O-N 3.47Å; Q493-M496 PolarHBondContact O-N 2.94Å; Q493-K497 WeakPolarHBondContact O-CG 3.46Å; Q493-K497 PolarHBondContact O-N 2.95Å |
| 494 | L | 87.3 | Confident | 87.2 | Confident | 91 Ų | 91 | 60.1 Ų | 60.1 | 48% | 0.476 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -66.1 | -44.6 | 177.6 | -70.6 | 174 | 0 | 0 | 0 | 111.2 | H490 I491 M496 K497 K498 | H490-L494 WeakPolarHBondContact O-CG 3.39Å; H490-L494 PolarHBondContact O-N 2.98Å; I491-L494 PolarHBondContact O-N 3.04Å; L494-M496 VanDerWaalsContact C-N 3.3Å; L494-M496 PolarHBondContact O-N 3.12Å; L494-K497 PolarHBondContact O-N 3.21Å; L494-K498 WeakPolarHBondContact O-CB 3.3Å; L494-K498 PolarHBondContact O-N 2.95Å |
| 495 | E | 85 | Confident | 86.4 | Confident | 71 Ų | 71 | 66.2 Ų | 66.2 | 33% | 0.332 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61.4 | -41.6 | 177.1 | -170.2 | 157.4 | -139.3 | 0 | 0 | 111 | K128 I491 N492 K498 H499 | K128-E495 WeakPolarHBondContact CD-OE1 3.27Å; K128-E495 IonicContact NZ-OE1 2.68Å; K128-E495 PolarHBondContact NZ-OE1 3.03Å; I491-E495 PolarHBondContact O-N 2.81Å; N492-E495 PolarHBondContact O-N 3.49Å; E495-K498 PolarHBondContact O-N 2.57Å; E495-H499 PolarHBondContact O-N 3.36Å |
| 496 | M | 82.8 | Confident | 85.5 | Confident | 90 Ų | 90 | 72 Ų | 72 | 44% | 0.443 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -67.6 | -38.4 | 177.5 | -70.7 | -87.8 | 51.5 | 0 | 0 | 113.8 | N492 Q493 L494 H499 Q500 | N492-M496 WeakPolarHBondContact O-CB 3.43Å; N492-M496 VanDerWaalsContact O-CG 3.24Å; N492-M496 WeakPolarHBondContact O-CG 3.21Å; N492-M496 PolarHBondContact O-N 2.89Å; Q493-M496 PolarHBondContact O-N 2.94Å; L494-M496 VanDerWaalsContact C-N 3.3Å; L494-M496 PolarHBondContact O-N 3.12Å; M496-H499 HydrophobicContact CE-CB 4.15Å; M496-H499 PolarHBondContact O-N 2.78Å; M496-Q500 WeakPolarHBondContact O-CG 3.19Å; M496-Q500 PolarHBondContact O-N 3.34Å |
| 497 | K | 86.6 | Confident | 84.5 | Confident | 121 Ų | 121 | 77.1 Ų | 77.1 | 53% | 0.526 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -64.6 | -41.7 | 173.9 | -77 | 178 | 180 | -175.6 | 0 | 111.8 | Q493 L494 Q500 Q501 | Q493-K497 WeakPolarHBondContact O-CG 3.46Å; Q493-K497 PolarHBondContact O-N 2.95Å; L494-K497 PolarHBondContact O-N 3.21Å; K497-Q500 PolarHBondContact O-N 2.86Å; K497-Q501 WeakPolarHBondContact O-CG 2.94Å; K497-Q501 PolarHBondContact O-N 2.77Å |
| 498 | K | 85.1 | Confident | 83.3 | Confident | 123 Ų | 123 | 83.5 Ų | 83.5 | 54% | 0.535 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.5 | -45.1 | 177.5 | -165.1 | -170.9 | -179.7 | -126.8 | 0 | 111 | L494 E495 Q500 Q501 E502 | L494-K498 WeakPolarHBondContact O-CB 3.3Å; L494-K498 PolarHBondContact O-N 2.95Å; E495-K498 PolarHBondContact O-N 2.57Å; K498-Q500 VanDerWaalsContact C-N 3.34Å; K498-Q500 PolarHBondContact O-N 3.17Å; K498-Q501 WeakPolarHBondContact O-CB 3.45Å; K498-Q501 PolarHBondContact O-N 3.29Å; K498-Q501 VanDerWaalsContact O-N 3.13Å; K498-E502 WeakPolarHBondContact CE-OE1 3.36Å; K498-E502 IonicContact NZ-OE1 2.94Å; K498-E502 PolarHBondContact NZ-OE1 3.03Å; K498-E502 WeakPolarHBondContact O-CG 3.41Å; K498-E502 PolarHBondContact O-N 3.39Å |
| 499 | H | 81 | Confident | 82 | Confident | 106 Ų | 106 | 90.2 Ų | 90.2 | 49% | 0.491 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.6 | -36.9 | 178.4 | -140.9 | 52.3 | 0 | 0 | 0 | 112.4 | E495 M496 Q501 E502 V503 | E495-H499 PolarHBondContact O-N 3.36Å; M496-H499 HydrophobicContact CE-CB 4.15Å; M496-H499 PolarHBondContact O-N 2.78Å; H499-Q501 VanDerWaalsContact C-N 3.32Å; H499-E502 IonicContact CE1-OE2 3.87Å; H499-E502 IonicContact ND1-OE2 3.72Å; H499-E502 PolarHBondContact ND1-OE2 3.47Å; H499-E502 VanDerWaalsContact ND1-OE2 3.17Å; H499-E502 PolarHBondContact O-N 3.06Å; H499-V503 WeakPolarHBondContact O-CB 3.02Å; H499-V503 VanDerWaalsContact O-CG2 3.25Å; H499-V503 WeakPolarHBondContact O-CG2 3.32Å; H499-V503 PolarHBondContact O-N 3.03Å |
| 500 | Q | 81.1 | Confident | 80.4 | Confident | 135 Ų | 135 | 93.3 Ų | 93.3 | 63% | 0.631 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -65 | -35.1 | 172.4 | -76.1 | 176.9 | -8.5 | 0 | 0 | 112.7 | M496 K497 K498 A504 | M496-Q500 WeakPolarHBondContact O-CG 3.19Å; M496-Q500 PolarHBondContact O-N 3.34Å; K497-Q500 PolarHBondContact O-N 2.86Å; K498-Q500 VanDerWaalsContact C-N 3.34Å; K498-Q500 PolarHBondContact O-N 3.17Å; Q500-A504 VanDerWaalsContact O-CB 3.23Å; Q500-A504 WeakPolarHBondContact O-CB 3.5Å; Q500-A504 PolarHBondContact O-N 2.74Å |
| 501 | Q | 80.8 | Confident | 78.6 | Confident | 125 Ų | 125 | 99.4 Ų | 99.4 | 58% | 0.584 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -69.6 | -46 | 173.9 | -76.9 | 178.5 | -43.7 | 0 | 0 | 111.7 | K497 K498 H499 V503 A504 E505 | K497-Q501 WeakPolarHBondContact O-CG 2.94Å; K497-Q501 PolarHBondContact O-N 2.77Å; K498-Q501 WeakPolarHBondContact O-CB 3.45Å; K498-Q501 PolarHBondContact O-N 3.29Å; K498-Q501 VanDerWaalsContact O-N 3.13Å; H499-Q501 VanDerWaalsContact C-N 3.32Å; Q501-V503 VanDerWaalsContact C-N 3.35Å; Q501-V503 PolarHBondContact O-N 3.06Å; Q501-A504 PolarHBondContact O-N 2.91Å; Q501-A504 VanDerWaalsContact O-N 3.13Å; Q501-E505 WeakPolarHBondContact O-CG 3.43Å; Q501-E505 PolarHBondContact O-N 2.71Å |
| 502 | E | 82.3 | Confident | 76.9 | Confident | 63 Ų | 63 | 103 Ų | 103 | 29% | 0.294 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57.5 | -47.1 | 176.2 | -71.7 | 167.3 | 176.1 | 0 | 0 | 110.7 | K498 H499 A504 E505 E506 | K498-E502 WeakPolarHBondContact CE-OE1 3.36Å; K498-E502 IonicContact NZ-OE1 2.94Å; K498-E502 PolarHBondContact NZ-OE1 3.03Å; K498-E502 WeakPolarHBondContact O-CG 3.41Å; K498-E502 PolarHBondContact O-N 3.39Å; H499-E502 IonicContact CE1-OE2 3.87Å; H499-E502 IonicContact ND1-OE2 3.72Å; H499-E502 PolarHBondContact ND1-OE2 3.47Å; H499-E502 VanDerWaalsContact ND1-OE2 3.17Å; H499-E502 PolarHBondContact O-N 3.06Å; E502-A504 VanDerWaalsContact C-N 3.34Å; E502-A504 PolarHBondContact O-N 2.89Å; E502-E505 PolarHBondContact O-N 2.97Å; E502-E506 WeakPolarHBondContact O-CG 3.5Å; E502-E506 PolarHBondContact O-N 3.24Å |
| 503 | V | 81.8 | Confident | 75.2 | Confident | 64 Ų | 64 | 108.9 Ų | 108.9 | 39% | 0.388 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.9 | -35.3 | 176.3 | 173.1 | 0 | 0 | 0 | 0 | 112.2 | H499 Q501 L507 | H499-V503 WeakPolarHBondContact O-CB 3.02Å; H499-V503 VanDerWaalsContact O-CG2 3.25Å; H499-V503 WeakPolarHBondContact O-CG2 3.32Å; H499-V503 PolarHBondContact O-N 3.03Å; Q501-V503 VanDerWaalsContact C-N 3.35Å; Q501-V503 PolarHBondContact O-N 3.06Å; V503-L507 HydrophobicContact CG1-CD1 3.94Å; V503-L507 HydrophobicContact CG1-CG 4.46Å; V503-L507 WeakPolarHBondContact O-CB 3.45Å; V503-L507 WeakPolarHBondContact O-CD1 3.5Å; V503-L507 WeakPolarHBondContact O-CG 3.44Å; V503-L507 PolarHBondContact O-N 2.79Å |
| 504 | A | 77.8 | Confident | 73.3 | Confident | 51 Ų | 51 | 109.7 Ų | 109.7 | 42% | 0.421 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -68.5 | -39.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q500 Q501 E502 L507 E508 | Q500-A504 VanDerWaalsContact O-CB 3.23Å; Q500-A504 WeakPolarHBondContact O-CB 3.5Å; Q500-A504 PolarHBondContact O-N 2.74Å; Q501-A504 PolarHBondContact O-N 2.91Å; Q501-A504 VanDerWaalsContact O-N 3.13Å; E502-A504 VanDerWaalsContact C-N 3.34Å; E502-A504 PolarHBondContact O-N 2.89Å; A504-L507 PolarHBondContact O-N 3.1Å; A504-E508 PolarHBondContact O-N 3.26Å |
| 505 | E | 76.7 | Confident | 71.5 | Confident | 127 Ų | 127 | 111.1 Ų | 111.1 | 59% | 0.593 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.1 | -44.6 | 174.7 | -74.8 | 176.1 | -178.3 | 0 | 0 | 111.2 | Q501 E502 L507 E508 E509 | Q501-E505 WeakPolarHBondContact O-CG 3.43Å; Q501-E505 PolarHBondContact O-N 2.71Å; E502-E505 PolarHBondContact O-N 2.97Å; E505-L507 VanDerWaalsContact C-N 3.33Å; E505-L507 PolarHBondContact O-N 3.11Å; E505-E508 PolarHBondContact O-N 3.37Å; E505-E508 VanDerWaalsContact O-N 3.15Å; E505-E509 PolarHBondContact O-N 3.18Å |
| 506 | E | 75.1 | Confident | 69.6 | Low | 123 Ų | 123 | 111.2 Ų | 111.2 | 58% | 0.575 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -60.6 | -40.9 | 174.2 | -74 | 179.9 | 179 | 0 | 0 | 112 | E502 E508 E509 V510 | E502-E506 WeakPolarHBondContact O-CG 3.5Å; E502-E506 PolarHBondContact O-N 3.24Å; E506-E508 VanDerWaalsContact C-N 3.32Å; E506-E508 PolarHBondContact O-N 2.77Å; E506-E509 PolarHBondContact O-N 2.8Å; E506-V510 VanDerWaalsContact O-CG2 3.26Å; E506-V510 WeakPolarHBondContact O-CG2 3.46Å; E506-V510 PolarHBondContact O-N 3.26Å |
| 507 | L | 73.6 | Confident | 67.8 | Low | 110 Ų | 110 | 113.1 Ų | 113.1 | 58% | 0.576 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -68.9 | -29.1 | 176.3 | -74.9 | 168.1 | 0 | 0 | 0 | 113 | V503 A504 E505 K511 | V503-L507 HydrophobicContact CG1-CD1 3.94Å; V503-L507 HydrophobicContact CG1-CG 4.46Å; V503-L507 WeakPolarHBondContact O-CB 3.45Å; V503-L507 WeakPolarHBondContact O-CD1 3.5Å; V503-L507 WeakPolarHBondContact O-CG 3.44Å; V503-L507 PolarHBondContact O-N 2.79Å; A504-L507 PolarHBondContact O-N 3.1Å; E505-L507 VanDerWaalsContact C-N 3.33Å; E505-L507 PolarHBondContact O-N 3.11Å; L507-K511 PolarHBondContact O-N 3.17Å |
| 508 | E | 68.4 | Low | 66 | Low | 138 Ų | 138 | 113.8 Ų | 113.8 | 65% | 0.645 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -74.4 | -42.9 | 172.5 | -79.2 | -170.4 | 167.8 | 0 | 0 | 111.6 | A504 E505 E506 V510 K511 V512 | A504-E508 PolarHBondContact O-N 3.26Å; E505-E508 PolarHBondContact O-N 3.37Å; E505-E508 VanDerWaalsContact O-N 3.15Å; E506-E508 VanDerWaalsContact C-N 3.32Å; E506-E508 PolarHBondContact O-N 2.77Å; E508-V510 PolarHBondContact O-N 2.87Å; E508-K511 PolarHBondContact O-N 3.12Å; E508-V512 WeakPolarHBondContact O-CG2 3.49Å; E508-V512 PolarHBondContact O-N 2.53Å; E508-V512 VanDerWaalsContact O-N 3.11Å |
| 509 | E | 64.9 | Low | 63.9 | Low | 142 Ų | 142 | 115 Ų | 115 | 66% | 0.664 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -59.6 | -45.3 | 174.6 | -82.3 | -170.6 | 154.8 | 0 | 0 | 112.1 | E505 E506 K511 V512 E513 | E505-E509 PolarHBondContact O-N 3.18Å; E506-E509 PolarHBondContact O-N 2.8Å; E509-K511 VanDerWaalsContact C-N 3.26Å; E509-K511 PolarHBondContact O-N 2.67Å; E509-V512 PolarHBondContact O-N 3.04Å; E509-E513 PolarHBondContact O-N 3.46Å |
| 510 | V | 58.4 | Low | 62.4 | Low | 95 Ų | 95 | 114.4 Ų | 114.4 | 58% | 0.576 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -63.1 | -31.8 | 177.6 | 173.1 | 0 | 0 | 0 | 0 | 112.1 | E506 E508 S514 | E506-V510 VanDerWaalsContact O-CG2 3.26Å; E506-V510 WeakPolarHBondContact O-CG2 3.46Å; E506-V510 PolarHBondContact O-N 3.26Å; E508-V510 PolarHBondContact O-N 2.87Å; V510-S514 PolarHBondContact O-N 3.37Å |
| 511 | K | 54.1 | Low | 60.6 | Low | 161 Ų | 161 | 116 Ų | 116 | 70% | 0.7 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70.6 | -34.7 | 173.7 | -87.4 | 178.8 | 177.8 | 174.2 | 0 | 112.5 | L507 E508 E509 S514 | L507-K511 PolarHBondContact O-N 3.17Å; E508-K511 PolarHBondContact O-N 3.12Å; E509-K511 VanDerWaalsContact C-N 3.26Å; E509-K511 PolarHBondContact O-N 2.67Å; K511-S514 PolarHBondContact O-N 3Å; K511-S514 PolarHBondContact O-OG 3.27Å |
| 512 | V | 55.8 | Low | 58.7 | Low | 115 Ų | 115 | 118.6 Ų | 118.6 | 70% | 0.697 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -75.2 | -30.2 | 179.2 | -179.4 | 0 | 0 | 0 | 0 | 111.5 | E508 E509 S514 | E508-V512 WeakPolarHBondContact O-CG2 3.49Å; E508-V512 PolarHBondContact O-N 2.53Å; E508-V512 VanDerWaalsContact O-N 3.11Å; E509-V512 PolarHBondContact O-N 3.04Å; V512-S514 VanDerWaalsContact C-N 3.3Å; V512-S514 PolarHBondContact O-N 2.76Å |
| 513 | E | 51.8 | Low | 56.6 | Low | 165 Ų | 165 | 124.6 Ų | 124.6 | 77% | 0.771 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -72.2 | -19.1 | 172.4 | -75.6 | -169 | 153.6 | 0 | 0 | 114 | E509 V515 | E509-E513 PolarHBondContact O-N 3.46Å; E513-V515 PolarHBondContact O-N 3.36Å |
| 514 | S | 49.3 | Very low | 54.6 | Low | 87 Ų | 87 | 127.2 Ų | 127.2 | 61% | 0.608 | 69% | 0.685 | S | S | * | * | trans | -74.7 | 53.7 | 169.1 | 72.7 | 0 | 0 | 0 | 0 | 112.3 | V510 K511 V512 A516 | V510-S514 PolarHBondContact O-N 3.37Å; K511-S514 PolarHBondContact O-N 3Å; K511-S514 PolarHBondContact O-OG 3.27Å; V512-S514 VanDerWaalsContact C-N 3.3Å; V512-S514 PolarHBondContact O-N 2.76Å; S514-A516 PolarHBondContact O-N 3Å | ||
| 515 | V | 48.3 | Very low | 52.8 | Low | 121 Ų | 121 | 129.8 Ų | 129.8 | 73% | 0.733 | 70% | 0.7 | S | S | * | * | trans | -64.1 | 120.1 | 164.8 | 178.7 | 0 | 0 | 0 | 0 | 106.9 | E513 N517 | E513-V515 PolarHBondContact O-N 3.36Å; V515-N517 PolarHBondContact O-N 2.89Å | ||
| 516 | A | 46.4 | Very low | 51.1 | Low | 74 Ų | 74 | 129.8 Ų | 129.8 | 61% | 0.612 | 71% | 0.711 | S | S | * | * | trans | -48.2 | 118 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | S514 V518 | S514-A516 PolarHBondContact O-N 3Å; A516-V518 VanDerWaalsContact C-N 3.29Å; A516-V518 HydrophobicContact CB-CG2 4.39Å; A516-V518 PolarHBondContact O-N 3.45Å | ||
| 517 | N | 45.3 | Very low | 49.5 | Very low | 130 Ų | 130 | 131.2 Ų | 131.2 | 70% | 0.695 | 72% | 0.721 | S | S | * | * | trans | -64.8 | 96.9 | 166.7 | -173 | 22.7 | 0 | 0 | 0 | 107.1 | V515 Q519 | V515-N517 PolarHBondContact O-N 2.89Å; N517-Q519 PolarHBondContact O-N 3.4Å; N517-Q519 PolarHBondContact OD1-N 2.85Å | ||
| 518 | V | 48 | Very low | 48 | Very low | 135 Ų | 135 | 132.5 Ų | 132.5 | 82% | 0.818 | 73% | 0.734 | S | S | * | * | trans | -74.5 | 2 | 177.5 | -178.8 | 0 | 0 | 0 | 0 | 111.4 | A516 A520 | A516-V518 VanDerWaalsContact C-N 3.29Å; A516-V518 HydrophobicContact CB-CG2 4.39Å; A516-V518 PolarHBondContact O-N 3.45Å; V518-A520 VanDerWaalsContact C-N 3.29Å; V518-A520 PolarHBondContact O-N 2.83Å | ||
| 519 | Q | 41.3 | Very low | 46.3 | Very low | 149 Ų | 149 | 134.7 Ų | 134.7 | 70% | 0.696 | 75% | 0.746 | S | S | * | * | trans | -89.7 | 73.3 | 163.6 | -68.7 | -177.1 | -15.8 | 0 | 0 | 109.7 | N517 E521 | N517-Q519 PolarHBondContact O-N 3.4Å; N517-Q519 PolarHBondContact OD1-N 2.85Å; Q519-E521 PolarHBondContact O-N 3.34Å; Q519-E521 VanDerWaalsContact O-N 3.1Å | ||
| 520 | A | 49.8 | Very low | 44.8 | Very low | 92 Ų | 92 | 136.8 Ų | 136.8 | 76% | 0.76 | 76% | 0.755 | S | S | * | * | trans | -69.1 | 89.4 | 149 | 0 | 0 | 0 | 0 | 0 | 106.8 | V518 E522 | V518-A520 VanDerWaalsContact C-N 3.29Å; V518-A520 PolarHBondContact O-N 2.83Å; A520-E522 PolarHBondContact O-N 2.89Å | ||
| 521 | E | 42.2 | Very low | 43.4 | Very low | 170 Ų | 170 | 140.7 Ų | 140.7 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | trans | -72.7 | 119.2 | 153.6 | -79.8 | -171.8 | 158.8 | 0 | 0 | 106.6 | Q519 E523 | Q519-E521 PolarHBondContact O-N 3.34Å; Q519-E521 VanDerWaalsContact O-N 3.1Å; E521-E523 PolarHBondContact O-N 2.87Å | ||
| 522 | E | 42.3 | Very low | 42.2 | Very low | 178 Ų | 178 | 139.8 Ų | 139.8 | 83% | 0.832 | 78% | 0.775 | S | S | * | * | trans | -54.7 | 99.3 | 168.4 | -70.6 | 176.5 | 146.1 | 0 | 0 | 108.5 | A520 T524 | A520-E522 PolarHBondContact O-N 2.89Å; E522-T524 PolarHBondContact O-N 2.98Å | ||
| 523 | E | 37 | Very low | 40.9 | Very low | 190 Ų | 190 | 143.2 Ų | 143.2 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | trans | -66.8 | 88.7 | 160.2 | -81.2 | -162.5 | 161 | 0 | 0 | 107.8 | E521 S525 | E521-E523 PolarHBondContact O-N 2.87Å; E523-S525 PolarHBondContact O-N 3.43Å | ||
| 524 | T | 40 | Very low | 39.9 | Very low | 118 Ų | 118 | 142.7 Ų | 142.7 | 72% | 0.724 | 78% | 0.782 | S | S | * | * | trans | -65.5 | 100.1 | 163.6 | 50.7 | 0 | 0 | 0 | 0 | 108.3 | E522 | E522-T524 PolarHBondContact O-N 2.98Š| ||
| 525 | S | 41 | Very low | 39 | Very low | 105 Ų | 105 | 144.8 Ų | 144.8 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | trans | -56.7 | 125 | 168.4 | -136.6 | 0 | 0 | 0 | 0 | 109.7 | E523 L527 | E523-S525 PolarHBondContact O-N 3.43Å; S525-L527 PolarHBondContact O-N 2.81Å | ||
| 526 | P | 40.7 | Very low | 38.1 | Very low | 127 Ų | 127 | 147.7 Ų | 147.7 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | 30.7 | -166.9 | 33.1 | -35.6 | 0 | 0 | 0 | 114.5 | ||
| 527 | L | 40.3 | Very low | 37.3 | Very low | 153 Ų | 153 | 148 Ų | 148 | 80% | 0.801 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132 | 9.4 | -167 | -96 | 166.7 | 0 | 0 | 0 | 118.2 | S525 | S525-L527 PolarHBondContact O-N 2.81Š|
| 528 | V | 43.7 | Very low | 36.6 | Very low | 138 Ų | 138 | 150.3 Ų | 150.3 | 84% | 0.836 | 81% | 0.811 | S | S | * | * | trans | -139.9 | 87.5 | 174.8 | -169.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 529 | M | 31.7 | Very low | 36.6 | Very low | 184 Ų | 184 | 148.1 Ų | 148.1 | 91% | 0.906 | 80% | 0.799 | S | S | * | * | trans | -162.9 | 84.5 | 144.6 | -83.4 | -132.9 | -148.1 | 0 | 0 | 110 | ||||
| 530 | H | 33.2 | Very low | 36.2 | Very low | 185 Ų | 185 | 149.9 Ų | 149.9 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | trans | -160.8 | 94.1 | 142.6 | -114 | -62.5 | 0 | 0 | 0 | 108.7 | ||||
| 531 | Q | 29.7 | Very low | 35.4 | Very low | 178 Ų | 178 | 149.1 Ų | 149.1 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | 165.3 | 120.5 | 127.6 | -95.9 | 174.3 | -23.7 | 0 | 0 | 110.3 | |||||
| 532 | T | 28.1 | Very low | 35.2 | Very low | 141 Ų | 141 | 148.2 Ų | 148.2 | 87% | 0.865 | 80% | 0.8 | S | S | * | * | trans | -136 | 135.7 | 148.2 | -38.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 533 | K | 28.4 | Very low | 34.8 | Very low | 187 Ų | 187 | 148.4 Ų | 148.4 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | trans | 88.9 | 114.3 | -171.3 | -59.3 | 177.3 | 175.2 | 176.8 | 0 | 111.6 | ||||
| 534 | I | 31 | Very low | 34.6 | Very low | 154 Ų | 154 | 144.2 Ų | 144.2 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | -157.3 | 141.4 | 68.1 | -80 | 166.8 | 0 | 0 | 0 | 111.4 | |||||
| 535 | L | 29.9 | Very low | 34.4 | Very low | 132 Ų | 132 | 144.8 Ų | 144.8 | 69% | 0.691 | 80% | 0.796 | S | S | * | * | trans | 25.3 | 136.1 | 151.7 | -83.1 | 79.8 | 0 | 0 | 0 | 123.5 | ||||
| 536 | E | 30.2 | Very low | 34.2 | Very low | 181 Ų | 181 | 151.3 Ų | 151.3 | 85% | 0.846 | 82% | 0.821 | S | S | * | * | trans | 68.1 | 125 | 134.1 | -68 | 177 | 171.5 | 0 | 0 | 121.3 | ||||
| 537 | G | 30 | Very low | 33.8 | Very low | 81 Ų | 81 | 152.5 Ų | 152.5 | 84% | 0.835 | 82% | 0.821 | S | S | * | * | trans | 131.8 | 105.3 | 149.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 538 | M | 30.6 | Very low | 33.5 | Very low | 179 Ų | 179 | 152.5 Ų | 152.5 | 88% | 0.882 | 82% | 0.822 | S | S | * | * | trans | -29.4 | 179.3 | 158.4 | -62.1 | 167.7 | 54.5 | 0 | 0 | 118.1 | ||||
| 539 | P | 46.7 | Very low | 32.9 | Very low | 88 Ų | 88 | 153.3 Ų | 153.3 | 57% | 0.571 | 82% | 0.821 | S | S | * | * | -134.7 | -173.7 | -58.8 | 41.9 | -24.5 | 0 | 0 | 0 | 111.7 | |||||
| 540 | E | 34.5 | Very low | 33 | Very low | 186 Ų | 186 | 151.5 Ų | 151.5 | 87% | 0.869 | 82% | 0.816 | S | S | * | * | trans | 67 | 144.3 | 153.5 | -75 | 170.4 | -170.1 | 0 | 0 | 117.9 | ||||
| 541 | A | 33.2 | Very low | 33 | Very low | 76 Ų | 76 | 149.4 Ų | 149.4 | 63% | 0.628 | 81% | 0.814 | S | S | * | * | cis | -171.4 | -179.1 | 0.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 542 | I | 36.9 | Very low | 33.2 | Very low | 152 Ų | 152 | 147.5 Ų | 147.5 | 78% | 0.779 | 81% | 0.812 | S | S | * | * | trans | 81.7 | 99.7 | 157.5 | -53.8 | 153.4 | 0 | 0 | 0 | 114.2 | ||||
| 543 | E | 34.7 | Very low | 33.6 | Very low | 181 Ų | 181 | 147.9 Ų | 147.9 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | 60 | 97.2 | 66.2 | -161.4 | -179.5 | -131.4 | 0 | 0 | 113.5 | |||||
| 544 | S | 32 | Very low | 34 | Very low | 103 Ų | 103 | 144.9 Ų | 144.9 | 72% | 0.72 | 81% | 0.808 | S | S | * | * | trans | 170.2 | 121 | 133.2 | 60.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 545 | V | 36.5 | Very low | 34.2 | Very low | 130 Ų | 130 | 144.2 Ų | 144.2 | 79% | 0.788 | 81% | 0.81 | S | S | * | * | 69 | 99 | 129.3 | -176.1 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 546 | L | 35.5 | Very low | 34.6 | Very low | 241 Ų | 241 | 145.3 Ų | 145.3 | 100% | 1.262 | 82% | 0.821 | S | S | * | * | -172 | 0 | 106.1 | -108.2 | 160.1 | 0 | 0 | 0 | 111.2 |
Retrieved 546 of 546 residues in 171.1 ms
(Link to these results)