| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.3 | Very low | 45.1 | Very low | 239 Ų | 239 | 142 Ų | 142 | 100% | 1.177 | 73% | 0.734 | S | S | * | * | 0 | 104.2 | 0 | -70.4 | 174.9 | -175.6 | 0 | 0 | 106.7 | |||||
| 2 | M | 37.1 | Very low | 45.6 | Very low | 178 Ų | 178 | 135.8 Ų | 135.8 | 88% | 0.877 | 72% | 0.719 | S | S | * | * | trans | -89.2 | 124.4 | -172.5 | -86.9 | 171.9 | 172.5 | 0 | 0 | 109.8 | P4 | M2-P4 HydrophobicContact CB-CG 4.3Š| ||
| 3 | F | 40.2 | Very low | 46 | Very low | 206 Ų | 206 | 135.7 Ų | 135.7 | 90% | 0.904 | 72% | 0.718 | S | S | * | * | trans | -114.5 | 97.5 | 155.8 | -73.5 | -82.6 | 0 | 0 | 0 | 107.4 | ||||
| 4 | P | 45.6 | Very low | 46.7 | Very low | 100 Ų | 100 | 132.9 Ų | 132.9 | 65% | 0.649 | 70% | 0.704 | S | S | * | * | trans | -124.3 | 61.2 | 171.8 | 37.7 | -19 | 0 | 0 | 0 | 109.3 | M2 | M2-P4 HydrophobicContact CB-CG 4.3Š| ||
| 5 | E | 53.5 | Low | 47.6 | Very low | 176 Ų | 176 | 126.3 Ų | 126.3 | 82% | 0.822 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -141.4 | -1.2 | 175.9 | -119.9 | -172.8 | 124.8 | 0 | 0 | 115.1 | ||
| 6 | Q | 45.7 | Very low | 48.7 | Very low | 164 Ų | 164 | 120.9 Ų | 120.9 | 77% | 0.766 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -98 | -11.4 | -175 | -149.9 | 171.4 | 10.2 | 0 | 0 | 114.4 | S9 | Q6-S9 PolarHBondContact O-OG 2.99Š|
| 7 | S | 49.2 | Very low | 49.6 | Very low | 82 Ų | 82 | 122.6 Ų | 122.6 | 57% | 0.573 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -82 | -30.6 | -178.3 | 61.7 | 0 | 0 | 0 | 0 | 113.9 | ||
| 8 | N | 45.3 | Very low | 50.5 | Low | 113 Ų | 113 | 121.6 Ų | 121.6 | 60% | 0.604 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -77.8 | -26.9 | -172.8 | -67.3 | -12.1 | 0 | 0 | 0 | 112.8 | A12 | N8-A12 WeakPolarHBondContact O-CB 3.48Å; N8-A12 PolarHBondContact O-N 3.44Å |
| 9 | S | 43.8 | Very low | 51.4 | Low | 64 Ų | 64 | 121.5 Ų | 121.5 | 45% | 0.448 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -72 | -36.5 | 178.9 | 58.5 | 0 | 0 | 0 | 0 | 112.4 | Q6 L13 | Q6-S9 PolarHBondContact O-OG 2.99Å; S9-L13 PolarHBondContact O-N 3.37Å |
| 10 | V | 46.7 | Very low | 52.2 | Low | 91 Ų | 91 | 118.5 Ų | 118.5 | 55% | 0.552 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -70.2 | -40 | 179.3 | -177 | 0 | 0 | 0 | 0 | 110.6 | L13 D14 | V10-L13 PolarHBondContact O-N 3.16Å; V10-D14 PolarHBondContact O-N 3.2Å |
| 11 | Q | 47.8 | Very low | 53 | Low | 149 Ų | 149 | 117.6 Ų | 117.6 | 70% | 0.696 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -70.1 | -33.8 | 179.1 | -143.2 | 169.7 | 30.4 | 0 | 0 | 112.5 | G15 | Q11-G15 PolarHBondContact O-N 3.45Å |
| 12 | A | 50.5 | Low | 54.3 | Low | 68 Ų | 68 | 107.8 Ų | 107.8 | 56% | 0.562 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -69.1 | -36.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | N8 G15 G16 | N8-A12 WeakPolarHBondContact O-CB 3.48Å; N8-A12 PolarHBondContact O-N 3.44Å; A12-G15 PolarHBondContact O-N 3.26Å; A12-G16 PolarHBondContact O-N 3.38Å |
| 13 | L | 51.3 | Low | 56.1 | Low | 134 Ų | 134 | 102.9 Ų | 102.9 | 70% | 0.702 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64.8 | -43.2 | 174 | -114.7 | 81.5 | 0 | 0 | 0 | 112 | S9 V10 G16 Y17 | S9-L13 PolarHBondContact O-N 3.37Å; V10-L13 PolarHBondContact O-N 3.16Å; L13-G16 PolarHBondContact O-N 3.44Å; L13-Y17 WeakPolarHBondContact O-CB 3.32Å; L13-Y17 PolarHBondContact O-N 3.41Å |
| 14 | D | 55.3 | Low | 57.4 | Low | 97 Ų | 97 | 97.3 Ų | 97.3 | 52% | 0.519 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66 | -38.9 | 177.2 | -101.3 | -8.4 | 0 | 0 | 0 | 112.2 | V10 Y17 N18 | V10-D14 PolarHBondContact O-N 3.2Å; D14-Y17 PolarHBondContact O-N 2.91Å; D14-N18 PolarHBondContact O-N 2.88Å; D14-N18 PolarHBondContact O-ND2 3.23Å |
| 15 | G | 60.9 | Low | 58.5 | Low | 33 Ų | 33 | 98.1 Ų | 98.1 | 34% | 0.34 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.5 | -47.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q11 A12 Y17 N18 I19 | Q11-G15 PolarHBondContact O-N 3.45Å; A12-G15 PolarHBondContact O-N 3.26Å; G15-Y17 PolarHBondContact O-N 3.42Å; G15-N18 PolarHBondContact O-N 2.88Å; G15-I19 WeakPolarHBondContact O-CD1 3.32Å; G15-I19 VanDerWaalsContact O-CG1 3.29Å; G15-I19 WeakPolarHBondContact O-CG1 3.28Å; G15-I19 PolarHBondContact O-N 2.85Å |
| 16 | G | 64.9 | Low | 59.2 | Low | 41 Ų | 41 | 96.2 Ų | 96.2 | 42% | 0.423 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.4 | -40 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | A12 L13 I19 A20 | A12-G16 PolarHBondContact O-N 3.38Å; L13-G16 PolarHBondContact O-N 3.44Å; G16-I19 PolarHBondContact O-N 3.37Å; G16-A20 WeakPolarHBondContact O-CB 3.24Å; G16-A20 PolarHBondContact O-N 2.87Å |
| 17 | Y | 63.6 | Low | 59.9 | Low | 150 Ų | 150 | 92.7 Ų | 92.7 | 59% | 0.588 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.4 | -42.9 | 178.6 | -176.5 | -101.8 | 0 | 0 | 0 | 112.4 | L13 D14 G15 I19 A20 K21 | L13-Y17 WeakPolarHBondContact O-CB 3.32Å; L13-Y17 PolarHBondContact O-N 3.41Å; D14-Y17 PolarHBondContact O-N 2.91Å; G15-Y17 PolarHBondContact O-N 3.42Å; Y17-I19 VanDerWaalsContact C-N 3.33Å; Y17-I19 PolarHBondContact O-N 3.05Å; Y17-A20 PolarHBondContact O-N 3.47Å; Y17-K21 HydrophobicContact CE1-CD 4.46Å; Y17-K21 VanDerWaalsContact O-CB 3.28Å; Y17-K21 WeakPolarHBondContact O-CB 3.4Å; Y17-K21 PolarHBondContact O-N 2.94Å |
| 18 | N | 66.4 | Low | 60.4 | Low | 103 Ų | 103 | 94.6 Ų | 94.6 | 55% | 0.551 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.2 | -37 | 177.5 | -75.1 | -36.4 | 0 | 0 | 0 | 112.4 | D14 G15 G22 | D14-N18 PolarHBondContact O-N 2.88Å; D14-N18 PolarHBondContact O-ND2 3.23Å; G15-N18 PolarHBondContact O-N 2.88Å; N18-G22 PolarHBondContact O-N 3.41Å |
| 19 | I | 68.1 | Low | 61.1 | Low | 121 Ų | 121 | 92.3 Ų | 92.3 | 62% | 0.621 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66 | -48.8 | 174.6 | -64.7 | 165.2 | 0 | 0 | 0 | 110.2 | G15 G16 Y17 K21 G22 V23 | G15-I19 WeakPolarHBondContact O-CD1 3.32Å; G15-I19 VanDerWaalsContact O-CG1 3.29Å; G15-I19 WeakPolarHBondContact O-CG1 3.28Å; G15-I19 PolarHBondContact O-N 2.85Å; G16-I19 PolarHBondContact O-N 3.37Å; Y17-I19 VanDerWaalsContact C-N 3.33Å; Y17-I19 PolarHBondContact O-N 3.05Å; I19-K21 VanDerWaalsContact C-N 3.31Å; I19-K21 PolarHBondContact O-N 2.9Å; I19-G22 PolarHBondContact O-N 2.99Å; I19-V23 WeakPolarHBondContact O-CG2 3.48Å; I19-V23 PolarHBondContact O-N 2.93Å |
| 20 | A | 66.5 | Low | 61.8 | Low | 60 Ų | 60 | 91.1 Ų | 91.1 | 50% | 0.496 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.7 | -39.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G16 Y17 V23 L24 | G16-A20 WeakPolarHBondContact O-CB 3.24Å; G16-A20 PolarHBondContact O-N 2.87Å; Y17-A20 PolarHBondContact O-N 3.47Å; A20-V23 PolarHBondContact O-N 3.41Å; A20-L24 WeakPolarHBondContact O-CB 3.18Å; A20-L24 PolarHBondContact O-N 3.28Å |
| 21 | K | 70.4 | Confident | 62 | Low | 101 Ų | 101 | 95.4 Ų | 95.4 | 44% | 0.439 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.9 | -43.8 | 174.7 | -169.5 | -176.8 | 177.7 | -170 | 0 | 111.6 | Y17 I19 L24 E25 | Y17-K21 HydrophobicContact CE1-CD 4.46Å; Y17-K21 VanDerWaalsContact O-CB 3.28Å; Y17-K21 WeakPolarHBondContact O-CB 3.4Å; Y17-K21 PolarHBondContact O-N 2.94Å; I19-K21 VanDerWaalsContact C-N 3.31Å; I19-K21 PolarHBondContact O-N 2.9Å; K21-L24 PolarHBondContact O-N 2.85Å; K21-E25 PolarHBondContact O-N 3.28Å |
| 22 | G | 68.4 | Low | 62.1 | Low | 33 Ų | 33 | 96.5 Ų | 96.5 | 34% | 0.34 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.7 | -44.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | N18 I19 E25 L26 | N18-G22 PolarHBondContact O-N 3.41Å; I19-G22 PolarHBondContact O-N 2.99Å; G22-E25 PolarHBondContact O-N 2.96Å; G22-L26 PolarHBondContact O-N 3.47Å |
| 23 | V | 74 | Confident | 61.9 | Low | 75 Ų | 75 | 98.2 Ų | 98.2 | 46% | 0.455 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.2 | -41 | 176 | 174 | 0 | 0 | 0 | 0 | 111.4 | I19 A20 L26 M27 | I19-V23 WeakPolarHBondContact O-CG2 3.48Å; I19-V23 PolarHBondContact O-N 2.93Å; A20-V23 PolarHBondContact O-N 3.41Å; V23-L26 PolarHBondContact O-N 3.35Å; V23-M27 HydrophobicContact CG1-CE 3.87Å; V23-M27 PolarHBondContact O-N 2.95Å |
| 24 | L | 66.8 | Low | 61.9 | Low | 88 Ų | 88 | 97.1 Ų | 97.1 | 46% | 0.461 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.4 | -38 | 177.6 | -174.3 | 67.2 | 0 | 0 | 0 | 112.5 | A20 K21 M27 K28 | A20-L24 WeakPolarHBondContact O-CB 3.18Å; A20-L24 PolarHBondContact O-N 3.28Å; K21-L24 PolarHBondContact O-N 2.85Å; L24-M27 PolarHBondContact O-N 3.34Å; L24-K28 WeakPolarHBondContact O-CB 3.27Å; L24-K28 WeakPolarHBondContact O-CG 3.43Å; L24-K28 PolarHBondContact O-N 2.93Å |
| 25 | E | 69.8 | Low | 61.3 | Low | 118 Ų | 118 | 100 Ų | 100 | 55% | 0.551 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.5 | -39.2 | 175.3 | -76.3 | -167.9 | -174.6 | 0 | 0 | 112.2 | K21 G22 K28 A29 | K21-E25 PolarHBondContact O-N 3.28Å; G22-E25 PolarHBondContact O-N 2.96Å; E25-K28 PolarHBondContact O-N 2.89Å; E25-A29 WeakPolarHBondContact O-CB 3.34Å; E25-A29 PolarHBondContact O-N 3.45Å |
| 26 | L | 67.1 | Low | 60.5 | Low | 135 Ų | 135 | 100.7 Ų | 100.7 | 71% | 0.707 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -60.2 | -45.7 | 171.9 | -81.8 | 158.7 | 0 | 0 | 0 | 111.8 | G22 V23 K28 A29 G30 | G22-L26 PolarHBondContact O-N 3.47Å; V23-L26 PolarHBondContact O-N 3.35Å; L26-K28 PolarHBondContact O-N 2.91Å; L26-A29 PolarHBondContact O-N 3.29Å; L26-G30 PolarHBondContact O-N 3.48Å |
| 27 | M | 60.9 | Low | 59.3 | Low | 90 Ų | 90 | 104.8 Ų | 104.8 | 44% | 0.443 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.6 | -41.5 | 174.7 | -86 | -162.6 | -93.3 | 0 | 0 | 112.3 | V23 L24 G30 R31 | V23-M27 HydrophobicContact CG1-CE 3.87Å; V23-M27 PolarHBondContact O-N 2.95Å; L24-M27 PolarHBondContact O-N 3.34Å; M27-G30 PolarHBondContact O-N 3.23Å; M27-R31 WeakPolarHBondContact O-CB 3.45Å; M27-R31 PolarHBondContact O-N 2.96Å |
| 28 | K | 60.4 | Low | 58.6 | Low | 122 Ų | 122 | 105.5 Ų | 105.5 | 53% | 0.53 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.8 | -37.2 | 177 | -80.8 | 178.7 | 178.1 | 176.3 | 0 | 112.5 | L24 E25 L26 R31 K32 | L24-K28 WeakPolarHBondContact O-CB 3.27Å; L24-K28 WeakPolarHBondContact O-CG 3.43Å; L24-K28 PolarHBondContact O-N 2.93Å; E25-K28 PolarHBondContact O-N 2.89Å; L26-K28 PolarHBondContact O-N 2.91Å; K28-R31 PolarHBondContact O-N 3.38Å; K28-K32 WeakPolarHBondContact O-CB 3.26Å; K28-K32 WeakPolarHBondContact O-CG 3.47Å; K28-K32 PolarHBondContact O-N 2.9Å |
| 29 | A | 60.5 | Low | 57.6 | Low | 66 Ų | 66 | 105 Ų | 105 | 55% | 0.545 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.5 | -41.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | E25 L26 S33 | E25-A29 WeakPolarHBondContact O-CB 3.34Å; E25-A29 PolarHBondContact O-N 3.45Å; L26-A29 PolarHBondContact O-N 3.29Å; A29-S33 PolarHBondContact O-N 3.42Å |
| 30 | G | 57.4 | Low | 56.8 | Low | 39 Ų | 39 | 104.2 Ų | 104.2 | 40% | 0.402 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -62.7 | -41.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113 | L26 M27 S33 I34 | L26-G30 PolarHBondContact O-N 3.48Å; M27-G30 PolarHBondContact O-N 3.23Å; G30-S33 PolarHBondContact O-N 2.88Å; G30-I34 WeakPolarHBondContact O-CD1 3.28Å; G30-I34 WeakPolarHBondContact O-CG1 3.45Å |
| 31 | R | 51.3 | Low | 56.2 | Low | 180 Ų | 180 | 107.1 Ų | 107.1 | 68% | 0.679 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -73.3 | -35.2 | -178.1 | -137.5 | 178.7 | -142.1 | 167.4 | 8.7 | 113.5 | M27 K28 S33 I34 | M27-R31 WeakPolarHBondContact O-CB 3.45Å; M27-R31 PolarHBondContact O-N 2.96Å; K28-R31 PolarHBondContact O-N 3.38Å; R31-S33 PolarHBondContact O-N 2.94Å; R31-I34 PolarHBondContact O-N 3.36Å; R31-I34 VanDerWaalsContact O-N 3.15Å |
| 32 | K | 48.7 | Very low | 55.4 | Low | 172 Ų | 172 | 107.2 Ų | 107.2 | 75% | 0.748 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68.2 | -21.5 | 175.8 | -76.5 | -174.5 | 178.5 | -175 | 0 | 113.1 | K28 I34 | K28-K32 WeakPolarHBondContact O-CB 3.26Å; K28-K32 WeakPolarHBondContact O-CG 3.47Å; K28-K32 PolarHBondContact O-N 2.9Å; K32-I34 VanDerWaalsContact C-N 3.27Å; K32-I34 PolarHBondContact O-N 3.14Å |
| 33 | S | 48.1 | Very low | 54.2 | Low | 104 Ų | 104 | 112.5 Ų | 112.5 | 73% | 0.727 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -14.8 | 172.3 | -175.6 | 0 | 0 | 0 | 0 | 113.7 | A29 G30 R31 | A29-S33 PolarHBondContact O-N 3.42Å; G30-S33 PolarHBondContact O-N 2.88Å; R31-S33 PolarHBondContact O-N 2.94Å |
| 34 | I | 50.5 | Low | 53 | Low | 111 Ų | 111 | 116.8 Ų | 116.8 | 57% | 0.569 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.8 | -6.1 | -168.8 | -59.9 | 170.9 | 0 | 0 | 0 | 111.8 | G30 R31 K32 F38 | G30-I34 WeakPolarHBondContact O-CD1 3.28Å; G30-I34 WeakPolarHBondContact O-CG1 3.45Å; R31-I34 PolarHBondContact O-N 3.36Å; R31-I34 VanDerWaalsContact O-N 3.15Å; K32-I34 VanDerWaalsContact C-N 3.27Å; K32-I34 PolarHBondContact O-N 3.14Å; I34-F38 HydrophobicContact CG2-CE2 4.26Å |
| 35 | Q | 42.6 | Very low | 52.3 | Low | 159 Ų | 159 | 117.7 Ų | 117.7 | 74% | 0.743 | 65% | 0.645 | S | S | * | * | trans | -99.6 | 16.7 | -168.2 | -128.3 | 166.8 | 32 | 0 | 0 | 115.8 | ||||
| 36 | G | 43.1 | Very low | 50.9 | Low | 46 Ų | 46 | 121.6 Ų | 121.6 | 47% | 0.474 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -88.9 | 159.5 | 165.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | F38 | G36-F38 PolarHBondContact O-N 3.4Š|
| 37 | P | 40.9 | Very low | 49.6 | Very low | 128 Ų | 128 | 120.5 Ų | 120.5 | 83% | 0.831 | 66% | 0.655 | S | S | * | * | trans | -55.1 | 113.5 | 175.6 | 23.8 | -31.6 | 0 | 0 | 0 | 108.5 | N39 | P37-N39 VanDerWaalsContact C-N 3.31Å; P37-N39 PolarHBondContact O-N 3.44Å | ||
| 38 | F | 48.5 | Very low | 48.5 | Very low | 164 Ų | 164 | 122.3 Ų | 122.3 | 72% | 0.719 | 67% | 0.667 | S | S | * | * | trans | -66.7 | 90.7 | -173.2 | -141.5 | -88.7 | 0 | 0 | 0 | 108.3 | I34 G36 P40 | I34-F38 HydrophobicContact CG2-CE2 4.26Å; G36-F38 PolarHBondContact O-N 3.4Å; F38-P40 WeakPolarHBondContact O-CD 3.39Å | ||
| 39 | N | 44.6 | Very low | 47.5 | Very low | 93 Ų | 93 | 120.2 Ų | 120.2 | 50% | 0.497 | 67% | 0.668 | S | S | . | * | trans | -101.7 | 101.6 | 178.5 | -144.6 | -13.4 | 0 | 0 | 0 | 107.2 | P37 T41 T42 | P37-N39 VanDerWaalsContact C-N 3.31Å; P37-N39 PolarHBondContact O-N 3.44Å; N39-T41 PolarHBondContact O-N 3.44Å; N39-T41 PolarHBondContact OD1-OG1 2.89Å; N39-T41 VanDerWaalsContact OD1-OG1 3.12Å; N39-T42 PolarHBondContact O-N 2.88Å; N39-T42 VanDerWaalsContact O-N 3.1Å; N39-T42 PolarHBondContact O-OG1 3.16Å | ||
| 40 | P | 51.4 | Low | 46.5 | Very low | 104 Ų | 104 | 125.6 Ų | 125.6 | 68% | 0.675 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -61.5 | -17.4 | -173.5 | 24.1 | -33.4 | 0 | 0 | 0 | 112.9 | F38 | F38-P40 WeakPolarHBondContact O-CD 3.39Š|
| 41 | T | 54.1 | Low | 45.8 | Very low | 121 Ų | 121 | 131.4 Ų | 131.4 | 74% | 0.742 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -83.4 | -13.3 | 179.4 | 32.4 | 0 | 0 | 0 | 0 | 114.9 | N39 | N39-T41 PolarHBondContact O-N 3.44Å; N39-T41 PolarHBondContact OD1-OG1 2.89Å; N39-T41 VanDerWaalsContact OD1-OG1 3.12Å |
| 42 | T | 54.1 | Low | 45.4 | Very low | 103 Ų | 103 | 128.9 Ų | 128.9 | 63% | 0.632 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -107.6 | 10.1 | 178.4 | 57.6 | 0 | 0 | 0 | 0 | 113.1 | N39 L44 | N39-T42 PolarHBondContact O-N 2.88Å; N39-T42 VanDerWaalsContact O-N 3.1Å; N39-T42 PolarHBondContact O-OG1 3.16Å; T42-L44 PolarHBondContact O-N 2.85Å |
| 43 | M | 43.7 | Very low | 45.2 | Very low | 144 Ų | 144 | 125.6 Ų | 125.6 | 71% | 0.709 | 69% | 0.693 | S | S | * | * | trans | -72.3 | 101.8 | 176.6 | -148.6 | 178.9 | 169.6 | 0 | 0 | 108.2 | S45 | M43-S45 PolarHBondContact O-N 2.91Š| ||
| 44 | L | 49.3 | Very low | 45 | Very low | 165 Ų | 165 | 125.3 Ų | 125.3 | 86% | 0.864 | 69% | 0.688 | S | S | * | * | trans | -48.4 | 115.2 | 166.4 | -88 | 139.4 | 0 | 0 | 0 | 107.7 | T42 W46 | T42-L44 PolarHBondContact O-N 2.85Å; L44-W46 PolarHBondContact O-N 3.31Å | ||
| 45 | S | 50.1 | Low | 44.7 | Very low | 107 Ų | 107 | 128.3 Ų | 128.3 | 75% | 0.748 | 71% | 0.705 | S | S | * | * | trans | -49.6 | 111.8 | 178.2 | 48.3 | 0 | 0 | 0 | 0 | 108.8 | M43 P47 | M43-S45 PolarHBondContact O-N 2.91Å; S45-P47 VanDerWaalsContact O-CD 3.23Å; S45-P47 WeakPolarHBondContact O-CD 3.25Å | ||
| 46 | W | 42.1 | Very low | 45.1 | Very low | 201 Ų | 201 | 122.6 Ų | 122.6 | 76% | 0.761 | 69% | 0.689 | S | S | * | * | trans | -56 | 114.2 | 170.9 | -160.8 | -80.8 | 0 | 0 | 0 | 107 | L44 N48 | L44-W46 PolarHBondContact O-N 3.31Å; W46-N48 PolarHBondContact O-N 3.37Å; W46-N48 VanDerWaalsContact O-N 3.13Å | ||
| 47 | P | 39.9 | Very low | 45.2 | Very low | 111 Ų | 111 | 126.8 Ų | 126.8 | 72% | 0.721 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | 122.2 | 177.5 | 26.1 | -27.1 | 0 | 0 | 0 | 106.2 | S45 | S45-P47 VanDerWaalsContact O-CD 3.23Å; S45-P47 WeakPolarHBondContact O-CD 3.25Å |
| 48 | N | 38 | Very low | 45.6 | Very low | 129 Ų | 129 | 123.6 Ų | 123.6 | 69% | 0.69 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 83.4 | 28.7 | 169.8 | -99.2 | -6.5 | 0 | 0 | 0 | 121.2 | W46 | W46-N48 PolarHBondContact O-N 3.37Å; W46-N48 VanDerWaalsContact O-N 3.13Å |
| 49 | S | 39.3 | Very low | 45.6 | Very low | 77 Ų | 77 | 122.9 Ų | 122.9 | 54% | 0.538 | 69% | 0.687 | S | S | . | * | S | Bend | trans | -93.5 | -8.3 | 165.8 | 63.7 | 0 | 0 | 0 | 0 | 115.2 | ||
| 50 | Q | 39.6 | Very low | 45.7 | Very low | 179 Ų | 179 | 126.6 Ų | 126.6 | 84% | 0.836 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -92.6 | -4 | -175.9 | -75.8 | -173.3 | -12.3 | 0 | 0 | 115.5 | ||
| 51 | Q | 42.4 | Very low | 45.6 | Very low | 161 Ų | 161 | 132.1 Ų | 132.1 | 75% | 0.752 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | 4.5 | -176.6 | -75.5 | -172.3 | -3 | 0 | 0 | 115.3 | ||
| 52 | V | 43.3 | Very low | 45.2 | Very low | 127 Ų | 127 | 134.1 Ų | 134.1 | 77% | 0.77 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.5 | 43.1 | 175.9 | -159.9 | 0 | 0 | 0 | 0 | 111.5 | P54 | V52-P54 WeakPolarHBondContact O-CD 3.48Š|
| 53 | L | 43.4 | Very low | 44.6 | Very low | 104 Ų | 104 | 135.6 Ų | 135.6 | 55% | 0.545 | 70% | 0.704 | S | S | . | * | trans | -98.3 | 100 | 159.3 | -108 | 72.1 | 0 | 0 | 0 | 107.8 | N55 L58 | L53-N55 PolarHBondContact O-N 3.29Å; L53-L58 HydrophobicContact CD2-CD1 4.47Å; L53-L58 HydrophobicContact CG-CD1 4.07Å | ||
| 54 | P | 44.3 | Very low | 44.7 | Very low | 97 Ų | 97 | 131.6 Ų | 131.6 | 63% | 0.63 | 69% | 0.69 | S | S | * | * | trans | -65.1 | 121.9 | 166.7 | 26.5 | -29.1 | 0 | 0 | 0 | 107.1 | V52 G56 L58 | V52-P54 WeakPolarHBondContact O-CD 3.48Å; P54-G56 PolarHBondContact O-N 2.91Å; P54-L58 VanDerWaalsContact O-CD1 3.24Å; P54-L58 WeakPolarHBondContact O-CD1 3.35Å | ||
| 55 | N | 43.6 | Very low | 44.7 | Very low | 174 Ų | 174 | 127.1 Ų | 127.1 | 93% | 0.93 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -65 | 58.5 | 174.4 | -70.4 | -31.5 | 0 | 0 | 0 | 112.1 | L53 | L53-N55 PolarHBondContact O-N 3.29Š|
| 56 | G | 51.1 | Low | 44.6 | Very low | 39 Ų | 39 | 126 Ų | 126 | 40% | 0.402 | 66% | 0.664 | S | S | . | * | S | Bend | trans | -118.1 | 165.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | P54 L58 | P54-G56 PolarHBondContact O-N 2.91Å; G56-L58 PolarHBondContact O-N 3.43Å |
| 57 | P | 44.6 | Very low | 44.9 | Very low | 134 Ų | 134 | 123 Ų | 123 | 87% | 0.87 | 66% | 0.659 | S | S | * | * | trans | -59.2 | 99.8 | -174.8 | 25.6 | -33.2 | 0 | 0 | 0 | 110 | D59 | P57-D59 VanDerWaalsContact C-N 3.25Å; P57-D59 PolarHBondContact O-N 2.83Å | ||
| 58 | L | 49.8 | Very low | 45.4 | Very low | 62 Ų | 62 | 124.8 Ų | 124.8 | 33% | 0.325 | 66% | 0.655 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.8 | 10.8 | -167.5 | -127.6 | 129.4 | 0 | 0 | 0 | 112.7 | L53 P54 G56 Y62 | L53-L58 HydrophobicContact CD2-CD1 4.47Å; L53-L58 HydrophobicContact CG-CD1 4.07Å; P54-L58 VanDerWaalsContact O-CD1 3.24Å; P54-L58 WeakPolarHBondContact O-CD1 3.35Å; G56-L58 PolarHBondContact O-N 3.43Å; L58-Y62 HydrophobicContact CD2-CD2 3.5Å; L58-Y62 HydrophobicContact CD2-CE2 3.61Å |
| 59 | D | 48.4 | Very low | 46.1 | Very low | 148 Ų | 148 | 123.3 Ų | 123.3 | 79% | 0.791 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | -10.9 | -175.7 | -77.1 | -31.5 | 0 | 0 | 0 | 114.5 | P57 | P57-D59 VanDerWaalsContact C-N 3.25Å; P57-D59 PolarHBondContact O-N 2.83Å |
| 60 | Q | 47.9 | Very low | 46.7 | Very low | 172 Ų | 172 | 123.2 Ų | 123.2 | 80% | 0.804 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.9 | -18 | -175.9 | -96.5 | 175.1 | -2.4 | 0 | 0 | 116.2 | ||
| 61 | R | 48.1 | Very low | 47.4 | Very low | 220 Ų | 220 | 117 Ų | 117 | 83% | 0.83 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.8 | -23.3 | 179 | -84.1 | -169.5 | -169.2 | -179 | 5.1 | 114.9 | S64 | R61-S64 PolarHBondContact O-OG 2.93Š|
| 62 | Y | 46.3 | Very low | 48 | Very low | 162 Ų | 162 | 114.2 Ų | 114.2 | 64% | 0.635 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -77.3 | -25.8 | 175.5 | -99.9 | -93.8 | 0 | 0 | 0 | 112.7 | L58 S64 S65 C66 | L58-Y62 HydrophobicContact CD2-CD2 3.5Å; L58-Y62 HydrophobicContact CD2-CE2 3.61Å; Y62-S64 PolarHBondContact O-N 3.38Å; Y62-S65 PolarHBondContact O-N 3.29Å; Y62-S65 VanDerWaalsContact O-N 3.15Å; Y62-C66 PolarHBondContact O-N 3.46Å |
| 63 | Q | 41.3 | Very low | 48.6 | Very low | 134 Ų | 134 | 112.4 Ų | 112.4 | 63% | 0.626 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -61.4 | -41.7 | -177.6 | -158.4 | 170.6 | 8.7 | 0 | 0 | 112.3 | S65 C66 E67 | Q63-S65 VanDerWaalsContact C-N 3.29Å; Q63-S65 PolarHBondContact O-N 3.3Å; Q63-C66 PolarHBondContact O-N 2.86Å; Q63-E67 WeakPolarHBondContact O-CB 3.45Å; Q63-E67 PolarHBondContact O-N 2.86Å |
| 64 | S | 45.2 | Very low | 49.3 | Very low | 60 Ų | 60 | 112.5 Ų | 112.5 | 42% | 0.42 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -69.9 | -22 | 178.4 | 62.2 | 0 | 0 | 0 | 0 | 114.4 | R61 Y62 K68 | R61-S64 PolarHBondContact O-OG 2.93Å; Y62-S64 PolarHBondContact O-N 3.38Å; S64-K68 WeakPolarHBondContact O-CG 3.49Å; S64-K68 PolarHBondContact O-N 3.5Å |
| 65 | S | 51.1 | Low | 50.2 | Low | 72 Ų | 72 | 111.9 Ų | 111.9 | 50% | 0.503 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -83.3 | -37.8 | 177 | -87.4 | 0 | 0 | 0 | 0 | 111.9 | Y62 Q63 K68 V69 | Y62-S65 PolarHBondContact O-N 3.29Å; Y62-S65 VanDerWaalsContact O-N 3.15Å; Q63-S65 VanDerWaalsContact C-N 3.29Å; Q63-S65 PolarHBondContact O-N 3.3Å; S65-K68 PolarHBondContact O-N 2.86Å; S65-V69 WeakPolarHBondContact O-CG2 3.43Å; S65-V69 PolarHBondContact O-N 3.32Å; S65-V69 VanDerWaalsContact O-N 3.13Å |
| 66 | C | 46.8 | Very low | 51.1 | Low | 84 Ų | 84 | 105.2 Ų | 105.2 | 57% | 0.568 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.8 | -40 | 170.6 | -92.3 | 0 | 0 | 0 | 0 | 111.5 | Y62 Q63 K68 V69 C70 | Y62-C66 PolarHBondContact O-N 3.46Å; Q63-C66 PolarHBondContact O-N 2.86Å; C66-K68 VanDerWaalsContact C-N 3.29Å; C66-K68 PolarHBondContact O-N 3.5Å; C66-V69 PolarHBondContact O-N 2.9Å; C66-V69 VanDerWaalsContact O-N 3.1Å; C66-C70 WeakPolarHBondContact O-CB 3.4Å; C66-C70 PolarHBondContact O-N 2.82Å; C66-C70 PolarHBondContact O-SG 3.33Å |
| 67 | E | 48.2 | Very low | 51.7 | Low | 138 Ų | 138 | 107.7 Ų | 107.7 | 65% | 0.645 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.9 | -37.5 | 178 | -166.8 | 172.4 | -171.2 | 0 | 0 | 112.1 | Q63 A71 | Q63-E67 WeakPolarHBondContact O-CB 3.45Å; Q63-E67 PolarHBondContact O-N 2.86Å; E67-A71 VanDerWaalsContact O-CB 3.25Å; E67-A71 WeakPolarHBondContact O-CB 3.4Å; E67-A71 PolarHBondContact O-N 2.81Å |
| 68 | K | 51 | Low | 52.7 | Low | 148 Ų | 148 | 105.8 Ų | 105.8 | 64% | 0.643 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.6 | -37.5 | 172.6 | -74.5 | 179.2 | -175.1 | 178.4 | 0 | 113 | S64 S65 C66 V72 | S64-K68 WeakPolarHBondContact O-CG 3.49Å; S64-K68 PolarHBondContact O-N 3.5Å; S65-K68 PolarHBondContact O-N 2.86Å; C66-K68 VanDerWaalsContact C-N 3.29Å; C66-K68 PolarHBondContact O-N 3.5Å; K68-V72 WeakPolarHBondContact O-CG2 3.28Å; K68-V72 PolarHBondContact O-N 2.87Å |
| 69 | V | 52.8 | Low | 53.7 | Low | 97 Ų | 97 | 107.8 Ų | 107.8 | 59% | 0.588 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -71.1 | -40.8 | 177.2 | 176.3 | 0 | 0 | 0 | 0 | 110.7 | S65 C66 V72 D73 | S65-V69 WeakPolarHBondContact O-CG2 3.43Å; S65-V69 PolarHBondContact O-N 3.32Å; S65-V69 VanDerWaalsContact O-N 3.13Å; C66-V69 PolarHBondContact O-N 2.9Å; C66-V69 VanDerWaalsContact O-N 3.1Å; V69-V72 PolarHBondContact O-N 3.29Å; V69-D73 PolarHBondContact O-N 3.32Å |
| 70 | C | 51.9 | Low | 54.4 | Low | 75 Ų | 75 | 104 Ų | 104 | 51% | 0.507 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.8 | -41.2 | 173.7 | -67 | 0 | 0 | 0 | 0 | 112 | C66 V72 D73 D74 | C66-C70 WeakPolarHBondContact O-CB 3.4Å; C66-C70 PolarHBondContact O-N 2.82Å; C66-C70 PolarHBondContact O-SG 3.33Å; C70-V72 VanDerWaalsContact C-N 3.29Å; C70-V72 PolarHBondContact O-N 3.37Å; C70-D73 PolarHBondContact O-N 3.28Å; C70-D74 PolarHBondContact O-N 3.29Å |
| 71 | A | 53.5 | Low | 55.3 | Low | 50 Ų | 50 | 103.7 Ų | 103.7 | 41% | 0.413 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.8 | -35.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | E67 V75 | E67-A71 VanDerWaalsContact O-CB 3.25Å; E67-A71 WeakPolarHBondContact O-CB 3.4Å; E67-A71 PolarHBondContact O-N 2.81Å; A71-V75 WeakPolarHBondContact O-CB 3.28Å; A71-V75 WeakPolarHBondContact O-CG2 3.46Å; A71-V75 PolarHBondContact O-N 3.46Å; A71-V75 VanDerWaalsContact O-N 3.08Å |
| 72 | V | 55.2 | Low | 56.2 | Low | 101 Ų | 101 | 98.3 Ų | 98.3 | 61% | 0.612 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -72.3 | -35.7 | 175 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | K68 V69 C70 V75 A76 | K68-V72 WeakPolarHBondContact O-CG2 3.28Å; K68-V72 PolarHBondContact O-N 2.87Å; V69-V72 PolarHBondContact O-N 3.29Å; C70-V72 VanDerWaalsContact C-N 3.29Å; C70-V72 PolarHBondContact O-N 3.37Å; V72-V75 PolarHBondContact O-N 2.96Å; V72-A76 WeakPolarHBondContact O-CB 3.28Å; V72-A76 PolarHBondContact O-N 2.86Å |
| 73 | D | 56.2 | Low | 57 | Low | 89 Ų | 89 | 93.2 Ų | 93.2 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 175.1 | -133.6 | -23.3 | 0 | 0 | 0 | 111.2 | V69 C70 V75 A76 E77 | V69-D73 PolarHBondContact O-N 3.32Å; C70-D73 PolarHBondContact O-N 3.28Å; D73-V75 VanDerWaalsContact C-N 3.34Å; D73-V75 PolarHBondContact O-N 3.49Å; D73-A76 PolarHBondContact O-N 3.42Å; D73-E77 PolarHBondContact O-N 2.95Å |
| 74 | D | 58.8 | Low | 58.2 | Low | 107 Ų | 107 | 94.3 Ų | 94.3 | 57% | 0.572 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.8 | -41.1 | 174.1 | -85.5 | -20.9 | 0 | 0 | 0 | 111.9 | C70 E77 T78 | C70-D74 PolarHBondContact O-N 3.29Å; D74-E77 PolarHBondContact O-N 3.27Å; D74-T78 WeakPolarHBondContact O-CB 3.16Å; D74-T78 PolarHBondContact O-N 3.25Å; D74-T78 PolarHBondContact O-OG1 3.1Å |
| 75 | V | 62 | Low | 59.1 | Low | 83 Ų | 83 | 97.6 Ų | 97.6 | 50% | 0.503 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67 | -41 | 175.4 | 171 | 0 | 0 | 0 | 0 | 110.7 | A71 V72 D73 T78 I79 | A71-V75 WeakPolarHBondContact O-CB 3.28Å; A71-V75 WeakPolarHBondContact O-CG2 3.46Å; A71-V75 PolarHBondContact O-N 3.46Å; A71-V75 VanDerWaalsContact O-N 3.08Å; V72-V75 PolarHBondContact O-N 2.96Å; D73-V75 VanDerWaalsContact C-N 3.34Å; D73-V75 PolarHBondContact O-N 3.49Å; V75-T78 PolarHBondContact O-N 2.9Å; V75-I79 HydrophobicContact CG1-CD1 3.68Å; V75-I79 HydrophobicContact CG1-CG1 4.34Å; V75-I79 WeakPolarHBondContact O-CB 3.4Å; V75-I79 VanDerWaalsContact O-CG1 3.22Å; V75-I79 WeakPolarHBondContact O-CG1 3.32Å; V75-I79 PolarHBondContact O-N 3.47Å |
| 76 | A | 62.6 | Low | 59.6 | Low | 34 Ų | 34 | 99.2 Ų | 99.2 | 28% | 0.281 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.9 | -40.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V72 D73 I79 S80 | V72-A76 WeakPolarHBondContact O-CB 3.28Å; V72-A76 PolarHBondContact O-N 2.86Å; D73-A76 PolarHBondContact O-N 3.42Å; A76-I79 PolarHBondContact O-N 3.49Å; A76-S80 WeakPolarHBondContact O-CB 3.3Å; A76-S80 PolarHBondContact O-N 2.89Å; A76-S80 PolarHBondContact O-OG 3.29Å |
| 77 | E | 64.4 | Low | 60.3 | Low | 91 Ų | 91 | 96.8 Ų | 96.8 | 43% | 0.425 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -44 | 173.9 | -170.8 | 173.6 | 168.4 | 0 | 0 | 110.7 | D73 D74 I79 S80 R81 | D73-E77 PolarHBondContact O-N 2.95Å; D74-E77 PolarHBondContact O-N 3.27Å; E77-I79 PolarHBondContact O-N 3.28Å; E77-S80 WeakPolarHBondContact CA-OG 3.36Å; E77-S80 PolarHBondContact O-N 3.47Å; E77-S80 PolarHBondContact O-OG 3.46Å; E77-R81 WeakPolarHBondContact O-CG 3.18Å; E77-R81 PolarHBondContact O-N 3.4Å; E77-R81 IonicContact OE1-CZ 3.33Å; E77-R81 IonicContact OE1-NE 3.25Å; E77-R81 PolarHBondContact OE1-NE 2.88Å; E77-R81 IonicContact OE1-NH2 2.73Å; E77-R81 PolarHBondContact OE1-NH2 3.38Å |
| 78 | T | 66.4 | Low | 61.1 | Low | 94 Ų | 94 | 93.6 Ų | 93.6 | 58% | 0.577 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.3 | -43.6 | 178.1 | -52.1 | 0 | 0 | 0 | 0 | 111.7 | D74 V75 R81 L82 | D74-T78 WeakPolarHBondContact O-CB 3.16Å; D74-T78 PolarHBondContact O-N 3.25Å; D74-T78 PolarHBondContact O-OG1 3.1Å; V75-T78 PolarHBondContact O-N 2.9Å; T78-R81 PolarHBondContact O-N 2.88Å; T78-L82 WeakPolarHBondContact O-CB 3.33Å; T78-L82 PolarHBondContact O-N 2.71Å |
| 79 | I | 69.1 | Low | 61.5 | Low | 105 Ų | 105 | 92.3 Ų | 92.3 | 54% | 0.538 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.4 | -41.1 | 176.5 | -68.3 | 167.5 | 0 | 0 | 0 | 110.8 | V75 A76 E77 L82 A83 | V75-I79 HydrophobicContact CG1-CD1 3.68Å; V75-I79 HydrophobicContact CG1-CG1 4.34Å; V75-I79 WeakPolarHBondContact O-CB 3.4Å; V75-I79 VanDerWaalsContact O-CG1 3.22Å; V75-I79 WeakPolarHBondContact O-CG1 3.32Å; V75-I79 PolarHBondContact O-N 3.47Å; A76-I79 PolarHBondContact O-N 3.49Å; E77-I79 PolarHBondContact O-N 3.28Å; I79-L82 PolarHBondContact O-N 3.18Å; I79-A83 WeakPolarHBondContact O-CB 3.31Å; I79-A83 PolarHBondContact O-N 2.86Å |
| 80 | S | 63.5 | Low | 62.1 | Low | 68 Ų | 68 | 93.8 Ų | 93.8 | 48% | 0.476 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.2 | -38.4 | 178.7 | 69.2 | 0 | 0 | 0 | 0 | 112.4 | A76 E77 A83 Y84 | A76-S80 WeakPolarHBondContact O-CB 3.3Å; A76-S80 PolarHBondContact O-N 2.89Å; A76-S80 PolarHBondContact O-OG 3.29Å; E77-S80 WeakPolarHBondContact CA-OG 3.36Å; E77-S80 PolarHBondContact O-N 3.47Å; E77-S80 PolarHBondContact O-OG 3.46Å; S80-A83 PolarHBondContact O-N 2.93Å; S80-Y84 WeakPolarHBondContact O-CB 3.46Å; S80-Y84 PolarHBondContact O-N 3.28Å |
| 81 | R | 67.9 | Low | 62.7 | Low | 165 Ų | 165 | 97.1 Ų | 97.1 | 62% | 0.623 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.2 | -41.2 | 171.3 | -74.7 | -176.6 | -175.4 | -166.8 | 4.5 | 111.5 | E77 T78 Y84 K85 | E77-R81 WeakPolarHBondContact O-CG 3.18Å; E77-R81 PolarHBondContact O-N 3.4Å; E77-R81 IonicContact OE1-CZ 3.33Å; E77-R81 IonicContact OE1-NE 3.25Å; E77-R81 PolarHBondContact OE1-NE 2.88Å; E77-R81 IonicContact OE1-NH2 2.73Å; E77-R81 PolarHBondContact OE1-NH2 3.38Å; T78-R81 PolarHBondContact O-N 2.88Å; R81-Y84 PolarHBondContact O-N 3.36Å; R81-K85 WeakPolarHBondContact O-CB 3.41Å; R81-K85 VanDerWaalsContact O-CG 3.32Å; R81-K85 WeakPolarHBondContact O-CG 2.89Å; R81-K85 PolarHBondContact O-N 3.5Å |
| 82 | L | 65.6 | Low | 63.5 | Low | 107 Ų | 107 | 99 Ų | 99 | 56% | 0.56 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.2 | -44 | 176.1 | -171.5 | 69 | 0 | 0 | 0 | 111.2 | T78 I79 Y84 K85 L86 | T78-L82 WeakPolarHBondContact O-CB 3.33Å; T78-L82 PolarHBondContact O-N 2.71Å; I79-L82 PolarHBondContact O-N 3.18Å; L82-Y84 PolarHBondContact O-N 2.96Å; L82-K85 PolarHBondContact O-N 3.31Å; L82-L86 HydrophobicContact CG-CD1 4.12Å; L82-L86 WeakPolarHBondContact O-CB 3.24Å; L82-L86 VanDerWaalsContact O-CG 3.29Å; L82-L86 WeakPolarHBondContact O-CG 3.4Å; L82-L86 PolarHBondContact O-N 3.49Å |
| 83 | A | 63.3 | Low | 64.4 | Low | 55 Ų | 55 | 99.8 Ų | 99.8 | 46% | 0.455 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.1 | -41.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I79 S80 L86 G87 | I79-A83 WeakPolarHBondContact O-CB 3.31Å; I79-A83 PolarHBondContact O-N 2.86Å; S80-A83 PolarHBondContact O-N 2.93Å; A83-L86 PolarHBondContact O-N 2.95Å; A83-G87 PolarHBondContact O-N 3.4Å |
| 84 | Y | 66.3 | Low | 65.3 | Low | 157 Ų | 157 | 98.6 Ų | 98.6 | 62% | 0.616 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.1 | -42.7 | 174.1 | -176.7 | -98.6 | 0 | 0 | 0 | 111.9 | S80 R81 L82 G87 Q88 | S80-Y84 WeakPolarHBondContact O-CB 3.46Å; S80-Y84 PolarHBondContact O-N 3.28Å; R81-Y84 PolarHBondContact O-N 3.36Å; L82-Y84 PolarHBondContact O-N 2.96Å; Y84-G87 PolarHBondContact O-N 3.41Å; Y84-Q88 HydrophobicContact CE1-CG 4.2Å; Y84-Q88 PolarHBondContact O-N 3.26Å; Y84-Q88 PolarHBondContact OH-NE2 3.25Å |
| 85 | K | 65.5 | Low | 66.2 | Low | 130 Ų | 130 | 97.9 Ų | 97.9 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.8 | -40.8 | 174.4 | -73.3 | -70.8 | -176.1 | -176.1 | 0 | 111.9 | R81 L82 Q88 M89 | R81-K85 WeakPolarHBondContact O-CB 3.41Å; R81-K85 VanDerWaalsContact O-CG 3.32Å; R81-K85 WeakPolarHBondContact O-CG 2.89Å; R81-K85 PolarHBondContact O-N 3.5Å; L82-K85 PolarHBondContact O-N 3.31Å; K85-Q88 PolarHBondContact O-N 2.85Å; K85-M89 VanDerWaalsContact O-CG 3.24Å; K85-M89 WeakPolarHBondContact O-CG 3.3Å; K85-M89 PolarHBondContact O-N 3.4Å |
| 86 | L | 60.1 | Low | 67.1 | Low | 105 Ų | 105 | 98.3 Ų | 98.3 | 55% | 0.55 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.1 | -39.7 | 176.5 | -73.3 | 170.1 | 0 | 0 | 0 | 112 | L82 A83 M89 Q90 | L82-L86 HydrophobicContact CG-CD1 4.12Å; L82-L86 WeakPolarHBondContact O-CB 3.24Å; L82-L86 VanDerWaalsContact O-CG 3.29Å; L82-L86 WeakPolarHBondContact O-CG 3.4Å; L82-L86 PolarHBondContact O-N 3.49Å; A83-L86 PolarHBondContact O-N 2.95Å; L86-M89 WeakPolarHBondContact O-CB 3.38Å; L86-M89 PolarHBondContact O-N 2.86Å; L86-Q90 PolarHBondContact O-N 2.87Å |
| 87 | G | 61.7 | Low | 68.1 | Low | 33 Ų | 33 | 102.2 Ų | 102.2 | 34% | 0.34 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A83 Y84 M89 Q90 E91 | A83-G87 PolarHBondContact O-N 3.4Å; Y84-G87 PolarHBondContact O-N 3.41Å; G87-M89 VanDerWaalsContact C-N 3.33Å; G87-M89 PolarHBondContact O-N 3.27Å; G87-Q90 PolarHBondContact O-N 3.4Å; G87-E91 PolarHBondContact O-N 2.93Å; G87-E91 VanDerWaalsContact O-N 3.14Å |
| 88 | Q | 64.7 | Low | 69.1 | Low | 72 Ų | 72 | 105.3 Ų | 105.3 | 34% | 0.336 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.5 | -40.6 | 172.4 | -75.3 | -170.5 | -30 | 0 | 0 | 112.2 | Y84 K85 Q90 E91 I92 | Y84-Q88 HydrophobicContact CE1-CG 4.2Å; Y84-Q88 PolarHBondContact O-N 3.26Å; Y84-Q88 PolarHBondContact OH-NE2 3.25Å; K85-Q88 PolarHBondContact O-N 2.85Å; Q88-Q90 VanDerWaalsContact C-N 3.29Å; Q88-Q90 PolarHBondContact O-N 3.49Å; Q88-E91 PolarHBondContact O-N 2.89Å; Q88-I92 WeakPolarHBondContact O-CB 3.3Å; Q88-I92 WeakPolarHBondContact O-CD1 3.46Å; Q88-I92 VanDerWaalsContact O-CG1 3.22Å; Q88-I92 WeakPolarHBondContact O-CG1 3.44Å; Q88-I92 PolarHBondContact O-N 3.3Å |
| 89 | M | 60.2 | Low | 70.2 | Confident | 120 Ų | 120 | 103.9 Ų | 103.9 | 59% | 0.591 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.1 | -34.8 | 175.7 | -72.1 | -65.3 | -150 | 0 | 0 | 112 | K85 L86 G87 I92 M93 | K85-M89 VanDerWaalsContact O-CG 3.24Å; K85-M89 WeakPolarHBondContact O-CG 3.3Å; K85-M89 PolarHBondContact O-N 3.4Å; L86-M89 WeakPolarHBondContact O-CB 3.38Å; L86-M89 PolarHBondContact O-N 2.86Å; G87-M89 VanDerWaalsContact C-N 3.33Å; G87-M89 PolarHBondContact O-N 3.27Å; M89-I92 PolarHBondContact O-N 3Å; M89-M93 WeakPolarHBondContact O-CB 3.46Å; M89-M93 PolarHBondContact O-N 3.33Å |
| 90 | Q | 65 | Low | 71.1 | Confident | 128 Ų | 128 | 104 Ų | 104 | 60% | 0.598 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -68.1 | -44.5 | 178.6 | -172.4 | 175.6 | -11.6 | 0 | 0 | 111.6 | L86 G87 Q88 I92 M93 V94 | L86-Q90 PolarHBondContact O-N 2.87Å; G87-Q90 PolarHBondContact O-N 3.4Å; Q88-Q90 VanDerWaalsContact C-N 3.29Å; Q88-Q90 PolarHBondContact O-N 3.49Å; Q90-I92 VanDerWaalsContact C-N 3.35Å; Q90-I92 PolarHBondContact O-N 3.45Å; Q90-M93 PolarHBondContact O-N 3.02Å; Q90-V94 WeakPolarHBondContact O-CG2 3.13Å; Q90-V94 PolarHBondContact O-N 2.92Å |
| 91 | E | 64.8 | Low | 72.4 | Confident | 146 Ų | 146 | 105.3 Ų | 105.3 | 68% | 0.682 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.5 | -44.1 | 174.3 | -70.6 | -175.7 | 171.6 | 0 | 0 | 111.5 | G87 Q88 M93 V94 V95 | G87-E91 PolarHBondContact O-N 2.93Å; G87-E91 VanDerWaalsContact O-N 3.14Å; Q88-E91 PolarHBondContact O-N 2.89Å; E91-M93 VanDerWaalsContact C-N 3.34Å; E91-M93 PolarHBondContact O-N 3.19Å; E91-V94 PolarHBondContact O-N 3.45Å; E91-V95 WeakPolarHBondContact O-CG2 3.44Å; E91-V95 PolarHBondContact O-N 3.46Å; E91-V95 VanDerWaalsContact O-N 3.17Å |
| 92 | I | 70.2 | Confident | 73.6 | Confident | 89 Ų | 89 | 102.9 Ų | 102.9 | 46% | 0.456 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.9 | -40.1 | 176.8 | -67.2 | 166.8 | 0 | 0 | 0 | 111 | Q88 M89 Q90 V94 V95 I96 | Q88-I92 WeakPolarHBondContact O-CB 3.3Å; Q88-I92 WeakPolarHBondContact O-CD1 3.46Å; Q88-I92 VanDerWaalsContact O-CG1 3.22Å; Q88-I92 WeakPolarHBondContact O-CG1 3.44Å; Q88-I92 PolarHBondContact O-N 3.3Å; M89-I92 PolarHBondContact O-N 3Å; Q90-I92 VanDerWaalsContact C-N 3.35Å; Q90-I92 PolarHBondContact O-N 3.45Å; I92-V94 VanDerWaalsContact C-N 3.34Å; I92-V94 PolarHBondContact O-N 2.79Å; I92-V95 PolarHBondContact O-N 3.48Å; I92-I96 HydrophobicContact CG2-CD1 3.6Å; I92-I96 HydrophobicContact CG2-CG1 4.16Å; I92-I96 WeakPolarHBondContact O-CB 3.22Å; I92-I96 VanDerWaalsContact O-CG1 3.28Å; I92-I96 WeakPolarHBondContact O-CG1 3.35Å; I92-I96 PolarHBondContact O-N 3.43Å |
| 93 | M | 73.3 | Confident | 74.8 | Confident | 117 Ų | 117 | 102.1 Ų | 102.1 | 58% | 0.576 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.4 | -41.7 | 179.1 | -173.4 | -170.5 | -41.7 | 0 | 0 | 111.5 | M89 Q90 E91 I96 Q97 | M89-M93 WeakPolarHBondContact O-CB 3.46Å; M89-M93 PolarHBondContact O-N 3.33Å; Q90-M93 PolarHBondContact O-N 3.02Å; E91-M93 VanDerWaalsContact C-N 3.34Å; E91-M93 PolarHBondContact O-N 3.19Å; M93-I96 PolarHBondContact O-N 3.26Å; M93-Q97 VanDerWaalsContact O-CB 3.29Å; M93-Q97 WeakPolarHBondContact O-CB 3.28Å; M93-Q97 PolarHBondContact O-N 3.36Å |
| 94 | V | 76.8 | Confident | 76.1 | Confident | 65 Ų | 65 | 102.3 Ų | 102.3 | 39% | 0.394 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 175.9 | 173.7 | 0 | 0 | 0 | 0 | 110.3 | Q90 E91 I92 Q97 Y98 | Q90-V94 WeakPolarHBondContact O-CG2 3.13Å; Q90-V94 PolarHBondContact O-N 2.92Å; E91-V94 PolarHBondContact O-N 3.45Å; I92-V94 VanDerWaalsContact C-N 3.34Å; I92-V94 PolarHBondContact O-N 2.79Å; V94-Q97 PolarHBondContact O-N 3.05Å; V94-Y98 HydrophobicContact CG1-CD2 3.74Å; V94-Y98 HydrophobicContact CG1-CE2 3.59Å; V94-Y98 WeakPolarHBondContact O-CD2 3.28Å; V94-Y98 PolarHBondContact O-N 3.28Å |
| 95 | V | 76.7 | Confident | 77.3 | Confident | 91 Ų | 91 | 96.7 Ų | 96.7 | 55% | 0.552 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.6 | -46.4 | 177.6 | 175.7 | 0 | 0 | 0 | 0 | 111.4 | E91 I92 Q97 Y98 C99 | E91-V95 WeakPolarHBondContact O-CG2 3.44Å; E91-V95 PolarHBondContact O-N 3.46Å; E91-V95 VanDerWaalsContact O-N 3.17Å; I92-V95 PolarHBondContact O-N 3.48Å; V95-Q97 VanDerWaalsContact C-N 3.3Å; V95-Q97 PolarHBondContact O-N 3.23Å; V95-Y98 PolarHBondContact O-N 3.05Å; V95-C99 PolarHBondContact O-N 3.49Å; V95-C99 PolarHBondContact O-SG 3.46Å; V95-C99 VanDerWaalsContact O-SG 3.4Å |
| 96 | I | 80.5 | Confident | 78.6 | Confident | 92 Ų | 92 | 93.7 Ų | 93.7 | 47% | 0.472 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.1 | -42.5 | 176.7 | -69.6 | 171.9 | 0 | 0 | 0 | 110.6 | I92 M93 Y98 C99 L100 | I92-I96 HydrophobicContact CG2-CD1 3.6Å; I92-I96 HydrophobicContact CG2-CG1 4.16Å; I92-I96 WeakPolarHBondContact O-CB 3.22Å; I92-I96 VanDerWaalsContact O-CG1 3.28Å; I92-I96 WeakPolarHBondContact O-CG1 3.35Å; I92-I96 PolarHBondContact O-N 3.43Å; M93-I96 PolarHBondContact O-N 3.26Å; I96-Y98 PolarHBondContact O-N 3.17Å; I96-C99 PolarHBondContact O-N 2.98Å; I96-L100 HydrophobicContact CG2-CD1 4Å; I96-L100 HydrophobicContact CG2-CG 4.32Å; I96-L100 WeakPolarHBondContact O-CG 3.31Å; I96-L100 PolarHBondContact O-N 3.46Å |
| 97 | Q | 84.2 | Confident | 80.2 | Confident | 116 Ų | 116 | 93.4 Ų | 93.4 | 54% | 0.542 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.7 | -44.9 | 178.3 | -174.2 | 175.5 | 0.5 | 0 | 0 | 111.4 | M93 V94 V95 L100 I101 | M93-Q97 VanDerWaalsContact O-CB 3.29Å; M93-Q97 WeakPolarHBondContact O-CB 3.28Å; M93-Q97 PolarHBondContact O-N 3.36Å; V94-Q97 PolarHBondContact O-N 3.05Å; V95-Q97 VanDerWaalsContact C-N 3.3Å; V95-Q97 PolarHBondContact O-N 3.23Å; Q97-L100 PolarHBondContact O-N 3.49Å; Q97-I101 HydrophobicContact CG-CD1 4.11Å; Q97-I101 VanDerWaalsContact O-CG1 3.26Å; Q97-I101 WeakPolarHBondContact O-CG1 3.29Å; Q97-I101 PolarHBondContact O-N 3.44Å |
| 98 | Y | 86.3 | Confident | 81.7 | Confident | 156 Ų | 156 | 94.4 Ų | 94.4 | 61% | 0.612 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62 | -43 | 174.2 | -83.6 | -71.7 | 0 | 0 | 0 | 112.2 | V94 V95 I96 L100 I101 I102 | V94-Y98 HydrophobicContact CG1-CD2 3.74Å; V94-Y98 HydrophobicContact CG1-CE2 3.59Å; V94-Y98 WeakPolarHBondContact O-CD2 3.28Å; V94-Y98 PolarHBondContact O-N 3.28Å; V95-Y98 PolarHBondContact O-N 3.05Å; I96-Y98 PolarHBondContact O-N 3.17Å; Y98-L100 PolarHBondContact O-N 2.81Å; Y98-I101 PolarHBondContact O-N 3Å; Y98-I102 VanDerWaalsContact O-CG1 3.31Å; Y98-I102 WeakPolarHBondContact O-CG1 3.48Å; Y98-I102 PolarHBondContact O-N 2.93Å |
| 99 | C | 87.9 | Confident | 83 | Confident | 65 Ų | 65 | 97.4 Ų | 97.4 | 44% | 0.439 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60 | -43.9 | 175.5 | -72.4 | 0 | 0 | 0 | 0 | 112.1 | V95 I96 I101 I102 I103 | V95-C99 PolarHBondContact O-N 3.49Å; V95-C99 PolarHBondContact O-SG 3.46Å; V95-C99 VanDerWaalsContact O-SG 3.4Å; I96-C99 PolarHBondContact O-N 2.98Å; C99-I101 PolarHBondContact O-N 3.26Å; C99-I102 PolarHBondContact O-N 3.25Å; C99-I103 VanDerWaalsContact O-CG1 3.28Å; C99-I103 WeakPolarHBondContact O-CG1 3.26Å; C99-I103 PolarHBondContact O-N 2.96Å |
| 100 | L | 88.7 | Confident | 84.5 | Confident | 108 Ų | 108 | 93.6 Ų | 93.6 | 57% | 0.565 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64 | -40.3 | 177.8 | -72.3 | 174.3 | 0 | 0 | 0 | 112.1 | I96 Q97 Y98 I103 A104 | I96-L100 HydrophobicContact CG2-CD1 4Å; I96-L100 HydrophobicContact CG2-CG 4.32Å; I96-L100 WeakPolarHBondContact O-CG 3.31Å; I96-L100 PolarHBondContact O-N 3.46Å; Q97-L100 PolarHBondContact O-N 3.49Å; Y98-L100 PolarHBondContact O-N 2.81Å; L100-I103 PolarHBondContact O-N 3.43Å; L100-A104 VanDerWaalsContact O-CB 3.3Å; L100-A104 WeakPolarHBondContact O-CB 3.24Å; L100-A104 PolarHBondContact O-N 3.32Å |
| 101 | I | 90.9 | Very high | 85.8 | Confident | 94 Ų | 94 | 92.6 Ų | 92.6 | 48% | 0.482 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62 | -44.4 | 175.9 | -69 | 164.5 | 0 | 0 | 0 | 110.5 | Q97 Y98 C99 A104 A105 | Q97-I101 HydrophobicContact CG-CD1 4.11Å; Q97-I101 VanDerWaalsContact O-CG1 3.26Å; Q97-I101 WeakPolarHBondContact O-CG1 3.29Å; Q97-I101 PolarHBondContact O-N 3.44Å; Y98-I101 PolarHBondContact O-N 3Å; C99-I101 PolarHBondContact O-N 3.26Å; I101-A104 PolarHBondContact O-N 3.14Å; I101-A105 WeakPolarHBondContact O-CB 3.35Å; I101-A105 PolarHBondContact O-N 3.18Å |
| 102 | I | 92.2 | Very high | 87.1 | Confident | 114 Ų | 114 | 91 Ų | 91 | 59% | 0.585 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64 | -44.9 | 178.6 | -67.5 | 166.5 | 0 | 0 | 0 | 110.8 | Y98 C99 A105 S106 | Y98-I102 VanDerWaalsContact O-CG1 3.31Å; Y98-I102 WeakPolarHBondContact O-CG1 3.48Å; Y98-I102 PolarHBondContact O-N 2.93Å; C99-I102 PolarHBondContact O-N 3.25Å; I102-A105 PolarHBondContact O-N 2.73Å; I102-S106 WeakPolarHBondContact O-CB 3.15Å; I102-S106 PolarHBondContact O-N 2.83Å; I102-S106 PolarHBondContact O-OG 2.69Å |
| 103 | I | 91.1 | Very high | 88.1 | Confident | 92 Ų | 92 | 91.8 Ų | 91.8 | 47% | 0.472 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.9 | -48.3 | 176.7 | -67.2 | 166.4 | 0 | 0 | 0 | 109.9 | C99 L100 A105 S106 L107 | C99-I103 VanDerWaalsContact O-CG1 3.28Å; C99-I103 WeakPolarHBondContact O-CG1 3.26Å; C99-I103 PolarHBondContact O-N 2.96Å; L100-I103 PolarHBondContact O-N 3.43Å; I103-A105 VanDerWaalsContact C-N 3.34Å; I103-A105 PolarHBondContact O-N 3.25Å; I103-S106 PolarHBondContact O-N 3.4Å; I103-S106 PolarHBondContact O-OG 2.87Å; I103-L107 HydrophobicContact CG2-CD1 3.97Å; I103-L107 HydrophobicContact CG2-CG 4.42Å; I103-L107 WeakPolarHBondContact O-CG 3.48Å; I103-L107 PolarHBondContact O-N 3.3Å |
| 104 | A | 91.2 | Very high | 89 | Confident | 59 Ų | 59 | 91.1 Ų | 91.1 | 49% | 0.488 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.5 | -41.8 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | L100 I101 L107 S108 | L100-A104 VanDerWaalsContact O-CB 3.3Å; L100-A104 WeakPolarHBondContact O-CB 3.24Å; L100-A104 PolarHBondContact O-N 3.32Å; I101-A104 PolarHBondContact O-N 3.14Å; A104-L107 PolarHBondContact O-N 2.88Å; A104-S108 WeakPolarHBondContact O-CB 3.22Å; A104-S108 PolarHBondContact O-N 2.93Å; A104-S108 PolarHBondContact O-OG 2.82Å |
| 105 | A | 92.1 | Very high | 89.6 | Confident | 39 Ų | 39 | 92.6 Ų | 92.6 | 32% | 0.322 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.4 | -43.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | I101 I102 I103 L107 S108 F109 | I101-A105 WeakPolarHBondContact O-CB 3.35Å; I101-A105 PolarHBondContact O-N 3.18Å; I102-A105 PolarHBondContact O-N 2.73Å; I103-A105 VanDerWaalsContact C-N 3.34Å; I103-A105 PolarHBondContact O-N 3.25Å; A105-L107 VanDerWaalsContact C-N 3.33Å; A105-L107 PolarHBondContact O-N 3.44Å; A105-S108 PolarHBondContact O-N 3.47Å; A105-S108 PolarHBondContact O-OG 3.45Å; A105-F109 WeakPolarHBondContact O-CD2 3.47Å; A105-F109 PolarHBondContact O-N 2.91Å |
| 106 | S | 92.9 | Very high | 90.2 | Very high | 66 Ų | 66 | 91.4 Ų | 91.4 | 46% | 0.462 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -40.4 | 178.1 | 73.3 | 0 | 0 | 0 | 0 | 112.3 | I102 I103 A110 | I102-S106 WeakPolarHBondContact O-CB 3.15Å; I102-S106 PolarHBondContact O-N 2.83Å; I102-S106 PolarHBondContact O-OG 2.69Å; I103-S106 PolarHBondContact O-N 3.4Å; I103-S106 PolarHBondContact O-OG 2.87Å; S106-A110 WeakPolarHBondContact O-CB 3.44Å; S106-A110 PolarHBondContact O-N 2.8Å |
| 107 | L | 93.3 | Very high | 90.6 | Very high | 100 Ų | 100 | 92 Ų | 92 | 52% | 0.524 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.3 | -40.1 | 176.2 | -70.8 | 174.1 | 0 | 0 | 0 | 111.6 | I103 A104 A105 A110 I111 | I103-L107 HydrophobicContact CG2-CD1 3.97Å; I103-L107 HydrophobicContact CG2-CG 4.42Å; I103-L107 WeakPolarHBondContact O-CG 3.48Å; I103-L107 PolarHBondContact O-N 3.3Å; A104-L107 PolarHBondContact O-N 2.88Å; A105-L107 VanDerWaalsContact C-N 3.33Å; A105-L107 PolarHBondContact O-N 3.44Å; L107-A110 PolarHBondContact O-N 3.26Å; L107-I111 VanDerWaalsContact O-CG1 3.24Å; L107-I111 WeakPolarHBondContact O-CG1 3.4Å; L107-I111 PolarHBondContact O-N 3.45Å |
| 108 | S | 92.8 | Very high | 90.8 | Very high | 54 Ų | 54 | 90.9 Ų | 90.9 | 38% | 0.378 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.8 | -42.9 | 177.2 | 73.2 | 0 | 0 | 0 | 0 | 111.4 | A104 A105 A110 I111 L112 | A104-S108 WeakPolarHBondContact O-CB 3.22Å; A104-S108 PolarHBondContact O-N 2.93Å; A104-S108 PolarHBondContact O-OG 2.82Å; A105-S108 PolarHBondContact O-N 3.47Å; A105-S108 PolarHBondContact O-OG 3.45Å; S108-A110 PolarHBondContact O-N 3.25Å; S108-I111 PolarHBondContact O-N 2.88Å; S108-L112 WeakPolarHBondContact O-CB 3.29Å; S108-L112 VanDerWaalsContact O-CG 3.3Å; S108-L112 WeakPolarHBondContact O-CG 3.44Å; S108-L112 PolarHBondContact O-N 3.42Å |
| 109 | F | 92 | Very high | 91 | Very high | 135 Ų | 135 | 88.6 Ų | 88.6 | 59% | 0.592 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.1 | -43 | 172.6 | -85.8 | -69.5 | 0 | 0 | 0 | 112.1 | A105 I111 L112 I113 | A105-F109 WeakPolarHBondContact O-CD2 3.47Å; A105-F109 PolarHBondContact O-N 2.91Å; F109-I111 PolarHBondContact O-N 2.94Å; F109-L112 PolarHBondContact O-N 2.8Å; F109-I113 WeakPolarHBondContact O-CG1 3.21Å; F109-I113 PolarHBondContact O-N 3.37Å; F109-I113 VanDerWaalsContact O-N 3.1Å |
| 110 | A | 91.9 | Very high | 90.9 | Very high | 39 Ų | 39 | 89.7 Ų | 89.7 | 32% | 0.322 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.4 | -45 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | S106 L107 S108 L112 I113 I114 | S106-A110 WeakPolarHBondContact O-CB 3.44Å; S106-A110 PolarHBondContact O-N 2.8Å; L107-A110 PolarHBondContact O-N 3.26Å; S108-A110 PolarHBondContact O-N 3.25Å; A110-L112 PolarHBondContact O-N 3.04Å; A110-I113 PolarHBondContact O-N 2.88Å; A110-I114 HydrophobicContact CB-CD1 4.38Å; A110-I114 WeakPolarHBondContact O-CB 3.43Å; A110-I114 WeakPolarHBondContact O-CD1 3.32Å; A110-I114 WeakPolarHBondContact O-CG1 3.49Å; A110-I114 PolarHBondContact O-N 3.25Å |
| 111 | I | 92 | Very high | 90.8 | Very high | 107 Ų | 107 | 89.5 Ų | 89.5 | 55% | 0.549 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 176.7 | -67.5 | 163.7 | 0 | 0 | 0 | 110.8 | L107 S108 F109 I113 I114 L115 | L107-I111 VanDerWaalsContact O-CG1 3.24Å; L107-I111 WeakPolarHBondContact O-CG1 3.4Å; L107-I111 PolarHBondContact O-N 3.45Å; S108-I111 PolarHBondContact O-N 2.88Å; F109-I111 PolarHBondContact O-N 2.94Å; I111-I113 PolarHBondContact O-N 3.05Å; I111-I114 PolarHBondContact O-N 3.41Å; I111-L115 WeakPolarHBondContact O-CB 3.49Å; I111-L115 PolarHBondContact O-N 3.43Å |
| 112 | L | 91.5 | Very high | 90.4 | Very high | 113 Ų | 113 | 89.4 Ų | 89.4 | 59% | 0.592 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62 | -27.7 | 178.3 | -75.9 | 174.1 | 0 | 0 | 0 | 113.2 | S108 F109 A110 P116 | S108-L112 WeakPolarHBondContact O-CB 3.29Å; S108-L112 VanDerWaalsContact O-CG 3.3Å; S108-L112 WeakPolarHBondContact O-CG 3.44Å; S108-L112 PolarHBondContact O-N 3.42Å; F109-L112 PolarHBondContact O-N 2.8Å; A110-L112 PolarHBondContact O-N 3.04Å; L112-P116 WeakPolarHBondContact O-CD 3.41Å; L112-P116 WeakPolarHBondContact O-CG 3.37Å |
| 113 | I | 91.4 | Very high | 89.7 | Confident | 105 Ų | 105 | 85.9 Ų | 85.9 | 54% | 0.538 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -87.6 | -45 | 176.2 | -64.4 | 166.1 | 0 | 0 | 0 | 110.9 | F109 A110 I111 P116 L117 | F109-I113 WeakPolarHBondContact O-CG1 3.21Å; F109-I113 PolarHBondContact O-N 3.37Å; F109-I113 VanDerWaalsContact O-N 3.1Å; A110-I113 PolarHBondContact O-N 2.88Å; I111-I113 PolarHBondContact O-N 3.05Å; I113-P116 WeakPolarHBondContact O-CD 3.22Å; I113-L117 HydrophobicContact CG2-CD1 3.84Å; I113-L117 VanDerWaalsContact O-CG 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.46Å; I113-L117 PolarHBondContact O-N 3.29Å |
| 114 | I | 91.9 | Very high | 88.9 | Confident | 104 Ų | 104 | 88.5 Ų | 88.5 | 53% | 0.533 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.4 | -38.7 | -176.5 | -68 | 166.4 | 0 | 0 | 0 | 111 | A110 I111 L117 L118 | A110-I114 HydrophobicContact CB-CD1 4.38Å; A110-I114 WeakPolarHBondContact O-CB 3.43Å; A110-I114 WeakPolarHBondContact O-CD1 3.32Å; A110-I114 WeakPolarHBondContact O-CG1 3.49Å; A110-I114 PolarHBondContact O-N 3.25Å; I111-I114 PolarHBondContact O-N 3.41Å; I114-L117 PolarHBondContact O-N 3.08Å; I114-L118 VanDerWaalsContact O-CB 3.32Å; I114-L118 WeakPolarHBondContact O-CB 3.45Å; I114-L118 PolarHBondContact O-N 2.88Å |
| 115 | L | 89.7 | Confident | 88 | Confident | 96 Ų | 96 | 94.8 Ų | 94.8 | 50% | 0.503 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -50.3 | -176.5 | -178.7 | 72.4 | 0 | 0 | 0 | 112.4 | I111 L117 L118 L119 | I111-L115 WeakPolarHBondContact O-CB 3.49Å; I111-L115 PolarHBondContact O-N 3.43Å; L115-L117 PolarHBondContact O-N 3.44Å; L115-L118 PolarHBondContact O-N 3.22Å; L115-L119 HydrophobicContact CG-CD1 4.35Å; L115-L119 VanDerWaalsContact O-CG 3.3Å; L115-L119 WeakPolarHBondContact O-CG 3.38Å; L115-L119 PolarHBondContact O-N 3.2Å |
| 116 | P | 89.5 | Confident | 86.8 | Confident | 66 Ų | 66 | 102.4 Ų | 102.4 | 43% | 0.429 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 172 | -24.4 | 33.6 | 0 | 0 | 0 | 113.1 | L112 I113 L118 L119 C120 | L112-P116 WeakPolarHBondContact O-CD 3.41Å; L112-P116 WeakPolarHBondContact O-CG 3.37Å; I113-P116 WeakPolarHBondContact O-CD 3.22Å; P116-L118 VanDerWaalsContact C-N 3.34Å; P116-L118 PolarHBondContact O-N 2.9Å; P116-L119 PolarHBondContact O-N 3.42Å; P116-C120 WeakPolarHBondContact O-CB 3.37Å; P116-C120 PolarHBondContact O-N 3.02Å; P116-C120 PolarHBondContact O-SG 2.87Å |
| 117 | L | 89.3 | Confident | 85.3 | Confident | 104 Ų | 104 | 103 Ų | 103 | 55% | 0.545 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 177.3 | -73.7 | 171.2 | 0 | 0 | 0 | 111.3 | I113 I114 L115 C120 L121 | I113-L117 HydrophobicContact CG2-CD1 3.84Å; I113-L117 VanDerWaalsContact O-CG 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.46Å; I113-L117 PolarHBondContact O-N 3.29Å; I114-L117 PolarHBondContact O-N 3.08Å; L115-L117 PolarHBondContact O-N 3.44Å; L117-C120 PolarHBondContact O-N 3.5Å; L117-L121 WeakPolarHBondContact O-CB 3.45Å; L117-L121 VanDerWaalsContact O-CG 3.28Å; L117-L121 WeakPolarHBondContact O-CG 3.25Å; L117-L121 PolarHBondContact O-N 3.18Å |
| 118 | L | 89.5 | Confident | 83.8 | Confident | 93 Ų | 93 | 101.4 Ų | 101.4 | 49% | 0.487 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.2 | -42.6 | 177.1 | -168.7 | 70.7 | 0 | 0 | 0 | 111.3 | I114 L115 P116 L121 L122 | I114-L118 VanDerWaalsContact O-CB 3.32Å; I114-L118 WeakPolarHBondContact O-CB 3.45Å; I114-L118 PolarHBondContact O-N 2.88Å; L115-L118 PolarHBondContact O-N 3.22Å; P116-L118 VanDerWaalsContact C-N 3.34Å; P116-L118 PolarHBondContact O-N 2.9Å; L118-L121 PolarHBondContact O-N 2.81Å; L118-L122 HydrophobicContact CG-CD1 4.15Å; L118-L122 WeakPolarHBondContact O-CB 3.43Å; L118-L122 VanDerWaalsContact O-CG 3.28Å; L118-L122 WeakPolarHBondContact O-CG 3.18Å; L118-L122 PolarHBondContact O-N 3.32Å |
| 119 | L | 89.7 | Confident | 82.3 | Confident | 107 Ų | 107 | 105.6 Ų | 105.6 | 56% | 0.56 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -62 | -43.3 | 174.6 | -71.7 | 172.3 | 0 | 0 | 0 | 111.8 | L115 P116 L121 L122 G123 | L115-L119 HydrophobicContact CG-CD1 4.35Å; L115-L119 VanDerWaalsContact O-CG 3.3Å; L115-L119 WeakPolarHBondContact O-CG 3.38Å; L115-L119 PolarHBondContact O-N 3.2Å; P116-L119 PolarHBondContact O-N 3.42Å; L119-L121 PolarHBondContact O-N 3.05Å; L119-L122 PolarHBondContact O-N 3.15Å; L119-G123 PolarHBondContact O-N 3.03Å |
| 120 | C | 85.8 | Confident | 80.8 | Confident | 89 Ų | 89 | 103.2 Ų | 103.2 | 60% | 0.601 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.8 | -42.2 | 174.8 | -75.3 | 0 | 0 | 0 | 0 | 111.8 | P116 L117 G123 K124 | P116-C120 WeakPolarHBondContact O-CB 3.37Å; P116-C120 PolarHBondContact O-N 3.02Å; P116-C120 PolarHBondContact O-SG 2.87Å; L117-C120 PolarHBondContact O-N 3.5Å; C120-G123 PolarHBondContact O-N 3.44Å; C120-K124 VanDerWaalsContact O-CB 3.28Å; C120-K124 WeakPolarHBondContact O-CB 3.34Å; C120-K124 PolarHBondContact O-N 3.46Å |
| 121 | L | 85.6 | Confident | 79.3 | Confident | 104 Ų | 104 | 105.3 Ų | 105.3 | 55% | 0.545 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -69.1 | -38.7 | 177.5 | -70.4 | 175.4 | 0 | 0 | 0 | 112.3 | L117 L118 L119 K124 R125 | L117-L121 WeakPolarHBondContact O-CB 3.45Å; L117-L121 VanDerWaalsContact O-CG 3.28Å; L117-L121 WeakPolarHBondContact O-CG 3.25Å; L117-L121 PolarHBondContact O-N 3.18Å; L118-L121 PolarHBondContact O-N 2.81Å; L119-L121 PolarHBondContact O-N 3.05Å; L121-K124 PolarHBondContact O-N 3.33Å; L121-R125 WeakPolarHBondContact O-CB 3.46Å; L121-R125 WeakPolarHBondContact O-CG 3.33Å; L121-R125 PolarHBondContact O-N 3.36Å |
| 122 | L | 83.5 | Confident | 77.9 | Confident | 92 Ų | 92 | 104.8 Ų | 104.8 | 48% | 0.482 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.2 | -42.5 | 174.5 | -74.7 | 167.1 | 0 | 0 | 0 | 111.4 | L118 L119 R125 R126 | L118-L122 HydrophobicContact CG-CD1 4.15Å; L118-L122 WeakPolarHBondContact O-CB 3.43Å; L118-L122 VanDerWaalsContact O-CG 3.28Å; L118-L122 WeakPolarHBondContact O-CG 3.18Å; L118-L122 PolarHBondContact O-N 3.32Å; L119-L122 PolarHBondContact O-N 3.15Å; L122-R125 PolarHBondContact O-N 3.39Å; L122-R126 PolarHBondContact O-N 3.13Å |
| 123 | G | 77.6 | Confident | 76.6 | Confident | 40 Ų | 40 | 104.1 Ų | 104.1 | 41% | 0.412 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L119 C120 R126 S127 | L119-G123 PolarHBondContact O-N 3.03Å; C120-G123 PolarHBondContact O-N 3.44Å; G123-R126 PolarHBondContact O-N 3.1Å; G123-S127 WeakPolarHBondContact O-CB 3.47Å; G123-S127 PolarHBondContact O-N 3.5Å |
| 124 | K | 74.7 | Confident | 75.1 | Confident | 146 Ų | 146 | 102 Ų | 102 | 64% | 0.635 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.6 | -40.8 | 176 | -167.3 | 171.4 | -177.8 | 174.7 | 0 | 111.9 | C120 L121 S127 T128 | C120-K124 VanDerWaalsContact O-CB 3.28Å; C120-K124 WeakPolarHBondContact O-CB 3.34Å; C120-K124 PolarHBondContact O-N 3.46Å; L121-K124 PolarHBondContact O-N 3.33Å; K124-S127 PolarHBondContact O-N 3.44Å; K124-T128 WeakPolarHBondContact O-CG2 3.36Å; K124-T128 PolarHBondContact O-N 2.9Å; K124-T128 PolarHBondContact O-OG1 3.41Å |
| 125 | R | 70.8 | Confident | 73.7 | Confident | 192 Ų | 192 | 102.8 Ų | 102.8 | 73% | 0.725 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.3 | -37.8 | 174.8 | -79.9 | -170.5 | -179 | -161.3 | 2.3 | 112.7 | L121 L122 T128 K129 | L121-R125 WeakPolarHBondContact O-CB 3.46Å; L121-R125 WeakPolarHBondContact O-CG 3.33Å; L121-R125 PolarHBondContact O-N 3.36Å; L122-R125 PolarHBondContact O-N 3.39Å; R125-T128 WeakPolarHBondContact CA-OG1 3.19Å; R125-T128 PolarHBondContact O-OG1 3.18Å; R125-K129 VanDerWaalsContact O-CB 3.25Å; R125-K129 WeakPolarHBondContact O-CB 3.43Å; R125-K129 PolarHBondContact O-N 2.96Å |
| 126 | R | 68.3 | Low | 72.5 | Confident | 198 Ų | 198 | 102.3 Ų | 102.3 | 75% | 0.747 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.9 | -43.3 | 172.4 | -77.8 | -173.5 | -178.7 | -178.5 | 1.6 | 111 | L122 G123 K129 C130 | L122-R126 PolarHBondContact O-N 3.13Å; G123-R126 PolarHBondContact O-N 3.1Å; R126-K129 PolarHBondContact O-N 3.35Å; R126-C130 WeakPolarHBondContact O-CB 3.46Å; R126-C130 PolarHBondContact O-N 3.21Å; R126-C130 PolarHBondContact O-SG 3.18Å; R126-C130 VanDerWaalsContact O-SG 3.38Å |
| 127 | S | 61.1 | Low | 71.2 | Confident | 79 Ų | 79 | 101 Ų | 101 | 55% | 0.552 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.8 | -43.8 | 177.6 | -177.9 | 0 | 0 | 0 | 0 | 112.4 | G123 K124 C130 N131 | G123-S127 WeakPolarHBondContact O-CB 3.47Å; G123-S127 PolarHBondContact O-N 3.5Å; K124-S127 PolarHBondContact O-N 3.44Å; S127-C130 PolarHBondContact O-N 3.47Å; S127-N131 WeakPolarHBondContact O-CB 3.46Å; S127-N131 PolarHBondContact O-N 3.06Å |
| 128 | T | 60.4 | Low | 69.9 | Low | 67 Ų | 67 | 102.7 Ų | 102.7 | 41% | 0.411 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -68.8 | -35.7 | 176.2 | 54.2 | 0 | 0 | 0 | 0 | 112.4 | K124 R125 N131 N132 | K124-T128 WeakPolarHBondContact O-CG2 3.36Å; K124-T128 PolarHBondContact O-N 2.9Å; K124-T128 PolarHBondContact O-OG1 3.41Å; R125-T128 WeakPolarHBondContact CA-OG1 3.19Å; R125-T128 PolarHBondContact O-OG1 3.18Å; T128-N131 PolarHBondContact O-N 2.97Å; T128-N132 WeakPolarHBondContact O-CB 3.4Å; T128-N132 VanDerWaalsContact O-CG 3.25Å; T128-N132 PolarHBondContact O-N 3.39Å |
| 129 | K | 61.4 | Low | 68.7 | Low | 141 Ų | 141 | 102.4 Ų | 102.4 | 61% | 0.613 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.3 | -47.8 | 173.6 | -168.5 | 172 | 179.6 | 178.8 | 0 | 111.2 | R125 R126 N131 N132 D133 | R125-K129 VanDerWaalsContact O-CB 3.25Å; R125-K129 WeakPolarHBondContact O-CB 3.43Å; R125-K129 PolarHBondContact O-N 2.96Å; R126-K129 PolarHBondContact O-N 3.35Å; K129-N131 VanDerWaalsContact C-N 3.34Å; K129-N131 PolarHBondContact O-N 3.26Å; K129-N132 PolarHBondContact O-N 2.84Å; K129-D133 VanDerWaalsContact O-CG 3.27Å; K129-D133 PolarHBondContact O-N 3.35Å |
| 130 | C | 61.2 | Low | 67.4 | Low | 85 Ų | 85 | 102.9 Ų | 102.9 | 57% | 0.574 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.1 | -37.6 | 175.1 | -70.8 | 0 | 0 | 0 | 0 | 113 | R126 S127 D133 A134 | R126-C130 WeakPolarHBondContact O-CB 3.46Å; R126-C130 PolarHBondContact O-N 3.21Å; R126-C130 PolarHBondContact O-SG 3.18Å; R126-C130 VanDerWaalsContact O-SG 3.38Å; S127-C130 PolarHBondContact O-N 3.47Å; C130-D133 PolarHBondContact O-N 2.97Å; C130-A134 VanDerWaalsContact O-CB 3.28Å; C130-A134 WeakPolarHBondContact O-CB 3.36Å; C130-A134 PolarHBondContact O-N 3.46Å |
| 131 | N | 60.3 | Low | 66.1 | Low | 84 Ų | 84 | 105 Ų | 105 | 45% | 0.449 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.5 | -40.5 | 176.3 | -170.6 | -0.3 | 0 | 0 | 0 | 111.5 | S127 T128 K129 A134 K135 | S127-N131 WeakPolarHBondContact O-CB 3.46Å; S127-N131 PolarHBondContact O-N 3.06Å; T128-N131 PolarHBondContact O-N 2.97Å; K129-N131 VanDerWaalsContact C-N 3.34Å; K129-N131 PolarHBondContact O-N 3.26Å; N131-A134 PolarHBondContact O-N 3.5Å; N131-K135 WeakPolarHBondContact O-CB 3.39Å; N131-K135 WeakPolarHBondContact O-CG 3.29Å; N131-K135 PolarHBondContact O-N 2.93Å |
| 132 | N | 61.9 | Low | 65 | Low | 96 Ų | 96 | 106.8 Ų | 106.8 | 51% | 0.513 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -67 | -42 | 175.7 | -71.4 | -12.8 | 0 | 0 | 0 | 111.6 | T128 K129 A134 K135 V136 | T128-N132 WeakPolarHBondContact O-CB 3.4Å; T128-N132 VanDerWaalsContact O-CG 3.25Å; T128-N132 PolarHBondContact O-N 3.39Å; K129-N132 PolarHBondContact O-N 2.84Å; N132-A134 VanDerWaalsContact C-N 3.33Å; N132-A134 PolarHBondContact O-N 3.45Å; N132-K135 PolarHBondContact O-N 2.95Å; N132-V136 VanDerWaalsContact O-CG2 3.26Å; N132-V136 WeakPolarHBondContact O-CG2 3.28Å; N132-V136 PolarHBondContact O-N 3.29Å |
| 133 | D | 64.5 | Low | 63.9 | Low | 98 Ų | 98 | 107.4 Ų | 107.4 | 52% | 0.524 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.1 | -39.2 | 176.2 | -65.9 | -26.1 | 0 | 0 | 0 | 111.2 | K129 C130 V136 G137 | K129-D133 VanDerWaalsContact O-CG 3.27Å; K129-D133 PolarHBondContact O-N 3.35Å; C130-D133 PolarHBondContact O-N 2.97Å; D133-V136 PolarHBondContact O-N 3.19Å; D133-G137 PolarHBondContact O-N 2.97Å |
| 134 | A | 60.7 | Low | 63.1 | Low | 60 Ų | 60 | 112.8 Ų | 112.8 | 50% | 0.496 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.4 | -43.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | C130 N131 N132 G137 E138 | C130-A134 VanDerWaalsContact O-CB 3.28Å; C130-A134 WeakPolarHBondContact O-CB 3.36Å; C130-A134 PolarHBondContact O-N 3.46Å; N131-A134 PolarHBondContact O-N 3.5Å; N132-A134 VanDerWaalsContact C-N 3.33Å; N132-A134 PolarHBondContact O-N 3.45Å; A134-G137 PolarHBondContact O-N 3.39Å; A134-E138 WeakPolarHBondContact O-CB 3.44Å; A134-E138 PolarHBondContact O-N 2.91Å |
| 135 | K | 63 | Low | 62.4 | Low | 121 Ų | 121 | 108.6 Ų | 108.6 | 53% | 0.526 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.2 | -40.5 | 175.9 | -77.5 | -176.3 | 179 | -172.1 | 0 | 112.5 | N131 N132 G137 E138 V139 | N131-K135 WeakPolarHBondContact O-CB 3.39Å; N131-K135 WeakPolarHBondContact O-CG 3.29Å; N131-K135 PolarHBondContact O-N 2.93Å; N132-K135 PolarHBondContact O-N 2.95Å; K135-G137 VanDerWaalsContact C-N 3.33Å; K135-E138 PolarHBondContact O-N 3.36Å; K135-V139 VanDerWaalsContact O-CG2 3.27Å; K135-V139 WeakPolarHBondContact O-CG2 3.39Å; K135-V139 PolarHBondContact O-N 3.37Å |
| 136 | V | 63.6 | Low | 61.8 | Low | 87 Ų | 87 | 103.3 Ų | 103.3 | 53% | 0.527 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.9 | -40.3 | 175.5 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | N132 D133 Q140 | N132-V136 VanDerWaalsContact O-CG2 3.26Å; N132-V136 WeakPolarHBondContact O-CG2 3.28Å; N132-V136 PolarHBondContact O-N 3.29Å; D133-V136 PolarHBondContact O-N 3.19Å; V136-Q140 PolarHBondContact O-N 3.15Å |
| 137 | G | 62.4 | Low | 61.3 | Low | 38 Ų | 38 | 96.8 Ų | 96.8 | 39% | 0.392 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.4 | -42.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | D133 A134 K135 Q140 L141 | D133-G137 PolarHBondContact O-N 2.97Å; A134-G137 PolarHBondContact O-N 3.39Å; K135-G137 VanDerWaalsContact C-N 3.33Å; G137-Q140 PolarHBondContact O-N 3.36Å; G137-L141 WeakPolarHBondContact O-CB 3.42Å; G137-L141 PolarHBondContact O-N 2.78Å |
| 138 | E | 62.5 | Low | 61 | Low | 139 Ų | 139 | 96.4 Ų | 96.4 | 65% | 0.65 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -67.8 | -40 | 179.9 | -152.4 | -173.8 | 157.7 | 0 | 0 | 112 | A134 K135 L141 K142 | A134-E138 WeakPolarHBondContact O-CB 3.44Å; A134-E138 PolarHBondContact O-N 2.91Å; K135-E138 PolarHBondContact O-N 3.36Å; E138-L141 PolarHBondContact O-N 2.96Å; E138-K142 WeakPolarHBondContact O-CB 3.45Å; E138-K142 PolarHBondContact O-N 3Å |
| 139 | V | 62.9 | Low | 60.7 | Low | 87 Ų | 87 | 100.1 Ų | 100.1 | 53% | 0.527 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.8 | -45.4 | 174.3 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | K135 L141 K142 D143 | K135-V139 VanDerWaalsContact O-CG2 3.27Å; K135-V139 WeakPolarHBondContact O-CG2 3.39Å; K135-V139 PolarHBondContact O-N 3.37Å; V139-L141 VanDerWaalsContact C-N 3.33Å; V139-L141 PolarHBondContact O-N 3.35Å; V139-K142 PolarHBondContact O-N 3.01Å; V139-D143 PolarHBondContact O-N 3.37Å |
| 140 | Q | 62.5 | Low | 60.2 | Low | 118 Ų | 118 | 98.2 Ų | 98.2 | 55% | 0.551 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.7 | -37.9 | 175.3 | -85.2 | -163.7 | 41.5 | 0 | 0 | 113.2 | V136 G137 K142 K144 | V136-Q140 PolarHBondContact O-N 3.15Å; G137-Q140 PolarHBondContact O-N 3.36Å; Q140-K142 VanDerWaalsContact C-N 3.34Å; Q140-K144 PolarHBondContact O-N 3.42Å |
| 141 | L | 60.2 | Low | 59.6 | Low | 134 Ų | 134 | 101.7 Ų | 101.7 | 70% | 0.702 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -69.9 | -35.5 | 179 | -141.5 | 122.3 | 0 | 0 | 0 | 111.3 | G137 E138 V139 S145 | G137-L141 WeakPolarHBondContact O-CB 3.42Å; G137-L141 PolarHBondContact O-N 2.78Å; E138-L141 PolarHBondContact O-N 2.96Å; V139-L141 VanDerWaalsContact C-N 3.33Å; V139-L141 PolarHBondContact O-N 3.35Å; L141-S145 WeakPolarHBondContact O-CB 3.48Å; L141-S145 PolarHBondContact O-N 3.49Å |
| 142 | K | 61.7 | Low | 58.9 | Low | 140 Ų | 140 | 107.7 Ų | 107.7 | 61% | 0.609 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -70.3 | -38.9 | 175.6 | -158 | 169.2 | -175.2 | 176.4 | 0 | 112.1 | E138 V139 Q140 S145 N146 | E138-K142 WeakPolarHBondContact O-CB 3.45Å; E138-K142 PolarHBondContact O-N 3Å; V139-K142 PolarHBondContact O-N 3.01Å; Q140-K142 VanDerWaalsContact C-N 3.34Å; K142-S145 PolarHBondContact O-N 2.84Å; K142-N146 WeakPolarHBondContact O-CB 3.44Å; K142-N146 VanDerWaalsContact O-CG 3.29Å; K142-N146 PolarHBondContact O-N 3.48Å; K142-N146 PolarHBondContact O-ND2 3.27Å |
| 143 | D | 60.5 | Low | 58.4 | Low | 105 Ų | 105 | 108.6 Ų | 108.6 | 56% | 0.561 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -66.9 | -41.7 | 173.7 | -84.5 | -20 | 0 | 0 | 0 | 112.3 | V139 N146 A147 | V139-D143 PolarHBondContact O-N 3.37Å; D143-N146 PolarHBondContact O-N 2.92Å; D143-A147 VanDerWaalsContact O-CB 3.32Å; D143-A147 WeakPolarHBondContact O-CB 3.49Å; D143-A147 PolarHBondContact O-N 3.34Å |
| 144 | K | 61.3 | Low | 57.8 | Low | 153 Ų | 153 | 109.1 Ų | 109.1 | 67% | 0.665 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.9 | -38.2 | 173.3 | -82.7 | -178.9 | 172.9 | 174.7 | 0 | 112.8 | Q140 S148 | Q140-K144 PolarHBondContact O-N 3.42Å; K144-S148 VanDerWaalsContact O-CB 3.24Å; K144-S148 WeakPolarHBondContact O-CB 3.37Å; K144-S148 PolarHBondContact O-N 3.48Å |
| 145 | S | 59.5 | Low | 57.2 | Low | 59 Ų | 59 | 113.9 Ų | 113.9 | 41% | 0.413 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -62.2 | -45.7 | 174.6 | 165.6 | 0 | 0 | 0 | 0 | 111.5 | L141 K142 S148 K149 | L141-S145 WeakPolarHBondContact O-CB 3.48Å; L141-S145 PolarHBondContact O-N 3.49Å; K142-S145 PolarHBondContact O-N 2.84Å; S145-S148 PolarHBondContact O-N 2.8Å; S145-K149 WeakPolarHBondContact O-CB 3.49Å; S145-K149 PolarHBondContact O-N 3.12Å |
| 146 | N | 57.6 | Low | 56.6 | Low | 80 Ų | 80 | 114.4 Ų | 114.4 | 43% | 0.428 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -67.8 | -42.5 | 177.5 | -73.2 | -17.2 | 0 | 0 | 0 | 111.5 | K142 D143 S148 K149 V150 | K142-N146 WeakPolarHBondContact O-CB 3.44Å; K142-N146 VanDerWaalsContact O-CG 3.29Å; K142-N146 PolarHBondContact O-N 3.48Å; K142-N146 PolarHBondContact O-ND2 3.27Å; D143-N146 PolarHBondContact O-N 2.92Å; N146-S148 VanDerWaalsContact C-N 3.33Å; N146-S148 PolarHBondContact O-N 2.94Å; N146-K149 PolarHBondContact O-N 2.7Å; N146-V150 VanDerWaalsContact O-CG2 3.28Å; N146-V150 WeakPolarHBondContact O-CG2 3.32Å; N146-V150 PolarHBondContact O-N 3.1Å |
| 147 | A | 57.7 | Low | 55.8 | Low | 62 Ų | 62 | 114 Ų | 114 | 51% | 0.512 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -61.3 | -41.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | D143 V150 H151 | D143-A147 VanDerWaalsContact O-CB 3.32Å; D143-A147 WeakPolarHBondContact O-CB 3.49Å; D143-A147 PolarHBondContact O-N 3.34Å; A147-V150 PolarHBondContact O-N 2.95Å; A147-H151 PolarHBondContact O-N 3.02Å |
| 148 | S | 55.7 | Low | 55.4 | Low | 71 Ų | 71 | 117.3 Ų | 117.3 | 50% | 0.497 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -68.4 | -33.7 | 176.2 | -178.9 | 0 | 0 | 0 | 0 | 112.7 | K144 S145 N146 R152 | K144-S148 VanDerWaalsContact O-CB 3.24Å; K144-S148 WeakPolarHBondContact O-CB 3.37Å; K144-S148 PolarHBondContact O-N 3.48Å; S145-S148 PolarHBondContact O-N 2.8Å; N146-S148 VanDerWaalsContact C-N 3.33Å; N146-S148 PolarHBondContact O-N 2.94Å; S148-R152 PolarHBondContact O-N 3.24Å |
| 149 | K | 53.4 | Low | 54.5 | Low | 145 Ų | 145 | 118.2 Ų | 118.2 | 63% | 0.63 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -71.3 | -40.5 | 173.7 | -102.8 | -178.6 | 178.7 | -178.6 | 0 | 112.2 | S145 N146 H151 R152 V153 | S145-K149 WeakPolarHBondContact O-CB 3.49Å; S145-K149 PolarHBondContact O-N 3.12Å; N146-K149 PolarHBondContact O-N 2.7Å; K149-H151 VanDerWaalsContact C-N 3.29Å; K149-H151 PolarHBondContact O-N 3.18Å; K149-R152 PolarHBondContact O-N 2.99Å; K149-R152 VanDerWaalsContact O-N 3.16Å; K149-V153 WeakPolarHBondContact O-CG2 3.24Å; K149-V153 PolarHBondContact O-N 3.03Å |
| 150 | V | 51.7 | Low | 54 | Low | 101 Ų | 101 | 122.8 Ų | 122.8 | 61% | 0.612 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -63.6 | -37.9 | 175 | 174.6 | 0 | 0 | 0 | 0 | 110.5 | N146 A147 R152 V154 | N146-V150 VanDerWaalsContact O-CG2 3.28Å; N146-V150 WeakPolarHBondContact O-CG2 3.32Å; N146-V150 PolarHBondContact O-N 3.1Å; A147-V150 PolarHBondContact O-N 2.95Å; V150-R152 VanDerWaalsContact C-N 3.29Å; V150-R152 PolarHBondContact O-N 3.02Å; V150-V154 WeakPolarHBondContact O-CG2 3.23Å |
| 151 | H | 47.1 | Very low | 53.2 | Low | 158 Ų | 158 | 123.5 Ų | 123.5 | 73% | 0.731 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -70.9 | -21.4 | 175.8 | -132.5 | -62.2 | 0 | 0 | 0 | 114.2 | A147 K149 | A147-H151 PolarHBondContact O-N 3.02Å; K149-H151 VanDerWaalsContact C-N 3.29Å; K149-H151 PolarHBondContact O-N 3.18Å |
| 152 | R | 47.1 | Very low | 52.7 | Low | 210 Ų | 210 | 124.4 Ų | 124.4 | 79% | 0.792 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -89.9 | -14.3 | 179.8 | -127.3 | 178.8 | -167.1 | 172.1 | 3.7 | 114.2 | S148 K149 V150 | S148-R152 PolarHBondContact O-N 3.24Å; K149-R152 PolarHBondContact O-N 2.99Å; K149-R152 VanDerWaalsContact O-N 3.16Å; V150-R152 VanDerWaalsContact C-N 3.29Å; V150-R152 PolarHBondContact O-N 3.02Å |
| 153 | V | 50.3 | Low | 51.8 | Low | 114 Ų | 114 | 125.2 Ų | 125.2 | 69% | 0.691 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -99 | -4.7 | -175.4 | 176.5 | 0 | 0 | 0 | 0 | 113 | K149 | K149-V153 WeakPolarHBondContact O-CG2 3.24Å; K149-V153 PolarHBondContact O-N 3.03Å |
| 154 | V | 51.5 | Low | 50.9 | Low | 109 Ų | 109 | 130 Ų | 130 | 66% | 0.661 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -97.8 | 7 | -175.3 | -179.5 | 0 | 0 | 0 | 0 | 114.1 | V150 | V150-V154 WeakPolarHBondContact O-CG2 3.23Š|
| 155 | H | 48.4 | Very low | 50.4 | Low | 160 Ų | 160 | 128.8 Ų | 128.8 | 74% | 0.741 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -136 | 41.5 | -176.1 | -92.5 | -70.9 | 0 | 0 | 0 | 116.2 | ||
| 156 | T | 50.3 | Low | 49.9 | Very low | 132 Ų | 132 | 132.5 Ų | 132.5 | 81% | 0.81 | 73% | 0.733 | S | S | * | * | trans | -120.6 | 25.6 | 168.6 | 61 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 157 | G | 48.1 | Very low | 49.5 | Very low | 78 Ų | 78 | 135.4 Ų | 135.4 | 80% | 0.804 | 75% | 0.75 | S | S | * | * | trans | -101.4 | 74.6 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 158 | V | 53.7 | Low | 49 | Very low | 108 Ų | 108 | 139.7 Ų | 139.7 | 66% | 0.655 | 76% | 0.764 | S | S | * | * | trans | -127.4 | 100.3 | 165.3 | -172.8 | 0 | 0 | 0 | 0 | 106.9 | F160 | V158-F160 HydrophobicContact CG1-CD2 3.76Å; V158-F160 HydrophobicContact CG1-CE2 3.59Å; V158-F160 PolarHBondContact O-N 3.13Å | ||
| 159 | D | 43.8 | Very low | 48.6 | Very low | 158 Ų | 158 | 144 Ų | 144 | 85% | 0.845 | 78% | 0.781 | S | S | * | * | trans | -54.8 | 121.8 | 165.5 | -80.1 | -49.1 | 0 | 0 | 0 | 109.7 | ||||
| 160 | F | 51.9 | Low | 48.2 | Very low | 183 Ų | 183 | 143.9 Ų | 143.9 | 80% | 0.803 | 79% | 0.791 | S | S | * | * | trans | -127.7 | 99.9 | 155.7 | -89.6 | -79.8 | 0 | 0 | 0 | 108.2 | V158 | V158-F160 HydrophobicContact CG1-CD2 3.76Å; V158-F160 HydrophobicContact CG1-CE2 3.59Å; V158-F160 PolarHBondContact O-N 3.13Å | ||
| 161 | T | 44.6 | Very low | 48 | Very low | 134 Ų | 134 | 147 Ų | 147 | 82% | 0.822 | 80% | 0.803 | S | S | * | * | trans | -73.3 | 120.6 | 158.9 | 14.6 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 162 | L | 51.1 | Low | 48.1 | Very low | 153 Ų | 153 | 146.2 Ų | 146.2 | 80% | 0.801 | 81% | 0.809 | S | S | * | * | trans | -114.4 | 101 | 168.3 | -124.1 | 147.4 | 0 | 0 | 0 | 107.2 | ||||
| 163 | N | 41.5 | Very low | 48.1 | Very low | 156 Ų | 156 | 140.8 Ų | 140.8 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | -87.2 | 107.9 | 166.9 | -104.8 | -2.3 | 0 | 0 | 0 | 107.7 | ||||
| 164 | T | 42.5 | Very low | 47.9 | Very low | 205 Ų | 205 | 143.3 Ų | 143.3 | 100% | 1.258 | 82% | 0.821 | S | S | * | * | trans | 177.6 | 0 | 141.3 | 31.5 | 0 | 0 | 0 | 0 | 108.7 |
Retrieved 164 of 164 residues in 300.4 ms
(Link to these results)