| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.6 | Very low | 37.7 | Very low | 255 Ų | 255 | 157.5 Ų | 157.5 | 100% | 1.256 | 82% | 0.816 | S | S | * | * | 0 | 129.7 | 0 | -89.1 | 165.6 | 152 | 0 | 0 | 108.6 | |||||
| 2 | G | 41.2 | Very low | 37.5 | Very low | 69 Ų | 69 | 148.8 Ų | 148.8 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | 127.8 | 39.4 | 164.2 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 3 | Y | 32.6 | Very low | 37.3 | Very low | 244 Ų | 244 | 141.8 Ų | 141.8 | 96% | 0.957 | 77% | 0.77 | S | S | * | * | trans | -131.5 | 65.9 | 164.5 | -83.3 | -86.2 | 0 | 0 | 0 | 110.6 | ||||
| 4 | A | 37.3 | Very low | 37.1 | Very low | 94 Ų | 94 | 142.1 Ų | 142.1 | 78% | 0.777 | 77% | 0.77 | S | S | * | * | trans | -156.2 | 67.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 5 | R | 39.5 | Very low | 37.4 | Very low | 241 Ų | 241 | 139.8 Ų | 139.8 | 91% | 0.909 | 76% | 0.762 | S | S | * | * | trans | -156.3 | 12.5 | 170.8 | -113.7 | 170.5 | -165.9 | -169.1 | 3 | 117.4 | ||||
| 6 | K | 36.9 | Very low | 37.8 | Very low | 207 Ų | 207 | 139.1 Ų | 139.1 | 90% | 0.9 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -112.5 | 19.9 | -179.9 | -86.3 | -172.7 | 177 | -178.5 | 0 | 116 | ||
| 7 | V | 41.3 | Very low | 37.8 | Very low | 124 Ų | 124 | 133.8 Ų | 133.8 | 75% | 0.752 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -114.9 | 1.3 | 177.1 | -153.6 | 0 | 0 | 0 | 0 | 112.9 | ||
| 8 | G | 35.7 | Very low | 38.1 | Very low | 49 Ų | 49 | 129.8 Ų | 129.8 | 51% | 0.505 | 73% | 0.728 | S | S | . | * | S | Bend | trans | -86.2 | -1.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 9 | W | 32.8 | Very low | 37.9 | Very low | 230 Ų | 230 | 124.8 Ų | 124.8 | 87% | 0.871 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -111.5 | -21.5 | -172.6 | -70.2 | 59.4 | 0 | 0 | 0 | 113.5 | ||
| 10 | V | 38.8 | Very low | 38.3 | Very low | 124 Ų | 124 | 121.2 Ų | 121.2 | 75% | 0.752 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -22.8 | 177.5 | -178.6 | 0 | 0 | 0 | 0 | 111.7 | ||
| 11 | T | 38.6 | Very low | 38.6 | Very low | 96 Ų | 96 | 119.7 Ų | 119.7 | 59% | 0.589 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | -18.1 | 175.8 | 44 | 0 | 0 | 0 | 0 | 113.9 | ||
| 12 | A | 36.1 | Very low | 38.9 | Very low | 53 Ų | 53 | 114 Ų | 114 | 44% | 0.438 | 66% | 0.656 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.1 | -31.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | L14 V15 | A12-L14 VanDerWaalsContact C-N 3.32Å; A12-L14 PolarHBondContact O-N 3.47Å; A12-V15 PolarHBondContact O-N 3.2Å |
| 13 | G | 34.6 | Very low | 39 | Very low | 57 Ų | 57 | 114.4 Ų | 114.4 | 59% | 0.588 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -69.7 | -24.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 14 | L | 34.7 | Very low | 39.9 | Very low | 147 Ų | 147 | 107.9 Ų | 107.9 | 77% | 0.77 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -80.9 | -17.2 | 178.4 | -134.4 | 97.8 | 0 | 0 | 0 | 113.2 | A12 | A12-L14 VanDerWaalsContact C-N 3.32Å; A12-L14 PolarHBondContact O-N 3.47Å |
| 15 | V | 41.1 | Very low | 40.6 | Very low | 107 Ų | 107 | 109 Ų | 109 | 65% | 0.648 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -93.7 | -22.6 | -175.7 | 178.8 | 0 | 0 | 0 | 0 | 112.1 | A12 G19 | A12-V15 PolarHBondContact O-N 3.2Å; V15-G19 PolarHBondContact O-N 3.11Å |
| 16 | I | 43.7 | Very low | 40.8 | Very low | 128 Ų | 128 | 104.1 Ų | 104.1 | 66% | 0.656 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -76.1 | -34.1 | 177.6 | -59.1 | 174.6 | 0 | 0 | 0 | 111.3 | G19 A20 | I16-G19 PolarHBondContact O-N 3.2Å; I16-A20 PolarHBondContact O-N 3.34Å |
| 17 | G | 38.4 | Very low | 41.2 | Very low | 49 Ų | 49 | 100.9 Ų | 100.9 | 51% | 0.505 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -67.9 | -36.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | C21 | G17-C21 PolarHBondContact O-N 3.11Å |
| 18 | A | 42.6 | Very low | 41.3 | Very low | 63 Ų | 63 | 99.2 Ų | 99.2 | 52% | 0.521 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -69.8 | -34.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y22 | A18-Y22 WeakPolarHBondContact O-CB 3.48Å; A18-Y22 PolarHBondContact O-N 3.43Å |
| 19 | G | 35.3 | Very low | 41.8 | Very low | 35 Ų | 35 | 103 Ų | 103 | 36% | 0.361 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -67 | -41 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | V15 I16 Y22 C23 | V15-G19 PolarHBondContact O-N 3.11Å; I16-G19 PolarHBondContact O-N 3.2Å; G19-Y22 PolarHBondContact O-N 2.84Å; G19-C23 PolarHBondContact O-N 2.86Å; G19-C23 PolarHBondContact O-SG 2.56Å |
| 20 | A | 45.1 | Very low | 42.1 | Very low | 51 Ų | 51 | 94.3 Ų | 94.3 | 42% | 0.421 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.6 | -38.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | I16 C23 I24 | I16-A20 PolarHBondContact O-N 3.34Å; A20-C23 PolarHBondContact O-N 3.16Å; A20-I24 PolarHBondContact O-N 3.29Å |
| 21 | C | 44.8 | Very low | 42.4 | Very low | 91 Ų | 91 | 98.4 Ų | 98.4 | 62% | 0.615 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66.9 | -38.4 | 175.7 | -155.7 | 0 | 0 | 0 | 0 | 112 | G17 I24 Y25 | G17-C21 PolarHBondContact O-N 3.11Å; C21-I24 PolarHBondContact O-N 3.29Å; C21-Y25 WeakPolarHBondContact O-CB 3.44Å; C21-Y25 PolarHBondContact O-N 3.44Å |
| 22 | Y | 45 | Very low | 42.5 | Very low | 136 Ų | 136 | 100.6 Ų | 100.6 | 53% | 0.533 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66.6 | -37.7 | 174 | -176.8 | -99.5 | 0 | 0 | 0 | 113.2 | A18 G19 I24 Y25 K26 | A18-Y22 WeakPolarHBondContact O-CB 3.48Å; A18-Y22 PolarHBondContact O-N 3.43Å; G19-Y22 PolarHBondContact O-N 2.84Å; Y22-I24 PolarHBondContact O-N 2.94Å; Y22-Y25 HydrophobicContact CD2-CD1 4.4Å; Y22-Y25 HydrophobicContact CE2-CD1 4.49Å; Y22-Y25 WeakPolarHBondContact O-CB 3.46Å; Y22-Y25 PolarHBondContact O-N 2.73Å; Y22-K26 HydrophobicContact CE1-CD 4.25Å; Y22-K26 WeakPolarHBondContact O-CB 3.25Å; Y22-K26 PolarHBondContact O-N 3.16Å |
| 23 | C | 45.1 | Very low | 42.7 | Very low | 77 Ų | 77 | 103.2 Ų | 103.2 | 52% | 0.52 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.1 | -39.7 | 177 | -73.7 | 0 | 0 | 0 | 0 | 112.2 | G19 A20 L27 | G19-C23 PolarHBondContact O-N 2.86Å; G19-C23 PolarHBondContact O-SG 2.56Å; A20-C23 PolarHBondContact O-N 3.16Å; C23-L27 WeakPolarHBondContact O-CG 3.43Å; C23-L27 PolarHBondContact O-N 3.34Å |
| 24 | I | 51.6 | Low | 43 | Very low | 106 Ų | 106 | 106.3 Ų | 106.3 | 54% | 0.544 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.2 | -39.5 | 174.8 | -64 | 177 | 0 | 0 | 0 | 110.8 | A20 C21 Y22 K26 L27 T28 | A20-I24 PolarHBondContact O-N 3.29Å; C21-I24 PolarHBondContact O-N 3.29Å; Y22-I24 PolarHBondContact O-N 2.94Å; I24-K26 PolarHBondContact O-N 2.9Å; I24-L27 PolarHBondContact O-N 3.03Å; I24-T28 WeakPolarHBondContact O-CG2 3.33Å; I24-T28 PolarHBondContact O-N 3.29Å; I24-T28 PolarHBondContact O-OG1 3.37Å; I24-T28 VanDerWaalsContact O-OG1 3.12Å |
| 25 | Y | 51.9 | Low | 43.2 | Very low | 119 Ų | 119 | 107.5 Ų | 107.5 | 47% | 0.467 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -60.6 | -40.7 | 174.4 | 177.2 | -97.3 | 0 | 0 | 0 | 113.3 | C21 Y22 T28 R29 | C21-Y25 WeakPolarHBondContact O-CB 3.44Å; C21-Y25 PolarHBondContact O-N 3.44Å; Y22-Y25 HydrophobicContact CD2-CD1 4.4Å; Y22-Y25 HydrophobicContact CE2-CD1 4.49Å; Y22-Y25 WeakPolarHBondContact O-CB 3.46Å; Y22-Y25 PolarHBondContact O-N 2.73Å; Y25-T28 PolarHBondContact O-OG1 3.09Å; Y25-T28 VanDerWaalsContact O-OG1 3.07Å; Y25-R29 WeakPolarHBondContact O-CB 3.16Å; Y25-R29 PolarHBondContact O-N 2.89Å; Y25-R29 PolarHBondContact OH-NH1 3.39Å |
| 26 | K | 42.6 | Very low | 43.3 | Very low | 138 Ų | 138 | 108.3 Ų | 108.3 | 60% | 0.6 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -71.9 | -35 | -179.8 | -166.5 | 175.6 | 179.7 | 179.3 | 0 | 112.7 | Y22 I24 T28 G30 | Y22-K26 HydrophobicContact CE1-CD 4.25Å; Y22-K26 WeakPolarHBondContact O-CB 3.25Å; Y22-K26 PolarHBondContact O-N 3.16Å; I24-K26 PolarHBondContact O-N 2.9Å; K26-T28 VanDerWaalsContact C-N 3.35Å; K26-G30 PolarHBondContact O-N 3.23Å |
| 27 | L | 45.5 | Very low | 43.1 | Very low | 139 Ų | 139 | 111 Ų | 111 | 73% | 0.728 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -70.6 | -29.3 | 178 | -72.1 | 169.7 | 0 | 0 | 0 | 112.9 | C23 I24 | C23-L27 WeakPolarHBondContact O-CG 3.43Å; C23-L27 PolarHBondContact O-N 3.34Å; I24-L27 PolarHBondContact O-N 3.03Å |
| 28 | T | 44.4 | Very low | 43.3 | Very low | 89 Ų | 89 | 117 Ų | 117 | 55% | 0.546 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -86.1 | -32.5 | -180 | 54.3 | 0 | 0 | 0 | 0 | 112.9 | I24 Y25 K26 | I24-T28 WeakPolarHBondContact O-CG2 3.33Å; I24-T28 PolarHBondContact O-N 3.29Å; I24-T28 PolarHBondContact O-OG1 3.37Å; I24-T28 VanDerWaalsContact O-OG1 3.12Å; Y25-T28 PolarHBondContact O-OG1 3.09Å; Y25-T28 VanDerWaalsContact O-OG1 3.07Å; K26-T28 VanDerWaalsContact C-N 3.35Å |
| 29 | R | 45.1 | Very low | 43.3 | Very low | 129 Ų | 129 | 117.9 Ų | 117.9 | 49% | 0.487 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -80.7 | -29.3 | -179 | -161.3 | 174.2 | 173.1 | -172.7 | -4.3 | 114.2 | Y25 R31 K32 Q33 | Y25-R29 WeakPolarHBondContact O-CB 3.16Å; Y25-R29 PolarHBondContact O-N 2.89Å; Y25-R29 PolarHBondContact OH-NH1 3.39Å; R29-R31 PolarHBondContact O-N 3.4Å; R29-K32 PolarHBondContact O-N 2.86Å; R29-K32 VanDerWaalsContact O-N 3.13Å; R29-Q33 PolarHBondContact O-N 3.32Å |
| 30 | G | 39.3 | Very low | 43.6 | Very low | 46 Ų | 46 | 125.5 Ų | 125.5 | 47% | 0.474 | 62% | 0.623 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -62.6 | -21.7 | 175 | 0 | 0 | 0 | 0 | 0 | 114.3 | K26 | K26-G30 PolarHBondContact O-N 3.23Š|
| 31 | R | 44.3 | Very low | 43.2 | Very low | 211 Ų | 211 | 126.8 Ų | 126.8 | 80% | 0.796 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -22.6 | 175 | -102.1 | 178.5 | 168 | 155.8 | -3.7 | 114.2 | R29 | R29-R31 PolarHBondContact O-N 3.4Š|
| 32 | K | 41.2 | Very low | 42.5 | Very low | 141 Ų | 141 | 125.9 Ų | 125.9 | 61% | 0.613 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.4 | -39.7 | -179.5 | -92.2 | -172.4 | 171.8 | -172.9 | 0 | 112.8 | R29 N34 K35 E36 | R29-K32 PolarHBondContact O-N 2.86Å; R29-K32 VanDerWaalsContact O-N 3.13Å; K32-N34 VanDerWaalsContact C-N 3.26Å; K32-N34 PolarHBondContact O-N 3.24Å; K32-K35 PolarHBondContact O-N 3.47Å; K32-E36 PolarHBondContact O-N 3.12Å |
| 33 | Q | 41.5 | Very low | 41.8 | Very low | 108 Ų | 108 | 125.6 Ų | 125.6 | 51% | 0.505 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -64 | -28.5 | 177.8 | -75.9 | -174.9 | -19.1 | 0 | 0 | 113.7 | R29 K35 K37 | R29-Q33 PolarHBondContact O-N 3.32Å; Q33-K35 VanDerWaalsContact C-N 3.3Å; Q33-K37 PolarHBondContact O-N 3.1Å |
| 34 | N | 39.6 | Very low | 41.1 | Very low | 123 Ų | 123 | 125.5 Ų | 125.5 | 66% | 0.658 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -74.1 | -19.1 | 173.1 | -90.4 | -4.4 | 0 | 0 | 0 | 113.5 | K32 | K32-N34 VanDerWaalsContact C-N 3.26Å; K32-N34 PolarHBondContact O-N 3.24Å |
| 35 | K | 39.6 | Very low | 40.1 | Very low | 171 Ų | 171 | 128 Ų | 128 | 74% | 0.743 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -89.5 | -36.1 | 174.2 | -87 | -171.5 | 169.8 | -170.8 | 0 | 112.3 | K32 Q33 M38 | K32-K35 PolarHBondContact O-N 3.47Å; Q33-K35 VanDerWaalsContact C-N 3.3Å; K35-M38 PolarHBondContact O-N 3.13Å |
| 36 | E | 42.3 | Very low | 39.3 | Very low | 124 Ų | 124 | 129 Ų | 129 | 58% | 0.579 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -71 | -33.5 | -179.9 | -76.3 | 165.7 | 179.9 | 0 | 0 | 112.5 | K32 M38 A39 | K32-E36 PolarHBondContact O-N 3.12Å; E36-M38 PolarHBondContact O-N 3.49Å; E36-M38 VanDerWaalsContact O-N 3.12Å; E36-A39 PolarHBondContact O-N 3.03Å |
| 37 | K | 39.7 | Very low | 38.7 | Very low | 184 Ų | 184 | 129.3 Ų | 129.3 | 80% | 0.8 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | -8.5 | 175 | -77.8 | -171.2 | 175.9 | -173 | 0 | 115.4 | Q33 | Q33-K37 PolarHBondContact O-N 3.1Š|
| 38 | M | 42.3 | Very low | 38 | Very low | 175 Ų | 175 | 130 Ų | 130 | 86% | 0.862 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | -5.6 | 176.4 | -72.2 | -176.5 | 169.3 | 0 | 0 | 113.2 | K35 E36 | K35-M38 PolarHBondContact O-N 3.13Å; E36-M38 PolarHBondContact O-N 3.49Å; E36-M38 VanDerWaalsContact O-N 3.12Å |
| 39 | A | 43.7 | Very low | 37.3 | Very low | 83 Ų | 83 | 129.9 Ų | 129.9 | 69% | 0.686 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.8 | -12.2 | -171.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | E36 G41 | E36-A39 PolarHBondContact O-N 3.03Å; A39-G41 PolarHBondContact O-N 2.97Å |
| 40 | E | 40.7 | Very low | 36.7 | Very low | 194 Ų | 194 | 127.4 Ų | 127.4 | 91% | 0.907 | 75% | 0.745 | S | S | * | * | trans | -91 | 85.9 | 173.3 | -84.9 | -179.2 | 154.9 | 0 | 0 | 110.9 | ||||
| 41 | G | 37.1 | Very low | 36.2 | Very low | 79 Ų | 79 | 132.6 Ų | 132.6 | 81% | 0.814 | 76% | 0.762 | S | S | * | * | trans | -168.3 | 75.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | A39 | A39-G41 PolarHBondContact O-N 2.97Š| ||
| 42 | G | 29.4 | Very low | 35.3 | Very low | 71 Ų | 71 | 127.6 Ų | 127.6 | 73% | 0.732 | 76% | 0.758 | S | S | * | * | trans | 176.8 | 86 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 43 | S | 31.7 | Very low | 34.6 | Very low | 130 Ų | 130 | 126.1 Ų | 126.1 | 91% | 0.909 | 77% | 0.766 | S | S | * | * | trans | 11.6 | 142.1 | 147.3 | 59.6 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 44 | G | 30.1 | Very low | 33.8 | Very low | 75 Ų | 75 | 124.8 Ų | 124.8 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | trans | 142.6 | 105.6 | 130.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 45 | D | 30.9 | Very low | 33.1 | Very low | 158 Ų | 158 | 124 Ų | 124 | 85% | 0.845 | 79% | 0.792 | S | S | * | * | trans | -60.9 | 162.9 | 173.7 | -52.7 | -64.1 | 0 | 0 | 0 | 114.8 | ||||
| 46 | V | 33.5 | Very low | 32.5 | Very low | 141 Ų | 141 | 126.7 Ų | 126.7 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | -173.2 | 137.7 | 116 | -179 | 0 | 0 | 0 | 0 | 110 | |||||
| 47 | D | 30.4 | Very low | 31.6 | Very low | 144 Ų | 144 | 130.6 Ų | 130.6 | 77% | 0.77 | 81% | 0.808 | S | S | * | * | trans | -66.4 | 159.5 | -179.6 | -50.3 | -71.8 | 0 | 0 | 0 | 116.3 | ||||
| 48 | D | 31.5 | Very low | 31 | Very low | 155 Ų | 155 | 128.1 Ų | 128.1 | 83% | 0.829 | 80% | 0.804 | S | S | * | * | 157.2 | 147.1 | 93.9 | -156.9 | 16.4 | 0 | 0 | 0 | 115 | |||||
| 49 | A | 30.5 | Very low | 30.4 | Very low | 86 Ų | 86 | 126.5 Ų | 126.5 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | 67.1 | 102.7 | 151.4 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 50 | G | 31.8 | Very low | 29.6 | Very low | 77 Ų | 77 | 133.9 Ų | 133.9 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -112.4 | 152.4 | 145.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 51 | D | 27.6 | Very low | 29 | Very low | 154 Ų | 154 | 129.4 Ų | 129.4 | 82% | 0.824 | 80% | 0.799 | S | S | * | * | trans | -157.4 | 146 | 147.1 | -146.3 | 7.2 | 0 | 0 | 0 | 114.4 | ||||
| 52 | C | 26.3 | Very low | 28.6 | Very low | 106 Ų | 106 | 133.5 Ų | 133.5 | 72% | 0.716 | 80% | 0.802 | S | S | * | * | trans | 3.8 | 157 | 156 | -74.1 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 53 | S | 26.6 | Very low | 28.6 | Very low | 111 Ų | 111 | 137 Ų | 137 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | cis | -177.4 | 154.6 | 6.6 | 43.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 54 | G | 24.8 | Very low | 28.7 | Very low | 80 Ų | 80 | 138.3 Ų | 138.3 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | 75.3 | 113.6 | 139 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 55 | A | 24.8 | Very low | 28.7 | Very low | 106 Ų | 106 | 140.8 Ų | 140.8 | 88% | 0.876 | 80% | 0.796 | S | S | * | * | trans | -167 | 128.7 | 130.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 56 | R | 26.7 | Very low | 28.6 | Very low | 227 Ų | 227 | 141.6 Ų | 141.6 | 86% | 0.857 | 80% | 0.8 | S | S | * | * | trans | -72.7 | 144.9 | 169.9 | -140.3 | 178.9 | -147.3 | 165.6 | 3.6 | 108.6 | ||||
| 57 | Y | 23.6 | Very low | 28.5 | Very low | 207 Ų | 207 | 139.3 Ų | 139.3 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | 176.3 | 140.8 | 128.6 | -96.7 | -66 | 0 | 0 | 0 | 113 | |||||
| 58 | N | 27.7 | Very low | 28.5 | Very low | 132 Ų | 132 | 139.6 Ų | 139.6 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | trans | 81.7 | 84.9 | 151.5 | -57.5 | -16.6 | 0 | 0 | 0 | 120.5 | ||||
| 59 | D | 28.7 | Very low | 28.5 | Very low | 141 Ų | 141 | 141.3 Ų | 141.3 | 75% | 0.754 | 80% | 0.795 | S | S | * | * | -39.7 | 123.3 | 122.1 | 179.7 | 30.6 | 0 | 0 | 0 | 111.6 | |||||
| 60 | W | 26.5 | Very low | 28.4 | Very low | 238 Ų | 238 | 142.3 Ų | 142.3 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | trans | -159.7 | 133.7 | 144.2 | -89.2 | 1.9 | 0 | 0 | 0 | 109.3 | ||||
| 61 | S | 28.1 | Very low | 28.3 | Very low | 99 Ų | 99 | 148.1 Ų | 148.1 | 69% | 0.692 | 80% | 0.8 | S | S | * | * | trans | -60.1 | 142.4 | 177.8 | -47.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 62 | D | 29.9 | Very low | 28.1 | Very low | 166 Ų | 166 | 145.9 Ų | 145.9 | 89% | 0.888 | 80% | 0.797 | S | S | * | * | trans | -121.6 | 104.3 | 150 | -78.7 | -33.9 | 0 | 0 | 0 | 107.6 | ||||
| 63 | D | 29.4 | Very low | 28.2 | Very low | 143 Ų | 143 | 147.4 Ų | 147.4 | 77% | 0.765 | 80% | 0.796 | S | S | * | * | trans | -68.8 | 124.6 | 150.7 | -74.6 | -52.7 | 0 | 0 | 0 | 106.9 | ||||
| 64 | D | 33.1 | Very low | 28.4 | Very low | 159 Ų | 159 | 146.6 Ų | 146.6 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | -173.4 | 117.8 | 128.2 | -90.8 | -27.2 | 0 | 0 | 0 | 111.4 | |||||
| 65 | D | 29.8 | Very low | 28.4 | Very low | 126 Ų | 126 | 153 Ų | 153 | 67% | 0.674 | 79% | 0.786 | S | S | * | * | trans | 46 | 106.5 | 135.9 | -134.4 | -10.5 | 0 | 0 | 0 | 119.7 | S67 | D65-S67 WeakPolarHBondContact OD1-CB 3.16Å; D65-S67 PolarHBondContact OD1-N 3.28Å; D65-S67 PolarHBondContact OD1-OG 2.97Å | ||
| 66 | D | 28.9 | Very low | 28.6 | Very low | 175 Ų | 175 | 156.1 Ų | 156.1 | 94% | 0.936 | 78% | 0.776 | S | S | * | * | trans | -139.6 | 91.1 | 139.7 | -123.1 | -17.8 | 0 | 0 | 0 | 109.7 | N68 | D66-N68 PolarHBondContact O-N 3.12Š| ||
| 67 | S | 31.7 | Very low | 28.6 | Very low | 93 Ų | 93 | 148.5 Ų | 148.5 | 65% | 0.65 | 76% | 0.757 | S | S | * | * | trans | -90.9 | 85.3 | 178.5 | 41.8 | 0 | 0 | 0 | 0 | 110.7 | D65 | D65-S67 WeakPolarHBondContact OD1-CB 3.16Å; D65-S67 PolarHBondContact OD1-N 3.28Å; D65-S67 PolarHBondContact OD1-OG 2.97Å | ||
| 68 | N | 31.3 | Very low | 28.9 | Very low | 150 Ų | 150 | 144.2 Ų | 144.2 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | trans | -165 | 91.2 | 149.8 | -142 | -0.6 | 0 | 0 | 0 | 114.7 | D66 | D66-N68 PolarHBondContact O-N 3.12Š| ||
| 69 | E | 30.9 | Very low | 29.5 | Very low | 191 Ų | 191 | 147.9 Ų | 147.9 | 89% | 0.893 | 76% | 0.758 | S | S | * | * | trans | -142.7 | 94.6 | 150.8 | -149.6 | 175 | -172.3 | 0 | 0 | 111.3 | K71 | E69-K71 PolarHBondContact O-N 3.27Š| ||
| 70 | S | 28.5 | Very low | 29.9 | Very low | 107 Ų | 107 | 144.5 Ų | 144.5 | 75% | 0.748 | 75% | 0.749 | S | S | * | * | trans | 2.9 | 100.2 | 154.2 | -65.3 | 0 | 0 | 0 | 0 | 116.9 | S72 | S70-S72 PolarHBondContact O-N 3.48Š| ||
| 71 | K | 28.5 | Very low | 30.4 | Very low | 199 Ų | 199 | 144 Ų | 144 | 87% | 0.865 | 75% | 0.747 | S | S | * | * | trans | -60.8 | 96.5 | 159.7 | -72.6 | 171.9 | -179.6 | 164.7 | 0 | 109.8 | E69 I73 | E69-K71 PolarHBondContact O-N 3.27Å; K71-I73 PolarHBondContact O-N 2.94Å | ||
| 72 | S | 23.7 | Very low | 31.1 | Very low | 107 Ų | 107 | 147.3 Ų | 147.3 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | trans | -70.9 | 94.7 | 161.7 | 174.5 | 0 | 0 | 0 | 0 | 109.2 | S70 V74 | S70-S72 PolarHBondContact O-N 3.48Å; S72-V74 PolarHBondContact O-N 3.41Å | ||
| 73 | I | 30 | Very low | 31.4 | Very low | 138 Ų | 138 | 141.8 Ų | 141.8 | 71% | 0.708 | 74% | 0.738 | S | S | * | * | trans | -63.9 | 103 | 169.8 | -63.4 | 170.2 | 0 | 0 | 0 | 108 | K71 W75 | K71-I73 PolarHBondContact O-N 2.94Å; I73-W75 PolarHBondContact O-N 2.89Å | ||
| 74 | V | 29.7 | Very low | 32 | Very low | 94 Ų | 94 | 140.5 Ų | 140.5 | 57% | 0.57 | 74% | 0.735 | S | S | * | * | trans | -72.7 | 108.6 | 167.9 | 177.1 | 0 | 0 | 0 | 0 | 108.2 | S72 Y76 | S72-V74 PolarHBondContact O-N 3.41Å; V74-Y76 HydrophobicContact CB-CE2 4.24Å; V74-Y76 HydrophobicContact CG1-CD2 4Å; V74-Y76 HydrophobicContact CG1-CE2 3.44Å; V74-Y76 VanDerWaalsContact CG1-CE2 3.44Å | ||
| 75 | W | 25.2 | Very low | 32.7 | Very low | 214 Ų | 214 | 141 Ų | 141 | 81% | 0.811 | 73% | 0.733 | S | S | * | * | trans | -71.5 | 126.3 | 173.4 | -116.7 | 89.4 | 0 | 0 | 0 | 110.5 | I73 | I73-W75 PolarHBondContact O-N 2.89Š| ||
| 76 | Y | 28.8 | Very low | 33.2 | Very low | 172 Ų | 172 | 138.8 Ų | 138.8 | 68% | 0.675 | 73% | 0.732 | S | S | * | * | trans | -115.9 | 140.6 | 168 | -74.5 | -85.7 | 0 | 0 | 0 | 110 | V74 | V74-Y76 HydrophobicContact CB-CE2 4.24Å; V74-Y76 HydrophobicContact CG1-CD2 4Å; V74-Y76 HydrophobicContact CG1-CE2 3.44Å; V74-Y76 VanDerWaalsContact CG1-CE2 3.44Å | ||
| 77 | P | 27.7 | Very low | 34 | Very low | 68 Ų | 68 | 131.6 Ų | 131.6 | 44% | 0.442 | 70% | 0.699 | S | S | . | * | trans | -69.7 | 154.9 | -176.5 | 25.1 | -31.7 | 0 | 0 | 0 | 113.8 | W79 A80 | P77-W79 VanDerWaalsContact C-N 3.28Å; P77-W79 PolarHBondContact O-N 2.98Å; P77-A80 PolarHBondContact O-N 3.33Å | ||
| 78 | P | 28.5 | Very low | 35 | Very low | 116 Ų | 116 | 130.8 Ų | 130.8 | 75% | 0.753 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -69.2 | -8.2 | -161.1 | -21.9 | 34.9 | 0 | 0 | 0 | 117.3 | ||
| 79 | W | 40.3 | Very low | 36.1 | Very low | 210 Ų | 210 | 132.7 Ų | 132.7 | 80% | 0.795 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -87.1 | -8.6 | 179.8 | 58.8 | -94.4 | 0 | 0 | 0 | 113.8 | P77 R81 | P77-W79 VanDerWaalsContact C-N 3.28Å; P77-W79 PolarHBondContact O-N 2.98Å; W79-R81 PolarHBondContact O-N 3.25Å |
| 80 | A | 36.6 | Very low | 37 | Very low | 69 Ų | 69 | 126.5 Ų | 126.5 | 57% | 0.57 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -78 | 5.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | P77 | P77-A80 PolarHBondContact O-N 3.33Š|
| 81 | R | 38.2 | Very low | 38.2 | Very low | 227 Ų | 227 | 128.2 Ų | 128.2 | 86% | 0.857 | 66% | 0.658 | S | S | * | * | trans | -109 | 37.3 | -170.9 | -152.5 | -172 | -70.7 | -145.8 | 0.5 | 113.9 | W79 | W79-R81 PolarHBondContact O-N 3.25Š| ||
| 82 | I | 41.4 | Very low | 39.4 | Very low | 169 Ų | 169 | 121.5 Ų | 121.5 | 87% | 0.867 | 64% | 0.639 | S | S | * | * | trans | -132.3 | 111.2 | 169.6 | -52.8 | 178.2 | 0 | 0 | 0 | 109.1 | ||||
| 83 | G | 36.3 | Very low | 41.1 | Very low | 51 Ų | 51 | 124.8 Ų | 124.8 | 53% | 0.526 | 64% | 0.635 | S | S | . | * | trans | 176 | 120.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 84 | T | 43.8 | Very low | 42 | Very low | 115 Ų | 115 | 121 Ų | 121 | 71% | 0.706 | 62% | 0.624 | S | S | * | * | trans | -54.6 | 154.7 | -170.9 | 51.9 | 0 | 0 | 0 | 0 | 115.3 | A86 G87 | T84-A86 PolarHBondContact O-N 2.79Å; T84-G87 PolarHBondContact O-N 3.44Å | ||
| 85 | E | 46.3 | Very low | 43.4 | Very low | 171 Ų | 171 | 125.4 Ų | 125.4 | 80% | 0.799 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -55.1 | -22.5 | -173.1 | -62.1 | -177 | 158.9 | 0 | 0 | 115.2 | G87 T88 | E85-G87 VanDerWaalsContact C-N 3.3Å; E85-G87 PolarHBondContact O-N 3.48Å; E85-T88 PolarHBondContact O-N 2.97Å; E85-T88 PolarHBondContact O-OG1 3.35Å |
| 86 | A | 41.5 | Very low | 45.1 | Very low | 79 Ų | 79 | 117.8 Ų | 117.8 | 65% | 0.653 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.2 | -32.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | T84 A90 | T84-A86 PolarHBondContact O-N 2.79Å; A86-A90 PolarHBondContact O-N 3.24Å |
| 87 | G | 45.3 | Very low | 46.5 | Very low | 23 Ų | 23 | 118.8 Ų | 118.8 | 24% | 0.237 | 62% | 0.616 | C | S | . | * | H | α-helix | trans | -75.9 | -22.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114 | T84 E85 R91 | T84-G87 PolarHBondContact O-N 3.44Å; E85-G87 VanDerWaalsContact C-N 3.3Å; E85-G87 PolarHBondContact O-N 3.48Å; G87-R91 WeakPolarHBondContact O-CB 3.31Å; G87-R91 VanDerWaalsContact O-CG 3.31Å; G87-R91 WeakPolarHBondContact O-CG 3.47Å; G87-R91 PolarHBondContact O-N 3.41Å; G87-R91 PolarHBondContact O-NE 3.03Å |
| 88 | T | 51.8 | Low | 47.6 | Very low | 77 Ų | 77 | 118.4 Ų | 118.4 | 47% | 0.472 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -78.3 | -38.6 | 179.7 | 60.5 | 0 | 0 | 0 | 0 | 111.4 | E85 R91 A92 | E85-T88 PolarHBondContact O-N 2.97Å; E85-T88 PolarHBondContact O-OG1 3.35Å; T88-R91 PolarHBondContact O-N 2.99Å; T88-A92 VanDerWaalsContact O-CB 3.32Å; T88-A92 WeakPolarHBondContact O-CB 3.26Å; T88-A92 PolarHBondContact O-N 3.13Å |
| 89 | R | 54.8 | Low | 49.1 | Very low | 190 Ų | 190 | 116.1 Ų | 116.1 | 72% | 0.717 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -67.7 | -39.9 | 174.5 | -75.5 | -179.5 | -179.8 | 170.5 | 1.8 | 112.9 | A92 R93 | R89-A92 PolarHBondContact O-N 3.2Å; R89-R93 WeakPolarHBondContact O-CB 3.43Å; R89-R93 VanDerWaalsContact O-CG 3.28Å; R89-R93 WeakPolarHBondContact O-CG 3.39Å; R89-R93 PolarHBondContact O-N 2.88Å |
| 90 | A | 50.4 | Low | 50 | Low | 61 Ų | 61 | 115.7 Ų | 115.7 | 50% | 0.504 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64 | -42.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A86 R93 A94 | A86-A90 PolarHBondContact O-N 3.24Å; A90-R93 PolarHBondContact O-N 3.38Å; A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 3.01Å |
| 91 | R | 52.6 | Low | 50.6 | Low | 143 Ų | 143 | 115 Ų | 115 | 54% | 0.54 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -68.5 | -37.8 | 175.6 | -76.7 | 179.9 | -82.8 | -146.3 | 2.5 | 112.9 | G87 T88 A94 R95 | G87-R91 WeakPolarHBondContact O-CB 3.31Å; G87-R91 VanDerWaalsContact O-CG 3.31Å; G87-R91 WeakPolarHBondContact O-CG 3.47Å; G87-R91 PolarHBondContact O-N 3.41Å; G87-R91 PolarHBondContact O-NE 3.03Å; T88-R91 PolarHBondContact O-N 2.99Å; R91-A94 PolarHBondContact O-N 3.44Å; R91-R95 WeakPolarHBondContact O-CB 3.38Å; R91-R95 WeakPolarHBondContact O-CG 3.49Å; R91-R95 PolarHBondContact O-N 3.1Å |
| 92 | A | 53.6 | Low | 51.2 | Low | 57 Ų | 57 | 113.7 Ų | 113.7 | 47% | 0.471 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.9 | -41.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | T88 R89 R95 A96 | T88-A92 VanDerWaalsContact O-CB 3.32Å; T88-A92 WeakPolarHBondContact O-CB 3.26Å; T88-A92 PolarHBondContact O-N 3.13Å; R89-A92 PolarHBondContact O-N 3.2Å; A92-R95 PolarHBondContact O-N 2.96Å; A92-A96 WeakPolarHBondContact O-CB 3.41Å; A92-A96 PolarHBondContact O-N 3Å |
| 93 | R | 60.3 | Low | 51.6 | Low | 177 Ų | 177 | 114.4 Ų | 114.4 | 67% | 0.668 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -66.4 | -39.2 | 174.2 | -72.7 | 174.2 | 177.3 | -173.3 | -1 | 112.1 | R89 A90 A96 R97 | R89-R93 WeakPolarHBondContact O-CB 3.43Å; R89-R93 VanDerWaalsContact O-CG 3.28Å; R89-R93 WeakPolarHBondContact O-CG 3.39Å; R89-R93 PolarHBondContact O-N 2.88Å; A90-R93 PolarHBondContact O-N 3.38Å; R93-A96 PolarHBondContact O-N 3.38Å; R93-R97 WeakPolarHBondContact O-CB 3.34Å; R93-R97 VanDerWaalsContact O-CG 3.31Å; R93-R97 WeakPolarHBondContact O-CG 3.48Å; R93-R97 PolarHBondContact O-N 3.39Å |
| 94 | A | 49.9 | Very low | 52.1 | Low | 58 Ų | 58 | 114.2 Ų | 114.2 | 48% | 0.479 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.1 | -42.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | A90 R91 R97 A98 | A90-A94 WeakPolarHBondContact O-CB 3.47Å; A90-A94 PolarHBondContact O-N 3.01Å; R91-A94 PolarHBondContact O-N 3.44Å; A94-R97 PolarHBondContact O-N 3.48Å; A94-A98 WeakPolarHBondContact O-CB 3.29Å; A94-A98 PolarHBondContact O-N 3.05Å |
| 95 | R | 58.2 | Low | 52.2 | Low | 187 Ų | 187 | 113.5 Ų | 113.5 | 71% | 0.706 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.3 | -46.4 | 173 | -75.1 | 177.8 | -179.1 | -171.5 | 0 | 111.5 | R91 A92 R97 A98 T99 | R91-R95 WeakPolarHBondContact O-CB 3.38Å; R91-R95 WeakPolarHBondContact O-CG 3.49Å; R91-R95 PolarHBondContact O-N 3.1Å; A92-R95 PolarHBondContact O-N 2.96Å; R95-R97 VanDerWaalsContact C-N 3.32Å; R95-R97 PolarHBondContact O-N 2.91Å; R95-A98 CarbonylContact O-C 3.58Å; R95-A98 PolarHBondContact O-N 3.47Å; R95-A98 VanDerWaalsContact O-N 3.14Å; R95-T99 PolarHBondContact O-N 3.26Å; R95-T99 PolarHBondContact O-OG1 2.86Å |
| 96 | A | 59.9 | Low | 52.2 | Low | 53 Ų | 53 | 111.9 Ų | 111.9 | 44% | 0.438 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.6 | -37.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A92 R93 R100 | A92-A96 WeakPolarHBondContact O-CB 3.41Å; A92-A96 PolarHBondContact O-N 3Å; R93-A96 PolarHBondContact O-N 3.38Å; A96-R100 WeakPolarHBondContact O-CB 3.13Å; A96-R100 PolarHBondContact O-N 3.04Å |
| 97 | R | 59.1 | Low | 52.1 | Low | 194 Ų | 194 | 116.5 Ų | 116.5 | 73% | 0.732 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -68.3 | -40.6 | 172.2 | -75.8 | 177.8 | 179.6 | -178.7 | -0.8 | 111.9 | R93 A94 R95 R100 A101 | R93-R97 WeakPolarHBondContact O-CB 3.34Å; R93-R97 VanDerWaalsContact O-CG 3.31Å; R93-R97 WeakPolarHBondContact O-CG 3.48Å; R93-R97 PolarHBondContact O-N 3.39Å; A94-R97 PolarHBondContact O-N 3.48Å; R95-R97 VanDerWaalsContact C-N 3.32Å; R95-R97 PolarHBondContact O-N 2.91Å; R97-R100 PolarHBondContact O-N 3.3Å; R97-A101 WeakPolarHBondContact O-CB 3.41Å; R97-A101 PolarHBondContact O-N 3.4Å |
| 98 | A | 51 | Low | 51.9 | Low | 59 Ų | 59 | 126.4 Ų | 126.4 | 49% | 0.488 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.1 | -40.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | A94 R95 A101 R102 | A94-A98 WeakPolarHBondContact O-CB 3.29Å; A94-A98 PolarHBondContact O-N 3.05Å; R95-A98 CarbonylContact O-C 3.58Å; R95-A98 PolarHBondContact O-N 3.47Å; R95-A98 VanDerWaalsContact O-N 3.14Å; A98-A101 PolarHBondContact O-N 3.29Å; A98-R102 VanDerWaalsContact O-CB 3.22Å; A98-R102 WeakPolarHBondContact O-CB 3.5Å; A98-R102 PolarHBondContact O-N 3.5Å |
| 99 | T | 60.1 | Low | 51.2 | Low | 68 Ų | 68 | 125.4 Ų | 125.4 | 42% | 0.417 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -70.3 | -37.5 | 176.6 | -45.2 | 0 | 0 | 0 | 0 | 111.8 | R95 R102 R103 | R95-T99 PolarHBondContact O-N 3.26Å; R95-T99 PolarHBondContact O-OG1 2.86Å; T99-R102 PolarHBondContact O-N 3.27Å; T99-R103 WeakPolarHBondContact O-CB 3.38Å; T99-R103 WeakPolarHBondContact O-CG 3.42Å; T99-R103 PolarHBondContact O-N 3.37Å |
| 100 | R | 59.9 | Low | 50.5 | Low | 201 Ų | 201 | 120.7 Ų | 120.7 | 76% | 0.758 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -67.5 | -39.3 | 171.2 | -83.9 | -178 | 175.2 | 173.2 | -0.7 | 112.2 | A96 R97 R103 A104 | A96-R100 WeakPolarHBondContact O-CB 3.13Å; A96-R100 PolarHBondContact O-N 3.04Å; R97-R100 PolarHBondContact O-N 3.3Å; R100-R103 PolarHBondContact O-N 3.06Å; R100-A104 WeakPolarHBondContact O-CB 3.45Å; R100-A104 PolarHBondContact O-N 3.07Å |
| 101 | A | 48.9 | Very low | 50.2 | Low | 54 Ų | 54 | 121.9 Ų | 121.9 | 45% | 0.446 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -65.5 | -40.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111 | R97 A98 A104 V105 | R97-A101 WeakPolarHBondContact O-CB 3.41Å; R97-A101 PolarHBondContact O-N 3.4Å; A98-A101 PolarHBondContact O-N 3.29Å; A101-A104 CarbonylContact O-C 3.51Å; A101-A104 PolarHBondContact O-N 2.96Å; A101-V105 WeakPolarHBondContact O-CB 3.44Å; A101-V105 WeakPolarHBondContact O-CG2 3.36Å; A101-V105 PolarHBondContact O-N 3.32Å |
| 102 | R | 49.5 | Very low | 49.6 | Very low | 200 Ų | 200 | 121.3 Ų | 121.3 | 76% | 0.755 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -67.7 | -40.9 | 176.5 | -155.3 | 173.6 | -176 | 176.2 | 0.2 | 111.7 | A98 T99 V105 Q106 | A98-R102 VanDerWaalsContact O-CB 3.22Å; A98-R102 WeakPolarHBondContact O-CB 3.5Å; A98-R102 PolarHBondContact O-N 3.5Å; T99-R102 PolarHBondContact O-N 3.27Å; R102-V105 PolarHBondContact O-N 3.3Å; R102-Q106 WeakPolarHBondContact O-CB 3.24Å; R102-Q106 PolarHBondContact O-N 3.26Å |
| 103 | R | 50.1 | Low | 49.3 | Very low | 185 Ų | 185 | 123 Ų | 123 | 70% | 0.698 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -68.3 | -33.2 | 171.3 | -76.6 | -179 | 179.2 | 163.1 | -0.1 | 112.8 | T99 R100 Q106 K107 | T99-R103 WeakPolarHBondContact O-CB 3.38Å; T99-R103 WeakPolarHBondContact O-CG 3.42Å; T99-R103 PolarHBondContact O-N 3.37Å; R100-R103 PolarHBondContact O-N 3.06Å; R103-Q106 PolarHBondContact O-N 3.14Å; R103-K107 VanDerWaalsContact O-CB 3.32Å; R103-K107 WeakPolarHBondContact O-CB 3.46Å; R103-K107 PolarHBondContact O-N 3.43Å |
| 104 | A | 47.4 | Very low | 48.8 | Very low | 47 Ų | 47 | 120.4 Ų | 120.4 | 39% | 0.388 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -74.7 | -31.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | R100 A101 R108 | R100-A104 WeakPolarHBondContact O-CB 3.45Å; R100-A104 PolarHBondContact O-N 3.07Å; A101-A104 CarbonylContact O-C 3.51Å; A101-A104 PolarHBondContact O-N 2.96Å; A104-R108 WeakPolarHBondContact O-CB 3.25Å; A104-R108 VanDerWaalsContact O-CG 3.31Å; A104-R108 WeakPolarHBondContact O-CG 3.34Å; A104-R108 PolarHBondContact O-N 3.34Å |
| 105 | V | 46.6 | Very low | 49 | Very low | 100 Ų | 100 | 124.1 Ų | 124.1 | 61% | 0.606 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -70.1 | -38.9 | 168.4 | 169.4 | 0 | 0 | 0 | 0 | 109.9 | A101 R102 R108 A109 | A101-V105 WeakPolarHBondContact O-CB 3.44Å; A101-V105 WeakPolarHBondContact O-CG2 3.36Å; A101-V105 PolarHBondContact O-N 3.32Å; R102-V105 PolarHBondContact O-N 3.3Å; V105-R108 PolarHBondContact O-N 3.15Å; V105-A109 WeakPolarHBondContact O-CA 3.38Å; V105-A109 WeakPolarHBondContact O-CB 3.21Å; V105-A109 PolarHBondContact O-N 3.5Å |
| 106 | Q | 45.4 | Very low | 49.7 | Very low | 136 Ų | 136 | 119.3 Ų | 119.3 | 64% | 0.636 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -67.6 | -36.7 | 172.9 | -156.7 | 79.2 | 25 | 0 | 0 | 112.3 | R102 R103 A109 S110 | R102-Q106 WeakPolarHBondContact O-CB 3.24Å; R102-Q106 PolarHBondContact O-N 3.26Å; R103-Q106 PolarHBondContact O-N 3.14Å; Q106-A109 CarbonylContact O-C 3.09Å; Q106-A109 PolarHBondContact O-N 3.32Å; Q106-S110 PolarHBondContact O-N 2.75Å |
| 107 | K | 40.1 | Very low | 50.9 | Low | 177 Ų | 177 | 119.1 Ų | 119.1 | 77% | 0.77 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -77.7 | -28.6 | 175.4 | -111.9 | -178.5 | 172.8 | -176.7 | 0 | 113.5 | R103 A109 S110 | R103-K107 VanDerWaalsContact O-CB 3.32Å; R103-K107 WeakPolarHBondContact O-CB 3.46Å; R103-K107 PolarHBondContact O-N 3.43Å; K107-A109 VanDerWaalsContact C-N 3.35Å; K107-S110 PolarHBondContact O-N 3.34Å |
| 108 | R | 40.9 | Very low | 52.4 | Low | 230 Ų | 230 | 111.5 Ų | 111.5 | 87% | 0.868 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -81.9 | -17.6 | 169.1 | -77 | -179.7 | 173.7 | -176.5 | -2.5 | 112.4 | A104 V105 S110 | A104-R108 WeakPolarHBondContact O-CB 3.25Å; A104-R108 VanDerWaalsContact O-CG 3.31Å; A104-R108 WeakPolarHBondContact O-CG 3.34Å; A104-R108 PolarHBondContact O-N 3.34Å; V105-R108 PolarHBondContact O-N 3.15Å; R108-S110 VanDerWaalsContact C-N 3.28Å |
| 109 | A | 37.2 | Very low | 54.4 | Low | 56 Ų | 56 | 110.6 Ų | 110.6 | 46% | 0.463 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.5 | 38.8 | 162.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | V105 Q106 K107 P111 | V105-A109 WeakPolarHBondContact O-CA 3.38Å; V105-A109 WeakPolarHBondContact O-CB 3.21Å; V105-A109 PolarHBondContact O-N 3.5Å; Q106-A109 CarbonylContact O-C 3.09Å; Q106-A109 PolarHBondContact O-N 3.32Å; K107-A109 VanDerWaalsContact C-N 3.35Å; A109-P111 WeakPolarHBondContact O-CD 3.35Å |
| 110 | S | 39 | Very low | 56 | Low | 92 Ų | 92 | 110 Ų | 110 | 64% | 0.643 | 57% | 0.568 | S | S | * | * | trans | -88.6 | 86.7 | 144.5 | -78.8 | 0 | 0 | 0 | 0 | 106.7 | Q106 K107 R108 | Q106-S110 PolarHBondContact O-N 2.75Å; K107-S110 PolarHBondContact O-N 3.34Å; R108-S110 VanDerWaalsContact C-N 3.28Å | ||
| 111 | P | 44.4 | Very low | 57.6 | Low | 86 Ų | 86 | 106.5 Ų | 106.5 | 56% | 0.558 | 56% | 0.56 | S | S | * | * | trans | -64.4 | 147 | 153.9 | 32.5 | -30.5 | 0 | 0 | 0 | 106.1 | A109 S113 | A109-P111 WeakPolarHBondContact O-CD 3.35Å; P111-S113 PolarHBondContact O-N 3.02Å | ||
| 112 | N | 40.5 | Very low | 59.7 | Low | 130 Ų | 130 | 108 Ų | 108 | 70% | 0.695 | 56% | 0.557 | S | S | * | * | trans | -48.6 | 121.8 | 155.2 | -79.1 | -14.7 | 0 | 0 | 0 | 106.7 | D114 | N112-D114 PolarHBondContact O-N 3.46Š| ||
| 113 | S | 47.3 | Very low | 62 | Low | 93 Ų | 93 | 98.4 Ų | 98.4 | 65% | 0.65 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | 0.3 | -162.9 | 41.8 | 0 | 0 | 0 | 0 | 115 | P111 | P111-S113 PolarHBondContact O-N 3.02Š|
| 114 | D | 48.5 | Very low | 64.2 | Low | 122 Ų | 122 | 93.5 Ų | 93.5 | 65% | 0.652 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.9 | -16.2 | -174.8 | -74.1 | -24.7 | 0 | 0 | 0 | 115.1 | N112 T116 I117 | N112-D114 PolarHBondContact O-N 3.46Å; D114-T116 PolarHBondContact O-N 3.11Å; D114-T116 VanDerWaalsContact O-N 3.12Å; D114-I117 PolarHBondContact O-N 2.68Å |
| 115 | D | 55.6 | Low | 66.5 | Low | 136 Ų | 136 | 97.9 Ų | 97.9 | 73% | 0.727 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -8.9 | -170 | -72.3 | -25.2 | 0 | 0 | 0 | 114.6 | ||
| 116 | T | 71.6 | Confident | 68.9 | Low | 86 Ų | 86 | 94 Ų | 94 | 53% | 0.528 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.2 | -16.4 | -178.7 | 52.1 | 0 | 0 | 0 | 0 | 113.7 | D114 | D114-T116 PolarHBondContact O-N 3.11Å; D114-T116 VanDerWaalsContact O-N 3.12Å |
| 117 | I | 86.2 | Confident | 71.4 | Confident | 50 Ų | 50 | 87.6 Ų | 87.6 | 26% | 0.256 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -95.9 | 113.1 | 178.4 | -61.5 | 170.4 | 0 | 0 | 0 | 106.7 | D114 Y152 F154 | D114-I117 PolarHBondContact O-N 2.68Å; I117-Y152 HydrophobicContact CD1-CD1 4.4Å; I117-Y152 HydrophobicContact CD1-CE1 3.98Å; I117-Y152 HydrophobicContact CG1-CD2 4.5Å; I117-Y152 HydrophobicContact CG1-CE1 4.08Å; I117-Y152 HydrophobicContact CG1-CE2 4.03Å; I117-F154 HydrophobicContact CD1-CZ 4.25Å; I117-F154 HydrophobicContact CG2-CE2 3.71Å; I117-F154 HydrophobicContact CG2-CZ 3.64Å |
| 118 | L | 90.3 | Very high | 74.1 | Confident | 34 Ų | 34 | 81.5 Ų | 81.5 | 18% | 0.178 | 44% | 0.442 | C | S | . | . | trans | -75.1 | 136.2 | -179.6 | -62.7 | 177.6 | 0 | 0 | 0 | 110.1 | E122 L123 V126 N149 | L118-E122 HydrophobicContact CB-CB 3.94Å; L118-E122 HydrophobicContact CD2-CB 4.1Å; L118-E122 HydrophobicContact CG-CB 4.47Å; L118-L123 HydrophobicContact CB-CD2 3.88Å; L118-L123 HydrophobicContact CB-CG 3.89Å; L118-L123 HydrophobicContact CD1-CD2 4.06Å; L118-V126 HydrophobicContact CD1-CG2 3.88Å; L118-N149 WeakPolarHBondContact CD1-ND2 3.47Å; L118-N149 WeakPolarHBondContact CG-ND2 3.37Å; L118-N149 PolarHBondContact N-OD1 3.15Å | ||
| 119 | S | 92.4 | Very high | 76.7 | Confident | 40 Ų | 40 | 74.6 Ų | 74.6 | 28% | 0.28 | 42% | 0.422 | S | S | . | . | trans | -63.1 | 160.1 | 168.3 | 62 | 0 | 0 | 0 | 0 | 111.3 | Q121 E122 L123 | S119-Q121 PolarHBondContact O-N 3.05Å; S119-E122 WeakPolarHBondContact CB-OE2 3.44Å; S119-E122 PolarHBondContact N-OE2 3.34Å; S119-E122 WeakPolarHBondContact O-CA 3.33Å; S119-E122 WeakPolarHBondContact O-CB 3.18Å; S119-E122 PolarHBondContact O-N 2.66Å; S119-E122 VanDerWaalsContact OG-CG 3.26Å; S119-E122 WeakPolarHBondContact OG-CG 3.35Å; S119-E122 PolarHBondContact OG-N 3.41Å; S119-E122 PolarHBondContact OG-OE2 3.41Å; S119-L123 PolarHBondContact O-N 3.05Å | ||
| 120 | P | 93.3 | Very high | 79.6 | Confident | 56 Ų | 56 | 72 Ų | 72 | 36% | 0.364 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -53 | -38.5 | 176.2 | -27.3 | 34.6 | 0 | 0 | 0 | 113.6 | E122 L123 Q124 I158 | P120-E122 VanDerWaalsContact C-N 3.33Å; P120-E122 PolarHBondContact O-N 3.01Å; P120-L123 PolarHBondContact O-N 3.35Å; P120-Q124 PolarHBondContact O-N 3.23Å; P120-I158 HydrophobicContact CB-CG2 3.99Å; P120-I158 HydrophobicContact CG-CD1 4.27Å; P120-I158 HydrophobicContact CG-CG2 4.27Å |
| 121 | Q | 93.8 | Very high | 82.3 | Confident | 126 Ų | 126 | 73.1 Ų | 73.1 | 59% | 0.589 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -69.1 | -31.9 | 177.9 | -62 | 81.7 | 2.5 | 0 | 0 | 112.3 | S119 K125 | S119-Q121 PolarHBondContact O-N 3.05Å; Q121-K125 WeakPolarHBondContact O-CG 3.41Å; Q121-K125 PolarHBondContact O-N 3.21Å |
| 122 | E | 94.5 | Very high | 84.6 | Confident | 85 Ų | 85 | 76 Ų | 76 | 40% | 0.397 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -76 | -39.5 | 174.8 | -71.6 | 165.1 | 144.7 | 0 | 0 | 111.7 | L118 S119 P120 Q124 K125 V126 | L118-E122 HydrophobicContact CB-CB 3.94Å; L118-E122 HydrophobicContact CD2-CB 4.1Å; L118-E122 HydrophobicContact CG-CB 4.47Å; S119-E122 WeakPolarHBondContact CB-OE2 3.44Å; S119-E122 PolarHBondContact N-OE2 3.34Å; S119-E122 WeakPolarHBondContact O-CA 3.33Å; S119-E122 WeakPolarHBondContact O-CB 3.18Å; S119-E122 PolarHBondContact O-N 2.66Å; S119-E122 VanDerWaalsContact OG-CG 3.26Å; S119-E122 WeakPolarHBondContact OG-CG 3.35Å; S119-E122 PolarHBondContact OG-N 3.41Å; S119-E122 PolarHBondContact OG-OE2 3.41Å; P120-E122 VanDerWaalsContact C-N 3.33Å; P120-E122 PolarHBondContact O-N 3.01Å; E122-Q124 VanDerWaalsContact C-N 3.31Å; E122-Q124 PolarHBondContact O-N 2.93Å; E122-K125 WeakPolarHBondContact O-CB 3.5Å; E122-K125 PolarHBondContact O-N 2.94Å; E122-K125 VanDerWaalsContact O-N 3.13Å; E122-V126 WeakPolarHBondContact O-CG2 3.4Å; E122-V126 PolarHBondContact O-N 3.29Å |
| 123 | L | 96 | Very high | 87 | Confident | 0 Ų | 0 | 70.9 Ų | 70.9 | 0% | 0 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -57.8 | -44.4 | 171.2 | -70.4 | 171.1 | 0 | 0 | 0 | 111.1 | L118 S119 P120 K125 V126 L127 L146 N149 N155 I158 I159 L162 | L118-L123 HydrophobicContact CB-CD2 3.88Å; L118-L123 HydrophobicContact CB-CG 3.89Å; L118-L123 HydrophobicContact CD1-CD2 4.06Å; S119-L123 PolarHBondContact O-N 3.05Å; P120-L123 PolarHBondContact O-N 3.35Å; L123-K125 VanDerWaalsContact C-N 3.31Å; L123-K125 PolarHBondContact O-N 3.25Å; L123-V126 PolarHBondContact O-N 3.17Å; L123-L127 WeakPolarHBondContact O-CG 3.16Å; L123-L127 PolarHBondContact O-N 3.36Å; L123-L146 HydrophobicContact CD2-CD1 4.19Å; L123-N149 HydrophobicContact CD2-CB 3.78Å; L123-N155 HydrophobicContact CD1-CB 4.47Å; L123-I158 HydrophobicContact CD1-CB 4.37Å; L123-I158 HydrophobicContact CD1-CG2 3.79Å; L123-I159 HydrophobicContact CD1-CG1 4.16Å; L123-I159 HydrophobicContact CD2-CD1 4.24Å; L123-I159 HydrophobicContact CD2-CG1 4.13Å; L123-L162 HydrophobicContact CB-CD1 3.91Å |
| 124 | Q | 96.9 | Very high | 89.1 | Confident | 81 Ų | 81 | 75.3 Ų | 75.3 | 38% | 0.379 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.7 | -40.4 | 175.2 | -175.4 | 63.4 | 66.9 | 0 | 0 | 112.2 | P120 E122 L127 C128 L162 | P120-Q124 PolarHBondContact O-N 3.23Å; E122-Q124 VanDerWaalsContact C-N 3.31Å; E122-Q124 PolarHBondContact O-N 2.93Å; Q124-L127 PolarHBondContact O-N 3.35Å; Q124-C128 WeakPolarHBondContact O-CB 3.33Å; Q124-C128 PolarHBondContact O-N 3.28Å; Q124-L162 HydrophobicContact CB-CD1 4.29Å; Q124-L162 VanDerWaalsContact OE1-CD2 3.25Å |
| 125 | K | 96.1 | Very high | 91.2 | Very high | 140 Ų | 140 | 74.9 Ų | 74.9 | 61% | 0.609 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -65.6 | -41.6 | 175.9 | -71.3 | 168.5 | -170.5 | 168.5 | 0 | 111.6 | Q121 E122 L123 C128 L129 | Q121-K125 WeakPolarHBondContact O-CG 3.41Å; Q121-K125 PolarHBondContact O-N 3.21Å; E122-K125 WeakPolarHBondContact O-CB 3.5Å; E122-K125 PolarHBondContact O-N 2.94Å; E122-K125 VanDerWaalsContact O-N 3.13Å; L123-K125 VanDerWaalsContact C-N 3.31Å; L123-K125 PolarHBondContact O-N 3.25Å; K125-C128 WeakPolarHBondContact O-CB 3.39Å; K125-C128 PolarHBondContact O-N 3.48Å; K125-L129 WeakPolarHBondContact O-CG 3.36Å; K125-L129 PolarHBondContact O-N 2.94Å |
| 126 | V | 97.4 | Very high | 93 | Very high | 19 Ų | 19 | 71.3 Ų | 71.3 | 12% | 0.115 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 176.3 | 174.2 | 0 | 0 | 0 | 0 | 110.7 | L118 E122 L123 C128 L129 V130 A142 L146 | L118-V126 HydrophobicContact CD1-CG2 3.88Å; E122-V126 WeakPolarHBondContact O-CG2 3.4Å; E122-V126 PolarHBondContact O-N 3.29Å; L123-V126 PolarHBondContact O-N 3.17Å; V126-C128 VanDerWaalsContact C-N 3.34Å; V126-C128 PolarHBondContact O-N 3.07Å; V126-L129 WeakPolarHBondContact O-CB 3.21Å; V126-L129 PolarHBondContact O-N 3.21Å; V126-L129 VanDerWaalsContact O-N 3.14Å; V126-V130 WeakPolarHBondContact O-CG2 3.35Å; V126-V130 PolarHBondContact O-N 3.25Å; V126-A142 HydrophobicContact CG1-CB 4.2Å; V126-A142 WeakPolarHBondContact CG1-O 3.4Å; V126-L146 HydrophobicContact CG1-CB 4.01Å |
| 127 | L | 97.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 74.2 Ų | 74.2 | 0% | 0 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60.6 | -42.8 | 175.2 | -72.8 | 173.6 | 0 | 0 | 0 | 112 | L123 Q124 L129 V130 E131 L146 L162 I167 | L123-L127 WeakPolarHBondContact O-CG 3.16Å; L123-L127 PolarHBondContact O-N 3.36Å; Q124-L127 PolarHBondContact O-N 3.35Å; L127-L129 VanDerWaalsContact C-N 3.31Å; L127-L129 PolarHBondContact O-N 3.03Å; L127-V130 PolarHBondContact O-N 3.01Å; L127-V130 VanDerWaalsContact O-N 3.16Å; L127-E131 WeakPolarHBondContact O-CB 3.37Å; L127-E131 PolarHBondContact O-N 2.73Å; L127-L146 HydrophobicContact CD2-CD1 4.12Å; L127-L146 HydrophobicContact CD2-CD2 3.64Å; L127-L146 HydrophobicContact CG-CD1 4.44Å; L127-L162 HydrophobicContact CD1-CB 3.67Å; L127-L162 HydrophobicContact CD1-CD1 4.29Å; L127-I167 HydrophobicContact CB-CD1 4.27Å; L127-I167 HydrophobicContact CD2-CG2 4.47Å |
| 128 | C | 96.6 | Very high | 94.4 | Very high | 50 Ų | 50 | 74.2 Ų | 74.2 | 34% | 0.338 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60 | -40.3 | 173.7 | -179.4 | 0 | 0 | 0 | 0 | 111.9 | Q124 K125 V126 E131 M132 | Q124-C128 WeakPolarHBondContact O-CB 3.33Å; Q124-C128 PolarHBondContact O-N 3.28Å; K125-C128 WeakPolarHBondContact O-CB 3.39Å; K125-C128 PolarHBondContact O-N 3.48Å; V126-C128 VanDerWaalsContact C-N 3.34Å; V126-C128 PolarHBondContact O-N 3.07Å; C128-E131 PolarHBondContact O-N 3.12Å; C128-M132 VanDerWaalsContact O-CB 3.31Å; C128-M132 WeakPolarHBondContact O-CB 3.4Å; C128-M132 WeakPolarHBondContact O-CG 3.44Å; C128-M132 PolarHBondContact O-N 3.15Å |
| 129 | L | 95.9 | Very high | 94.7 | Very high | 85 Ų | 85 | 73.3 Ų | 73.3 | 45% | 0.445 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.2 | -40.7 | 173.8 | -71 | 171.6 | 0 | 0 | 0 | 112.6 | K125 V126 L127 E131 S133 A142 | K125-L129 WeakPolarHBondContact O-CG 3.36Å; K125-L129 PolarHBondContact O-N 2.94Å; V126-L129 WeakPolarHBondContact O-CB 3.21Å; V126-L129 PolarHBondContact O-N 3.21Å; V126-L129 VanDerWaalsContact O-N 3.14Å; L127-L129 VanDerWaalsContact C-N 3.31Å; L127-L129 PolarHBondContact O-N 3.03Å; L129-E131 VanDerWaalsContact C-N 3.3Å; L129-S133 WeakPolarHBondContact O-CB 3.39Å; L129-S133 PolarHBondContact O-N 3.12Å; L129-S133 VanDerWaalsContact O-N 3.1Å; L129-A142 HydrophobicContact CB-CB 4.36Å |
| 130 | V | 97.1 | Very high | 94.8 | Very high | 2 Ų | 2 | 74.5 Ų | 74.5 | 1% | 0.012 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 175.4 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | V126 L127 L139 A142 L143 I167 I171 | V126-V130 WeakPolarHBondContact O-CG2 3.35Å; V126-V130 PolarHBondContact O-N 3.25Å; L127-V130 PolarHBondContact O-N 3.01Å; L127-V130 VanDerWaalsContact O-N 3.16Å; V130-L139 VanDerWaalsContact O-CD2 3.28Å; V130-L139 WeakPolarHBondContact O-CD2 3.49Å; V130-A142 HydrophobicContact CG2-CB 3.7Å; V130-L143 HydrophobicContact CG1-CD2 4.08Å; V130-L143 HydrophobicContact CG2-CD2 4.1Å; V130-L143 HydrophobicContact CG2-CG 4.32Å; V130-I167 HydrophobicContact CB-CG2 4.12Å; V130-I167 HydrophobicContact CG1-CG2 3.79Å; V130-I171 HydrophobicContact CG1-CD1 3.89Å; V130-I171 HydrophobicContact CG1-CG1 3.75Å |
| 131 | E | 95.9 | Very high | 94.9 | Very high | 115 Ų | 115 | 74 Ų | 74 | 54% | 0.537 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -75.7 | -40 | -177.8 | -174.8 | 168.9 | -144.9 | 0 | 0 | 113.3 | L127 C128 L129 I167 | L127-E131 WeakPolarHBondContact O-CB 3.37Å; L127-E131 PolarHBondContact O-N 2.73Å; C128-E131 PolarHBondContact O-N 3.12Å; L129-E131 VanDerWaalsContact C-N 3.3Å; E131-I167 HydrophobicContact CB-CG2 4.07Å |
| 132 | M | 93.2 | Very high | 95 | Very high | 147 Ų | 147 | 68.4 Ų | 68.4 | 72% | 0.724 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -94.4 | -19.1 | -171 | -64.4 | -168.7 | 72.2 | 0 | 0 | 114.7 | C128 | C128-M132 VanDerWaalsContact O-CB 3.31Å; C128-M132 WeakPolarHBondContact O-CB 3.4Å; C128-M132 WeakPolarHBondContact O-CG 3.44Å; C128-M132 PolarHBondContact O-N 3.15Å |
| 133 | S | 91.9 | Very high | 95.1 | Very high | 21 Ų | 21 | 64.4 Ų | 64.4 | 15% | 0.147 | 32% | 0.321 | C | S | . | . | trans | -88.1 | 130 | -175 | 179.6 | 0 | 0 | 0 | 0 | 112.3 | L129 K135 I138 L139 | L129-S133 WeakPolarHBondContact O-CB 3.39Å; L129-S133 PolarHBondContact O-N 3.12Å; L129-S133 VanDerWaalsContact O-N 3.1Å; S133-K135 PolarHBondContact OG-N 3.14Å; S133-I138 WeakPolarHBondContact OG-CB 3.28Å; S133-I138 WeakPolarHBondContact OG-CG2 3.33Å; S133-L139 WeakPolarHBondContact O-CD2 3.2Å | ||
| 134 | E | 91.6 | Very high | 95.1 | Very high | 186 Ų | 186 | 67.9 Ų | 67.9 | 87% | 0.869 | 34% | 0.338 | S | S | * | . | trans | -93 | -9.9 | 168.9 | -61.9 | -178.9 | 171.5 | 0 | 0 | 112.7 | P136 | E134-P136 WeakPolarHBondContact O-CD 3.19Š| ||
| 135 | K | 92.6 | Very high | 95.1 | Very high | 113 Ų | 113 | 65.6 Ų | 65.6 | 49% | 0.491 | 33% | 0.333 | S | S | . | . | trans | -82.2 | 121.2 | -173.6 | -61.6 | -172.6 | -174.7 | 177.5 | 0 | 111 | S133 Y137 I138 L139 | S133-K135 PolarHBondContact OG-N 3.14Å; K135-Y137 HydrophobicContact CB-CD1 4.14Å; K135-Y137 HydrophobicContact CB-CE1 3.72Å; K135-Y137 HydrophobicContact CD-CE1 3.77Å; K135-Y137 VanDerWaalsContact CD-OH 3.22Å; K135-Y137 WeakPolarHBondContact CD-OH 3.28Å; K135-Y137 HydrophobicContact CG-CE1 4.25Å; K135-Y137 PolarHBondContact O-N 3.26Å; K135-I138 HydrophobicContact CB-CB 4.32Å; K135-I138 HydrophobicContact CB-CD1 3.98Å; K135-I138 HydrophobicContact CB-CG1 3.98Å; K135-I138 HydrophobicContact CD-CD1 3.89Å; K135-I138 HydrophobicContact CG-CD1 4.39Å; K135-I138 PolarHBondContact O-N 3.15Å; K135-I138 VanDerWaalsContact O-N 3.09Å; K135-L139 PolarHBondContact O-N 3.43Å; K135-L139 VanDerWaalsContact O-N 3.09Å | ||
| 136 | P | 93 | Very high | 95.1 | Very high | 61 Ų | 61 | 59 Ų | 59 | 40% | 0.396 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -57.8 | -42 | -174.4 | -29.1 | 35.9 | 0 | 0 | 0 | 115 | E134 I138 L139 E140 D176 V179 | E134-P136 WeakPolarHBondContact O-CD 3.19Å; P136-I138 VanDerWaalsContact C-N 3.28Å; P136-I138 PolarHBondContact O-N 2.9Å; P136-L139 PolarHBondContact O-N 3.22Å; P136-E140 WeakPolarHBondContact O-CB 3.27Å; P136-E140 PolarHBondContact O-N 3.45Å; P136-D176 VanDerWaalsContact CB-OD2 3.31Å; P136-D176 WeakPolarHBondContact CB-OD2 3.25Å; P136-V179 HydrophobicContact CB-CG2 4.05Å |
| 137 | Y | 93.1 | Very high | 95 | Very high | 147 Ų | 147 | 58.2 Ų | 58.2 | 58% | 0.576 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -66.6 | -28.8 | -179.7 | 68.1 | -91.4 | 0 | 0 | 0 | 113.2 | K135 A141 | K135-Y137 HydrophobicContact CB-CD1 4.14Å; K135-Y137 HydrophobicContact CB-CE1 3.72Å; K135-Y137 HydrophobicContact CD-CE1 3.77Å; K135-Y137 VanDerWaalsContact CD-OH 3.22Å; K135-Y137 WeakPolarHBondContact CD-OH 3.28Å; K135-Y137 HydrophobicContact CG-CE1 4.25Å; K135-Y137 PolarHBondContact O-N 3.26Å; Y137-A141 WeakPolarHBondContact O-CB 3.34Å; Y137-A141 PolarHBondContact O-N 3.5Å |
| 138 | I | 93.3 | Very high | 94.9 | Very high | 50 Ų | 50 | 63.2 Ų | 63.2 | 26% | 0.256 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -75.2 | -45.4 | 175 | -59.5 | -175.2 | 0 | 0 | 0 | 109.3 | S133 K135 P136 E140 A141 A142 | S133-I138 WeakPolarHBondContact OG-CB 3.28Å; S133-I138 WeakPolarHBondContact OG-CG2 3.33Å; K135-I138 HydrophobicContact CB-CB 4.32Å; K135-I138 HydrophobicContact CB-CD1 3.98Å; K135-I138 HydrophobicContact CB-CG1 3.98Å; K135-I138 HydrophobicContact CD-CD1 3.89Å; K135-I138 HydrophobicContact CG-CD1 4.39Å; K135-I138 PolarHBondContact O-N 3.15Å; K135-I138 VanDerWaalsContact O-N 3.09Å; P136-I138 VanDerWaalsContact C-N 3.28Å; P136-I138 PolarHBondContact O-N 2.9Å; I138-E140 PolarHBondContact O-N 3Å; I138-A141 PolarHBondContact O-N 3.43Å; I138-A142 VanDerWaalsContact O-CB 3.31Å; I138-A142 WeakPolarHBondContact O-CB 3.44Å; I138-A142 PolarHBondContact O-N 3.49Å |
| 139 | L | 96 | Very high | 94.8 | Very high | 15 Ų | 15 | 61 Ų | 61 | 8% | 0.079 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.7 | -46.1 | 177 | -71.3 | 176.3 | 0 | 0 | 0 | 111.3 | V130 S133 K135 P136 A141 A142 L143 I171 V179 | V130-L139 VanDerWaalsContact O-CD2 3.28Å; V130-L139 WeakPolarHBondContact O-CD2 3.49Å; S133-L139 WeakPolarHBondContact O-CD2 3.2Å; K135-L139 PolarHBondContact O-N 3.43Å; K135-L139 VanDerWaalsContact O-N 3.09Å; P136-L139 PolarHBondContact O-N 3.22Å; L139-A141 PolarHBondContact O-N 3.31Å; L139-A142 PolarHBondContact O-N 2.83Å; L139-L143 VanDerWaalsContact O-CB 3.32Å; L139-L143 WeakPolarHBondContact O-CB 3.41Å; L139-L143 WeakPolarHBondContact O-CD1 3.45Å; L139-L143 WeakPolarHBondContact O-CG 2.91Å; L139-L143 PolarHBondContact O-N 3.33Å; L139-I171 HydrophobicContact CD2-CD1 4.31Å; L139-V179 HydrophobicContact CB-CG1 3.88Å; L139-V179 HydrophobicContact CB-CG2 4.24Å; L139-V179 HydrophobicContact CD1-CG1 4.11Å |
| 140 | E | 95.4 | Very high | 94.8 | Very high | 66 Ų | 66 | 57 Ų | 57 | 31% | 0.308 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -57.2 | -51.3 | 176.7 | -175.8 | -177 | -178.1 | 0 | 0 | 111.3 | P136 I138 A142 L143 I144 I178 K182 | P136-E140 WeakPolarHBondContact O-CB 3.27Å; P136-E140 PolarHBondContact O-N 3.45Å; I138-E140 PolarHBondContact O-N 3Å; E140-A142 PolarHBondContact O-N 3.06Å; E140-L143 PolarHBondContact O-N 3.45Å; E140-I144 HydrophobicContact CG-CD1 3.9Å; E140-I144 VanDerWaalsContact O-CG1 3.25Å; E140-I144 WeakPolarHBondContact O-CG1 3.32Å; E140-I144 PolarHBondContact O-N 3.21Å; E140-I178 VanDerWaalsContact CD-CG2 3.46Å; E140-I178 HydrophobicContact CG-CG2 4.02Å; E140-I178 WeakPolarHBondContact OE1-CG2 3.4Å; E140-K182 HydrophobicContact CG-CG 4.15Å |
| 141 | A | 94.4 | Very high | 94.5 | Very high | 45 Ų | 45 | 59.3 Ų | 59.3 | 37% | 0.372 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62 | -42.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y137 I138 L139 I144 A145 | Y137-A141 WeakPolarHBondContact O-CB 3.34Å; Y137-A141 PolarHBondContact O-N 3.5Å; I138-A141 PolarHBondContact O-N 3.43Å; L139-A141 PolarHBondContact O-N 3.31Å; A141-I144 PolarHBondContact O-N 2.93Å; A141-A145 PolarHBondContact O-N 3.4Å; A141-A145 VanDerWaalsContact O-N 3.09Å |
| 142 | A | 96.8 | Very high | 94.3 | Very high | 8 Ų | 8 | 58 Ų | 58 | 7% | 0.066 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | V126 L129 V130 I138 L139 E140 A145 L146 | V126-A142 HydrophobicContact CG1-CB 4.2Å; V126-A142 WeakPolarHBondContact CG1-O 3.4Å; L129-A142 HydrophobicContact CB-CB 4.36Å; V130-A142 HydrophobicContact CG2-CB 3.7Å; I138-A142 VanDerWaalsContact O-CB 3.31Å; I138-A142 WeakPolarHBondContact O-CB 3.44Å; I138-A142 PolarHBondContact O-N 3.49Å; L139-A142 PolarHBondContact O-N 2.83Å; E140-A142 PolarHBondContact O-N 3.06Å; A142-A145 PolarHBondContact O-N 2.92Å; A142-L146 WeakPolarHBondContact O-CB 3.44Å; A142-L146 PolarHBondContact O-N 3.47Å |
| 143 | L | 97.4 | Very high | 94.1 | Very high | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.01 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -67.9 | -35 | 177.9 | -69.2 | 165.8 | 0 | 0 | 0 | 112.2 | V130 L139 E140 L146 G147 V168 I171 V179 K182 A183 V186 | V130-L143 HydrophobicContact CG1-CD2 4.08Å; V130-L143 HydrophobicContact CG2-CD2 4.1Å; V130-L143 HydrophobicContact CG2-CG 4.32Å; L139-L143 VanDerWaalsContact O-CB 3.32Å; L139-L143 WeakPolarHBondContact O-CB 3.41Å; L139-L143 WeakPolarHBondContact O-CD1 3.45Å; L139-L143 WeakPolarHBondContact O-CG 2.91Å; L139-L143 PolarHBondContact O-N 3.33Å; E140-L143 PolarHBondContact O-N 3.45Å; L143-L146 PolarHBondContact O-N 3.25Å; L143-G147 PolarHBondContact O-N 2.82Å; L143-V168 HydrophobicContact CD2-CG1 4.25Å; L143-V168 HydrophobicContact CD2-CG2 4.46Å; L143-I171 HydrophobicContact CD1-CG2 4.13Å; L143-V179 HydrophobicContact CD1-CG1 3.82Å; L143-K182 HydrophobicContact CB-CB 3.68Å; L143-K182 HydrophobicContact CD1-CB 4.06Å; L143-A183 HydrophobicContact CD1-CB 4.29Å; L143-A183 HydrophobicContact CD2-CB 4.46Å; L143-V186 HydrophobicContact CB-CG2 4.28Å; L143-V186 HydrophobicContact CD2-CG2 4.17Å; L143-V186 WeakPolarHBondContact O-CG2 3.49Å |
| 144 | I | 95.7 | Very high | 94 | Very high | 72 Ų | 72 | 58 Ų | 58 | 37% | 0.369 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.9 | -48.3 | 172.9 | -70.8 | 166.5 | 0 | 0 | 0 | 110.4 | E140 A141 L146 G147 N148 K182 | E140-I144 HydrophobicContact CG-CD1 3.9Å; E140-I144 VanDerWaalsContact O-CG1 3.25Å; E140-I144 WeakPolarHBondContact O-CG1 3.32Å; E140-I144 PolarHBondContact O-N 3.21Å; A141-I144 PolarHBondContact O-N 2.93Å; I144-L146 VanDerWaalsContact C-N 3.34Å; I144-L146 PolarHBondContact O-N 3.23Å; I144-G147 PolarHBondContact O-N 2.65Å; I144-N148 PolarHBondContact O-N 3.37Å; I144-N148 PolarHBondContact O-ND2 2.81Å; I144-K182 HydrophobicContact CG1-CD 4.21Å; I144-K182 HydrophobicContact CG1-CG 4.23Å |
| 145 | A | 95.4 | Very high | 94.1 | Very high | 34 Ų | 34 | 49.2 Ų | 49.2 | 28% | 0.281 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -60.8 | -44.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | A141 A142 N149 | A141-A145 PolarHBondContact O-N 3.4Å; A141-A145 VanDerWaalsContact O-N 3.09Å; A142-A145 PolarHBondContact O-N 2.92Å; A145-N149 PolarHBondContact O-N 2.94Å; A145-N149 PolarHBondContact O-ND2 3.36Å |
| 146 | L | 97.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65.1 | -40.6 | 177.5 | -170.7 | 62.3 | 0 | 0 | 0 | 112 | L123 V126 L127 A142 L143 I144 N149 A150 I159 V168 V186 | L123-L146 HydrophobicContact CD2-CD1 4.19Å; V126-L146 HydrophobicContact CG1-CB 4.01Å; L127-L146 HydrophobicContact CD2-CD1 4.12Å; L127-L146 HydrophobicContact CD2-CD2 3.64Å; L127-L146 HydrophobicContact CG-CD1 4.44Å; A142-L146 WeakPolarHBondContact O-CB 3.44Å; A142-L146 PolarHBondContact O-N 3.47Å; L143-L146 PolarHBondContact O-N 3.25Å; I144-L146 VanDerWaalsContact C-N 3.34Å; I144-L146 PolarHBondContact O-N 3.23Å; L146-N149 PolarHBondContact O-N 3.06Å; L146-A150 WeakPolarHBondContact O-CB 3.33Å; L146-A150 PolarHBondContact O-N 3.49Å; L146-I159 HydrophobicContact CD1-CD1 3.73Å; L146-I159 HydrophobicContact CD1-CG1 3.98Å; L146-I159 HydrophobicContact CD1-CG2 4.33Å; L146-V168 HydrophobicContact CD2-CG2 3.53Å; L146-V186 HydrophobicContact CB-CG2 4.46Å; L146-V186 HydrophobicContact CD2-CG1 3.96Å; L146-V186 HydrophobicContact CG-CG1 4Å |
| 147 | G | 95.1 | Very high | 94.2 | Very high | 4 Ų | 4 | 45.4 Ų | 45.4 | 4% | 0.041 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66.8 | -39.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L143 I144 N149 A150 A151 N189 | L143-G147 PolarHBondContact O-N 2.82Å; I144-G147 PolarHBondContact O-N 2.65Å; G147-N149 VanDerWaalsContact C-N 3.3Å; G147-A150 PolarHBondContact O-N 2.88Å; G147-A151 PolarHBondContact O-N 2.72Å; G147-N189 PolarHBondContact O-ND2 3.21Å |
| 148 | N | 94.4 | Very high | 94.3 | Very high | 104 Ų | 104 | 40.6 Ų | 40.6 | 56% | 0.556 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -62.8 | -39.7 | 172.2 | -69.7 | -18.6 | 0 | 0 | 0 | 111.2 | I144 A151 Y152 | I144-N148 PolarHBondContact O-N 3.37Å; I144-N148 PolarHBondContact O-ND2 2.81Å; N148-A151 VanDerWaalsContact O-CB 3.29Å; N148-A151 WeakPolarHBondContact O-CB 3.36Å; N148-A151 PolarHBondContact O-N 3.23Å; N148-Y152 WeakPolarHBondContact O-CD2 3.48Å; N148-Y152 WeakPolarHBondContact O-CE2 3.36Å |
| 149 | N | 95.1 | Very high | 94.5 | Very high | 5 Ų | 5 | 38.2 Ų | 38.2 | 3% | 0.027 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -73.2 | -35.6 | 178.4 | -82.3 | -86.9 | 0 | 0 | 0 | 113 | L118 L123 A145 L146 G147 A151 Y152 N155 | L118-N149 WeakPolarHBondContact CD1-ND2 3.47Å; L118-N149 WeakPolarHBondContact CG-ND2 3.37Å; L118-N149 PolarHBondContact N-OD1 3.15Å; L123-N149 HydrophobicContact CD2-CB 3.78Å; A145-N149 PolarHBondContact O-N 2.94Å; A145-N149 PolarHBondContact O-ND2 3.36Å; L146-N149 PolarHBondContact O-N 3.06Å; G147-N149 VanDerWaalsContact C-N 3.3Å; N149-A151 PolarHBondContact O-N 3.34Å; N149-A151 VanDerWaalsContact O-N 3.17Å; N149-Y152 WeakPolarHBondContact O-CD2 3.47Å; N149-Y152 PolarHBondContact O-N 3.04Å; N149-Y152 VanDerWaalsContact O-N 3.11Å; N149-N155 WeakPolarHBondContact O-CB 3.38Å; N149-N155 PolarHBondContact OD1-ND2 3.37Å; N149-N155 VanDerWaalsContact OD1-ND2 3.17Å |
| 150 | A | 95.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63 | -17.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L146 G147 Y152 R156 I159 N189 L190 | L146-A150 WeakPolarHBondContact O-CB 3.33Å; L146-A150 PolarHBondContact O-N 3.49Å; G147-A150 PolarHBondContact O-N 2.88Å; A150-Y152 VanDerWaalsContact C-N 3.25Å; A150-Y152 PolarHBondContact O-N 2.89Å; A150-R156 WeakPolarHBondContact O-CG 3.38Å; A150-R156 PolarHBondContact O-NE 2.83Å; A150-I159 HydrophobicContact CB-CD1 4.06Å; A150-N189 HydrophobicContact CB-CB 3.83Å; A150-L190 HydrophobicContact CB-CD2 3.59Å; A150-L190 HydrophobicContact CB-CG 3.78Å |
| 151 | A | 91.7 | Very high | 94.6 | Very high | 51 Ų | 51 | 41.3 Ų | 41.3 | 42% | 0.421 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -28.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | G147 N148 N149 R156 | G147-A151 PolarHBondContact O-N 2.72Å; N148-A151 VanDerWaalsContact O-CB 3.29Å; N148-A151 WeakPolarHBondContact O-CB 3.36Å; N148-A151 PolarHBondContact O-N 3.23Å; N149-A151 PolarHBondContact O-N 3.34Å; N149-A151 VanDerWaalsContact O-N 3.17Å; A151-R156 PolarHBondContact O-NH2 3.19Å |
| 152 | Y | 91 | Very high | 94.8 | Very high | 86 Ų | 86 | 41.5 Ų | 41.5 | 34% | 0.337 | 23% | 0.227 | S | C | . | . | S | Bend | trans | -82.8 | 130 | 178.9 | -59.6 | -87.1 | 0 | 0 | 0 | 111.5 | I117 N148 N149 A150 F154 N155 R156 | I117-Y152 HydrophobicContact CD1-CD1 4.4Å; I117-Y152 HydrophobicContact CD1-CE1 3.98Å; I117-Y152 HydrophobicContact CG1-CD2 4.5Å; I117-Y152 HydrophobicContact CG1-CE1 4.08Å; I117-Y152 HydrophobicContact CG1-CE2 4.03Å; N148-Y152 WeakPolarHBondContact O-CD2 3.48Å; N148-Y152 WeakPolarHBondContact O-CE2 3.36Å; N149-Y152 WeakPolarHBondContact O-CD2 3.47Å; N149-Y152 PolarHBondContact O-N 3.04Å; N149-Y152 VanDerWaalsContact O-N 3.11Å; A150-Y152 VanDerWaalsContact C-N 3.25Å; A150-Y152 PolarHBondContact O-N 2.89Å; Y152-F154 HydrophobicContact CD1-CE1 4.12Å; Y152-F154 HydrophobicContact CD1-CZ 4.25Å; Y152-F154 HydrophobicContact CG-CE1 4.22Å; Y152-F154 HydrophobicContact CG-CZ 4.12Å; Y152-F154 PolarHBondContact O-N 3Å; Y152-N155 PolarHBondContact O-N 3.05Å; Y152-N155 VanDerWaalsContact O-N 3.14Å; Y152-R156 WeakPolarHBondContact O-CG 3.34Å; Y152-R156 PolarHBondContact O-N 3.36Å |
| 153 | A | 89.6 | Confident | 94.8 | Very high | 63 Ų | 63 | 42.5 Ų | 42.5 | 52% | 0.521 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -55.6 | -48.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | N155 R156 | A153-N155 VanDerWaalsContact C-N 3.3Å; A153-N155 PolarHBondContact O-N 3.47Å; A153-R156 WeakPolarHBondContact O-CB 3.49Å; A153-R156 PolarHBondContact O-N 3.3Å; A153-R156 VanDerWaalsContact O-N 3.13Å |
| 154 | F | 89.8 | Confident | 94.8 | Very high | 105 Ų | 105 | 42.4 Ų | 42.4 | 46% | 0.461 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.1 | -34.1 | 179.8 | 59.5 | -93.3 | 0 | 0 | 0 | 113.1 | I117 Y152 R156 D157 I158 | I117-F154 HydrophobicContact CD1-CZ 4.25Å; I117-F154 HydrophobicContact CG2-CE2 3.71Å; I117-F154 HydrophobicContact CG2-CZ 3.64Å; Y152-F154 HydrophobicContact CD1-CE1 4.12Å; Y152-F154 HydrophobicContact CD1-CZ 4.25Å; Y152-F154 HydrophobicContact CG-CE1 4.22Å; Y152-F154 HydrophobicContact CG-CZ 4.12Å; Y152-F154 PolarHBondContact O-N 3Å; F154-R156 VanDerWaalsContact C-N 3.31Å; F154-R156 PolarHBondContact O-N 3.29Å; F154-D157 PolarHBondContact O-N 2.67Å; F154-I158 HydrophobicContact CD2-CD1 4.36Å; F154-I158 WeakPolarHBondContact O-CG1 3.4Å; F154-I158 PolarHBondContact O-N 3.22Å |
| 155 | N | 93.5 | Very high | 94.9 | Very high | 2 Ų | 2 | 39.2 Ų | 39.2 | 1% | 0.011 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -73.5 | -22.2 | 177.9 | -83.1 | -11.5 | 0 | 0 | 0 | 112.7 | L123 N149 Y152 A153 D157 I158 I159 | L123-N155 HydrophobicContact CD1-CB 4.47Å; N149-N155 WeakPolarHBondContact O-CB 3.38Å; N149-N155 PolarHBondContact OD1-ND2 3.37Å; N149-N155 VanDerWaalsContact OD1-ND2 3.17Å; Y152-N155 PolarHBondContact O-N 3.05Å; Y152-N155 VanDerWaalsContact O-N 3.14Å; A153-N155 VanDerWaalsContact C-N 3.3Å; A153-N155 PolarHBondContact O-N 3.47Å; N155-D157 VanDerWaalsContact C-N 3.29Å; N155-D157 PolarHBondContact O-N 3.01Å; N155-I158 PolarHBondContact O-N 3.38Å; N155-I159 HydrophobicContact CB-CD1 4.42Å; N155-I159 VanDerWaalsContact O-CB 3.26Å; N155-I159 WeakPolarHBondContact O-CB 3.33Å; N155-I159 WeakPolarHBondContact O-CD1 2.99Å; N155-I159 WeakPolarHBondContact O-CG1 3.42Å; N155-I159 PolarHBondContact O-N 3.26Å |
| 156 | R | 94.1 | Very high | 95.1 | Very high | 42 Ų | 42 | 40.8 Ų | 40.8 | 16% | 0.158 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64.8 | -37.4 | 175.6 | -63.4 | 173.1 | -165.4 | 161.8 | 2.8 | 111.7 | A150 A151 Y152 A153 F154 R160 N189 L190 N193 N196 | A150-R156 WeakPolarHBondContact O-CG 3.38Å; A150-R156 PolarHBondContact O-NE 2.83Å; A151-R156 PolarHBondContact O-NH2 3.19Å; Y152-R156 WeakPolarHBondContact O-CG 3.34Å; Y152-R156 PolarHBondContact O-N 3.36Å; A153-R156 WeakPolarHBondContact O-CB 3.49Å; A153-R156 PolarHBondContact O-N 3.3Å; A153-R156 VanDerWaalsContact O-N 3.13Å; F154-R156 VanDerWaalsContact C-N 3.31Å; F154-R156 PolarHBondContact O-N 3.29Å; R156-R160 WeakPolarHBondContact O-CB 3.42Å; R156-R160 PolarHBondContact O-N 3.39Å; R156-N189 PolarHBondContact NE-O 2.98Å; R156-L190 HydrophobicContact CB-CD2 4.23Å; R156-L190 HydrophobicContact CG-CD2 4.19Å; R156-N193 HydrophobicContact CB-CB 4.39Å; R156-N196 PolarHBondContact O-ND2 3.22Å |
| 157 | D | 93.6 | Very high | 95.1 | Very high | 53 Ų | 53 | 41.8 Ų | 41.8 | 28% | 0.283 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -72.2 | -47.7 | 176.6 | -63.7 | -50 | 0 | 0 | 0 | 110.3 | F154 N155 I159 R160 D161 N193 | F154-D157 PolarHBondContact O-N 2.67Å; N155-D157 VanDerWaalsContact C-N 3.29Å; N155-D157 PolarHBondContact O-N 3.01Å; D157-I159 PolarHBondContact O-N 3.33Å; D157-R160 WeakPolarHBondContact O-CB 3.22Å; D157-R160 PolarHBondContact O-N 3.11Å; D157-R160 VanDerWaalsContact O-N 3.16Å; D157-R160 IonicContact OD1-CZ 2.68Å; D157-R160 IonicContact OD1-NH1 2.69Å; D157-R160 PolarHBondContact OD1-NH1 2.89Å; D157-R160 IonicContact OD1-NH2 2.77Å; D157-R160 PolarHBondContact OD1-NH2 3.38Å; D157-D161 WeakPolarHBondContact O-CB 3.46Å; D157-D161 PolarHBondContact O-N 3.36Å; D157-N193 PolarHBondContact OD1-ND2 3.08Å; D157-N193 VanDerWaalsContact OD1-ND2 3.13Å |
| 158 | I | 95.9 | Very high | 95.3 | Very high | 45 Ų | 45 | 41.6 Ų | 41.6 | 23% | 0.231 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.1 | -48.7 | 176.7 | -63.5 | 161.8 | 0 | 0 | 0 | 111.2 | P120 L123 F154 N155 R160 D161 L162 | P120-I158 HydrophobicContact CB-CG2 3.99Å; P120-I158 HydrophobicContact CG-CD1 4.27Å; P120-I158 HydrophobicContact CG-CG2 4.27Å; L123-I158 HydrophobicContact CD1-CB 4.37Å; L123-I158 HydrophobicContact CD1-CG2 3.79Å; F154-I158 HydrophobicContact CD2-CD1 4.36Å; F154-I158 WeakPolarHBondContact O-CG1 3.4Å; F154-I158 PolarHBondContact O-N 3.22Å; N155-I158 PolarHBondContact O-N 3.38Å; I158-R160 VanDerWaalsContact C-N 3.28Å; I158-R160 PolarHBondContact O-N 3.42Å; I158-D161 PolarHBondContact O-N 3.45Å; I158-D161 VanDerWaalsContact O-N 3.16Å; I158-L162 HydrophobicContact CG2-CD1 3.74Å; I158-L162 HydrophobicContact CG2-CG 4.22Å; I158-L162 WeakPolarHBondContact O-CB 3.43Å; I158-L162 WeakPolarHBondContact O-CG 3.43Å; I158-L162 PolarHBondContact O-N 3.32Å |
| 159 | I | 97.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.2 | -40.1 | 179.2 | -69.8 | 164.2 | 0 | 0 | 0 | 110.9 | L123 L146 A150 N155 D157 G164 L190 | L123-I159 HydrophobicContact CD1-CG1 4.16Å; L123-I159 HydrophobicContact CD2-CD1 4.24Å; L123-I159 HydrophobicContact CD2-CG1 4.13Å; L146-I159 HydrophobicContact CD1-CD1 3.73Å; L146-I159 HydrophobicContact CD1-CG1 3.98Å; L146-I159 HydrophobicContact CD1-CG2 4.33Å; A150-I159 HydrophobicContact CB-CD1 4.06Å; N155-I159 HydrophobicContact CB-CD1 4.42Å; N155-I159 VanDerWaalsContact O-CB 3.26Å; N155-I159 WeakPolarHBondContact O-CB 3.33Å; N155-I159 WeakPolarHBondContact O-CD1 2.99Å; N155-I159 WeakPolarHBondContact O-CG1 3.42Å; N155-I159 PolarHBondContact O-N 3.26Å; D157-I159 PolarHBondContact O-N 3.33Å; I159-G164 VanDerWaalsContact O-CA 3.32Å; I159-G164 WeakPolarHBondContact O-CA 3.27Å; I159-G164 PolarHBondContact O-N 3.09Å; I159-L190 HydrophobicContact CB-CD2 4.08Å; I159-L190 HydrophobicContact CD1-CD2 4.06Å; I159-L190 HydrophobicContact CG2-CD1 3.94Å; I159-L190 HydrophobicContact CG2-CD2 3.92Å |
| 160 | R | 97.4 | Very high | 95.6 | Very high | 33 Ų | 33 | 43.1 Ų | 43.1 | 13% | 0.125 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.4 | -48.9 | 174.9 | 172.4 | -164 | 54.6 | -126.1 | 6.4 | 110.8 | R156 D157 I158 L162 G163 L165 N193 N196 R199 | R156-R160 WeakPolarHBondContact O-CB 3.42Å; R156-R160 PolarHBondContact O-N 3.39Å; D157-R160 WeakPolarHBondContact O-CB 3.22Å; D157-R160 PolarHBondContact O-N 3.11Å; D157-R160 VanDerWaalsContact O-N 3.16Å; D157-R160 IonicContact OD1-CZ 2.68Å; D157-R160 IonicContact OD1-NH1 2.69Å; D157-R160 PolarHBondContact OD1-NH1 2.89Å; D157-R160 IonicContact OD1-NH2 2.77Å; D157-R160 PolarHBondContact OD1-NH2 3.38Å; I158-R160 VanDerWaalsContact C-N 3.28Å; I158-R160 PolarHBondContact O-N 3.42Å; R160-L162 PolarHBondContact O-N 3.11Å; R160-G163 WeakPolarHBondContact O-CA 3.39Å; R160-G163 PolarHBondContact O-N 3.11Å; R160-L165 HydrophobicContact CB-CD1 4.23Å; R160-L165 HydrophobicContact CB-CG 4.43Å; R160-L165 HydrophobicContact CG-CD1 3.89Å; R160-N193 PolarHBondContact NH1-OD1 3.41Å; R160-N196 WeakPolarHBondContact CB-OD1 3.35Å; R160-N196 WeakPolarHBondContact CD-OD1 3.47Å; R160-N196 PolarHBondContact NH1-OD1 2.91Å; R160-R199 VanDerWaalsContact CD-NH1 3.26Å |
| 161 | D | 96.7 | Very high | 95.8 | Very high | 114 Ų | 114 | 44.2 Ų | 44.2 | 61% | 0.61 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -68 | -27.2 | -174 | -61.9 | -11.6 | 0 | 0 | 0 | 111.5 | D157 I158 G163 | D157-D161 WeakPolarHBondContact O-CB 3.46Å; D157-D161 PolarHBondContact O-N 3.36Å; I158-D161 PolarHBondContact O-N 3.45Å; I158-D161 VanDerWaalsContact O-N 3.16Å; D161-G163 PolarHBondContact O-N 2.83Å |
| 162 | L | 97.3 | Very high | 96 | Very high | 49 Ų | 49 | 41.8 Ų | 41.8 | 26% | 0.257 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | 6.6 | 169.4 | -60.5 | 172.3 | 0 | 0 | 0 | 113.8 | L123 Q124 L127 I158 R160 | L123-L162 HydrophobicContact CB-CD1 3.91Å; Q124-L162 HydrophobicContact CB-CD1 4.29Å; Q124-L162 VanDerWaalsContact OE1-CD2 3.25Å; L127-L162 HydrophobicContact CD1-CB 3.67Å; L127-L162 HydrophobicContact CD1-CD1 4.29Å; I158-L162 HydrophobicContact CG2-CD1 3.74Å; I158-L162 HydrophobicContact CG2-CG 4.22Å; I158-L162 WeakPolarHBondContact O-CB 3.43Å; I158-L162 WeakPolarHBondContact O-CG 3.43Å; I158-L162 PolarHBondContact O-N 3.32Å; R160-L162 PolarHBondContact O-N 3.11Å |
| 163 | G | 97.3 | Very high | 96.3 | Very high | 29 Ų | 29 | 43 Ų | 43 | 30% | 0.299 | 23% | 0.231 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 76.6 | 18.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | R160 D161 L165 P166 I167 | R160-G163 WeakPolarHBondContact O-CA 3.39Å; R160-G163 PolarHBondContact O-N 3.11Å; D161-G163 PolarHBondContact O-N 2.83Å; G163-L165 VanDerWaalsContact C-N 3.35Å; G163-L165 PolarHBondContact O-N 3.03Å; G163-P166 VanDerWaalsContact O-CD 3.23Å; G163-P166 WeakPolarHBondContact O-CD 3.01Å; G163-P166 VanDerWaalsContact O-CG 3.29Å; G163-P166 WeakPolarHBondContact O-CG 3.47Å; G163-I167 WeakPolarHBondContact O-CG1 3.37Å |
| 164 | G | 98.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.7 | -27.4 | -172.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | I159 I167 V168 | I159-G164 VanDerWaalsContact O-CA 3.32Å; I159-G164 WeakPolarHBondContact O-CA 3.27Å; I159-G164 PolarHBondContact O-N 3.09Å; G164-I167 PolarHBondContact O-N 2.92Å; G164-V168 VanDerWaalsContact O-CG2 3.26Å; G164-V168 WeakPolarHBondContact O-CG2 3.28Å; G164-V168 PolarHBondContact O-N 3.02Å |
| 165 | L | 98.3 | Very high | 96.8 | Very high | 4 Ų | 4 | 48.7 Ų | 48.7 | 2% | 0.021 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.3 | -57.5 | -179.8 | -60.1 | 175.8 | 0 | 0 | 0 | 112.8 | R160 G163 I167 V168 A169 L190 N196 R199 L200 | R160-L165 HydrophobicContact CB-CD1 4.23Å; R160-L165 HydrophobicContact CB-CG 4.43Å; R160-L165 HydrophobicContact CG-CD1 3.89Å; G163-L165 VanDerWaalsContact C-N 3.35Å; G163-L165 PolarHBondContact O-N 3.03Å; L165-I167 VanDerWaalsContact C-N 3.32Å; L165-I167 PolarHBondContact O-N 3.22Å; L165-V168 PolarHBondContact O-N 3.47Å; L165-A169 VanDerWaalsContact O-CB 3.3Å; L165-A169 WeakPolarHBondContact O-CB 3.47Å; L165-A169 PolarHBondContact O-N 3.25Å; L165-L190 HydrophobicContact CD2-CB 3.89Å; L165-L190 HydrophobicContact CD2-CD1 3.63Å; L165-L190 HydrophobicContact CD2-CG 4.27Å; L165-N196 HydrophobicContact CD1-CB 4.22Å; L165-N196 HydrophobicContact CD2-CB 4.43Å; L165-R199 HydrophobicContact CD1-CB 3.68Å; L165-R199 HydrophobicContact CD1-CG 4.35Å; L165-L200 HydrophobicContact CB-CD2 4.15Å; L165-L200 HydrophobicContact CD1-CG 4.5Å; L165-L200 HydrophobicContact CD2-CD1 4.18Å; L165-L200 HydrophobicContact CD2-CD2 4.03Å; L165-L200 HydrophobicContact CD2-CG 4.14Å |
| 166 | P | 98.4 | Very high | 97 | Very high | 67 Ų | 67 | 50.6 Ų | 50.6 | 44% | 0.435 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -63.8 | -34.3 | 177 | 24.5 | -34.7 | 0 | 0 | 0 | 113.1 | G163 A169 K170 | G163-P166 VanDerWaalsContact O-CD 3.23Å; G163-P166 WeakPolarHBondContact O-CD 3.01Å; G163-P166 VanDerWaalsContact O-CG 3.29Å; G163-P166 WeakPolarHBondContact O-CG 3.47Å; P166-A169 PolarHBondContact O-N 3.49Å; P166-K170 WeakPolarHBondContact O-CB 3.39Å; P166-K170 PolarHBondContact O-N 2.97Å |
| 167 | I | 98.4 | Very high | 97 | Very high | 22 Ų | 22 | 52.3 Ų | 52.3 | 11% | 0.113 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.4 | -50.6 | 176.8 | -68.3 | 171.1 | 0 | 0 | 0 | 110.3 | L127 V130 E131 G163 G164 L165 K170 | L127-I167 HydrophobicContact CB-CD1 4.27Å; L127-I167 HydrophobicContact CD2-CG2 4.47Å; V130-I167 HydrophobicContact CB-CG2 4.12Å; V130-I167 HydrophobicContact CG1-CG2 3.79Å; E131-I167 HydrophobicContact CB-CG2 4.07Å; G163-I167 WeakPolarHBondContact O-CG1 3.37Å; G164-I167 PolarHBondContact O-N 2.92Å; L165-I167 VanDerWaalsContact C-N 3.32Å; L165-I167 PolarHBondContact O-N 3.22Å; I167-K170 PolarHBondContact O-N 3.37Å |
| 168 | V | 98.5 | Very high | 97.2 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -70 | -39.4 | 179.7 | 179.1 | 0 | 0 | 0 | 0 | 111.1 | L143 L146 G164 L165 K170 I171 A183 V186 L187 | L143-V168 HydrophobicContact CD2-CG1 4.25Å; L143-V168 HydrophobicContact CD2-CG2 4.46Å; L146-V168 HydrophobicContact CD2-CG2 3.53Å; G164-V168 VanDerWaalsContact O-CG2 3.26Å; G164-V168 WeakPolarHBondContact O-CG2 3.28Å; G164-V168 PolarHBondContact O-N 3.02Å; L165-V168 PolarHBondContact O-N 3.47Å; V168-K170 VanDerWaalsContact C-N 3.28Å; V168-K170 PolarHBondContact O-N 3.48Å; V168-I171 VanDerWaalsContact O-CB 3.27Å; V168-I171 WeakPolarHBondContact O-CB 3.35Å; V168-I171 PolarHBondContact O-N 2.87Å; V168-I171 VanDerWaalsContact O-N 3.09Å; V168-A183 HydrophobicContact CG1-CB 4.12Å; V168-V186 HydrophobicContact CB-CG1 4.48Å; V168-V186 HydrophobicContact CG1-CB 3.94Å; V168-V186 HydrophobicContact CG1-CG1 3.88Å; V168-V186 HydrophobicContact CG2-CG1 3.95Å; V168-L187 HydrophobicContact CB-CD2 3.96Å; V168-L187 HydrophobicContact CB-CG 4.49Å; V168-L187 HydrophobicContact CG1-CD1 4.45Å; V168-L187 HydrophobicContact CG1-CD2 3.73Å; V168-L187 HydrophobicContact CG1-CG 3.73Å |
| 169 | A | 98.1 | Very high | 97.3 | Very high | 1 Ų | 1 | 51.5 Ų | 51.5 | 1% | 0.008 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.9 | -35 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L165 P166 I171 L172 Y203 | L165-A169 VanDerWaalsContact O-CB 3.3Å; L165-A169 WeakPolarHBondContact O-CB 3.47Å; L165-A169 PolarHBondContact O-N 3.25Å; P166-A169 PolarHBondContact O-N 3.49Å; A169-I171 PolarHBondContact O-N 3.21Å; A169-L172 VanDerWaalsContact O-CB 3.24Å; A169-L172 WeakPolarHBondContact O-CB 3.46Å; A169-L172 VanDerWaalsContact O-CG 3.23Å; A169-L172 WeakPolarHBondContact O-CG 3.47Å; A169-L172 PolarHBondContact O-N 3.27Å; A169-Y203 HydrophobicContact CB-CD1 3.79Å; A169-Y203 HydrophobicContact CB-CD2 3.73Å; A169-Y203 HydrophobicContact CB-CE1 3.62Å; A169-Y203 HydrophobicContact CB-CE2 3.57Å; A169-Y203 HydrophobicContact CB-CG 3.84Å |
| 170 | K | 97.9 | Very high | 97.3 | Very high | 140 Ų | 140 | 53 Ų | 53 | 61% | 0.609 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -58.5 | -32.2 | 174.9 | -173 | -178.9 | 178.6 | -174.2 | 0 | 112.6 | P166 I167 V168 L172 N173 | P166-K170 WeakPolarHBondContact O-CB 3.39Å; P166-K170 PolarHBondContact O-N 2.97Å; I167-K170 PolarHBondContact O-N 3.37Å; V168-K170 VanDerWaalsContact C-N 3.28Å; V168-K170 PolarHBondContact O-N 3.48Å; K170-L172 PolarHBondContact O-N 3.07Å; K170-N173 PolarHBondContact O-N 3.32Å; K170-N173 PolarHBondContact O-ND2 3.33Å; K170-N173 VanDerWaalsContact O-ND2 3.16Å |
| 171 | I | 98 | Very high | 97.4 | Very high | 22 Ų | 22 | 53 Ų | 53 | 11% | 0.113 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -63.9 | -22.9 | 178.7 | -56 | -59.1 | 0 | 0 | 0 | 112 | V130 L139 L143 V168 A169 N173 T174 V179 A183 | V130-I171 HydrophobicContact CG1-CD1 3.89Å; V130-I171 HydrophobicContact CG1-CG1 3.75Å; L139-I171 HydrophobicContact CD2-CD1 4.31Å; L143-I171 HydrophobicContact CD1-CG2 4.13Å; V168-I171 VanDerWaalsContact O-CB 3.27Å; V168-I171 WeakPolarHBondContact O-CB 3.35Å; V168-I171 PolarHBondContact O-N 2.87Å; V168-I171 VanDerWaalsContact O-N 3.09Å; A169-I171 PolarHBondContact O-N 3.21Å; I171-N173 PolarHBondContact O-N 3.22Å; I171-T174 HydrophobicContact CG2-CG2 4.34Å; I171-T174 VanDerWaalsContact O-CB 3.32Å; I171-T174 WeakPolarHBondContact O-CB 3.42Å; I171-T174 WeakPolarHBondContact O-CG2 3.48Å; I171-T174 PolarHBondContact O-N 3.44Å; I171-V179 HydrophobicContact CG2-CG1 3.5Å; I171-A183 HydrophobicContact CB-CB 3.91Å; I171-A183 HydrophobicContact CG2-CB 3.76Å |
| 172 | L | 97.4 | Very high | 97.4 | Very high | 1 Ų | 1 | 49.8 Ų | 49.8 | 1% | 0.005 | 25% | 0.251 | C | S | . | . | G | 310 helix | trans | -58.1 | -21.5 | 176.7 | -59.9 | 179 | 0 | 0 | 0 | 113 | A169 K170 T174 K180 A183 L184 L187 V207 | A169-L172 VanDerWaalsContact O-CB 3.24Å; A169-L172 WeakPolarHBondContact O-CB 3.46Å; A169-L172 VanDerWaalsContact O-CG 3.23Å; A169-L172 WeakPolarHBondContact O-CG 3.47Å; A169-L172 PolarHBondContact O-N 3.27Å; K170-L172 PolarHBondContact O-N 3.07Å; L172-T174 PolarHBondContact O-N 3.5Å; L172-K180 WeakPolarHBondContact O-CE 3.29Å; L172-K180 PolarHBondContact O-NZ 2.98Å; L172-A183 HydrophobicContact CD2-CB 4.21Å; L172-L184 HydrophobicContact CD2-CD2 3.56Å; L172-L184 HydrophobicContact CD2-CG 3.73Å; L172-L187 HydrophobicContact CD1-CD1 3.85Å; L172-L187 HydrophobicContact CD2-CD1 4.17Å; L172-L187 HydrophobicContact CG-CD1 4.2Å; L172-V207 HydrophobicContact CD1-CG2 3.72Å |
| 173 | N | 96.4 | Very high | 97.5 | Very high | 110 Ų | 110 | 47.4 Ų | 47.4 | 59% | 0.588 | 24% | 0.239 | S | C | * | . | G | 310 helix | trans | -76.8 | -3 | 175.9 | -60.2 | -52.7 | 0 | 0 | 0 | 114.2 | K170 I171 Q206 | K170-N173 PolarHBondContact O-N 3.32Å; K170-N173 PolarHBondContact O-ND2 3.33Å; K170-N173 VanDerWaalsContact O-ND2 3.16Å; I171-N173 PolarHBondContact O-N 3.22Å; N173-Q206 PolarHBondContact OD1-NE2 2.95Å |
| 174 | T | 96 | Very high | 97.6 | Very high | 39 Ų | 39 | 46.3 Ų | 46.3 | 24% | 0.239 | 23% | 0.226 | C | C | . | . | trans | -67.6 | 150.1 | 178.1 | -169.3 | 0 | 0 | 0 | 0 | 112.3 | I171 L172 D176 V179 K180 | I171-T174 HydrophobicContact CG2-CG2 4.34Å; I171-T174 VanDerWaalsContact O-CB 3.32Å; I171-T174 WeakPolarHBondContact O-CB 3.42Å; I171-T174 WeakPolarHBondContact O-CG2 3.48Å; I171-T174 PolarHBondContact O-N 3.44Å; L172-T174 PolarHBondContact O-N 3.5Å; T174-D176 WeakPolarHBondContact CG2-O 3.47Å; T174-D176 PolarHBondContact OG1-N 3.24Å; T174-V179 HydrophobicContact CG2-CB 4.23Å; T174-V179 HydrophobicContact CG2-CG1 4.23Å; T174-K180 HydrophobicContact CG2-CB 3.75Å; T174-K180 WeakPolarHBondContact O-CE 3.36Å | ||
| 175 | R | 94.6 | Very high | 97.6 | Very high | 249 Ų | 249 | 49 Ų | 49 | 94% | 0.94 | 24% | 0.24 | S | C | * | . | S | Bend | trans | -86.2 | -11.6 | 169.8 | -64.7 | -175.5 | -179.7 | 174.7 | 0.5 | 112.9 | P177 | R175-P177 VanDerWaalsContact O-CD 3.3Å; R175-P177 WeakPolarHBondContact O-CD 3.34Å |
| 176 | D | 96.4 | Very high | 97.6 | Very high | 43 Ų | 43 | 48.9 Ų | 48.9 | 23% | 0.23 | 24% | 0.239 | C | C | . | . | trans | -79.9 | 111.9 | 179 | -171.8 | -37.5 | 0 | 0 | 0 | 110.4 | P136 T174 I178 V179 K180 | P136-D176 VanDerWaalsContact CB-OD2 3.31Å; P136-D176 WeakPolarHBondContact CB-OD2 3.25Å; T174-D176 WeakPolarHBondContact CG2-O 3.47Å; T174-D176 PolarHBondContact OG1-N 3.24Å; D176-I178 VanDerWaalsContact C-N 3.28Å; D176-I178 PolarHBondContact O-N 3.09Å; D176-I178 WeakPolarHBondContact OD1-CB 3.39Å; D176-I178 PolarHBondContact OD1-N 2.94Å; D176-V179 HydrophobicContact CB-CB 4.07Å; D176-V179 HydrophobicContact CB-CG2 4.05Å; D176-V179 PolarHBondContact O-N 3.47Å; D176-V179 PolarHBondContact OD1-N 3.28Å; D176-K180 WeakPolarHBondContact O-CB 3.41Å; D176-K180 PolarHBondContact O-N 3.46Å | ||
| 177 | P | 95.9 | Very high | 97.6 | Very high | 78 Ų | 78 | 45.8 Ų | 45.8 | 51% | 0.506 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -65.4 | -29.8 | -177.3 | 27.7 | -34.7 | 0 | 0 | 0 | 112.9 | R175 E181 V220 | R175-P177 VanDerWaalsContact O-CD 3.3Å; R175-P177 WeakPolarHBondContact O-CD 3.34Å; P177-E181 VanDerWaalsContact O-CB 3.27Å; P177-E181 WeakPolarHBondContact O-CB 3.32Å; P177-E181 PolarHBondContact O-N 3.21Å; P177-V220 HydrophobicContact CB-CG2 3.87Å; P177-V220 WeakPolarHBondContact O-CG2 3.46Å |
| 178 | I | 96.3 | Very high | 97.6 | Very high | 79 Ų | 79 | 45.9 Ų | 45.9 | 41% | 0.405 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -69.4 | -48.7 | 179.9 | -63.5 | 169.3 | 0 | 0 | 0 | 109 | E140 D176 E181 K182 | E140-I178 VanDerWaalsContact CD-CG2 3.46Å; E140-I178 HydrophobicContact CG-CG2 4.02Å; E140-I178 WeakPolarHBondContact OE1-CG2 3.4Å; D176-I178 VanDerWaalsContact C-N 3.28Å; D176-I178 PolarHBondContact O-N 3.09Å; D176-I178 WeakPolarHBondContact OD1-CB 3.39Å; D176-I178 PolarHBondContact OD1-N 2.94Å; I178-E181 WeakPolarHBondContact O-CB 3.47Å; I178-E181 PolarHBondContact O-N 3.33Å; I178-K182 WeakPolarHBondContact O-CG 3.28Å; I178-K182 PolarHBondContact O-N 3.09Å; I178-K182 VanDerWaalsContact O-N 3.07Å |
| 179 | V | 97.8 | Very high | 97.6 | Very high | 1 Ų | 1 | 47.7 Ų | 47.7 | 1% | 0.006 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -64.3 | -42.8 | 178.2 | 178.1 | 0 | 0 | 0 | 0 | 110.8 | P136 L139 L143 I171 T174 D176 E181 K182 A183 | P136-V179 HydrophobicContact CB-CG2 4.05Å; L139-V179 HydrophobicContact CB-CG1 3.88Å; L139-V179 HydrophobicContact CB-CG2 4.24Å; L139-V179 HydrophobicContact CD1-CG1 4.11Å; L143-V179 HydrophobicContact CD1-CG1 3.82Å; I171-V179 HydrophobicContact CG2-CG1 3.5Å; T174-V179 HydrophobicContact CG2-CB 4.23Å; T174-V179 HydrophobicContact CG2-CG1 4.23Å; D176-V179 HydrophobicContact CB-CB 4.07Å; D176-V179 HydrophobicContact CB-CG2 4.05Å; D176-V179 PolarHBondContact O-N 3.47Å; D176-V179 PolarHBondContact OD1-N 3.28Å; V179-E181 PolarHBondContact O-N 2.88Å; V179-K182 PolarHBondContact O-N 3.43Å; V179-A183 PolarHBondContact O-N 3.22Å |
| 180 | K | 98.4 | Very high | 97.6 | Very high | 33 Ų | 33 | 47.7 Ų | 47.7 | 14% | 0.143 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.5 | -45.1 | 175.8 | -175.2 | 175.4 | -69.1 | -143.3 | 0 | 111.7 | L172 T174 D176 K182 A183 L184 D210 V220 | L172-K180 WeakPolarHBondContact O-CE 3.29Å; L172-K180 PolarHBondContact O-NZ 2.98Å; T174-K180 HydrophobicContact CG2-CB 3.75Å; T174-K180 WeakPolarHBondContact O-CE 3.36Å; D176-K180 WeakPolarHBondContact O-CB 3.41Å; D176-K180 PolarHBondContact O-N 3.46Å; K180-K182 PolarHBondContact O-N 2.93Å; K180-A183 PolarHBondContact O-N 2.95Å; K180-L184 HydrophobicContact CG-CD1 4.23Å; K180-L184 WeakPolarHBondContact O-CG 3.44Å; K180-L184 PolarHBondContact O-N 3.41Å; K180-D210 IonicContact NZ-OD2 2.72Å; K180-D210 PolarHBondContact NZ-OD2 2.93Å; K180-V220 HydrophobicContact CD-CG1 3.74Å; K180-V220 HydrophobicContact CG-CG1 4.04Å |
| 181 | E | 98.4 | Very high | 97.5 | Very high | 33 Ų | 33 | 41 Ų | 41 | 15% | 0.154 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -57.2 | -47.4 | 175.3 | -177.2 | -156.7 | 133.8 | 0 | 0 | 111.3 | P177 I178 V179 A183 L184 I185 S219 V220 A223 | P177-E181 VanDerWaalsContact O-CB 3.27Å; P177-E181 WeakPolarHBondContact O-CB 3.32Å; P177-E181 PolarHBondContact O-N 3.21Å; I178-E181 WeakPolarHBondContact O-CB 3.47Å; I178-E181 PolarHBondContact O-N 3.33Å; V179-E181 PolarHBondContact O-N 2.88Å; E181-A183 VanDerWaalsContact C-N 3.34Å; E181-A183 PolarHBondContact O-N 2.94Å; E181-L184 PolarHBondContact O-N 2.75Å; E181-I185 HydrophobicContact CG-CD1 4.04Å; E181-I185 WeakPolarHBondContact O-CG1 3.41Å; E181-I185 PolarHBondContact O-N 3.26Å; E181-S219 VanDerWaalsContact CD-CB 3.47Å; E181-S219 WeakPolarHBondContact OE2-CB 3.45Å; E181-S219 PolarHBondContact OE2-OG 2.63Å; E181-V220 HydrophobicContact CB-CG2 4.06Å; E181-A223 HydrophobicContact CG-CB 4.27Å |
| 182 | K | 98.3 | Very high | 97.3 | Very high | 45 Ų | 45 | 43.7 Ų | 43.7 | 20% | 0.196 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.1 | -38.4 | -179.9 | -58.9 | -39.8 | 174.6 | -163.7 | 0 | 112.1 | E140 L143 I144 I178 V179 K180 I185 V186 | E140-K182 HydrophobicContact CG-CG 4.15Å; L143-K182 HydrophobicContact CB-CB 3.68Å; L143-K182 HydrophobicContact CD1-CB 4.06Å; I144-K182 HydrophobicContact CG1-CD 4.21Å; I144-K182 HydrophobicContact CG1-CG 4.23Å; I178-K182 WeakPolarHBondContact O-CG 3.28Å; I178-K182 PolarHBondContact O-N 3.09Å; I178-K182 VanDerWaalsContact O-N 3.07Å; V179-K182 PolarHBondContact O-N 3.43Å; K180-K182 PolarHBondContact O-N 2.93Å; K182-I185 HydrophobicContact CD-CD1 4.17Å; K182-I185 PolarHBondContact O-N 3.4Å; K182-V186 VanDerWaalsContact O-CG2 3.28Å; K182-V186 WeakPolarHBondContact O-CG2 3.45Å; K182-V186 PolarHBondContact O-N 3.4Å |
| 183 | A | 98.8 | Very high | 97.1 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.1 | -46.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | L143 V168 I171 L172 V179 K180 E181 I185 V186 L187 | L143-A183 HydrophobicContact CD1-CB 4.29Å; L143-A183 HydrophobicContact CD2-CB 4.46Å; V168-A183 HydrophobicContact CG1-CB 4.12Å; I171-A183 HydrophobicContact CB-CB 3.91Å; I171-A183 HydrophobicContact CG2-CB 3.76Å; L172-A183 HydrophobicContact CD2-CB 4.21Å; V179-A183 PolarHBondContact O-N 3.22Å; K180-A183 PolarHBondContact O-N 2.95Å; E181-A183 VanDerWaalsContact C-N 3.34Å; E181-A183 PolarHBondContact O-N 2.94Å; A183-I185 VanDerWaalsContact C-N 3.31Å; A183-I185 PolarHBondContact O-N 2.68Å; A183-V186 PolarHBondContact O-N 2.69Å; A183-L187 WeakPolarHBondContact O-CG 3.16Å; A183-L187 PolarHBondContact O-N 3.39Å |
| 184 | L | 98.8 | Very high | 96.9 | Very high | 5 Ų | 5 | 43.2 Ų | 43.2 | 3% | 0.026 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.1 | -39.7 | 176.1 | -71.6 | 166.6 | 0 | 0 | 0 | 112.3 | L172 K180 E181 L187 N188 V207 V220 A223 L227 | L172-L184 HydrophobicContact CD2-CD2 3.56Å; L172-L184 HydrophobicContact CD2-CG 3.73Å; K180-L184 HydrophobicContact CG-CD1 4.23Å; K180-L184 WeakPolarHBondContact O-CG 3.44Å; K180-L184 PolarHBondContact O-N 3.41Å; E181-L184 PolarHBondContact O-N 2.75Å; L184-L187 PolarHBondContact O-N 2.96Å; L184-N188 VanDerWaalsContact O-CB 3.29Å; L184-N188 WeakPolarHBondContact O-CB 3.34Å; L184-N188 PolarHBondContact O-N 3.18Å; L184-V207 HydrophobicContact CD2-CG1 4.2Å; L184-V207 HydrophobicContact CD2-CG2 4.39Å; L184-V220 HydrophobicContact CD1-CG1 3.89Å; L184-A223 HydrophobicContact CB-CB 3.69Å; L184-A223 HydrophobicContact CD1-CB 4.13Å; L184-L227 HydrophobicContact CD2-CD2 3.99Å |
| 185 | I | 98.5 | Very high | 96.8 | Very high | 58 Ų | 58 | 44.2 Ų | 44.2 | 30% | 0.297 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.5 | -44 | 175.8 | -68.6 | 166.3 | 0 | 0 | 0 | 111.4 | E181 K182 A183 N188 N189 A223 | E181-I185 HydrophobicContact CG-CD1 4.04Å; E181-I185 WeakPolarHBondContact O-CG1 3.41Å; E181-I185 PolarHBondContact O-N 3.26Å; K182-I185 HydrophobicContact CD-CD1 4.17Å; K182-I185 PolarHBondContact O-N 3.4Å; A183-I185 VanDerWaalsContact C-N 3.31Å; A183-I185 PolarHBondContact O-N 2.68Å; I185-N188 PolarHBondContact O-N 2.62Å; I185-N189 PolarHBondContact O-N 3.02Å; I185-N189 VanDerWaalsContact O-N 3.11Å; I185-A223 HydrophobicContact CG1-CB 4.25Å |
| 186 | V | 98.7 | Very high | 96.8 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.7 | -50.4 | 176.1 | 175.1 | 0 | 0 | 0 | 0 | 110.2 | L143 L146 V168 K182 A183 N188 N189 L190 | L143-V186 HydrophobicContact CB-CG2 4.28Å; L143-V186 HydrophobicContact CD2-CG2 4.17Å; L143-V186 WeakPolarHBondContact O-CG2 3.49Å; L146-V186 HydrophobicContact CB-CG2 4.46Å; L146-V186 HydrophobicContact CD2-CG1 3.96Å; L146-V186 HydrophobicContact CG-CG1 4Å; V168-V186 HydrophobicContact CB-CG1 4.48Å; V168-V186 HydrophobicContact CG1-CB 3.94Å; V168-V186 HydrophobicContact CG1-CG1 3.88Å; V168-V186 HydrophobicContact CG2-CG1 3.95Å; K182-V186 VanDerWaalsContact O-CG2 3.28Å; K182-V186 WeakPolarHBondContact O-CG2 3.45Å; K182-V186 PolarHBondContact O-N 3.4Å; A183-V186 PolarHBondContact O-N 2.69Å; V186-N188 VanDerWaalsContact C-N 3.31Å; V186-N188 PolarHBondContact O-N 2.92Å; V186-N189 PolarHBondContact O-N 2.77Å; V186-L190 HydrophobicContact CG1-CD1 3.81Å; V186-L190 HydrophobicContact CG1-CG 4.41Å; V186-L190 WeakPolarHBondContact O-CG 3.19Å; V186-L190 PolarHBondContact O-N 3.35Å |
| 187 | L | 98.7 | Very high | 96.8 | Very high | 2 Ų | 2 | 30.9 Ų | 30.9 | 1% | 0.01 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.3 | -40.2 | 179.3 | -67.1 | 178.3 | 0 | 0 | 0 | 112 | V168 L172 A183 L184 N189 L190 S191 L200 L227 | V168-L187 HydrophobicContact CB-CD2 3.96Å; V168-L187 HydrophobicContact CB-CG 4.49Å; V168-L187 HydrophobicContact CG1-CD1 4.45Å; V168-L187 HydrophobicContact CG1-CD2 3.73Å; V168-L187 HydrophobicContact CG1-CG 3.73Å; L172-L187 HydrophobicContact CD1-CD1 3.85Å; L172-L187 HydrophobicContact CD2-CD1 4.17Å; L172-L187 HydrophobicContact CG-CD1 4.2Å; A183-L187 WeakPolarHBondContact O-CG 3.16Å; A183-L187 PolarHBondContact O-N 3.39Å; L184-L187 PolarHBondContact O-N 2.96Å; L187-N189 VanDerWaalsContact C-N 3.33Å; L187-N189 PolarHBondContact O-N 3.35Å; L187-L190 PolarHBondContact O-N 2.82Å; L187-S191 VanDerWaalsContact O-CB 3.3Å; L187-S191 WeakPolarHBondContact O-CB 3.21Å; L187-S191 PolarHBondContact O-N 2.73Å; L187-S191 PolarHBondContact O-OG 3.03Å; L187-L200 HydrophobicContact CD2-CD2 3.76Å; L187-L227 HydrophobicContact CB-CD1 4.23Å; L187-L227 HydrophobicContact CB-CD2 3.77Å; L187-L227 HydrophobicContact CD1-CD2 4.2Å |
| 188 | N | 98.3 | Very high | 96.8 | Very high | 25 Ų | 25 | 33.6 Ų | 33.6 | 13% | 0.134 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.6 | -38.6 | 176.8 | 176.7 | 76.1 | 0 | 0 | 0 | 112.9 | L184 I185 V186 S191 R226 L227 N230 | L184-N188 VanDerWaalsContact O-CB 3.29Å; L184-N188 WeakPolarHBondContact O-CB 3.34Å; L184-N188 PolarHBondContact O-N 3.18Å; I185-N188 PolarHBondContact O-N 2.62Å; V186-N188 VanDerWaalsContact C-N 3.31Å; V186-N188 PolarHBondContact O-N 2.92Å; N188-S191 PolarHBondContact O-OG 2.95Å; N188-R226 PolarHBondContact OD1-O 3.05Å; N188-R226 VanDerWaalsContact OD1-O 3.12Å; N188-L227 HydrophobicContact CB-CB 4.15Å; N188-L227 HydrophobicContact CB-CD1 4.46Å; N188-L227 WeakPolarHBondContact OD1-CA 3.27Å; N188-L227 PolarHBondContact OD1-N 3.41Å; N188-N230 PolarHBondContact O-ND2 2.9Å; N188-N230 VanDerWaalsContact O-ND2 3.09Å; N188-N230 PolarHBondContact OD1-ND2 2.97Å |
| 189 | N | 98.1 | Very high | 96.8 | Very high | 38 Ų | 38 | 35.2 Ų | 35.2 | 20% | 0.203 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -71.6 | -39.7 | 176.5 | -70.6 | -5.6 | 0 | 0 | 0 | 111.1 | G147 A150 R156 I185 V186 L187 S191 V192 | G147-N189 PolarHBondContact O-ND2 3.21Å; A150-N189 HydrophobicContact CB-CB 3.83Å; R156-N189 PolarHBondContact NE-O 2.98Å; I185-N189 PolarHBondContact O-N 3.02Å; I185-N189 VanDerWaalsContact O-N 3.11Å; V186-N189 PolarHBondContact O-N 2.77Å; L187-N189 VanDerWaalsContact C-N 3.33Å; L187-N189 PolarHBondContact O-N 3.35Å; N189-S191 VanDerWaalsContact C-N 3.33Å; N189-V192 PolarHBondContact O-N 2.89Å |
| 190 | L | 97.6 | Very high | 96.7 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -67.2 | -33.9 | 176.7 | -67.2 | 172.5 | 0 | 0 | 0 | 112.1 | A150 R156 I159 L165 V186 L187 V192 N193 N196 | A150-L190 HydrophobicContact CB-CD2 3.59Å; A150-L190 HydrophobicContact CB-CG 3.78Å; R156-L190 HydrophobicContact CB-CD2 4.23Å; R156-L190 HydrophobicContact CG-CD2 4.19Å; I159-L190 HydrophobicContact CB-CD2 4.08Å; I159-L190 HydrophobicContact CD1-CD2 4.06Å; I159-L190 HydrophobicContact CG2-CD1 3.94Å; I159-L190 HydrophobicContact CG2-CD2 3.92Å; L165-L190 HydrophobicContact CD2-CB 3.89Å; L165-L190 HydrophobicContact CD2-CD1 3.63Å; L165-L190 HydrophobicContact CD2-CG 4.27Å; V186-L190 HydrophobicContact CG1-CD1 3.81Å; V186-L190 HydrophobicContact CG1-CG 4.41Å; V186-L190 WeakPolarHBondContact O-CG 3.19Å; V186-L190 PolarHBondContact O-N 3.35Å; L187-L190 PolarHBondContact O-N 2.82Å; L190-V192 PolarHBondContact O-N 3.42Å; L190-N193 PolarHBondContact O-N 3.48Å; L190-N196 WeakPolarHBondContact O-CB 3.32Å; L190-N196 PolarHBondContact O-ND2 2.81Å |
| 191 | S | 96.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 19% | 0.187 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.1 | -1.3 | -178.8 | 76.2 | 0 | 0 | 0 | 0 | 114.2 | L187 N188 N189 N193 Q197 N230 | L187-S191 VanDerWaalsContact O-CB 3.3Å; L187-S191 WeakPolarHBondContact O-CB 3.21Å; L187-S191 PolarHBondContact O-N 2.73Å; L187-S191 PolarHBondContact O-OG 3.03Å; N188-S191 PolarHBondContact O-OG 2.95Å; N189-S191 VanDerWaalsContact C-N 3.33Å; S191-N193 PolarHBondContact O-N 2.85Å; S191-Q197 WeakPolarHBondContact O-CG 3.31Å; S191-Q197 PolarHBondContact O-NE2 2.68Å; S191-N230 WeakPolarHBondContact OG-CB 3.34Å |
| 192 | V | 93.3 | Very high | 96.6 | Very high | 78 Ų | 78 | 41.3 Ų | 41.3 | 47% | 0.473 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -23.2 | 169.6 | -178.5 | 0 | 0 | 0 | 0 | 110.9 | N189 L190 | N189-V192 PolarHBondContact O-N 2.89Å; L190-V192 PolarHBondContact O-N 3.42Å |
| 193 | N | 92.7 | Very high | 96.5 | Very high | 35 Ų | 35 | 42 Ų | 42 | 19% | 0.187 | 21% | 0.21 | C | C | . | . | S | Bend | trans | -87.1 | 126.6 | 174.1 | 175.5 | -67.8 | 0 | 0 | 0 | 110.2 | R156 D157 R160 L190 S191 E195 N196 Q197 | R156-N193 HydrophobicContact CB-CB 4.39Å; D157-N193 PolarHBondContact OD1-ND2 3.08Å; D157-N193 VanDerWaalsContact OD1-ND2 3.13Å; R160-N193 PolarHBondContact NH1-OD1 3.41Å; L190-N193 PolarHBondContact O-N 3.48Å; S191-N193 PolarHBondContact O-N 2.85Å; N193-E195 VanDerWaalsContact C-N 3.34Å; N193-E195 PolarHBondContact O-N 2.88Å; N193-E195 WeakPolarHBondContact OD1-CB 3.3Å; N193-E195 PolarHBondContact OD1-N 3.35Å; N193-N196 HydrophobicContact CB-CB 4.14Å; N193-N196 WeakPolarHBondContact O-CB 3.26Å; N193-N196 PolarHBondContact O-N 3.29Å; N193-N196 VanDerWaalsContact O-N 3.1Å; N193-N196 PolarHBondContact OD1-N 3.02Å; N193-Q197 PolarHBondContact O-N 3.38Å |
| 194 | A | 92.3 | Very high | 96.4 | Very high | 67 Ų | 67 | 42.2 Ų | 42.2 | 55% | 0.554 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -61.3 | -37.4 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | N196 Q197 R198 | A194-N196 VanDerWaalsContact C-N 3.29Å; A194-N196 PolarHBondContact O-N 2.63Å; A194-Q197 WeakPolarHBondContact O-CB 3.47Å; A194-Q197 PolarHBondContact O-N 3.3Å; A194-R198 PolarHBondContact O-N 3.21Å |
| 195 | E | 93.9 | Very high | 96.3 | Very high | 60 Ų | 60 | 45.7 Ų | 45.7 | 28% | 0.28 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -70.1 | -29.5 | 177.8 | -177.7 | 57.4 | -160.2 | 0 | 0 | 111.9 | N193 R198 R199 | N193-E195 VanDerWaalsContact C-N 3.34Å; N193-E195 PolarHBondContact O-N 2.88Å; N193-E195 WeakPolarHBondContact OD1-CB 3.3Å; N193-E195 PolarHBondContact OD1-N 3.35Å; E195-R198 IonicContact OE1-NH1 2.69Å; E195-R198 IonicContact OE2-CZ 2.66Å; E195-R198 IonicContact OE2-NE 2.72Å; E195-R198 IonicContact OE2-NH1 2.65Å; E195-R198 PolarHBondContact OE2-NH1 2.9Å; E195-R198 IonicContact OE2-NH2 2.96Å; E195-R199 VanDerWaalsContact CD-NH1 3.31Å; E195-R199 VanDerWaalsContact CG-NH1 3.27Å; E195-R199 PolarHBondContact O-N 2.82Å; E195-R199 IonicContact OE1-CZ 3.52Å; E195-R199 IonicContact OE1-NH1 3.91Å; E195-R199 PolarHBondContact OE1-NH1 2.91Å; E195-R199 IonicContact OE1-NH2 3.14Å |
| 196 | N | 95.9 | Very high | 96.3 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -71 | -38.7 | 170 | -68 | -4.1 | 0 | 0 | 0 | 111.4 | R156 R160 L165 L190 N193 A194 R198 R199 L200 | R156-N196 PolarHBondContact O-ND2 3.22Å; R160-N196 WeakPolarHBondContact CB-OD1 3.35Å; R160-N196 WeakPolarHBondContact CD-OD1 3.47Å; R160-N196 PolarHBondContact NH1-OD1 2.91Å; L165-N196 HydrophobicContact CD1-CB 4.22Å; L165-N196 HydrophobicContact CD2-CB 4.43Å; L190-N196 WeakPolarHBondContact O-CB 3.32Å; L190-N196 PolarHBondContact O-ND2 2.81Å; N193-N196 HydrophobicContact CB-CB 4.14Å; N193-N196 WeakPolarHBondContact O-CB 3.26Å; N193-N196 PolarHBondContact O-N 3.29Å; N193-N196 VanDerWaalsContact O-N 3.1Å; N193-N196 PolarHBondContact OD1-N 3.02Å; A194-N196 VanDerWaalsContact C-N 3.29Å; A194-N196 PolarHBondContact O-N 2.63Å; N196-R198 VanDerWaalsContact C-N 3.31Å; N196-R198 PolarHBondContact O-N 2.75Å; N196-R199 PolarHBondContact O-N 3.06Å; N196-R199 VanDerWaalsContact O-N 3.17Å; N196-L200 WeakPolarHBondContact O-CB 3.41Å; N196-L200 VanDerWaalsContact O-CG 3.29Å; N196-L200 WeakPolarHBondContact O-CG 3.08Å; N196-L200 PolarHBondContact O-N 3.28Å |
| 197 | Q | 95.5 | Very high | 96.3 | Very high | 12 Ų | 12 | 45.8 Ų | 45.8 | 6% | 0.056 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -57.2 | -45.8 | 173.7 | -63.5 | -174.5 | -18.7 | 0 | 0 | 111.3 | S191 N193 A194 R199 L200 K201 N230 M231 T234 Y237 | S191-Q197 WeakPolarHBondContact O-CG 3.31Å; S191-Q197 PolarHBondContact O-NE2 2.68Å; N193-Q197 PolarHBondContact O-N 3.38Å; A194-Q197 WeakPolarHBondContact O-CB 3.47Å; A194-Q197 PolarHBondContact O-N 3.3Å; Q197-R199 PolarHBondContact O-N 3.34Å; Q197-L200 CarbonylContact O-C 3.58Å; Q197-L200 PolarHBondContact O-N 3.16Å; Q197-K201 PolarHBondContact O-N 3.23Å; Q197-N230 PolarHBondContact NE2-O 2.8Å; Q197-M231 HydrophobicContact CB-CE 4.22Å; Q197-M231 HydrophobicContact CB-SD 3.99Å; Q197-M231 HydrophobicContact CG-SD 3.88Å; Q197-M231 WeakPolarHBondContact O-CE 3.46Å; Q197-T234 PolarHBondContact OE1-OG1 2.92Å; Q197-Y237 HydrophobicContact CB-CE2 3.86Å |
| 198 | R | 95.7 | Very high | 96.2 | Very high | 134 Ų | 134 | 45.7 Ų | 45.7 | 51% | 0.506 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -54.5 | -39.6 | 176.9 | -176.8 | -171.7 | -68.5 | 169.9 | -7.5 | 112.8 | A194 E195 N196 K201 Y237 | A194-R198 PolarHBondContact O-N 3.21Å; E195-R198 IonicContact OE1-NH1 2.69Å; E195-R198 IonicContact OE2-CZ 2.66Å; E195-R198 IonicContact OE2-NE 2.72Å; E195-R198 IonicContact OE2-NH1 2.65Å; E195-R198 PolarHBondContact OE2-NH1 2.9Å; E195-R198 IonicContact OE2-NH2 2.96Å; N196-R198 VanDerWaalsContact C-N 3.31Å; N196-R198 PolarHBondContact O-N 2.75Å; R198-K201 WeakPolarHBondContact O-CD 3.4Å; R198-K201 VanDerWaalsContact O-CG 3.28Å; R198-K201 WeakPolarHBondContact O-CG 3.28Å; R198-Y237 WeakPolarHBondContact CA-OH 3.3Å |
| 199 | R | 96.3 | Very high | 96.2 | Very high | 114 Ų | 114 | 49 Ų | 49 | 43% | 0.43 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -76.4 | -36.5 | 175.9 | -74.4 | -176.6 | 174.2 | 72.3 | -3.1 | 112.4 | R160 L165 E195 N196 Q197 K201 | R160-R199 VanDerWaalsContact CD-NH1 3.26Å; L165-R199 HydrophobicContact CD1-CB 3.68Å; L165-R199 HydrophobicContact CD1-CG 4.35Å; E195-R199 VanDerWaalsContact CD-NH1 3.31Å; E195-R199 VanDerWaalsContact CG-NH1 3.27Å; E195-R199 PolarHBondContact O-N 2.82Å; E195-R199 IonicContact OE1-CZ 3.52Å; E195-R199 IonicContact OE1-NH1 3.91Å; E195-R199 PolarHBondContact OE1-NH1 2.91Å; E195-R199 IonicContact OE1-NH2 3.14Å; N196-R199 PolarHBondContact O-N 3.06Å; N196-R199 VanDerWaalsContact O-N 3.17Å; Q197-R199 PolarHBondContact O-N 3.34Å; R199-K201 VanDerWaalsContact C-N 3.34Å |
| 200 | L | 97.1 | Very high | 96.2 | Very high | 8 Ų | 8 | 48.9 Ų | 48.9 | 4% | 0.042 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -76.4 | -17.4 | -177.6 | -72 | 175 | 0 | 0 | 0 | 114 | L165 L187 N196 Q197 V202 Y203 M231 | L165-L200 HydrophobicContact CB-CD2 4.15Å; L165-L200 HydrophobicContact CD1-CG 4.5Å; L165-L200 HydrophobicContact CD2-CD1 4.18Å; L165-L200 HydrophobicContact CD2-CD2 4.03Å; L165-L200 HydrophobicContact CD2-CG 4.14Å; L187-L200 HydrophobicContact CD2-CD2 3.76Å; N196-L200 WeakPolarHBondContact O-CB 3.41Å; N196-L200 VanDerWaalsContact O-CG 3.29Å; N196-L200 WeakPolarHBondContact O-CG 3.08Å; N196-L200 PolarHBondContact O-N 3.28Å; Q197-L200 CarbonylContact O-C 3.58Å; Q197-L200 PolarHBondContact O-N 3.16Å; L200-V202 PolarHBondContact O-N 3.28Å; L200-Y203 HydrophobicContact CD2-CD2 4.03Å; L200-Y203 HydrophobicContact CD2-CE2 4.4Å; L200-Y203 PolarHBondContact O-N 2.88Å; L200-M231 HydrophobicContact CB-CE 3.97Å; L200-M231 HydrophobicContact CB-SD 4.12Å |
| 201 | K | 96.3 | Very high | 96.2 | Very high | 87 Ų | 87 | 49 Ų | 49 | 38% | 0.378 | 25% | 0.246 | S | C | . | . | G | 310 helix | trans | -52 | -31.9 | -178.3 | 77.9 | -175.1 | -179.6 | 173 | 0 | 113.8 | Q197 R198 R199 Y203 M204 Y237 M240 | Q197-K201 PolarHBondContact O-N 3.23Å; R198-K201 WeakPolarHBondContact O-CD 3.4Å; R198-K201 VanDerWaalsContact O-CG 3.28Å; R198-K201 WeakPolarHBondContact O-CG 3.28Å; R199-K201 VanDerWaalsContact C-N 3.34Å; K201-Y203 PolarHBondContact O-N 3.46Å; K201-M204 VanDerWaalsContact O-CB 3.22Å; K201-M204 WeakPolarHBondContact O-CB 3.47Å; K201-M204 PolarHBondContact O-N 3.35Å; K201-M204 VanDerWaalsContact O-N 3.09Å; K201-Y237 HydrophobicContact CB-CD1 3.82Å; K201-Y237 HydrophobicContact CB-CE1 3.92Å; K201-Y237 HydrophobicContact CB-CG 4.37Å; K201-Y237 HydrophobicContact CD-CD1 4.03Å; K201-Y237 HydrophobicContact CD-CE1 3.55Å; K201-Y237 HydrophobicContact CG-CE1 4.37Å; K201-M240 WeakPolarHBondContact O-CE 3.42Å |
| 202 | V | 97.1 | Very high | 96.2 | Very high | 100 Ų | 100 | 50.6 Ų | 50.6 | 61% | 0.606 | 26% | 0.255 | S | S | * | . | G | 310 helix | trans | -64.6 | -22.9 | 179.5 | -57.1 | 0 | 0 | 0 | 0 | 113.1 | L200 | L200-V202 PolarHBondContact O-N 3.28Š|
| 203 | Y | 97.6 | Very high | 96.4 | Very high | 60 Ų | 60 | 52.3 Ų | 52.3 | 24% | 0.235 | 27% | 0.265 | C | S | . | . | G | 310 helix | trans | -95.2 | -3.8 | 177.8 | -53 | -70.4 | 0 | 0 | 0 | 112.8 | A169 L200 K201 N205 Q206 V207 | A169-Y203 HydrophobicContact CB-CD1 3.79Å; A169-Y203 HydrophobicContact CB-CD2 3.73Å; A169-Y203 HydrophobicContact CB-CE1 3.62Å; A169-Y203 HydrophobicContact CB-CE2 3.57Å; A169-Y203 HydrophobicContact CB-CG 3.84Å; L200-Y203 HydrophobicContact CD2-CD2 4.03Å; L200-Y203 HydrophobicContact CD2-CE2 4.4Å; L200-Y203 PolarHBondContact O-N 2.88Å; K201-Y203 PolarHBondContact O-N 3.46Å; Y203-N205 PolarHBondContact O-N 3.41Å; Y203-Q206 PolarHBondContact O-N 3.3Å; Y203-V207 WeakPolarHBondContact O-CG2 3.26Å; Y203-V207 PolarHBondContact O-N 3.03Å |
| 204 | M | 96.5 | Very high | 96.6 | Very high | 4 Ų | 4 | 51.8 Ų | 51.8 | 2% | 0.02 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.3 | -42.5 | -170.9 | -169.7 | 176 | -172.3 | 0 | 0 | 112.7 | K201 V207 C208 L228 M231 T232 M240 L241 | K201-M204 VanDerWaalsContact O-CB 3.22Å; K201-M204 WeakPolarHBondContact O-CB 3.47Å; K201-M204 PolarHBondContact O-N 3.35Å; K201-M204 VanDerWaalsContact O-N 3.09Å; M204-V207 PolarHBondContact O-N 3.24Å; M204-C208 WeakPolarHBondContact O-CB 3.4Å; M204-C208 PolarHBondContact O-N 2.9Å; M204-L228 HydrophobicContact CG-CD2 4.11Å; M204-M231 HydrophobicContact CE-CB 4.13Å; M204-T232 HydrophobicContact CE-CG2 3.8Å; M204-M240 HydrophobicContact CB-CE 4.17Å; M204-M240 HydrophobicContact CB-SD 4.46Å; M204-M240 HydrophobicContact SD-CB 4.03Å; M204-M240 HydrophobicContact SD-CG 4.48Å; M204-M240 HydrophobicContact SD-SD 4.01Å; M204-L241 HydrophobicContact CE-CD1 3.67Å; M204-L241 HydrophobicContact CE-CD2 3.92Å; M204-L241 HydrophobicContact CE-CG 3.55Å; M204-L241 HydrophobicContact CG-CD2 4.29Å |
| 205 | N | 96.9 | Very high | 96.8 | Very high | 77 Ų | 77 | 59 Ų | 59 | 41% | 0.412 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.6 | -45.8 | 177.1 | -67.8 | -11.8 | 0 | 0 | 0 | 111.3 | Y203 V207 C208 D209 | Y203-N205 PolarHBondContact O-N 3.41Å; N205-V207 VanDerWaalsContact C-N 3.35Å; N205-V207 PolarHBondContact O-N 3.37Å; N205-C208 WeakPolarHBondContact O-CB 3.49Å; N205-C208 PolarHBondContact O-N 3.33Å; N205-C208 VanDerWaalsContact O-N 3.11Å; N205-D209 PolarHBondContact O-N 3.42Å |
| 206 | Q | 97.3 | Very high | 97 | Very high | 56 Ų | 56 | 59.8 Ų | 59.8 | 26% | 0.262 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -58 | -47.1 | 175.1 | 178.4 | -179.2 | 9.4 | 0 | 0 | 111.5 | N173 Y203 C208 D209 D210 | N173-Q206 PolarHBondContact OD1-NE2 2.95Å; Y203-Q206 PolarHBondContact O-N 3.3Å; Q206-C208 VanDerWaalsContact C-N 3.27Å; Q206-C208 PolarHBondContact O-N 2.94Å; Q206-D209 PolarHBondContact O-N 3.17Å; Q206-D210 WeakPolarHBondContact O-CB 3.49Å; Q206-D210 PolarHBondContact O-N 3.02Å |
| 207 | V | 98.2 | Very high | 97.1 | Very high | 4 Ų | 4 | 62.4 Ų | 62.4 | 2% | 0.024 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.2 | -39.7 | 177.5 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | L172 L184 Y203 M204 N205 T211 L227 L228 | L172-V207 HydrophobicContact CD1-CG2 3.72Å; L184-V207 HydrophobicContact CD2-CG1 4.2Å; L184-V207 HydrophobicContact CD2-CG2 4.39Å; Y203-V207 WeakPolarHBondContact O-CG2 3.26Å; Y203-V207 PolarHBondContact O-N 3.03Å; M204-V207 PolarHBondContact O-N 3.24Å; N205-V207 VanDerWaalsContact C-N 3.35Å; N205-V207 PolarHBondContact O-N 3.37Å; V207-T211 WeakPolarHBondContact O-CB 3.37Å; V207-T211 PolarHBondContact O-N 3.23Å; V207-T211 PolarHBondContact O-OG1 3.13Å; V207-L227 HydrophobicContact CG1-CD2 3.89Å; V207-L227 HydrophobicContact CG1-CG 4.3Å; V207-L227 HydrophobicContact CG2-CD2 3.94Å; V207-L228 HydrophobicContact CB-CD2 4.3Å; V207-L228 HydrophobicContact CG1-CD1 4.45Å; V207-L228 HydrophobicContact CG1-CD2 3.83Å; V207-L228 HydrophobicContact CG1-CG 3.9Å |
| 208 | C | 98.4 | Very high | 97.2 | Very high | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.007 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61.9 | -51.7 | 176.9 | -170.2 | 0 | 0 | 0 | 0 | 111.5 | M204 N205 Q206 T211 I212 L228 L241 S244 | M204-C208 WeakPolarHBondContact O-CB 3.4Å; M204-C208 PolarHBondContact O-N 2.9Å; N205-C208 WeakPolarHBondContact O-CB 3.49Å; N205-C208 PolarHBondContact O-N 3.33Å; N205-C208 VanDerWaalsContact O-N 3.11Å; Q206-C208 VanDerWaalsContact C-N 3.27Å; Q206-C208 PolarHBondContact O-N 2.94Å; C208-T211 WeakPolarHBondContact O-CB 3.39Å; C208-T211 PolarHBondContact O-N 3.28Å; C208-I212 WeakPolarHBondContact O-CG1 3.33Å; C208-I212 PolarHBondContact O-N 3.24Å; C208-I212 VanDerWaalsContact SG-CD1 3.59Å; C208-L228 HydrophobicContact CB-CD1 4.34Å; C208-L228 HydrophobicContact CB-CD2 4.32Å; C208-L241 HydrophobicContact CB-CD2 3.89Å; C208-S244 WeakPolarHBondContact SG-CB 3.16Å; C208-S244 PolarHBondContact SG-OG 3.33Å |
| 209 | D | 97.6 | Very high | 97.3 | Very high | 93 Ų | 93 | 59.3 Ų | 59.3 | 50% | 0.497 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.5 | -46.7 | 179.6 | -65.7 | -21.6 | 0 | 0 | 0 | 111.5 | N205 Q206 T211 I212 T213 | N205-D209 PolarHBondContact O-N 3.42Å; Q206-D209 PolarHBondContact O-N 3.17Å; D209-T211 VanDerWaalsContact C-N 3.27Å; D209-T211 PolarHBondContact O-N 2.85Å; D209-I212 PolarHBondContact O-N 3.22Å; D209-T213 WeakPolarHBondContact O-CB 3.4Å; D209-T213 WeakPolarHBondContact O-CG2 3.35Å; D209-T213 PolarHBondContact O-N 2.92Å; D209-T213 PolarHBondContact O-OG1 3.48Å |
| 210 | D | 97.1 | Very high | 97.3 | Very high | 36 Ų | 36 | 54.3 Ų | 54.3 | 19% | 0.193 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60 | -38.7 | 176.1 | -89.5 | 19 | 0 | 0 | 0 | 111.5 | K180 Q206 T213 S214 | K180-D210 IonicContact NZ-OD2 2.72Å; K180-D210 PolarHBondContact NZ-OD2 2.93Å; Q206-D210 WeakPolarHBondContact O-CB 3.49Å; Q206-D210 PolarHBondContact O-N 3.02Å; D210-T213 PolarHBondContact O-OG1 3.33Å; D210-S214 VanDerWaalsContact O-CB 3.29Å; D210-S214 WeakPolarHBondContact O-CB 3.47Å; D210-S214 PolarHBondContact O-N 2.93Å; D210-S214 PolarHBondContact O-OG 2.85Å |
| 211 | T | 98 | Very high | 97.4 | Very high | 2 Ų | 2 | 54 Ų | 54 | 1% | 0.012 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -69.1 | -43.2 | -179.5 | -62.6 | 0 | 0 | 0 | 0 | 111.8 | V207 C208 D209 Q221 G224 L225 L228 | V207-T211 WeakPolarHBondContact O-CB 3.37Å; V207-T211 PolarHBondContact O-N 3.23Å; V207-T211 PolarHBondContact O-OG1 3.13Å; C208-T211 WeakPolarHBondContact O-CB 3.39Å; C208-T211 PolarHBondContact O-N 3.28Å; D209-T211 VanDerWaalsContact C-N 3.27Å; D209-T211 PolarHBondContact O-N 2.85Å; T211-Q221 HydrophobicContact CG2-CG 4.22Å; T211-Q221 PolarHBondContact O-NE2 3.26Å; T211-G224 VanDerWaalsContact OG1-CA 3.31Å; T211-G224 WeakPolarHBondContact OG1-CA 3.41Å; T211-L225 HydrophobicContact CG2-CB 4.48Å; T211-L225 HydrophobicContact CG2-CD2 3.8Å; T211-L225 HydrophobicContact CG2-CG 3.63Å; T211-L228 HydrophobicContact CG2-CD1 4.37Å |
| 212 | I | 97.2 | Very high | 97.5 | Very high | 35 Ų | 35 | 50.4 Ų | 50.4 | 18% | 0.179 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -68.7 | -41.3 | -179.6 | -68.6 | 162.8 | 0 | 0 | 0 | 110.7 | C208 D209 D247 F248 L251 | C208-I212 WeakPolarHBondContact O-CG1 3.33Å; C208-I212 PolarHBondContact O-N 3.24Å; C208-I212 VanDerWaalsContact SG-CD1 3.59Å; D209-I212 PolarHBondContact O-N 3.22Å; I212-D247 HydrophobicContact CD1-CB 3.59Å; I212-D247 HydrophobicContact CG1-CB 3.92Å; I212-D247 HydrophobicContact CG2-CB 3.95Å; I212-D247 WeakPolarHBondContact CG2-OD1 3.42Å; I212-F248 HydrophobicContact CG1-CE1 4.48Å; I212-L251 HydrophobicContact CG1-CD1 4.06Å |
| 213 | T | 96.4 | Very high | 97.6 | Very high | 113 Ų | 113 | 46 Ų | 46 | 69% | 0.693 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -80.8 | -15.2 | -178.5 | 57.7 | 0 | 0 | 0 | 0 | 114 | D209 D210 | D209-T213 WeakPolarHBondContact O-CB 3.4Å; D209-T213 WeakPolarHBondContact O-CG2 3.35Å; D209-T213 PolarHBondContact O-N 2.92Å; D209-T213 PolarHBondContact O-OG1 3.48Å; D210-T213 PolarHBondContact O-OG1 3.33Å |
| 214 | S | 96.8 | Very high | 97.6 | Very high | 25 Ų | 25 | 43.1 Ų | 43.1 | 18% | 0.175 | 23% | 0.225 | C | C | . | . | S | Bend | trans | -60.9 | 152.8 | 176 | -76.8 | 0 | 0 | 0 | 0 | 112.5 | D210 L216 V220 Q221 | D210-S214 VanDerWaalsContact O-CB 3.29Å; D210-S214 WeakPolarHBondContact O-CB 3.47Å; D210-S214 PolarHBondContact O-N 2.93Å; D210-S214 PolarHBondContact O-OG 2.85Å; S214-L216 PolarHBondContact O-N 3.37Å; S214-V220 WeakPolarHBondContact OG-CG1 2.99Å; S214-Q221 PolarHBondContact O-NE2 3.04Å |
| 215 | R | 97.4 | Very high | 97.7 | Very high | 218 Ų | 218 | 42.9 Ų | 42.9 | 82% | 0.823 | 22% | 0.224 | S | C | * | . | P | Polyproline II helix | trans | -52.9 | 130.1 | 174.4 | 175.7 | -178 | -96.9 | -175.6 | -5.4 | 109.9 | N217 S218 | R215-N217 PolarHBondContact O-N 3.48Å; R215-S218 WeakPolarHBondContact O-CB 3.38Å; R215-S218 PolarHBondContact O-N 3.19Å; R215-S218 PolarHBondContact O-OG 3.42Å |
| 216 | L | 97.9 | Very high | 97.8 | Very high | 76 Ų | 76 | 44 Ų | 44 | 40% | 0.398 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -52.4 | 132.1 | 179.1 | -174.1 | 67.6 | 0 | 0 | 0 | 111.6 | S214 S218 L251 A254 | S214-L216 PolarHBondContact O-N 3.37Å; L216-S218 PolarHBondContact O-N 3.41Å; L216-L251 HydrophobicContact CD1-CD2 4.15Å; L216-A254 HydrophobicContact CD1-CB 4.24Å; L216-A254 HydrophobicContact CD2-CB 4.04Å |
| 217 | N | 97.4 | Very high | 97.9 | Very high | 55 Ų | 55 | 41.7 Ų | 41.7 | 29% | 0.294 | 21% | 0.212 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 63.3 | 14.3 | -178 | -50.7 | -49.4 | 0 | 0 | 0 | 115.1 | R215 G255 N256 T259 | R215-N217 PolarHBondContact O-N 3.48Å; N217-G255 WeakPolarHBondContact OD1-CA 3.38Å; N217-N256 PolarHBondContact OD1-N 3.1Å; N217-N256 PolarHBondContact OD1-OD1 3.4Å; N217-T259 PolarHBondContact OD1-OG1 2.91Å |
| 218 | S | 97.9 | Very high | 97.9 | Very high | 25 Ų | 25 | 41.6 Ų | 41.6 | 18% | 0.175 | 21% | 0.211 | C | C | . | . | trans | -71 | 156.3 | 174.9 | 64.3 | 0 | 0 | 0 | 0 | 112 | R215 L216 V220 Q221 L222 | R215-S218 WeakPolarHBondContact O-CB 3.38Å; R215-S218 PolarHBondContact O-N 3.19Å; R215-S218 PolarHBondContact O-OG 3.42Å; L216-S218 PolarHBondContact O-N 3.41Å; S218-V220 PolarHBondContact O-N 3.07Å; S218-Q221 PolarHBondContact O-N 3.41Å; S218-Q221 WeakPolarHBondContact OG-CB 3.07Å; S218-Q221 PolarHBondContact OG-N 3.48Å; S218-L222 PolarHBondContact O-N 2.72Å | ||
| 219 | S | 97.4 | Very high | 97.9 | Very high | 57 Ų | 57 | 42.1 Ų | 42.1 | 40% | 0.399 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -60.8 | -34.9 | 174.5 | 56.1 | 0 | 0 | 0 | 0 | 112.4 | E181 L222 A223 | E181-S219 VanDerWaalsContact CD-CB 3.47Å; E181-S219 WeakPolarHBondContact OE2-CB 3.45Å; E181-S219 PolarHBondContact OE2-OG 2.63Å; S219-L222 PolarHBondContact O-N 3.22Å; S219-A223 VanDerWaalsContact O-CB 3.29Å; S219-A223 WeakPolarHBondContact O-CB 3.12Å; S219-A223 PolarHBondContact O-N 3.05Å |
| 220 | V | 98.1 | Very high | 97.8 | Very high | 8 Ų | 8 | 39.6 Ų | 39.6 | 5% | 0.048 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60 | -49.3 | 172.6 | 177.3 | 0 | 0 | 0 | 0 | 111 | P177 K180 E181 L184 S214 S218 L222 A223 G224 | P177-V220 HydrophobicContact CB-CG2 3.87Å; P177-V220 WeakPolarHBondContact O-CG2 3.46Å; K180-V220 HydrophobicContact CD-CG1 3.74Å; K180-V220 HydrophobicContact CG-CG1 4.04Å; E181-V220 HydrophobicContact CB-CG2 4.06Å; L184-V220 HydrophobicContact CD1-CG1 3.89Å; S214-V220 WeakPolarHBondContact OG-CG1 2.99Å; S218-V220 PolarHBondContact O-N 3.07Å; V220-L222 VanDerWaalsContact C-N 3.35Å; V220-L222 PolarHBondContact O-N 2.7Å; V220-A223 PolarHBondContact O-N 3.18Å; V220-G224 PolarHBondContact O-N 3.44Å |
| 221 | Q | 98.4 | Very high | 97.8 | Very high | 2 Ų | 2 | 38.1 Ų | 38.1 | 1% | 0.009 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60.5 | -44.3 | 178.2 | 179.8 | 170.2 | 81.5 | 0 | 0 | 111.4 | T211 S214 S218 G224 L225 | T211-Q221 HydrophobicContact CG2-CG 4.22Å; T211-Q221 PolarHBondContact O-NE2 3.26Å; S214-Q221 PolarHBondContact O-NE2 3.04Å; S218-Q221 PolarHBondContact O-N 3.41Å; S218-Q221 WeakPolarHBondContact OG-CB 3.07Å; S218-Q221 PolarHBondContact OG-N 3.48Å; Q221-G224 PolarHBondContact O-N 2.93Å; Q221-L225 HydrophobicContact CG-CD1 4.22Å; Q221-L225 WeakPolarHBondContact O-CB 3.39Å; Q221-L225 VanDerWaalsContact O-CG 3.3Å; Q221-L225 WeakPolarHBondContact O-CG 3.24Å; Q221-L225 PolarHBondContact O-N 3.03Å |
| 222 | L | 98.4 | Very high | 97.6 | Very high | 12 Ų | 12 | 38 Ų | 38 | 6% | 0.063 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.2 | -41.2 | 177.2 | -73.2 | 171.4 | 0 | 0 | 0 | 112.7 | S218 S219 V220 L225 R226 E258 | S218-L222 PolarHBondContact O-N 2.72Å; S219-L222 PolarHBondContact O-N 3.22Å; V220-L222 VanDerWaalsContact C-N 3.35Å; V220-L222 PolarHBondContact O-N 2.7Å; L222-L225 PolarHBondContact O-N 3.24Å; L222-R226 VanDerWaalsContact O-CG 3.27Å; L222-R226 WeakPolarHBondContact O-CG 3.43Å; L222-R226 PolarHBondContact O-N 3.26Å; L222-E258 VanDerWaalsContact CD1-CD 3.45Å; L222-E258 HydrophobicContact CD1-CG 4.04Å; L222-E258 WeakPolarHBondContact CD1-OE2 3.33Å; L222-E258 HydrophobicContact CD2-CG 3.94Å |
| 223 | A | 98.4 | Very high | 97.4 | Very high | 6 Ų | 6 | 40.9 Ų | 40.9 | 5% | 0.05 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64.6 | -41.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | E181 L184 I185 S219 V220 R226 L227 | E181-A223 HydrophobicContact CG-CB 4.27Å; L184-A223 HydrophobicContact CB-CB 3.69Å; L184-A223 HydrophobicContact CD1-CB 4.13Å; I185-A223 HydrophobicContact CG1-CB 4.25Å; S219-A223 VanDerWaalsContact O-CB 3.29Å; S219-A223 WeakPolarHBondContact O-CB 3.12Å; S219-A223 PolarHBondContact O-N 3.05Å; V220-A223 PolarHBondContact O-N 3.18Å; A223-R226 PolarHBondContact O-N 3.02Å; A223-L227 PolarHBondContact O-N 3.41Å |
| 224 | G | 98.7 | Very high | 97 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.2 | -47.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | T211 V220 Q221 R226 L227 L228 | T211-G224 VanDerWaalsContact OG1-CA 3.31Å; T211-G224 WeakPolarHBondContact OG1-CA 3.41Å; V220-G224 PolarHBondContact O-N 3.44Å; Q221-G224 PolarHBondContact O-N 2.93Å; G224-R226 VanDerWaalsContact C-N 3.29Å; G224-R226 PolarHBondContact O-N 3.32Å; G224-L227 PolarHBondContact O-N 3.16Å; G224-L228 WeakPolarHBondContact O-CG 3.46Å; G224-L228 PolarHBondContact O-N 3.24Å |
| 225 | L | 98.7 | Very high | 96.8 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -59.1 | -38.8 | 175.1 | -72.7 | 171.7 | 0 | 0 | 0 | 112.5 | T211 Q221 L222 L228 T229 F248 T259 Q262 V263 | T211-L225 HydrophobicContact CG2-CB 4.48Å; T211-L225 HydrophobicContact CG2-CD2 3.8Å; T211-L225 HydrophobicContact CG2-CG 3.63Å; Q221-L225 HydrophobicContact CG-CD1 4.22Å; Q221-L225 WeakPolarHBondContact O-CB 3.39Å; Q221-L225 VanDerWaalsContact O-CG 3.3Å; Q221-L225 WeakPolarHBondContact O-CG 3.24Å; Q221-L225 PolarHBondContact O-N 3.03Å; L222-L225 PolarHBondContact O-N 3.24Å; L225-L228 PolarHBondContact O-N 3.28Å; L225-T229 WeakPolarHBondContact O-CB 3.23Å; L225-T229 PolarHBondContact O-N 3.35Å; L225-T229 PolarHBondContact O-OG1 2.86Å; L225-F248 HydrophobicContact CD2-CD1 4.28Å; L225-F248 HydrophobicContact CD2-CE1 4.19Å; L225-T259 HydrophobicContact CD1-CG2 3.97Å; L225-Q262 HydrophobicContact CB-CB 4.48Å; L225-Q262 HydrophobicContact CB-CG 3.6Å; L225-Q262 HydrophobicContact CD1-CB 4.47Å; L225-Q262 HydrophobicContact CD1-CG 4.43Å; L225-V263 HydrophobicContact CD1-CG2 3.81Å; L225-V263 HydrophobicContact CD2-CG2 4.04Å |
| 226 | R | 98.6 | Very high | 96.5 | Very high | 101 Ų | 101 | 36 Ų | 36 | 38% | 0.381 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -63 | -47.1 | 175.7 | -74.8 | 170.8 | -175.4 | 173.7 | 6.3 | 111.7 | N188 L222 A223 G224 L228 T229 N230 E258 Q262 | N188-R226 PolarHBondContact OD1-O 3.05Å; N188-R226 VanDerWaalsContact OD1-O 3.12Å; L222-R226 VanDerWaalsContact O-CG 3.27Å; L222-R226 WeakPolarHBondContact O-CG 3.43Å; L222-R226 PolarHBondContact O-N 3.26Å; A223-R226 PolarHBondContact O-N 3.02Å; G224-R226 VanDerWaalsContact C-N 3.29Å; G224-R226 PolarHBondContact O-N 3.32Å; R226-L228 PolarHBondContact O-N 2.89Å; R226-T229 WeakPolarHBondContact O-CB 3.36Å; R226-T229 PolarHBondContact O-N 2.93Å; R226-N230 PolarHBondContact O-N 3.44Å; R226-E258 IonicContact NH2-OE1 2.77Å; R226-E258 PolarHBondContact NH2-OE1 3.24Å; R226-Q262 HydrophobicContact CG-CG 4.18Å |
| 227 | L | 98.5 | Very high | 96.2 | Very high | 7 Ų | 7 | 33 Ų | 33 | 4% | 0.037 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -58.8 | -48.3 | 175.5 | 172.9 | 55.7 | 0 | 0 | 0 | 111.3 | L184 L187 N188 V207 A223 G224 T229 N230 M231 | L184-L227 HydrophobicContact CD2-CD2 3.99Å; L187-L227 HydrophobicContact CB-CD1 4.23Å; L187-L227 HydrophobicContact CB-CD2 3.77Å; L187-L227 HydrophobicContact CD1-CD2 4.2Å; N188-L227 HydrophobicContact CB-CB 4.15Å; N188-L227 HydrophobicContact CB-CD1 4.46Å; N188-L227 WeakPolarHBondContact OD1-CA 3.27Å; N188-L227 PolarHBondContact OD1-N 3.41Å; V207-L227 HydrophobicContact CG1-CD2 3.89Å; V207-L227 HydrophobicContact CG1-CG 4.3Å; V207-L227 HydrophobicContact CG2-CD2 3.94Å; A223-L227 PolarHBondContact O-N 3.41Å; G224-L227 PolarHBondContact O-N 3.16Å; L227-T229 VanDerWaalsContact C-N 3.29Å; L227-T229 PolarHBondContact O-N 3.28Å; L227-N230 PolarHBondContact O-N 3.03Å; L227-M231 HydrophobicContact CD1-CG 3.89Å; L227-M231 HydrophobicContact CD1-SD 4.48Å; L227-M231 HydrophobicContact CG-CG 4.42Å; L227-M231 VanDerWaalsContact O-CG 3.26Å; L227-M231 WeakPolarHBondContact O-CG 3.47Å; L227-M231 PolarHBondContact O-N 3.17Å |
| 228 | L | 98.5 | Very high | 96.1 | Very high | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.005 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61 | -38.4 | 177.4 | -65.9 | 171.5 | 0 | 0 | 0 | 112.1 | M204 V207 C208 T211 G224 L225 R226 M231 T232 L241 F248 L266 | M204-L228 HydrophobicContact CG-CD2 4.11Å; V207-L228 HydrophobicContact CB-CD2 4.3Å; V207-L228 HydrophobicContact CG1-CD1 4.45Å; V207-L228 HydrophobicContact CG1-CD2 3.83Å; V207-L228 HydrophobicContact CG1-CG 3.9Å; C208-L228 HydrophobicContact CB-CD1 4.34Å; C208-L228 HydrophobicContact CB-CD2 4.32Å; T211-L228 HydrophobicContact CG2-CD1 4.37Å; G224-L228 WeakPolarHBondContact O-CG 3.46Å; G224-L228 PolarHBondContact O-N 3.24Å; L225-L228 PolarHBondContact O-N 3.28Å; R226-L228 PolarHBondContact O-N 2.89Å; L228-M231 PolarHBondContact O-N 2.92Å; L228-T232 WeakPolarHBondContact O-CB 3.29Å; L228-T232 VanDerWaalsContact O-CG2 3.28Å; L228-T232 WeakPolarHBondContact O-CG2 3.45Å; L228-T232 PolarHBondContact O-N 2.97Å; L228-T232 PolarHBondContact O-OG1 3.14Å; L228-L241 HydrophobicContact CD2-CD2 4.19Å; L228-F248 HydrophobicContact CD1-CE1 4.34Å; L228-F248 HydrophobicContact CD1-CZ 4.28Å; L228-L266 VanDerWaalsContact C-CD1 3.46Å; L228-L266 HydrophobicContact CB-CD1 3.65Å |
| 229 | T | 97.8 | Very high | 95.9 | Very high | 12 Ų | 12 | 35 Ų | 35 | 7% | 0.074 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.8 | -44.5 | 175 | -57.5 | 0 | 0 | 0 | 0 | 111.1 | L225 R226 L227 M231 T232 V233 Q262 K265 N269 | L225-T229 WeakPolarHBondContact O-CB 3.23Å; L225-T229 PolarHBondContact O-N 3.35Å; L225-T229 PolarHBondContact O-OG1 2.86Å; R226-T229 WeakPolarHBondContact O-CB 3.36Å; R226-T229 PolarHBondContact O-N 2.93Å; L227-T229 VanDerWaalsContact C-N 3.29Å; L227-T229 PolarHBondContact O-N 3.28Å; T229-M231 PolarHBondContact O-N 3.09Å; T229-T232 WeakPolarHBondContact CA-OG1 3.29Å; T229-T232 PolarHBondContact O-N 2.95Å; T229-T232 PolarHBondContact O-OG1 2.92Å; T229-V233 PolarHBondContact O-N 2.87Å; T229-Q262 PolarHBondContact OG1-NE2 2.99Å; T229-K265 HydrophobicContact CG2-CB 3.86Å; T229-N269 PolarHBondContact O-ND2 3.23Å |
| 230 | N | 96.3 | Very high | 95.8 | Very high | 41 Ų | 41 | 34.4 Ų | 34.4 | 22% | 0.219 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 176.1 | -82.3 | 4.7 | 0 | 0 | 0 | 112 | N188 S191 Q197 R226 L227 T232 V233 | N188-N230 PolarHBondContact O-ND2 2.9Å; N188-N230 VanDerWaalsContact O-ND2 3.09Å; N188-N230 PolarHBondContact OD1-ND2 2.97Å; S191-N230 WeakPolarHBondContact OG-CB 3.34Å; Q197-N230 PolarHBondContact NE2-O 2.8Å; R226-N230 PolarHBondContact O-N 3.44Å; L227-N230 PolarHBondContact O-N 3.03Å; N230-T232 PolarHBondContact O-N 3.35Å; N230-V233 PolarHBondContact O-N 3.22Å |
| 231 | M | 96.3 | Very high | 95.8 | Very high | 5 Ų | 5 | 34 Ų | 34 | 3% | 0.025 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -67.3 | -16.7 | 178.3 | -68 | -67.8 | -64.8 | 0 | 0 | 113.5 | Q197 L200 M204 L227 L228 T229 Y237 | Q197-M231 HydrophobicContact CB-CE 4.22Å; Q197-M231 HydrophobicContact CB-SD 3.99Å; Q197-M231 HydrophobicContact CG-SD 3.88Å; Q197-M231 WeakPolarHBondContact O-CE 3.46Å; L200-M231 HydrophobicContact CB-CE 3.97Å; L200-M231 HydrophobicContact CB-SD 4.12Å; M204-M231 HydrophobicContact CE-CB 4.13Å; L227-M231 HydrophobicContact CD1-CG 3.89Å; L227-M231 HydrophobicContact CD1-SD 4.48Å; L227-M231 HydrophobicContact CG-CG 4.42Å; L227-M231 VanDerWaalsContact O-CG 3.26Å; L227-M231 WeakPolarHBondContact O-CG 3.47Å; L227-M231 PolarHBondContact O-N 3.17Å; L228-M231 PolarHBondContact O-N 2.92Å; T229-M231 PolarHBondContact O-N 3.09Å; M231-Y237 HydrophobicContact CE-CD2 4.44Å |
| 232 | T | 95.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 18% | 0.177 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -103.4 | 2.7 | 179.9 | 50 | 0 | 0 | 0 | 0 | 113.6 | M204 L228 T229 N230 T234 Q238 L241 L266 N269 L270 | M204-T232 HydrophobicContact CE-CG2 3.8Å; L228-T232 WeakPolarHBondContact O-CB 3.29Å; L228-T232 VanDerWaalsContact O-CG2 3.28Å; L228-T232 WeakPolarHBondContact O-CG2 3.45Å; L228-T232 PolarHBondContact O-N 2.97Å; L228-T232 PolarHBondContact O-OG1 3.14Å; T229-T232 WeakPolarHBondContact CA-OG1 3.29Å; T229-T232 PolarHBondContact O-N 2.95Å; T229-T232 PolarHBondContact O-OG1 2.92Å; N230-T232 PolarHBondContact O-N 3.35Å; T232-T234 PolarHBondContact O-N 3.47Å; T232-Q238 HydrophobicContact CG2-CG 4.18Å; T232-Q238 PolarHBondContact O-NE2 3.4Å; T232-L241 HydrophobicContact CG2-CD1 3.56Å; T232-L266 HydrophobicContact CG2-CD1 4.11Å; T232-N269 WeakPolarHBondContact O-CB 3.23Å; T232-N269 PolarHBondContact OG1-ND2 3.49Å; T232-L270 HydrophobicContact CG2-CD2 4.17Å |
| 233 | V | 92.3 | Very high | 95.5 | Very high | 95 Ų | 95 | 41.2 Ų | 41.2 | 58% | 0.576 | 21% | 0.212 | S | C | * | . | S | Bend | trans | -60.2 | -30 | 171.6 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | T229 N230 | T229-V233 PolarHBondContact O-N 2.87Å; N230-V233 PolarHBondContact O-N 3.22Å |
| 234 | T | 88.8 | Confident | 95.4 | Very high | 44 Ų | 44 | 41.6 Ų | 41.6 | 27% | 0.27 | 21% | 0.214 | S | C | . | . | S | Bend | trans | -99.9 | 146.8 | 172.8 | 63.2 | 0 | 0 | 0 | 0 | 110.4 | Q197 T232 E236 Q238 | Q197-T234 PolarHBondContact OE1-OG1 2.92Å; T232-T234 PolarHBondContact O-N 3.47Å; T234-E236 PolarHBondContact O-N 2.94Å; T234-Q238 WeakPolarHBondContact O-CG 3.26Å |
| 235 | N | 92.3 | Very high | 95.4 | Very high | 90 Ų | 90 | 41.6 Ų | 41.6 | 48% | 0.481 | 21% | 0.214 | S | C | . | . | G | 310 helix | trans | -71.7 | -17.5 | -178.8 | -67 | -6.1 | 0 | 0 | 0 | 113.3 | Y237 Q238 | N235-Y237 VanDerWaalsContact C-N 3.28Å; N235-Y237 PolarHBondContact O-N 3.21Å; N235-Q238 PolarHBondContact OD1-NE2 3.33Å |
| 236 | E | 90.2 | Very high | 95.3 | Very high | 119 Ų | 119 | 42.8 Ų | 42.8 | 56% | 0.556 | 22% | 0.222 | S | C | * | . | G | 310 helix | trans | -57.8 | -36.3 | -171.8 | -65 | -175.4 | 179.8 | 0 | 0 | 113.5 | T234 H239 | T234-E236 PolarHBondContact O-N 2.94Å; E236-H239 PolarHBondContact O-CE1 3.43Å; E236-H239 PolarHBondContact O-ND1 3.45Å; E236-H239 VanDerWaalsContact O-ND1 3.14Å |
| 237 | Y | 91.8 | Very high | 95.3 | Very high | 12 Ų | 12 | 39.5 Ų | 39.5 | 5% | 0.047 | 21% | 0.212 | C | C | . | . | G | 310 helix | trans | -110.4 | -5.6 | -170.1 | -47.9 | -54.7 | 0 | 0 | 0 | 113.9 | Q197 R198 K201 M231 N235 H239 M240 | Q197-Y237 HydrophobicContact CB-CE2 3.86Å; R198-Y237 WeakPolarHBondContact CA-OH 3.3Å; K201-Y237 HydrophobicContact CB-CD1 3.82Å; K201-Y237 HydrophobicContact CB-CE1 3.92Å; K201-Y237 HydrophobicContact CB-CG 4.37Å; K201-Y237 HydrophobicContact CD-CD1 4.03Å; K201-Y237 HydrophobicContact CD-CE1 3.55Å; K201-Y237 HydrophobicContact CG-CE1 4.37Å; M231-Y237 HydrophobicContact CE-CD2 4.44Å; N235-Y237 VanDerWaalsContact C-N 3.28Å; N235-Y237 PolarHBondContact O-N 3.21Å; Y237-H239 VanDerWaalsContact C-N 3.29Å; Y237-H239 PolarHBondContact O-N 3.07Å; Y237-M240 WeakPolarHBondContact O-CB 3.47Å; Y237-M240 PolarHBondContact O-N 2.96Å; Y237-M240 VanDerWaalsContact O-N 3.12Å |
| 238 | Q | 95.2 | Very high | 95.3 | Very high | 1 Ų | 1 | 39.1 Ų | 39.1 | 1% | 0.005 | 21% | 0.21 | C | C | . | . | G | 310 helix | trans | -60.7 | -35.4 | -173.9 | -68.6 | -177.1 | -8.3 | 0 | 0 | 113.5 | T232 T234 N235 M240 L241 N269 L270 N273 M276 | T232-Q238 HydrophobicContact CG2-CG 4.18Å; T232-Q238 PolarHBondContact O-NE2 3.4Å; T234-Q238 WeakPolarHBondContact O-CG 3.26Å; N235-Q238 PolarHBondContact OD1-NE2 3.33Å; Q238-M240 PolarHBondContact O-N 3.44Å; Q238-M240 VanDerWaalsContact O-N 3.15Å; Q238-L241 PolarHBondContact O-N 3.2Å; Q238-N269 PolarHBondContact NE2-O 3.4Å; Q238-L270 HydrophobicContact CB-CD2 3.66Å; Q238-L270 HydrophobicContact CG-CD2 3.72Å; Q238-N273 PolarHBondContact OE1-ND2 3.04Å; Q238-M276 HydrophobicContact CB-CG 4.07Å; Q238-M276 HydrophobicContact CB-SD 3.94Å |
| 239 | H | 94.6 | Very high | 95.3 | Very high | 121 Ų | 121 | 39.1 Ų | 39.1 | 56% | 0.56 | 21% | 0.21 | S | C | * | . | G | 310 helix | trans | -59.7 | -25.4 | 178.6 | 68.9 | -84.8 | 0 | 0 | 0 | 113.3 | E236 Y237 L241 A242 | E236-H239 PolarHBondContact O-CE1 3.43Å; E236-H239 PolarHBondContact O-ND1 3.45Å; E236-H239 VanDerWaalsContact O-ND1 3.14Å; Y237-H239 VanDerWaalsContact C-N 3.29Å; Y237-H239 PolarHBondContact O-N 3.07Å; H239-L241 PolarHBondContact O-N 3.38Å; H239-A242 WeakPolarHBondContact O-CB 3.4Å; H239-A242 PolarHBondContact O-N 3Å |
| 240 | M | 95.8 | Very high | 95.2 | Very high | 46 Ų | 46 | 44.4 Ų | 44.4 | 23% | 0.227 | 23% | 0.229 | C | C | . | . | G | 310 helix | trans | -65.5 | -22 | 177 | -59.7 | -175.4 | 65.4 | 0 | 0 | 112.2 | K201 M204 Y237 Q238 | K201-M240 WeakPolarHBondContact O-CE 3.42Å; M204-M240 HydrophobicContact CB-CE 4.17Å; M204-M240 HydrophobicContact CB-SD 4.46Å; M204-M240 HydrophobicContact SD-CB 4.03Å; M204-M240 HydrophobicContact SD-CG 4.48Å; M204-M240 HydrophobicContact SD-SD 4.01Å; Y237-M240 WeakPolarHBondContact O-CB 3.47Å; Y237-M240 PolarHBondContact O-N 2.96Å; Y237-M240 VanDerWaalsContact O-N 3.12Å; Q238-M240 PolarHBondContact O-N 3.44Å; Q238-M240 VanDerWaalsContact O-N 3.15Å |
| 241 | L | 96.7 | Very high | 95.3 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 22% | 0.222 | C | C | . | . | G | 310 helix | trans | -94.8 | 0.3 | 178.8 | -60.2 | -172.5 | 0 | 0 | 0 | 114 | M204 C208 L228 T232 Q238 H239 N243 S244 I245 F248 L266 | M204-L241 HydrophobicContact CE-CD1 3.67Å; M204-L241 HydrophobicContact CE-CD2 3.92Å; M204-L241 HydrophobicContact CE-CG 3.55Å; M204-L241 HydrophobicContact CG-CD2 4.29Å; C208-L241 HydrophobicContact CB-CD2 3.89Å; L228-L241 HydrophobicContact CD2-CD2 4.19Å; T232-L241 HydrophobicContact CG2-CD1 3.56Å; Q238-L241 PolarHBondContact O-N 3.2Å; H239-L241 PolarHBondContact O-N 3.38Å; L241-N243 VanDerWaalsContact C-N 3.29Å; L241-N243 PolarHBondContact O-N 3.04Å; L241-S244 PolarHBondContact O-N 3.04Å; L241-I245 PolarHBondContact O-N 3.41Å; L241-F248 HydrophobicContact CB-CE2 4.23Å; L241-F248 HydrophobicContact CD1-CE2 4.23Å; L241-F248 HydrophobicContact CD1-CZ 4.36Å; L241-L266 HydrophobicContact CD1-CD1 4.06Å |
| 242 | A | 94.9 | Very high | 95.3 | Very high | 18 Ų | 18 | 42.9 Ų | 42.9 | 15% | 0.149 | 22% | 0.221 | C | C | . | . | G | 310 helix | trans | -55.1 | -43.7 | -173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | H239 S244 I245 M276 E279 | H239-A242 WeakPolarHBondContact O-CB 3.4Å; H239-A242 PolarHBondContact O-N 3Å; A242-S244 PolarHBondContact O-N 3.21Å; A242-I245 WeakPolarHBondContact O-CG1 3.4Å; A242-I245 PolarHBondContact O-N 3.43Å; A242-M276 HydrophobicContact CB-CE 4.24Å; A242-E279 HydrophobicContact CB-CB 4.29Å; A242-E279 HydrophobicContact CB-CG 4.13Å |
| 243 | N | 95.3 | Very high | 95.2 | Very high | 147 Ų | 147 | 44.1 Ų | 44.1 | 79% | 0.786 | 23% | 0.229 | S | C | * | . | G | 310 helix | trans | -68 | -18.8 | 179.9 | -64.3 | -27.4 | 0 | 0 | 0 | 113.5 | L241 | L241-N243 VanDerWaalsContact C-N 3.29Å; L241-N243 PolarHBondContact O-N 3.04Å |
| 244 | S | 97.6 | Very high | 95.3 | Very high | 14 Ų | 14 | 42.5 Ų | 42.5 | 10% | 0.098 | 23% | 0.226 | C | C | . | . | G | 310 helix | trans | -99.9 | -1.5 | -175.8 | -55.2 | 0 | 0 | 0 | 0 | 113.3 | C208 L241 A242 S246 D247 F248 | C208-S244 WeakPolarHBondContact SG-CB 3.16Å; C208-S244 PolarHBondContact SG-OG 3.33Å; L241-S244 PolarHBondContact O-N 3.04Å; A242-S244 PolarHBondContact O-N 3.21Å; S244-S246 VanDerWaalsContact C-N 3.26Å; S244-S246 PolarHBondContact O-N 3.17Å; S244-D247 WeakPolarHBondContact O-CA 3.22Å; S244-D247 WeakPolarHBondContact O-CB 3.4Å; S244-D247 PolarHBondContact O-N 2.97Å; S244-F248 WeakPolarHBondContact O-CD2 3.34Å; S244-F248 PolarHBondContact O-N 3.17Å |
| 245 | I | 97.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.2 | -41.1 | -178.7 | -62.6 | 174.4 | 0 | 0 | 0 | 111.1 | L241 A242 D247 F248 F249 L267 L270 M276 E279 L280 A283 | L241-I245 PolarHBondContact O-N 3.41Å; A242-I245 WeakPolarHBondContact O-CG1 3.4Å; A242-I245 PolarHBondContact O-N 3.43Å; I245-D247 VanDerWaalsContact C-N 3.3Å; I245-D247 PolarHBondContact O-N 2.78Å; I245-F248 PolarHBondContact O-N 3.49Å; I245-F249 HydrophobicContact CG2-CD2 3.96Å; I245-F249 HydrophobicContact CG2-CE2 3.74Å; I245-F249 WeakPolarHBondContact O-CD2 3.4Å; I245-F249 PolarHBondContact O-N 3.47Å; I245-L267 HydrophobicContact CG2-CD2 4.35Å; I245-L270 HydrophobicContact CD1-CD1 4.43Å; I245-L270 HydrophobicContact CG1-CD1 4.16Å; I245-M276 HydrophobicContact CD1-CE 4.06Å; I245-E279 HydrophobicContact CD1-CB 3.91Å; I245-L280 HydrophobicContact CD1-CD2 4.19Å; I245-L280 HydrophobicContact CD1-CG 4.23Å; I245-L280 HydrophobicContact CG2-CD2 3.78Å; I245-A283 HydrophobicContact CB-CB 3.89Å; I245-A283 HydrophobicContact CG2-CB 3.35Å |
| 246 | S | 97.8 | Very high | 95.7 | Very high | 25 Ų | 25 | 39.7 Ų | 39.7 | 18% | 0.175 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.1 | -37.3 | 176 | -54.7 | 0 | 0 | 0 | 0 | 112.2 | S244 F249 R250 Q284 | S244-S246 VanDerWaalsContact C-N 3.26Å; S244-S246 PolarHBondContact O-N 3.17Å; S246-F249 PolarHBondContact O-N 2.92Å; S246-R250 PolarHBondContact O-N 3.27Å; S246-Q284 PolarHBondContact OG-N 3.12Å |
| 247 | D | 98.1 | Very high | 95.9 | Very high | 31 Ų | 31 | 38.9 Ų | 38.9 | 17% | 0.166 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.9 | -40 | 174.3 | -65 | -86.3 | 0 | 0 | 0 | 111.9 | I212 S244 I245 R250 L251 | I212-D247 HydrophobicContact CD1-CB 3.59Å; I212-D247 HydrophobicContact CG1-CB 3.92Å; I212-D247 HydrophobicContact CG2-CB 3.95Å; I212-D247 WeakPolarHBondContact CG2-OD1 3.42Å; S244-D247 WeakPolarHBondContact O-CA 3.22Å; S244-D247 WeakPolarHBondContact O-CB 3.4Å; S244-D247 PolarHBondContact O-N 2.97Å; I245-D247 VanDerWaalsContact C-N 3.3Å; I245-D247 PolarHBondContact O-N 2.78Å; D247-R250 WeakPolarHBondContact O-CB 3.34Å; D247-R250 PolarHBondContact O-N 2.88Å; D247-R250 IonicContact OD1-CZ 2.63Å; D247-R250 IonicContact OD1-NH1 3.82Å; D247-R250 PolarHBondContact OD1-NH1 3.48Å; D247-R250 IonicContact OD1-NH2 3.64Å; D247-R250 PolarHBondContact OD1-NH2 3Å; D247-R250 IonicContact OD2-NH2 3.58Å; D247-R250 PolarHBondContact OD2-NH2 2.78Å; D247-R250 VanDerWaalsContact OD2-NH2 3.11Å; D247-L251 WeakPolarHBondContact O-CB 3.29Å; D247-L251 WeakPolarHBondContact O-CG 3.39Å; D247-L251 PolarHBondContact O-N 2.69Å |
| 248 | F | 98.4 | Very high | 96.1 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.8 | -41 | 175.5 | -61.6 | -47.5 | 0 | 0 | 0 | 111.9 | I212 L225 L228 L241 S244 I245 R250 L251 F252 V263 L266 L267 | I212-F248 HydrophobicContact CG1-CE1 4.48Å; L225-F248 HydrophobicContact CD2-CD1 4.28Å; L225-F248 HydrophobicContact CD2-CE1 4.19Å; L228-F248 HydrophobicContact CD1-CE1 4.34Å; L228-F248 HydrophobicContact CD1-CZ 4.28Å; L241-F248 HydrophobicContact CB-CE2 4.23Å; L241-F248 HydrophobicContact CD1-CE2 4.23Å; L241-F248 HydrophobicContact CD1-CZ 4.36Å; S244-F248 WeakPolarHBondContact O-CD2 3.34Å; S244-F248 PolarHBondContact O-N 3.17Å; I245-F248 PolarHBondContact O-N 3.49Å; F248-R250 VanDerWaalsContact C-N 3.35Å; F248-R250 PolarHBondContact O-N 3.42Å; F248-L251 HydrophobicContact CD1-CD1 4.14Å; F248-L251 PolarHBondContact O-N 3.44Å; F248-F252 WeakPolarHBondContact O-CB 3.26Å; F248-F252 PolarHBondContact O-N 3.49Å; F248-V263 HydrophobicContact CB-CG1 4.02Å; F248-V263 WeakPolarHBondContact O-CG1 3.04Å; F248-L266 HydrophobicContact CD1-CD2 3.72Å; F248-L266 HydrophobicContact CD2-CD2 3.46Å; F248-L266 VanDerWaalsContact CD2-CD2 3.46Å; F248-L266 HydrophobicContact CE1-CD2 3.67Å; F248-L266 HydrophobicContact CE2-CD2 3.44Å; F248-L266 VanDerWaalsContact CE2-CD2 3.44Å; F248-L266 HydrophobicContact CG-CD2 3.64Å; F248-L266 HydrophobicContact CZ-CD2 3.54Å; F248-L267 HydrophobicContact CB-CD2 4.11Å |
| 249 | F | 97.8 | Very high | 96.2 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.9 | -38.3 | 172.9 | -79.4 | -67.6 | 0 | 0 | 0 | 112.8 | I245 S246 F252 S253 L267 A283 V285 L333 | I245-F249 HydrophobicContact CG2-CD2 3.96Å; I245-F249 HydrophobicContact CG2-CE2 3.74Å; I245-F249 WeakPolarHBondContact O-CD2 3.4Å; I245-F249 PolarHBondContact O-N 3.47Å; S246-F249 PolarHBondContact O-N 2.92Å; F249-F252 WeakPolarHBondContact O-CB 3.3Å; F249-F252 PolarHBondContact O-N 3.14Å; F249-S253 PolarHBondContact O-N 2.82Å; F249-S253 PolarHBondContact O-OG 3.47Å; F249-L267 HydrophobicContact CD1-CD1 4.16Å; F249-L267 HydrophobicContact CE1-CD1 3.85Å; F249-L267 HydrophobicContact CE2-CD2 4.37Å; F249-L267 HydrophobicContact CZ-CD1 4.09Å; F249-L267 HydrophobicContact CZ-CD2 4.45Å; F249-A283 HydrophobicContact CD2-CB 4.17Å; F249-A283 HydrophobicContact CE2-CB 4.19Å; F249-V285 HydrophobicContact CB-CG1 4.31Å; F249-V285 HydrophobicContact CD1-CG1 4.08Å; F249-V285 HydrophobicContact CD2-CG1 3.88Å; F249-V285 HydrophobicContact CE1-CG1 4.36Å; F249-V285 HydrophobicContact CE2-CG1 4.17Å; F249-V285 HydrophobicContact CG-CG1 3.84Å; F249-V285 HydrophobicContact CZ-CG1 4.41Å; F249-L333 HydrophobicContact CE2-CD2 4.3Å; F249-L333 HydrophobicContact CZ-CD2 3.93Å |
| 250 | R | 96.8 | Very high | 96.3 | Very high | 124 Ų | 124 | 37.9 Ų | 37.9 | 47% | 0.468 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.3 | -44.9 | 172.6 | -77.3 | -175.5 | -88.5 | 112.2 | -7.1 | 112.3 | S246 D247 F248 F252 S253 A254 P286 | S246-R250 PolarHBondContact O-N 3.27Å; D247-R250 WeakPolarHBondContact O-CB 3.34Å; D247-R250 PolarHBondContact O-N 2.88Å; D247-R250 IonicContact OD1-CZ 2.63Å; D247-R250 IonicContact OD1-NH1 3.82Å; D247-R250 PolarHBondContact OD1-NH1 3.48Å; D247-R250 IonicContact OD1-NH2 3.64Å; D247-R250 PolarHBondContact OD1-NH2 3Å; D247-R250 IonicContact OD2-NH2 3.58Å; D247-R250 PolarHBondContact OD2-NH2 2.78Å; D247-R250 VanDerWaalsContact OD2-NH2 3.11Å; F248-R250 VanDerWaalsContact C-N 3.35Å; F248-R250 PolarHBondContact O-N 3.42Å; R250-F252 VanDerWaalsContact C-N 3.34Å; R250-S253 PolarHBondContact O-N 2.91Å; R250-A254 WeakPolarHBondContact O-CB 3.4Å; R250-A254 PolarHBondContact O-N 2.97Å; R250-P286 HydrophobicContact CG-CG 4.02Å |
| 251 | L | 97.1 | Very high | 96.3 | Very high | 14 Ų | 14 | 37 Ų | 37 | 7% | 0.073 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.6 | -41.9 | 175.1 | -79.7 | 160.1 | 0 | 0 | 0 | 111.8 | I212 L216 D247 F248 A254 G255 V263 | I212-L251 HydrophobicContact CG1-CD1 4.06Å; L216-L251 HydrophobicContact CD1-CD2 4.15Å; D247-L251 WeakPolarHBondContact O-CB 3.29Å; D247-L251 WeakPolarHBondContact O-CG 3.39Å; D247-L251 PolarHBondContact O-N 2.69Å; F248-L251 HydrophobicContact CD1-CD1 4.14Å; F248-L251 PolarHBondContact O-N 3.44Å; L251-A254 PolarHBondContact O-N 3Å; L251-G255 WeakPolarHBondContact O-CA 3.4Å; L251-G255 PolarHBondContact O-N 3.05Å; L251-V263 HydrophobicContact CB-CG2 4.2Å |
| 252 | F | 96.8 | Very high | 96.4 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.9 | -46.8 | 175.3 | 173.8 | -109.9 | 0 | 0 | 0 | 111.7 | F248 F249 R250 A254 K260 V263 L264 L289 L292 V301 L305 | F248-F252 WeakPolarHBondContact O-CB 3.26Å; F248-F252 PolarHBondContact O-N 3.49Å; F249-F252 WeakPolarHBondContact O-CB 3.3Å; F249-F252 PolarHBondContact O-N 3.14Å; R250-F252 VanDerWaalsContact C-N 3.34Å; F252-A254 PolarHBondContact O-N 2.91Å; F252-K260 HydrophobicContact CD2-CB 3.96Å; F252-K260 HydrophobicContact CD2-CG 3.9Å; F252-K260 HydrophobicContact CE2-CB 3.96Å; F252-K260 HydrophobicContact CE2-CD 4.36Å; F252-K260 HydrophobicContact CE2-CG 4.03Å; F252-K260 VanDerWaalsContact O-CE 3.28Å; F252-K260 WeakPolarHBondContact O-CE 3.47Å; F252-K260 WeakPolarHBondContact O-CG 3.16Å; F252-V263 HydrophobicContact CB-CB 4.44Å; F252-V263 HydrophobicContact CB-CG1 3.89Å; F252-L264 HydrophobicContact CD2-CD1 4.38Å; F252-L264 HydrophobicContact CD2-CD2 4.07Å; F252-L264 HydrophobicContact CD2-CG 3.89Å; F252-L264 HydrophobicContact CE2-CD1 3.59Å; F252-L264 HydrophobicContact CE2-CD2 3.63Å; F252-L264 HydrophobicContact CE2-CG 3.53Å; F252-L264 HydrophobicContact CZ-CD1 4.31Å; F252-L264 HydrophobicContact CZ-CD2 4.01Å; F252-L264 HydrophobicContact CZ-CG 4.36Å; F252-L289 HydrophobicContact CD1-CD1 3.8Å; F252-L289 HydrophobicContact CE1-CD1 3.58Å; F252-L292 HydrophobicContact CD1-CD1 4.17Å; F252-L292 HydrophobicContact CE1-CD1 3.25Å; F252-L292 HydrophobicContact CZ-CD1 3.7Å; F252-V301 HydrophobicContact CE2-CG1 3.75Å; F252-V301 HydrophobicContact CZ-CG1 3.77Å; F252-L305 HydrophobicContact CE1-CD1 4.18Å; F252-L305 HydrophobicContact CE1-CD2 3.93Å; F252-L305 HydrophobicContact CZ-CD1 4.37Å; F252-L305 HydrophobicContact CZ-CD2 4.08Å |
| 253 | S | 94.1 | Very high | 96.5 | Very high | 26 Ų | 26 | 36.9 Ų | 36.9 | 18% | 0.182 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -68.2 | -34.5 | 179.8 | -64.6 | 0 | 0 | 0 | 0 | 113.4 | F249 R250 P286 | F249-S253 PolarHBondContact O-N 2.82Å; F249-S253 PolarHBondContact O-OG 3.47Å; R250-S253 PolarHBondContact O-N 2.91Å; S253-P286 WeakPolarHBondContact OG-CG 3.09Å |
| 254 | A | 94.4 | Very high | 96.7 | Very high | 61 Ų | 61 | 30 Ų | 30 | 50% | 0.504 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -89.4 | -26.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | L216 R250 L251 F252 | L216-A254 HydrophobicContact CD1-CB 4.24Å; L216-A254 HydrophobicContact CD2-CB 4.04Å; R250-A254 WeakPolarHBondContact O-CB 3.4Å; R250-A254 PolarHBondContact O-N 2.97Å; L251-A254 PolarHBondContact O-N 3Å; F252-A254 PolarHBondContact O-N 2.91Å |
| 255 | G | 94.9 | Very high | 96.7 | Very high | 9 Ų | 9 | 33.7 Ų | 33.7 | 9% | 0.093 | 17% | 0.173 | C | C | . | . | S | Bend | trans | -69.1 | 162.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | N217 L251 K260 | N217-G255 WeakPolarHBondContact OD1-CA 3.38Å; L251-G255 WeakPolarHBondContact O-CA 3.4Å; L251-G255 PolarHBondContact O-N 3.05Å; G255-K260 WeakPolarHBondContact O-CE 3.41Å |
| 256 | N | 94.5 | Very high | 96.7 | Very high | 65 Ų | 65 | 33.7 Ų | 33.7 | 35% | 0.348 | 17% | 0.173 | S | C | . | . | trans | -72.9 | 175.8 | 165.3 | 70.5 | 4.3 | 0 | 0 | 0 | 110.7 | N217 E258 T259 K260 | N217-N256 PolarHBondContact OD1-N 3.1Å; N217-N256 PolarHBondContact OD1-OD1 3.4Å; N256-E258 VanDerWaalsContact C-N 3.31Å; N256-E258 PolarHBondContact O-N 2.99Å; N256-E258 PolarHBondContact OD1-N 2.94Å; N256-T259 PolarHBondContact O-N 3.36Å; N256-T259 WeakPolarHBondContact OD1-CB 3.27Å; N256-T259 PolarHBondContact OD1-N 3.33Å; N256-T259 PolarHBondContact OD1-OG1 3.34Å; N256-K260 WeakPolarHBondContact O-CB 3.37Å; N256-K260 WeakPolarHBondContact O-CG 3.35Å; N256-K260 PolarHBondContact O-N 3.47Å | ||
| 257 | E | 93.8 | Very high | 96.8 | Very high | 103 Ų | 103 | 32.5 Ų | 32.5 | 48% | 0.481 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -55.6 | -41.8 | -178 | -170.2 | 179.7 | 147.2 | 0 | 0 | 113.6 | K260 L261 N298 | E257-K260 PolarHBondContact O-N 3.45Å; E257-L261 HydrophobicContact CG-CD1 4.15Å; E257-L261 WeakPolarHBondContact O-CB 3.3Å; E257-L261 VanDerWaalsContact O-CG 3.29Å; E257-L261 WeakPolarHBondContact O-CG 3.32Å; E257-L261 PolarHBondContact O-N 2.86Å; E257-N298 VanDerWaalsContact CD-ND2 3.27Å; E257-N298 HydrophobicContact CG-CB 4.43Å; E257-N298 PolarHBondContact OE1-ND2 3.2Å |
| 258 | E | 95.7 | Very high | 96.7 | Very high | 94 Ų | 94 | 33.1 Ų | 33.1 | 44% | 0.439 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64.4 | -46.2 | 179.1 | -172.7 | 177.9 | -172.7 | 0 | 0 | 111.8 | L222 R226 N256 L261 Q262 | L222-E258 VanDerWaalsContact CD1-CD 3.45Å; L222-E258 HydrophobicContact CD1-CG 4.04Å; L222-E258 WeakPolarHBondContact CD1-OE2 3.33Å; L222-E258 HydrophobicContact CD2-CG 3.94Å; R226-E258 IonicContact NH2-OE1 2.77Å; R226-E258 PolarHBondContact NH2-OE1 3.24Å; N256-E258 VanDerWaalsContact C-N 3.31Å; N256-E258 PolarHBondContact O-N 2.99Å; N256-E258 PolarHBondContact OD1-N 2.94Å; E258-L261 PolarHBondContact O-N 2.96Å; E258-Q262 PolarHBondContact O-N 2.99Å |
| 259 | T | 96.8 | Very high | 96.7 | Very high | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.3 | -44.5 | 177.9 | -56.3 | 0 | 0 | 0 | 0 | 110.6 | N217 L225 N256 L261 Q262 V263 | N217-T259 PolarHBondContact OD1-OG1 2.91Å; L225-T259 HydrophobicContact CD1-CG2 3.97Å; N256-T259 PolarHBondContact O-N 3.36Å; N256-T259 WeakPolarHBondContact OD1-CB 3.27Å; N256-T259 PolarHBondContact OD1-N 3.33Å; N256-T259 PolarHBondContact OD1-OG1 3.34Å; T259-L261 PolarHBondContact O-N 3.2Å; T259-Q262 PolarHBondContact O-N 3.48Å; T259-V263 HydrophobicContact CG2-CG2 4.35Å; T259-V263 WeakPolarHBondContact O-CG2 3.09Å; T259-V263 PolarHBondContact O-N 3.3Å |
| 260 | K | 96.6 | Very high | 96.7 | Very high | 18 Ų | 18 | 34.4 Ų | 34.4 | 8% | 0.078 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -55 | -52.1 | 175.3 | -78 | -178 | -175.8 | -174.3 | 0 | 111.7 | F252 G255 N256 E257 Q262 V263 L264 E297 V301 | F252-K260 HydrophobicContact CD2-CB 3.96Å; F252-K260 HydrophobicContact CD2-CG 3.9Å; F252-K260 HydrophobicContact CE2-CB 3.96Å; F252-K260 HydrophobicContact CE2-CD 4.36Å; F252-K260 HydrophobicContact CE2-CG 4.03Å; F252-K260 VanDerWaalsContact O-CE 3.28Å; F252-K260 WeakPolarHBondContact O-CE 3.47Å; F252-K260 WeakPolarHBondContact O-CG 3.16Å; G255-K260 WeakPolarHBondContact O-CE 3.41Å; N256-K260 WeakPolarHBondContact O-CB 3.37Å; N256-K260 WeakPolarHBondContact O-CG 3.35Å; N256-K260 PolarHBondContact O-N 3.47Å; E257-K260 PolarHBondContact O-N 3.45Å; K260-Q262 VanDerWaalsContact C-N 3.27Å; K260-Q262 PolarHBondContact O-N 2.99Å; K260-V263 PolarHBondContact O-N 3.27Å; K260-L264 WeakPolarHBondContact O-CB 3.12Å; K260-L264 VanDerWaalsContact O-CG 3.26Å; K260-L264 WeakPolarHBondContact O-CG 3.11Å; K260-L264 PolarHBondContact O-N 3.3Å; K260-E297 WeakPolarHBondContact CD-OE1 3.27Å; K260-E297 IonicContact NZ-OE1 3.06Å; K260-E297 PolarHBondContact NZ-OE1 3.36Å; K260-E297 IonicContact NZ-OE2 2.68Å; K260-E297 PolarHBondContact NZ-OE2 2.6Å; K260-V301 HydrophobicContact CB-CG2 4.31Å; K260-V301 HydrophobicContact CD-CG1 4.26Å |
| 261 | L | 96.6 | Very high | 96.7 | Very high | 28 Ų | 28 | 28.5 Ų | 28.5 | 15% | 0.147 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.5 | -35.1 | -179.6 | -72.7 | 171.3 | 0 | 0 | 0 | 112.1 | E257 E258 T259 K265 E300 V301 K304 | E257-L261 HydrophobicContact CG-CD1 4.15Å; E257-L261 WeakPolarHBondContact O-CB 3.3Å; E257-L261 VanDerWaalsContact O-CG 3.29Å; E257-L261 WeakPolarHBondContact O-CG 3.32Å; E257-L261 PolarHBondContact O-N 2.86Å; E258-L261 PolarHBondContact O-N 2.96Å; T259-L261 PolarHBondContact O-N 3.2Å; L261-K265 WeakPolarHBondContact O-CG 3.29Å; L261-K265 PolarHBondContact O-N 2.67Å; L261-E300 HydrophobicContact CD2-CB 4.4Å; L261-E300 HydrophobicContact CD2-CG 3.92Å; L261-V301 HydrophobicContact CD2-CG2 3.86Å; L261-V301 HydrophobicContact CG-CG2 4.1Å; L261-K304 HydrophobicContact CD2-CD 4.18Å |
| 262 | Q | 98.1 | Very high | 96.6 | Very high | 16 Ų | 16 | 33.3 Ų | 33.3 | 8% | 0.075 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -72.8 | -42.2 | 176.9 | -169.3 | 60.4 | 39.1 | 0 | 0 | 112.3 | L225 R226 T229 E258 T259 K260 L264 K265 L266 | L225-Q262 HydrophobicContact CB-CB 4.48Å; L225-Q262 HydrophobicContact CB-CG 3.6Å; L225-Q262 HydrophobicContact CD1-CB 4.47Å; L225-Q262 HydrophobicContact CD1-CG 4.43Å; R226-Q262 HydrophobicContact CG-CG 4.18Å; T229-Q262 PolarHBondContact OG1-NE2 2.99Å; E258-Q262 PolarHBondContact O-N 2.99Å; T259-Q262 PolarHBondContact O-N 3.48Å; K260-Q262 VanDerWaalsContact C-N 3.27Å; K260-Q262 PolarHBondContact O-N 2.99Å; Q262-L264 VanDerWaalsContact C-N 3.31Å; Q262-L264 PolarHBondContact O-N 3.38Å; Q262-K265 PolarHBondContact O-N 3.45Å; Q262-L266 PolarHBondContact O-N 3.34Å |
| 263 | V | 98.5 | Very high | 96.4 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.2 | -41.5 | 174.5 | 173 | 0 | 0 | 0 | 0 | 111 | L225 F248 L251 F252 T259 K260 K265 L266 L267 | L225-V263 HydrophobicContact CD1-CG2 3.81Å; L225-V263 HydrophobicContact CD2-CG2 4.04Å; F248-V263 HydrophobicContact CB-CG1 4.02Å; F248-V263 WeakPolarHBondContact O-CG1 3.04Å; L251-V263 HydrophobicContact CB-CG2 4.2Å; F252-V263 HydrophobicContact CB-CB 4.44Å; F252-V263 HydrophobicContact CB-CG1 3.89Å; T259-V263 HydrophobicContact CG2-CG2 4.35Å; T259-V263 WeakPolarHBondContact O-CG2 3.09Å; T259-V263 PolarHBondContact O-N 3.3Å; K260-V263 PolarHBondContact O-N 3.27Å; V263-K265 VanDerWaalsContact C-N 3.29Å; V263-K265 PolarHBondContact O-N 3.43Å; V263-L266 WeakPolarHBondContact O-CB 3.37Å; V263-L266 PolarHBondContact O-N 2.97Å; V263-L266 VanDerWaalsContact O-N 3.16Å; V263-L267 HydrophobicContact CG1-CD1 3.87Å; V263-L267 HydrophobicContact CG1-CG 4.15Å; V263-L267 WeakPolarHBondContact O-CG 3.42Å; V263-L267 PolarHBondContact O-N 3.19Å |
| 264 | L | 98.4 | Very high | 96.3 | Very high | 1 Ų | 1 | 36.5 Ų | 36.5 | 1% | 0.005 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.2 | -36 | 176.9 | -72.8 | 169.7 | 0 | 0 | 0 | 112.6 | F252 K260 Q262 L267 L268 V301 K304 L305 I308 | F252-L264 HydrophobicContact CD2-CD1 4.38Å; F252-L264 HydrophobicContact CD2-CD2 4.07Å; F252-L264 HydrophobicContact CD2-CG 3.89Å; F252-L264 HydrophobicContact CE2-CD1 3.59Å; F252-L264 HydrophobicContact CE2-CD2 3.63Å; F252-L264 HydrophobicContact CE2-CG 3.53Å; F252-L264 HydrophobicContact CZ-CD1 4.31Å; F252-L264 HydrophobicContact CZ-CD2 4.01Å; F252-L264 HydrophobicContact CZ-CG 4.36Å; K260-L264 WeakPolarHBondContact O-CB 3.12Å; K260-L264 VanDerWaalsContact O-CG 3.26Å; K260-L264 WeakPolarHBondContact O-CG 3.11Å; K260-L264 PolarHBondContact O-N 3.3Å; Q262-L264 VanDerWaalsContact C-N 3.31Å; Q262-L264 PolarHBondContact O-N 3.38Å; L264-L267 PolarHBondContact O-N 3.38Å; L264-L268 VanDerWaalsContact O-CB 3.26Å; L264-L268 WeakPolarHBondContact O-CB 3.43Å; L264-L268 PolarHBondContact O-N 2.96Å; L264-V301 HydrophobicContact CD1-CB 4.35Å; L264-V301 HydrophobicContact CD1-CG1 4.04Å; L264-K304 HydrophobicContact CB-CB 4.41Å; L264-K304 HydrophobicContact CD1-CB 3.94Å; L264-L305 HydrophobicContact CD2-CB 4.04Å; L264-L305 HydrophobicContact CD2-CD1 3.97Å; L264-I308 HydrophobicContact CB-CD1 4.24Å; L264-I308 HydrophobicContact CD2-CD1 3.49Å; L264-I308 VanDerWaalsContact CD2-CD1 3.49Å; L264-I308 HydrophobicContact CG-CD1 4.48Å; L264-I308 WeakPolarHBondContact O-CD1 3.49Å |
| 265 | K | 98.2 | Very high | 96.3 | Very high | 93 Ų | 93 | 37.3 Ų | 37.3 | 40% | 0.404 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -64 | -43 | 174.7 | -69.4 | 170.1 | -173.9 | 174.3 | 0 | 111.8 | T229 L261 Q262 V263 L268 N269 | T229-K265 HydrophobicContact CG2-CB 3.86Å; L261-K265 WeakPolarHBondContact O-CG 3.29Å; L261-K265 PolarHBondContact O-N 2.67Å; Q262-K265 PolarHBondContact O-N 3.45Å; V263-K265 VanDerWaalsContact C-N 3.29Å; V263-K265 PolarHBondContact O-N 3.43Å; K265-L268 PolarHBondContact O-N 3.36Å; K265-N269 PolarHBondContact O-N 3.11Å; K265-N269 PolarHBondContact O-OD1 2.98Å |
| 266 | L | 98.3 | Very high | 96.3 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.9 | -51.7 | 175.3 | -176.8 | 92.8 | 0 | 0 | 0 | 110.7 | L228 T232 L241 F248 Q262 V263 L268 N269 L270 | L228-L266 VanDerWaalsContact C-CD1 3.46Å; L228-L266 HydrophobicContact CB-CD1 3.65Å; T232-L266 HydrophobicContact CG2-CD1 4.11Å; L241-L266 HydrophobicContact CD1-CD1 4.06Å; F248-L266 HydrophobicContact CD1-CD2 3.72Å; F248-L266 HydrophobicContact CD2-CD2 3.46Å; F248-L266 VanDerWaalsContact CD2-CD2 3.46Å; F248-L266 HydrophobicContact CE1-CD2 3.67Å; F248-L266 HydrophobicContact CE2-CD2 3.44Å; F248-L266 VanDerWaalsContact CE2-CD2 3.44Å; F248-L266 HydrophobicContact CG-CD2 3.64Å; F248-L266 HydrophobicContact CZ-CD2 3.54Å; Q262-L266 PolarHBondContact O-N 3.34Å; V263-L266 WeakPolarHBondContact O-CB 3.37Å; V263-L266 PolarHBondContact O-N 2.97Å; V263-L266 VanDerWaalsContact O-N 3.16Å; L266-L268 VanDerWaalsContact C-N 3.26Å; L266-L268 PolarHBondContact O-N 3.42Å; L266-N269 WeakPolarHBondContact O-CB 3.33Å; L266-N269 PolarHBondContact O-N 3.01Å; L266-L270 WeakPolarHBondContact O-CG 3.36Å; L266-L270 PolarHBondContact O-N 2.81Å |
| 267 | L | 98.4 | Very high | 96.3 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62 | -34.1 | -179.6 | -70.3 | 176.7 | 0 | 0 | 0 | 112.3 | I245 F248 F249 V263 L264 L270 A271 L280 I308 | I245-L267 HydrophobicContact CG2-CD2 4.35Å; F248-L267 HydrophobicContact CB-CD2 4.11Å; F249-L267 HydrophobicContact CD1-CD1 4.16Å; F249-L267 HydrophobicContact CE1-CD1 3.85Å; F249-L267 HydrophobicContact CE2-CD2 4.37Å; F249-L267 HydrophobicContact CZ-CD1 4.09Å; F249-L267 HydrophobicContact CZ-CD2 4.45Å; V263-L267 HydrophobicContact CG1-CD1 3.87Å; V263-L267 HydrophobicContact CG1-CG 4.15Å; V263-L267 WeakPolarHBondContact O-CG 3.42Å; V263-L267 PolarHBondContact O-N 3.19Å; L264-L267 PolarHBondContact O-N 3.38Å; L267-L270 HydrophobicContact CD2-CD1 4.46Å; L267-L270 PolarHBondContact O-N 2.91Å; L267-A271 WeakPolarHBondContact O-CB 3.29Å; L267-A271 PolarHBondContact O-N 3.16Å; L267-L280 HydrophobicContact CD2-CD2 4.3Å; L267-I308 HydrophobicContact CB-CD1 3.83Å |
| 268 | L | 97.7 | Very high | 96.2 | Very high | 44 Ų | 44 | 32.8 Ų | 32.8 | 23% | 0.23 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -63 | -47.5 | 174.9 | -178.7 | 62.3 | 0 | 0 | 0 | 111.9 | L264 K265 L266 L270 A271 E272 V307 I308 N311 | L264-L268 VanDerWaalsContact O-CB 3.26Å; L264-L268 WeakPolarHBondContact O-CB 3.43Å; L264-L268 PolarHBondContact O-N 2.96Å; K265-L268 PolarHBondContact O-N 3.36Å; L266-L268 VanDerWaalsContact C-N 3.26Å; L266-L268 PolarHBondContact O-N 3.42Å; L268-L270 PolarHBondContact O-N 3.35Å; L268-A271 PolarHBondContact O-N 3.2Å; L268-A271 VanDerWaalsContact O-N 3.07Å; L268-E272 HydrophobicContact CD1-CG 4.37Å; L268-E272 WeakPolarHBondContact O-CG 3.26Å; L268-E272 PolarHBondContact O-N 2.89Å; L268-V307 HydrophobicContact CD1-CG1 3.85Å; L268-I308 HydrophobicContact CB-CD1 4.42Å; L268-I308 HydrophobicContact CB-CG1 4Å; L268-I308 HydrophobicContact CD1-CG1 4.06Å; L268-N311 WeakPolarHBondContact CD1-ND2 3.32Å |
| 269 | N | 97.3 | Very high | 96.1 | Very high | 27 Ų | 27 | 31.1 Ų | 31.1 | 14% | 0.144 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -56.1 | -40.4 | 175.4 | -70.2 | -4 | 0 | 0 | 0 | 111.6 | T229 T232 Q238 K265 L266 | T229-N269 PolarHBondContact O-ND2 3.23Å; T232-N269 WeakPolarHBondContact O-CB 3.23Å; T232-N269 PolarHBondContact OG1-ND2 3.49Å; Q238-N269 PolarHBondContact NE2-O 3.4Å; K265-N269 PolarHBondContact O-N 3.11Å; K265-N269 PolarHBondContact O-OD1 2.98Å; L266-N269 WeakPolarHBondContact O-CB 3.33Å; L266-N269 PolarHBondContact O-N 3.01Å |
| 270 | L | 97.7 | Very high | 96.1 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -67.3 | -43.7 | 176.2 | -57.6 | -177.9 | 0 | 0 | 0 | 111.4 | T232 Q238 I245 L266 L267 L268 E272 N273 M276 L280 | T232-L270 HydrophobicContact CG2-CD2 4.17Å; Q238-L270 HydrophobicContact CB-CD2 3.66Å; Q238-L270 HydrophobicContact CG-CD2 3.72Å; I245-L270 HydrophobicContact CD1-CD1 4.43Å; I245-L270 HydrophobicContact CG1-CD1 4.16Å; L266-L270 WeakPolarHBondContact O-CG 3.36Å; L266-L270 PolarHBondContact O-N 2.81Å; L267-L270 HydrophobicContact CD2-CD1 4.46Å; L267-L270 PolarHBondContact O-N 2.91Å; L268-L270 PolarHBondContact O-N 3.35Å; L270-E272 VanDerWaalsContact C-N 3.32Å; L270-E272 PolarHBondContact O-N 3.36Å; L270-N273 PolarHBondContact O-N 2.93Å; L270-N273 VanDerWaalsContact O-N 3.15Å; L270-M276 HydrophobicContact CB-CB 4.5Å; L270-M276 HydrophobicContact CD2-CE 4.41Å; L270-M276 WeakPolarHBondContact O-CB 3.48Å; L270-L280 HydrophobicContact CB-CD1 4.18Å; L270-L280 HydrophobicContact CB-CD2 4.34Å |
| 271 | A | 96.6 | Very high | 96 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -68.6 | -28.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | L267 L268 N273 L280 I308 N311 I312 N315 | L267-A271 WeakPolarHBondContact O-CB 3.29Å; L267-A271 PolarHBondContact O-N 3.16Å; L268-A271 PolarHBondContact O-N 3.2Å; L268-A271 VanDerWaalsContact O-N 3.07Å; A271-N273 PolarHBondContact O-N 3.34Å; A271-L280 HydrophobicContact CB-CD1 4Å; A271-I308 HydrophobicContact CB-CG2 3.94Å; A271-N311 HydrophobicContact CB-CB 4.02Å; A271-I312 HydrophobicContact CB-CD1 4.4Å; A271-I312 HydrophobicContact CB-CG1 3.88Å; A271-N315 PolarHBondContact O-ND2 3.46Å |
| 272 | E | 94.6 | Very high | 95.9 | Very high | 115 Ų | 115 | 33 Ų | 33 | 54% | 0.537 | 17% | 0.169 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -19.6 | 173.2 | -74.4 | 177.2 | -179 | 0 | 0 | 112.9 | L268 L270 P274 N311 | L268-E272 HydrophobicContact CD1-CG 4.37Å; L268-E272 WeakPolarHBondContact O-CG 3.26Å; L268-E272 PolarHBondContact O-N 2.89Å; L270-E272 VanDerWaalsContact C-N 3.32Å; L270-E272 PolarHBondContact O-N 3.36Å; E272-P274 WeakPolarHBondContact O-CD 3.47Å; E272-N311 WeakPolarHBondContact CG-ND2 3.37Å |
| 273 | N | 93.5 | Very high | 95.8 | Very high | 16 Ų | 16 | 32.5 Ų | 32.5 | 9% | 0.086 | 17% | 0.167 | C | C | . | . | S | Bend | trans | -95.5 | 112.8 | 177.6 | -178.7 | 3 | 0 | 0 | 0 | 111.5 | Q238 L270 A271 A275 M276 | Q238-N273 PolarHBondContact OE1-ND2 3.04Å; L270-N273 PolarHBondContact O-N 2.93Å; L270-N273 VanDerWaalsContact O-N 3.15Å; A271-N273 PolarHBondContact O-N 3.34Å; N273-A275 PolarHBondContact O-N 3.46Å; N273-A275 WeakPolarHBondContact OD1-CB 3.19Å; N273-A275 PolarHBondContact OD1-N 2.82Å; N273-M276 HydrophobicContact CB-CB 4.48Å; N273-M276 HydrophobicContact CB-CG 4.09Å; N273-M276 PolarHBondContact O-N 3.26Å |
| 274 | P | 92.4 | Very high | 95.7 | Very high | 77 Ų | 77 | 36.5 Ų | 36.5 | 50% | 0.5 | 19% | 0.186 | S | C | . | . | G | 310 helix | trans | -57.4 | -27.9 | 179.1 | -23.4 | 32.6 | 0 | 0 | 0 | 114.1 | E272 M276 T277 N315 | E272-P274 WeakPolarHBondContact O-CD 3.47Å; P274-M276 PolarHBondContact O-N 3.27Å; P274-T277 WeakPolarHBondContact O-CB 3.41Å; P274-T277 PolarHBondContact O-N 3.34Å; P274-T277 PolarHBondContact O-OG1 3.23Å; P274-N315 HydrophobicContact CB-CB 4.29Å |
| 275 | A | 92.9 | Very high | 95.6 | Very high | 77 Ų | 77 | 37.2 Ų | 37.2 | 64% | 0.636 | 19% | 0.19 | S | C | * | . | G | 310 helix | trans | -66 | -25.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | N273 | N273-A275 PolarHBondContact O-N 3.46Å; N273-A275 WeakPolarHBondContact OD1-CB 3.19Å; N273-A275 PolarHBondContact OD1-N 2.82Å |
| 276 | M | 95.4 | Very high | 95.4 | Very high | 7 Ų | 7 | 34 Ų | 34 | 3% | 0.034 | 18% | 0.179 | C | C | . | . | G | 310 helix | trans | -89.6 | -12.1 | 179 | -62.9 | -57 | -58.3 | 0 | 0 | 112.9 | Q238 A242 I245 L270 N273 P274 R278 E279 L280 | Q238-M276 HydrophobicContact CB-CG 4.07Å; Q238-M276 HydrophobicContact CB-SD 3.94Å; A242-M276 HydrophobicContact CB-CE 4.24Å; I245-M276 HydrophobicContact CD1-CE 4.06Å; L270-M276 HydrophobicContact CB-CB 4.5Å; L270-M276 HydrophobicContact CD2-CE 4.41Å; L270-M276 WeakPolarHBondContact O-CB 3.48Å; N273-M276 HydrophobicContact CB-CB 4.48Å; N273-M276 HydrophobicContact CB-CG 4.09Å; N273-M276 PolarHBondContact O-N 3.26Å; P274-M276 PolarHBondContact O-N 3.27Å; M276-R278 VanDerWaalsContact C-N 3.34Å; M276-R278 PolarHBondContact O-N 3.44Å; M276-E279 HydrophobicContact CE-CB 4.33Å; M276-E279 PolarHBondContact O-N 2.8Å; M276-L280 HydrophobicContact CB-CD1 4.29Å; M276-L280 PolarHBondContact O-N 3.45Å |
| 277 | T | 94.4 | Very high | 94.8 | Very high | 3 Ų | 3 | 40.1 Ų | 40.1 | 2% | 0.018 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -56.3 | -44.3 | -173.9 | -63.8 | 0 | 0 | 0 | 0 | 112.8 | P274 E279 L280 L281 I312 N315 F316 | P274-T277 WeakPolarHBondContact O-CB 3.41Å; P274-T277 PolarHBondContact O-N 3.34Å; P274-T277 PolarHBondContact O-OG1 3.23Å; T277-E279 VanDerWaalsContact C-N 3.35Å; T277-E279 PolarHBondContact O-N 3.41Å; T277-L280 PolarHBondContact O-N 3.27Å; T277-L281 HydrophobicContact CG2-CD1 4.03Å; T277-L281 WeakPolarHBondContact O-CB 3.37Å; T277-L281 WeakPolarHBondContact O-CG 3.43Å; T277-L281 PolarHBondContact O-N 2.77Å; T277-I312 HydrophobicContact CG2-CG2 4.19Å; T277-N315 HydrophobicContact CG2-CB 4.04Å; T277-N315 WeakPolarHBondContact OG1-CB 3.41Å; T277-F316 HydrophobicContact CG2-CB 3.82Å; T277-F316 HydrophobicContact CG2-CD2 4.28Å; T277-F316 HydrophobicContact CG2-CG 4.49Å |
| 278 | R | 91.9 | Very high | 94.2 | Very high | 72 Ų | 72 | 42.4 Ų | 42.4 | 27% | 0.272 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -65 | -38.5 | 177.5 | -74.5 | -175.2 | 128.5 | -118.9 | -6.7 | 112.2 | M276 L281 R282 E320 | M276-R278 VanDerWaalsContact C-N 3.34Å; M276-R278 PolarHBondContact O-N 3.44Å; R278-L281 PolarHBondContact O-N 3.09Å; R278-R282 WeakPolarHBondContact O-CB 3.31Å; R278-R282 VanDerWaalsContact O-CG 3.26Å; R278-R282 WeakPolarHBondContact O-CG 3.37Å; R278-R282 PolarHBondContact O-N 3.16Å; R278-E320 IonicContact CZ-OE2 2.73Å; R278-E320 IonicContact NE-OE2 2.85Å; R278-E320 IonicContact NH2-OE1 3.95Å; R278-E320 IonicContact NH2-OE2 2.86Å; R278-E320 PolarHBondContact NH2-OE2 2.88Å |
| 279 | E | 94.6 | Very high | 93.7 | Very high | 60 Ų | 60 | 40.3 Ų | 40.3 | 28% | 0.28 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -69.5 | -38.4 | 177.9 | -60.4 | -53.4 | 126.9 | 0 | 0 | 111.6 | A242 I245 M276 T277 R282 A283 | A242-E279 HydrophobicContact CB-CB 4.29Å; A242-E279 HydrophobicContact CB-CG 4.13Å; I245-E279 HydrophobicContact CD1-CB 3.91Å; M276-E279 HydrophobicContact CE-CB 4.33Å; M276-E279 PolarHBondContact O-N 2.8Å; T277-E279 VanDerWaalsContact C-N 3.35Å; T277-E279 PolarHBondContact O-N 3.41Å; E279-R282 PolarHBondContact O-N 3.47Å; E279-R282 IonicContact OE1-CZ 3.82Å; E279-R282 IonicContact OE1-NH1 3.93Å; E279-R282 PolarHBondContact OE1-NH1 2.84Å; E279-A283 PolarHBondContact O-N 3.1Å; E279-A283 VanDerWaalsContact O-N 3.12Å |
| 280 | L | 96.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.6 | -44.3 | 172.6 | -75.2 | 161.3 | 0 | 0 | 0 | 111.9 | I245 L267 L270 A271 M276 T277 R282 A283 I312 L333 | I245-L280 HydrophobicContact CD1-CD2 4.19Å; I245-L280 HydrophobicContact CD1-CG 4.23Å; I245-L280 HydrophobicContact CG2-CD2 3.78Å; L267-L280 HydrophobicContact CD2-CD2 4.3Å; L270-L280 HydrophobicContact CB-CD1 4.18Å; L270-L280 HydrophobicContact CB-CD2 4.34Å; A271-L280 HydrophobicContact CB-CD1 4Å; M276-L280 HydrophobicContact CB-CD1 4.29Å; M276-L280 PolarHBondContact O-N 3.45Å; T277-L280 PolarHBondContact O-N 3.27Å; L280-R282 VanDerWaalsContact C-N 3.33Å; L280-R282 PolarHBondContact O-N 3.18Å; L280-A283 WeakPolarHBondContact O-CB 3.31Å; L280-A283 PolarHBondContact O-N 2.9Å; L280-I312 HydrophobicContact CB-CD1 3.99Å; L280-I312 HydrophobicContact CB-CG1 4.4Å; L280-I312 HydrophobicContact CD1-CD1 4.07Å; L280-I312 HydrophobicContact CD1-CG1 3.97Å; L280-I312 HydrophobicContact CG-CD1 4.44Å; L280-L333 WeakPolarHBondContact O-CB 3.48Å; L280-L333 WeakPolarHBondContact O-CD2 3.41Å |
| 281 | L | 94.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -67.4 | -31.9 | 178.6 | -75.1 | 171.3 | 0 | 0 | 0 | 112.9 | T277 R278 A283 I312 F316 F328 S332 L333 F334 L337 | T277-L281 HydrophobicContact CG2-CD1 4.03Å; T277-L281 WeakPolarHBondContact O-CB 3.37Å; T277-L281 WeakPolarHBondContact O-CG 3.43Å; T277-L281 PolarHBondContact O-N 2.77Å; R278-L281 PolarHBondContact O-N 3.09Å; L281-A283 VanDerWaalsContact C-N 3.34Å; L281-I312 HydrophobicContact CD1-CG2 4.32Å; L281-I312 HydrophobicContact CD2-CG2 3.65Å; L281-I312 HydrophobicContact CG-CG2 3.8Å; L281-F316 HydrophobicContact CD1-CB 4Å; L281-F316 HydrophobicContact CD1-CD1 3.96Å; L281-F316 HydrophobicContact CD1-CD2 3.27Å; L281-F316 HydrophobicContact CD1-CE1 4.26Å; L281-F316 HydrophobicContact CD1-CE2 3.63Å; L281-F316 HydrophobicContact CD1-CG 3.45Å; L281-F316 VanDerWaalsContact CD1-CG 3.45Å; L281-F316 HydrophobicContact CD1-CZ 4.12Å; L281-F328 HydrophobicContact CB-CD1 4.18Å; L281-F328 HydrophobicContact CB-CE1 3.5Å; L281-F328 HydrophobicContact CB-CZ 4.07Å; L281-F328 HydrophobicContact CD1-CZ 4.41Å; L281-S332 WeakPolarHBondContact O-CB 3.49Å; L281-L333 PolarHBondContact O-N 3.21Å; L281-F334 HydrophobicContact CB-CB 4.29Å; L281-F334 HydrophobicContact CD2-CB 4.19Å; L281-F334 HydrophobicContact CD2-CD2 4.41Å; L281-F334 PolarHBondContact O-N 3.13Å; L281-F334 VanDerWaalsContact O-N 3.1Å; L281-L337 HydrophobicContact CD2-CD1 4.05Å |
| 282 | R | 94.2 | Very high | 91.2 | Very high | 86 Ų | 86 | 42.1 Ų | 42.1 | 33% | 0.325 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -73.9 | -23.1 | 174.4 | -76 | 171.4 | 178 | 164 | -6.4 | 113.6 | R278 E279 L280 Q284 F328 | R278-R282 WeakPolarHBondContact O-CB 3.31Å; R278-R282 VanDerWaalsContact O-CG 3.26Å; R278-R282 WeakPolarHBondContact O-CG 3.37Å; R278-R282 PolarHBondContact O-N 3.16Å; E279-R282 PolarHBondContact O-N 3.47Å; E279-R282 IonicContact OE1-CZ 3.82Å; E279-R282 IonicContact OE1-NH1 3.93Å; E279-R282 PolarHBondContact OE1-NH1 2.84Å; L280-R282 VanDerWaalsContact C-N 3.33Å; L280-R282 PolarHBondContact O-N 3.18Å; R282-Q284 PolarHBondContact O-N 3.28Å; R282-F328 HydrophobicContact CB-CD1 4.43Å; R282-F328 HydrophobicContact CG-CD1 3.67Å; R282-F328 HydrophobicContact CG-CE1 3.71Å |
| 283 | A | 96.5 | Very high | 90.4 | Very high | 4 Ų | 4 | 36.7 Ų | 36.7 | 3% | 0.033 | 22% | 0.219 | C | C | . | . | S | Bend | trans | -60 | 138.3 | -176 | 0 | 0 | 0 | 0 | 0 | 111.8 | I245 F249 E279 L280 L281 S332 L333 | I245-A283 HydrophobicContact CB-CB 3.89Å; I245-A283 HydrophobicContact CG2-CB 3.35Å; F249-A283 HydrophobicContact CD2-CB 4.17Å; F249-A283 HydrophobicContact CE2-CB 4.19Å; E279-A283 PolarHBondContact O-N 3.1Å; E279-A283 VanDerWaalsContact O-N 3.12Å; L280-A283 WeakPolarHBondContact O-CB 3.31Å; L280-A283 PolarHBondContact O-N 2.9Å; L281-A283 VanDerWaalsContact C-N 3.34Å; A283-S332 CarbonylContact O-C 3.5Å; A283-S332 VanDerWaalsContact O-CA 3.29Å; A283-S332 WeakPolarHBondContact O-CA 3.17Å; A283-L333 PolarHBondContact O-N 2.81Å |
| 284 | Q | 96.5 | Very high | 89.2 | Confident | 84 Ų | 84 | 39.2 Ų | 39.2 | 39% | 0.393 | 23% | 0.232 | S | C | . | . | B | Isolated β-bridge | trans | -75.6 | 127.5 | 176.3 | -70.6 | -68.2 | -38.8 | 0 | 0 | 109.5 | S246 R282 E330 G331 | S246-Q284 PolarHBondContact OG-N 3.12Å; R282-Q284 PolarHBondContact O-N 3.28Å; Q284-E330 PolarHBondContact NE2-O 3.02Å; Q284-E330 PolarHBondContact OE1-O 3.29Å; Q284-G331 PolarHBondContact OE1-O 3.39Å |
| 285 | V | 95.8 | Very high | 88.1 | Confident | 17 Ų | 17 | 41.4 Ų | 41.4 | 10% | 0.103 | 23% | 0.233 | C | C | . | . | trans | -111.9 | 140 | -179.3 | -64.3 | 0 | 0 | 0 | 0 | 111.2 | F249 L289 G331 L333 F336 | F249-V285 HydrophobicContact CB-CG1 4.31Å; F249-V285 HydrophobicContact CD1-CG1 4.08Å; F249-V285 HydrophobicContact CD2-CG1 3.88Å; F249-V285 HydrophobicContact CE1-CG1 4.36Å; F249-V285 HydrophobicContact CE2-CG1 4.17Å; F249-V285 HydrophobicContact CG-CG1 3.84Å; F249-V285 HydrophobicContact CZ-CG1 4.41Å; V285-L289 HydrophobicContact CB-CD2 3.93Å; V285-L289 HydrophobicContact CG1-CD2 4.14Å; V285-L289 HydrophobicContact CG2-CD2 4.28Å; V285-G331 WeakPolarHBondContact CG2-O 3.39Å; V285-G331 PolarHBondContact N-O 2.7Å; V285-L333 HydrophobicContact CG1-CB 3.79Å; V285-L333 HydrophobicContact CG1-CD1 3.99Å; V285-L333 HydrophobicContact CG1-CG 4.44Å; V285-F336 HydrophobicContact CG2-CB 3.69Å; V285-F336 HydrophobicContact CG2-CD2 4.43Å; V285-F336 HydrophobicContact CG2-CG 4.11Å | ||
| 286 | P | 93.3 | Very high | 87.2 | Confident | 26 Ų | 26 | 47.7 Ų | 47.7 | 17% | 0.169 | 25% | 0.246 | C | C | . | . | trans | -62 | 139.5 | 175.2 | -25 | 36.2 | 0 | 0 | 0 | 111.9 | R250 S253 S288 L289 | R250-P286 HydrophobicContact CG-CG 4.02Å; S253-P286 WeakPolarHBondContact OG-CG 3.09Å; P286-S288 PolarHBondContact O-N 3.48Å; P286-L289 WeakPolarHBondContact O-CB 3.36Å; P286-L289 PolarHBondContact O-N 2.86Å | ||
| 287 | S | 87.1 | Confident | 86.6 | Confident | 127 Ų | 127 | 49.2 Ų | 49.2 | 89% | 0.888 | 25% | 0.254 | S | S | * | . | G | 310 helix | trans | -58.2 | -22.9 | 174.5 | 58.6 | 0 | 0 | 0 | 0 | 113.3 | L289 | S287-L289 PolarHBondContact O-N 3.35Š|
| 288 | S | 86 | Confident | 86.2 | Confident | 48 Ų | 48 | 51.3 Ų | 51.3 | 34% | 0.336 | 27% | 0.265 | S | S | . | . | G | 310 helix | trans | -71.1 | -12.1 | 175.2 | 62.2 | 0 | 0 | 0 | 0 | 114.2 | P286 G290 S291 | P286-S288 PolarHBondContact O-N 3.48Å; S288-G290 VanDerWaalsContact C-N 3.3Å; S288-G290 PolarHBondContact O-N 3.07Å; S288-S291 WeakPolarHBondContact O-CB 3.28Å; S288-S291 PolarHBondContact O-N 3.31Å; S288-S291 PolarHBondContact O-OG 3.48Å |
| 289 | L | 87.1 | Confident | 85.9 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 27% | 0.274 | C | S | . | . | G | 310 helix | trans | -57.2 | -42.4 | -179.7 | -172.4 | 68.5 | 0 | 0 | 0 | 111.8 | F252 V285 P286 S287 S291 L292 L305 F309 F336 | F252-L289 HydrophobicContact CD1-CD1 3.8Å; F252-L289 HydrophobicContact CE1-CD1 3.58Å; V285-L289 HydrophobicContact CB-CD2 3.93Å; V285-L289 HydrophobicContact CG1-CD2 4.14Å; V285-L289 HydrophobicContact CG2-CD2 4.28Å; P286-L289 WeakPolarHBondContact O-CB 3.36Å; P286-L289 PolarHBondContact O-N 2.86Å; S287-L289 PolarHBondContact O-N 3.35Å; L289-S291 VanDerWaalsContact C-N 3.26Å; L289-S291 PolarHBondContact O-N 2.92Å; L289-L292 HydrophobicContact CD1-CD1 3.86Å; L289-L292 WeakPolarHBondContact O-CB 3.17Å; L289-L292 WeakPolarHBondContact O-CG 3.32Å; L289-L292 PolarHBondContact O-N 2.79Å; L289-L305 HydrophobicContact CD1-CD2 4.11Å; L289-F309 HydrophobicContact CD2-CZ 4.18Å; L289-F336 HydrophobicContact CB-CE2 4.04Å; L289-F336 HydrophobicContact CB-CZ 4.23Å; L289-F336 HydrophobicContact CD2-CD1 3.95Å; L289-F336 HydrophobicContact CD2-CD2 4.32Å; L289-F336 HydrophobicContact CD2-CE1 3.75Å; L289-F336 HydrophobicContact CD2-CE2 4.13Å; L289-F336 HydrophobicContact CD2-CG 4.23Å; L289-F336 HydrophobicContact CD2-CZ 3.84Å; L289-F336 HydrophobicContact CG-CE1 4.23Å; L289-F336 HydrophobicContact CG-CE2 4.17Å; L289-F336 HydrophobicContact CG-CZ 3.86Å |
| 290 | G | 80.3 | Confident | 85.7 | Confident | 22 Ų | 22 | 54.1 Ų | 54.1 | 23% | 0.227 | 28% | 0.279 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -30.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S288 L292 F293 | S288-G290 VanDerWaalsContact C-N 3.3Å; S288-G290 PolarHBondContact O-N 3.07Å; G290-L292 PolarHBondContact O-N 3.01Å; G290-F293 PolarHBondContact O-N 3.37Å |
| 291 | S | 79.9 | Confident | 85.5 | Confident | 32 Ų | 32 | 54.2 Ų | 54.2 | 22% | 0.224 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -68 | -16.4 | 179.3 | 80.5 | 0 | 0 | 0 | 0 | 113.7 | S288 L289 F293 N294 K295 | S288-S291 WeakPolarHBondContact O-CB 3.28Å; S288-S291 PolarHBondContact O-N 3.31Å; S288-S291 PolarHBondContact O-OG 3.48Å; L289-S291 VanDerWaalsContact C-N 3.26Å; L289-S291 PolarHBondContact O-N 2.92Å; S291-F293 PolarHBondContact O-N 3.16Å; S291-N294 PolarHBondContact O-N 2.95Å; S291-K295 WeakPolarHBondContact O-CG 3.43Å; S291-K295 PolarHBondContact O-N 3.42Å; S291-K295 VanDerWaalsContact O-N 3.08Å; S291-K295 PolarHBondContact OG-NZ 2.81Å; S291-K295 VanDerWaalsContact OG-NZ 3.15Å |
| 292 | L | 79.1 | Confident | 85.2 | Confident | 11 Ų | 11 | 54.3 Ų | 54.3 | 6% | 0.058 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -66.1 | -27.3 | 177.9 | -63.5 | 176 | 0 | 0 | 0 | 112.8 | F252 L289 G290 N294 E297 L305 | F252-L292 HydrophobicContact CD1-CD1 4.17Å; F252-L292 HydrophobicContact CE1-CD1 3.25Å; F252-L292 HydrophobicContact CZ-CD1 3.7Å; L289-L292 HydrophobicContact CD1-CD1 3.86Å; L289-L292 WeakPolarHBondContact O-CB 3.17Å; L289-L292 WeakPolarHBondContact O-CG 3.32Å; L289-L292 PolarHBondContact O-N 2.79Å; G290-L292 PolarHBondContact O-N 3.01Å; L292-N294 VanDerWaalsContact C-N 3.35Å; L292-E297 HydrophobicContact CD2-CG 4.26Å; L292-E297 WeakPolarHBondContact CD2-OE2 3.32Å; L292-E297 WeakPolarHBondContact O-CB 3.45Å; L292-L305 HydrophobicContact CD1-CD2 4.43Å |
| 293 | F | 76.4 | Confident | 85 | Confident | 2 Ų | 2 | 52.1 Ų | 52.1 | 1% | 0.009 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -78.1 | -23.7 | 177.6 | -62.8 | -82.2 | 0 | 0 | 0 | 112.3 | G290 S291 I302 L305 L306 F309 F336 F340 I350 H354 V362 | G290-F293 PolarHBondContact O-N 3.37Å; S291-F293 PolarHBondContact O-N 3.16Å; F293-I302 HydrophobicContact CD1-CG2 3.78Å; F293-I302 HydrophobicContact CE1-CG2 3.69Å; F293-L305 HydrophobicContact CE2-CD2 4.2Å; F293-L305 HydrophobicContact CZ-CD2 3.88Å; F293-L306 HydrophobicContact CE1-CD2 3.81Å; F293-L306 HydrophobicContact CE1-CG 4.09Å; F293-L306 HydrophobicContact CZ-CD2 4.21Å; F293-F309 HydrophobicContact CE2-CE2 4.45Å; F293-F309 HydrophobicContact CZ-CE2 4.07Å; F293-F336 HydrophobicContact CE2-CZ 4.46Å; F293-F340 HydrophobicContact CD1-CE2 4.45Å; F293-F340 HydrophobicContact CD1-CZ 4.27Å; F293-F340 AromaticContact CD2-CE2 3.56Å; F293-F340 HydrophobicContact CD2-CE2 3.56Å; F293-F340 HydrophobicContact CD2-CZ 4.14Å; F293-F340 HydrophobicContact CE1-CE2 4.48Å; F293-F340 HydrophobicContact CE1-CZ 4.12Å; F293-F340 HydrophobicContact CE2-CD2 4.43Å; F293-F340 AromaticContact CE2-CE2 3.6Å; F293-F340 HydrophobicContact CE2-CE2 3.6Å; F293-F340 AromaticContact CE2-CZ 3.99Å; F293-F340 HydrophobicContact CE2-CZ 3.99Å; F293-F340 HydrophobicContact CG-CE2 4.01Å; F293-F340 HydrophobicContact CG-CZ 4.27Å; F293-F340 HydrophobicContact CZ-CE2 4.08Å; F293-F340 AromaticContact CZ-CZ 3.98Å; F293-F340 HydrophobicContact CZ-CZ 3.98Å; F293-I350 WeakPolarHBondContact O-CG1 3.41Å; F293-H354 PolarHBondContact O-CE1 2.93Å; F293-H354 PolarHBondContact O-NE2 3.45Å; F293-V362 HydrophobicContact CD1-CG2 4.19Å; F293-V362 HydrophobicContact CE1-CG2 4.43Å |
| 294 | N | 69.2 | Low | 84.9 | Confident | 69 Ų | 69 | 54.8 Ų | 54.8 | 37% | 0.369 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -101.7 | -16.2 | -174.6 | -63 | -23 | 0 | 0 | 0 | 113.8 | S291 L292 | S291-N294 PolarHBondContact O-N 2.95Å; L292-N294 VanDerWaalsContact C-N 3.35Å |
| 295 | K | 68.6 | Low | 84.8 | Confident | 122 Ų | 122 | 50.8 Ų | 50.8 | 53% | 0.53 | 27% | 0.267 | S | S | . | . | S | Bend | trans | -94.4 | 161.2 | 176.8 | -72 | 172.2 | 179.5 | 163.7 | 0 | 110.4 | S291 E297 H354 | S291-K295 WeakPolarHBondContact O-CG 3.43Å; S291-K295 PolarHBondContact O-N 3.42Å; S291-K295 VanDerWaalsContact O-N 3.08Å; S291-K295 PolarHBondContact OG-NZ 2.81Å; S291-K295 VanDerWaalsContact OG-NZ 3.15Å; K295-E297 PolarHBondContact O-N 2.86Å; K295-H354 PolarHBondContact O-CE1 3.31Å; K295-H354 PolarHBondContact O-NE2 3.19Å |
| 296 | K | 73.7 | Confident | 84.5 | Confident | 209 Ų | 209 | 50 Ų | 50 | 91% | 0.909 | 26% | 0.262 | S | S | * | . | trans | -66 | 67.3 | 169.1 | -167.3 | -177.1 | 179.2 | 178.9 | 0 | 112.1 | ||||
| 297 | E | 83 | Confident | 84.6 | Confident | 40 Ų | 40 | 51.1 Ų | 51.1 | 19% | 0.187 | 27% | 0.269 | C | S | . | . | trans | -85.7 | 156.1 | 173.3 | -167.6 | 63.3 | -135.5 | 0 | 0 | 109.7 | K260 L292 K295 K299 V301 I302 | K260-E297 WeakPolarHBondContact CD-OE1 3.27Å; K260-E297 IonicContact NZ-OE1 3.06Å; K260-E297 PolarHBondContact NZ-OE1 3.36Å; K260-E297 IonicContact NZ-OE2 2.68Å; K260-E297 PolarHBondContact NZ-OE2 2.6Å; L292-E297 HydrophobicContact CD2-CG 4.26Å; L292-E297 WeakPolarHBondContact CD2-OE2 3.32Å; L292-E297 WeakPolarHBondContact O-CB 3.45Å; K295-E297 PolarHBondContact O-N 2.86Å; E297-K299 PolarHBondContact O-N 2.94Å; E297-V301 HydrophobicContact CG-CB 4.29Å; E297-V301 HydrophobicContact CG-CG1 3.98Å; E297-I302 HydrophobicContact CB-CD1 4.1Å; E297-I302 HydrophobicContact CB-CG1 4.21Å; E297-I302 HydrophobicContact CG-CG1 4.26Å | ||
| 298 | N | 86.4 | Confident | 85 | Confident | 47 Ų | 47 | 45.1 Ų | 45.1 | 25% | 0.251 | 23% | 0.227 | S | C | . | . | trans | -62.7 | 130.5 | 176.7 | -174.7 | -36.2 | 0 | 0 | 0 | 110 | E257 E300 V301 I302 | E257-N298 VanDerWaalsContact CD-ND2 3.27Å; E257-N298 HydrophobicContact CG-CB 4.43Å; E257-N298 PolarHBondContact OE1-ND2 3.2Å; N298-E300 PolarHBondContact O-N 3.36Å; N298-E300 WeakPolarHBondContact OD1-CB 3.17Å; N298-E300 PolarHBondContact OD1-N 3.17Å; N298-V301 HydrophobicContact CB-CB 4.34Å; N298-V301 HydrophobicContact CB-CG2 4Å; N298-V301 WeakPolarHBondContact O-CB 3.39Å; N298-V301 PolarHBondContact O-N 3.43Å; N298-I302 PolarHBondContact O-N 3.35Å; N298-I302 VanDerWaalsContact O-N 3.17Å | ||
| 299 | K | 86.6 | Confident | 85.3 | Confident | 107 Ų | 107 | 42.9 Ų | 42.9 | 47% | 0.465 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -53.7 | -37.7 | 177 | 70.1 | 177.3 | -175.6 | 175.6 | 0 | 113.5 | E297 V301 I302 L303 D355 V358 | E297-K299 PolarHBondContact O-N 2.94Å; K299-V301 VanDerWaalsContact C-N 3.32Å; K299-V301 PolarHBondContact O-N 2.84Å; K299-I302 PolarHBondContact O-N 3.47Å; K299-L303 WeakPolarHBondContact O-CB 3.48Å; K299-L303 WeakPolarHBondContact O-CG 3.44Å; K299-L303 PolarHBondContact O-N 3.45Å; K299-D355 HydrophobicContact CD-CB 4.37Å; K299-D355 WeakPolarHBondContact CD-OD2 3.47Å; K299-D355 IonicContact NZ-OD2 2.8Å; K299-D355 PolarHBondContact NZ-OD2 2.78Å; K299-D355 VanDerWaalsContact NZ-OD2 3.14Å; K299-V358 HydrophobicContact CB-CG2 3.87Å |
| 300 | E | 89.9 | Confident | 85.5 | Confident | 84 Ų | 84 | 44.1 Ų | 44.1 | 39% | 0.393 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -65.2 | -38.4 | 179.3 | -172.6 | 179.3 | 167.6 | 0 | 0 | 111.1 | L261 N298 K304 | L261-E300 HydrophobicContact CD2-CB 4.4Å; L261-E300 HydrophobicContact CD2-CG 3.92Å; N298-E300 PolarHBondContact O-N 3.36Å; N298-E300 WeakPolarHBondContact OD1-CB 3.17Å; N298-E300 PolarHBondContact OD1-N 3.17Å; E300-K304 HydrophobicContact CG-CD 4.21Å; E300-K304 WeakPolarHBondContact O-CB 3.21Å; E300-K304 WeakPolarHBondContact O-CG 3.28Å; E300-K304 PolarHBondContact O-N 2.98Å; E300-K304 WeakPolarHBondContact OE1-CE 3.37Å; E300-K304 IonicContact OE1-NZ 3.17Å; E300-K304 PolarHBondContact OE1-NZ 3.43Å |
| 301 | V | 91.2 | Very high | 86.2 | Confident | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.006 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.8 | -48.7 | 175.9 | 169.3 | 0 | 0 | 0 | 0 | 110.2 | F252 K260 L261 L264 E297 N298 K299 L305 | F252-V301 HydrophobicContact CE2-CG1 3.75Å; F252-V301 HydrophobicContact CZ-CG1 3.77Å; K260-V301 HydrophobicContact CB-CG2 4.31Å; K260-V301 HydrophobicContact CD-CG1 4.26Å; L261-V301 HydrophobicContact CD2-CG2 3.86Å; L261-V301 HydrophobicContact CG-CG2 4.1Å; L264-V301 HydrophobicContact CD1-CB 4.35Å; L264-V301 HydrophobicContact CD1-CG1 4.04Å; E297-V301 HydrophobicContact CG-CB 4.29Å; E297-V301 HydrophobicContact CG-CG1 3.98Å; N298-V301 HydrophobicContact CB-CB 4.34Å; N298-V301 HydrophobicContact CB-CG2 4Å; N298-V301 WeakPolarHBondContact O-CB 3.39Å; N298-V301 PolarHBondContact O-N 3.43Å; K299-V301 VanDerWaalsContact C-N 3.32Å; K299-V301 PolarHBondContact O-N 2.84Å; V301-L305 WeakPolarHBondContact O-CB 3.49Å; V301-L305 PolarHBondContact O-N 3.13Å |
| 302 | I | 89.1 | Confident | 86.8 | Confident | 2 Ų | 2 | 43.3 Ų | 43.3 | 1% | 0.01 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.4 | -48.9 | 178.8 | -61.7 | 168.2 | 0 | 0 | 0 | 110.9 | F293 E297 N298 K299 K304 L305 L306 V358 | F293-I302 HydrophobicContact CD1-CG2 3.78Å; F293-I302 HydrophobicContact CE1-CG2 3.69Å; E297-I302 HydrophobicContact CB-CD1 4.1Å; E297-I302 HydrophobicContact CB-CG1 4.21Å; E297-I302 HydrophobicContact CG-CG1 4.26Å; N298-I302 PolarHBondContact O-N 3.35Å; N298-I302 VanDerWaalsContact O-N 3.17Å; K299-I302 PolarHBondContact O-N 3.47Å; I302-K304 VanDerWaalsContact C-N 3.35Å; I302-K304 PolarHBondContact O-N 3.32Å; I302-L305 PolarHBondContact O-N 3.24Å; I302-L306 HydrophobicContact CG2-CD1 4.04Å; I302-L306 HydrophobicContact CG2-CG 4.44Å; I302-L306 WeakPolarHBondContact O-CG 3.29Å; I302-L306 PolarHBondContact O-N 2.82Å; I302-V358 HydrophobicContact CB-CG1 4.37Å; I302-V358 HydrophobicContact CD1-CG1 4.16Å; I302-V358 HydrophobicContact CG2-CG1 3.67Å |
| 303 | L | 89.6 | Confident | 87.2 | Confident | 40 Ų | 40 | 42.8 Ų | 42.8 | 21% | 0.209 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.1 | -41.6 | -177.4 | -70.5 | 174.3 | 0 | 0 | 0 | 111.9 | K299 L306 V307 L357 V358 K361 | K299-L303 WeakPolarHBondContact O-CB 3.48Å; K299-L303 WeakPolarHBondContact O-CG 3.44Å; K299-L303 PolarHBondContact O-N 3.45Å; L303-L306 PolarHBondContact O-N 3.09Å; L303-V307 WeakPolarHBondContact O-CG2 3.14Å; L303-V307 PolarHBondContact O-N 3.29Å; L303-V307 VanDerWaalsContact O-N 3.09Å; L303-L357 HydrophobicContact CD1-CD2 4.11Å; L303-V358 HydrophobicContact CD2-CG2 4.24Å; L303-V358 HydrophobicContact CG-CG2 4.22Å; L303-K361 HydrophobicContact CD2-CB 3.9Å; L303-K361 HydrophobicContact CD2-CG 3.93Å |
| 304 | K | 93.7 | Very high | 87.9 | Confident | 60 Ų | 60 | 46.5 Ų | 46.5 | 26% | 0.261 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -67.2 | -38.7 | 176.3 | -75.9 | -177.5 | -176.6 | -178.9 | 0 | 112.5 | L261 L264 E300 I302 L306 V307 I308 | L261-K304 HydrophobicContact CD2-CD 4.18Å; L264-K304 HydrophobicContact CB-CB 4.41Å; L264-K304 HydrophobicContact CD1-CB 3.94Å; E300-K304 HydrophobicContact CG-CD 4.21Å; E300-K304 WeakPolarHBondContact O-CB 3.21Å; E300-K304 WeakPolarHBondContact O-CG 3.28Å; E300-K304 PolarHBondContact O-N 2.98Å; E300-K304 WeakPolarHBondContact OE1-CE 3.37Å; E300-K304 IonicContact OE1-NZ 3.17Å; E300-K304 PolarHBondContact OE1-NZ 3.43Å; I302-K304 VanDerWaalsContact C-N 3.35Å; I302-K304 PolarHBondContact O-N 3.32Å; K304-L306 VanDerWaalsContact C-N 3.32Å; K304-L306 PolarHBondContact O-N 3.09Å; K304-V307 PolarHBondContact O-N 2.82Å; K304-I308 WeakPolarHBondContact O-CG1 3.47Å; K304-I308 PolarHBondContact O-N 2.91Å; K304-I308 VanDerWaalsContact O-N 3.09Å |
| 305 | L | 94.1 | Very high | 88.8 | Confident | 1 Ų | 1 | 46.1 Ų | 46.1 | 1% | 0.005 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.8 | -41.4 | 174.5 | -176.1 | 64.8 | 0 | 0 | 0 | 111.5 | F252 L264 L289 L292 F293 V301 I302 V307 I308 F309 | F252-L305 HydrophobicContact CE1-CD1 4.18Å; F252-L305 HydrophobicContact CE1-CD2 3.93Å; F252-L305 HydrophobicContact CZ-CD1 4.37Å; F252-L305 HydrophobicContact CZ-CD2 4.08Å; L264-L305 HydrophobicContact CD2-CB 4.04Å; L264-L305 HydrophobicContact CD2-CD1 3.97Å; L289-L305 HydrophobicContact CD1-CD2 4.11Å; L292-L305 HydrophobicContact CD1-CD2 4.43Å; F293-L305 HydrophobicContact CE2-CD2 4.2Å; F293-L305 HydrophobicContact CZ-CD2 3.88Å; V301-L305 WeakPolarHBondContact O-CB 3.49Å; V301-L305 PolarHBondContact O-N 3.13Å; I302-L305 PolarHBondContact O-N 3.24Å; L305-V307 PolarHBondContact O-N 3.36Å; L305-I308 WeakPolarHBondContact O-CB 3.11Å; L305-I308 PolarHBondContact O-N 3.14Å; L305-F309 HydrophobicContact CD1-CD1 4.4Å; L305-F309 HydrophobicContact CD1-CE1 3.67Å; L305-F309 HydrophobicContact CD1-CE2 4.3Å; L305-F309 HydrophobicContact CD1-CZ 3.61Å; L305-F309 HydrophobicContact CD2-CE2 4.1Å; L305-F309 HydrophobicContact CD2-CZ 3.95Å; L305-F309 HydrophobicContact CG-CD2 4.42Å; L305-F309 HydrophobicContact CG-CE1 4.1Å; L305-F309 HydrophobicContact CG-CE2 3.82Å; L305-F309 HydrophobicContact CG-CZ 3.64Å; L305-F309 WeakPolarHBondContact O-CG 3.39Å; L305-F309 PolarHBondContact O-N 3.35Å |
| 306 | L | 91.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.6 | -39.2 | 175.6 | -70 | 169.8 | 0 | 0 | 0 | 112.4 | F293 I302 L303 K304 I308 F309 E310 K361 V362 F365 | F293-L306 HydrophobicContact CE1-CD2 3.81Å; F293-L306 HydrophobicContact CE1-CG 4.09Å; F293-L306 HydrophobicContact CZ-CD2 4.21Å; I302-L306 HydrophobicContact CG2-CD1 4.04Å; I302-L306 HydrophobicContact CG2-CG 4.44Å; I302-L306 WeakPolarHBondContact O-CG 3.29Å; I302-L306 PolarHBondContact O-N 2.82Å; L303-L306 PolarHBondContact O-N 3.09Å; K304-L306 VanDerWaalsContact C-N 3.32Å; K304-L306 PolarHBondContact O-N 3.09Å; L306-I308 VanDerWaalsContact C-N 3.31Å; L306-I308 PolarHBondContact O-N 3.36Å; L306-F309 PolarHBondContact O-N 3.26Å; L306-E310 WeakPolarHBondContact O-CB 3.26Å; L306-E310 WeakPolarHBondContact O-CG 3.35Å; L306-E310 PolarHBondContact O-N 2.97Å; L306-K361 HydrophobicContact CD1-CB 4.24Å; L306-K361 HydrophobicContact CD1-CG 3.93Å; L306-V362 HydrophobicContact CD1-CG2 3.62Å; L306-V362 HydrophobicContact CD2-CG2 4.32Å; L306-F365 HydrophobicContact CD2-CB 4.35Å; L306-F365 HydrophobicContact CD2-CD1 3.8Å; L306-F365 HydrophobicContact CD2-CE1 4.5Å; L306-F365 HydrophobicContact CD2-CG 4.21Å |
| 307 | V | 93.5 | Very high | 89.9 | Confident | 50 Ų | 50 | 39 Ų | 39 | 30% | 0.303 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.3 | -40.4 | 175 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | L268 L303 K304 L305 F309 E310 N311 | L268-V307 HydrophobicContact CD1-CG1 3.85Å; L303-V307 WeakPolarHBondContact O-CG2 3.14Å; L303-V307 PolarHBondContact O-N 3.29Å; L303-V307 VanDerWaalsContact O-N 3.09Å; K304-V307 PolarHBondContact O-N 2.82Å; L305-V307 PolarHBondContact O-N 3.36Å; V307-F309 VanDerWaalsContact C-N 3.35Å; V307-F309 PolarHBondContact O-N 3.14Å; V307-E310 PolarHBondContact O-N 3.46Å; V307-N311 PolarHBondContact O-N 3.25Å; V307-N311 PolarHBondContact O-OD1 3.33Å |
| 308 | I | 95.8 | Very high | 89.3 | Confident | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.005 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.8 | -46.5 | 174.8 | -67.5 | 163.4 | 0 | 0 | 0 | 110.4 | L264 L267 L268 A271 K304 L305 L306 E310 N311 I312 | L264-I308 HydrophobicContact CB-CD1 4.24Å; L264-I308 HydrophobicContact CD2-CD1 3.49Å; L264-I308 VanDerWaalsContact CD2-CD1 3.49Å; L264-I308 HydrophobicContact CG-CD1 4.48Å; L264-I308 WeakPolarHBondContact O-CD1 3.49Å; L267-I308 HydrophobicContact CB-CD1 3.83Å; L268-I308 HydrophobicContact CB-CD1 4.42Å; L268-I308 HydrophobicContact CB-CG1 4Å; L268-I308 HydrophobicContact CD1-CG1 4.06Å; A271-I308 HydrophobicContact CB-CG2 3.94Å; K304-I308 WeakPolarHBondContact O-CG1 3.47Å; K304-I308 PolarHBondContact O-N 2.91Å; K304-I308 VanDerWaalsContact O-N 3.09Å; L305-I308 WeakPolarHBondContact O-CB 3.11Å; L305-I308 PolarHBondContact O-N 3.14Å; L306-I308 VanDerWaalsContact C-N 3.31Å; L306-I308 PolarHBondContact O-N 3.36Å; I308-E310 VanDerWaalsContact C-N 3.34Å; I308-E310 PolarHBondContact O-N 3.44Å; I308-N311 PolarHBondContact O-N 3.5Å; I308-I312 HydrophobicContact CG2-CD1 3.85Å; I308-I312 VanDerWaalsContact O-CG1 3.28Å; I308-I312 WeakPolarHBondContact O-CG1 3.31Å; I308-I312 PolarHBondContact O-N 2.94Å |
| 309 | F | 93.5 | Very high | 88.1 | Confident | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.9 | -37.7 | 177.8 | -62.9 | -17.5 | 0 | 0 | 0 | 112.6 | L289 F293 L305 L306 V307 I312 N313 L333 F336 L337 F365 | L289-F309 HydrophobicContact CD2-CZ 4.18Å; F293-F309 HydrophobicContact CE2-CE2 4.45Å; F293-F309 HydrophobicContact CZ-CE2 4.07Å; L305-F309 HydrophobicContact CD1-CD1 4.4Å; L305-F309 HydrophobicContact CD1-CE1 3.67Å; L305-F309 HydrophobicContact CD1-CE2 4.3Å; L305-F309 HydrophobicContact CD1-CZ 3.61Å; L305-F309 HydrophobicContact CD2-CE2 4.1Å; L305-F309 HydrophobicContact CD2-CZ 3.95Å; L305-F309 HydrophobicContact CG-CD2 4.42Å; L305-F309 HydrophobicContact CG-CE1 4.1Å; L305-F309 HydrophobicContact CG-CE2 3.82Å; L305-F309 HydrophobicContact CG-CZ 3.64Å; L305-F309 WeakPolarHBondContact O-CG 3.39Å; L305-F309 PolarHBondContact O-N 3.35Å; L306-F309 PolarHBondContact O-N 3.26Å; V307-F309 VanDerWaalsContact C-N 3.35Å; V307-F309 PolarHBondContact O-N 3.14Å; F309-I312 PolarHBondContact O-N 3.36Å; F309-N313 VanDerWaalsContact O-CB 3.27Å; F309-N313 WeakPolarHBondContact O-CB 3.22Å; F309-N313 PolarHBondContact O-N 3.09Å; F309-L333 HydrophobicContact CD1-CD1 4.34Å; F309-L333 HydrophobicContact CE1-CD1 3.66Å; F309-L333 HydrophobicContact CZ-CD1 4.19Å; F309-F336 AromaticContact CE2-CE1 3.86Å; F309-F336 HydrophobicContact CE2-CE1 3.86Å; F309-F336 HydrophobicContact CZ-CD1 4.38Å; F309-F336 AromaticContact CZ-CE1 3.81Å; F309-F336 HydrophobicContact CZ-CE1 3.81Å; F309-L337 HydrophobicContact CB-CD2 4.22Å; F309-L337 HydrophobicContact CD1-CD2 4.25Å; F309-L337 HydrophobicContact CD2-CD2 3.93Å; F309-L337 HydrophobicContact CE2-CD2 4.29Å; F309-L337 HydrophobicContact CG-CD2 3.91Å; F309-F365 HydrophobicContact CB-CE1 3.97Å; F309-F365 HydrophobicContact CB-CE2 3.83Å; F309-F365 HydrophobicContact CB-CZ 3.4Å; F309-F365 VanDerWaalsContact CB-CZ 3.4Å; F309-F365 HydrophobicContact CD2-CE1 4.11Å; F309-F365 HydrophobicContact CD2-CZ 4.36Å; F309-F365 HydrophobicContact CG-CZ 4.34Å |
| 310 | E | 91.5 | Very high | 86.6 | Confident | 26 Ų | 26 | 40.9 Ų | 40.9 | 12% | 0.121 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.8 | -48.9 | 173 | -77.8 | 175 | 174.6 | 0 | 0 | 111.2 | L306 V307 I308 I312 N313 D314 K361 F365 | L306-E310 WeakPolarHBondContact O-CB 3.26Å; L306-E310 WeakPolarHBondContact O-CG 3.35Å; L306-E310 PolarHBondContact O-N 2.97Å; V307-E310 PolarHBondContact O-N 3.46Å; I308-E310 VanDerWaalsContact C-N 3.34Å; I308-E310 PolarHBondContact O-N 3.44Å; E310-I312 VanDerWaalsContact C-N 3.35Å; E310-I312 PolarHBondContact O-N 2.89Å; E310-N313 PolarHBondContact O-N 3.19Å; E310-D314 WeakPolarHBondContact O-CB 3.45Å; E310-D314 PolarHBondContact O-N 2.92Å; E310-K361 VanDerWaalsContact OE1-CE 3.25Å; E310-K361 WeakPolarHBondContact OE1-CE 3.47Å; E310-K361 IonicContact OE1-NZ 3.11Å; E310-K361 PolarHBondContact OE1-NZ 2.8Å; E310-K361 IonicContact OE2-NZ 2.86Å; E310-K361 PolarHBondContact OE2-NZ 3.48Å; E310-F365 HydrophobicContact CB-CD2 4.46Å; E310-F365 HydrophobicContact CG-CD2 3.42Å; E310-F365 VanDerWaalsContact CG-CD2 3.42Å; E310-F365 HydrophobicContact CG-CE2 3.99Å; E310-F365 HydrophobicContact CG-CG 4.33Å |
| 311 | N | 93.6 | Very high | 84.9 | Confident | 37 Ų | 37 | 42.8 Ų | 42.8 | 20% | 0.198 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.4 | -41.3 | 179 | -72.6 | 2.2 | 0 | 0 | 0 | 112.1 | L268 A271 E272 V307 I308 D314 N315 | L268-N311 WeakPolarHBondContact CD1-ND2 3.32Å; A271-N311 HydrophobicContact CB-CB 4.02Å; E272-N311 WeakPolarHBondContact CG-ND2 3.37Å; V307-N311 PolarHBondContact O-N 3.25Å; V307-N311 PolarHBondContact O-OD1 3.33Å; I308-N311 PolarHBondContact O-N 3.5Å; N311-D314 PolarHBondContact O-N 3.46Å; N311-N315 WeakPolarHBondContact O-CB 3.33Å; N311-N315 VanDerWaalsContact O-CG 3.31Å; N311-N315 PolarHBondContact O-N 3.13Å; N311-N315 VanDerWaalsContact O-N 3.15Å; N311-N315 PolarHBondContact O-ND2 2.87Å |
| 312 | I | 92.7 | Very high | 83.1 | Confident | 1 Ų | 1 | 49.5 Ų | 49.5 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.8 | -46.2 | 175.5 | -68.8 | 168.7 | 0 | 0 | 0 | 110.2 | A271 T277 L280 L281 I308 F309 E310 D314 N315 F316 L333 | A271-I312 HydrophobicContact CB-CD1 4.4Å; A271-I312 HydrophobicContact CB-CG1 3.88Å; T277-I312 HydrophobicContact CG2-CG2 4.19Å; L280-I312 HydrophobicContact CB-CD1 3.99Å; L280-I312 HydrophobicContact CB-CG1 4.4Å; L280-I312 HydrophobicContact CD1-CD1 4.07Å; L280-I312 HydrophobicContact CD1-CG1 3.97Å; L280-I312 HydrophobicContact CG-CD1 4.44Å; L281-I312 HydrophobicContact CD1-CG2 4.32Å; L281-I312 HydrophobicContact CD2-CG2 3.65Å; L281-I312 HydrophobicContact CG-CG2 3.8Å; I308-I312 HydrophobicContact CG2-CD1 3.85Å; I308-I312 VanDerWaalsContact O-CG1 3.28Å; I308-I312 WeakPolarHBondContact O-CG1 3.31Å; I308-I312 PolarHBondContact O-N 2.94Å; F309-I312 PolarHBondContact O-N 3.36Å; E310-I312 VanDerWaalsContact C-N 3.35Å; E310-I312 PolarHBondContact O-N 2.89Å; I312-D314 PolarHBondContact O-N 3.34Å; I312-N315 PolarHBondContact O-N 3.24Å; I312-F316 WeakPolarHBondContact O-CB 3.36Å; I312-F316 PolarHBondContact O-N 3.21Å; I312-F316 VanDerWaalsContact O-N 3.14Å; I312-L333 HydrophobicContact CD1-CD2 3.67Å |
| 313 | N | 89.1 | Confident | 81.3 | Confident | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.2 | -41 | -179.9 | -178.7 | 75.9 | 0 | 0 | 0 | 112.1 | F309 E310 N315 F316 W318 F365 L369 H372 | F309-N313 VanDerWaalsContact O-CB 3.27Å; F309-N313 WeakPolarHBondContact O-CB 3.22Å; F309-N313 PolarHBondContact O-N 3.09Å; E310-N313 PolarHBondContact O-N 3.19Å; N313-N315 VanDerWaalsContact C-N 3.28Å; N313-N315 PolarHBondContact O-N 3.44Å; N313-F316 PolarHBondContact O-N 3.47Å; N313-W318 PolarHBondContact OD1-NE1 3.05Å; N313-F365 HydrophobicContact CB-CE2 4.46Å; N313-L369 WeakPolarHBondContact OD1-CD1 3.31Å; N313-H372 PolarHBondContact ND2-ND1 2.86Å |
| 314 | D | 89.4 | Confident | 79.7 | Confident | 80 Ų | 80 | 52.9 Ų | 52.9 | 43% | 0.428 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -68.5 | -30.4 | -179.6 | -69.7 | -4.1 | 0 | 0 | 0 | 112.2 | E310 N311 I312 K368 | E310-D314 WeakPolarHBondContact O-CB 3.45Å; E310-D314 PolarHBondContact O-N 2.92Å; N311-D314 PolarHBondContact O-N 3.46Å; I312-D314 PolarHBondContact O-N 3.34Å; D314-K368 WeakPolarHBondContact OD1-CE 3.39Å; D314-K368 IonicContact OD1-NZ 3.15Å; D314-K368 PolarHBondContact OD1-NZ 3.38Å; D314-K368 IonicContact OD2-NZ 3.99Å; D314-K368 PolarHBondContact OD2-NZ 3.41Å |
| 315 | N | 88.4 | Confident | 78.1 | Confident | 60 Ų | 60 | 52.4 Ų | 52.4 | 32% | 0.321 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -85.7 | -9 | 177.8 | -71.9 | -25.9 | 0 | 0 | 0 | 113.4 | A271 P274 T277 N311 I312 N313 | A271-N315 PolarHBondContact O-ND2 3.46Å; P274-N315 HydrophobicContact CB-CB 4.29Å; T277-N315 HydrophobicContact CG2-CB 4.04Å; T277-N315 WeakPolarHBondContact OG1-CB 3.41Å; N311-N315 WeakPolarHBondContact O-CB 3.33Å; N311-N315 VanDerWaalsContact O-CG 3.31Å; N311-N315 PolarHBondContact O-N 3.13Å; N311-N315 VanDerWaalsContact O-N 3.15Å; N311-N315 PolarHBondContact O-ND2 2.87Å; I312-N315 PolarHBondContact O-N 3.24Å; N313-N315 VanDerWaalsContact C-N 3.28Å; N313-N315 PolarHBondContact O-N 3.44Å |
| 316 | F | 85.4 | Confident | 76.6 | Confident | 15 Ų | 15 | 58.1 Ų | 58.1 | 7% | 0.066 | 29% | 0.294 | C | S | . | . | trans | -110.6 | 128.2 | -175.1 | -171.2 | -107.3 | 0 | 0 | 0 | 112.4 | T277 L281 I312 N313 W318 F328 F334 | T277-F316 HydrophobicContact CG2-CB 3.82Å; T277-F316 HydrophobicContact CG2-CD2 4.28Å; T277-F316 HydrophobicContact CG2-CG 4.49Å; L281-F316 HydrophobicContact CD1-CB 4Å; L281-F316 HydrophobicContact CD1-CD1 3.96Å; L281-F316 HydrophobicContact CD1-CD2 3.27Å; L281-F316 HydrophobicContact CD1-CE1 4.26Å; L281-F316 HydrophobicContact CD1-CE2 3.63Å; L281-F316 HydrophobicContact CD1-CG 3.45Å; L281-F316 VanDerWaalsContact CD1-CG 3.45Å; L281-F316 HydrophobicContact CD1-CZ 4.12Å; I312-F316 WeakPolarHBondContact O-CB 3.36Å; I312-F316 PolarHBondContact O-N 3.21Å; I312-F316 VanDerWaalsContact O-N 3.14Å; N313-F316 PolarHBondContact O-N 3.47Å; F316-W318 AromaticContact CD1-CD1 3.88Å; F316-W318 AromaticContact CD1-CD2 3.66Å; F316-W318 HydrophobicContact CD1-CD2 3.66Å; F316-W318 AromaticContact CD1-CE2 3.73Å; F316-W318 HydrophobicContact CD1-CE3 4.2Å; F316-W318 AromaticContact CD1-CG 3.82Å; F316-W318 HydrophobicContact CD1-CG 3.82Å; F316-W318 HydrophobicContact CD1-CZ2 4.3Å; F316-W318 AromaticContact CD1-NE1 3.86Å; F316-W318 HydrophobicContact CE1-CB 4.47Å; F316-W318 AromaticContact CE1-CD2 3.78Å; F316-W318 HydrophobicContact CE1-CD2 3.78Å; F316-W318 AromaticContact CE1-CE3 3.88Å; F316-W318 HydrophobicContact CE1-CE3 3.88Å; F316-W318 HydrophobicContact CE1-CG 4.05Å; F316-W318 HydrophobicContact CE1-CZ3 4.44Å; F316-F328 HydrophobicContact CE2-CZ 4.26Å; F316-F328 HydrophobicContact CZ-CE2 4.24Å; F316-F328 HydrophobicContact CZ-CZ 4.28Å; F316-F334 HydrophobicContact CE1-CD2 4.32Å; F316-F334 AromaticContact CE1-CE2 3.86Å; F316-F334 HydrophobicContact CE1-CE2 3.86Å; F316-F334 HydrophobicContact CZ-CE2 4.14Å | ||
| 317 | K | 79.9 | Confident | 75.7 | Confident | 166 Ų | 166 | 62.2 Ų | 62.2 | 72% | 0.722 | 31% | 0.313 | S | S | * | . | trans | -90.7 | 110.3 | 171.8 | -64.8 | -175.9 | 178.9 | -175.5 | 0 | 109.2 | E319 | K317-E319 PolarHBondContact O-N 2.96Š| ||
| 318 | W | 71.8 | Confident | 75.3 | Confident | 17 Ų | 17 | 60.3 Ų | 60.3 | 6% | 0.064 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73 | -11.5 | -179 | -67.2 | 87.8 | 0 | 0 | 0 | 114.2 | N313 F316 E320 F334 L337 K338 L369 H372 M373 | N313-W318 PolarHBondContact OD1-NE1 3.05Å; F316-W318 AromaticContact CD1-CD1 3.88Å; F316-W318 AromaticContact CD1-CD2 3.66Å; F316-W318 HydrophobicContact CD1-CD2 3.66Å; F316-W318 AromaticContact CD1-CE2 3.73Å; F316-W318 HydrophobicContact CD1-CE3 4.2Å; F316-W318 AromaticContact CD1-CG 3.82Å; F316-W318 HydrophobicContact CD1-CG 3.82Å; F316-W318 HydrophobicContact CD1-CZ2 4.3Å; F316-W318 AromaticContact CD1-NE1 3.86Å; F316-W318 HydrophobicContact CE1-CB 4.47Å; F316-W318 AromaticContact CE1-CD2 3.78Å; F316-W318 HydrophobicContact CE1-CD2 3.78Å; F316-W318 AromaticContact CE1-CE3 3.88Å; F316-W318 HydrophobicContact CE1-CE3 3.88Å; F316-W318 HydrophobicContact CE1-CG 4.05Å; F316-W318 HydrophobicContact CE1-CZ3 4.44Å; W318-E320 VanDerWaalsContact C-N 3.26Å; W318-E320 PolarHBondContact O-N 3.43Å; W318-F334 HydrophobicContact CE3-CD2 4.41Å; W318-F334 AromaticContact CE3-CE2 3.64Å; W318-F334 HydrophobicContact CE3-CE2 3.64Å; W318-F334 HydrophobicContact CE3-CZ 4.25Å; W318-F334 HydrophobicContact CH2-CD2 4.02Å; W318-F334 HydrophobicContact CH2-CE2 4.04Å; W318-F334 AromaticContact CZ3-CD2 3.64Å; W318-F334 HydrophobicContact CZ3-CD2 3.64Å; W318-F334 AromaticContact CZ3-CE2 3.21Å; W318-F334 HydrophobicContact CZ3-CE2 3.21Å; W318-F334 AromaticContact CZ3-CZ 3.87Å; W318-F334 HydrophobicContact CZ3-CZ 3.87Å; W318-L337 HydrophobicContact CH2-CB 4.25Å; W318-K338 HydrophobicContact CZ3-CG 4.02Å; W318-L369 HydrophobicContact CH2-CD1 4.41Å; W318-L369 HydrophobicContact CZ2-CD1 3.67Å; W318-H372 WeakPolarHBondContact CB-O 3.25Å; W318-M373 HydrophobicContact CB-CG 4.48Å; W318-M373 HydrophobicContact CD2-CG 3.49Å; W318-M373 VanDerWaalsContact CD2-CG 3.49Å; W318-M373 HydrophobicContact CD2-SD 4.24Å; W318-M373 HydrophobicContact CE3-CG 3.61Å; W318-M373 HydrophobicContact CE3-SD 3.83Å; W318-M373 HydrophobicContact CG-CG 3.9Å; W318-M373 HydrophobicContact CH2-CG 4.3Å; W318-M373 HydrophobicContact CH2-SD 3.85Å; W318-M373 HydrophobicContact CZ2-CG 4.2Å; W318-M373 HydrophobicContact CZ2-SD 4.24Å; W318-M373 HydrophobicContact CZ3-CG 4.01Å; W318-M373 HydrophobicContact CZ3-SD 3.62Å |
| 319 | E | 60.3 | Low | 74.8 | Confident | 150 Ų | 150 | 62 Ų | 62 | 70% | 0.701 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | 4.3 | 178.8 | -63.5 | 179.1 | 168.8 | 0 | 0 | 114.4 | K317 N321 P375 | K317-E319 PolarHBondContact O-N 2.96Å; E319-N321 PolarHBondContact O-N 2.88Å; E319-P375 HydrophobicContact CG-CG 4.25Å; E319-P375 WeakPolarHBondContact OE1-CG 3.28Å |
| 320 | E | 54.5 | Low | 74.4 | Confident | 68 Ų | 68 | 70.8 Ų | 70.8 | 32% | 0.318 | 36% | 0.36 | S | S | . | . | S | Bend | trans | -63.2 | 129.9 | 173.1 | -60.2 | -169.8 | 158.8 | 0 | 0 | 109.9 | R278 W318 T324 | R278-E320 IonicContact CZ-OE2 2.73Å; R278-E320 IonicContact NE-OE2 2.85Å; R278-E320 IonicContact NH2-OE1 3.95Å; R278-E320 IonicContact NH2-OE2 2.86Å; R278-E320 PolarHBondContact NH2-OE2 2.88Å; W318-E320 VanDerWaalsContact C-N 3.26Å; W318-E320 PolarHBondContact O-N 3.43Å; E320-T324 HydrophobicContact CB-CG2 4.02Å; E320-T324 WeakPolarHBondContact CB-OG1 3.43Å; E320-T324 WeakPolarHBondContact OE2-CB 3.34Å; E320-T324 VanDerWaalsContact OE2-CG2 3.25Å; E320-T324 WeakPolarHBondContact OE2-CG2 3.45Å |
| 321 | N | 55.5 | Low | 74.2 | Confident | 124 Ų | 124 | 71.1 Ų | 71.1 | 66% | 0.663 | 37% | 0.371 | S | S | * | . | trans | -40.5 | 154.3 | -177.5 | -63.2 | -46.1 | 0 | 0 | 0 | 114.2 | E319 P323 T324 | E319-N321 PolarHBondContact O-N 2.88Å; N321-P323 VanDerWaalsContact C-N 3.3Å; N321-P323 HydrophobicContact CB-CG 3.84Å; N321-T324 PolarHBondContact N-OG1 3.11Å; N321-T324 VanDerWaalsContact N-OG1 3.16Å; N321-T324 WeakPolarHBondContact O-CB 3.48Å; N321-T324 PolarHBondContact O-N 2.85Å; N321-T324 PolarHBondContact O-OG1 3.17Å | ||
| 322 | E | 52 | Low | 74.3 | Confident | 141 Ų | 141 | 69.4 Ų | 69.4 | 66% | 0.659 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -33.6 | -47.3 | 169.4 | -86.7 | -91.6 | 147.3 | 0 | 0 | 116.1 | T324 Q325 N326 | E322-T324 VanDerWaalsContact C-N 3.26Å; E322-T324 PolarHBondContact O-N 3.49Å; E322-Q325 PolarHBondContact O-N 2.96Å; E322-Q325 VanDerWaalsContact O-N 3.11Å; E322-N326 PolarHBondContact O-N 3.17Å; E322-N326 PolarHBondContact O-ND2 3.35Å |
| 323 | P | 52.5 | Low | 74.4 | Confident | 88 Ų | 88 | 69.3 Ų | 69.3 | 57% | 0.571 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -61.2 | -24.8 | 177.1 | 20.1 | -34.6 | 0 | 0 | 0 | 115.8 | N321 | N321-P323 VanDerWaalsContact C-N 3.3Å; N321-P323 HydrophobicContact CB-CG 3.84Å |
| 324 | T | 55.9 | Low | 74.5 | Confident | 26 Ų | 26 | 69.4 Ų | 69.4 | 16% | 0.16 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -81.1 | -27.5 | 176.5 | 12.7 | 0 | 0 | 0 | 0 | 112.1 | E320 N321 E322 Q327 | E320-T324 HydrophobicContact CB-CG2 4.02Å; E320-T324 WeakPolarHBondContact CB-OG1 3.43Å; E320-T324 WeakPolarHBondContact OE2-CB 3.34Å; E320-T324 VanDerWaalsContact OE2-CG2 3.25Å; E320-T324 WeakPolarHBondContact OE2-CG2 3.45Å; N321-T324 PolarHBondContact N-OG1 3.11Å; N321-T324 VanDerWaalsContact N-OG1 3.16Å; N321-T324 WeakPolarHBondContact O-CB 3.48Å; N321-T324 PolarHBondContact O-N 2.85Å; N321-T324 PolarHBondContact O-OG1 3.17Å; E322-T324 VanDerWaalsContact C-N 3.26Å; E322-T324 PolarHBondContact O-N 3.49Å; T324-Q327 WeakPolarHBondContact O-CB 3.41Å; T324-Q327 PolarHBondContact O-N 3.05Å |
| 325 | Q | 59.6 | Low | 74.5 | Confident | 50 Ų | 50 | 69.1 Ų | 69.1 | 23% | 0.234 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -73.9 | -31.3 | 172.7 | -55.9 | -169.5 | 16.1 | 0 | 0 | 111.7 | E322 Q327 F328 F334 | E322-Q325 PolarHBondContact O-N 2.96Å; E322-Q325 VanDerWaalsContact O-N 3.11Å; Q325-Q327 PolarHBondContact O-N 3.06Å; Q325-Q327 VanDerWaalsContact O-N 3.11Å; Q325-F328 PolarHBondContact O-N 3.23Å; Q325-F334 HydrophobicContact CB-CE1 4.47Å; Q325-F334 HydrophobicContact CB-CZ 4.28Å; Q325-F334 HydrophobicContact CG-CZ 4.17Å |
| 326 | N | 61.5 | Low | 74.6 | Confident | 120 Ų | 120 | 67.3 Ų | 67.3 | 64% | 0.642 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.6 | -4.4 | 174.2 | -67.1 | -24.3 | 0 | 0 | 0 | 114.2 | E322 F328 | E322-N326 PolarHBondContact O-N 3.17Å; E322-N326 PolarHBondContact O-ND2 3.35Å; N326-F328 VanDerWaalsContact C-N 3.33Å |
| 327 | Q | 74 | Confident | 74.8 | Confident | 86 Ų | 86 | 66.6 Ų | 66.6 | 40% | 0.402 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | -10.9 | 176 | -62.4 | -179.2 | 18.3 | 0 | 0 | 113.3 | T324 Q325 | T324-Q327 WeakPolarHBondContact O-CB 3.41Å; T324-Q327 PolarHBondContact O-N 3.05Å; Q325-Q327 PolarHBondContact O-N 3.06Å; Q325-Q327 VanDerWaalsContact O-N 3.11Å |
| 328 | F | 85.2 | Confident | 75 | Confident | 10 Ų | 10 | 61.4 Ų | 61.4 | 4% | 0.044 | 32% | 0.32 | C | S | . | . | S | Bend | trans | -98.6 | 130 | 178.9 | -57.8 | -72.7 | 0 | 0 | 0 | 109.7 | L281 R282 F316 Q325 N326 F334 F335 | L281-F328 HydrophobicContact CB-CD1 4.18Å; L281-F328 HydrophobicContact CB-CE1 3.5Å; L281-F328 HydrophobicContact CB-CZ 4.07Å; L281-F328 HydrophobicContact CD1-CZ 4.41Å; R282-F328 HydrophobicContact CB-CD1 4.43Å; R282-F328 HydrophobicContact CG-CD1 3.67Å; R282-F328 HydrophobicContact CG-CE1 3.71Å; F316-F328 HydrophobicContact CE2-CZ 4.26Å; F316-F328 HydrophobicContact CZ-CE2 4.24Å; F316-F328 HydrophobicContact CZ-CZ 4.28Å; Q325-F328 PolarHBondContact O-N 3.23Å; N326-F328 VanDerWaalsContact C-N 3.33Å; F328-F334 HydrophobicContact CB-CB 4Å; F328-F334 HydrophobicContact CB-CD1 3.85Å; F328-F334 HydrophobicContact CB-CG 4.1Å; F328-F334 HydrophobicContact CD1-CB 3.91Å; F328-F334 HydrophobicContact CD1-CG 4.31Å; F328-F334 HydrophobicContact CD2-CB 4.09Å; F328-F334 AromaticContact CD2-CD1 3.67Å; F328-F334 HydrophobicContact CD2-CD1 3.67Å; F328-F334 AromaticContact CD2-CD2 3.81Å; F328-F334 HydrophobicContact CD2-CD2 3.81Å; F328-F334 AromaticContact CD2-CE1 3.93Å; F328-F334 HydrophobicContact CD2-CE1 3.93Å; F328-F334 HydrophobicContact CD2-CE2 4.06Å; F328-F334 AromaticContact CD2-CG 3.58Å; F328-F334 HydrophobicContact CD2-CG 3.58Å; F328-F334 HydrophobicContact CD2-CZ 4.11Å; F328-F334 HydrophobicContact CE1-CB 4.43Å; F328-F334 HydrophobicContact CE2-CD1 4.47Å; F328-F334 AromaticContact CE2-CD2 3.8Å; F328-F334 HydrophobicContact CE2-CD2 3.8Å; F328-F334 AromaticContact CE2-CE2 3.96Å; F328-F334 HydrophobicContact CE2-CE2 3.96Å; F328-F334 HydrophobicContact CE2-CG 4.05Å; F328-F334 HydrophobicContact CE2-CZ 4.36Å; F328-F334 HydrophobicContact CG-CB 3.73Å; F328-F334 AromaticContact CG-CD1 3.9Å; F328-F334 HydrophobicContact CG-CD1 3.9Å; F328-F334 HydrophobicContact CG-CD2 4.32Å; F328-F334 AromaticContact CG-CG 3.73Å; F328-F334 HydrophobicContact CG-CG 3.73Å; F328-F334 HydrophobicContact CZ-CD2 4.3Å; F328-F335 HydrophobicContact CB-CD2 4.48Å; F328-F335 HydrophobicContact CB-CE2 4.42Å; F328-F335 WeakPolarHBondContact O-CE2 3.5Å |
| 329 | G | 85.1 | Confident | 75.5 | Confident | 37 Ų | 37 | 66.5 Ų | 66.5 | 38% | 0.381 | 35% | 0.345 | S | S | . | . | P | Polyproline II helix | trans | -75.9 | 156.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | G331 S332 F335 | G329-G331 PolarHBondContact O-N 3.5Å; G329-S332 WeakPolarHBondContact O-CB 3.46Å; G329-S332 PolarHBondContact O-N 2.97Å; G329-S332 VanDerWaalsContact O-N 3.09Å; G329-S332 PolarHBondContact O-OG 3.4Å; G329-F335 VanDerWaalsContact O-CD2 3.31Å; G329-F335 WeakPolarHBondContact O-CD2 3.49Å |
| 330 | E | 83.9 | Confident | 76.5 | Confident | 184 Ų | 184 | 59.9 Ų | 59.9 | 86% | 0.86 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.5 | 133.7 | 166.2 | -163.1 | 174.9 | 177.9 | 0 | 0 | 109.2 | Q284 | Q284-E330 PolarHBondContact NE2-O 3.02Å; Q284-E330 PolarHBondContact OE1-O 3.29Å |
| 331 | G | 88.5 | Confident | 77.5 | Confident | 34 Ų | 34 | 58.3 Ų | 58.3 | 35% | 0.351 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.1 | 1.3 | -173.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | Q284 V285 G329 | Q284-G331 PolarHBondContact OE1-O 3.39Å; V285-G331 WeakPolarHBondContact CG2-O 3.39Å; V285-G331 PolarHBondContact N-O 2.7Å; G329-G331 PolarHBondContact O-N 3.5Å |
| 332 | S | 94.8 | Very high | 78.2 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 31% | 0.307 | C | S | . | . | B | Isolated β-bridge | trans | -73 | 160.1 | 174 | 62.7 | 0 | 0 | 0 | 0 | 113.1 | L281 A283 G329 F334 F335 F336 | L281-S332 WeakPolarHBondContact O-CB 3.49Å; A283-S332 CarbonylContact O-C 3.5Å; A283-S332 VanDerWaalsContact O-CA 3.29Å; A283-S332 WeakPolarHBondContact O-CA 3.17Å; G329-S332 WeakPolarHBondContact O-CB 3.46Å; G329-S332 PolarHBondContact O-N 2.97Å; G329-S332 VanDerWaalsContact O-N 3.09Å; G329-S332 PolarHBondContact O-OG 3.4Å; S332-F334 PolarHBondContact O-N 2.86Å; S332-F335 PolarHBondContact O-N 3.28Å; S332-F335 VanDerWaalsContact O-N 3.16Å; S332-F336 PolarHBondContact O-N 3.25Å |
| 333 | L | 94.3 | Very high | 78.9 | Confident | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -57.4 | -34.1 | 174.4 | -179.2 | 62.8 | 0 | 0 | 0 | 111.9 | F249 L280 L281 A283 V285 F309 I312 F336 L337 | F249-L333 HydrophobicContact CE2-CD2 4.3Å; F249-L333 HydrophobicContact CZ-CD2 3.93Å; L280-L333 WeakPolarHBondContact O-CB 3.48Å; L280-L333 WeakPolarHBondContact O-CD2 3.41Å; L281-L333 PolarHBondContact O-N 3.21Å; A283-L333 PolarHBondContact O-N 2.81Å; V285-L333 HydrophobicContact CG1-CB 3.79Å; V285-L333 HydrophobicContact CG1-CD1 3.99Å; V285-L333 HydrophobicContact CG1-CG 4.44Å; F309-L333 HydrophobicContact CD1-CD1 4.34Å; F309-L333 HydrophobicContact CE1-CD1 3.66Å; F309-L333 HydrophobicContact CZ-CD1 4.19Å; I312-L333 HydrophobicContact CD1-CD2 3.67Å; L333-F336 HydrophobicContact CD1-CD1 3.98Å; L333-F336 WeakPolarHBondContact O-CB 3.32Å; L333-F336 PolarHBondContact O-N 3.2Å; L333-L337 HydrophobicContact CD1-CG 4.24Å; L333-L337 HydrophobicContact CG-CD1 4.28Å; L333-L337 HydrophobicContact CG-CG 4.39Å; L333-L337 WeakPolarHBondContact O-CG 3.4Å; L333-L337 PolarHBondContact O-N 3.49Å |
| 334 | F | 91.8 | Very high | 79.4 | Confident | 2 Ų | 2 | 50.4 Ų | 50.4 | 1% | 0.009 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -56.8 | -51.9 | 174.1 | 177.4 | -96.7 | 0 | 0 | 0 | 112.5 | L281 F316 W318 Q325 F328 S332 F336 L337 K338 | L281-F334 HydrophobicContact CB-CB 4.29Å; L281-F334 HydrophobicContact CD2-CB 4.19Å; L281-F334 HydrophobicContact CD2-CD2 4.41Å; L281-F334 PolarHBondContact O-N 3.13Å; L281-F334 VanDerWaalsContact O-N 3.1Å; F316-F334 HydrophobicContact CE1-CD2 4.32Å; F316-F334 AromaticContact CE1-CE2 3.86Å; F316-F334 HydrophobicContact CE1-CE2 3.86Å; F316-F334 HydrophobicContact CZ-CE2 4.14Å; W318-F334 HydrophobicContact CE3-CD2 4.41Å; W318-F334 AromaticContact CE3-CE2 3.64Å; W318-F334 HydrophobicContact CE3-CE2 3.64Å; W318-F334 HydrophobicContact CE3-CZ 4.25Å; W318-F334 HydrophobicContact CH2-CD2 4.02Å; W318-F334 HydrophobicContact CH2-CE2 4.04Å; W318-F334 AromaticContact CZ3-CD2 3.64Å; W318-F334 HydrophobicContact CZ3-CD2 3.64Å; W318-F334 AromaticContact CZ3-CE2 3.21Å; W318-F334 HydrophobicContact CZ3-CE2 3.21Å; W318-F334 AromaticContact CZ3-CZ 3.87Å; W318-F334 HydrophobicContact CZ3-CZ 3.87Å; Q325-F334 HydrophobicContact CB-CE1 4.47Å; Q325-F334 HydrophobicContact CB-CZ 4.28Å; Q325-F334 HydrophobicContact CG-CZ 4.17Å; F328-F334 HydrophobicContact CB-CB 4Å; F328-F334 HydrophobicContact CB-CD1 3.85Å; F328-F334 HydrophobicContact CB-CG 4.1Å; F328-F334 HydrophobicContact CD1-CB 3.91Å; F328-F334 HydrophobicContact CD1-CG 4.31Å; F328-F334 HydrophobicContact CD2-CB 4.09Å; F328-F334 AromaticContact CD2-CD1 3.67Å; F328-F334 HydrophobicContact CD2-CD1 3.67Å; F328-F334 AromaticContact CD2-CD2 3.81Å; F328-F334 HydrophobicContact CD2-CD2 3.81Å; F328-F334 AromaticContact CD2-CE1 3.93Å; F328-F334 HydrophobicContact CD2-CE1 3.93Å; F328-F334 HydrophobicContact CD2-CE2 4.06Å; F328-F334 AromaticContact CD2-CG 3.58Å; F328-F334 HydrophobicContact CD2-CG 3.58Å; F328-F334 HydrophobicContact CD2-CZ 4.11Å; F328-F334 HydrophobicContact CE1-CB 4.43Å; F328-F334 HydrophobicContact CE2-CD1 4.47Å; F328-F334 AromaticContact CE2-CD2 3.8Å; F328-F334 HydrophobicContact CE2-CD2 3.8Å; F328-F334 AromaticContact CE2-CE2 3.96Å; F328-F334 HydrophobicContact CE2-CE2 3.96Å; F328-F334 HydrophobicContact CE2-CG 4.05Å; F328-F334 HydrophobicContact CE2-CZ 4.36Å; F328-F334 HydrophobicContact CG-CB 3.73Å; F328-F334 AromaticContact CG-CD1 3.9Å; F328-F334 HydrophobicContact CG-CD1 3.9Å; F328-F334 HydrophobicContact CG-CD2 4.32Å; F328-F334 AromaticContact CG-CG 3.73Å; F328-F334 HydrophobicContact CG-CG 3.73Å; F328-F334 HydrophobicContact CZ-CD2 4.3Å; S332-F334 PolarHBondContact O-N 2.86Å; F334-F336 VanDerWaalsContact C-N 3.34Å; F334-L337 PolarHBondContact O-N 3.39Å; F334-K338 HydrophobicContact CD1-CD 4.43Å; F334-K338 HydrophobicContact CE1-CD 3.82Å; F334-K338 VanDerWaalsContact CE1-CE 3.46Å; F334-K338 HydrophobicContact CZ-CD 4.14Å; F334-K338 PolarHBondContact O-N 3.42Å; F334-K338 VanDerWaalsContact O-N 3.12Å |
| 335 | F | 89.2 | Confident | 79.5 | Confident | 73 Ų | 73 | 55.8 Ų | 55.8 | 32% | 0.32 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -65.7 | -39.1 | 177.3 | -88 | -77.9 | 0 | 0 | 0 | 111.8 | F328 G329 S332 L337 K338 E339 | F328-F335 HydrophobicContact CB-CD2 4.48Å; F328-F335 HydrophobicContact CB-CE2 4.42Å; F328-F335 WeakPolarHBondContact O-CE2 3.5Å; G329-F335 VanDerWaalsContact O-CD2 3.31Å; G329-F335 WeakPolarHBondContact O-CD2 3.49Å; S332-F335 PolarHBondContact O-N 3.28Å; S332-F335 VanDerWaalsContact O-N 3.16Å; F335-L337 VanDerWaalsContact C-N 3.33Å; F335-L337 PolarHBondContact O-N 3.39Å; F335-K338 PolarHBondContact O-N 3.02Å; F335-E339 WeakPolarHBondContact O-CG 3.32Å; F335-E339 PolarHBondContact O-N 3.46Å |
| 336 | F | 90.8 | Very high | 79.7 | Confident | 22 Ų | 22 | 61.2 Ų | 61.2 | 10% | 0.096 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -56.9 | -45.4 | 174.3 | 174.8 | -94.1 | 0 | 0 | 0 | 112 | V285 L289 F293 F309 S332 L333 F334 E339 F340 | V285-F336 HydrophobicContact CG2-CB 3.69Å; V285-F336 HydrophobicContact CG2-CD2 4.43Å; V285-F336 HydrophobicContact CG2-CG 4.11Å; L289-F336 HydrophobicContact CB-CE2 4.04Å; L289-F336 HydrophobicContact CB-CZ 4.23Å; L289-F336 HydrophobicContact CD2-CD1 3.95Å; L289-F336 HydrophobicContact CD2-CD2 4.32Å; L289-F336 HydrophobicContact CD2-CE1 3.75Å; L289-F336 HydrophobicContact CD2-CE2 4.13Å; L289-F336 HydrophobicContact CD2-CG 4.23Å; L289-F336 HydrophobicContact CD2-CZ 3.84Å; L289-F336 HydrophobicContact CG-CE1 4.23Å; L289-F336 HydrophobicContact CG-CE2 4.17Å; L289-F336 HydrophobicContact CG-CZ 3.86Å; F293-F336 HydrophobicContact CE2-CZ 4.46Å; F309-F336 AromaticContact CE2-CE1 3.86Å; F309-F336 HydrophobicContact CE2-CE1 3.86Å; F309-F336 HydrophobicContact CZ-CD1 4.38Å; F309-F336 AromaticContact CZ-CE1 3.81Å; F309-F336 HydrophobicContact CZ-CE1 3.81Å; S332-F336 PolarHBondContact O-N 3.25Å; L333-F336 HydrophobicContact CD1-CD1 3.98Å; L333-F336 WeakPolarHBondContact O-CB 3.32Å; L333-F336 PolarHBondContact O-N 3.2Å; F334-F336 VanDerWaalsContact C-N 3.34Å; F336-E339 PolarHBondContact O-N 3.27Å; F336-F340 HydrophobicContact CE1-CB 4.43Å; F336-F340 HydrophobicContact CE1-CD2 4.33Å; F336-F340 HydrophobicContact CE1-CG 4.5Å; F336-F340 HydrophobicContact CZ-CD2 4.05Å; F336-F340 WeakPolarHBondContact O-CB 3.26Å; F336-F340 PolarHBondContact O-N 3.48Å |
| 337 | L | 88.9 | Confident | 79.6 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66.3 | -38.4 | 178.5 | -69.9 | 175.6 | 0 | 0 | 0 | 112.2 | L281 F309 W318 L333 F334 F335 F340 Q341 F365 L369 | L281-L337 HydrophobicContact CD2-CD1 4.05Å; F309-L337 HydrophobicContact CB-CD2 4.22Å; F309-L337 HydrophobicContact CD1-CD2 4.25Å; F309-L337 HydrophobicContact CD2-CD2 3.93Å; F309-L337 HydrophobicContact CE2-CD2 4.29Å; F309-L337 HydrophobicContact CG-CD2 3.91Å; W318-L337 HydrophobicContact CH2-CB 4.25Å; L333-L337 HydrophobicContact CD1-CG 4.24Å; L333-L337 HydrophobicContact CG-CD1 4.28Å; L333-L337 HydrophobicContact CG-CG 4.39Å; L333-L337 WeakPolarHBondContact O-CG 3.4Å; L333-L337 PolarHBondContact O-N 3.49Å; F334-L337 PolarHBondContact O-N 3.39Å; F335-L337 VanDerWaalsContact C-N 3.33Å; F335-L337 PolarHBondContact O-N 3.39Å; L337-F340 PolarHBondContact O-N 3Å; L337-Q341 PolarHBondContact O-N 3.39Å; L337-F365 HydrophobicContact CD2-CE1 4.39Å; L337-F365 HydrophobicContact CD2-CZ 4.18Å; L337-L369 HydrophobicContact CB-CD2 4.46Å |
| 338 | K | 84.8 | Confident | 79 | Confident | 58 Ų | 58 | 56.5 Ų | 56.5 | 25% | 0.252 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.1 | -50.1 | 172.2 | -78.9 | -171.3 | 168.4 | -175.9 | 0 | 111.7 | W318 F334 F335 F340 Q341 V342 M373 | W318-K338 HydrophobicContact CZ3-CG 4.02Å; F334-K338 HydrophobicContact CD1-CD 4.43Å; F334-K338 HydrophobicContact CE1-CD 3.82Å; F334-K338 VanDerWaalsContact CE1-CE 3.46Å; F334-K338 HydrophobicContact CZ-CD 4.14Å; F334-K338 PolarHBondContact O-N 3.42Å; F334-K338 VanDerWaalsContact O-N 3.12Å; F335-K338 PolarHBondContact O-N 3.02Å; K338-F340 VanDerWaalsContact C-N 3.34Å; K338-F340 PolarHBondContact O-N 3.31Å; K338-Q341 WeakPolarHBondContact O-CB 3.44Å; K338-Q341 PolarHBondContact O-N 3.28Å; K338-V342 WeakPolarHBondContact O-CG2 3.42Å; K338-V342 PolarHBondContact O-N 3.36Å; K338-V342 VanDerWaalsContact O-N 3.1Å; K338-M373 HydrophobicContact CG-SD 3.94Å |
| 339 | E | 83.3 | Confident | 77.7 | Confident | 124 Ų | 124 | 58.5 Ų | 58.5 | 58% | 0.579 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -64.5 | -39.7 | 178.2 | -72.8 | -179 | -174.9 | 0 | 0 | 112.4 | F335 F336 Q341 V342 C343 | F335-E339 WeakPolarHBondContact O-CG 3.32Å; F335-E339 PolarHBondContact O-N 3.46Å; F336-E339 PolarHBondContact O-N 3.27Å; E339-Q341 PolarHBondContact O-N 3.45Å; E339-V342 PolarHBondContact O-N 3.12Å; E339-C343 WeakPolarHBondContact O-CB 3.35Å; E339-C343 PolarHBondContact O-N 3.02Å; E339-C343 PolarHBondContact O-SG 3.2Å; E339-C343 VanDerWaalsContact O-SG 3.41Å |
| 340 | F | 80.7 | Confident | 76.6 | Confident | 11 Ų | 11 | 57 Ų | 57 | 5% | 0.048 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.3 | -40.6 | 176.2 | -170.2 | -101.6 | 0 | 0 | 0 | 110.5 | F293 F336 L337 K338 V347 V362 F365 M366 | F293-F340 HydrophobicContact CD1-CE2 4.45Å; F293-F340 HydrophobicContact CD1-CZ 4.27Å; F293-F340 AromaticContact CD2-CE2 3.56Å; F293-F340 HydrophobicContact CD2-CE2 3.56Å; F293-F340 HydrophobicContact CD2-CZ 4.14Å; F293-F340 HydrophobicContact CE1-CE2 4.48Å; F293-F340 HydrophobicContact CE1-CZ 4.12Å; F293-F340 HydrophobicContact CE2-CD2 4.43Å; F293-F340 AromaticContact CE2-CE2 3.6Å; F293-F340 HydrophobicContact CE2-CE2 3.6Å; F293-F340 AromaticContact CE2-CZ 3.99Å; F293-F340 HydrophobicContact CE2-CZ 3.99Å; F293-F340 HydrophobicContact CG-CE2 4.01Å; F293-F340 HydrophobicContact CG-CZ 4.27Å; F293-F340 HydrophobicContact CZ-CE2 4.08Å; F293-F340 AromaticContact CZ-CZ 3.98Å; F293-F340 HydrophobicContact CZ-CZ 3.98Å; F336-F340 HydrophobicContact CE1-CB 4.43Å; F336-F340 HydrophobicContact CE1-CD2 4.33Å; F336-F340 HydrophobicContact CE1-CG 4.5Å; F336-F340 HydrophobicContact CZ-CD2 4.05Å; F336-F340 WeakPolarHBondContact O-CB 3.26Å; F336-F340 PolarHBondContact O-N 3.48Å; L337-F340 PolarHBondContact O-N 3Å; K338-F340 VanDerWaalsContact C-N 3.34Å; K338-F340 PolarHBondContact O-N 3.31Å; F340-V347 HydrophobicContact CD2-CG2 4.13Å; F340-V347 HydrophobicContact CE1-CG1 4.18Å; F340-V347 HydrophobicContact CE2-CG1 3.83Å; F340-V347 HydrophobicContact CE2-CG2 3.92Å; F340-V347 HydrophobicContact CZ-CG1 3.55Å; F340-V347 HydrophobicContact CZ-CG2 4.42Å; F340-V362 HydrophobicContact CZ-CG1 4.44Å; F340-F365 HydrophobicContact CD1-CE1 4.19Å; F340-F365 HydrophobicContact CE1-CD1 4.04Å; F340-F365 HydrophobicContact CE1-CE1 4.07Å; F340-M366 HydrophobicContact CD1-SD 3.39Å; F340-M366 WeakPolarHBondContact CD1-SD 3.37Å; F340-M366 HydrophobicContact CE1-CG 4.19Å; F340-M366 HydrophobicContact CE1-SD 3.44Å; F340-M366 WeakPolarHBondContact CE1-SD 3.42Å; F340-M366 HydrophobicContact CG-SD 4.38Å; F340-M366 HydrophobicContact CZ-SD 4.46Å; F340-M366 VanDerWaalsContact O-CE 3.25Å; F340-M366 WeakPolarHBondContact O-CE 3.33Å |
| 341 | Q | 75.9 | Confident | 75.2 | Confident | 34 Ų | 34 | 54 Ų | 54 | 16% | 0.159 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -66 | -46.3 | 174.8 | -176.1 | -96.6 | -2.5 | 0 | 0 | 113.3 | L337 K338 E339 C343 A344 M366 L369 A370 M373 | L337-Q341 PolarHBondContact O-N 3.39Å; K338-Q341 WeakPolarHBondContact O-CB 3.44Å; K338-Q341 PolarHBondContact O-N 3.28Å; E339-Q341 PolarHBondContact O-N 3.45Å; Q341-C343 PolarHBondContact O-N 3.28Å; Q341-A344 PolarHBondContact O-N 3.47Å; Q341-M366 VanDerWaalsContact CA-CE 3.43Å; Q341-M366 HydrophobicContact CB-CE 4.47Å; Q341-M366 VanDerWaalsContact O-CE 3.24Å; Q341-M366 WeakPolarHBondContact O-CE 3.31Å; Q341-L369 HydrophobicContact CB-CD2 3.9Å; Q341-L369 HydrophobicContact CB-CG 4.3Å; Q341-A370 HydrophobicContact CG-CB 4.38Å; Q341-M373 HydrophobicContact CB-CE 3.39Å; Q341-M373 VanDerWaalsContact CD-CE 3.41Å; Q341-M373 HydrophobicContact CG-CE 3.27Å |
| 342 | V | 70.7 | Confident | 73.4 | Confident | 111 Ų | 111 | 57.5 Ų | 57.5 | 67% | 0.673 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -65.7 | -31 | -178.8 | 175.8 | 0 | 0 | 0 | 0 | 111.3 | K338 E339 A344 | K338-V342 WeakPolarHBondContact O-CG2 3.42Å; K338-V342 PolarHBondContact O-N 3.36Å; K338-V342 VanDerWaalsContact O-N 3.1Å; E339-V342 PolarHBondContact O-N 3.12Å; V342-A344 PolarHBondContact O-N 3.49Å |
| 343 | C | 66.5 | Low | 71.4 | Confident | 48 Ų | 48 | 65 Ų | 65 | 32% | 0.324 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | 26.2 | 178.5 | -67.2 | 0 | 0 | 0 | 0 | 114.1 | E339 Q341 D345 K346 V347 | E339-C343 WeakPolarHBondContact O-CB 3.35Å; E339-C343 PolarHBondContact O-N 3.02Å; E339-C343 PolarHBondContact O-SG 3.2Å; E339-C343 VanDerWaalsContact O-SG 3.41Å; Q341-C343 PolarHBondContact O-N 3.28Å; C343-D345 VanDerWaalsContact C-N 3.27Å; C343-D345 PolarHBondContact O-N 3.12Å; C343-D345 VanDerWaalsContact O-N 3.13Å; C343-K346 PolarHBondContact O-N 2.99Å; C343-V347 HydrophobicContact CB-CG2 4.32Å; C343-V347 WeakPolarHBondContact O-CG2 3.46Å; C343-V347 PolarHBondContact O-N 3.04Å |
| 344 | A | 61.6 | Low | 69.8 | Low | 28 Ų | 28 | 66.1 Ų | 66.1 | 23% | 0.231 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -48 | -44.2 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q341 V342 K346 V347 L348 M366 | Q341-A344 PolarHBondContact O-N 3.47Å; V342-A344 PolarHBondContact O-N 3.49Å; A344-K346 PolarHBondContact O-N 3.33Å; A344-V347 CarbonylContact O-C 3.6Å; A344-V347 PolarHBondContact O-N 3.19Å; A344-L348 VanDerWaalsContact O-CB 3.28Å; A344-L348 WeakPolarHBondContact O-CB 2.96Å; A344-L348 WeakPolarHBondContact O-CG 3.45Å; A344-L348 PolarHBondContact O-N 3.07Å; A344-M366 VanDerWaalsContact CA-CE 3.5Å; A344-M366 HydrophobicContact CB-CE 3.46Å; A344-M366 VanDerWaalsContact CB-CE 3.46Å |
| 345 | D | 59.4 | Low | 69 | Low | 140 Ų | 140 | 69.1 Ų | 69.1 | 75% | 0.749 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -68.5 | -36 | -178.2 | -64.7 | -33 | 0 | 0 | 0 | 113.3 | C343 G349 | C343-D345 VanDerWaalsContact C-N 3.27Å; C343-D345 PolarHBondContact O-N 3.12Å; C343-D345 VanDerWaalsContact O-N 3.13Å; D345-G349 PolarHBondContact O-N 2.89Å |
| 346 | K | 62.8 | Low | 68.5 | Low | 163 Ų | 163 | 73.6 Ų | 73.6 | 71% | 0.709 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -71.9 | -33.8 | 175 | -69.2 | 179.1 | -177.9 | 171.9 | 0 | 111.5 | C343 A344 | C343-K346 PolarHBondContact O-N 2.99Å; A344-K346 PolarHBondContact O-N 3.33Å |
| 347 | V | 60.1 | Low | 68.1 | Low | 11 Ų | 11 | 77.1 Ų | 77.1 | 7% | 0.067 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -81.7 | -25.9 | 179 | 174.5 | 0 | 0 | 0 | 0 | 111.9 | F340 C343 A344 I350 V362 | F340-V347 HydrophobicContact CD2-CG2 4.13Å; F340-V347 HydrophobicContact CE1-CG1 4.18Å; F340-V347 HydrophobicContact CE2-CG1 3.83Å; F340-V347 HydrophobicContact CE2-CG2 3.92Å; F340-V347 HydrophobicContact CZ-CG1 3.55Å; F340-V347 HydrophobicContact CZ-CG2 4.42Å; C343-V347 HydrophobicContact CB-CG2 4.32Å; C343-V347 WeakPolarHBondContact O-CG2 3.46Å; C343-V347 PolarHBondContact O-N 3.04Å; A344-V347 CarbonylContact O-C 3.6Å; A344-V347 PolarHBondContact O-N 3.19Å; V347-I350 WeakPolarHBondContact O-CD1 3.48Å; V347-I350 WeakPolarHBondContact O-CG1 3.48Å; V347-V362 HydrophobicContact CG1-CG1 3.44Å; V347-V362 VanDerWaalsContact CG1-CG1 3.44Å |
| 348 | L | 61.2 | Low | 67.8 | Low | 96 Ų | 96 | 77.1 Ų | 77.1 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -81.7 | -26.2 | 169.7 | -70.3 | 170.7 | 0 | 0 | 0 | 111.1 | A344 I350 | A344-L348 VanDerWaalsContact O-CB 3.28Å; A344-L348 WeakPolarHBondContact O-CB 2.96Å; A344-L348 WeakPolarHBondContact O-CG 3.45Å; A344-L348 PolarHBondContact O-N 3.07Å; L348-I350 PolarHBondContact O-N 3.13Å; L348-I350 VanDerWaalsContact O-N 3.11Å |
| 349 | G | 58.2 | Low | 67.5 | Low | 52 Ų | 52 | 77.3 Ų | 77.3 | 54% | 0.536 | 41% | 0.41 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | 16.3 | 167.2 | 0 | 0 | 0 | 0 | 0 | 115 | D345 E351 | D345-G349 PolarHBondContact O-N 2.89Å; G349-E351 PolarHBondContact O-N 2.76Å; G349-E351 VanDerWaalsContact O-N 3.11Å |
| 350 | I | 61.7 | Low | 67.5 | Low | 6 Ų | 6 | 73.8 Ų | 73.8 | 3% | 0.031 | 40% | 0.397 | C | S | . | . | trans | -45.3 | 122.9 | 168.2 | -75.3 | 160.3 | 0 | 0 | 0 | 108 | F293 V347 L348 H354 K359 V362 | F293-I350 WeakPolarHBondContact O-CG1 3.41Å; V347-I350 WeakPolarHBondContact O-CD1 3.48Å; V347-I350 WeakPolarHBondContact O-CG1 3.48Å; L348-I350 PolarHBondContact O-N 3.13Å; L348-I350 VanDerWaalsContact O-N 3.11Å; I350-H354 HydrophobicContact CG2-CB 3.5Å; I350-H354 VanDerWaalsContact CG2-CB 3.5Å; I350-H354 WeakPolarHBondContact CG2-CD2 3.05Å; I350-K359 PolarHBondContact O-NZ 3.46Å; I350-V362 HydrophobicContact CD1-CB 4.36Å; I350-V362 HydrophobicContact CD1-CG1 4.15Å; I350-V362 HydrophobicContact CD1-CG2 4.05Å | ||
| 351 | E | 54 | Low | 67.7 | Low | 122 Ų | 122 | 76 Ų | 76 | 57% | 0.57 | 41% | 0.407 | S | S | * | . | trans | -47 | 151.3 | -173.9 | -70.2 | -175.5 | 167.4 | 0 | 0 | 111.6 | G349 H353 H354 K359 | G349-E351 PolarHBondContact O-N 2.76Å; G349-E351 VanDerWaalsContact O-N 3.11Å; E351-H353 PolarHBondContact O-N 3.49Å; E351-H354 PolarHBondContact O-N 2.82Å; E351-K359 PolarHBondContact O-NZ 2.76Å | ||
| 352 | S | 50.9 | Low | 68.1 | Low | 106 Ų | 106 | 74.4 Ų | 74.4 | 74% | 0.741 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.2 | -4.2 | -177.6 | 30.2 | 0 | 0 | 0 | 0 | 115.5 | ||
| 353 | H | 53.3 | Low | 68.7 | Low | 157 Ų | 157 | 70.2 Ų | 70.2 | 73% | 0.727 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.4 | -3.3 | -176.8 | -62.7 | -59.4 | 0 | 0 | 0 | 116.1 | E351 | E351-H353 PolarHBondContact O-N 3.49Š|
| 354 | H | 60.6 | Low | 69.6 | Low | 24 Ų | 24 | 74.6 Ų | 74.6 | 11% | 0.111 | 39% | 0.392 | C | S | . | . | S | Bend | trans | -85.5 | 143.9 | 175 | -74.8 | -97.7 | 0 | 0 | 0 | 113.5 | F293 K295 I350 E351 F356 | F293-H354 PolarHBondContact O-CE1 2.93Å; F293-H354 PolarHBondContact O-NE2 3.45Å; K295-H354 PolarHBondContact O-CE1 3.31Å; K295-H354 PolarHBondContact O-NE2 3.19Å; I350-H354 HydrophobicContact CG2-CB 3.5Å; I350-H354 VanDerWaalsContact CG2-CB 3.5Å; I350-H354 WeakPolarHBondContact CG2-CD2 3.05Å; E351-H354 PolarHBondContact O-N 2.82Å; H354-F356 PolarHBondContact O-N 3.29Å |
| 355 | D | 73.6 | Confident | 70.8 | Confident | 66 Ų | 66 | 73.2 Ų | 73.2 | 35% | 0.353 | 38% | 0.381 | S | S | . | . | trans | -50.4 | 132.6 | 173.9 | -171.3 | -49.1 | 0 | 0 | 0 | 110.4 | K299 L357 V358 K359 | K299-D355 HydrophobicContact CD-CB 4.37Å; K299-D355 WeakPolarHBondContact CD-OD2 3.47Å; K299-D355 IonicContact NZ-OD2 2.8Å; K299-D355 PolarHBondContact NZ-OD2 2.78Å; K299-D355 VanDerWaalsContact NZ-OD2 3.14Å; D355-L357 PolarHBondContact O-N 3.42Å; D355-L357 VanDerWaalsContact O-N 3.13Å; D355-L357 VanDerWaalsContact OD1-CB 3.26Å; D355-L357 WeakPolarHBondContact OD1-CB 3.2Å; D355-L357 PolarHBondContact OD1-N 3.39Å; D355-V358 HydrophobicContact CB-CG2 4.15Å; D355-V358 WeakPolarHBondContact O-CB 3.35Å; D355-V358 PolarHBondContact O-N 3.44Å; D355-K359 PolarHBondContact O-N 2.88Å | ||
| 356 | F | 80.2 | Confident | 71.9 | Confident | 166 Ų | 166 | 67.1 Ų | 67.1 | 73% | 0.728 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -52.3 | -36.3 | -179.8 | 176.4 | -100.2 | 0 | 0 | 0 | 112.2 | H354 V358 K359 V360 | H354-F356 PolarHBondContact O-N 3.29Å; F356-V358 VanDerWaalsContact C-N 3.32Å; F356-V358 PolarHBondContact O-N 3.14Å; F356-K359 PolarHBondContact O-N 3.24Å; F356-V360 HydrophobicContact CD1-CG2 4.12Å; F356-V360 HydrophobicContact CE1-CG2 3.68Å; F356-V360 HydrophobicContact CE2-CG2 4.13Å; F356-V360 HydrophobicContact CZ-CG2 3.68Å; F356-V360 WeakPolarHBondContact O-CG2 3.33Å; F356-V360 PolarHBondContact O-N 3.46Å |
| 357 | L | 81.5 | Confident | 72.9 | Confident | 96 Ų | 96 | 61.8 Ų | 61.8 | 50% | 0.503 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62.7 | -38.9 | 177.9 | -178 | 61.5 | 0 | 0 | 0 | 112.2 | L303 D355 V360 K361 | L303-L357 HydrophobicContact CD1-CD2 4.11Å; D355-L357 PolarHBondContact O-N 3.42Å; D355-L357 VanDerWaalsContact O-N 3.13Å; D355-L357 VanDerWaalsContact OD1-CB 3.26Å; D355-L357 WeakPolarHBondContact OD1-CB 3.2Å; D355-L357 PolarHBondContact OD1-N 3.39Å; L357-V360 PolarHBondContact O-N 2.84Å; L357-K361 WeakPolarHBondContact O-CB 3.36Å; L357-K361 PolarHBondContact O-N 3.34Å |
| 358 | V | 82.3 | Confident | 74.1 | Confident | 1 Ų | 1 | 64.2 Ų | 64.2 | 1% | 0.006 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -63.7 | -47.1 | 177.8 | 173.6 | 0 | 0 | 0 | 0 | 109.6 | K299 I302 L303 D355 F356 V360 K361 V362 | K299-V358 HydrophobicContact CB-CG2 3.87Å; I302-V358 HydrophobicContact CB-CG1 4.37Å; I302-V358 HydrophobicContact CD1-CG1 4.16Å; I302-V358 HydrophobicContact CG2-CG1 3.67Å; L303-V358 HydrophobicContact CD2-CG2 4.24Å; L303-V358 HydrophobicContact CG-CG2 4.22Å; D355-V358 HydrophobicContact CB-CG2 4.15Å; D355-V358 WeakPolarHBondContact O-CB 3.35Å; D355-V358 PolarHBondContact O-N 3.44Å; F356-V358 VanDerWaalsContact C-N 3.32Å; F356-V358 PolarHBondContact O-N 3.14Å; V358-V360 VanDerWaalsContact C-N 3.35Å; V358-V360 PolarHBondContact O-N 3.41Å; V358-K361 PolarHBondContact O-N 2.77Å; V358-V362 HydrophobicContact CG1-CG2 4.21Å; V358-V362 WeakPolarHBondContact O-CB 3.31Å; V358-V362 VanDerWaalsContact O-CG2 3.27Å; V358-V362 WeakPolarHBondContact O-CG2 3.38Å; V358-V362 PolarHBondContact O-N 2.84Å |
| 359 | K | 79.5 | Confident | 75.2 | Confident | 62 Ų | 62 | 59.6 Ų | 59.6 | 27% | 0.27 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59.6 | -45.3 | 179.1 | -60.6 | -168.1 | -178.4 | -153 | 0 | 112 | I350 E351 D355 F356 G363 | I350-K359 PolarHBondContact O-NZ 3.46Å; E351-K359 PolarHBondContact O-NZ 2.76Å; D355-K359 PolarHBondContact O-N 2.88Å; F356-K359 PolarHBondContact O-N 3.24Å; K359-G363 PolarHBondContact O-N 2.79Å |
| 360 | V | 83.4 | Confident | 76.3 | Confident | 50 Ų | 50 | 58.7 Ų | 58.7 | 30% | 0.303 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | 177.1 | 172.7 | 0 | 0 | 0 | 0 | 111.4 | F356 L357 V358 G363 K364 | F356-V360 HydrophobicContact CD1-CG2 4.12Å; F356-V360 HydrophobicContact CE1-CG2 3.68Å; F356-V360 HydrophobicContact CE2-CG2 4.13Å; F356-V360 HydrophobicContact CZ-CG2 3.68Å; F356-V360 WeakPolarHBondContact O-CG2 3.33Å; F356-V360 PolarHBondContact O-N 3.46Å; L357-V360 PolarHBondContact O-N 2.84Å; V358-V360 VanDerWaalsContact C-N 3.35Å; V358-V360 PolarHBondContact O-N 3.41Å; V360-G363 PolarHBondContact O-N 3.38Å; V360-K364 HydrophobicContact CG1-CD 4.14Å; V360-K364 HydrophobicContact CG1-CG 4.47Å; V360-K364 WeakPolarHBondContact O-CB 3.21Å; V360-K364 WeakPolarHBondContact O-CG 3.22Å; V360-K364 PolarHBondContact O-N 3.4Å |
| 361 | K | 84.8 | Confident | 77.2 | Confident | 57 Ų | 57 | 64.6 Ų | 64.6 | 25% | 0.248 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -67.3 | -40.7 | -178.6 | -169.9 | 62.1 | 166.8 | 157.2 | 0 | 111.7 | L303 L306 E310 L357 V358 K364 F365 | L303-K361 HydrophobicContact CD2-CB 3.9Å; L303-K361 HydrophobicContact CD2-CG 3.93Å; L306-K361 HydrophobicContact CD1-CB 4.24Å; L306-K361 HydrophobicContact CD1-CG 3.93Å; E310-K361 VanDerWaalsContact OE1-CE 3.25Å; E310-K361 WeakPolarHBondContact OE1-CE 3.47Å; E310-K361 IonicContact OE1-NZ 3.11Å; E310-K361 PolarHBondContact OE1-NZ 2.8Å; E310-K361 IonicContact OE2-NZ 2.86Å; E310-K361 PolarHBondContact OE2-NZ 3.48Å; L357-K361 WeakPolarHBondContact O-CB 3.36Å; L357-K361 PolarHBondContact O-N 3.34Å; V358-K361 PolarHBondContact O-N 2.77Å; K361-K364 PolarHBondContact O-N 3.43Å; K361-F365 WeakPolarHBondContact O-CB 3.33Å; K361-F365 PolarHBondContact O-N 2.87Å |
| 362 | V | 84.1 | Confident | 78.3 | Confident | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -59.7 | -50.9 | 172.7 | 171.8 | 0 | 0 | 0 | 0 | 110.5 | F293 L306 F340 V347 I350 V358 K364 F365 M366 | F293-V362 HydrophobicContact CD1-CG2 4.19Å; F293-V362 HydrophobicContact CE1-CG2 4.43Å; L306-V362 HydrophobicContact CD1-CG2 3.62Å; L306-V362 HydrophobicContact CD2-CG2 4.32Å; F340-V362 HydrophobicContact CZ-CG1 4.44Å; V347-V362 HydrophobicContact CG1-CG1 3.44Å; V347-V362 VanDerWaalsContact CG1-CG1 3.44Å; I350-V362 HydrophobicContact CD1-CB 4.36Å; I350-V362 HydrophobicContact CD1-CG1 4.15Å; I350-V362 HydrophobicContact CD1-CG2 4.05Å; V358-V362 HydrophobicContact CG1-CG2 4.21Å; V358-V362 WeakPolarHBondContact O-CB 3.31Å; V358-V362 VanDerWaalsContact O-CG2 3.27Å; V358-V362 WeakPolarHBondContact O-CG2 3.38Å; V358-V362 PolarHBondContact O-N 2.84Å; V362-K364 VanDerWaalsContact C-N 3.33Å; V362-K364 PolarHBondContact O-N 2.85Å; V362-F365 PolarHBondContact O-N 2.96Å; V362-M366 HydrophobicContact CG1-CG 4.29Å; V362-M366 WeakPolarHBondContact O-CB 3.32Å; V362-M366 WeakPolarHBondContact O-CG 3.4Å; V362-M366 PolarHBondContact O-N 3.44Å |
| 363 | G | 82.5 | Confident | 79.4 | Confident | 23 Ų | 23 | 58.3 Ų | 58.3 | 24% | 0.237 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.9 | -40.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | K359 V360 M366 A367 | K359-G363 PolarHBondContact O-N 2.79Å; V360-G363 PolarHBondContact O-N 3.38Å; G363-M366 PolarHBondContact O-N 3.03Å; G363-A367 PolarHBondContact O-N 3.44Å |
| 364 | K | 85.6 | Confident | 80.2 | Confident | 140 Ų | 140 | 57.5 Ų | 57.5 | 61% | 0.609 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -63.9 | -45.7 | 174.6 | -75.7 | -179.1 | 178 | -173.2 | 0 | 112.5 | V360 K361 V362 M366 A367 K368 | V360-K364 HydrophobicContact CG1-CD 4.14Å; V360-K364 HydrophobicContact CG1-CG 4.47Å; V360-K364 WeakPolarHBondContact O-CB 3.21Å; V360-K364 WeakPolarHBondContact O-CG 3.22Å; V360-K364 PolarHBondContact O-N 3.4Å; K361-K364 PolarHBondContact O-N 3.43Å; V362-K364 VanDerWaalsContact C-N 3.33Å; V362-K364 PolarHBondContact O-N 2.85Å; K364-M366 VanDerWaalsContact C-N 3.31Å; K364-M366 PolarHBondContact O-N 2.79Å; K364-A367 PolarHBondContact O-N 2.92Å; K364-K368 WeakPolarHBondContact O-CB 3.2Å; K364-K368 PolarHBondContact O-N 2.92Å |
| 365 | F | 86.7 | Confident | 80.2 | Confident | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 177.7 | 173.2 | -114.2 | 0 | 0 | 0 | 111.2 | L306 F309 E310 N313 L337 F340 K361 V362 A367 K368 L369 | L306-F365 HydrophobicContact CD2-CB 4.35Å; L306-F365 HydrophobicContact CD2-CD1 3.8Å; L306-F365 HydrophobicContact CD2-CE1 4.5Å; L306-F365 HydrophobicContact CD2-CG 4.21Å; F309-F365 HydrophobicContact CB-CE1 3.97Å; F309-F365 HydrophobicContact CB-CE2 3.83Å; F309-F365 HydrophobicContact CB-CZ 3.4Å; F309-F365 VanDerWaalsContact CB-CZ 3.4Å; F309-F365 HydrophobicContact CD2-CE1 4.11Å; F309-F365 HydrophobicContact CD2-CZ 4.36Å; F309-F365 HydrophobicContact CG-CZ 4.34Å; E310-F365 HydrophobicContact CB-CD2 4.46Å; E310-F365 HydrophobicContact CG-CD2 3.42Å; E310-F365 VanDerWaalsContact CG-CD2 3.42Å; E310-F365 HydrophobicContact CG-CE2 3.99Å; E310-F365 HydrophobicContact CG-CG 4.33Å; N313-F365 HydrophobicContact CB-CE2 4.46Å; L337-F365 HydrophobicContact CD2-CE1 4.39Å; L337-F365 HydrophobicContact CD2-CZ 4.18Å; F340-F365 HydrophobicContact CD1-CE1 4.19Å; F340-F365 HydrophobicContact CE1-CD1 4.04Å; F340-F365 HydrophobicContact CE1-CE1 4.07Å; K361-F365 WeakPolarHBondContact O-CB 3.33Å; K361-F365 PolarHBondContact O-N 2.87Å; V362-F365 PolarHBondContact O-N 2.96Å; F365-A367 PolarHBondContact O-N 3.46Å; F365-K368 PolarHBondContact O-N 3.27Å; F365-L369 HydrophobicContact CE1-CD2 4.08Å; F365-L369 HydrophobicContact CZ-CB 4.48Å; F365-L369 HydrophobicContact CZ-CD2 4.06Å; F365-L369 WeakPolarHBondContact O-CB 3.15Å; F365-L369 PolarHBondContact O-N 3.33Å |
| 366 | M | 83.1 | Confident | 79.2 | Confident | 11 Ų | 11 | 65.4 Ų | 65.4 | 5% | 0.054 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.8 | -45.2 | 177.8 | -73.3 | -70 | -62.5 | 0 | 0 | 113 | F340 Q341 A344 V362 G363 K364 K368 L369 A370 | F340-M366 HydrophobicContact CD1-SD 3.39Å; F340-M366 WeakPolarHBondContact CD1-SD 3.37Å; F340-M366 HydrophobicContact CE1-CG 4.19Å; F340-M366 HydrophobicContact CE1-SD 3.44Å; F340-M366 WeakPolarHBondContact CE1-SD 3.42Å; F340-M366 HydrophobicContact CG-SD 4.38Å; F340-M366 HydrophobicContact CZ-SD 4.46Å; F340-M366 VanDerWaalsContact O-CE 3.25Å; F340-M366 WeakPolarHBondContact O-CE 3.33Å; Q341-M366 VanDerWaalsContact CA-CE 3.43Å; Q341-M366 HydrophobicContact CB-CE 4.47Å; Q341-M366 VanDerWaalsContact O-CE 3.24Å; Q341-M366 WeakPolarHBondContact O-CE 3.31Å; A344-M366 VanDerWaalsContact CA-CE 3.5Å; A344-M366 HydrophobicContact CB-CE 3.46Å; A344-M366 VanDerWaalsContact CB-CE 3.46Å; V362-M366 HydrophobicContact CG1-CG 4.29Å; V362-M366 WeakPolarHBondContact O-CB 3.32Å; V362-M366 WeakPolarHBondContact O-CG 3.4Å; V362-M366 PolarHBondContact O-N 3.44Å; G363-M366 PolarHBondContact O-N 3.03Å; K364-M366 VanDerWaalsContact C-N 3.31Å; K364-M366 PolarHBondContact O-N 2.79Å; M366-K368 VanDerWaalsContact C-N 3.35Å; M366-L369 PolarHBondContact O-N 2.79Å; M366-A370 WeakPolarHBondContact O-CB 3.38Å; M366-A370 PolarHBondContact O-N 3.46Å |
| 367 | A | 83.3 | Confident | 77.6 | Confident | 52 Ų | 52 | 62.8 Ų | 62.8 | 43% | 0.43 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.2 | -46.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | G363 K364 F365 L369 A370 E371 | G363-A367 PolarHBondContact O-N 3.44Å; K364-A367 PolarHBondContact O-N 2.92Å; F365-A367 PolarHBondContact O-N 3.46Å; A367-L369 PolarHBondContact O-N 3.46Å; A367-A370 PolarHBondContact O-N 2.88Å; A367-E371 WeakPolarHBondContact O-CG 3.36Å; A367-E371 PolarHBondContact O-N 2.91Å |
| 368 | K | 85.5 | Confident | 75.6 | Confident | 61 Ų | 61 | 67.5 Ų | 67.5 | 27% | 0.265 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -61.5 | -43.3 | 177.4 | -171.1 | 176.6 | -178.7 | -171.8 | 0 | 112 | D314 K364 F365 M366 A370 E371 H372 | D314-K368 WeakPolarHBondContact OD1-CE 3.39Å; D314-K368 IonicContact OD1-NZ 3.15Å; D314-K368 PolarHBondContact OD1-NZ 3.38Å; D314-K368 IonicContact OD2-NZ 3.99Å; D314-K368 PolarHBondContact OD2-NZ 3.41Å; K364-K368 WeakPolarHBondContact O-CB 3.2Å; K364-K368 PolarHBondContact O-N 2.92Å; F365-K368 PolarHBondContact O-N 3.27Å; M366-K368 VanDerWaalsContact C-N 3.35Å; K368-A370 VanDerWaalsContact C-N 3.34Å; K368-A370 PolarHBondContact O-N 2.78Å; K368-E371 PolarHBondContact O-N 2.84Å; K368-H372 PolarHBondContact O-N 2.94Å; K368-H372 VanDerWaalsContact O-N 3.13Å; K368-H372 PolarHBondContact O-ND1 2.9Å |
| 369 | L | 84 | Confident | 73.4 | Confident | 0 Ų | 0 | 79.8 Ų | 79.8 | 0% | 0 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -63.8 | -40.3 | 177.9 | -176.5 | 60.8 | 0 | 0 | 0 | 111.4 | N313 W318 L337 Q341 F365 M366 A367 H372 M373 | N313-L369 WeakPolarHBondContact OD1-CD1 3.31Å; W318-L369 HydrophobicContact CH2-CD1 4.41Å; W318-L369 HydrophobicContact CZ2-CD1 3.67Å; L337-L369 HydrophobicContact CB-CD2 4.46Å; Q341-L369 HydrophobicContact CB-CD2 3.9Å; Q341-L369 HydrophobicContact CB-CG 4.3Å; F365-L369 HydrophobicContact CE1-CD2 4.08Å; F365-L369 HydrophobicContact CZ-CB 4.48Å; F365-L369 HydrophobicContact CZ-CD2 4.06Å; F365-L369 WeakPolarHBondContact O-CB 3.15Å; F365-L369 PolarHBondContact O-N 3.33Å; M366-L369 PolarHBondContact O-N 2.79Å; A367-L369 PolarHBondContact O-N 3.46Å; L369-H372 PolarHBondContact O-N 3.43Å; L369-M373 HydrophobicContact CD1-CG 4.33Å; L369-M373 HydrophobicContact CD1-SD 4.34Å; L369-M373 HydrophobicContact CG-CE 4.08Å; L369-M373 HydrophobicContact CG-SD 4.47Å; L369-M373 WeakPolarHBondContact O-CB 3.4Å; L369-M373 WeakPolarHBondContact O-CG 3.32Å; L369-M373 PolarHBondContact O-N 3.47Å |
| 370 | A | 81.4 | Confident | 73.1 | Confident | 32 Ų | 32 | 80.7 Ų | 80.7 | 26% | 0.264 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q341 M366 A367 K368 H372 M373 F374 | Q341-A370 HydrophobicContact CG-CB 4.38Å; M366-A370 WeakPolarHBondContact O-CB 3.38Å; M366-A370 PolarHBondContact O-N 3.46Å; A367-A370 PolarHBondContact O-N 2.88Å; K368-A370 VanDerWaalsContact C-N 3.34Å; K368-A370 PolarHBondContact O-N 2.78Å; A370-H372 VanDerWaalsContact C-N 3.35Å; A370-H372 PolarHBondContact O-N 3.43Å; A370-M373 PolarHBondContact O-N 3.47Å; A370-F374 PolarHBondContact O-N 3.02Å |
| 371 | E | 80.8 | Confident | 72.5 | Confident | 131 Ų | 131 | 82.3 Ų | 82.3 | 61% | 0.612 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -61.6 | -40.4 | 176.1 | -73.2 | 172.3 | -179.8 | 0 | 0 | 112.6 | A367 K368 F374 P375 | A367-E371 WeakPolarHBondContact O-CG 3.36Å; A367-E371 PolarHBondContact O-N 2.91Å; K368-E371 PolarHBondContact O-N 2.84Å; E371-F374 CarbonylContact O-C 3.53Å; E371-P375 WeakPolarHBondContact O-CA 3.37Å |
| 372 | H | 77.6 | Confident | 71.9 | Confident | 69 Ų | 69 | 83.7 Ų | 83.7 | 32% | 0.319 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -75.7 | -33.9 | -179.5 | -72.3 | 81.4 | 0 | 0 | 0 | 112.8 | N313 W318 K368 L369 A370 | N313-H372 PolarHBondContact ND2-ND1 2.86Å; W318-H372 WeakPolarHBondContact CB-O 3.25Å; K368-H372 PolarHBondContact O-N 2.94Å; K368-H372 VanDerWaalsContact O-N 3.13Å; K368-H372 PolarHBondContact O-ND1 2.9Å; L369-H372 PolarHBondContact O-N 3.43Å; A370-H372 VanDerWaalsContact C-N 3.35Å; A370-H372 PolarHBondContact O-N 3.43Å |
| 373 | M | 74.1 | Confident | 71.1 | Confident | 26 Ų | 26 | 88.6 Ų | 88.6 | 13% | 0.128 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -80 | -31 | 179.1 | -71.4 | -163.1 | -52.9 | 0 | 0 | 113.7 | W318 K338 Q341 L369 A370 P375 | W318-M373 HydrophobicContact CB-CG 4.48Å; W318-M373 HydrophobicContact CD2-CG 3.49Å; W318-M373 VanDerWaalsContact CD2-CG 3.49Å; W318-M373 HydrophobicContact CD2-SD 4.24Å; W318-M373 HydrophobicContact CE3-CG 3.61Å; W318-M373 HydrophobicContact CE3-SD 3.83Å; W318-M373 HydrophobicContact CG-CG 3.9Å; W318-M373 HydrophobicContact CH2-CG 4.3Å; W318-M373 HydrophobicContact CH2-SD 3.85Å; W318-M373 HydrophobicContact CZ2-CG 4.2Å; W318-M373 HydrophobicContact CZ2-SD 4.24Å; W318-M373 HydrophobicContact CZ3-CG 4.01Å; W318-M373 HydrophobicContact CZ3-SD 3.62Å; K338-M373 HydrophobicContact CG-SD 3.94Å; Q341-M373 HydrophobicContact CB-CE 3.39Å; Q341-M373 VanDerWaalsContact CD-CE 3.41Å; Q341-M373 HydrophobicContact CG-CE 3.27Å; L369-M373 HydrophobicContact CD1-CG 4.33Å; L369-M373 HydrophobicContact CD1-SD 4.34Å; L369-M373 HydrophobicContact CG-CE 4.08Å; L369-M373 HydrophobicContact CG-SD 4.47Å; L369-M373 WeakPolarHBondContact O-CB 3.4Å; L369-M373 WeakPolarHBondContact O-CG 3.32Å; L369-M373 PolarHBondContact O-N 3.47Å; A370-M373 PolarHBondContact O-N 3.47Å; M373-P375 VanDerWaalsContact C-CD 3.47Å |
| 374 | F | 69.2 | Low | 70.4 | Confident | 140 Ų | 140 | 92.7 Ų | 92.7 | 61% | 0.614 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -129.1 | 68.3 | 178.2 | -56.5 | -77.3 | 0 | 0 | 0 | 109.1 | A370 E371 K376 | A370-F374 PolarHBondContact O-N 3.02Å; E371-F374 CarbonylContact O-C 3.53Å; F374-K376 PolarHBondContact O-N 3.12Å |
| 375 | P | 61.2 | Low | 69.4 | Low | 61 Ų | 61 | 89.5 Ų | 89.5 | 40% | 0.396 | 46% | 0.455 | S | S | . | . | trans | -57.4 | 120.1 | 174.4 | 22.6 | -28.9 | 0 | 0 | 0 | 106.8 | E319 E371 M373 S377 | E319-P375 HydrophobicContact CG-CG 4.25Å; E319-P375 WeakPolarHBondContact OE1-CG 3.28Å; E371-P375 WeakPolarHBondContact O-CA 3.37Å; M373-P375 VanDerWaalsContact C-CD 3.47Å; P375-S377 PolarHBondContact O-N 3.18Å | ||
| 376 | K | 52.8 | Low | 68.2 | Low | 196 Ų | 196 | 95.9 Ų | 95.9 | 85% | 0.852 | 49% | 0.488 | S | S | * | . | trans | -52.5 | 116.2 | 176.5 | -70.6 | -179.7 | 179.6 | 177.3 | 0 | 106.5 | F374 Q378 | F374-K376 PolarHBondContact O-N 3.12Å; K376-Q378 PolarHBondContact O-N 3.4Å | ||
| 377 | S | 45.4 | Very low | 67 | Low | 110 Ų | 110 | 102.5 Ų | 102.5 | 77% | 0.769 | 52% | 0.521 | S | S | * | . | trans | -51.9 | 108.2 | 169.7 | 37.7 | 0 | 0 | 0 | 0 | 106.8 | P375 E379 | P375-S377 PolarHBondContact O-N 3.18Å; S377-E379 PolarHBondContact O-N 3.32Å | ||
| 378 | Q | 40.4 | Very low | 65.7 | Low | 195 Ų | 195 | 106.7 Ų | 106.7 | 91% | 0.911 | 53% | 0.529 | S | S | * | . | trans | -67.9 | 101.8 | 170.6 | -71.3 | -170.3 | -7.3 | 0 | 0 | 105.9 | K376 | K376-Q378 PolarHBondContact O-N 3.4Š| ||
| 379 | E | 35.8 | Very low | 63.9 | Low | 259 Ų | 259 | 110.8 Ų | 110.8 | 100% | 1.21 | 55% | 0.552 | S | S | * | * | trans | -66.8 | 0 | 160.3 | -79.5 | -175.2 | 155 | 0 | 0 | 110.9 | S377 | S377-E379 PolarHBondContact O-N 3.32Š|
Retrieved 379 of 379 residues in 262 ms
(Link to these results)