| 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 | 74.3 | Confident | 86.1 | Confident | 177 Ų | 177 | 145.5 Ų | 145.5 | 87% | 0.872 | 65% | 0.647 | S | S | * | * | 0 | -23 | 0 | -61.8 | -54 | -83.2 | 0 | 0 | 115.3 | |||||
| 2 | K | 86 | Confident | 86.1 | Confident | 167 Ų | 167 | 136.5 Ų | 136.5 | 73% | 0.726 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -58.4 | -52 | -175.9 | -167.5 | 174.9 | 178.7 | 179.7 | 0 | 114.4 | Q4 R5 D6 | K2-Q4 VanDerWaalsContact C-N 3.33Å; K2-Q4 PolarHBondContact O-N 3.06Å; K2-R5 WeakPolarHBondContact O-CB 3.25Å; K2-R5 PolarHBondContact O-N 3.3Å; K2-D6 PolarHBondContact O-N 2.82Å; K2-D6 VanDerWaalsContact O-N 3.09Å |
| 3 | R | 84.3 | Confident | 86.2 | Confident | 210 Ų | 210 | 131.3 Ų | 131.3 | 79% | 0.792 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -55.6 | -40.1 | -178.9 | -66.3 | -176.2 | -177.8 | 172.4 | 0.1 | 114.4 | R5 D6 D7 | R3-R5 VanDerWaalsContact C-N 3.33Å; R3-R5 PolarHBondContact O-N 3.31Å; R3-D6 PolarHBondContact O-N 3.41Å; R3-D7 PolarHBondContact O-N 3.3Å |
| 4 | Q | 86.4 | Confident | 86.4 | Confident | 123 Ų | 123 | 127.9 Ų | 127.9 | 58% | 0.575 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -67.5 | -32.3 | 178 | -76.5 | 179.8 | -19.4 | 0 | 0 | 112.9 | K2 L8 | K2-Q4 VanDerWaalsContact C-N 3.33Å; K2-Q4 PolarHBondContact O-N 3.06Å; Q4-L8 VanDerWaalsContact O-CG 3.29Å; Q4-L8 WeakPolarHBondContact O-CG 3.35Å; Q4-L8 PolarHBondContact O-N 2.85Å |
| 5 | R | 86.3 | Confident | 86.8 | Confident | 189 Ų | 189 | 129.1 Ų | 129.1 | 71% | 0.713 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -70 | -45.5 | 174 | -74.7 | -172.9 | 179.2 | 178.9 | -0.6 | 110.7 | K2 R3 D7 L8 E9 | K2-R5 WeakPolarHBondContact O-CB 3.25Å; K2-R5 PolarHBondContact O-N 3.3Å; R3-R5 VanDerWaalsContact C-N 3.33Å; R3-R5 PolarHBondContact O-N 3.31Å; R5-D7 VanDerWaalsContact C-N 3.32Å; R5-D7 PolarHBondContact O-N 2.85Å; R5-L8 PolarHBondContact O-N 2.88Å; R5-L8 VanDerWaalsContact O-N 3.15Å; R5-E9 WeakPolarHBondContact O-CB 3.44Å; R5-E9 PolarHBondContact O-N 2.9Å |
| 6 | D | 89.2 | Confident | 87.1 | Confident | 74 Ų | 74 | 125.6 Ų | 125.6 | 40% | 0.396 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -59.9 | -42.5 | 178.3 | -55.9 | -18.5 | 0 | 0 | 0 | 110.9 | K2 R3 L8 E9 Q10 | K2-D6 PolarHBondContact O-N 2.82Å; K2-D6 VanDerWaalsContact O-N 3.09Å; R3-D6 PolarHBondContact O-N 3.41Å; D6-L8 PolarHBondContact O-N 2.86Å; D6-E9 PolarHBondContact O-N 2.8Å; D6-Q10 WeakPolarHBondContact O-CB 3.36Å; D6-Q10 PolarHBondContact O-N 2.87Å |
| 7 | D | 90.1 | Very high | 87.4 | Confident | 88 Ų | 88 | 119.6 Ų | 119.6 | 47% | 0.471 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -63.2 | -40 | 175.4 | -75.1 | -16 | 0 | 0 | 0 | 112.8 | R3 R5 R11 | R3-D7 PolarHBondContact O-N 3.3Å; R5-D7 VanDerWaalsContact C-N 3.32Å; R5-D7 PolarHBondContact O-N 2.85Å; D7-R11 WeakPolarHBondContact O-CB 3.46Å; D7-R11 VanDerWaalsContact O-CG 3.31Å; D7-R11 WeakPolarHBondContact O-CG 3.49Å; D7-R11 PolarHBondContact O-N 3.41Å |
| 8 | L | 87.6 | Confident | 87.8 | Confident | 115 Ų | 115 | 118.7 Ų | 118.7 | 60% | 0.602 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -68 | -38.7 | 176.7 | -75.5 | 171.7 | 0 | 0 | 0 | 111.6 | Q4 R5 D6 R11 A12 | Q4-L8 VanDerWaalsContact O-CG 3.29Å; Q4-L8 WeakPolarHBondContact O-CG 3.35Å; Q4-L8 PolarHBondContact O-N 2.85Å; R5-L8 PolarHBondContact O-N 2.88Å; R5-L8 VanDerWaalsContact O-N 3.15Å; D6-L8 PolarHBondContact O-N 2.86Å; L8-R11 PolarHBondContact O-N 3.02Å; L8-A12 WeakPolarHBondContact O-CB 3.24Å; L8-A12 PolarHBondContact O-N 2.64Å |
| 9 | E | 88.3 | Confident | 88.2 | Confident | 141 Ų | 141 | 118.1 Ų | 118.1 | 66% | 0.659 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -68.7 | -39 | 176.5 | -169.1 | 167.8 | -169.4 | 0 | 0 | 111.7 | R5 D6 A12 S13 | R5-E9 WeakPolarHBondContact O-CB 3.44Å; R5-E9 PolarHBondContact O-N 2.9Å; D6-E9 PolarHBondContact O-N 2.8Å; E9-A12 PolarHBondContact O-N 2.75Å; E9-S13 PolarHBondContact O-N 3.09Å; E9-S13 PolarHBondContact O-OG 3.15Å |
| 10 | Q | 88.3 | Confident | 88.5 | Confident | 131 Ų | 131 | 120.8 Ų | 120.8 | 61% | 0.612 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.4 | -41 | 173.2 | -166.7 | 178.5 | 11.3 | 0 | 0 | 112 | D6 S13 S14 | D6-Q10 WeakPolarHBondContact O-CB 3.36Å; D6-Q10 PolarHBondContact O-N 2.87Å; Q10-S13 WeakPolarHBondContact CA-OG 3.49Å; Q10-S13 PolarHBondContact O-OG 3.26Å; Q10-S14 VanDerWaalsContact O-CB 3.31Å; Q10-S14 WeakPolarHBondContact O-CB 3.4Å; Q10-S14 PolarHBondContact O-N 3.23Å |
| 11 | R | 86.7 | Confident | 88.8 | Confident | 185 Ų | 185 | 120.3 Ų | 120.3 | 70% | 0.698 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.4 | -39.4 | 173.8 | -74.7 | 177.9 | -175.9 | -171.9 | 2.7 | 112 | D7 L8 R15 | D7-R11 WeakPolarHBondContact O-CB 3.46Å; D7-R11 VanDerWaalsContact O-CG 3.31Å; D7-R11 WeakPolarHBondContact O-CG 3.49Å; D7-R11 PolarHBondContact O-N 3.41Å; L8-R11 PolarHBondContact O-N 3.02Å; R11-R15 WeakPolarHBondContact O-CB 3.49Å; R11-R15 PolarHBondContact O-N 3.37Å |
| 12 | A | 85.6 | Confident | 89.9 | Confident | 38 Ų | 38 | 114.5 Ų | 114.5 | 31% | 0.314 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.9 | -48.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | L8 E9 S14 R15 D16 | L8-A12 WeakPolarHBondContact O-CB 3.24Å; L8-A12 PolarHBondContact O-N 2.64Å; E9-A12 PolarHBondContact O-N 2.75Å; A12-S14 PolarHBondContact O-N 2.96Å; A12-R15 WeakPolarHBondContact O-CB 3.4Å; A12-R15 PolarHBondContact O-N 3.01Å; A12-D16 PolarHBondContact O-N 3.32Å |
| 13 | S | 87.1 | Confident | 90.4 | Very high | 69 Ų | 69 | 111.9 Ų | 111.9 | 48% | 0.483 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.3 | -40.1 | 177.3 | 55.4 | 0 | 0 | 0 | 0 | 112.9 | E9 Q10 D16 G17 | E9-S13 PolarHBondContact O-N 3.09Å; E9-S13 PolarHBondContact O-OG 3.15Å; Q10-S13 WeakPolarHBondContact CA-OG 3.49Å; Q10-S13 PolarHBondContact O-OG 3.26Å; S13-D16 PolarHBondContact O-N 3.35Å; S13-G17 PolarHBondContact O-N 2.96Å |
| 14 | S | 90.1 | Very high | 91 | Very high | 84 Ų | 84 | 107.5 Ų | 107.5 | 59% | 0.587 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.8 | -43.3 | 173.4 | 178.9 | 0 | 0 | 0 | 0 | 112 | Q10 A12 D16 G17 L18 | Q10-S14 VanDerWaalsContact O-CB 3.31Å; Q10-S14 WeakPolarHBondContact O-CB 3.4Å; Q10-S14 PolarHBondContact O-N 3.23Å; A12-S14 PolarHBondContact O-N 2.96Å; S14-D16 VanDerWaalsContact C-N 3.34Å; S14-D16 PolarHBondContact O-N 3.15Å; S14-G17 PolarHBondContact O-N 3.18Å; S14-L18 PolarHBondContact O-N 2.88Å |
| 15 | R | 91.2 | Very high | 91.6 | Very high | 146 Ų | 146 | 106.5 Ų | 106.5 | 55% | 0.551 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.5 | -40.9 | 176.4 | -174.3 | -173.4 | 67.9 | -173.7 | -2.6 | 111.9 | R11 A12 L18 K19 | R11-R15 WeakPolarHBondContact O-CB 3.49Å; R11-R15 PolarHBondContact O-N 3.37Å; A12-R15 WeakPolarHBondContact O-CB 3.4Å; A12-R15 PolarHBondContact O-N 3.01Å; R15-L18 PolarHBondContact O-N 3.46Å; R15-K19 WeakPolarHBondContact O-CG 2.9Å; R15-K19 PolarHBondContact O-N 3.44Å |
| 16 | D | 91.5 | Very high | 92.1 | Very high | 72 Ų | 72 | 105.8 Ų | 105.8 | 39% | 0.385 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -74.2 | -28.5 | 179.1 | -64.6 | -20.7 | 0 | 0 | 0 | 112 | A12 S13 S14 K19 R20 | A12-D16 PolarHBondContact O-N 3.32Å; S13-D16 PolarHBondContact O-N 3.35Å; S14-D16 VanDerWaalsContact C-N 3.34Å; S14-D16 PolarHBondContact O-N 3.15Å; D16-K19 IonicContact OD1-NZ 3.79Å; D16-R20 WeakPolarHBondContact O-CG 3.36Å; D16-R20 PolarHBondContact O-N 2.87Å; D16-R20 PolarHBondContact O-NE 2.87Å |
| 17 | G | 93.3 | Very high | 92.5 | Very high | 24 Ų | 24 | 108.5 Ų | 108.5 | 25% | 0.247 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -61.4 | -51.2 | 165.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S13 S14 K19 R20 E21 | S13-G17 PolarHBondContact O-N 2.96Å; S14-G17 PolarHBondContact O-N 3.18Å; G17-K19 VanDerWaalsContact C-N 3.33Å; G17-K19 PolarHBondContact O-N 2.95Å; G17-R20 PolarHBondContact O-N 3.47Å; G17-E21 PolarHBondContact O-N 3.37Å; G17-E21 VanDerWaalsContact O-N 3.08Å |
| 18 | L | 93.9 | Very high | 92.9 | Very high | 104 Ų | 104 | 108.1 Ų | 108.1 | 55% | 0.545 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.3 | -38.7 | 179 | -173.2 | 68.2 | 0 | 0 | 0 | 112.3 | S14 R15 R20 E21 V22 | S14-L18 PolarHBondContact O-N 2.88Å; R15-L18 PolarHBondContact O-N 3.46Å; L18-R20 PolarHBondContact O-N 3.46Å; L18-E21 PolarHBondContact O-N 3.49Å; L18-V22 HydrophobicContact CG-CG2 4.5Å; L18-V22 WeakPolarHBondContact O-CB 3.46Å; L18-V22 VanDerWaalsContact O-CG2 3.29Å; L18-V22 WeakPolarHBondContact O-CG2 3.37Å; L18-V22 PolarHBondContact O-N 3.38Å |
| 19 | K | 95.1 | Very high | 93.3 | Very high | 106 Ų | 106 | 107.2 Ų | 107.2 | 46% | 0.461 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.8 | -44.9 | 175.1 | -78.9 | 176.7 | -179.3 | 175.9 | 0 | 112.1 | R15 D16 G17 V22 E23 | R15-K19 WeakPolarHBondContact O-CG 2.9Å; R15-K19 PolarHBondContact O-N 3.44Å; D16-K19 IonicContact OD1-NZ 3.79Å; G17-K19 VanDerWaalsContact C-N 3.33Å; G17-K19 PolarHBondContact O-N 2.95Å; K19-V22 PolarHBondContact O-N 2.87Å; K19-E23 WeakPolarHBondContact O-CG 3.33Å; K19-E23 PolarHBondContact O-N 3.36Å |
| 20 | R | 94.7 | Very high | 93.8 | Very high | 173 Ų | 173 | 107.8 Ų | 107.8 | 65% | 0.653 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.6 | -42 | 177 | -74.6 | -176.6 | -73.3 | 171.2 | -2.9 | 111.9 | D16 G17 L18 E23 Q24 | D16-R20 WeakPolarHBondContact O-CG 3.36Å; D16-R20 PolarHBondContact O-N 2.87Å; D16-R20 PolarHBondContact O-NE 2.87Å; G17-R20 PolarHBondContact O-N 3.47Å; L18-R20 PolarHBondContact O-N 3.46Å; R20-E23 PolarHBondContact O-N 2.9Å; R20-Q24 WeakPolarHBondContact O-CB 3.33Å; R20-Q24 PolarHBondContact O-N 3.34Å |
| 21 | E | 95.8 | Very high | 94.3 | Very high | 110 Ų | 110 | 105 Ų | 105 | 51% | 0.514 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.2 | -42.1 | 176.5 | -170.5 | 177.9 | -176.7 | 0 | 0 | 111.8 | G17 L18 E23 Q24 L25 | G17-E21 PolarHBondContact O-N 3.37Å; G17-E21 VanDerWaalsContact O-N 3.08Å; L18-E21 PolarHBondContact O-N 3.49Å; E21-E23 PolarHBondContact O-N 3.01Å; E21-Q24 PolarHBondContact O-N 3.42Å; E21-L25 HydrophobicContact CG-CD1 4.33Å; E21-L25 WeakPolarHBondContact O-CB 3.35Å; E21-L25 WeakPolarHBondContact O-CG 3.38Å; E21-L25 PolarHBondContact O-N 3.26Å |
| 22 | V | 96.5 | Very high | 94.8 | Very high | 55 Ų | 55 | 101.5 Ų | 101.5 | 33% | 0.333 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.9 | -40.2 | 175.5 | 170 | 0 | 0 | 0 | 0 | 111.7 | L18 K19 R26 | L18-V22 HydrophobicContact CG-CG2 4.5Å; L18-V22 WeakPolarHBondContact O-CB 3.46Å; L18-V22 VanDerWaalsContact O-CG2 3.29Å; L18-V22 WeakPolarHBondContact O-CG2 3.37Å; L18-V22 PolarHBondContact O-N 3.38Å; K19-V22 PolarHBondContact O-N 2.87Å; V22-R26 VanDerWaalsContact O-CG 3.27Å; V22-R26 WeakPolarHBondContact O-CG 3.45Å; V22-R26 PolarHBondContact O-N 3.14Å |
| 23 | E | 96.5 | Very high | 95.4 | Very high | 113 Ų | 113 | 105.3 Ų | 105.3 | 53% | 0.528 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.9 | -45.8 | 174.7 | -76.8 | 174.4 | 178.3 | 0 | 0 | 111.4 | K19 R20 E21 L25 R26 E27 | K19-E23 WeakPolarHBondContact O-CG 3.33Å; K19-E23 PolarHBondContact O-N 3.36Å; R20-E23 PolarHBondContact O-N 2.9Å; E21-E23 PolarHBondContact O-N 3.01Å; E23-L25 PolarHBondContact O-N 2.92Å; E23-R26 WeakPolarHBondContact O-CB 3.45Å; E23-R26 PolarHBondContact O-N 2.73Å; E23-R26 VanDerWaalsContact O-N 3.16Å; E23-E27 PolarHBondContact O-N 3.23Å |
| 24 | Q | 97.4 | Very high | 95.9 | Very high | 118 Ų | 118 | 108.5 Ų | 108.5 | 55% | 0.551 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.3 | -43.5 | 176.5 | -172.4 | 179.3 | 6.8 | 0 | 0 | 112.2 | R20 E21 R26 E27 N28 | R20-Q24 WeakPolarHBondContact O-CB 3.33Å; R20-Q24 PolarHBondContact O-N 3.34Å; E21-Q24 PolarHBondContact O-N 3.42Å; Q24-R26 VanDerWaalsContact C-N 3.3Å; Q24-R26 PolarHBondContact O-N 3.44Å; Q24-E27 PolarHBondContact O-N 3.1Å; Q24-N28 WeakPolarHBondContact O-CB 3.38Å; Q24-N28 VanDerWaalsContact O-CG 3.28Å; Q24-N28 PolarHBondContact O-N 3.45Å |
| 25 | L | 97.5 | Very high | 96.3 | Very high | 101 Ų | 101 | 109.1 Ų | 109.1 | 53% | 0.529 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.7 | -35.7 | 176.4 | -74.7 | 172.7 | 0 | 0 | 0 | 112.1 | E21 E23 N28 L29 | E21-L25 HydrophobicContact CG-CD1 4.33Å; E21-L25 WeakPolarHBondContact O-CB 3.35Å; E21-L25 WeakPolarHBondContact O-CG 3.38Å; E21-L25 PolarHBondContact O-N 3.26Å; E23-L25 PolarHBondContact O-N 2.92Å; L25-N28 PolarHBondContact O-N 2.92Å; L25-L29 VanDerWaalsContact O-CB 3.29Å; L25-L29 WeakPolarHBondContact O-CB 3.4Å; L25-L29 PolarHBondContact O-N 3.43Å |
| 26 | R | 97.5 | Very high | 96.6 | Very high | 174 Ų | 174 | 105.9 Ų | 105.9 | 66% | 0.657 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66.3 | -40.6 | 174.4 | -75.8 | 171.6 | 177.3 | 174.9 | 0.4 | 112 | V22 E23 Q24 L29 K30 | V22-R26 VanDerWaalsContact O-CG 3.27Å; V22-R26 WeakPolarHBondContact O-CG 3.45Å; V22-R26 PolarHBondContact O-N 3.14Å; E23-R26 WeakPolarHBondContact O-CB 3.45Å; E23-R26 PolarHBondContact O-N 2.73Å; E23-R26 VanDerWaalsContact O-N 3.16Å; Q24-R26 VanDerWaalsContact C-N 3.3Å; Q24-R26 PolarHBondContact O-N 3.44Å; R26-L29 PolarHBondContact O-N 3.45Å; R26-K30 WeakPolarHBondContact O-CB 3.32Å; R26-K30 PolarHBondContact O-N 3.42Å |
| 27 | E | 97.8 | Very high | 96.8 | Very high | 132 Ų | 132 | 106 Ų | 106 | 62% | 0.617 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65 | -43.4 | 175 | -71.1 | -175.7 | 167.7 | 0 | 0 | 112 | E23 Q24 L29 K30 T31 | E23-E27 PolarHBondContact O-N 3.23Å; Q24-E27 PolarHBondContact O-N 3.1Å; E27-L29 PolarHBondContact O-N 3.11Å; E27-K30 PolarHBondContact O-N 3.12Å; E27-T31 PolarHBondContact O-N 2.99Å; E27-T31 PolarHBondContact O-OG1 3.31Å |
| 28 | N | 98.1 | Very high | 97 | Very high | 79 Ų | 79 | 109.4 Ų | 109.4 | 42% | 0.422 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 175.4 | -71.4 | -16.4 | 0 | 0 | 0 | 111.5 | Q24 L25 K30 T31 L32 | Q24-N28 WeakPolarHBondContact O-CB 3.38Å; Q24-N28 VanDerWaalsContact O-CG 3.28Å; Q24-N28 PolarHBondContact O-N 3.45Å; L25-N28 PolarHBondContact O-N 2.92Å; N28-K30 PolarHBondContact O-N 3.26Å; N28-T31 WeakPolarHBondContact O-CB 3.47Å; N28-T31 PolarHBondContact O-N 2.95Å; N28-L32 WeakPolarHBondContact O-CG 3.43Å; N28-L32 PolarHBondContact O-N 3.42Å |
| 29 | L | 97.6 | Very high | 97.2 | Very high | 96 Ų | 96 | 109.2 Ų | 109.2 | 50% | 0.503 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.8 | -45.7 | 177.7 | -165.4 | 160.4 | 0 | 0 | 0 | 110.8 | L25 R26 E27 T31 L32 E33 | L25-L29 VanDerWaalsContact O-CB 3.29Å; L25-L29 WeakPolarHBondContact O-CB 3.4Å; L25-L29 PolarHBondContact O-N 3.43Å; R26-L29 PolarHBondContact O-N 3.45Å; E27-L29 PolarHBondContact O-N 3.11Å; L29-T31 VanDerWaalsContact C-N 3.27Å; L29-T31 PolarHBondContact O-N 3.29Å; L29-L32 PolarHBondContact O-N 3.12Å; L29-E33 HydrophobicContact CD2-CG 3.84Å; L29-E33 WeakPolarHBondContact CD2-OE1 3.05Å; L29-E33 WeakPolarHBondContact O-CG 3.46Å; L29-E33 PolarHBondContact O-N 3.12Å |
| 30 | K | 97.7 | Very high | 97.3 | Very high | 153 Ų | 153 | 111 Ų | 111 | 67% | 0.665 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.2 | -36.4 | 176.4 | -170.3 | 178 | -178 | -179 | 0 | 112.3 | R26 E27 N28 K34 | R26-K30 WeakPolarHBondContact O-CB 3.32Å; R26-K30 PolarHBondContact O-N 3.42Å; E27-K30 PolarHBondContact O-N 3.12Å; N28-K30 PolarHBondContact O-N 3.26Å; K30-K34 PolarHBondContact O-N 3.46Å; K30-K34 VanDerWaalsContact O-N 3.13Å |
| 31 | T | 97.9 | Very high | 97.4 | Very high | 73 Ų | 73 | 108.8 Ų | 108.8 | 45% | 0.448 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.5 | -48.2 | 176 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | E27 N28 L29 E33 K34 E35 | E27-T31 PolarHBondContact O-N 2.99Å; E27-T31 PolarHBondContact O-OG1 3.31Å; N28-T31 WeakPolarHBondContact O-CB 3.47Å; N28-T31 PolarHBondContact O-N 2.95Å; L29-T31 VanDerWaalsContact C-N 3.27Å; L29-T31 PolarHBondContact O-N 3.29Å; T31-E33 VanDerWaalsContact C-N 3.33Å; T31-E33 PolarHBondContact O-N 3.25Å; T31-K34 WeakPolarHBondContact O-CB 3.46Å; T31-K34 PolarHBondContact O-N 3.47Å; T31-K34 VanDerWaalsContact O-N 3.12Å; T31-E35 WeakPolarHBondContact O-CG 3.4Å; T31-E35 PolarHBondContact O-N 3.41Å |
| 32 | L | 98 | Very high | 97.5 | Very high | 111 Ų | 111 | 107.9 Ų | 107.9 | 58% | 0.581 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.1 | -38.7 | 176.2 | -77.7 | 167.2 | 0 | 0 | 0 | 112.5 | N28 L29 K34 E35 N36 | N28-L32 WeakPolarHBondContact O-CG 3.43Å; N28-L32 PolarHBondContact O-N 3.42Å; L29-L32 PolarHBondContact O-N 3.12Å; L32-K34 VanDerWaalsContact C-N 3.34Å; L32-E35 PolarHBondContact O-N 3.15Å; L32-N36 WeakPolarHBondContact O-CB 3.36Å; L32-N36 PolarHBondContact O-N 3.42Å |
| 33 | E | 98.1 | Very high | 97.5 | Very high | 118 Ų | 118 | 110.9 Ų | 110.9 | 55% | 0.551 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63 | -40.8 | 174.4 | -77.2 | -179.9 | 161.7 | 0 | 0 | 111.8 | L29 T31 N36 T37 | L29-E33 HydrophobicContact CD2-CG 3.84Å; L29-E33 WeakPolarHBondContact CD2-OE1 3.05Å; L29-E33 WeakPolarHBondContact O-CG 3.46Å; L29-E33 PolarHBondContact O-N 3.12Å; T31-E33 VanDerWaalsContact C-N 3.33Å; T31-E33 PolarHBondContact O-N 3.25Å; E33-N36 PolarHBondContact O-N 3.34Å; E33-T37 WeakPolarHBondContact O-CB 3.35Å; E33-T37 VanDerWaalsContact O-CG2 3.3Å; E33-T37 WeakPolarHBondContact O-CG2 3.39Å; E33-T37 PolarHBondContact O-N 3.3Å; E33-T37 PolarHBondContact O-OG1 2.91Å |
| 34 | K | 97.9 | Very high | 97.5 | Very high | 136 Ų | 136 | 109 Ų | 109 | 59% | 0.591 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.3 | -43.3 | 175.5 | -171.7 | -179.2 | 176.7 | -173.8 | 0 | 111.7 | K30 T31 L32 T37 Q38 | K30-K34 PolarHBondContact O-N 3.46Å; K30-K34 VanDerWaalsContact O-N 3.13Å; T31-K34 WeakPolarHBondContact O-CB 3.46Å; T31-K34 PolarHBondContact O-N 3.47Å; T31-K34 VanDerWaalsContact O-N 3.12Å; L32-K34 VanDerWaalsContact C-N 3.34Å; K34-T37 WeakPolarHBondContact CA-OG1 3.49Å; K34-T37 PolarHBondContact O-N 3.42Å; K34-T37 PolarHBondContact O-OG1 3Å; K34-Q38 VanDerWaalsContact O-CG 3.29Å; K34-Q38 WeakPolarHBondContact O-CG 3.39Å; K34-Q38 PolarHBondContact O-N 3.39Å |
| 35 | E | 97.9 | Very high | 97.5 | Very high | 97 Ų | 97 | 109.8 Ų | 109.8 | 45% | 0.453 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 176.2 | -70.7 | 176.6 | -179.6 | 0 | 0 | 111.6 | T31 L32 T37 Q38 L39 | T31-E35 WeakPolarHBondContact O-CG 3.4Å; T31-E35 PolarHBondContact O-N 3.41Å; L32-E35 PolarHBondContact O-N 3.15Å; E35-T37 VanDerWaalsContact C-N 3.35Å; E35-T37 PolarHBondContact O-N 3.2Å; E35-Q38 PolarHBondContact O-N 3.37Å; E35-L39 WeakPolarHBondContact O-CB 3.45Å; E35-L39 WeakPolarHBondContact O-CG 3.43Å; E35-L39 PolarHBondContact O-N 3.13Å |
| 36 | N | 97.6 | Very high | 97.4 | Very high | 79 Ų | 79 | 112.3 Ų | 112.3 | 42% | 0.422 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.4 | -41.5 | 178.4 | -165.7 | -54.6 | 0 | 0 | 0 | 111.4 | L32 E33 L39 K40 | L32-N36 WeakPolarHBondContact O-CB 3.36Å; L32-N36 PolarHBondContact O-N 3.42Å; E33-N36 PolarHBondContact O-N 3.34Å; N36-L39 PolarHBondContact O-N 2.91Å; N36-K40 WeakPolarHBondContact O-CB 3.47Å; N36-K40 WeakPolarHBondContact O-CG 3.48Å; N36-K40 PolarHBondContact O-N 3.42Å; N36-K40 WeakPolarHBondContact OD1-CD 3.39Å; N36-K40 WeakPolarHBondContact OD1-CE 3.44Å; N36-K40 PolarHBondContact OD1-NZ 3.04Å |
| 37 | T | 97.1 | Very high | 97.5 | Very high | 73 Ų | 73 | 112.3 Ų | 112.3 | 45% | 0.448 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.4 | -39.6 | 174.8 | 50.7 | 0 | 0 | 0 | 0 | 112.2 | E33 K34 E35 K40 Q41 | E33-T37 WeakPolarHBondContact O-CB 3.35Å; E33-T37 VanDerWaalsContact O-CG2 3.3Å; E33-T37 WeakPolarHBondContact O-CG2 3.39Å; E33-T37 PolarHBondContact O-N 3.3Å; E33-T37 PolarHBondContact O-OG1 2.91Å; K34-T37 WeakPolarHBondContact CA-OG1 3.49Å; K34-T37 PolarHBondContact O-N 3.42Å; K34-T37 PolarHBondContact O-OG1 3Å; E35-T37 VanDerWaalsContact C-N 3.35Å; E35-T37 PolarHBondContact O-N 3.2Å; T37-K40 PolarHBondContact O-N 3.08Å; T37-Q41 WeakPolarHBondContact O-CG 3.34Å; T37-Q41 PolarHBondContact O-N 2.67Å; T37-Q41 VanDerWaalsContact O-N 3.16Å |
| 38 | Q | 97.3 | Very high | 97.4 | Very high | 96 Ų | 96 | 112.4 Ų | 112.4 | 45% | 0.449 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.9 | -45.5 | 173 | -73 | 176.5 | 1.5 | 0 | 0 | 112.1 | K34 E35 K40 Q41 L42 | K34-Q38 VanDerWaalsContact O-CG 3.29Å; K34-Q38 WeakPolarHBondContact O-CG 3.39Å; K34-Q38 PolarHBondContact O-N 3.39Å; E35-Q38 PolarHBondContact O-N 3.37Å; Q38-K40 PolarHBondContact O-N 3.09Å; Q38-Q41 PolarHBondContact O-N 3.43Å; Q38-Q41 VanDerWaalsContact O-N 3.11Å; Q38-L42 WeakPolarHBondContact O-CG 3.38Å; Q38-L42 PolarHBondContact O-N 3Å |
| 39 | L | 97.8 | Very high | 97.4 | Very high | 101 Ų | 101 | 110.9 Ų | 110.9 | 53% | 0.529 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 177 | -73.5 | 172.8 | 0 | 0 | 0 | 111.8 | E35 N36 Q41 L42 L43 | E35-L39 WeakPolarHBondContact O-CB 3.45Å; E35-L39 WeakPolarHBondContact O-CG 3.43Å; E35-L39 PolarHBondContact O-N 3.13Å; N36-L39 PolarHBondContact O-N 2.91Å; L39-Q41 PolarHBondContact O-N 3.34Å; L39-L42 PolarHBondContact O-N 3.34Å; L39-L42 VanDerWaalsContact O-N 3.15Å; L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.39Å; L39-L43 PolarHBondContact O-N 2.74Å |
| 40 | K | 97.3 | Very high | 97.4 | Very high | 144 Ų | 144 | 110 Ų | 110 | 63% | 0.626 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.7 | -28.8 | 174.3 | -79.8 | 174.6 | 174.5 | 166.8 | 0 | 113 | N36 T37 Q38 P44 | N36-K40 WeakPolarHBondContact O-CB 3.47Å; N36-K40 WeakPolarHBondContact O-CG 3.48Å; N36-K40 PolarHBondContact O-N 3.42Å; N36-K40 WeakPolarHBondContact OD1-CD 3.39Å; N36-K40 WeakPolarHBondContact OD1-CE 3.44Å; N36-K40 PolarHBondContact OD1-NZ 3.04Å; T37-K40 PolarHBondContact O-N 3.08Å; Q38-K40 PolarHBondContact O-N 3.09Å; K40-P44 WeakPolarHBondContact O-CD 3.43Å; K40-P44 WeakPolarHBondContact O-CG 3.35Å |
| 41 | Q | 95.9 | Very high | 97.4 | Very high | 126 Ų | 126 | 107.3 Ų | 107.3 | 59% | 0.589 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -84.4 | -33.7 | 174.6 | -68.6 | 177.2 | 9.1 | 0 | 0 | 113.2 | T37 Q38 L39 P44 | T37-Q41 WeakPolarHBondContact O-CG 3.34Å; T37-Q41 PolarHBondContact O-N 2.67Å; T37-Q41 VanDerWaalsContact O-N 3.16Å; Q38-Q41 PolarHBondContact O-N 3.43Å; Q38-Q41 VanDerWaalsContact O-N 3.11Å; L39-Q41 PolarHBondContact O-N 3.34Å; Q41-P44 WeakPolarHBondContact O-CG 3.41Å |
| 42 | L | 97.3 | Very high | 97.4 | Very high | 91 Ų | 91 | 108 Ų | 108 | 48% | 0.476 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -79.6 | -39.5 | -177.4 | -73.2 | 174.5 | 0 | 0 | 0 | 113.2 | Q38 L39 K45 K46 | Q38-L42 WeakPolarHBondContact O-CG 3.38Å; Q38-L42 PolarHBondContact O-N 3Å; L39-L42 PolarHBondContact O-N 3.34Å; L39-L42 VanDerWaalsContact O-N 3.15Å; L42-K45 PolarHBondContact O-N 3.26Å; L42-K46 PolarHBondContact O-N 3.22Å |
| 43 | L | 97 | Very high | 97.4 | Very high | 118 Ų | 118 | 108.2 Ų | 108.2 | 62% | 0.618 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -53.3 | -50.2 | 179.1 | -77 | 172.7 | 0 | 0 | 0 | 113.8 | L39 K45 K46 R47 | L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.39Å; L39-L43 PolarHBondContact O-N 2.74Å; L43-K45 VanDerWaalsContact C-N 3.33Å; L43-K45 PolarHBondContact O-N 3.4Å; L43-K46 PolarHBondContact O-N 3.47Å; L43-R47 VanDerWaalsContact O-CB 3.3Å; L43-R47 WeakPolarHBondContact O-CB 3.48Å; L43-R47 PolarHBondContact O-N 2.95Å |
| 44 | P | 97 | Very high | 97.4 | Very high | 72 Ų | 72 | 106.3 Ų | 106.3 | 47% | 0.468 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.1 | -38.9 | 178.7 | 22.8 | -32.8 | 0 | 0 | 0 | 112 | K40 Q41 R47 E48 | K40-P44 WeakPolarHBondContact O-CD 3.43Å; K40-P44 WeakPolarHBondContact O-CG 3.35Å; Q41-P44 WeakPolarHBondContact O-CG 3.41Å; P44-R47 PolarHBondContact O-N 3.42Å; P44-E48 WeakPolarHBondContact O-CB 3.38Å; P44-E48 PolarHBondContact O-N 3.16Å |
| 45 | K | 96.6 | Very high | 97.4 | Very high | 135 Ų | 135 | 104.3 Ų | 104.3 | 59% | 0.587 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.9 | -43.2 | 177.2 | -66.4 | 179.7 | 179.5 | -180 | 0 | 112.2 | L42 L43 E48 A49 | L42-K45 PolarHBondContact O-N 3.26Å; L43-K45 VanDerWaalsContact C-N 3.33Å; L43-K45 PolarHBondContact O-N 3.4Å; K45-E48 PolarHBondContact O-N 3.48Å; K45-A49 WeakPolarHBondContact O-CB 3.39Å; K45-A49 PolarHBondContact O-N 3.01Å |
| 46 | K | 97.2 | Very high | 97.4 | Very high | 154 Ų | 154 | 105.5 Ų | 105.5 | 67% | 0.67 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -68.3 | -39.1 | 177.2 | -72.5 | -67 | -174.2 | 177.1 | 0 | 111.8 | L42 L43 A49 C50 | L42-K46 PolarHBondContact O-N 3.22Å; L43-K46 PolarHBondContact O-N 3.47Å; K46-A49 PolarHBondContact O-N 2.91Å; K46-C50 WeakPolarHBondContact O-CB 3.44Å; K46-C50 PolarHBondContact O-N 3.42Å |
| 47 | R | 97.7 | Very high | 97.4 | Very high | 175 Ų | 175 | 106.4 Ų | 106.4 | 66% | 0.66 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63 | -44.6 | 174.1 | -176.9 | 178.3 | 177.7 | 179 | 2.4 | 111.6 | L43 P44 C50 H51 | L43-R47 VanDerWaalsContact O-CB 3.3Å; L43-R47 WeakPolarHBondContact O-CB 3.48Å; L43-R47 PolarHBondContact O-N 2.95Å; P44-R47 PolarHBondContact O-N 3.42Å; R47-C50 PolarHBondContact O-N 2.95Å; R47-H51 PolarHBondContact NE-NE2 2.99Å; R47-H51 WeakPolarHBondContact O-CB 3.4Å; R47-H51 PolarHBondContact O-CD2 2.92Å; R47-H51 PolarHBondContact O-N 3.26Å |
| 48 | E | 97.5 | Very high | 97.4 | Very high | 133 Ų | 133 | 108.2 Ų | 108.2 | 62% | 0.621 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.4 | -48.3 | 176.5 | -175 | 175.5 | -168 | 0 | 0 | 111.3 | P44 K45 C50 H51 T52 | P44-E48 WeakPolarHBondContact O-CB 3.38Å; P44-E48 PolarHBondContact O-N 3.16Å; K45-E48 PolarHBondContact O-N 3.48Å; E48-C50 VanDerWaalsContact C-N 3.35Å; E48-C50 PolarHBondContact O-N 2.86Å; E48-H51 PolarHBondContact O-N 2.88Å; E48-H51 VanDerWaalsContact O-N 3.13Å; E48-T52 WeakPolarHBondContact O-CG2 3.47Å; E48-T52 PolarHBondContact O-N 3.23Å; E48-T52 PolarHBondContact O-OG1 2.89Å |
| 49 | A | 97 | Very high | 97.5 | Very high | 47 Ų | 47 | 111 Ų | 111 | 39% | 0.388 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -55.8 | -48.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | K45 K46 H51 T52 E53 | K45-A49 WeakPolarHBondContact O-CB 3.39Å; K45-A49 PolarHBondContact O-N 3.01Å; K46-A49 PolarHBondContact O-N 2.91Å; A49-H51 VanDerWaalsContact C-N 3.35Å; A49-H51 PolarHBondContact O-N 3.34Å; A49-T52 WeakPolarHBondContact CA-OG1 3.18Å; A49-T52 PolarHBondContact O-N 3.31Å; A49-T52 PolarHBondContact O-OG1 3.27Å; A49-E53 WeakPolarHBondContact O-CB 3.31Å; A49-E53 PolarHBondContact O-N 3.21Å |
| 50 | C | 97.7 | Very high | 97.5 | Very high | 79 Ų | 79 | 109.8 Ų | 109.8 | 53% | 0.534 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -59.8 | -42.3 | 176.5 | -177.7 | 0 | 0 | 0 | 0 | 112.3 | K46 R47 E48 E53 C54 | K46-C50 WeakPolarHBondContact O-CB 3.44Å; K46-C50 PolarHBondContact O-N 3.42Å; R47-C50 PolarHBondContact O-N 2.95Å; E48-C50 VanDerWaalsContact C-N 3.35Å; E48-C50 PolarHBondContact O-N 2.86Å; C50-E53 PolarHBondContact O-N 3.4Å; C50-C54 VanDerWaalsContact O-CB 3.22Å; C50-C54 WeakPolarHBondContact O-CB 3.45Å; C50-C54 PolarHBondContact O-N 2.87Å |
| 51 | H | 97.9 | Very high | 97.5 | Very high | 96 Ų | 96 | 105.5 Ų | 105.5 | 44% | 0.444 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.6 | -40.8 | 175.9 | -82.2 | -56.1 | 0 | 0 | 0 | 112.2 | R47 E48 A49 N55 | R47-H51 PolarHBondContact NE-NE2 2.99Å; R47-H51 WeakPolarHBondContact O-CB 3.4Å; R47-H51 PolarHBondContact O-CD2 2.92Å; R47-H51 PolarHBondContact O-N 3.26Å; E48-H51 PolarHBondContact O-N 2.88Å; E48-H51 VanDerWaalsContact O-N 3.13Å; A49-H51 VanDerWaalsContact C-N 3.35Å; A49-H51 PolarHBondContact O-N 3.34Å; H51-N55 VanDerWaalsContact O-CB 3.27Å; H51-N55 WeakPolarHBondContact O-CB 3.28Å; H51-N55 VanDerWaalsContact O-CG 3.28Å; H51-N55 PolarHBondContact O-N 3.41Å; H51-N55 PolarHBondContact O-ND2 3.32Å |
| 52 | T | 97.9 | Very high | 97.6 | Very high | 86 Ų | 86 | 103.9 Ų | 103.9 | 53% | 0.528 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.9 | -41.7 | 177.7 | 57.3 | 0 | 0 | 0 | 0 | 112.1 | E48 A49 K56 | E48-T52 WeakPolarHBondContact O-CG2 3.47Å; E48-T52 PolarHBondContact O-N 3.23Å; E48-T52 PolarHBondContact O-OG1 2.89Å; A49-T52 WeakPolarHBondContact CA-OG1 3.18Å; A49-T52 PolarHBondContact O-N 3.31Å; A49-T52 PolarHBondContact O-OG1 3.27Å; T52-K56 WeakPolarHBondContact O-CB 3.46Å; T52-K56 PolarHBondContact O-N 3.42Å |
| 53 | E | 97.9 | Very high | 97.7 | Very high | 117 Ų | 117 | 103 Ų | 103 | 55% | 0.547 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.3 | -45.1 | 178.1 | -173.2 | 168.7 | -155.3 | 0 | 0 | 111.7 | A49 C50 N55 K56 H57 | A49-E53 WeakPolarHBondContact O-CB 3.31Å; A49-E53 PolarHBondContact O-N 3.21Å; C50-E53 PolarHBondContact O-N 3.4Å; E53-N55 PolarHBondContact O-N 3.18Å; E53-K56 WeakPolarHBondContact O-CB 3.48Å; E53-K56 PolarHBondContact O-N 2.95Å; E53-K56 VanDerWaalsContact O-N 3.17Å; E53-H57 PolarHBondContact O-CD2 3.09Å; E53-H57 VanDerWaalsContact O-CD2 3.27Å; E53-H57 PolarHBondContact O-N 3.32Å |
| 54 | C | 97.6 | Very high | 97.7 | Very high | 77 Ų | 77 | 106.2 Ų | 106.2 | 52% | 0.52 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 174.8 | -176.7 | 0 | 0 | 0 | 0 | 111.7 | C50 K56 H57 H58 | C50-C54 VanDerWaalsContact O-CB 3.22Å; C50-C54 WeakPolarHBondContact O-CB 3.45Å; C50-C54 PolarHBondContact O-N 2.87Å; C54-K56 VanDerWaalsContact C-N 3.29Å; C54-K56 PolarHBondContact O-N 3.05Å; C54-H57 PolarHBondContact O-N 3Å; C54-H58 VanDerWaalsContact O-CB 3.28Å; C54-H58 WeakPolarHBondContact O-CB 3.28Å; C54-H58 PolarHBondContact O-N 3.2Å |
| 55 | N | 98 | Very high | 97.8 | Very high | 94 Ų | 94 | 109.6 Ų | 109.6 | 50% | 0.503 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.7 | -36.1 | 176 | -80.5 | -22.2 | 0 | 0 | 0 | 112.6 | H51 E53 K59 | H51-N55 VanDerWaalsContact O-CB 3.27Å; H51-N55 WeakPolarHBondContact O-CB 3.28Å; H51-N55 VanDerWaalsContact O-CG 3.28Å; H51-N55 PolarHBondContact O-N 3.41Å; H51-N55 PolarHBondContact O-ND2 3.32Å; E53-N55 PolarHBondContact O-N 3.18Å; N55-K59 WeakPolarHBondContact O-CB 3.4Å; N55-K59 VanDerWaalsContact O-CG 3.28Å; N55-K59 WeakPolarHBondContact O-CG 3.27Å; N55-K59 PolarHBondContact O-N 2.95Å |
| 56 | K | 98.1 | Very high | 97.9 | Very high | 123 Ų | 123 | 105.4 Ų | 105.4 | 54% | 0.535 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.7 | -53.8 | 174.9 | -178.2 | -172.4 | 173 | -168.4 | 0 | 110.5 | T52 E53 C54 H58 K59 E60 | T52-K56 WeakPolarHBondContact O-CB 3.46Å; T52-K56 PolarHBondContact O-N 3.42Å; E53-K56 WeakPolarHBondContact O-CB 3.48Å; E53-K56 PolarHBondContact O-N 2.95Å; E53-K56 VanDerWaalsContact O-N 3.17Å; C54-K56 VanDerWaalsContact C-N 3.29Å; C54-K56 PolarHBondContact O-N 3.05Å; K56-H58 VanDerWaalsContact C-N 3.31Å; K56-H58 PolarHBondContact O-N 2.87Å; K56-K59 PolarHBondContact O-N 2.85Å; K56-E60 WeakPolarHBondContact CE-OE1 3.41Å; K56-E60 WeakPolarHBondContact O-CG 3.37Å; K56-E60 PolarHBondContact O-N 3.19Å |
| 57 | H | 97.8 | Very high | 97.9 | Very high | 98 Ų | 98 | 100.9 Ų | 100.9 | 45% | 0.454 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -37.3 | 179.3 | -71.1 | -50.8 | 0 | 0 | 0 | 112.7 | E53 C54 E60 A61 | E53-H57 PolarHBondContact O-CD2 3.09Å; E53-H57 VanDerWaalsContact O-CD2 3.27Å; E53-H57 PolarHBondContact O-N 3.32Å; C54-H57 PolarHBondContact O-N 3Å; H57-E60 IonicContact ND1-OE2 3.46Å; H57-E60 PolarHBondContact ND1-OE2 3.34Å; H57-E60 PolarHBondContact O-N 2.98Å; H57-A61 WeakPolarHBondContact O-CB 3.45Å; H57-A61 PolarHBondContact O-N 3.22Å |
| 58 | H | 98.2 | Very high | 97.9 | Very high | 111 Ų | 111 | 94.8 Ų | 94.8 | 51% | 0.514 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 176 | -167.7 | 68.6 | 0 | 0 | 0 | 111.8 | C54 K56 A61 L62 | C54-H58 VanDerWaalsContact O-CB 3.28Å; C54-H58 WeakPolarHBondContact O-CB 3.28Å; C54-H58 PolarHBondContact O-N 3.2Å; K56-H58 VanDerWaalsContact C-N 3.31Å; K56-H58 PolarHBondContact O-N 2.87Å; H58-A61 PolarHBondContact O-N 3.36Å; H58-L62 WeakPolarHBondContact O-CB 3.34Å; H58-L62 VanDerWaalsContact O-CG 3.31Å; H58-L62 WeakPolarHBondContact O-CG 3.18Å; H58-L62 PolarHBondContact O-N 2.96Å |
| 59 | K | 98.3 | Very high | 97.9 | Very high | 154 Ų | 154 | 91.2 Ų | 91.2 | 67% | 0.67 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.4 | -41.4 | 174.5 | -75.5 | 176.4 | 179.7 | -176.9 | 0 | 112.3 | N55 K56 L62 S63 | N55-K59 WeakPolarHBondContact O-CB 3.4Å; N55-K59 VanDerWaalsContact O-CG 3.28Å; N55-K59 WeakPolarHBondContact O-CG 3.27Å; N55-K59 PolarHBondContact O-N 2.95Å; K56-K59 PolarHBondContact O-N 2.85Å; K59-L62 PolarHBondContact O-N 3.43Å; K59-S63 WeakPolarHBondContact O-CB 3.39Å; K59-S63 PolarHBondContact O-N 2.94Å |
| 60 | E | 97.9 | Very high | 98 | Very high | 75 Ų | 75 | 94.5 Ų | 94.5 | 35% | 0.35 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63 | -44.3 | 175.8 | -72.2 | 171.3 | -177.8 | 0 | 0 | 111.5 | K56 H57 S63 R64 | K56-E60 WeakPolarHBondContact CE-OE1 3.41Å; K56-E60 WeakPolarHBondContact O-CG 3.37Å; K56-E60 PolarHBondContact O-N 3.19Å; H57-E60 IonicContact ND1-OE2 3.46Å; H57-E60 PolarHBondContact ND1-OE2 3.34Å; H57-E60 PolarHBondContact O-N 2.98Å; E60-S63 PolarHBondContact O-N 2.86Å; E60-R64 WeakPolarHBondContact O-CG 3.3Å; E60-R64 PolarHBondContact O-N 3.02Å |
| 61 | A | 97.7 | Very high | 98 | Very high | 54 Ų | 54 | 97.3 Ų | 97.3 | 45% | 0.446 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -45.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | H57 H58 S63 R64 F65 | H57-A61 WeakPolarHBondContact O-CB 3.45Å; H57-A61 PolarHBondContact O-N 3.22Å; H58-A61 PolarHBondContact O-N 3.36Å; A61-S63 VanDerWaalsContact C-N 3.31Å; A61-S63 PolarHBondContact O-N 3.28Å; A61-R64 PolarHBondContact O-N 3.46Å; A61-F65 WeakPolarHBondContact O-CB 3.22Å; A61-F65 PolarHBondContact O-N 3.04Å |
| 62 | L | 98.4 | Very high | 98 | Very high | 93 Ų | 93 | 99.5 Ų | 99.5 | 49% | 0.487 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.4 | -40.1 | 174.9 | -73.3 | 175.3 | 0 | 0 | 0 | 111.9 | H58 K59 F65 A66 | H58-L62 WeakPolarHBondContact O-CB 3.34Å; H58-L62 VanDerWaalsContact O-CG 3.31Å; H58-L62 WeakPolarHBondContact O-CG 3.18Å; H58-L62 PolarHBondContact O-N 2.96Å; K59-L62 PolarHBondContact O-N 3.43Å; L62-F65 PolarHBondContact O-N 3.27Å; L62-A66 WeakPolarHBondContact O-CB 3.42Å; L62-A66 PolarHBondContact O-N 3.25Å |
| 63 | S | 98.2 | Very high | 98 | Very high | 72 Ų | 72 | 100.3 Ų | 100.3 | 50% | 0.503 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.7 | -45.2 | 176.3 | -171.5 | 0 | 0 | 0 | 0 | 111.6 | K59 E60 A61 F65 A66 S67 | K59-S63 WeakPolarHBondContact O-CB 3.39Å; K59-S63 PolarHBondContact O-N 2.94Å; E60-S63 PolarHBondContact O-N 2.86Å; A61-S63 VanDerWaalsContact C-N 3.31Å; A61-S63 PolarHBondContact O-N 3.28Å; S63-F65 VanDerWaalsContact C-N 3.34Å; S63-A66 PolarHBondContact O-N 3.41Å; S63-S67 PolarHBondContact O-N 2.96Å; S63-S67 PolarHBondContact O-OG 2.9Å |
| 64 | R | 97.8 | Very high | 97.9 | Very high | 186 Ų | 186 | 103.8 Ų | 103.8 | 70% | 0.702 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.4 | -43.1 | 176.7 | -71.7 | 177.5 | -174.1 | 176.8 | 3 | 111.5 | E60 A61 S67 S68 | E60-R64 WeakPolarHBondContact O-CG 3.3Å; E60-R64 PolarHBondContact O-N 3.02Å; A61-R64 PolarHBondContact O-N 3.46Å; R64-S67 PolarHBondContact O-N 3.03Å; R64-S68 PolarHBondContact O-N 3.23Å |
| 65 | F | 98.3 | Very high | 97.9 | Very high | 142 Ų | 142 | 102.7 Ų | 102.7 | 62% | 0.623 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61 | -48.5 | 176.2 | 178.5 | -102.5 | 0 | 0 | 0 | 111.5 | A61 L62 S63 S67 S68 V69 | A61-F65 WeakPolarHBondContact O-CB 3.22Å; A61-F65 PolarHBondContact O-N 3.04Å; L62-F65 PolarHBondContact O-N 3.27Å; S63-F65 VanDerWaalsContact C-N 3.34Å; F65-S67 VanDerWaalsContact C-N 3.35Å; F65-S67 PolarHBondContact O-N 3.36Å; F65-S68 WeakPolarHBondContact O-CB 3.29Å; F65-S68 PolarHBondContact O-N 3.47Å; F65-V69 HydrophobicContact CD1-CG2 4.38Å; F65-V69 HydrophobicContact CE1-CG2 3.94Å; F65-V69 HydrophobicContact CE2-CG2 4.23Å; F65-V69 HydrophobicContact CZ-CG2 3.86Å; F65-V69 WeakPolarHBondContact O-CG2 3.5Å; F65-V69 PolarHBondContact O-N 2.95Å |
| 66 | A | 98.1 | Very high | 97.8 | Very high | 48 Ų | 48 | 102.8 Ų | 102.8 | 40% | 0.397 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.5 | -42.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L62 S63 S68 V69 L70 | L62-A66 WeakPolarHBondContact O-CB 3.42Å; L62-A66 PolarHBondContact O-N 3.25Å; S63-A66 PolarHBondContact O-N 3.41Å; A66-S68 PolarHBondContact O-N 2.94Å; A66-V69 PolarHBondContact O-N 2.91Å; A66-L70 WeakPolarHBondContact O-CG 3.37Å; A66-L70 PolarHBondContact O-N 3.05Å |
| 67 | S | 98.1 | Very high | 97.7 | Very high | 58 Ų | 58 | 100.1 Ų | 100.1 | 41% | 0.406 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60 | -44.5 | 174.1 | -66.7 | 0 | 0 | 0 | 0 | 112.1 | S63 R64 F65 V69 L70 E71 | S63-S67 PolarHBondContact O-N 2.96Å; S63-S67 PolarHBondContact O-OG 2.9Å; R64-S67 PolarHBondContact O-N 3.03Å; F65-S67 VanDerWaalsContact C-N 3.35Å; F65-S67 PolarHBondContact O-N 3.36Å; S67-V69 VanDerWaalsContact C-N 3.35Å; S67-V69 PolarHBondContact O-N 3.26Å; S67-L70 PolarHBondContact O-N 3.41Å; S67-E71 WeakPolarHBondContact O-CG 3.3Å; S67-E71 PolarHBondContact O-N 3.14Å |
| 68 | S | 98.1 | Very high | 97.7 | Very high | 47 Ų | 47 | 103.2 Ų | 103.2 | 33% | 0.329 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.7 | -41.7 | 177 | -176.9 | 0 | 0 | 0 | 0 | 112.3 | R64 F65 A66 E71 K72 | R64-S68 PolarHBondContact O-N 3.23Å; F65-S68 WeakPolarHBondContact O-CB 3.29Å; F65-S68 PolarHBondContact O-N 3.47Å; A66-S68 PolarHBondContact O-N 2.94Å; S68-E71 PolarHBondContact O-N 3.45Å; S68-K72 WeakPolarHBondContact O-CG 3.37Å; S68-K72 PolarHBondContact O-N 2.9Å |
| 69 | V | 98 | Very high | 97.6 | Very high | 58 Ų | 58 | 101.8 Ų | 101.8 | 35% | 0.352 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 175.3 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | F65 A66 S67 E71 K72 L73 | F65-V69 HydrophobicContact CD1-CG2 4.38Å; F65-V69 HydrophobicContact CE1-CG2 3.94Å; F65-V69 HydrophobicContact CE2-CG2 4.23Å; F65-V69 HydrophobicContact CZ-CG2 3.86Å; F65-V69 WeakPolarHBondContact O-CG2 3.5Å; F65-V69 PolarHBondContact O-N 2.95Å; A66-V69 PolarHBondContact O-N 2.91Å; S67-V69 VanDerWaalsContact C-N 3.35Å; S67-V69 PolarHBondContact O-N 3.26Å; V69-E71 PolarHBondContact O-N 3.18Å; V69-K72 PolarHBondContact O-N 3.39Å; V69-L73 HydrophobicContact CG1-CD1 4.05Å; V69-L73 HydrophobicContact CG1-CG 4.41Å; V69-L73 WeakPolarHBondContact O-CG 3.05Å; V69-L73 PolarHBondContact O-N 2.96Å |
| 70 | L | 98.2 | Very high | 97.5 | Very high | 116 Ų | 116 | 100.3 Ų | 100.3 | 61% | 0.607 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.5 | -39.1 | 178 | -72.5 | 172.7 | 0 | 0 | 0 | 112.5 | A66 S67 L73 R74 | A66-L70 WeakPolarHBondContact O-CG 3.37Å; A66-L70 PolarHBondContact O-N 3.05Å; S67-L70 PolarHBondContact O-N 3.41Å; L70-L73 PolarHBondContact O-N 2.95Å; L70-R74 WeakPolarHBondContact O-CB 3.38Å; L70-R74 PolarHBondContact O-N 3.5Å |
| 71 | E | 97.5 | Very high | 97.5 | Very high | 138 Ų | 138 | 100.3 Ų | 100.3 | 65% | 0.645 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.2 | -43.3 | 174.3 | -76.1 | 178.1 | 169.3 | 0 | 0 | 111.8 | S67 S68 V69 R74 A75 | S67-E71 WeakPolarHBondContact O-CG 3.3Å; S67-E71 PolarHBondContact O-N 3.14Å; S68-E71 PolarHBondContact O-N 3.45Å; V69-E71 PolarHBondContact O-N 3.18Å; E71-R74 WeakPolarHBondContact O-CB 3.48Å; E71-R74 PolarHBondContact O-N 3.42Å; E71-A75 PolarHBondContact O-N 3.43Å |
| 72 | K | 97.9 | Very high | 97.4 | Very high | 142 Ų | 142 | 101.9 Ų | 101.9 | 62% | 0.617 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.7 | -43.6 | 175.9 | -72.3 | 178.8 | 179.9 | -175.7 | 0 | 112.1 | S68 V69 R74 A75 V76 | S68-K72 WeakPolarHBondContact O-CG 3.37Å; S68-K72 PolarHBondContact O-N 2.9Å; V69-K72 PolarHBondContact O-N 3.39Å; K72-R74 VanDerWaalsContact C-N 3.28Å; K72-R74 PolarHBondContact O-N 3.32Å; K72-A75 WeakPolarHBondContact O-CB 3.5Å; K72-A75 PolarHBondContact O-N 2.94Å; K72-V76 WeakPolarHBondContact O-CG2 3.39Å; K72-V76 PolarHBondContact O-N 2.88Å |
| 73 | L | 97.5 | Very high | 97.3 | Very high | 104 Ų | 104 | 101.1 Ų | 101.1 | 55% | 0.545 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62 | -37.7 | 175.2 | -72.2 | 173.4 | 0 | 0 | 0 | 111.8 | V69 L70 V76 S77 | V69-L73 HydrophobicContact CG1-CD1 4.05Å; V69-L73 HydrophobicContact CG1-CG 4.41Å; V69-L73 WeakPolarHBondContact O-CG 3.05Å; V69-L73 PolarHBondContact O-N 2.96Å; L70-L73 PolarHBondContact O-N 2.95Å; L73-V76 PolarHBondContact O-N 3.46Å; L73-S77 PolarHBondContact O-N 3.3Å |
| 74 | R | 97.4 | Very high | 97.2 | Very high | 189 Ų | 189 | 101 Ų | 101 | 71% | 0.713 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.7 | -40.7 | 174.7 | -165.6 | -179.6 | -156.6 | 162.2 | 6.5 | 112.1 | L70 E71 K72 S77 Y78 | L70-R74 WeakPolarHBondContact O-CB 3.38Å; L70-R74 PolarHBondContact O-N 3.5Å; E71-R74 WeakPolarHBondContact O-CB 3.48Å; E71-R74 PolarHBondContact O-N 3.42Å; K72-R74 VanDerWaalsContact C-N 3.28Å; K72-R74 PolarHBondContact O-N 3.32Å; R74-S77 PolarHBondContact O-N 3.45Å; R74-Y78 WeakPolarHBondContact O-CB 3.4Å; R74-Y78 PolarHBondContact O-N 2.92Å |
| 75 | A | 95.7 | Very high | 97.2 | Very high | 55 Ų | 55 | 98.3 Ų | 98.3 | 46% | 0.455 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | E71 K72 Y78 V79 | E71-A75 PolarHBondContact O-N 3.43Å; K72-A75 WeakPolarHBondContact O-CB 3.5Å; K72-A75 PolarHBondContact O-N 2.94Å; A75-Y78 PolarHBondContact O-N 3.38Å; A75-V79 WeakPolarHBondContact O-CG2 3.38Å; A75-V79 PolarHBondContact O-N 3.2Å |
| 76 | V | 96.4 | Very high | 97.1 | Very high | 95 Ų | 95 | 94.3 Ų | 94.3 | 58% | 0.576 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.4 | -47.9 | 175.1 | 172.2 | 0 | 0 | 0 | 0 | 111 | K72 L73 Y78 V79 E80 | K72-V76 WeakPolarHBondContact O-CG2 3.39Å; K72-V76 PolarHBondContact O-N 2.88Å; L73-V76 PolarHBondContact O-N 3.46Å; V76-Y78 VanDerWaalsContact C-N 3.29Å; V76-Y78 PolarHBondContact O-N 3.44Å; V76-V79 PolarHBondContact O-N 3.04Å; V76-E80 WeakPolarHBondContact O-CB 3.4Å; V76-E80 PolarHBondContact O-N 3.38Å |
| 77 | S | 97.2 | Very high | 96.9 | Very high | 68 Ų | 68 | 96.6 Ų | 96.6 | 48% | 0.476 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.5 | -35.2 | 178.1 | 178.2 | 0 | 0 | 0 | 0 | 112.7 | L73 R74 S81 | L73-S77 PolarHBondContact O-N 3.3Å; R74-S77 PolarHBondContact O-N 3.45Å; S77-S81 PolarHBondContact O-N 3.26Å |
| 78 | Y | 97.4 | Very high | 96.8 | Very high | 162 Ų | 162 | 98 Ų | 98 | 64% | 0.635 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65 | -46.1 | 173.6 | 175.2 | -101 | 0 | 0 | 0 | 112 | R74 A75 V76 E80 S81 L82 | R74-Y78 WeakPolarHBondContact O-CB 3.4Å; R74-Y78 PolarHBondContact O-N 2.92Å; A75-Y78 PolarHBondContact O-N 3.38Å; V76-Y78 VanDerWaalsContact C-N 3.29Å; V76-Y78 PolarHBondContact O-N 3.44Å; Y78-E80 VanDerWaalsContact C-N 3.35Å; Y78-S81 PolarHBondContact O-N 3.31Å; Y78-L82 PolarHBondContact O-N 2.99Å |
| 79 | V | 96.3 | Very high | 96.6 | Very high | 81 Ų | 81 | 98 Ų | 98 | 49% | 0.491 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 176.8 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | A75 V76 S81 L82 V83 | A75-V79 WeakPolarHBondContact O-CG2 3.38Å; A75-V79 PolarHBondContact O-N 3.2Å; V76-V79 PolarHBondContact O-N 3.04Å; V79-S81 PolarHBondContact O-N 2.87Å; V79-L82 PolarHBondContact O-N 2.9Å; V79-V83 HydrophobicContact CG1-CG2 4.3Å; V79-V83 WeakPolarHBondContact O-CG2 3.38Å; V79-V83 PolarHBondContact O-N 3.37Å |
| 80 | E | 96.2 | Very high | 96.4 | Very high | 123 Ų | 123 | 100.9 Ų | 100.9 | 58% | 0.575 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -55.6 | -50.9 | 174.6 | -178.1 | -176.9 | -174 | 0 | 0 | 110.8 | V76 Y78 L82 V83 T84 | V76-E80 WeakPolarHBondContact O-CB 3.4Å; V76-E80 PolarHBondContact O-N 3.38Å; Y78-E80 VanDerWaalsContact C-N 3.35Å; E80-L82 VanDerWaalsContact C-N 3.29Å; E80-L82 PolarHBondContact O-N 3.47Å; E80-V83 PolarHBondContact O-N 3.27Å; E80-T84 PolarHBondContact O-N 2.97Å; E80-T84 PolarHBondContact O-OG1 3.38Å; E80-T84 VanDerWaalsContact O-OG1 3.05Å |
| 81 | S | 96.8 | Very high | 96.1 | Very high | 76 Ų | 76 | 98.9 Ų | 98.9 | 53% | 0.531 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.2 | -39.3 | 177.2 | -176.3 | 0 | 0 | 0 | 0 | 112.7 | S77 Y78 V79 H85 | S77-S81 PolarHBondContact O-N 3.26Å; Y78-S81 PolarHBondContact O-N 3.31Å; V79-S81 PolarHBondContact O-N 2.87Å; S81-H85 VanDerWaalsContact O-CB 3.32Å; S81-H85 WeakPolarHBondContact O-CB 3.32Å; S81-H85 PolarHBondContact O-N 2.9Å |
| 82 | L | 97.1 | Very high | 95.9 | Very high | 87 Ų | 87 | 96.6 Ų | 96.6 | 46% | 0.455 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.3 | -42.8 | 178.8 | -173.8 | 69.8 | 0 | 0 | 0 | 111.3 | Y78 V79 E80 H85 S86 | Y78-L82 PolarHBondContact O-N 2.99Å; V79-L82 PolarHBondContact O-N 2.9Å; E80-L82 VanDerWaalsContact C-N 3.29Å; E80-L82 PolarHBondContact O-N 3.47Å; L82-H85 PolarHBondContact O-N 2.92Å; L82-S86 WeakPolarHBondContact O-CB 3.04Å; L82-S86 PolarHBondContact O-N 3.45Å; L82-S86 PolarHBondContact O-OG 3.33Å |
| 83 | V | 95.9 | Very high | 95.5 | Very high | 77 Ų | 77 | 92 Ų | 92 | 47% | 0.467 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.9 | -46.6 | 177.1 | 170.7 | 0 | 0 | 0 | 0 | 110.3 | V79 E80 H85 S86 L87 | V79-V83 HydrophobicContact CG1-CG2 4.3Å; V79-V83 WeakPolarHBondContact O-CG2 3.38Å; V79-V83 PolarHBondContact O-N 3.37Å; E80-V83 PolarHBondContact O-N 3.27Å; V83-H85 VanDerWaalsContact C-N 3.33Å; V83-H85 PolarHBondContact O-N 3.17Å; V83-S86 PolarHBondContact O-N 3.48Å; V83-L87 HydrophobicContact CG1-CD1 3.9Å; V83-L87 HydrophobicContact CG1-CG 4.33Å; V83-L87 WeakPolarHBondContact O-CB 3.2Å; V83-L87 WeakPolarHBondContact O-CG 3.3Å; V83-L87 PolarHBondContact O-N 2.92Å |
| 84 | T | 96.3 | Very high | 95 | Very high | 68 Ų | 68 | 94.4 Ų | 94.4 | 42% | 0.417 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59 | -44.4 | 175.5 | -56.7 | 0 | 0 | 0 | 0 | 111.5 | E80 S86 L87 N88 | E80-T84 PolarHBondContact O-N 2.97Å; E80-T84 PolarHBondContact O-OG1 3.38Å; E80-T84 VanDerWaalsContact O-OG1 3.05Å; T84-S86 VanDerWaalsContact C-N 3.34Å; T84-S86 PolarHBondContact O-N 2.96Å; T84-L87 PolarHBondContact O-N 3.36Å; T84-N88 WeakPolarHBondContact O-CB 3.47Å; T84-N88 VanDerWaalsContact O-CG 3.24Å; T84-N88 PolarHBondContact O-N 3.44Å |
| 85 | H | 96.1 | Very high | 94.5 | Very high | 131 Ų | 131 | 92 Ų | 92 | 61% | 0.606 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.1 | -41.8 | 177.6 | -172.7 | 60.4 | 0 | 0 | 0 | 112.1 | S81 L82 V83 N88 A89 | S81-H85 VanDerWaalsContact O-CB 3.32Å; S81-H85 WeakPolarHBondContact O-CB 3.32Å; S81-H85 PolarHBondContact O-N 2.9Å; L82-H85 PolarHBondContact O-N 2.92Å; V83-H85 VanDerWaalsContact C-N 3.33Å; V83-H85 PolarHBondContact O-N 3.17Å; H85-N88 PolarHBondContact O-N 2.97Å; H85-A89 WeakPolarHBondContact O-CB 3.49Å; H85-A89 PolarHBondContact O-N 3.39Å |
| 86 | S | 96 | Very high | 94.1 | Very high | 57 Ų | 57 | 96.3 Ų | 96.3 | 40% | 0.399 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.6 | -40.6 | 178.7 | -54.4 | 0 | 0 | 0 | 0 | 112 | L82 V83 T84 A89 L90 | L82-S86 WeakPolarHBondContact O-CB 3.04Å; L82-S86 PolarHBondContact O-N 3.45Å; L82-S86 PolarHBondContact O-OG 3.33Å; V83-S86 PolarHBondContact O-N 3.48Å; T84-S86 VanDerWaalsContact C-N 3.34Å; T84-S86 PolarHBondContact O-N 2.96Å; S86-A89 PolarHBondContact O-N 2.7Å; S86-L90 WeakPolarHBondContact O-CG 3.42Å; S86-L90 PolarHBondContact O-N 2.84Å |
| 87 | L | 95 | Very high | 93.4 | Very high | 97 Ų | 97 | 95.7 Ų | 95.7 | 51% | 0.508 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.7 | -42.8 | 176 | -73 | 173.5 | 0 | 0 | 0 | 111.6 | V83 T84 A89 L90 C91 | V83-L87 HydrophobicContact CG1-CD1 3.9Å; V83-L87 HydrophobicContact CG1-CG 4.33Å; V83-L87 WeakPolarHBondContact O-CB 3.2Å; V83-L87 WeakPolarHBondContact O-CG 3.3Å; V83-L87 PolarHBondContact O-N 2.92Å; T84-L87 PolarHBondContact O-N 3.36Å; L87-A89 VanDerWaalsContact C-N 3.34Å; L87-A89 PolarHBondContact O-N 3.18Å; L87-L90 PolarHBondContact O-N 3.4Å; L87-C91 PolarHBondContact O-N 2.92Å; L87-C91 PolarHBondContact O-SG 2.96Å |
| 88 | N | 96.1 | Very high | 92.5 | Very high | 87 Ų | 87 | 94.9 Ų | 94.9 | 47% | 0.465 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 175 | -70.1 | -9.3 | 0 | 0 | 0 | 111.1 | T84 H85 L90 C91 D92 | T84-N88 WeakPolarHBondContact O-CB 3.47Å; T84-N88 VanDerWaalsContact O-CG 3.24Å; T84-N88 PolarHBondContact O-N 3.44Å; H85-N88 PolarHBondContact O-N 2.97Å; N88-L90 VanDerWaalsContact C-N 3.28Å; N88-L90 PolarHBondContact O-N 3.48Å; N88-C91 WeakPolarHBondContact O-CB 3.4Å; N88-C91 PolarHBondContact O-N 3.13Å; N88-C91 VanDerWaalsContact O-N 3.16Å; N88-D92 PolarHBondContact O-N 3.48Å |
| 89 | A | 94.3 | Very high | 91.6 | Very high | 48 Ų | 48 | 88.7 Ų | 88.7 | 40% | 0.397 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61 | -36.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | H85 S86 L87 A93 | H85-A89 WeakPolarHBondContact O-CB 3.49Å; H85-A89 PolarHBondContact O-N 3.39Å; S86-A89 PolarHBondContact O-N 2.7Å; L87-A89 VanDerWaalsContact C-N 3.34Å; L87-A89 PolarHBondContact O-N 3.18Å; A89-A93 WeakPolarHBondContact O-CB 3.5Å; A89-A93 PolarHBondContact O-N 2.96Å |
| 90 | L | 92.8 | Very high | 90.8 | Very high | 118 Ų | 118 | 88 Ų | 88 | 62% | 0.618 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -68.4 | -41.6 | 173.9 | -74.9 | 169.9 | 0 | 0 | 0 | 112.2 | S86 L87 N88 A93 Y94 | S86-L90 WeakPolarHBondContact O-CG 3.42Å; S86-L90 PolarHBondContact O-N 2.84Å; L87-L90 PolarHBondContact O-N 3.4Å; N88-L90 VanDerWaalsContact C-N 3.28Å; N88-L90 PolarHBondContact O-N 3.48Å; L90-A93 PolarHBondContact O-N 2.86Å; L90-Y94 WeakPolarHBondContact O-CB 3.49Å; L90-Y94 PolarHBondContact O-N 2.85Å |
| 91 | C | 93.3 | Very high | 89.8 | Confident | 74 Ų | 74 | 86.4 Ų | 86.4 | 50% | 0.5 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 174.7 | -69.1 | 0 | 0 | 0 | 0 | 111.2 | L87 N88 A93 Y94 E95 | L87-C91 PolarHBondContact O-N 2.92Å; L87-C91 PolarHBondContact O-SG 2.96Å; N88-C91 WeakPolarHBondContact O-CB 3.4Å; N88-C91 PolarHBondContact O-N 3.13Å; N88-C91 VanDerWaalsContact O-N 3.16Å; C91-A93 VanDerWaalsContact C-N 3.32Å; C91-A93 PolarHBondContact O-N 3.37Å; C91-Y94 WeakPolarHBondContact O-CB 3.43Å; C91-Y94 PolarHBondContact O-N 3.41Å; C91-Y94 VanDerWaalsContact O-N 3.13Å; C91-E95 PolarHBondContact O-N 3.33Å |
| 92 | D | 92.2 | Very high | 88.9 | Confident | 89 Ų | 89 | 88.3 Ų | 88.3 | 48% | 0.476 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 177.8 | -65.2 | -16.5 | 0 | 0 | 0 | 111.2 | N88 E95 Q96 | N88-D92 PolarHBondContact O-N 3.48Å; D92-E95 PolarHBondContact O-N 2.92Å; D92-Q96 WeakPolarHBondContact O-CG 3.47Å; D92-Q96 PolarHBondContact O-N 3.41Å |
| 93 | A | 90.1 | Very high | 88 | Confident | 47 Ų | 47 | 90.9 Ų | 90.9 | 39% | 0.388 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.8 | -38.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A89 L90 C91 Q96 V97 | A89-A93 WeakPolarHBondContact O-CB 3.5Å; A89-A93 PolarHBondContact O-N 2.96Å; L90-A93 PolarHBondContact O-N 2.86Å; C91-A93 VanDerWaalsContact C-N 3.32Å; C91-A93 PolarHBondContact O-N 3.37Å; A93-Q96 PolarHBondContact O-N 2.87Å; A93-V97 WeakPolarHBondContact O-CG2 3.5Å; A93-V97 PolarHBondContact O-N 3.2Å |
| 94 | Y | 86.9 | Confident | 87.1 | Confident | 154 Ų | 154 | 91.9 Ų | 91.9 | 60% | 0.604 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.2 | -41.6 | 176.1 | -174.2 | -102.9 | 0 | 0 | 0 | 112 | L90 C91 Q96 V97 N98 | L90-Y94 WeakPolarHBondContact O-CB 3.49Å; L90-Y94 PolarHBondContact O-N 2.85Å; C91-Y94 WeakPolarHBondContact O-CB 3.43Å; C91-Y94 PolarHBondContact O-N 3.41Å; C91-Y94 VanDerWaalsContact O-N 3.13Å; Y94-Q96 VanDerWaalsContact C-N 3.3Å; Y94-Q96 PolarHBondContact O-N 3.19Å; Y94-V97 PolarHBondContact O-N 3.36Å; Y94-V97 VanDerWaalsContact O-N 3.15Å; Y94-N98 WeakPolarHBondContact CE1-ND2 3.44Å; Y94-N98 PolarHBondContact O-N 2.87Å |
| 95 | E | 87.2 | Confident | 86.3 | Confident | 139 Ų | 139 | 91.7 Ų | 91.7 | 65% | 0.65 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.2 | -38.9 | 173.7 | -73.4 | -171.7 | 172.3 | 0 | 0 | 112 | C91 D92 V97 N98 G99 | C91-E95 PolarHBondContact O-N 3.33Å; D92-E95 PolarHBondContact O-N 2.92Å; E95-V97 VanDerWaalsContact C-N 3.28Å; E95-V97 PolarHBondContact O-N 2.84Å; E95-N98 PolarHBondContact O-N 2.9Å; E95-G99 PolarHBondContact O-N 3.2Å |
| 96 | Q | 85.9 | Confident | 85.6 | Confident | 144 Ų | 144 | 88.6 Ų | 88.6 | 67% | 0.673 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.5 | -28.3 | 175.2 | -74.2 | 175.7 | 37.9 | 0 | 0 | 113.5 | D92 A93 Y94 P100 | D92-Q96 WeakPolarHBondContact O-CG 3.47Å; D92-Q96 PolarHBondContact O-N 3.41Å; A93-Q96 PolarHBondContact O-N 2.87Å; Y94-Q96 VanDerWaalsContact C-N 3.3Å; Y94-Q96 PolarHBondContact O-N 3.19Å; Q96-P100 WeakPolarHBondContact O-CD 3.21Å; Q96-P100 WeakPolarHBondContact O-CG 3.29Å |
| 97 | V | 82.8 | Confident | 84.9 | Confident | 83 Ų | 83 | 92.1 Ų | 92.1 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -83.6 | -34.4 | 176.2 | 176.5 | 0 | 0 | 0 | 0 | 111.6 | A93 Y94 E95 G99 P100 L101 | A93-V97 WeakPolarHBondContact O-CG2 3.5Å; A93-V97 PolarHBondContact O-N 3.2Å; Y94-V97 PolarHBondContact O-N 3.36Å; Y94-V97 VanDerWaalsContact O-N 3.15Å; E95-V97 VanDerWaalsContact C-N 3.28Å; E95-V97 PolarHBondContact O-N 2.84Å; V97-G99 VanDerWaalsContact C-N 3.35Å; V97-G99 PolarHBondContact O-N 3.37Å; V97-P100 WeakPolarHBondContact O-CD 3.44Å; V97-L101 HydrophobicContact CG1-CD1 3.74Å; V97-L101 HydrophobicContact CG1-CG 4.18Å; V97-L101 WeakPolarHBondContact O-CG 3.44Å; V97-L101 PolarHBondContact O-N 2.78Å; V97-L101 VanDerWaalsContact O-N 3.1Å |
| 98 | N | 78.7 | Confident | 84.3 | Confident | 51 Ų | 51 | 90.7 Ų | 90.7 | 27% | 0.273 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.5 | -34.6 | 178.7 | -86 | -13.4 | 0 | 0 | 0 | 113.4 | Y94 E95 L101 N102 | Y94-N98 WeakPolarHBondContact CE1-ND2 3.44Å; Y94-N98 PolarHBondContact O-N 2.87Å; E95-N98 PolarHBondContact O-N 2.9Å; N98-L101 PolarHBondContact O-N 2.87Å; N98-N102 WeakPolarHBondContact O-CB 3.34Å; N98-N102 PolarHBondContact O-N 3.12Å; N98-N102 PolarHBondContact O-ND2 3.03Å |
| 99 | G | 77.6 | Confident | 83.7 | Confident | 32 Ų | 32 | 91 Ų | 91 | 33% | 0.33 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -56.3 | -59 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | E95 V97 L101 N102 Q103 | E95-G99 PolarHBondContact O-N 3.2Å; V97-G99 VanDerWaalsContact C-N 3.35Å; V97-G99 PolarHBondContact O-N 3.37Å; G99-L101 PolarHBondContact O-N 3.3Å; G99-N102 PolarHBondContact O-N 2.81Å; G99-Q103 WeakPolarHBondContact O-CG 3.29Å; G99-Q103 PolarHBondContact O-N 2.88Å; G99-Q103 VanDerWaalsContact O-N 3.11Å |
| 100 | P | 78.6 | Confident | 83.1 | Confident | 65 Ų | 65 | 91.7 Ų | 91.7 | 42% | 0.422 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.3 | -40.3 | 174.5 | -25.7 | 33.5 | 0 | 0 | 0 | 113.8 | Q96 V97 N102 Q103 I104 | Q96-P100 WeakPolarHBondContact O-CD 3.21Å; Q96-P100 WeakPolarHBondContact O-CG 3.29Å; V97-P100 WeakPolarHBondContact O-CD 3.44Å; P100-N102 VanDerWaalsContact C-N 3.33Å; P100-N102 PolarHBondContact O-N 3.48Å; P100-Q103 WeakPolarHBondContact O-CB 3.27Å; P100-Q103 PolarHBondContact O-N 3.45Å; P100-Q103 VanDerWaalsContact O-N 3.14Å; P100-I104 WeakPolarHBondContact O-CG1 3.47Å; P100-I104 PolarHBondContact O-N 2.9Å |
| 101 | L | 76.1 | Confident | 82.6 | Confident | 91 Ų | 91 | 90 Ų | 90 | 48% | 0.476 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.1 | -40.9 | 176.7 | -76.5 | 173.7 | 0 | 0 | 0 | 112 | V97 N98 G99 Q103 I104 S105 | V97-L101 HydrophobicContact CG1-CD1 3.74Å; V97-L101 HydrophobicContact CG1-CG 4.18Å; V97-L101 WeakPolarHBondContact O-CG 3.44Å; V97-L101 PolarHBondContact O-N 2.78Å; V97-L101 VanDerWaalsContact O-N 3.1Å; N98-L101 PolarHBondContact O-N 2.87Å; G99-L101 PolarHBondContact O-N 3.3Å; L101-Q103 VanDerWaalsContact C-N 3.29Å; L101-Q103 PolarHBondContact O-N 3.39Å; L101-I104 PolarHBondContact O-N 3.11Å; L101-S105 PolarHBondContact O-N 2.8Å |
| 102 | N | 78.7 | Confident | 82.2 | Confident | 115 Ų | 115 | 93.1 Ų | 93.1 | 62% | 0.615 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.9 | -33.9 | 174.8 | -71.8 | -19.1 | 0 | 0 | 0 | 112.1 | N98 G99 P100 S106 | N98-N102 WeakPolarHBondContact O-CB 3.34Å; N98-N102 PolarHBondContact O-N 3.12Å; N98-N102 PolarHBondContact O-ND2 3.03Å; G99-N102 PolarHBondContact O-N 2.81Å; P100-N102 VanDerWaalsContact C-N 3.33Å; P100-N102 PolarHBondContact O-N 3.48Å; N102-S106 PolarHBondContact O-N 3.15Å; N102-S106 VanDerWaalsContact O-N 3.12Å |
| 103 | Q | 76.9 | Confident | 81.8 | Confident | 142 Ų | 142 | 93.5 Ų | 93.5 | 66% | 0.664 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -68.5 | -40.2 | 173.7 | -67.9 | 176.4 | 9.1 | 0 | 0 | 112.2 | G99 P100 L101 S106 F107 | G99-Q103 WeakPolarHBondContact O-CG 3.29Å; G99-Q103 PolarHBondContact O-N 2.88Å; G99-Q103 VanDerWaalsContact O-N 3.11Å; P100-Q103 WeakPolarHBondContact O-CB 3.27Å; P100-Q103 PolarHBondContact O-N 3.45Å; P100-Q103 VanDerWaalsContact O-N 3.14Å; L101-Q103 VanDerWaalsContact C-N 3.29Å; L101-Q103 PolarHBondContact O-N 3.39Å; Q103-S106 WeakPolarHBondContact O-CB 3.37Å; Q103-S106 PolarHBondContact O-N 2.84Å; Q103-F107 PolarHBondContact O-N 2.92Å |
| 104 | I | 78.1 | Confident | 81.4 | Confident | 98 Ų | 98 | 95.4 Ų | 95.4 | 50% | 0.503 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.2 | -43 | 175.6 | -66.9 | 166.6 | 0 | 0 | 0 | 110.4 | P100 L101 S106 F107 C108 | P100-I104 WeakPolarHBondContact O-CG1 3.47Å; P100-I104 PolarHBondContact O-N 2.9Å; L101-I104 PolarHBondContact O-N 3.11Å; I104-S106 VanDerWaalsContact C-N 3.32Å; I104-S106 PolarHBondContact O-N 3.23Å; I104-F107 PolarHBondContact O-N 3.16Å; I104-F107 VanDerWaalsContact O-N 3.09Å; I104-C108 PolarHBondContact O-N 3.25Å; I104-C108 PolarHBondContact O-SG 2.87Å |
| 105 | S | 79.3 | Confident | 81.1 | Confident | 63 Ų | 63 | 91.8 Ų | 91.8 | 44% | 0.441 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -56.3 | -48.1 | 175 | -168.8 | 0 | 0 | 0 | 0 | 111.2 | L101 F107 C108 D109 | L101-S105 PolarHBondContact O-N 2.8Å; S105-F107 VanDerWaalsContact C-N 3.28Å; S105-F107 PolarHBondContact O-N 2.81Å; S105-C108 WeakPolarHBondContact O-CB 3.37Å; S105-C108 PolarHBondContact O-N 2.86Å; S105-D109 VanDerWaalsContact O-CG 3.29Å; S105-D109 PolarHBondContact O-N 2.89Å |
| 106 | S | 80.5 | Confident | 80.8 | Confident | 66 Ų | 66 | 89.4 Ų | 89.4 | 46% | 0.462 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.8 | -37.7 | 175.6 | 154.5 | 0 | 0 | 0 | 0 | 112.8 | N102 Q103 I104 D109 V110 | N102-S106 PolarHBondContact O-N 3.15Å; N102-S106 VanDerWaalsContact O-N 3.12Å; Q103-S106 WeakPolarHBondContact O-CB 3.37Å; Q103-S106 PolarHBondContact O-N 2.84Å; I104-S106 VanDerWaalsContact C-N 3.32Å; I104-S106 PolarHBondContact O-N 3.23Å; S106-D109 PolarHBondContact O-N 2.89Å; S106-V110 WeakPolarHBondContact O-CG2 3.31Å; S106-V110 PolarHBondContact O-N 2.82Å; S106-V110 VanDerWaalsContact O-N 3.15Å |
| 107 | F | 81.6 | Confident | 80.4 | Confident | 131 Ų | 131 | 89.8 Ų | 89.8 | 58% | 0.575 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -69.7 | -38.9 | 178 | -172.9 | -104.6 | 0 | 0 | 0 | 111.9 | Q103 I104 S105 D109 V110 I111 | Q103-F107 PolarHBondContact O-N 2.92Å; I104-F107 PolarHBondContact O-N 3.16Å; I104-F107 VanDerWaalsContact O-N 3.09Å; S105-F107 VanDerWaalsContact C-N 3.28Å; S105-F107 PolarHBondContact O-N 2.81Å; F107-D109 VanDerWaalsContact C-N 3.35Å; F107-V110 PolarHBondContact O-N 2.83Å; F107-I111 HydrophobicContact CD1-CD1 3.72Å; F107-I111 HydrophobicContact CD1-CG1 4.35Å; F107-I111 HydrophobicContact CE1-CD1 3.33Å; F107-I111 HydrophobicContact CE1-CG1 4.07Å; F107-I111 HydrophobicContact CZ-CD1 4.03Å; F107-I111 HydrophobicContact CZ-CG1 4.39Å; F107-I111 PolarHBondContact O-N 2.93Å |
| 108 | C | 82.3 | Confident | 79.6 | Confident | 67 Ų | 67 | 92.3 Ų | 92.3 | 45% | 0.453 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 173.1 | -68.6 | 0 | 0 | 0 | 0 | 111.7 | I104 S105 V110 I111 E112 | I104-C108 PolarHBondContact O-N 3.25Å; I104-C108 PolarHBondContact O-SG 2.87Å; S105-C108 WeakPolarHBondContact O-CB 3.37Å; S105-C108 PolarHBondContact O-N 2.86Å; C108-V110 VanDerWaalsContact C-N 3.28Å; C108-V110 PolarHBondContact O-N 3.47Å; C108-I111 PolarHBondContact O-N 3.38Å; C108-I111 VanDerWaalsContact O-N 3.15Å; C108-E112 PolarHBondContact O-N 2.83Å |
| 109 | D | 83.2 | Confident | 78.5 | Confident | 95 Ų | 95 | 91.9 Ų | 91.9 | 51% | 0.508 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.8 | -40.4 | 175.8 | -62.1 | -25 | 0 | 0 | 0 | 111.2 | S105 S106 F107 E112 E113 | S105-D109 VanDerWaalsContact O-CG 3.29Å; S105-D109 PolarHBondContact O-N 2.89Å; S106-D109 PolarHBondContact O-N 2.89Å; F107-D109 VanDerWaalsContact C-N 3.35Å; D109-E112 PolarHBondContact O-N 3.02Å; D109-E113 WeakPolarHBondContact O-CB 3.36Å; D109-E113 PolarHBondContact O-N 3.39Å |
| 110 | V | 83.1 | Confident | 77.6 | Confident | 62 Ų | 62 | 96.7 Ų | 96.7 | 38% | 0.376 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.4 | -41 | 175.5 | 172.5 | 0 | 0 | 0 | 0 | 111.6 | S106 F107 C108 E112 E113 I114 | S106-V110 WeakPolarHBondContact O-CG2 3.31Å; S106-V110 PolarHBondContact O-N 2.82Å; S106-V110 VanDerWaalsContact O-N 3.15Å; F107-V110 PolarHBondContact O-N 2.83Å; C108-V110 VanDerWaalsContact C-N 3.28Å; C108-V110 PolarHBondContact O-N 3.47Å; V110-E112 VanDerWaalsContact C-N 3.32Å; V110-E112 PolarHBondContact O-N 3.48Å; V110-E113 PolarHBondContact O-N 3.3Å; V110-I114 HydrophobicContact CG1-CD1 3.8Å; V110-I114 HydrophobicContact CG1-CG1 4.35Å; V110-I114 WeakPolarHBondContact O-CB 3.48Å; V110-I114 VanDerWaalsContact O-CG1 3.25Å; V110-I114 WeakPolarHBondContact O-CG1 3.47Å; V110-I114 PolarHBondContact O-N 3.44Å |
| 111 | I | 81.3 | Confident | 76.3 | Confident | 82 Ų | 82 | 98.3 Ų | 98.3 | 42% | 0.421 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.5 | -41.7 | 175.4 | -72.7 | 175.5 | 0 | 0 | 0 | 110.9 | F107 C108 I114 S115 | F107-I111 HydrophobicContact CD1-CD1 3.72Å; F107-I111 HydrophobicContact CD1-CG1 4.35Å; F107-I111 HydrophobicContact CE1-CD1 3.33Å; F107-I111 HydrophobicContact CE1-CG1 4.07Å; F107-I111 HydrophobicContact CZ-CD1 4.03Å; F107-I111 HydrophobicContact CZ-CG1 4.39Å; F107-I111 PolarHBondContact O-N 2.93Å; C108-I111 PolarHBondContact O-N 3.38Å; C108-I111 VanDerWaalsContact O-N 3.15Å; I111-I114 PolarHBondContact O-N 3.22Å; I111-S115 WeakPolarHBondContact O-CB 3.31Å; I111-S115 PolarHBondContact O-N 3.01Å; I111-S115 PolarHBondContact O-OG 3.21Å |
| 112 | E | 84.5 | Confident | 74.8 | Confident | 140 Ų | 140 | 99.7 Ų | 99.7 | 65% | 0.654 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66.7 | -40.7 | 177.9 | -162.6 | 168.6 | -164.1 | 0 | 0 | 110.9 | C108 D109 V110 S115 S116 | C108-E112 PolarHBondContact O-N 2.83Å; D109-E112 PolarHBondContact O-N 3.02Å; V110-E112 VanDerWaalsContact C-N 3.32Å; V110-E112 PolarHBondContact O-N 3.48Å; E112-S115 PolarHBondContact O-N 3.01Å; E112-S116 WeakPolarHBondContact O-CB 3.43Å; E112-S116 PolarHBondContact O-N 3.12Å; E112-S116 PolarHBondContact O-OG 3.13Å |
| 113 | E | 85.1 | Confident | 73.5 | Confident | 96 Ų | 96 | 99.3 Ų | 99.3 | 45% | 0.449 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62 | -47.1 | 173.1 | -169.4 | -176.3 | 173.4 | 0 | 0 | 111.7 | D109 V110 S115 S116 K117 | D109-E113 WeakPolarHBondContact O-CB 3.36Å; D109-E113 PolarHBondContact O-N 3.39Å; V110-E113 PolarHBondContact O-N 3.3Å; E113-S115 VanDerWaalsContact C-N 3.34Å; E113-S115 PolarHBondContact O-N 2.87Å; E113-S116 PolarHBondContact O-N 3.5Å; E113-S116 PolarHBondContact O-OG 2.89Å; E113-K117 PolarHBondContact O-N 3.48Å; E113-K117 VanDerWaalsContact OE1-CE 3.24Å; E113-K117 WeakPolarHBondContact OE1-CE 3.4Å; E113-K117 IonicContact OE1-NZ 2.64Å; E113-K117 PolarHBondContact OE1-NZ 2.93Å |
| 114 | I | 81.7 | Confident | 72.1 | Confident | 88 Ų | 88 | 98.1 Ų | 98.1 | 45% | 0.451 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -61.1 | -45.1 | 177.2 | -68.6 | 167 | 0 | 0 | 0 | 110.4 | V110 I111 S116 K117 Q118 | V110-I114 HydrophobicContact CG1-CD1 3.8Å; V110-I114 HydrophobicContact CG1-CG1 4.35Å; V110-I114 WeakPolarHBondContact O-CB 3.48Å; V110-I114 VanDerWaalsContact O-CG1 3.25Å; V110-I114 WeakPolarHBondContact O-CG1 3.47Å; V110-I114 PolarHBondContact O-N 3.44Å; I111-I114 PolarHBondContact O-N 3.22Å; I114-S116 VanDerWaalsContact C-N 3.29Å; I114-S116 PolarHBondContact O-N 2.93Å; I114-K117 PolarHBondContact O-N 2.93Å; I114-Q118 PolarHBondContact O-N 2.95Å |
| 115 | S | 79.4 | Confident | 70.6 | Confident | 78 Ų | 78 | 102.6 Ų | 102.6 | 55% | 0.545 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -62.6 | -37.2 | 177.9 | -65.6 | 0 | 0 | 0 | 0 | 111.8 | I111 E112 E113 | I111-S115 WeakPolarHBondContact O-CB 3.31Å; I111-S115 PolarHBondContact O-N 3.01Å; I111-S115 PolarHBondContact O-OG 3.21Å; E112-S115 PolarHBondContact O-N 3.01Å; E113-S115 VanDerWaalsContact C-N 3.34Å; E113-S115 PolarHBondContact O-N 2.87Å |
| 116 | S | 80.7 | Confident | 69.1 | Low | 89 Ų | 89 | 103.5 Ų | 103.5 | 62% | 0.622 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -70.7 | -31 | 177.1 | 75.3 | 0 | 0 | 0 | 0 | 113.5 | E112 E113 I114 | E112-S116 WeakPolarHBondContact O-CB 3.43Å; E112-S116 PolarHBondContact O-N 3.12Å; E112-S116 PolarHBondContact O-OG 3.13Å; E113-S116 PolarHBondContact O-N 3.5Å; E113-S116 PolarHBondContact O-OG 2.89Å; I114-S116 VanDerWaalsContact C-N 3.29Å; I114-S116 PolarHBondContact O-N 2.93Å |
| 117 | K | 79.1 | Confident | 67.5 | Low | 152 Ų | 152 | 105.1 Ų | 105.1 | 66% | 0.661 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -83.3 | -25.6 | 176.9 | -70.5 | -173.2 | -173.3 | 170.5 | 0 | 113.1 | E113 I114 G119 | E113-K117 PolarHBondContact O-N 3.48Å; E113-K117 VanDerWaalsContact OE1-CE 3.24Å; E113-K117 WeakPolarHBondContact OE1-CE 3.4Å; E113-K117 IonicContact OE1-NZ 2.64Å; E113-K117 PolarHBondContact OE1-NZ 2.93Å; I114-K117 PolarHBondContact O-N 2.93Å; K117-G119 PolarHBondContact O-N 3.34Å |
| 118 | Q | 65.3 | Low | 65.9 | Low | 135 Ų | 135 | 107.6 Ų | 107.6 | 63% | 0.631 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -77.8 | 77.1 | 164 | -68.9 | -171.1 | 27 | 0 | 0 | 108.9 | I114 | I114-Q118 PolarHBondContact O-N 2.95Š|
| 119 | G | 56.3 | Low | 64.5 | Low | 43 Ų | 43 | 108.5 Ų | 108.5 | 44% | 0.443 | 65% | 0.653 | S | S | . | * | trans | -51.3 | 149.8 | 163.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | K117 S121 | K117-G119 PolarHBondContact O-N 3.34Å; G119-S121 PolarHBondContact O-N 3.34Å | ||
| 120 | P | 57.6 | Low | 62.6 | Low | 132 Ų | 132 | 112.4 Ų | 112.4 | 86% | 0.857 | 67% | 0.668 | S | S | * | * | trans | -51.7 | 111.3 | -176.2 | 20.5 | -31.5 | 0 | 0 | 0 | 108.7 | S122 | P120-S122 VanDerWaalsContact C-N 3.33Å; P120-S122 PolarHBondContact O-N 2.99Å | ||
| 121 | S | 52.3 | Low | 61.1 | Low | 100 Ų | 100 | 115.2 Ų | 115.2 | 70% | 0.699 | 69% | 0.687 | S | S | * | * | trans | -67.5 | 98.8 | -177.3 | -52.8 | 0 | 0 | 0 | 0 | 107.1 | G119 S123 | G119-S121 PolarHBondContact O-N 3.34Å; S121-S123 VanDerWaalsContact C-N 3.27Å; S121-S123 PolarHBondContact O-N 3.49Å | ||
| 122 | S | 44.4 | Very low | 59.3 | Low | 120 Ų | 120 | 120.8 Ų | 120.8 | 84% | 0.839 | 71% | 0.709 | S | S | * | * | trans | -63.6 | 90.5 | 169.5 | 54 | 0 | 0 | 0 | 0 | 108.3 | P120 | P120-S122 VanDerWaalsContact C-N 3.33Å; P120-S122 PolarHBondContact O-N 2.99Å | ||
| 123 | S | 50.6 | Low | 57.1 | Low | 107 Ų | 107 | 121.5 Ų | 121.5 | 75% | 0.748 | 72% | 0.717 | S | S | * | * | trans | -118.2 | 92.1 | 160 | 53.3 | 0 | 0 | 0 | 0 | 107.9 | S121 Q125 | S121-S123 VanDerWaalsContact C-N 3.27Å; S121-S123 PolarHBondContact O-N 3.49Å; S123-Q125 PolarHBondContact O-N 2.86Å | ||
| 124 | S | 48.5 | Very low | 55.2 | Low | 116 Ų | 116 | 123.3 Ų | 123.3 | 81% | 0.811 | 73% | 0.728 | S | S | * | * | trans | -66.2 | 104.4 | 154.2 | 22.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 125 | Q | 46 | Very low | 53.1 | Low | 192 Ų | 192 | 125.5 Ų | 125.5 | 90% | 0.897 | 74% | 0.741 | S | S | * | * | trans | -166.9 | 123.5 | 137.8 | -109.2 | 175.9 | -7.5 | 0 | 0 | 109.6 | S123 | S123-Q125 PolarHBondContact O-N 2.86Š| ||
| 126 | G | 48.4 | Very low | 51.4 | Low | 82 Ų | 82 | 126.9 Ų | 126.9 | 85% | 0.845 | 75% | 0.751 | S | S | * | * | trans | -68.2 | 148.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 127 | S | 46 | Very low | 49.5 | Very low | 101 Ų | 101 | 130 Ų | 130 | 71% | 0.706 | 76% | 0.761 | S | S | * | * | trans | -152.8 | 105 | 151.5 | 179.6 | 0 | 0 | 0 | 0 | 107 | S129 | S127-S129 PolarHBondContact O-N 3.25Å; S127-S129 PolarHBondContact OG-OG 2.99Å | ||
| 128 | I | 49.1 | Very low | 47.7 | Very low | 182 Ų | 182 | 127.5 Ų | 127.5 | 93% | 0.933 | 77% | 0.768 | S | S | * | * | trans | -76.6 | 103.2 | 166.4 | -57.3 | 162.7 | 0 | 0 | 0 | 105.3 | ||||
| 129 | S | 51.1 | Low | 46.2 | Very low | 87 Ų | 87 | 124.7 Ų | 124.7 | 61% | 0.608 | 78% | 0.776 | S | S | * | * | trans | -163.4 | 106.1 | 163.5 | 47.9 | 0 | 0 | 0 | 0 | 109.7 | S127 | S127-S129 PolarHBondContact O-N 3.25Å; S127-S129 PolarHBondContact OG-OG 2.99Å | ||
| 130 | E | 44.6 | Very low | 45.5 | Very low | 177 Ų | 177 | 131.2 Ų | 131.2 | 83% | 0.827 | 80% | 0.797 | S | S | * | * | trans | 70.5 | 115.1 | 164.2 | -59.5 | -168.4 | 159.1 | 0 | 0 | 118.5 | F132 | E130-F132 PolarHBondContact O-N 3.43Š| ||
| 131 | P | 50.4 | Low | 44.7 | Very low | 121 Ų | 121 | 129.2 Ų | 129.2 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | trans | -67.4 | 129.5 | 157.5 | 30.2 | -26.6 | 0 | 0 | 0 | 106.6 | N133 | P131-N133 PolarHBondContact O-N 3.45Š| ||
| 132 | F | 44.3 | Very low | 44.4 | Very low | 198 Ų | 198 | 131 Ų | 131 | 87% | 0.868 | 79% | 0.793 | S | S | * | * | trans | -49.8 | 106.6 | 165.1 | -89 | -94.1 | 0 | 0 | 0 | 108.2 | E130 I134 | E130-F132 PolarHBondContact O-N 3.43Å; F132-I134 HydrophobicContact CB-CG1 4.37Å; F132-I134 PolarHBondContact O-N 2.87Å | ||
| 133 | N | 37.4 | Very low | 44 | Very low | 155 Ų | 155 | 129.2 Ų | 129.2 | 83% | 0.829 | 79% | 0.786 | S | S | * | * | trans | -70.9 | 83.2 | 167.3 | -149.5 | 8.3 | 0 | 0 | 0 | 105.3 | P131 D135 | P131-N133 PolarHBondContact O-N 3.45Å; N133-D135 VanDerWaalsContact C-N 3.3Å; N133-D135 PolarHBondContact O-N 3.25Å | ||
| 134 | I | 46.2 | Very low | 43.1 | Very low | 134 Ų | 134 | 131 Ų | 131 | 69% | 0.687 | 79% | 0.787 | S | S | * | * | trans | -71.1 | 99.3 | 165.5 | -61.2 | 174.6 | 0 | 0 | 0 | 104.5 | F132 S136 | F132-I134 HydrophobicContact CB-CG1 4.37Å; F132-I134 PolarHBondContact O-N 2.87Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 3.41Å | ||
| 135 | D | 37.4 | Very low | 42.7 | Very low | 134 Ų | 134 | 133.8 Ų | 133.8 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | trans | -48.9 | 106.4 | 161.1 | -108.7 | -30.8 | 0 | 0 | 0 | 107.2 | N133 N137 | N133-D135 VanDerWaalsContact C-N 3.3Å; N133-D135 PolarHBondContact O-N 3.25Å; D135-N137 PolarHBondContact O-N 3.34Å | ||
| 136 | S | 44.7 | Very low | 41.8 | Very low | 107 Ų | 107 | 126.2 Ų | 126.2 | 75% | 0.748 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -70.7 | 68 | 171.8 | -66.2 | 0 | 0 | 0 | 0 | 108.1 | I134 | I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 3.41Å |
| 137 | N | 41 | Very low | 41.2 | Very low | 155 Ų | 155 | 130.7 Ų | 130.7 | 83% | 0.829 | 76% | 0.761 | S | S | * | * | trans | -165 | 48.8 | 176.6 | -93.9 | -24.9 | 0 | 0 | 0 | 112 | D135 | D135-N137 PolarHBondContact O-N 3.34Š| ||
| 138 | A | 40.1 | Very low | 40.8 | Very low | 100 Ų | 100 | 130.3 Ų | 130.3 | 83% | 0.826 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -159.6 | 112.3 | 160.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 139 | G | 34.1 | Very low | 40.2 | Very low | 76 Ų | 76 | 129.3 Ų | 129.3 | 78% | 0.784 | 76% | 0.755 | S | S | * | * | trans | 90.7 | 81.6 | 159.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 140 | M | 41.5 | Very low | 39.3 | Very low | 179 Ų | 179 | 133.6 Ų | 133.6 | 88% | 0.882 | 77% | 0.765 | S | S | * | * | trans | -49.3 | 139.6 | 165 | -68.9 | -153.5 | 84.4 | 0 | 0 | 111.4 | ||||
| 141 | P | 40.3 | Very low | 38.6 | Very low | 90 Ų | 90 | 126.6 Ų | 126.6 | 58% | 0.584 | 74% | 0.741 | S | S | * | * | trans | -62.8 | 150.7 | 164.3 | 29 | -33 | 0 | 0 | 0 | 108.9 | A143 | P141-A143 HydrophobicContact CB-CB 4.46Å; P141-A143 HydrophobicContact CG-CB 4.17Å; P141-A143 PolarHBondContact O-N 2.91Å | ||
| 142 | P | 46.7 | Very low | 37.7 | Very low | 137 Ų | 137 | 128.3 Ų | 128.3 | 89% | 0.89 | 74% | 0.743 | S | S | * | * | trans | -73.7 | 66.6 | 164.2 | 33.9 | -31.8 | 0 | 0 | 0 | 108.3 | N144 | P142-N144 PolarHBondContact O-N 3Š| ||
| 143 | A | 35 | Very low | 37.3 | Very low | 84 Ų | 84 | 126.4 Ų | 126.4 | 69% | 0.694 | 74% | 0.742 | S | S | * | * | trans | -91.6 | 61.5 | 164.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | P141 | P141-A143 HydrophobicContact CB-CB 4.46Å; P141-A143 HydrophobicContact CG-CB 4.17Å; P141-A143 PolarHBondContact O-N 2.91Å | ||
| 144 | N | 33 | Very low | 37 | Very low | 143 Ų | 143 | 124.3 Ų | 124.3 | 77% | 0.765 | 73% | 0.73 | S | S | * | * | trans | -161.1 | 62.3 | 159.2 | -132 | -10.3 | 0 | 0 | 0 | 110.8 | P142 G146 | P142-N144 PolarHBondContact O-N 3Å; N144-G146 WeakPolarHBondContact OD1-CA 3.49Å; N144-G146 PolarHBondContact OD1-N 3.16Å; N144-G146 VanDerWaalsContact OD1-N 3.12Å | ||
| 145 | I | 39.4 | Very low | 36.5 | Very low | 175 Ų | 175 | 123.5 Ų | 123.5 | 90% | 0.897 | 73% | 0.733 | S | S | * | * | -88.7 | 63.5 | 129.3 | -51.1 | 173.7 | 0 | 0 | 0 | 104.5 | |||||
| 146 | G | 28.1 | Very low | 36.2 | Very low | 33 Ų | 33 | 123.7 Ų | 123.7 | 34% | 0.34 | 73% | 0.734 | S | S | . | * | trans | -52.4 | 145.1 | 149.2 | 0 | 0 | 0 | 0 | 0 | 105.8 | N144 A148 | N144-G146 WeakPolarHBondContact OD1-CA 3.49Å; N144-G146 PolarHBondContact OD1-N 3.16Å; N144-G146 VanDerWaalsContact OD1-N 3.12Å; G146-A148 PolarHBondContact O-N 2.9Å; G146-A148 VanDerWaalsContact O-N 3.12Å | ||
| 147 | F | 35.7 | Very low | 35.4 | Very low | 176 Ų | 176 | 124.9 Ų | 124.9 | 77% | 0.772 | 74% | 0.741 | S | S | * | * | trans | -33.7 | 130.2 | 155.1 | -69.1 | -96 | 0 | 0 | 0 | 107.6 | Q149 | F147-Q149 HydrophobicContact CB-CB 4.16Å; F147-Q149 HydrophobicContact CB-CG 3.79Å; F147-Q149 PolarHBondContact O-N 3.45Å | ||
| 148 | A | 37.8 | Very low | 34.8 | Very low | 94 Ų | 94 | 124.1 Ų | 124.1 | 78% | 0.777 | 73% | 0.733 | S | S | * | * | trans | -61.8 | 63.9 | 147.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | G146 H150 | G146-A148 PolarHBondContact O-N 2.9Å; G146-A148 VanDerWaalsContact O-N 3.12Å; A148-H150 PolarHBondContact O-N 3.4Å; A148-H150 VanDerWaalsContact O-N 3.09Å | ||
| 149 | Q | 36.5 | Very low | 34.4 | Very low | 160 Ų | 160 | 125 Ų | 125 | 75% | 0.748 | 73% | 0.73 | S | S | * | * | trans | -67.7 | 53.8 | 138.3 | -79.3 | 179.2 | -8.2 | 0 | 0 | 107 | F147 G151 | F147-Q149 HydrophobicContact CB-CB 4.16Å; F147-Q149 HydrophobicContact CB-CG 3.79Å; F147-Q149 PolarHBondContact O-N 3.45Å; Q149-G151 PolarHBondContact O-N 3.04Å; Q149-G151 VanDerWaalsContact O-N 3.08Å | ||
| 150 | H | 31.7 | Very low | 34.3 | Very low | 177 Ų | 177 | 127.9 Ų | 127.9 | 82% | 0.819 | 73% | 0.727 | S | S | * | * | trans | -75.9 | 68.7 | 136.9 | -81.6 | -63.9 | 0 | 0 | 0 | 106.1 | A148 | A148-H150 PolarHBondContact O-N 3.4Å; A148-H150 VanDerWaalsContact O-N 3.09Å | ||
| 151 | G | 29.2 | Very low | 33.6 | Very low | 30 Ų | 30 | 123.6 Ų | 123.6 | 31% | 0.309 | 72% | 0.72 | S | S | . | * | trans | -136.1 | 48.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 107.2 | Q149 | Q149-G151 PolarHBondContact O-N 3.04Å; Q149-G151 VanDerWaalsContact O-N 3.08Å | ||
| 152 | N | 32.3 | Very low | 33.4 | Very low | 157 Ų | 157 | 122.6 Ų | 122.6 | 84% | 0.84 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -151.4 | 49.4 | 153 | -88 | -21.8 | 0 | 0 | 0 | 107.2 | ||
| 153 | N | 34.5 | Very low | 32.6 | Very low | 158 Ų | 158 | 126 Ų | 126 | 85% | 0.845 | 72% | 0.724 | S | S | * | * | trans | -146.6 | 53.7 | 141.3 | -93.4 | -22.8 | 0 | 0 | 0 | 104.2 | ||||
| 154 | I | 32.9 | Very low | 32.5 | Very low | 111 Ų | 111 | 129.3 Ų | 129.3 | 57% | 0.569 | 73% | 0.729 | S | S | * | * | trans | -79.2 | 115.6 | 155.1 | -66.5 | 164.7 | 0 | 0 | 0 | 102.5 | D156 | I154-D156 PolarHBondContact O-N 3.3Å; I154-D156 VanDerWaalsContact O-N 3.09Å | ||
| 155 | P | 35.2 | Very low | 32.6 | Very low | 118 Ų | 118 | 127.8 Ų | 127.8 | 77% | 0.766 | 73% | 0.729 | S | S | * | * | trans | -58.8 | 121.3 | 164 | 26 | -29.3 | 0 | 0 | 0 | 105.8 | C157 | P155-C157 PolarHBondContact O-N 2.99Š| ||
| 156 | D | 31.3 | Very low | 32.3 | Very low | 138 Ų | 138 | 123 Ų | 123 | 74% | 0.738 | 72% | 0.716 | S | S | * | * | trans | -30.3 | 119.6 | -179.3 | -68.4 | -61.8 | 0 | 0 | 0 | 112.5 | I154 Q158 | I154-D156 PolarHBondContact O-N 3.3Å; I154-D156 VanDerWaalsContact O-N 3.09Å; D156-Q158 HydrophobicContact CB-CB 4.18Å; D156-Q158 PolarHBondContact O-N 3.27Å | ||
| 157 | C | 26.4 | Very low | 32.5 | Very low | 131 Ų | 131 | 128.5 Ų | 128.5 | 89% | 0.885 | 74% | 0.736 | S | S | * | * | trans | -66.5 | 71 | 142.6 | -82.2 | 0 | 0 | 0 | 0 | 107.9 | P155 | P155-C157 PolarHBondContact O-N 2.99Š| ||
| 158 | Q | 28.4 | Very low | 32.4 | Very low | 140 Ų | 140 | 125.8 Ų | 125.8 | 65% | 0.654 | 73% | 0.734 | S | S | * | * | trans | -118.5 | 111.3 | 150.7 | -92.6 | -150.3 | -1.4 | 0 | 0 | 107.5 | D156 N160 | D156-Q158 HydrophobicContact CB-CB 4.18Å; D156-Q158 PolarHBondContact O-N 3.27Å; Q158-N160 PolarHBondContact O-N 3.49Å | ||
| 159 | P | 31.6 | Very low | 32.2 | Very low | 119 Ų | 119 | 129.1 Ų | 129.1 | 77% | 0.773 | 74% | 0.739 | S | S | * | * | trans | -82.6 | 96.3 | 164.2 | 31.8 | -23.9 | 0 | 0 | 0 | 107 | ||||
| 160 | N | 32 | Very low | 32 | Very low | 136 Ų | 136 | 125.6 Ų | 125.6 | 73% | 0.727 | 74% | 0.737 | S | S | * | * | trans | -168.5 | 136.8 | 163.7 | -81.2 | -37.2 | 0 | 0 | 0 | 106.3 | Q158 | Q158-N160 PolarHBondContact O-N 3.49Š| ||
| 161 | A | 28.2 | Very low | 32 | Very low | 89 Ų | 89 | 124.9 Ų | 124.9 | 74% | 0.736 | 74% | 0.739 | S | S | * | * | cis | -173.8 | 159.4 | -7.7 | 0 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 162 | A | 34.9 | Very low | 32.4 | Very low | 69 Ų | 69 | 128.6 Ų | 128.6 | 57% | 0.57 | 76% | 0.757 | S | S | * | * | trans | 74.2 | 79.9 | 156.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | L164 | A162-L164 VanDerWaalsContact C-N 3.28Å; A162-L164 HydrophobicContact CB-CB 4.04Å; A162-L164 HydrophobicContact CB-CD1 3.76Å; A162-L164 HydrophobicContact CB-CG 3.83Å | ||
| 163 | E | 31.3 | Very low | 32.4 | Very low | 209 Ų | 209 | 128 Ų | 128 | 98% | 0.977 | 76% | 0.759 | S | S | * | * | -81.9 | 92.3 | 108.4 | -89.2 | -175.1 | 157.5 | 0 | 0 | 107.3 | |||||
| 164 | L | 33 | Very low | 32.5 | Very low | 152 Ų | 152 | 123.9 Ų | 123.9 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | trans | -92.2 | 105.4 | 167.1 | -92.2 | 165 | 0 | 0 | 0 | 107.8 | A162 | A162-L164 VanDerWaalsContact C-N 3.28Å; A162-L164 HydrophobicContact CB-CB 4.04Å; A162-L164 HydrophobicContact CB-CD1 3.76Å; A162-L164 HydrophobicContact CB-CG 3.83Å | ||
| 165 | S | 33.5 | Very low | 32.4 | Very low | 111 Ų | 111 | 128.5 Ų | 128.5 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | trans | -139.2 | 93.8 | 133.2 | 46 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 166 | A | 33 | Very low | 32.7 | Very low | 76 Ų | 76 | 129 Ų | 129 | 63% | 0.628 | 76% | 0.758 | S | S | * | * | 75.1 | 112.2 | 93 | 0 | 0 | 0 | 0 | 0 | 109.2 | |||||
| 167 | I | 33.5 | Very low | 32.5 | Very low | 148 Ų | 148 | 134.2 Ų | 134.2 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | cis | -173.9 | 136.4 | 43 | -92.4 | 144.1 | 0 | 0 | 0 | 107.4 | ||||
| 168 | T | 33.4 | Very low | 33.1 | Very low | 118 Ų | 118 | 136.5 Ų | 136.5 | 72% | 0.724 | 76% | 0.762 | S | S | * | * | trans | 37.3 | 121.2 | 154 | 61.6 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 169 | D | 33.5 | Very low | 33.5 | Very low | 164 Ų | 164 | 139.4 Ų | 139.4 | 88% | 0.877 | 77% | 0.773 | S | S | * | * | -147.8 | 130.1 | 70.3 | -83.5 | -34.9 | 0 | 0 | 0 | 113.4 | |||||
| 170 | A | 32.6 | Very low | 33.7 | Very low | 87 Ų | 87 | 139.6 Ų | 139.6 | 72% | 0.719 | 77% | 0.772 | S | S | * | * | trans | -100.7 | 135.9 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 171 | L | 32 | Very low | 34.1 | Very low | 162 Ų | 162 | 139.8 Ų | 139.8 | 85% | 0.848 | 77% | 0.771 | S | S | * | * | trans | 81.6 | 153.5 | 156.3 | -60.7 | 169.1 | 0 | 0 | 0 | 119.3 | ||||
| 172 | P | 37.8 | Very low | 34.4 | Very low | 107 Ų | 107 | 139.9 Ų | 139.9 | 70% | 0.695 | 77% | 0.767 | S | S | * | * | cis | -129.6 | 161.1 | 0.1 | 26.2 | -3.9 | 0 | 0 | 0 | 115.9 | A174 | P172-A174 VanDerWaalsContact C-N 3.34Å; P172-A174 PolarHBondContact O-N 2.92Å | ||
| 173 | V | 30.6 | Very low | 34.6 | Very low | 144 Ų | 144 | 145.1 Ų | 145.1 | 87% | 0.873 | 78% | 0.776 | S | S | * | * | trans | -47.3 | 92.7 | 155.4 | 176.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 174 | A | 36.5 | Very low | 34.6 | Very low | 73 Ų | 73 | 143.2 Ų | 143.2 | 60% | 0.603 | 77% | 0.765 | S | S | * | * | trans | -91.2 | 114.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | P172 I176 | P172-A174 VanDerWaalsContact C-N 3.34Å; P172-A174 PolarHBondContact O-N 2.92Å; A174-I176 VanDerWaalsContact C-N 3.34Å; A174-I176 PolarHBondContact O-N 3.32Å | ||
| 175 | K | 31.8 | Very low | 34.7 | Very low | 207 Ų | 207 | 141.4 Ų | 141.4 | 90% | 0.9 | 76% | 0.76 | S | S | * | * | trans | -53.6 | 93.8 | 162 | -72 | 171.3 | 176.3 | 170.4 | 0 | 109.6 | ||||
| 176 | I | 40.5 | Very low | 34.7 | Very low | 129 Ų | 129 | 142 Ų | 142 | 66% | 0.662 | 75% | 0.754 | S | S | * | * | trans | -105.2 | 92.7 | 162.8 | -55.5 | -179.4 | 0 | 0 | 0 | 107.7 | A174 K178 | A174-I176 VanDerWaalsContact C-N 3.34Å; A174-I176 PolarHBondContact O-N 3.32Å; I176-K178 HydrophobicContact CG2-CG 3.83Å; I176-K178 PolarHBondContact O-N 3.49Å | ||
| 177 | R | 28.9 | Very low | 34.5 | Very low | 248 Ų | 248 | 143.6 Ų | 143.6 | 94% | 0.936 | 76% | 0.76 | S | S | * | * | trans | -60.6 | 86.4 | 154 | -74.6 | -179.8 | 171.3 | -175.8 | -2.8 | 107.6 | K179 | R177-K179 PolarHBondContact O-N 2.92Š| ||
| 178 | K | 38.1 | Very low | 34.5 | Very low | 178 Ų | 178 | 142.1 Ų | 142.1 | 77% | 0.774 | 76% | 0.758 | S | S | * | * | trans | -71.1 | 116.1 | 160.2 | -88.9 | 179.2 | -178.1 | 175.1 | 0 | 106.5 | I176 V180 | I176-K178 HydrophobicContact CG2-CG 3.83Å; I176-K178 PolarHBondContact O-N 3.49Å; K178-V180 PolarHBondContact O-N 3.34Å | ||
| 179 | K | 35.9 | Very low | 34.4 | Very low | 201 Ų | 201 | 142.4 Ų | 142.4 | 87% | 0.874 | 76% | 0.761 | S | S | * | * | trans | -49.3 | 94.5 | 160.8 | -86.5 | 176.4 | 171.9 | 175 | 0 | 107.8 | R177 I181 | R177-K179 PolarHBondContact O-N 2.92Å; K179-I181 VanDerWaalsContact C-N 3.31Å; K179-I181 PolarHBondContact O-N 3.33Å; K179-I181 VanDerWaalsContact O-N 3.12Å | ||
| 180 | V | 36.4 | Very low | 34.2 | Very low | 124 Ų | 124 | 137.3 Ų | 137.3 | 75% | 0.752 | 75% | 0.747 | S | S | * | * | trans | -67.1 | 105.2 | 151.8 | 178.9 | 0 | 0 | 0 | 0 | 103.5 | K178 S182 | K178-V180 PolarHBondContact O-N 3.34Å; V180-S182 PolarHBondContact O-N 3.33Å | ||
| 181 | I | 40.9 | Very low | 34.2 | Very low | 139 Ų | 139 | 142.7 Ų | 142.7 | 71% | 0.713 | 76% | 0.755 | S | S | * | * | trans | -62.5 | 91.7 | 158.4 | -65 | 172 | 0 | 0 | 0 | 104 | K179 K183 | K179-I181 VanDerWaalsContact C-N 3.31Å; K179-I181 PolarHBondContact O-N 3.33Å; K179-I181 VanDerWaalsContact O-N 3.12Å; I181-K183 HydrophobicContact CG2-CG 4.14Å; I181-K183 PolarHBondContact O-N 2.89Å | ||
| 182 | S | 35.3 | Very low | 34.2 | Very low | 92 Ų | 92 | 140.4 Ų | 140.4 | 64% | 0.643 | 75% | 0.752 | S | S | * | * | trans | -64.5 | 87.8 | 158.8 | 51.4 | 0 | 0 | 0 | 0 | 105.8 | V180 K184 | V180-S182 PolarHBondContact O-N 3.33Å; S182-K184 PolarHBondContact O-N 2.91Å | ||
| 183 | K | 37.9 | Very low | 33.8 | Very low | 179 Ų | 179 | 146.1 Ų | 146.1 | 78% | 0.778 | 76% | 0.761 | S | S | * | * | trans | -63.7 | 97.8 | 147.3 | -79.7 | -170.4 | 177.8 | -178 | 0 | 104.3 | I181 V185 | I181-K183 HydrophobicContact CG2-CG 4.14Å; I181-K183 PolarHBondContact O-N 2.89Å; K183-V185 PolarHBondContact O-N 3.4Å | ||
| 184 | K | 32.5 | Very low | 34.3 | Very low | 168 Ų | 168 | 144.9 Ų | 144.9 | 73% | 0.73 | 76% | 0.756 | S | S | * | * | trans | -49.4 | 96.7 | 153.4 | -70.3 | -172.9 | 175.8 | -172.6 | 0 | 105.7 | S182 D186 | S182-K184 PolarHBondContact O-N 2.91Å; K184-D186 PolarHBondContact O-N 3.39Å | ||
| 185 | V | 34.7 | Very low | 34.4 | Very low | 115 Ų | 115 | 149 Ų | 149 | 70% | 0.697 | 77% | 0.768 | S | S | * | * | trans | -75.1 | 96 | 149.7 | 176.8 | 0 | 0 | 0 | 0 | 101.9 | K183 C187 | K183-V185 PolarHBondContact O-N 3.4Å; V185-C187 PolarHBondContact O-N 3.08Å | ||
| 186 | D | 33 | Very low | 34.7 | Very low | 122 Ų | 122 | 149.2 Ų | 149.2 | 65% | 0.652 | 76% | 0.763 | S | S | * | * | trans | -56.5 | 94.6 | 166.1 | -68.8 | -40.7 | 0 | 0 | 0 | 106.2 | K184 V188 | K184-D186 PolarHBondContact O-N 3.39Å; D186-V188 HydrophobicContact CB-CG2 4.39Å; D186-V188 PolarHBondContact O-N 3.21Å | ||
| 187 | C | 28.5 | Very low | 34.3 | Very low | 111 Ų | 111 | 152.2 Ų | 152.2 | 75% | 0.75 | 77% | 0.771 | S | S | * | * | trans | -70.4 | 84.8 | 164 | -68.2 | 0 | 0 | 0 | 0 | 105.3 | V185 P189 | V185-C187 PolarHBondContact O-N 3.08Å; C187-P189 WeakPolarHBondContact O-CD 3.29Å | ||
| 188 | V | 34.4 | Very low | 34.9 | Very low | 117 Ų | 117 | 149.3 Ų | 149.3 | 71% | 0.709 | 77% | 0.765 | S | S | * | * | trans | -67.2 | 112.9 | 166.9 | 178.9 | 0 | 0 | 0 | 0 | 106.8 | D186 | D186-V188 HydrophobicContact CB-CG2 4.39Å; D186-V188 PolarHBondContact O-N 3.21Å | ||
| 189 | P | 31 | Very low | 35 | Very low | 124 Ų | 124 | 147.5 Ų | 147.5 | 81% | 0.805 | 76% | 0.764 | S | S | * | * | trans | -84.6 | 120.1 | 169.5 | 23.4 | -7.8 | 0 | 0 | 0 | 107.7 | C187 | C187-P189 WeakPolarHBondContact O-CD 3.29Š| ||
| 190 | G | 29.7 | Very low | 34.7 | Very low | 56 Ų | 56 | 146.5 Ų | 146.5 | 58% | 0.577 | 76% | 0.763 | S | S | * | * | trans | 120.3 | 94.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 191 | K | 31.4 | Very low | 34.7 | Very low | 201 Ų | 201 | 145.6 Ų | 145.6 | 87% | 0.874 | 76% | 0.761 | S | S | * | * | -178.2 | 103.9 | 116.9 | -92.2 | 165.5 | -168.9 | -169.1 | 0 | 109.1 | |||||
| 192 | S | 31.8 | Very low | 34.4 | Very low | 113 Ų | 113 | 144.5 Ų | 144.5 | 79% | 0.79 | 76% | 0.761 | S | S | * | * | trans | 38.3 | 113.9 | 143 | 59.3 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 193 | Y | 29.8 | Very low | 34.7 | Very low | 227 Ų | 227 | 148 Ų | 148 | 89% | 0.89 | 77% | 0.771 | S | S | * | * | trans | -93.1 | 165.3 | 136.2 | -78.2 | -82.5 | 0 | 0 | 0 | 108.2 | ||||
| 194 | P | 42.1 | Very low | 34.7 | Very low | 118 Ų | 118 | 147.7 Ų | 147.7 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | cis | -133.9 | 167 | -11 | 32.9 | -14.1 | 0 | 0 | 0 | 113.3 | ||||
| 195 | D | 37 | Very low | 34.7 | Very low | 159 Ų | 159 | 147 Ų | 147 | 85% | 0.85 | 77% | 0.774 | S | S | * | * | trans | -146 | 149.6 | 144.5 | -145.8 | -4.7 | 0 | 0 | 0 | 113.8 | ||||
| 196 | R | 38.5 | Very low | 34.8 | Very low | 212 Ų | 212 | 147 Ų | 147 | 80% | 0.8 | 78% | 0.779 | S | S | * | * | trans | -78.9 | 149.8 | -166.4 | -74.1 | 167.5 | 162.2 | 178.5 | -3.2 | 112.8 | ||||
| 197 | K | 33.3 | Very low | 34.9 | Very low | 192 Ų | 192 | 146 Ų | 146 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | 56.9 | 112.8 | 147.7 | -66.4 | -177.8 | 179.9 | -172 | 0 | 117.6 | ||||
| 198 | K | 41 | Very low | 35 | Very low | 187 Ų | 187 | 149.1 Ų | 149.1 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | 179.6 | 128.5 | 121.8 | -99.4 | 165.5 | -177.4 | 179.5 | 0 | 112.8 | |||||
| 199 | N | 39.7 | Very low | 35.3 | Very low | 140 Ų | 140 | 147.6 Ų | 147.6 | 75% | 0.749 | 80% | 0.795 | S | S | * | * | trans | 82 | 108.1 | 138 | -56.6 | -11 | 0 | 0 | 0 | 121.6 | ||||
| 200 | H | 30.7 | Very low | 35.4 | Very low | 181 Ų | 181 | 148.6 Ų | 148.6 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | trans | -4.8 | 146 | 139.6 | -74.3 | -81.7 | 0 | 0 | 0 | 120.2 | ||||
| 201 | S | 36.1 | Very low | 35.6 | Very low | 104 Ų | 104 | 154.5 Ų | 154.5 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | 89.1 | 130.9 | 142.4 | 72.8 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 202 | T | 34.8 | Very low | 35.6 | Very low | 116 Ų | 116 | 156.9 Ų | 156.9 | 71% | 0.712 | 82% | 0.816 | S | S | * | * | trans | 66.3 | 92.2 | 157.4 | 35.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 203 | I | 40.3 | Very low | 35.9 | Very low | 167 Ų | 167 | 155.9 Ų | 155.9 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | trans | -115.2 | 94.1 | 138 | -63 | 176.7 | 0 | 0 | 0 | 107 | ||||
| 204 | K | 37.8 | Very low | 36.3 | Very low | 171 Ų | 171 | 151.6 Ų | 151.6 | 74% | 0.743 | 81% | 0.812 | S | S | * | * | trans | -74 | 140.3 | 155 | -79.3 | 178.5 | 174.5 | 176.9 | 0 | 107.6 | ||||
| 205 | N | 34 | Very low | 36 | Very low | 154 Ų | 154 | 153.2 Ų | 153.2 | 82% | 0.824 | 82% | 0.82 | S | S | * | * | trans | 48.6 | 97.5 | 148.3 | -61.7 | -11.5 | 0 | 0 | 0 | 118.9 | ||||
| 206 | S | 35.7 | Very low | 36 | Very low | 114 Ų | 114 | 150.5 Ų | 150.5 | 80% | 0.797 | 82% | 0.819 | S | S | * | * | trans | -174.5 | 80 | 144.9 | 40.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 207 | A | 34.5 | Very low | 35.9 | Very low | 103 Ų | 103 | 150.3 Ų | 150.3 | 85% | 0.851 | 83% | 0.825 | S | S | * | * | trans | -157.7 | 56 | 149.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 208 | I | 31.8 | Very low | 36.1 | Very low | 176 Ų | 176 | 150.1 Ų | 150.1 | 90% | 0.903 | 82% | 0.824 | S | S | * | * | trans | -107.2 | 95.7 | 159.3 | -60.6 | 174.6 | 0 | 0 | 0 | 105.2 | ||||
| 209 | A | 39.5 | Very low | 35.7 | Very low | 85 Ų | 85 | 147.7 Ų | 147.7 | 70% | 0.702 | 82% | 0.819 | S | S | * | * | trans | -151.9 | 116.9 | 166.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 210 | N | 32.9 | Very low | 35.7 | Very low | 145 Ų | 145 | 147.9 Ų | 147.9 | 78% | 0.775 | 83% | 0.826 | S | S | * | * | trans | 70.7 | 81.7 | 148.6 | -58.5 | -15.2 | 0 | 0 | 0 | 119.1 | ||||
| 211 | N | 34.6 | Very low | 35.7 | Very low | 179 Ų | 179 | 142.4 Ų | 142.4 | 96% | 0.957 | 82% | 0.818 | S | S | * | * | trans | -144.9 | 77 | 131.9 | -86.4 | -39.1 | 0 | 0 | 0 | 108.2 | ||||
| 212 | R | 31.7 | Very low | 35.8 | Very low | 251 Ų | 251 | 143 Ų | 143 | 95% | 0.947 | 82% | 0.822 | S | S | * | * | trans | -138.4 | 86.1 | 175.3 | -154.9 | -179.6 | -166.5 | 179.5 | 4 | 109.4 | ||||
| 213 | A | 39 | Very low | 35.7 | Very low | 93 Ų | 93 | 146 Ų | 146 | 77% | 0.769 | 83% | 0.828 | S | S | * | * | trans | -162.4 | 120.1 | 166 | 0 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 214 | T | 38 | Very low | 35.2 | Very low | 136 Ų | 136 | 143.7 Ų | 143.7 | 83% | 0.834 | 83% | 0.827 | S | S | * | * | cis | -155.1 | 124.8 | 23.7 | 29.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 215 | T | 35.5 | Very low | 35.1 | Very low | 153 Ų | 153 | 144.3 Ų | 144.3 | 94% | 0.939 | 83% | 0.83 | S | S | * | * | trans | -103 | 104.9 | 159 | 40.9 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 216 | A | 37.4 | Very low | 34.9 | Very low | 101 Ų | 101 | 142.2 Ų | 142.2 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | trans | -117.6 | 106 | 162.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 217 | K | 36.6 | Very low | 35 | Very low | 209 Ų | 209 | 141.3 Ų | 141.3 | 91% | 0.909 | 82% | 0.82 | S | S | * | * | trans | -97.6 | 113.6 | 168.6 | -111.3 | -176.2 | 178.3 | 179.9 | 0 | 107.4 | ||||
| 218 | K | 37 | Very low | 35 | Very low | 188 Ų | 188 | 143 Ų | 143 | 82% | 0.817 | 81% | 0.813 | S | S | * | * | -176.3 | 122.4 | 129.2 | -103.9 | 174.5 | -179.3 | -178.5 | 0 | 110.8 | |||||
| 219 | N | 33.1 | Very low | 34.9 | Very low | 135 Ų | 135 | 143.2 Ų | 143.2 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | 61.8 | 98.4 | 146.5 | -56.5 | -4.8 | 0 | 0 | 0 | 117.9 | ||||
| 220 | T | 38.6 | Very low | 34.6 | Very low | 145 Ų | 145 | 146.8 Ų | 146.8 | 89% | 0.89 | 81% | 0.814 | S | S | * | * | 157.6 | 136.1 | 109.1 | 41.9 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 221 | G | 30.6 | Very low | 34.9 | Very low | 65 Ų | 65 | 144.5 Ų | 144.5 | 67% | 0.67 | 82% | 0.816 | S | S | * | * | trans | 73.5 | 113.4 | 145.7 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 222 | S | 37.7 | Very low | 34.8 | Very low | 116 Ų | 116 | 144.2 Ų | 144.2 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | trans | 78.6 | 109.4 | 136.9 | 19.5 | 0 | 0 | 0 | 0 | 120 | ||||
| 223 | Q | 32.7 | Very low | 34.9 | Very low | 179 Ų | 179 | 136.7 Ų | 136.7 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | 75.1 | 77.2 | 144.7 | -54 | -156.6 | 3.3 | 0 | 0 | 118.9 | K225 | Q223-K225 PolarHBondContact O-N 3.27Š| ||
| 224 | S | 30.3 | Very low | 34.8 | Very low | 119 Ų | 119 | 140.6 Ų | 140.6 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -75.1 | 95.2 | 150.9 | 58.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 225 | K | 36.6 | Very low | 34.7 | Very low | 184 Ų | 184 | 143.3 Ų | 143.3 | 80% | 0.8 | 80% | 0.803 | S | S | * | * | trans | -89.9 | 88.3 | 147.2 | -80.8 | -173.8 | 180 | 178.1 | 0 | 107.3 | Q223 S227 | Q223-K225 PolarHBondContact O-N 3.27Å; K225-S227 PolarHBondContact O-N 3.05Å | ||
| 226 | C | 29.6 | Very low | 34.7 | Very low | 111 Ų | 111 | 140.8 Ų | 140.8 | 75% | 0.75 | 79% | 0.792 | S | S | * | * | trans | -76.1 | 79.9 | 163.1 | -165.7 | 0 | 0 | 0 | 0 | 107.1 | I228 | C226-I228 PolarHBondContact O-N 2.94Š| ||
| 227 | S | 38.4 | Very low | 34.4 | Very low | 95 Ų | 95 | 140.6 Ų | 140.6 | 66% | 0.664 | 79% | 0.79 | S | S | * | * | trans | -82.5 | 93.5 | 165.7 | 50.6 | 0 | 0 | 0 | 0 | 107.7 | K225 Q229 | K225-S227 PolarHBondContact O-N 3.05Å; S227-Q229 PolarHBondContact O-N 2.94Å | ||
| 228 | I | 32.5 | Very low | 34.4 | Very low | 137 Ų | 137 | 134.9 Ų | 134.9 | 70% | 0.703 | 78% | 0.782 | S | S | * | * | trans | -65.7 | 95.4 | 156.7 | -62.2 | 172.4 | 0 | 0 | 0 | 105.2 | C226 M230 | C226-I228 PolarHBondContact O-N 2.94Å; I228-M230 VanDerWaalsContact C-N 3.26Å; I228-M230 HydrophobicContact CG2-CG 4.36Å; I228-M230 PolarHBondContact O-N 2.99Å | ||
| 229 | Q | 31.6 | Very low | 34.3 | Very low | 182 Ų | 182 | 132.1 Ų | 132.1 | 85% | 0.85 | 78% | 0.78 | S | S | * | * | trans | -68.6 | 93.7 | 163 | -84.8 | -179.5 | -17.3 | 0 | 0 | 106.8 | S227 A231 | S227-Q229 PolarHBondContact O-N 2.94Å; Q229-A231 PolarHBondContact O-N 2.92Å | ||
| 230 | M | 31.7 | Very low | 34.4 | Very low | 159 Ų | 159 | 134 Ų | 134 | 78% | 0.783 | 79% | 0.785 | S | S | * | * | trans | -56.8 | 128.5 | 155.3 | -68.5 | -78.4 | -80 | 0 | 0 | 106.4 | I228 E232 | I228-M230 VanDerWaalsContact C-N 3.26Å; I228-M230 HydrophobicContact CG2-CG 4.36Å; I228-M230 PolarHBondContact O-N 2.99Å; M230-E232 PolarHBondContact O-N 2.98Å | ||
| 231 | A | 38.9 | Very low | 34.1 | Very low | 98 Ų | 98 | 134.4 Ų | 134.4 | 81% | 0.81 | 78% | 0.777 | S | S | * | * | trans | -57.5 | 115.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | Q229 A233 | Q229-A231 PolarHBondContact O-N 2.92Å; A231-A233 PolarHBondContact O-N 3.23Å | ||
| 232 | E | 34 | Very low | 34.2 | Very low | 173 Ų | 173 | 139.4 Ų | 139.4 | 81% | 0.808 | 79% | 0.788 | S | S | * | * | trans | -47.6 | 116.1 | 168.7 | -78.1 | 177.3 | 150.1 | 0 | 0 | 107.7 | M230 K234 | M230-E232 PolarHBondContact O-N 2.98Å; E232-K234 PolarHBondContact O-N 3.48Å | ||
| 233 | A | 34.1 | Very low | 34 | Very low | 93 Ų | 93 | 138.5 Ų | 138.5 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | -62.2 | 93.4 | 162.7 | 0 | 0 | 0 | 0 | 0 | 106.2 | A231 Q235 | A231-A233 PolarHBondContact O-N 3.23Å; A233-Q235 VanDerWaalsContact C-N 3.28Å; A233-Q235 PolarHBondContact O-N 3.33Å | ||
| 234 | K | 37.1 | Very low | 34.3 | Very low | 175 Ų | 175 | 140.8 Ų | 140.8 | 76% | 0.761 | 78% | 0.78 | S | S | * | * | trans | -57.9 | 102.6 | 161.7 | -73.2 | -171.6 | 175.8 | -173.9 | 0 | 106.2 | E232 S236 | E232-K234 PolarHBondContact O-N 3.48Å; K234-S236 PolarHBondContact O-N 2.91Å | ||
| 235 | Q | 34.4 | Very low | 34.5 | Very low | 193 Ų | 193 | 140 Ų | 140 | 90% | 0.902 | 78% | 0.775 | S | S | * | * | trans | -59.9 | 84.7 | 155.8 | -71.6 | 177.3 | -12.9 | 0 | 0 | 106.5 | A233 A237 | A233-Q235 VanDerWaalsContact C-N 3.28Å; A233-Q235 PolarHBondContact O-N 3.33Å; Q235-A237 PolarHBondContact O-N 2.96Å | ||
| 236 | S | 35.7 | Very low | 34.5 | Very low | 100 Ų | 100 | 140.6 Ų | 140.6 | 70% | 0.699 | 78% | 0.777 | S | S | * | * | trans | -79.1 | 95 | 163.4 | -66.7 | 0 | 0 | 0 | 0 | 106.8 | K234 A238 | K234-S236 PolarHBondContact O-N 2.91Å; S236-A238 PolarHBondContact O-N 2.98Å | ||
| 237 | A | 31.7 | Very low | 34.8 | Very low | 97 Ų | 97 | 142 Ų | 142 | 80% | 0.802 | 78% | 0.776 | S | S | * | * | trans | -59.6 | 97 | 149.8 | 0 | 0 | 0 | 0 | 0 | 107 | Q235 | Q235-A237 PolarHBondContact O-N 2.96Š| ||
| 238 | A | 36.7 | Very low | 34.6 | Very low | 89 Ų | 89 | 140 Ų | 140 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | trans | -104.5 | 82.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 107 | S236 E240 | S236-A238 PolarHBondContact O-N 2.98Å; A238-E240 PolarHBondContact O-N 3.46Å | ||
| 239 | T | 34.8 | Very low | 34.5 | Very low | 129 Ų | 129 | 141.9 Ų | 141.9 | 79% | 0.791 | 78% | 0.777 | S | S | * | * | trans | -53.3 | 113.7 | 141.5 | 25.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 240 | E | 34.6 | Very low | 34.8 | Very low | 174 Ų | 174 | 141.4 Ų | 141.4 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | trans | -175.8 | 103.7 | 150 | -101.3 | 167.6 | -158.3 | 0 | 0 | 109.9 | A238 | A238-E240 PolarHBondContact O-N 3.46Š| ||
| 241 | H | 31.9 | Very low | 35.1 | Very low | 155 Ų | 155 | 138.6 Ų | 138.6 | 72% | 0.718 | 78% | 0.775 | S | S | * | * | trans | 57.8 | 77.2 | 152.3 | -54.6 | -70.6 | 0 | 0 | 0 | 120.8 | ||||
| 242 | D | 32.2 | Very low | 34.8 | Very low | 169 Ų | 169 | 142.5 Ų | 142.5 | 90% | 0.904 | 78% | 0.777 | S | S | * | * | trans | -93.2 | 81.6 | 139.5 | -100.5 | -24.2 | 0 | 0 | 0 | 108.8 | ||||
| 243 | T | 34.6 | Very low | 35 | Very low | 98 Ų | 98 | 144.9 Ų | 144.9 | 60% | 0.601 | 78% | 0.778 | S | S | * | * | trans | -112.9 | 81.3 | 162.3 | 42.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 244 | Y | 38.3 | Very low | 35.2 | Very low | 227 Ų | 227 | 146.9 Ų | 146.9 | 89% | 0.89 | 78% | 0.776 | S | S | * | * | trans | -114.2 | 81.2 | 141.1 | -77.1 | -78.4 | 0 | 0 | 0 | 107.4 | F246 | Y244-F246 VanDerWaalsContact C-N 3.31Å; Y244-F246 PolarHBondContact O-N 3.26Å | ||
| 245 | S | 35.3 | Very low | 34.9 | Very low | 102 Ų | 102 | 147.3 Ų | 147.3 | 71% | 0.713 | 79% | 0.785 | S | S | * | * | trans | -61.6 | 99.4 | 153.9 | -76.4 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 246 | F | 37 | Very low | 34.9 | Very low | 196 Ų | 196 | 144.2 Ų | 144.2 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | trans | -102 | 86.2 | 152.1 | -140 | -90.2 | 0 | 0 | 0 | 106.7 | Y244 G248 | Y244-F246 VanDerWaalsContact C-N 3.31Å; Y244-F246 PolarHBondContact O-N 3.26Å; F246-G248 PolarHBondContact O-N 2.87Å | ||
| 247 | I | 35.3 | Very low | 34.7 | Very low | 141 Ų | 141 | 143.8 Ų | 143.8 | 72% | 0.723 | 78% | 0.782 | S | S | * | * | trans | -68.8 | 91.9 | 157.8 | -63.4 | 172.6 | 0 | 0 | 0 | 105 | E249 | I247-E249 HydrophobicContact CG2-CG 4.08Š| ||
| 248 | G | 34.8 | Very low | 35 | Very low | 54 Ų | 54 | 148.6 Ų | 148.6 | 56% | 0.557 | 79% | 0.788 | S | S | * | * | trans | -106.3 | 91.4 | 154.1 | 0 | 0 | 0 | 0 | 0 | 106.2 | F246 L250 | F246-G248 PolarHBondContact O-N 2.87Å; G248-L250 PolarHBondContact O-N 3.48Å | ||
| 249 | E | 30.7 | Very low | 34.7 | Very low | 176 Ų | 176 | 154 Ų | 154 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -49.9 | 108.6 | 164.5 | -71.2 | 175.2 | 146.9 | 0 | 0 | 108.9 | I247 | I247-E249 HydrophobicContact CG2-CG 4.08Š| ||
| 250 | L | 38 | Very low | 34.8 | Very low | 171 Ų | 171 | 152.9 Ų | 152.9 | 90% | 0.895 | 79% | 0.792 | S | S | * | * | trans | -119.3 | 82.3 | 154.1 | -76.7 | 176.5 | 0 | 0 | 0 | 107.1 | G248 | G248-L250 PolarHBondContact O-N 3.48Š| ||
| 251 | S | 37.8 | Very low | 34.9 | Very low | 100 Ų | 100 | 154.2 Ų | 154.2 | 70% | 0.699 | 80% | 0.795 | S | S | * | * | trans | 18.8 | 118.8 | 143.6 | -175.9 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 252 | E | 30.8 | Very low | 35.3 | Very low | 181 Ų | 181 | 152.3 Ų | 152.3 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | trans | -35.6 | 138.2 | 150.1 | -61.1 | 174.3 | 149.5 | 0 | 0 | 113 | ||||
| 253 | R | 38.9 | Very low | 35.6 | Very low | 223 Ų | 223 | 149.7 Ų | 149.7 | 84% | 0.842 | 79% | 0.792 | S | S | * | * | trans | 152.8 | 125.7 | 158.1 | -86.3 | 164.6 | -168 | -160.3 | 6.5 | 106.3 | ||||
| 254 | N | 38.2 | Very low | 35.8 | Very low | 135 Ų | 135 | 155.4 Ų | 155.4 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | cis | -155.3 | 130.6 | 8.2 | -91.2 | -34.8 | 0 | 0 | 0 | 107.9 | V256 | N254-V256 HydrophobicContact CB-CG2 4.46Å; N254-V256 PolarHBondContact O-N 3.32Å | ||
| 255 | L | 31.8 | Very low | 35.8 | Very low | 183 Ų | 183 | 153.1 Ų | 153.1 | 96% | 0.958 | 80% | 0.797 | S | S | * | * | trans | -65.7 | 108.8 | 150.4 | -83.7 | 147.6 | 0 | 0 | 0 | 107.6 | ||||
| 256 | V | 34.8 | Very low | 36.2 | Very low | 129 Ų | 129 | 157.3 Ų | 157.3 | 78% | 0.782 | 80% | 0.802 | S | S | * | * | trans | -133.9 | 124.7 | 154.3 | -179.8 | 0 | 0 | 0 | 0 | 108.5 | N254 | N254-V256 HydrophobicContact CB-CG2 4.46Å; N254-V256 PolarHBondContact O-N 3.32Å | ||
| 257 | A | 31.6 | Very low | 36.2 | Very low | 91 Ų | 91 | 159 Ų | 159 | 75% | 0.752 | 80% | 0.803 | S | S | * | * | trans | -60.7 | 142.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 258 | E | 36.5 | Very low | 36.3 | Very low | 198 Ų | 198 | 158.9 Ų | 158.9 | 93% | 0.925 | 81% | 0.808 | S | S | * | * | trans | -142.3 | 105.4 | 143.5 | -131.1 | -177.5 | -179.6 | 0 | 0 | 110.4 | ||||
| 259 | K | 31.7 | Very low | 36.4 | Very low | 202 Ų | 202 | 162.8 Ų | 162.8 | 88% | 0.878 | 82% | 0.816 | S | S | * | * | trans | -102.2 | 122.6 | 159.3 | -81.9 | -176.1 | 178 | 175.9 | 0 | 107.6 | ||||
| 260 | S | 36.4 | Very low | 36.6 | Very low | 105 Ų | 105 | 162.5 Ų | 162.5 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | trans | 169.2 | 149.5 | 132 | 60.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 261 | K | 35.9 | Very low | 36.4 | Very low | 203 Ų | 203 | 159.7 Ų | 159.7 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | cis | -168.3 | 171.4 | -7.4 | -107.4 | 173.9 | -172.4 | 177 | 0 | 106.2 | ||||
| 262 | P | 41.8 | Very low | 36.1 | Very low | 115 Ų | 115 | 163.2 Ų | 163.2 | 75% | 0.747 | 81% | 0.81 | S | S | * | * | trans | -98.5 | 161 | -166.2 | 37 | -32.9 | 0 | 0 | 0 | 116 | ||||
| 263 | S | 36.8 | Very low | 36.5 | Very low | 114 Ų | 114 | 165.7 Ų | 165.7 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | 122.7 | 130.3 | 137.3 | 81.3 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 264 | R | 39.7 | Very low | 36.7 | Very low | 217 Ų | 217 | 162.9 Ų | 162.9 | 82% | 0.819 | 81% | 0.813 | S | S | * | * | trans | 56 | 113.4 | 141.1 | -82.3 | -178.5 | 167 | 174 | -3.2 | 123.2 | ||||
| 265 | K | 38.8 | Very low | 37 | Very low | 179 Ų | 179 | 161.8 Ų | 161.8 | 78% | 0.778 | 81% | 0.814 | S | S | * | * | 72.5 | 137.7 | 123.7 | -74.5 | -172 | 177.1 | -176.5 | 0 | 122.5 | |||||
| 266 | K | 42.2 | Very low | 37 | Very low | 191 Ų | 191 | 159.9 Ų | 159.9 | 83% | 0.83 | 81% | 0.809 | S | S | * | * | trans | 81.1 | 107.6 | 154.5 | -81.6 | -177.5 | 172.1 | -179 | 0 | 116.9 | ||||
| 267 | R | 37 | Very low | 37.3 | Very low | 231 Ų | 231 | 158.6 Ų | 158.6 | 87% | 0.872 | 81% | 0.806 | S | S | * | * | 74.5 | 116.2 | 86.2 | -112.4 | -171.5 | 162.2 | -165.8 | -4.2 | 112.2 | |||||
| 268 | V | 38.1 | Very low | 37.9 | Very low | 138 Ų | 138 | 160 Ų | 160 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | -174 | 146.7 | 115.6 | 168.1 | 0 | 0 | 0 | 0 | 109.2 | |||||
| 269 | N | 36.9 | Very low | 37.9 | Very low | 136 Ų | 136 | 159 Ų | 159 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | -61 | 177.2 | -176.6 | -52.5 | -38.8 | 0 | 0 | 0 | 113.5 | ||||
| 270 | Q | 34.5 | Very low | 38 | Very low | 171 Ų | 171 | 155.2 Ų | 155.2 | 80% | 0.799 | 80% | 0.799 | S | S | * | * | cis | 175.7 | 167.3 | 35.6 | -152.8 | 174 | 17.4 | 0 | 0 | 109.8 | ||||
| 271 | V | 34.9 | Very low | 38.1 | Very low | 112 Ų | 112 | 154.7 Ų | 154.7 | 68% | 0.679 | 80% | 0.801 | S | S | * | * | trans | 81 | 98 | 157.1 | -170.6 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 272 | E | 31.8 | Very low | 37.9 | Very low | 173 Ų | 173 | 151.7 Ų | 151.7 | 81% | 0.808 | 79% | 0.794 | S | S | * | * | 85.3 | 116.8 | 81.5 | -160.9 | -177.1 | -150 | 0 | 0 | 113.9 | |||||
| 273 | R | 37.3 | Very low | 37.9 | Very low | 234 Ų | 234 | 152.6 Ų | 152.6 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | 171.4 | 111.9 | 135 | -92.6 | 169.7 | -167.5 | -156.8 | 4.6 | 110.2 | ||||
| 274 | N | 44.3 | Very low | 37.6 | Very low | 163 Ų | 163 | 158.1 Ų | 158.1 | 87% | 0.872 | 80% | 0.801 | S | S | * | * | trans | -79.1 | 149.9 | 149.6 | -81.3 | -29.2 | 0 | 0 | 0 | 107.9 | ||||
| 275 | P | 43.7 | Very low | 37.3 | Very low | 113 Ų | 113 | 159.4 Ų | 159.4 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | -149.8 | 144 | 117.3 | 26.5 | -4.8 | 0 | 0 | 0 | 117.1 | |||||
| 276 | V | 32.5 | Very low | 37.2 | Very low | 142 Ų | 142 | 155.9 Ų | 155.9 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | trans | 83 | 129.6 | 133.5 | -178.5 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 277 | S | 40.3 | Very low | 36.8 | Very low | 102 Ų | 102 | 153.6 Ų | 153.6 | 71% | 0.713 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 147.9 | 172.2 | -172.6 | 0 | 0 | 0 | 0 | 111.6 | ||
| 278 | P | 45.1 | Very low | 37 | Very low | 122 Ų | 122 | 147.9 Ų | 147.9 | 79% | 0.792 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -98.4 | 122.6 | 162.8 | 23.9 | -9.3 | 0 | 0 | 0 | 112 | ||
| 279 | M | 36.5 | Very low | 37.1 | Very low | 177 Ų | 177 | 151.4 Ų | 151.4 | 87% | 0.872 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 140.9 | 162.3 | -79.3 | 172.3 | 69.3 | 0 | 0 | 112.1 | ||
| 280 | V | 33.5 | Very low | 37 | Very low | 121 Ų | 121 | 149.2 Ų | 149.2 | 73% | 0.733 | 81% | 0.806 | S | S | * | * | trans | 0.1 | 126.1 | 146.8 | -172.2 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 281 | A | 39.6 | Very low | 37.3 | Very low | 94 Ų | 94 | 148.1 Ų | 148.1 | 78% | 0.777 | 81% | 0.805 | S | S | * | * | trans | -107.8 | 117.7 | 146.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | T283 | A281-T283 PolarHBondContact O-N 2.91Š| ||
| 282 | D | 31.2 | Very low | 38 | Very low | 140 Ų | 140 | 154 Ų | 154 | 75% | 0.749 | 82% | 0.815 | S | S | * | * | trans | -65.1 | 109.9 | 167.8 | -106.1 | -40.8 | 0 | 0 | 0 | 109.5 | ||||
| 283 | T | 41.4 | Very low | 38.6 | Very low | 134 Ų | 134 | 151.9 Ų | 151.9 | 82% | 0.822 | 82% | 0.816 | S | S | * | * | trans | -131 | 98 | 153.8 | 38.3 | 0 | 0 | 0 | 0 | 108.8 | A281 R285 | A281-T283 PolarHBondContact O-N 2.91Å; T283-R285 PolarHBondContact O-N 3.15Å | ||
| 284 | R | 29.4 | Very low | 39.1 | Very low | 230 Ų | 230 | 152.2 Ų | 152.2 | 87% | 0.868 | 82% | 0.817 | S | S | * | * | trans | -59.3 | 111.4 | 162.8 | -64.4 | 179.4 | 177.1 | -164.3 | -1.2 | 108.9 | ||||
| 285 | R | 34.5 | Very low | 39 | Very low | 245 Ų | 245 | 154 Ų | 154 | 93% | 0.925 | 82% | 0.817 | S | S | * | * | trans | 168.8 | 133.1 | 138.4 | -95.5 | 165.3 | -178.5 | -169.4 | 0.8 | 111.5 | T283 | T283-R285 PolarHBondContact O-N 3.15Š| ||
| 286 | S | 37.1 | Very low | 38.8 | Very low | 105 Ų | 105 | 160.2 Ų | 160.2 | 73% | 0.734 | 83% | 0.826 | S | S | * | * | trans | 81.1 | 99 | 156.6 | -157.3 | 0 | 0 | 0 | 0 | 118.6 | V288 | S286-V288 PolarHBondContact O-N 3.45Š| ||
| 287 | T | 34.3 | Very low | 39.1 | Very low | 143 Ų | 143 | 159 Ų | 159 | 88% | 0.877 | 82% | 0.819 | S | S | * | * | trans | -65.8 | 102.9 | 159 | 42.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 288 | V | 39.7 | Very low | 39.4 | Very low | 110 Ų | 110 | 159.1 Ų | 159.1 | 67% | 0.667 | 82% | 0.82 | S | S | * | * | trans | -147.9 | 111.2 | 162 | -177.1 | 0 | 0 | 0 | 0 | 108.9 | S286 | S286-V288 PolarHBondContact O-N 3.45Š| ||
| 289 | Y | 41.9 | Very low | 39.3 | Very low | 212 Ų | 212 | 163.4 Ų | 163.4 | 83% | 0.831 | 82% | 0.822 | S | S | * | * | trans | 38.3 | 111.2 | 167.2 | -61.9 | -80.1 | 0 | 0 | 0 | 120 | L291 | Y289-L291 PolarHBondContact O-N 2.99Š| ||
| 290 | G | 34.1 | Very low | 39.5 | Very low | 91 Ų | 91 | 162.5 Ų | 162.5 | 94% | 0.938 | 82% | 0.819 | S | S | * | * | trans | -64.1 | 86.5 | 168.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 291 | L | 41 | Very low | 39.5 | Very low | 147 Ų | 147 | 164.6 Ų | 164.6 | 77% | 0.77 | 83% | 0.826 | S | S | * | * | trans | -91.7 | 112.1 | 160.7 | -70.1 | 170.8 | 0 | 0 | 0 | 108.9 | Y289 | Y289-L291 PolarHBondContact O-N 2.99Š| ||
| 292 | R | 48.6 | Very low | 39.5 | Very low | 237 Ų | 237 | 171.1 Ų | 171.1 | 89% | 0.894 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -61 | 138.3 | 168.4 | -80.6 | -178 | 176 | 176.2 | -0.9 | 109.6 | R294 | R292-R294 PolarHBondContact O-N 3.17Š|
| 293 | P | 45.6 | Very low | 39.9 | Very low | 127 Ų | 127 | 172.7 Ų | 172.7 | 83% | 0.825 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 124.4 | 174 | -15.7 | 27.7 | 0 | 0 | 0 | 110.4 | K295 | P293-K295 PolarHBondContact O-N 3.37Š|
| 294 | R | 46.6 | Very low | 39.8 | Very low | 242 Ų | 242 | 174.7 Ų | 174.7 | 91% | 0.913 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 126.3 | 166.2 | -87.3 | -179.1 | 156.8 | 173.4 | -6.3 | 108.3 | R292 R296 | R292-R294 PolarHBondContact O-N 3.17Å; R294-R296 PolarHBondContact O-N 3.09Å |
| 295 | K | 42.1 | Very low | 40.4 | Very low | 200 Ų | 200 | 171.7 Ų | 171.7 | 87% | 0.87 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 125.4 | 167.8 | -74.6 | -173.7 | 174.3 | -175.1 | 0 | 108.6 | P293 V297 | P293-K295 PolarHBondContact O-N 3.37Å; K295-V297 PolarHBondContact O-N 3.22Å |
| 296 | R | 39.4 | Very low | 40.7 | Very low | 244 Ų | 244 | 167.4 Ų | 167.4 | 92% | 0.921 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 118.1 | 169.1 | -72.8 | -178.5 | 169.3 | -171.2 | -4.1 | 108 | R294 S298 | R294-R296 PolarHBondContact O-N 3.09Å; R296-S298 PolarHBondContact O-N 3.46Å |
| 297 | V | 39.5 | Very low | 41 | Very low | 116 Ų | 116 | 171.3 Ų | 171.3 | 70% | 0.703 | 85% | 0.854 | S | S | * | * | trans | -79.1 | 107.4 | 163.3 | -179.4 | 0 | 0 | 0 | 0 | 105.2 | K295 Y299 | K295-V297 PolarHBondContact O-N 3.22Å; V297-Y299 PolarHBondContact O-N 2.95Å | ||
| 298 | S | 46.3 | Very low | 41.4 | Very low | 105 Ų | 105 | 173.1 Ų | 173.1 | 73% | 0.734 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 117.3 | 165.1 | 47.1 | 0 | 0 | 0 | 0 | 107.6 | R296 L300 | R296-S298 PolarHBondContact O-N 3.46Å; S298-L300 PolarHBondContact O-N 3Å |
| 299 | Y | 44 | Very low | 41.5 | Very low | 212 Ų | 212 | 177.6 Ų | 177.6 | 83% | 0.831 | 87% | 0.866 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 124.2 | 163.1 | -69 | -86.3 | 0 | 0 | 0 | 107.3 | V297 | V297-Y299 PolarHBondContact O-N 2.95Š|
| 300 | L | 40.7 | Very low | 41.5 | Very low | 158 Ų | 158 | 175 Ų | 175 | 83% | 0.827 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 125.7 | 163.2 | -93.6 | 152.5 | 0 | 0 | 0 | 106.7 | S298 I302 | S298-L300 PolarHBondContact O-N 3Å; L300-I302 PolarHBondContact O-N 3.41Å |
| 301 | D | 33.6 | Very low | 42.1 | Very low | 164 Ų | 164 | 182 Ų | 182 | 88% | 0.877 | 86% | 0.863 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 119.6 | 168.2 | -70.5 | -39.1 | 0 | 0 | 0 | 109.3 | ||
| 302 | I | 38.3 | Very low | 42.2 | Very low | 232 Ų | 232 | 185.2 Ų | 185.2 | 100% | 1.19 | 87% | 0.871 | S | S | * | * | trans | -128.8 | 0 | 161 | -60.5 | 176.4 | 0 | 0 | 0 | 106.3 | L300 | L300-I302 PolarHBondContact O-N 3.41Š|
Retrieved 302 of 302 residues in 56.8 ms
(Link to these results)