| 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 | E | 58.3 | Low | 78.2 | Confident | 191 Ų | 191 | 119.1 Ų | 119.1 | 89% | 0.893 | 58% | 0.578 | S | S | * | * | 0 | -105.4 | 0 | -59.3 | -165.7 | -168.7 | 0 | 0 | 115.1 | R3 E4 R5 | E1-R3 PolarHBondContact O-N 3.35Å; E1-E4 PolarHBondContact N-OE2 2.75Å; E1-E4 WeakPolarHBondContact O-CA 3.37Å; E1-E4 WeakPolarHBondContact O-CB 3.42Å; E1-E4 PolarHBondContact O-N 2.91Å; E1-R5 PolarHBondContact O-N 3.45Å | |||
| 2 | G | 67.1 | Low | 79.5 | Confident | 63 Ų | 63 | 113.8 Ų | 113.8 | 65% | 0.649 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -53.2 | -59.3 | -166 | 0 | 0 | 0 | 0 | 0 | 115.6 | E4 R5 E6 | G2-E4 PolarHBondContact O-N 2.72Å; G2-E4 VanDerWaalsContact O-N 3.09Å; G2-R5 PolarHBondContact O-N 2.89Å; G2-E6 PolarHBondContact O-N 3.25Å; G2-E6 VanDerWaalsContact O-N 3.12Å |
| 3 | R | 70.4 | Confident | 80.6 | Confident | 204 Ų | 204 | 106.5 Ų | 106.5 | 77% | 0.77 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.3 | -17.7 | 175.6 | -170 | -175 | -65.4 | 151.7 | -0.2 | 113.8 | E1 R7 | E1-R3 PolarHBondContact O-N 3.35Å; R3-R7 WeakPolarHBondContact O-CG 3.24Å; R3-R7 PolarHBondContact O-N 2.76Å |
| 4 | E | 73.8 | Confident | 81.6 | Confident | 106 Ų | 106 | 106.3 Ų | 106.3 | 50% | 0.495 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -90.2 | -46 | -176.2 | -170.7 | 164.1 | -129.6 | 0 | 0 | 110.6 | E1 G2 E6 R7 C8 | E1-E4 PolarHBondContact N-OE2 2.75Å; E1-E4 WeakPolarHBondContact O-CA 3.37Å; E1-E4 WeakPolarHBondContact O-CB 3.42Å; E1-E4 PolarHBondContact O-N 2.91Å; G2-E4 PolarHBondContact O-N 2.72Å; G2-E4 VanDerWaalsContact O-N 3.09Å; E4-E6 PolarHBondContact O-N 3.33Å; E4-R7 PolarHBondContact O-N 3.41Å; E4-C8 PolarHBondContact O-N 2.92Å; E4-C8 PolarHBondContact O-SG 3.01Å; E4-C8 VanDerWaalsContact O-SG 3.34Å |
| 5 | R | 77.9 | Confident | 82.6 | Confident | 195 Ų | 195 | 104.5 Ų | 104.5 | 74% | 0.736 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -55.5 | -36.2 | 167 | -171.9 | 178.9 | -67.6 | -146.1 | 1 | 111.5 | E1 G2 C8 K9 | E1-R5 PolarHBondContact O-N 3.45Å; G2-R5 PolarHBondContact O-N 2.89Å; R5-C8 PolarHBondContact O-N 2.85Å; R5-K9 PolarHBondContact O-N 3.35Å |
| 6 | E | 76.8 | Confident | 83.5 | Confident | 78 Ų | 78 | 98 Ų | 98 | 36% | 0.364 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -68.1 | -39.8 | 174.1 | -178.2 | 154.1 | -122.3 | 0 | 0 | 113.5 | G2 E4 C8 K9 M10 R94 | G2-E6 PolarHBondContact O-N 3.25Å; G2-E6 VanDerWaalsContact O-N 3.12Å; E4-E6 PolarHBondContact O-N 3.33Å; E6-C8 VanDerWaalsContact C-N 3.34Å; E6-K9 PolarHBondContact O-N 3.36Å; E6-M10 WeakPolarHBondContact O-CG 3.37Å; E6-M10 PolarHBondContact O-N 2.81Å; E6-R94 IonicContact OE1-CZ 2.61Å; E6-R94 IonicContact OE1-NE 2.63Å; E6-R94 PolarHBondContact OE1-NE 3.35Å; E6-R94 IonicContact OE1-NH2 2.62Å; E6-R94 PolarHBondContact OE1-NH2 2.98Å |
| 7 | R | 82 | Confident | 84.2 | Confident | 162 Ų | 162 | 96.5 Ų | 96.5 | 61% | 0.611 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -65.1 | -37.6 | 172.7 | -75 | -173.8 | -60.8 | -165.2 | 5.4 | 112.1 | R3 E4 M10 A11 | R3-R7 WeakPolarHBondContact O-CG 3.24Å; R3-R7 PolarHBondContact O-N 2.76Å; E4-R7 PolarHBondContact O-N 3.41Å; R7-M10 PolarHBondContact O-N 3.23Å; R7-A11 PolarHBondContact O-N 3.26Å |
| 8 | C | 83.6 | Confident | 84.9 | Confident | 80 Ų | 80 | 96.8 Ų | 96.8 | 54% | 0.541 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.3 | -49.2 | 171.3 | -61.6 | 0 | 0 | 0 | 0 | 111.1 | E4 R5 E6 M10 A11 E12 | E4-C8 PolarHBondContact O-N 2.92Å; E4-C8 PolarHBondContact O-SG 3.01Å; E4-C8 VanDerWaalsContact O-SG 3.34Å; R5-C8 PolarHBondContact O-N 2.85Å; E6-C8 VanDerWaalsContact C-N 3.34Å; C8-M10 VanDerWaalsContact C-N 3.27Å; C8-M10 PolarHBondContact O-N 2.88Å; C8-A11 PolarHBondContact O-N 3.16Å; C8-A11 VanDerWaalsContact O-N 3.14Å; C8-E12 VanDerWaalsContact O-CB 3.3Å; C8-E12 WeakPolarHBondContact O-CB 3.32Å; C8-E12 PolarHBondContact O-N 3.47Å |
| 9 | K | 87.3 | Confident | 85.4 | Confident | 77 Ų | 77 | 98.6 Ų | 98.6 | 34% | 0.335 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.2 | -27.8 | 177.3 | -73.6 | -157.5 | 167.4 | -143.2 | 0 | 114.6 | R5 E6 L13 | R5-K9 PolarHBondContact O-N 3.35Å; E6-K9 PolarHBondContact O-N 3.36Å; K9-L13 WeakPolarHBondContact O-CB 3.26Å; K9-L13 PolarHBondContact O-N 3Å; K9-L13 VanDerWaalsContact O-N 3.11Å |
| 10 | M | 90.3 | Very high | 86 | Confident | 92 Ų | 92 | 97.1 Ų | 97.1 | 45% | 0.453 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -73.8 | -40.6 | 172.6 | -74.2 | -68.6 | -175.5 | 0 | 0 | 112 | E6 R7 C8 L13 Q14 Q91 | E6-M10 WeakPolarHBondContact O-CG 3.37Å; E6-M10 PolarHBondContact O-N 2.81Å; R7-M10 PolarHBondContact O-N 3.23Å; C8-M10 VanDerWaalsContact C-N 3.27Å; C8-M10 PolarHBondContact O-N 2.88Å; M10-L13 PolarHBondContact O-N 2.67Å; M10-Q14 PolarHBondContact O-N 2.91Å; M10-Q91 HydrophobicContact CE-CG 4.33Å; M10-Q91 PolarHBondContact SD-NE2 2.83Å |
| 11 | A | 92.7 | Very high | 86.5 | Confident | 62 Ų | 62 | 94 Ų | 94 | 51% | 0.512 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.8 | -40.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | R7 C8 Q14 M15 | R7-A11 PolarHBondContact O-N 3.26Å; C8-A11 PolarHBondContact O-N 3.16Å; C8-A11 VanDerWaalsContact O-N 3.14Å; A11-Q14 PolarHBondContact O-N 3.3Å; A11-M15 WeakPolarHBondContact O-CB 3.22Å; A11-M15 PolarHBondContact O-N 2.98Å |
| 12 | E | 93.7 | Very high | 88.4 | Confident | 56 Ų | 56 | 87 Ų | 87 | 26% | 0.262 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -57.3 | -47.3 | 172.5 | -172.5 | -176.1 | 179.1 | 0 | 0 | 111.3 | C8 Q14 M15 L16 Q83 I87 | C8-E12 VanDerWaalsContact O-CB 3.3Å; C8-E12 WeakPolarHBondContact O-CB 3.32Å; C8-E12 PolarHBondContact O-N 3.47Å; E12-Q14 PolarHBondContact O-N 3.42Å; E12-M15 PolarHBondContact O-N 3.05Å; E12-L16 HydrophobicContact CG-CD1 4.43Å; E12-L16 WeakPolarHBondContact O-CB 3.36Å; E12-L16 WeakPolarHBondContact O-CD1 3.23Å; E12-L16 WeakPolarHBondContact O-CG 3.33Å; E12-L16 PolarHBondContact O-N 2.81Å; E12-Q83 PolarHBondContact OE1-NE2 2.81Å; E12-I87 HydrophobicContact CB-CD1 4.3Å; E12-I87 HydrophobicContact CG-CD1 3.7Å |
| 13 | L | 94.6 | Very high | 89.8 | Confident | 18 Ų | 18 | 85.8 Ų | 85.8 | 9% | 0.094 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61.6 | -42 | 174.4 | -171.7 | 73.4 | 0 | 0 | 0 | 112.4 | K9 M10 L16 L17 L84 I87 Q88 | K9-L13 WeakPolarHBondContact O-CB 3.26Å; K9-L13 PolarHBondContact O-N 3Å; K9-L13 VanDerWaalsContact O-N 3.11Å; M10-L13 PolarHBondContact O-N 2.67Å; L13-L16 PolarHBondContact O-N 3.47Å; L13-L17 HydrophobicContact CD2-CD1 4.5Å; L13-L17 HydrophobicContact CG-CD1 4.08Å; L13-L17 WeakPolarHBondContact O-CB 3.39Å; L13-L17 WeakPolarHBondContact O-CG 3.48Å; L13-L17 PolarHBondContact O-N 3.15Å; L13-L84 HydrophobicContact CD1-CD1 3.51Å; L13-L84 HydrophobicContact CD1-CG 4.15Å; L13-L84 HydrophobicContact CG-CD1 4.45Å; L13-I87 HydrophobicContact CB-CG2 4.05Å; L13-I87 HydrophobicContact CD1-CB 4.13Å; L13-I87 HydrophobicContact CD1-CG2 3.96Å; L13-I87 HydrophobicContact CG-CG2 4.42Å; L13-Q88 HydrophobicContact CD1-CG 4.02Å |
| 14 | Q | 94.6 | Very high | 91.1 | Very high | 104 Ų | 104 | 77 Ų | 77 | 49% | 0.486 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -65.1 | -44.6 | 179.8 | -161.7 | 70.9 | 38.5 | 0 | 0 | 111.4 | M10 A11 E12 L16 L17 D18 | M10-Q14 PolarHBondContact O-N 2.91Å; A11-Q14 PolarHBondContact O-N 3.3Å; E12-Q14 PolarHBondContact O-N 3.42Å; Q14-L16 PolarHBondContact O-N 3.38Å; Q14-L17 PolarHBondContact O-N 2.79Å; Q14-D18 PolarHBondContact NE2-OD1 2.9Å; Q14-D18 PolarHBondContact NE2-OD2 3.49Å; Q14-D18 WeakPolarHBondContact O-CB 3.36Å; Q14-D18 PolarHBondContact O-N 2.74Å |
| 15 | M | 95.9 | Very high | 92.2 | Very high | 80 Ų | 80 | 78.7 Ų | 78.7 | 39% | 0.394 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.3 | -42.8 | 176.6 | -174.3 | -177.3 | 77.3 | 0 | 0 | 111.8 | A11 E12 E19 E20 | A11-M15 WeakPolarHBondContact O-CB 3.22Å; A11-M15 PolarHBondContact O-N 2.98Å; E12-M15 PolarHBondContact O-N 3.05Å; M15-E19 WeakPolarHBondContact O-CB 3.14Å; M15-E19 PolarHBondContact O-N 2.95Å; M15-E19 VanDerWaalsContact O-N 3.09Å; M15-E20 HydrophobicContact CG-CG 4.2Å; M15-E20 PolarHBondContact O-N 3.3Å |
| 16 | L | 96.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 77 Ų | 77 | 0% | 0 | 39% | 0.386 | C | S | . | . | I | π-helix | trans | -62.1 | -44 | 174.5 | -75.4 | 163.4 | 0 | 0 | 0 | 112.4 | E12 L13 Q14 E20 I21 N80 Q83 L84 I87 | E12-L16 HydrophobicContact CG-CD1 4.43Å; E12-L16 WeakPolarHBondContact O-CB 3.36Å; E12-L16 WeakPolarHBondContact O-CD1 3.23Å; E12-L16 WeakPolarHBondContact O-CG 3.33Å; E12-L16 PolarHBondContact O-N 2.81Å; L13-L16 PolarHBondContact O-N 3.47Å; Q14-L16 PolarHBondContact O-N 3.38Å; L16-E20 VanDerWaalsContact CD2-OE2 3.26Å; L16-E20 WeakPolarHBondContact CD2-OE2 3.14Å; L16-I21 HydrophobicContact CB-CD1 4.29Å; L16-I21 VanDerWaalsContact O-CB 3.23Å; L16-I21 WeakPolarHBondContact O-CB 3.4Å; L16-I21 VanDerWaalsContact O-CG1 3.27Å; L16-I21 WeakPolarHBondContact O-CG1 3.42Å; L16-I21 PolarHBondContact O-N 2.77Å; L16-N80 HydrophobicContact CD2-CB 3.66Å; L16-Q83 HydrophobicContact CD1-CB 4.29Å; L16-Q83 HydrophobicContact CD1-CG 3.93Å; L16-L84 HydrophobicContact CB-CD1 3.8Å; L16-L84 HydrophobicContact CD1-CB 4.5Å; L16-I87 HydrophobicContact CD1-CD1 3.78Å |
| 17 | L | 95.9 | Very high | 94.1 | Very high | 73 Ų | 73 | 75 Ų | 75 | 38% | 0.382 | 38% | 0.383 | S | S | . | . | I | π-helix | trans | -72.8 | -46.6 | -177.3 | -74.6 | 172.8 | 0 | 0 | 0 | 114 | L13 Q14 P22 L84 | L13-L17 HydrophobicContact CD2-CD1 4.5Å; L13-L17 HydrophobicContact CG-CD1 4.08Å; L13-L17 WeakPolarHBondContact O-CB 3.39Å; L13-L17 WeakPolarHBondContact O-CG 3.48Å; L13-L17 PolarHBondContact O-N 3.15Å; Q14-L17 PolarHBondContact O-N 2.79Å; L17-P22 VanDerWaalsContact O-CD 3.25Å; L17-P22 WeakPolarHBondContact O-CD 3.46Å; L17-P22 WeakPolarHBondContact O-CG 3.5Å; L17-L84 HydrophobicContact CD2-CD1 3.55Å; L17-L84 HydrophobicContact CD2-CD2 4.08Å; L17-L84 HydrophobicContact CD2-CG 4.41Å; L17-L84 HydrophobicContact CG-CD1 3.62Å |
| 18 | D | 96.1 | Very high | 94.8 | Very high | 101 Ų | 101 | 70.1 Ų | 70.1 | 54% | 0.54 | 37% | 0.368 | S | S | . | . | I | π-helix | trans | -89.9 | -35.5 | -170.1 | -69 | -9.1 | 0 | 0 | 0 | 112.5 | Q14 | Q14-D18 PolarHBondContact NE2-OD1 2.9Å; Q14-D18 PolarHBondContact NE2-OD2 3.49Å; Q14-D18 WeakPolarHBondContact O-CB 3.36Å; Q14-D18 PolarHBondContact O-N 2.74Å |
| 19 | E | 95.6 | Very high | 95.4 | Very high | 132 Ų | 132 | 70 Ų | 70 | 62% | 0.617 | 37% | 0.365 | S | S | * | . | I | π-helix | trans | -111.5 | -63.9 | -170.9 | -60.5 | -167.9 | 175.3 | 0 | 0 | 112.4 | M15 A23 | M15-E19 WeakPolarHBondContact O-CB 3.14Å; M15-E19 PolarHBondContact O-N 2.95Å; M15-E19 VanDerWaalsContact O-N 3.09Å; E19-A23 WeakPolarHBondContact O-CB 3.35Å; E19-A23 PolarHBondContact O-N 3.22Å |
| 20 | E | 96.6 | Very high | 95.8 | Very high | 68 Ų | 68 | 71.7 Ų | 71.7 | 32% | 0.318 | 37% | 0.374 | S | S | . | . | I | π-helix | trans | -73.6 | -50.3 | -163.8 | -62.6 | -169.6 | 144.2 | 0 | 0 | 114.3 | M15 L16 A23 G24 N80 | M15-E20 HydrophobicContact CG-CG 4.2Å; M15-E20 PolarHBondContact O-N 3.3Å; L16-E20 VanDerWaalsContact CD2-OE2 3.26Å; L16-E20 WeakPolarHBondContact CD2-OE2 3.14Å; E20-A23 PolarHBondContact O-N 3Å; E20-G24 PolarHBondContact O-N 3.11Å; E20-N80 PolarHBondContact OE2-ND2 3.33Å |
| 21 | I | 97.5 | Very high | 96.2 | Very high | 31 Ų | 31 | 67.6 Ų | 67.6 | 16% | 0.159 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.8 | -42.2 | 178.9 | -64 | 170.3 | 0 | 0 | 0 | 110.5 | L16 A23 K25 L77 N80 V81 L84 | L16-I21 HydrophobicContact CB-CD1 4.29Å; L16-I21 VanDerWaalsContact O-CB 3.23Å; L16-I21 WeakPolarHBondContact O-CB 3.4Å; L16-I21 VanDerWaalsContact O-CG1 3.27Å; L16-I21 WeakPolarHBondContact O-CG1 3.42Å; L16-I21 PolarHBondContact O-N 2.77Å; I21-A23 VanDerWaalsContact C-N 3.35Å; I21-A23 PolarHBondContact O-N 3.46Å; I21-K25 VanDerWaalsContact O-CB 3.27Å; I21-K25 WeakPolarHBondContact O-CB 3.41Å; I21-K25 PolarHBondContact O-N 3.49Å; I21-L77 HydrophobicContact CB-CD1 4.34Å; I21-L77 HydrophobicContact CG2-CD1 3.93Å; I21-N80 HydrophobicContact CG1-CB 3.97Å; I21-V81 HydrophobicContact CD1-CG2 4.02Å; I21-V81 HydrophobicContact CG1-CG2 4.3Å; I21-V81 HydrophobicContact CG2-CG2 4.21Å; I21-L84 HydrophobicContact CD1-CB 4.01Å; I21-L84 HydrophobicContact CD1-CD1 4.13Å; I21-L84 HydrophobicContact CD1-CD2 3.94Å; I21-L84 HydrophobicContact CD1-CG 4.25Å |
| 22 | P | 98 | Very high | 96.3 | Very high | 45 Ų | 45 | 72.8 Ų | 72.8 | 29% | 0.292 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -61.9 | -35.1 | 169.7 | -26.9 | 37.9 | 0 | 0 | 0 | 114.2 | L17 R26 | L17-P22 VanDerWaalsContact O-CD 3.25Å; L17-P22 WeakPolarHBondContact O-CD 3.46Å; L17-P22 WeakPolarHBondContact O-CG 3.5Å; P22-R26 WeakPolarHBondContact O-CB 3.47Å; P22-R26 VanDerWaalsContact O-CG 3.3Å; P22-R26 WeakPolarHBondContact O-CG 3.29Å; P22-R26 PolarHBondContact O-N 3.13Å; P22-R26 PolarHBondContact O-NE 2.88Å |
| 23 | A | 96.7 | Very high | 96.5 | Very high | 37 Ų | 37 | 75.1 Ų | 75.1 | 31% | 0.306 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -70.1 | -48.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | E19 E20 I21 K25 R26 A27 | E19-A23 WeakPolarHBondContact O-CB 3.35Å; E19-A23 PolarHBondContact O-N 3.22Å; E20-A23 PolarHBondContact O-N 3Å; I21-A23 VanDerWaalsContact C-N 3.35Å; I21-A23 PolarHBondContact O-N 3.46Å; A23-K25 VanDerWaalsContact C-N 3.31Å; A23-K25 PolarHBondContact O-N 3.26Å; A23-R26 PolarHBondContact O-N 2.92Å; A23-R26 VanDerWaalsContact O-N 3.13Å; A23-A27 WeakPolarHBondContact O-CB 3.47Å; A23-A27 PolarHBondContact O-N 3.03Å |
| 24 | G | 96.9 | Very high | 96.6 | Very high | 21 Ų | 21 | 76.6 Ų | 76.6 | 22% | 0.216 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -59.6 | -41.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | E20 A27 L28 | E20-G24 PolarHBondContact O-N 3.11Å; G24-A27 PolarHBondContact O-N 3.11Å; G24-L28 WeakPolarHBondContact O-CB 3.24Å; G24-L28 PolarHBondContact O-N 2.92Å |
| 25 | K | 97.6 | Very high | 96.7 | Very high | 141 Ų | 141 | 74.1 Ų | 74.1 | 61% | 0.613 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.6 | -42.1 | 173.1 | -175 | 176.3 | 179.9 | 178 | 0 | 112.6 | I21 A23 L28 V29 | I21-K25 VanDerWaalsContact O-CB 3.27Å; I21-K25 WeakPolarHBondContact O-CB 3.41Å; I21-K25 PolarHBondContact O-N 3.49Å; A23-K25 VanDerWaalsContact C-N 3.31Å; A23-K25 PolarHBondContact O-N 3.26Å; K25-L28 PolarHBondContact O-N 3.14Å; K25-V29 WeakPolarHBondContact O-CG2 3.47Å; K25-V29 PolarHBondContact O-N 3.33Å; K25-V29 VanDerWaalsContact O-N 3.14Å |
| 26 | R | 97.2 | Very high | 96.8 | Very high | 160 Ų | 160 | 73.4 Ų | 73.4 | 60% | 0.604 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -63.8 | -45.3 | 174.7 | -80.6 | 179.5 | -71.9 | 116.5 | -8.7 | 111.7 | P22 A23 L28 V29 E30 | P22-R26 WeakPolarHBondContact O-CB 3.47Å; P22-R26 VanDerWaalsContact O-CG 3.3Å; P22-R26 WeakPolarHBondContact O-CG 3.29Å; P22-R26 PolarHBondContact O-N 3.13Å; P22-R26 PolarHBondContact O-NE 2.88Å; A23-R26 PolarHBondContact O-N 2.92Å; A23-R26 VanDerWaalsContact O-N 3.13Å; R26-L28 VanDerWaalsContact C-N 3.3Å; R26-L28 PolarHBondContact O-N 3.27Å; R26-V29 PolarHBondContact O-N 3.16Å; R26-E30 PolarHBondContact O-N 3.07Å |
| 27 | A | 96.2 | Very high | 96.8 | Very high | 36 Ų | 36 | 79.9 Ų | 79.9 | 30% | 0.298 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60 | -39.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | A23 G24 E30 S31 | A23-A27 WeakPolarHBondContact O-CB 3.47Å; A23-A27 PolarHBondContact O-N 3.03Å; G24-A27 PolarHBondContact O-N 3.11Å; A27-E30 PolarHBondContact O-N 2.61Å; A27-S31 WeakPolarHBondContact O-CB 3.23Å; A27-S31 PolarHBondContact O-N 3.42Å |
| 28 | L | 96.5 | Very high | 96.9 | Very high | 59 Ų | 59 | 78.2 Ų | 78.2 | 31% | 0.309 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -66.9 | -37.9 | 176.5 | -157.1 | 74.6 | 0 | 0 | 0 | 112.5 | G24 K25 R26 S31 Y32 Q73 I74 L77 | G24-L28 WeakPolarHBondContact O-CB 3.24Å; G24-L28 PolarHBondContact O-N 2.92Å; K25-L28 PolarHBondContact O-N 3.14Å; R26-L28 VanDerWaalsContact C-N 3.3Å; R26-L28 PolarHBondContact O-N 3.27Å; L28-S31 WeakPolarHBondContact O-CB 3.15Å; L28-S31 PolarHBondContact O-N 2.63Å; L28-Y32 PolarHBondContact O-N 3.47Å; L28-Y32 VanDerWaalsContact O-N 3.1Å; L28-Q73 HydrophobicContact CD1-CB 3.76Å; L28-I74 HydrophobicContact CD1-CG1 3.82Å; L28-L77 HydrophobicContact CD2-CD2 4.43Å |
| 29 | V | 97.3 | Very high | 97 | Very high | 78 Ų | 78 | 76.3 Ų | 76.3 | 47% | 0.473 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -69.7 | -38 | 174.1 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | K25 R26 Q33 | K25-V29 WeakPolarHBondContact O-CG2 3.47Å; K25-V29 PolarHBondContact O-N 3.33Å; K25-V29 VanDerWaalsContact O-N 3.14Å; R26-V29 PolarHBondContact O-N 3.16Å; V29-Q33 PolarHBondContact O-N 3.4Å |
| 30 | E | 96.4 | Very high | 97.1 | Very high | 111 Ų | 111 | 73.8 Ų | 73.8 | 52% | 0.519 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -67.5 | -40.9 | 173.7 | -159.9 | -155.6 | 125.6 | 0 | 0 | 111.2 | R26 A27 Y32 Q33 N34 | R26-E30 PolarHBondContact O-N 3.07Å; A27-E30 PolarHBondContact O-N 2.61Å; E30-Y32 PolarHBondContact O-N 2.89Å; E30-Q33 PolarHBondContact O-N 3.28Å; E30-Q33 VanDerWaalsContact O-N 3.09Å; E30-N34 WeakPolarHBondContact O-CB 3.47Å; E30-N34 PolarHBondContact O-N 3.01Å; E30-N34 PolarHBondContact O-ND2 3.21Å; E30-N34 PolarHBondContact OE1-ND2 3Å |
| 31 | S | 96.8 | Very high | 97.1 | Very high | 7 Ų | 7 | 75.5 Ų | 75.5 | 5% | 0.049 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -55.4 | -47.8 | 174.7 | -163.4 | 0 | 0 | 0 | 0 | 111.2 | A27 L28 Q33 N34 L35 Q73 | A27-S31 WeakPolarHBondContact O-CB 3.23Å; A27-S31 PolarHBondContact O-N 3.42Å; L28-S31 WeakPolarHBondContact O-CB 3.15Å; L28-S31 PolarHBondContact O-N 2.63Å; S31-Q33 PolarHBondContact O-N 3.43Å; S31-N34 PolarHBondContact O-N 2.92Å; S31-L35 WeakPolarHBondContact O-CB 3.45Å; S31-L35 WeakPolarHBondContact O-CG 3.28Å; S31-L35 PolarHBondContact O-N 2.86Å; S31-Q73 PolarHBondContact OG-OE1 3.05Å |
| 32 | Y | 96 | Very high | 97.1 | Very high | 170 Ų | 170 | 74.6 Ų | 74.6 | 67% | 0.667 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -51.7 | -49.5 | 172.2 | 168.6 | -99.5 | 0 | 0 | 0 | 112.7 | L28 E30 L35 T36 | L28-Y32 PolarHBondContact O-N 3.47Å; L28-Y32 VanDerWaalsContact O-N 3.1Å; E30-Y32 PolarHBondContact O-N 2.89Å; Y32-L35 PolarHBondContact O-N 3.27Å; Y32-T36 PolarHBondContact O-N 3.39Å; Y32-T36 VanDerWaalsContact O-N 3.13Å; Y32-T36 PolarHBondContact O-OG1 3.45Å; Y32-T36 VanDerWaalsContact O-OG1 3.11Å |
| 33 | Q | 96.8 | Very high | 97.1 | Very high | 105 Ų | 105 | 78.9 Ų | 78.9 | 49% | 0.491 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -69.1 | -34.5 | 179.5 | -62.1 | 179.8 | 13.2 | 0 | 0 | 113.5 | V29 E30 S31 R37 | V29-Q33 PolarHBondContact O-N 3.4Å; E30-Q33 PolarHBondContact O-N 3.28Å; E30-Q33 VanDerWaalsContact O-N 3.09Å; S31-Q33 PolarHBondContact O-N 3.43Å; Q33-R37 PolarHBondContact O-N 2.87Å; Q33-R37 PolarHBondContact O-NE 3.46Å |
| 34 | N | 96.6 | Very high | 97.1 | Very high | 50 Ų | 50 | 81 Ų | 81 | 27% | 0.267 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -67.4 | -42.5 | 175.3 | -76.3 | -34.9 | 0 | 0 | 0 | 110.5 | E30 S31 R37 V38 | E30-N34 WeakPolarHBondContact O-CB 3.47Å; E30-N34 PolarHBondContact O-N 3.01Å; E30-N34 PolarHBondContact O-ND2 3.21Å; E30-N34 PolarHBondContact OE1-ND2 3Å; S31-N34 PolarHBondContact O-N 2.92Å; N34-R37 PolarHBondContact O-N 3.43Å; N34-R37 VanDerWaalsContact OD1-CZ 3.28Å; N34-R37 PolarHBondContact OD1-NH1 2.74Å; N34-R37 PolarHBondContact OD1-NH2 2.98Å; N34-V38 WeakPolarHBondContact O-CG2 3.23Å; N34-V38 PolarHBondContact O-N 3.39Å |
| 35 | L | 97.3 | Very high | 97.1 | Very high | 52 Ų | 52 | 81.6 Ų | 81.6 | 27% | 0.272 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.4 | -36.7 | -179.1 | -69.6 | 172.4 | 0 | 0 | 0 | 113.1 | S31 Y32 V38 A39 S66 V70 | S31-L35 WeakPolarHBondContact O-CB 3.45Å; S31-L35 WeakPolarHBondContact O-CG 3.28Å; S31-L35 PolarHBondContact O-N 2.86Å; Y32-L35 PolarHBondContact O-N 3.27Å; L35-V38 PolarHBondContact O-N 2.78Å; L35-A39 PolarHBondContact O-N 2.82Å; L35-S66 WeakPolarHBondContact CD2-OG 3.46Å; L35-V70 HydrophobicContact CD1-CG2 3.47Å; L35-V70 VanDerWaalsContact CD1-CG2 3.47Å |
| 36 | T | 97.7 | Very high | 97.1 | Very high | 65 Ų | 65 | 79.7 Ų | 79.7 | 40% | 0.399 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -55.9 | -51.5 | 169.6 | -50.2 | 0 | 0 | 0 | 0 | 110.5 | Y32 V38 A39 D40 | Y32-T36 PolarHBondContact O-N 3.39Å; Y32-T36 VanDerWaalsContact O-N 3.13Å; Y32-T36 PolarHBondContact O-OG1 3.45Å; Y32-T36 VanDerWaalsContact O-OG1 3.11Å; T36-V38 VanDerWaalsContact C-N 3.31Å; T36-V38 PolarHBondContact O-N 3.09Å; T36-A39 WeakPolarHBondContact O-CB 3.47Å; T36-A39 PolarHBondContact O-N 3.34Å; T36-A39 VanDerWaalsContact O-N 3.14Å; T36-D40 VanDerWaalsContact O-CG 3.22Å; T36-D40 PolarHBondContact O-N 3.43Å |
| 37 | R | 97.4 | Very high | 97 | Very high | 136 Ų | 136 | 76.7 Ų | 76.7 | 51% | 0.513 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.6 | -31.6 | 178.2 | -76.6 | -176.7 | -85.9 | 105.1 | -4.4 | 113.8 | Q33 N34 Y41 | Q33-R37 PolarHBondContact O-N 2.87Å; Q33-R37 PolarHBondContact O-NE 3.46Å; N34-R37 PolarHBondContact O-N 3.43Å; N34-R37 VanDerWaalsContact OD1-CZ 3.28Å; N34-R37 PolarHBondContact OD1-NH1 2.74Å; N34-R37 PolarHBondContact OD1-NH2 2.98Å; R37-Y41 VanDerWaalsContact O-CB 3.24Å; R37-Y41 WeakPolarHBondContact O-CB 3.06Å; R37-Y41 PolarHBondContact O-N 2.82Å |
| 38 | V | 97.6 | Very high | 97 | Very high | 38 Ų | 38 | 81.9 Ų | 81.9 | 23% | 0.23 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -70.4 | -39.4 | 174.1 | 168.9 | 0 | 0 | 0 | 0 | 111.1 | N34 L35 T36 Y41 C42 Y62 | N34-V38 WeakPolarHBondContact O-CG2 3.23Å; N34-V38 PolarHBondContact O-N 3.39Å; L35-V38 PolarHBondContact O-N 2.78Å; T36-V38 VanDerWaalsContact C-N 3.31Å; T36-V38 PolarHBondContact O-N 3.09Å; V38-Y41 PolarHBondContact O-N 3.18Å; V38-C42 WeakPolarHBondContact O-CB 3.41Å; V38-C42 PolarHBondContact O-N 2.94Å; V38-C42 PolarHBondContact O-SG 3.1Å; V38-Y62 HydrophobicContact CG1-CD1 3.95Å; V38-Y62 HydrophobicContact CG1-CG 4.05Å |
| 39 | A | 97.6 | Very high | 97 | Very high | 60 Ų | 60 | 80.2 Ų | 80.2 | 50% | 0.496 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.2 | -49.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L35 T36 Y41 C42 E43 | L35-A39 PolarHBondContact O-N 2.82Å; T36-A39 WeakPolarHBondContact O-CB 3.47Å; T36-A39 PolarHBondContact O-N 3.34Å; T36-A39 VanDerWaalsContact O-N 3.14Å; A39-Y41 VanDerWaalsContact C-N 3.26Å; A39-Y41 PolarHBondContact O-N 2.82Å; A39-C42 PolarHBondContact O-N 3.31Å; A39-C42 VanDerWaalsContact O-N 3.15Å; A39-E43 PolarHBondContact O-N 3.43Å |
| 40 | D | 97.8 | Very high | 96.8 | Very high | 80 Ų | 80 | 86.2 Ų | 86.2 | 43% | 0.428 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -54.3 | -44 | 174.8 | -61.4 | -31.3 | 0 | 0 | 0 | 111.2 | T36 N44 | T36-D40 VanDerWaalsContact O-CG 3.22Å; T36-D40 PolarHBondContact O-N 3.43Å; D40-N44 WeakPolarHBondContact O-CB 3.43Å; D40-N44 PolarHBondContact O-N 3.48Å; D40-N44 PolarHBondContact O-ND2 3.5Å |
| 41 | Y | 97.8 | Very high | 96.8 | Very high | 104 Ų | 104 | 85.2 Ų | 85.2 | 41% | 0.408 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.6 | -46.8 | 177.3 | 171.3 | -101.7 | 0 | 0 | 0 | 112.3 | R37 V38 A39 E43 N44 N45 Y62 | R37-Y41 VanDerWaalsContact O-CB 3.24Å; R37-Y41 WeakPolarHBondContact O-CB 3.06Å; R37-Y41 PolarHBondContact O-N 2.82Å; V38-Y41 PolarHBondContact O-N 3.18Å; A39-Y41 VanDerWaalsContact C-N 3.26Å; A39-Y41 PolarHBondContact O-N 2.82Å; Y41-E43 PolarHBondContact O-N 2.83Å; Y41-N44 PolarHBondContact O-N 3.22Å; Y41-N45 HydrophobicContact CE1-CB 4.4Å; Y41-N45 HydrophobicContact CE2-CB 4.28Å; Y41-N45 WeakPolarHBondContact O-CB 3.44Å; Y41-N45 PolarHBondContact O-N 3.34Å; Y41-Y62 HydrophobicContact CD1-CE2 4.28Å; Y41-Y62 HydrophobicContact CE1-CD2 4.44Å; Y41-Y62 AromaticContact CE1-CE2 3.79Å; Y41-Y62 HydrophobicContact CE1-CE2 3.79Å |
| 42 | C | 97.4 | Very high | 96.7 | Very high | 11 Ų | 11 | 88.7 Ų | 88.7 | 7% | 0.074 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63 | -42.1 | -179.2 | -69.1 | 0 | 0 | 0 | 0 | 111.8 | V38 A39 Y46 T59 | V38-C42 WeakPolarHBondContact O-CB 3.41Å; V38-C42 PolarHBondContact O-N 2.94Å; V38-C42 PolarHBondContact O-SG 3.1Å; A39-C42 PolarHBondContact O-N 3.31Å; A39-C42 VanDerWaalsContact O-N 3.15Å; C42-Y46 VanDerWaalsContact O-CB 3.26Å; C42-Y46 WeakPolarHBondContact O-CB 3.43Å; C42-Y46 PolarHBondContact O-N 3.09Å; C42-T59 HydrophobicContact CB-CG2 3.8Å |
| 43 | E | 96.9 | Very high | 96.7 | Very high | 135 Ų | 135 | 90.5 Ų | 90.5 | 63% | 0.631 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -62.7 | -51 | 174.9 | -176 | 174.2 | -172.6 | 0 | 0 | 111.3 | A39 Y41 N45 Y46 V47 | A39-E43 PolarHBondContact O-N 3.43Å; Y41-E43 PolarHBondContact O-N 2.83Å; E43-N45 PolarHBondContact O-N 2.86Å; E43-Y46 PolarHBondContact O-N 3.04Å; E43-V47 WeakPolarHBondContact O-CG2 3.16Å; E43-V47 PolarHBondContact O-N 2.73Å |
| 44 | N | 97.3 | Very high | 96.7 | Very high | 82 Ų | 82 | 92.3 Ų | 92.3 | 44% | 0.439 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63.2 | -42.4 | -179.5 | -82.7 | -81.4 | 0 | 0 | 0 | 112.6 | D40 Y41 V47 Q48 | D40-N44 WeakPolarHBondContact O-CB 3.43Å; D40-N44 PolarHBondContact O-N 3.48Å; D40-N44 PolarHBondContact O-ND2 3.5Å; Y41-N44 PolarHBondContact O-N 3.22Å; N44-V47 PolarHBondContact O-N 3Å; N44-Q48 WeakPolarHBondContact O-CB 3.42Å; N44-Q48 VanDerWaalsContact O-CG 3.22Å; N44-Q48 WeakPolarHBondContact O-CG 3.37Å; N44-Q48 PolarHBondContact O-N 3.02Å |
| 45 | N | 96.9 | Very high | 96.7 | Very high | 34 Ų | 34 | 90 Ų | 90 | 18% | 0.182 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -61.2 | -46.5 | 174.7 | -175.7 | 29.1 | 0 | 0 | 0 | 110.6 | Y41 E43 V47 Q48 A49 E58 | Y41-N45 HydrophobicContact CE1-CB 4.4Å; Y41-N45 HydrophobicContact CE2-CB 4.28Å; Y41-N45 WeakPolarHBondContact O-CB 3.44Å; Y41-N45 PolarHBondContact O-N 3.34Å; E43-N45 PolarHBondContact O-N 2.86Å; N45-V47 PolarHBondContact O-N 3.45Å; N45-Q48 PolarHBondContact O-N 2.84Å; N45-A49 WeakPolarHBondContact O-CB 3.34Å; N45-A49 PolarHBondContact O-N 2.87Å; N45-E58 PolarHBondContact ND2-OE2 2.93Å |
| 46 | Y | 97.1 | Very high | 96.6 | Very high | 100 Ų | 100 | 91.3 Ų | 91.3 | 39% | 0.392 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.4 | -39.1 | 176.9 | -172.6 | -93.9 | 0 | 0 | 0 | 112.7 | C42 E43 K52 A55 L56 | C42-Y46 VanDerWaalsContact O-CB 3.26Å; C42-Y46 WeakPolarHBondContact O-CB 3.43Å; C42-Y46 PolarHBondContact O-N 3.09Å; E43-Y46 PolarHBondContact O-N 3.04Å; Y46-K52 HydrophobicContact CE1-CD 4.42Å; Y46-K52 HydrophobicContact CE2-CB 3.86Å; Y46-K52 HydrophobicContact CE2-CD 4.4Å; Y46-K52 WeakPolarHBondContact CE2-O 3.41Å; Y46-K52 VanDerWaalsContact O-CD 3.24Å; Y46-K52 WeakPolarHBondContact O-CD 3.42Å; Y46-K52 WeakPolarHBondContact O-CE 3.43Å; Y46-K52 PolarHBondContact O-NZ 2.86Å; Y46-A55 HydrophobicContact CD2-CB 4.06Å; Y46-L56 HydrophobicContact CD2-CB 4.49Å; Y46-L56 HydrophobicContact CE2-CB 4.15Å |
| 47 | V | 96.4 | Very high | 96.6 | Very high | 98 Ų | 98 | 93.2 Ų | 93.2 | 59% | 0.594 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -67.5 | -44 | 175.8 | 171.5 | 0 | 0 | 0 | 0 | 111.7 | E43 N44 N45 K52 | E43-V47 WeakPolarHBondContact O-CG2 3.16Å; E43-V47 PolarHBondContact O-N 2.73Å; N44-V47 PolarHBondContact O-N 3Å; N45-V47 PolarHBondContact O-N 3.45Å; V47-K52 PolarHBondContact O-NZ 2.79Å |
| 48 | Q | 95.6 | Very high | 96.6 | Very high | 145 Ų | 145 | 89.9 Ų | 89.9 | 68% | 0.678 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -83 | -28.4 | -173.3 | -65.2 | 173.9 | 36.3 | 0 | 0 | 114.2 | N44 N45 | N44-Q48 WeakPolarHBondContact O-CB 3.42Å; N44-Q48 VanDerWaalsContact O-CG 3.22Å; N44-Q48 WeakPolarHBondContact O-CG 3.37Å; N44-Q48 PolarHBondContact O-N 3.02Å; N45-Q48 PolarHBondContact O-N 2.84Å |
| 49 | A | 95.4 | Very high | 96.6 | Very high | 24 Ų | 24 | 89.5 Ų | 89.5 | 20% | 0.198 | 43% | 0.434 | C | S | . | . | trans | -64.9 | 139.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | N45 K52 A55 | N45-A49 WeakPolarHBondContact O-CB 3.34Å; N45-A49 PolarHBondContact O-N 2.87Å; A49-K52 WeakPolarHBondContact O-CE 3.4Å; A49-K52 PolarHBondContact O-NZ 3.09Å; A49-A55 HydrophobicContact CB-CB 3.83Å | ||
| 50 | Q | 94.6 | Very high | 96.6 | Very high | 204 Ų | 204 | 91.2 Ų | 91.2 | 95% | 0.953 | 43% | 0.431 | S | S | * | . | S | Bend | trans | -71.4 | -39.2 | 171.7 | -71.1 | 177.3 | -27.2 | 0 | 0 | 111.9 | ||
| 51 | D | 95.6 | Very high | 96.6 | Very high | 90 Ų | 90 | 90.2 Ų | 90.2 | 48% | 0.481 | 43% | 0.433 | S | S | . | . | trans | -95.3 | 97.8 | 172.7 | -176.3 | -2.3 | 0 | 0 | 0 | 111 | R53 K54 A55 | D51-R53 PolarHBondContact O-N 3.1Å; D51-R53 WeakPolarHBondContact OD1-CA 3.3Å; D51-R53 VanDerWaalsContact OD1-CB 3.23Å; D51-R53 WeakPolarHBondContact OD1-CB 3.25Å; D51-R53 PolarHBondContact OD1-N 2.87Å; D51-K54 HydrophobicContact CB-CB 4.19Å; D51-K54 PolarHBondContact OD1-N 2.95Å; D51-K54 VanDerWaalsContact OD1-N 3.16Å; D51-K54 WeakPolarHBondContact OD2-CB 3.48Å; D51-A55 PolarHBondContact O-N 2.91Å | ||
| 52 | K | 95.7 | Very high | 96.6 | Very high | 79 Ų | 79 | 88.9 Ų | 88.9 | 34% | 0.343 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.1 | -28 | 174.9 | -55.9 | -51.6 | -175 | -163.1 | 0 | 113 | Y46 V47 A49 L56 | Y46-K52 HydrophobicContact CE1-CD 4.42Å; Y46-K52 HydrophobicContact CE2-CB 3.86Å; Y46-K52 HydrophobicContact CE2-CD 4.4Å; Y46-K52 WeakPolarHBondContact CE2-O 3.41Å; Y46-K52 VanDerWaalsContact O-CD 3.24Å; Y46-K52 WeakPolarHBondContact O-CD 3.42Å; Y46-K52 WeakPolarHBondContact O-CE 3.43Å; Y46-K52 PolarHBondContact O-NZ 2.86Å; V47-K52 PolarHBondContact O-NZ 2.79Å; A49-K52 WeakPolarHBondContact O-CE 3.4Å; A49-K52 PolarHBondContact O-NZ 3.09Å; K52-L56 WeakPolarHBondContact O-CB 3.48Å; K52-L56 PolarHBondContact O-N 2.88Å |
| 53 | R | 96 | Very high | 96.6 | Very high | 209 Ų | 209 | 92.5 Ų | 92.5 | 79% | 0.789 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -73.5 | -41.9 | -176.8 | -154.6 | -178.7 | -61.6 | 158.4 | 2.7 | 110.4 | D51 E57 | D51-R53 PolarHBondContact O-N 3.1Å; D51-R53 WeakPolarHBondContact OD1-CA 3.3Å; D51-R53 VanDerWaalsContact OD1-CB 3.23Å; D51-R53 WeakPolarHBondContact OD1-CB 3.25Å; D51-R53 PolarHBondContact OD1-N 2.87Å; R53-E57 PolarHBondContact O-N 2.93Å |
| 54 | K | 96.1 | Very high | 96.6 | Very high | 142 Ų | 142 | 90.7 Ų | 90.7 | 62% | 0.617 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -63.3 | -48.2 | 171.3 | -174 | -174.8 | 175.3 | -167.8 | 0 | 112.1 | D51 L56 E57 E58 | D51-K54 HydrophobicContact CB-CB 4.19Å; D51-K54 PolarHBondContact OD1-N 2.95Å; D51-K54 VanDerWaalsContact OD1-N 3.16Å; D51-K54 WeakPolarHBondContact OD2-CB 3.48Å; K54-L56 VanDerWaalsContact C-N 3.28Å; K54-L56 PolarHBondContact O-N 3.39Å; K54-E57 PolarHBondContact O-N 3.05Å; K54-E57 VanDerWaalsContact O-N 3.11Å; K54-E58 PolarHBondContact O-N 3.39Å |
| 55 | A | 95.8 | Very high | 96.6 | Very high | 2 Ų | 2 | 93 Ų | 93 | 2% | 0.017 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -63.8 | -31.9 | -179 | 0 | 0 | 0 | 0 | 0 | 113 | Y46 A49 D51 T59 | Y46-A55 HydrophobicContact CD2-CB 4.06Å; A49-A55 HydrophobicContact CB-CB 3.83Å; D51-A55 PolarHBondContact O-N 2.91Å; A55-T59 WeakPolarHBondContact O-CB 3.36Å; A55-T59 PolarHBondContact O-N 3.14Å; A55-T59 PolarHBondContact O-OG1 2.86Å |
| 56 | L | 96.4 | Very high | 96.7 | Very high | 79 Ų | 79 | 92.5 Ų | 92.5 | 41% | 0.414 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66.2 | -42.1 | 171.5 | -177.9 | 64.1 | 0 | 0 | 0 | 112.2 | Y46 K52 K54 T59 K60 | Y46-L56 HydrophobicContact CD2-CB 4.49Å; Y46-L56 HydrophobicContact CE2-CB 4.15Å; K52-L56 WeakPolarHBondContact O-CB 3.48Å; K52-L56 PolarHBondContact O-N 2.88Å; K54-L56 VanDerWaalsContact C-N 3.28Å; K54-L56 PolarHBondContact O-N 3.39Å; L56-T59 WeakPolarHBondContact O-CB 3.31Å; L56-T59 PolarHBondContact O-N 3.2Å; L56-K60 WeakPolarHBondContact O-CG 3.21Å; L56-K60 PolarHBondContact O-N 3.29Å |
| 57 | E | 97.1 | Very high | 96.7 | Very high | 105 Ų | 105 | 93.9 Ų | 93.9 | 49% | 0.491 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -67.6 | -38.6 | 179.7 | -145 | 64.2 | -148.3 | 0 | 0 | 111.9 | R53 K54 T59 K60 A61 | R53-E57 PolarHBondContact O-N 2.93Å; K54-E57 PolarHBondContact O-N 3.05Å; K54-E57 VanDerWaalsContact O-N 3.11Å; E57-T59 VanDerWaalsContact C-N 3.34Å; E57-K60 WeakPolarHBondContact O-CB 3.37Å; E57-K60 PolarHBondContact O-N 2.89Å; E57-K60 VanDerWaalsContact OE1-CD 3.29Å; E57-K60 WeakPolarHBondContact OE1-CD 3.37Å; E57-K60 IonicContact OE1-NZ 2.88Å; E57-K60 PolarHBondContact OE1-NZ 3.5Å; E57-K60 IonicContact OE2-NZ 2.67Å; E57-K60 PolarHBondContact OE2-NZ 3.07Å; E57-A61 PolarHBondContact O-N 2.89Å |
| 58 | E | 96.5 | Very high | 96.7 | Very high | 66 Ų | 66 | 92.2 Ų | 92.2 | 31% | 0.308 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.4 | -43 | 170.1 | -174.8 | 161.6 | -132.1 | 0 | 0 | 111.4 | N45 K54 K60 A61 Y62 | N45-E58 PolarHBondContact ND2-OE2 2.93Å; K54-E58 PolarHBondContact O-N 3.39Å; E58-K60 PolarHBondContact O-N 3.4Å; E58-A61 WeakPolarHBondContact O-CB 3.22Å; E58-A61 PolarHBondContact O-N 2.95Å; E58-Y62 HydrophobicContact CG-CD2 4.07Å; E58-Y62 HydrophobicContact CG-CE2 3.85Å; E58-Y62 VanDerWaalsContact O-CD2 3.28Å; E58-Y62 WeakPolarHBondContact O-CD2 3.4Å; E58-Y62 PolarHBondContact O-N 3.07Å |
| 59 | T | 97.6 | Very high | 96.8 | Very high | 31 Ų | 31 | 87.5 Ų | 87.5 | 19% | 0.19 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -62.3 | -41.4 | 174.6 | -58.9 | 0 | 0 | 0 | 0 | 112.4 | C42 A55 L56 E57 A61 Y62 T63 | C42-T59 HydrophobicContact CB-CG2 3.8Å; A55-T59 WeakPolarHBondContact O-CB 3.36Å; A55-T59 PolarHBondContact O-N 3.14Å; A55-T59 PolarHBondContact O-OG1 2.86Å; L56-T59 WeakPolarHBondContact O-CB 3.31Å; L56-T59 PolarHBondContact O-N 3.2Å; E57-T59 VanDerWaalsContact C-N 3.34Å; T59-A61 VanDerWaalsContact C-N 3.35Å; T59-A61 PolarHBondContact O-N 3.44Å; T59-Y62 PolarHBondContact O-N 2.8Å; T59-T63 WeakPolarHBondContact O-CB 3.35Å; T59-T63 PolarHBondContact O-N 2.95Å; T59-T63 PolarHBondContact O-OG1 2.89Å |
| 60 | K | 97.9 | Very high | 96.9 | Very high | 96 Ų | 96 | 88.5 Ų | 88.5 | 42% | 0.417 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -61.7 | -41.1 | 173.1 | -68.8 | 171.2 | -177.3 | 167.2 | 0 | 112.1 | L56 E57 E58 T63 T64 | L56-K60 WeakPolarHBondContact O-CG 3.21Å; L56-K60 PolarHBondContact O-N 3.29Å; E57-K60 WeakPolarHBondContact O-CB 3.37Å; E57-K60 PolarHBondContact O-N 2.89Å; E57-K60 VanDerWaalsContact OE1-CD 3.29Å; E57-K60 WeakPolarHBondContact OE1-CD 3.37Å; E57-K60 IonicContact OE1-NZ 2.88Å; E57-K60 PolarHBondContact OE1-NZ 3.5Å; E57-K60 IonicContact OE2-NZ 2.67Å; E57-K60 PolarHBondContact OE2-NZ 3.07Å; E58-K60 PolarHBondContact O-N 3.4Å; K60-T63 PolarHBondContact O-N 3.36Å; K60-T64 WeakPolarHBondContact O-CB 3.29Å; K60-T64 PolarHBondContact O-N 3.41Å; K60-T64 PolarHBondContact O-OG1 2.85Å |
| 61 | A | 97.8 | Very high | 97.1 | Very high | 58 Ų | 58 | 81.4 Ų | 81.4 | 48% | 0.479 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.1 | -49.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | E57 E58 T59 T63 T64 Q65 | E57-A61 PolarHBondContact O-N 2.89Å; E58-A61 WeakPolarHBondContact O-CB 3.22Å; E58-A61 PolarHBondContact O-N 2.95Å; T59-A61 VanDerWaalsContact C-N 3.35Å; T59-A61 PolarHBondContact O-N 3.44Å; A61-T63 VanDerWaalsContact C-N 3.34Å; A61-T63 PolarHBondContact O-N 2.97Å; A61-T64 PolarHBondContact O-N 2.99Å; A61-Q65 WeakPolarHBondContact O-CB 3.17Å; A61-Q65 PolarHBondContact O-N 3.05Å |
| 62 | Y | 97.8 | Very high | 97.2 | Very high | 76 Ų | 76 | 85.3 Ų | 85.3 | 30% | 0.298 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -59.8 | -40.6 | 172.8 | -80.3 | -65.1 | 0 | 0 | 0 | 112.7 | V38 Y41 E58 T59 T64 Q65 S66 | V38-Y62 HydrophobicContact CG1-CD1 3.95Å; V38-Y62 HydrophobicContact CG1-CG 4.05Å; Y41-Y62 HydrophobicContact CD1-CE2 4.28Å; Y41-Y62 HydrophobicContact CE1-CD2 4.44Å; Y41-Y62 AromaticContact CE1-CE2 3.79Å; Y41-Y62 HydrophobicContact CE1-CE2 3.79Å; E58-Y62 HydrophobicContact CG-CD2 4.07Å; E58-Y62 HydrophobicContact CG-CE2 3.85Å; E58-Y62 VanDerWaalsContact O-CD2 3.28Å; E58-Y62 WeakPolarHBondContact O-CD2 3.4Å; E58-Y62 PolarHBondContact O-N 3.07Å; T59-Y62 PolarHBondContact O-N 2.8Å; Y62-T64 PolarHBondContact O-N 3.36Å; Y62-Q65 PolarHBondContact O-N 2.9Å; Y62-S66 VanDerWaalsContact O-CB 3.23Å; Y62-S66 WeakPolarHBondContact O-CB 3.31Å; Y62-S66 PolarHBondContact O-N 3.24Å; Y62-S66 PolarHBondContact O-OG 3.1Å |
| 63 | T | 97.8 | Very high | 97.3 | Very high | 87 Ų | 87 | 83.4 Ų | 83.4 | 53% | 0.534 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 176.8 | -56.8 | 0 | 0 | 0 | 0 | 111.6 | T59 K60 A61 S66 L67 | T59-T63 WeakPolarHBondContact O-CB 3.35Å; T59-T63 PolarHBondContact O-N 2.95Å; T59-T63 PolarHBondContact O-OG1 2.89Å; K60-T63 PolarHBondContact O-N 3.36Å; A61-T63 VanDerWaalsContact C-N 3.34Å; A61-T63 PolarHBondContact O-N 2.97Å; T63-S66 WeakPolarHBondContact O-CB 3.41Å; T63-S66 PolarHBondContact O-N 2.99Å; T63-L67 PolarHBondContact O-N 2.79Å |
| 64 | T | 97.9 | Very high | 97.4 | Very high | 97 Ų | 97 | 77.8 Ų | 77.8 | 60% | 0.595 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -68.7 | -44.1 | -179.9 | -52 | 0 | 0 | 0 | 0 | 111.3 | K60 A61 Y62 S66 L67 A68 | K60-T64 WeakPolarHBondContact O-CB 3.29Å; K60-T64 PolarHBondContact O-N 3.41Å; K60-T64 PolarHBondContact O-OG1 2.85Å; A61-T64 PolarHBondContact O-N 2.99Å; Y62-T64 PolarHBondContact O-N 3.36Å; T64-S66 VanDerWaalsContact C-N 3.31Å; T64-S66 PolarHBondContact O-N 3.46Å; T64-L67 PolarHBondContact O-N 3.03Å; T64-A68 PolarHBondContact O-N 2.92Å; T64-A68 VanDerWaalsContact O-N 3.09Å |
| 65 | Q | 97.4 | Very high | 97.5 | Very high | 130 Ų | 130 | 75.5 Ų | 75.5 | 61% | 0.607 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -62.2 | -39 | 174.8 | -173.6 | -178.8 | 10.7 | 0 | 0 | 111.9 | A61 Y62 S69 | A61-Q65 WeakPolarHBondContact O-CB 3.17Å; A61-Q65 PolarHBondContact O-N 3.05Å; Y62-Q65 PolarHBondContact O-N 2.9Å; Q65-S69 VanDerWaalsContact O-CB 3.25Å; Q65-S69 WeakPolarHBondContact O-CB 3.2Å; Q65-S69 PolarHBondContact O-N 3.35Å |
| 66 | S | 97.9 | Very high | 97.5 | Very high | 25 Ų | 25 | 77.1 Ų | 77.1 | 18% | 0.175 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -63 | -48.3 | 177.6 | -62.8 | 0 | 0 | 0 | 0 | 111.7 | L35 Y62 T63 T64 S69 V70 | L35-S66 WeakPolarHBondContact CD2-OG 3.46Å; Y62-S66 VanDerWaalsContact O-CB 3.23Å; Y62-S66 WeakPolarHBondContact O-CB 3.31Å; Y62-S66 PolarHBondContact O-N 3.24Å; Y62-S66 PolarHBondContact O-OG 3.1Å; T63-S66 WeakPolarHBondContact O-CB 3.41Å; T63-S66 PolarHBondContact O-N 2.99Å; T64-S66 VanDerWaalsContact C-N 3.31Å; T64-S66 PolarHBondContact O-N 3.46Å; S66-S69 PolarHBondContact O-N 2.75Å; S66-V70 WeakPolarHBondContact O-CG2 3.38Å; S66-V70 PolarHBondContact O-N 2.87Å |
| 67 | L | 97.4 | Very high | 97.5 | Very high | 129 Ų | 129 | 74.9 Ų | 74.9 | 68% | 0.675 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -59.5 | -47.7 | 177.1 | 178.7 | 61 | 0 | 0 | 0 | 111.6 | T63 T64 S69 A71 | T63-L67 PolarHBondContact O-N 2.79Å; T64-L67 PolarHBondContact O-N 3.03Å; L67-S69 PolarHBondContact O-N 2.91Å; L67-A71 VanDerWaalsContact O-CB 3.3Å; L67-A71 WeakPolarHBondContact O-CB 3.26Å; L67-A71 PolarHBondContact O-N 2.96Å |
| 68 | A | 97.2 | Very high | 97.6 | Very high | 62 Ų | 62 | 72 Ų | 72 | 51% | 0.512 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | T64 Y72 | T64-A68 PolarHBondContact O-N 2.92Å; T64-A68 VanDerWaalsContact O-N 3.09Å; A68-Y72 WeakPolarHBondContact O-CB 3.48Å; A68-Y72 PolarHBondContact O-N 3.5Å |
| 69 | S | 97.4 | Very high | 97.7 | Very high | 47 Ų | 47 | 72.7 Ų | 72.7 | 33% | 0.329 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -62.4 | -49.1 | 178.5 | -174.8 | 0 | 0 | 0 | 0 | 112.1 | Q65 S66 L67 Y72 Q73 | Q65-S69 VanDerWaalsContact O-CB 3.25Å; Q65-S69 WeakPolarHBondContact O-CB 3.2Å; Q65-S69 PolarHBondContact O-N 3.35Å; S66-S69 PolarHBondContact O-N 2.75Å; L67-S69 PolarHBondContact O-N 2.91Å; S69-Y72 PolarHBondContact O-N 3.45Å; S69-Q73 WeakPolarHBondContact O-CB 3.42Å; S69-Q73 VanDerWaalsContact O-CG 3.26Å; S69-Q73 WeakPolarHBondContact O-CG 3.39Å; S69-Q73 PolarHBondContact O-N 3.13Å |
| 70 | V | 97.6 | Very high | 97.7 | Very high | 45 Ų | 45 | 72.9 Ų | 72.9 | 27% | 0.273 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65 | -44.8 | 178.8 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | L35 S66 Y72 Q73 I74 | L35-V70 HydrophobicContact CD1-CG2 3.47Å; L35-V70 VanDerWaalsContact CD1-CG2 3.47Å; S66-V70 WeakPolarHBondContact O-CG2 3.38Å; S66-V70 PolarHBondContact O-N 2.87Å; V70-Y72 VanDerWaalsContact C-N 3.34Å; V70-Y72 PolarHBondContact O-N 2.89Å; V70-Q73 PolarHBondContact O-N 2.84Å; V70-I74 HydrophobicContact CG1-CD1 3.63Å; V70-I74 HydrophobicContact CG1-CG1 4.26Å; V70-I74 WeakPolarHBondContact O-CB 3.27Å; V70-I74 WeakPolarHBondContact O-CG1 3.45Å; V70-I74 PolarHBondContact O-N 3.08Å |
| 71 | A | 97.9 | Very high | 97.7 | Very high | 55 Ų | 55 | 71 Ų | 71 | 46% | 0.455 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -59.7 | -43.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L67 N75 | L67-A71 VanDerWaalsContact O-CB 3.3Å; L67-A71 WeakPolarHBondContact O-CB 3.26Å; L67-A71 PolarHBondContact O-N 2.96Å; A71-N75 VanDerWaalsContact O-CB 3.25Å; A71-N75 WeakPolarHBondContact O-CB 3.45Å; A71-N75 PolarHBondContact O-N 3.37Å |
| 72 | Y | 97.8 | Very high | 97.7 | Very high | 171 Ų | 171 | 73.1 Ų | 73.1 | 67% | 0.671 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -63 | -47 | 176 | 178 | -99.1 | 0 | 0 | 0 | 112.4 | A68 S69 V70 N75 A76 | A68-Y72 WeakPolarHBondContact O-CB 3.48Å; A68-Y72 PolarHBondContact O-N 3.5Å; S69-Y72 PolarHBondContact O-N 3.45Å; V70-Y72 VanDerWaalsContact C-N 3.34Å; V70-Y72 PolarHBondContact O-N 2.89Å; Y72-N75 PolarHBondContact O-N 2.81Å; Y72-A76 WeakPolarHBondContact O-CB 3.38Å; Y72-A76 PolarHBondContact O-N 3.01Å |
| 73 | Q | 97.4 | Very high | 97.6 | Very high | 39 Ų | 39 | 72.8 Ų | 72.8 | 18% | 0.182 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -63.5 | -42.5 | -179.9 | -72.1 | 169.8 | -4.9 | 0 | 0 | 112.6 | L28 S31 S69 V70 L77 | L28-Q73 HydrophobicContact CD1-CB 3.76Å; S31-Q73 PolarHBondContact OG-OE1 3.05Å; S69-Q73 WeakPolarHBondContact O-CB 3.42Å; S69-Q73 VanDerWaalsContact O-CG 3.26Å; S69-Q73 WeakPolarHBondContact O-CG 3.39Å; S69-Q73 PolarHBondContact O-N 3.13Å; V70-Q73 PolarHBondContact O-N 2.84Å; Q73-L77 WeakPolarHBondContact O-CB 3.25Å; Q73-L77 PolarHBondContact O-N 3.19Å; Q73-L77 VanDerWaalsContact O-N 3.07Å |
| 74 | I | 97.8 | Very high | 97.5 | Very high | 91 Ų | 91 | 69.7 Ų | 69.7 | 47% | 0.467 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.1 | -46.6 | 175.8 | -67.9 | 174.9 | 0 | 0 | 0 | 110.2 | L28 V70 A76 L77 A78 | L28-I74 HydrophobicContact CD1-CG1 3.82Å; V70-I74 HydrophobicContact CG1-CD1 3.63Å; V70-I74 HydrophobicContact CG1-CG1 4.26Å; V70-I74 WeakPolarHBondContact O-CB 3.27Å; V70-I74 WeakPolarHBondContact O-CG1 3.45Å; V70-I74 PolarHBondContact O-N 3.08Å; I74-A76 PolarHBondContact O-N 3.46Å; I74-L77 PolarHBondContact O-N 2.96Å; I74-A78 VanDerWaalsContact O-CB 3.27Å; I74-A78 WeakPolarHBondContact O-CB 3.34Å; I74-A78 PolarHBondContact O-N 3.41Å |
| 75 | N | 98 | Very high | 97.5 | Very high | 95 Ų | 95 | 69.4 Ų | 69.4 | 51% | 0.508 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.4 | -45.8 | 179.3 | 179.1 | 69.2 | 0 | 0 | 0 | 112 | A71 Y72 A78 N79 | A71-N75 VanDerWaalsContact O-CB 3.25Å; A71-N75 WeakPolarHBondContact O-CB 3.45Å; A71-N75 PolarHBondContact O-N 3.37Å; Y72-N75 PolarHBondContact O-N 2.81Å; N75-A78 PolarHBondContact O-N 3.2Å; N75-N79 PolarHBondContact O-N 3.15Å; N75-N79 PolarHBondContact O-ND2 3.41Å; N75-N79 PolarHBondContact OD1-ND2 3.06Å; N75-N79 VanDerWaalsContact OD1-ND2 3.15Å |
| 76 | A | 96.6 | Very high | 97.4 | Very high | 35 Ų | 35 | 68.5 Ų | 68.5 | 29% | 0.289 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -59.3 | -51.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y72 I74 A78 N79 N80 | Y72-A76 WeakPolarHBondContact O-CB 3.38Å; Y72-A76 PolarHBondContact O-N 3.01Å; I74-A76 PolarHBondContact O-N 3.46Å; A76-A78 VanDerWaalsContact C-N 3.31Å; A76-A78 PolarHBondContact O-N 3.48Å; A76-N79 PolarHBondContact O-N 2.83Å; A76-N80 PolarHBondContact O-N 3.11Å; A76-N80 VanDerWaalsContact O-N 3.11Å; A76-N80 PolarHBondContact O-OD1 2.94Å |
| 77 | L | 97.6 | Very high | 97.3 | Very high | 33 Ų | 33 | 67.4 Ų | 67.4 | 17% | 0.173 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -61.6 | -37.5 | 179.3 | -174.6 | 59.8 | 0 | 0 | 0 | 112.6 | I21 L28 Q73 I74 V81 | I21-L77 HydrophobicContact CB-CD1 4.34Å; I21-L77 HydrophobicContact CG2-CD1 3.93Å; L28-L77 HydrophobicContact CD2-CD2 4.43Å; Q73-L77 WeakPolarHBondContact O-CB 3.25Å; Q73-L77 PolarHBondContact O-N 3.19Å; Q73-L77 VanDerWaalsContact O-N 3.07Å; I74-L77 PolarHBondContact O-N 2.96Å; L77-V81 VanDerWaalsContact O-CG2 3.29Å; L77-V81 WeakPolarHBondContact O-CG2 3.46Å; L77-V81 PolarHBondContact O-N 3.37Å |
| 78 | A | 98 | Very high | 97.2 | Very high | 44 Ų | 44 | 64.8 Ų | 64.8 | 36% | 0.364 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.7 | -44.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | I74 N75 A76 V81 L82 | I74-A78 VanDerWaalsContact O-CB 3.27Å; I74-A78 WeakPolarHBondContact O-CB 3.34Å; I74-A78 PolarHBondContact O-N 3.41Å; N75-A78 PolarHBondContact O-N 3.2Å; A76-A78 VanDerWaalsContact C-N 3.31Å; A76-A78 PolarHBondContact O-N 3.48Å; A78-V81 PolarHBondContact O-N 2.9Å; A78-L82 WeakPolarHBondContact O-CG 3.05Å; A78-L82 PolarHBondContact O-N 2.9Å |
| 79 | N | 98 | Very high | 97.2 | Very high | 81 Ų | 81 | 63.7 Ų | 63.7 | 43% | 0.433 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 177.2 | -79.9 | -84.4 | 0 | 0 | 0 | 111.4 | N75 A76 V81 L82 Q83 | N75-N79 PolarHBondContact O-N 3.15Å; N75-N79 PolarHBondContact O-ND2 3.41Å; N75-N79 PolarHBondContact OD1-ND2 3.06Å; N75-N79 VanDerWaalsContact OD1-ND2 3.15Å; A76-N79 PolarHBondContact O-N 2.83Å; N79-V81 VanDerWaalsContact C-N 3.33Å; N79-V81 PolarHBondContact O-N 3.28Å; N79-L82 PolarHBondContact O-N 2.78Å; N79-Q83 WeakPolarHBondContact O-CB 3.45Å; N79-Q83 PolarHBondContact O-N 3.3Å |
| 80 | N | 97.6 | Very high | 97 | Very high | 34 Ų | 34 | 62.3 Ų | 62.3 | 18% | 0.182 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.3 | -36.7 | 178.2 | -66.3 | 40.6 | 0 | 0 | 0 | 111.7 | L16 E20 I21 A76 L84 | L16-N80 HydrophobicContact CD2-CB 3.66Å; E20-N80 PolarHBondContact OE2-ND2 3.33Å; I21-N80 HydrophobicContact CG1-CB 3.97Å; A76-N80 PolarHBondContact O-N 3.11Å; A76-N80 VanDerWaalsContact O-N 3.11Å; A76-N80 PolarHBondContact O-OD1 2.94Å; N80-L84 WeakPolarHBondContact O-CB 3.33Å; N80-L84 PolarHBondContact O-N 3.02Å |
| 81 | V | 97.8 | Very high | 96.8 | Very high | 56 Ų | 56 | 62.2 Ų | 62.2 | 34% | 0.339 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -68.1 | -38.3 | 173.6 | 169.3 | 0 | 0 | 0 | 0 | 112.3 | I21 L77 A78 N79 L84 L85 | I21-V81 HydrophobicContact CD1-CG2 4.02Å; I21-V81 HydrophobicContact CG1-CG2 4.3Å; I21-V81 HydrophobicContact CG2-CG2 4.21Å; L77-V81 VanDerWaalsContact O-CG2 3.29Å; L77-V81 WeakPolarHBondContact O-CG2 3.46Å; L77-V81 PolarHBondContact O-N 3.37Å; A78-V81 PolarHBondContact O-N 2.9Å; N79-V81 VanDerWaalsContact C-N 3.33Å; N79-V81 PolarHBondContact O-N 3.28Å; V81-L84 WeakPolarHBondContact O-CB 3.4Å; V81-L84 PolarHBondContact O-N 2.98Å; V81-L85 HydrophobicContact CG1-CD1 4.22Å; V81-L85 WeakPolarHBondContact O-CG 3.3Å; V81-L85 PolarHBondContact O-N 2.8Å; V81-L85 VanDerWaalsContact O-N 3.15Å |
| 82 | L | 97.8 | Very high | 96.7 | Very high | 104 Ų | 104 | 64.7 Ų | 64.7 | 55% | 0.545 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64.8 | -46.3 | 174.2 | -70.7 | 169.6 | 0 | 0 | 0 | 111.2 | A78 N79 L84 L85 D86 | A78-L82 WeakPolarHBondContact O-CG 3.05Å; A78-L82 PolarHBondContact O-N 2.9Å; N79-L82 PolarHBondContact O-N 2.78Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L82-L84 PolarHBondContact O-N 3.43Å; L82-L85 PolarHBondContact O-N 2.89Å; L82-L85 VanDerWaalsContact O-N 3.14Å; L82-D86 PolarHBondContact O-N 2.62Å |
| 83 | Q | 96.5 | Very high | 96.6 | Very high | 69 Ų | 69 | 63.9 Ų | 63.9 | 32% | 0.322 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -58.8 | -41.2 | 176.5 | -171.5 | 179.6 | -0.1 | 0 | 0 | 112 | E12 L16 N79 D86 I87 | E12-Q83 PolarHBondContact OE1-NE2 2.81Å; L16-Q83 HydrophobicContact CD1-CB 4.29Å; L16-Q83 HydrophobicContact CD1-CG 3.93Å; N79-Q83 WeakPolarHBondContact O-CB 3.45Å; N79-Q83 PolarHBondContact O-N 3.3Å; Q83-D86 PolarHBondContact O-N 3.1Å; Q83-I87 HydrophobicContact CG-CD1 4.16Å; Q83-I87 WeakPolarHBondContact O-CD1 3.31Å; Q83-I87 VanDerWaalsContact O-CG1 3.24Å; Q83-I87 WeakPolarHBondContact O-CG1 3.39Å; Q83-I87 PolarHBondContact O-N 3.15Å |
| 84 | L | 96.7 | Very high | 96.4 | Very high | 22 Ų | 22 | 65.9 Ų | 65.9 | 12% | 0.115 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -56.4 | -50.8 | 173 | -174.5 | 87.2 | 0 | 0 | 0 | 111.6 | L13 L16 L17 I21 N80 V81 L82 I87 Q88 | L13-L84 HydrophobicContact CD1-CD1 3.51Å; L13-L84 HydrophobicContact CD1-CG 4.15Å; L13-L84 HydrophobicContact CG-CD1 4.45Å; L16-L84 HydrophobicContact CB-CD1 3.8Å; L16-L84 HydrophobicContact CD1-CB 4.5Å; L17-L84 HydrophobicContact CD2-CD1 3.55Å; L17-L84 HydrophobicContact CD2-CD2 4.08Å; L17-L84 HydrophobicContact CD2-CG 4.41Å; L17-L84 HydrophobicContact CG-CD1 3.62Å; I21-L84 HydrophobicContact CD1-CB 4.01Å; I21-L84 HydrophobicContact CD1-CD1 4.13Å; I21-L84 HydrophobicContact CD1-CD2 3.94Å; I21-L84 HydrophobicContact CD1-CG 4.25Å; N80-L84 WeakPolarHBondContact O-CB 3.33Å; N80-L84 PolarHBondContact O-N 3.02Å; V81-L84 WeakPolarHBondContact O-CB 3.4Å; V81-L84 PolarHBondContact O-N 2.98Å; L82-L84 VanDerWaalsContact C-N 3.31Å; L82-L84 PolarHBondContact O-N 3.43Å; L84-I87 PolarHBondContact O-N 3.02Å; L84-Q88 WeakPolarHBondContact O-CG 3.47Å; L84-Q88 PolarHBondContact O-N 2.87Å |
| 85 | L | 97.1 | Very high | 96.4 | Very high | 90 Ų | 90 | 66.7 Ų | 66.7 | 47% | 0.471 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.9 | -40 | -178.4 | -68.7 | 169.9 | 0 | 0 | 0 | 111.8 | V81 L82 I87 Q88 A89 | V81-L85 HydrophobicContact CG1-CD1 4.22Å; V81-L85 WeakPolarHBondContact O-CG 3.3Å; V81-L85 PolarHBondContact O-N 2.8Å; V81-L85 VanDerWaalsContact O-N 3.15Å; L82-L85 PolarHBondContact O-N 2.89Å; L82-L85 VanDerWaalsContact O-N 3.14Å; L85-I87 PolarHBondContact O-N 2.91Å; L85-Q88 PolarHBondContact O-N 2.93Å; L85-A89 VanDerWaalsContact O-CB 3.3Å; L85-A89 WeakPolarHBondContact O-CB 3.32Å; L85-A89 PolarHBondContact O-N 3.44Å |
| 86 | D | 96.3 | Very high | 96.3 | Very high | 111 Ų | 111 | 67.4 Ų | 67.4 | 59% | 0.594 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -63 | -40.7 | 174.8 | -92.7 | -28.1 | 0 | 0 | 0 | 112.5 | L82 Q83 S90 | L82-D86 PolarHBondContact O-N 2.62Å; Q83-D86 PolarHBondContact O-N 3.1Å; D86-S90 WeakPolarHBondContact O-CB 3.43Å; D86-S90 PolarHBondContact O-N 2.63Å |
| 87 | I | 94.9 | Very high | 96.3 | Very high | 3 Ų | 3 | 69.6 Ų | 69.6 | 2% | 0.015 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -64.9 | -45.9 | 175.5 | -64.9 | 162 | 0 | 0 | 0 | 109.9 | E12 L13 L16 Q83 L84 L85 S90 Q91 | E12-I87 HydrophobicContact CB-CD1 4.3Å; E12-I87 HydrophobicContact CG-CD1 3.7Å; L13-I87 HydrophobicContact CB-CG2 4.05Å; L13-I87 HydrophobicContact CD1-CB 4.13Å; L13-I87 HydrophobicContact CD1-CG2 3.96Å; L13-I87 HydrophobicContact CG-CG2 4.42Å; L16-I87 HydrophobicContact CD1-CD1 3.78Å; Q83-I87 HydrophobicContact CG-CD1 4.16Å; Q83-I87 WeakPolarHBondContact O-CD1 3.31Å; Q83-I87 VanDerWaalsContact O-CG1 3.24Å; Q83-I87 WeakPolarHBondContact O-CG1 3.39Å; Q83-I87 PolarHBondContact O-N 3.15Å; L84-I87 PolarHBondContact O-N 3.02Å; L85-I87 PolarHBondContact O-N 2.91Å; I87-S90 WeakPolarHBondContact O-CB 3.41Å; I87-S90 PolarHBondContact O-N 2.72Å; I87-S90 PolarHBondContact O-OG 3.08Å; I87-Q91 WeakPolarHBondContact O-CG 3.27Å; I87-Q91 PolarHBondContact O-N 3.05Å |
| 88 | Q | 96.1 | Very high | 96.3 | Very high | 73 Ų | 73 | 71.2 Ų | 71.2 | 34% | 0.341 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.2 | -47.7 | 176.2 | -71.7 | -179.8 | -7.8 | 0 | 0 | 112.2 | L13 L84 L85 S90 Q91 L92 | L13-Q88 HydrophobicContact CD1-CG 4.02Å; L84-Q88 WeakPolarHBondContact O-CG 3.47Å; L84-Q88 PolarHBondContact O-N 2.87Å; L85-Q88 PolarHBondContact O-N 2.93Å; Q88-S90 PolarHBondContact O-N 3.03Å; Q88-Q91 WeakPolarHBondContact O-CA 3.41Å; Q88-Q91 WeakPolarHBondContact O-CB 3.14Å; Q88-Q91 PolarHBondContact O-N 3.18Å; Q88-L92 PolarHBondContact O-N 2.97Å |
| 89 | A | 96.3 | Very high | 96.3 | Very high | 40 Ų | 40 | 73.7 Ų | 73.7 | 33% | 0.331 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62 | -29.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L85 R93 | L85-A89 VanDerWaalsContact O-CB 3.3Å; L85-A89 WeakPolarHBondContact O-CB 3.32Å; L85-A89 PolarHBondContact O-N 3.44Å; A89-R93 WeakPolarHBondContact O-CG 3.29Å; A89-R93 PolarHBondContact O-N 3.32Å; A89-R93 PolarHBondContact O-NE 3.38Å |
| 90 | S | 93.6 | Very high | 96.3 | Very high | 18 Ų | 18 | 73.7 Ų | 73.7 | 13% | 0.126 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -71.3 | -35 | 170.7 | 87.3 | 0 | 0 | 0 | 0 | 112.6 | D86 I87 Q88 R94 | D86-S90 WeakPolarHBondContact O-CB 3.43Å; D86-S90 PolarHBondContact O-N 2.63Å; I87-S90 WeakPolarHBondContact O-CB 3.41Å; I87-S90 PolarHBondContact O-N 2.72Å; I87-S90 PolarHBondContact O-OG 3.08Å; Q88-S90 PolarHBondContact O-N 3.03Å; S90-R94 WeakPolarHBondContact O-CG 3.37Å; S90-R94 PolarHBondContact O-N 3.3Å; S90-R94 PolarHBondContact O-NH1 3.01Å; S90-R94 PolarHBondContact OG-NH1 3.4Å |
| 91 | Q | 93.4 | Very high | 96.3 | Very high | 43 Ų | 43 | 77.8 Ų | 77.8 | 20% | 0.201 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -70.9 | -45 | 179.4 | -72.9 | 174.2 | -0.3 | 0 | 0 | 111.1 | M10 I87 Q88 R93 R94 M95 | M10-Q91 HydrophobicContact CE-CG 4.33Å; M10-Q91 PolarHBondContact SD-NE2 2.83Å; I87-Q91 WeakPolarHBondContact O-CG 3.27Å; I87-Q91 PolarHBondContact O-N 3.05Å; Q88-Q91 WeakPolarHBondContact O-CA 3.41Å; Q88-Q91 WeakPolarHBondContact O-CB 3.14Å; Q88-Q91 PolarHBondContact O-N 3.18Å; Q91-R93 PolarHBondContact O-N 3.5Å; Q91-R94 PolarHBondContact O-N 3.14Å; Q91-R94 VanDerWaalsContact O-N 3.12Å; Q91-M95 PolarHBondContact O-N 3.38Å |
| 92 | L | 95.9 | Very high | 96.3 | Very high | 107 Ų | 107 | 80.2 Ų | 80.2 | 56% | 0.56 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -56.3 | -48.7 | 176.4 | -65.7 | -179.6 | 0 | 0 | 0 | 111.4 | Q88 R94 M95 E96 | Q88-L92 PolarHBondContact O-N 2.97Å; L92-R94 VanDerWaalsContact C-N 3.3Å; L92-R94 PolarHBondContact O-N 2.8Å; L92-M95 HydrophobicContact CD2-CE 3.71Å; L92-M95 PolarHBondContact O-N 2.9Å; L92-M95 VanDerWaalsContact O-N 3.14Å; L92-E96 WeakPolarHBondContact O-CB 3.3Å; L92-E96 PolarHBondContact O-N 3.45Å |
| 93 | R | 95.9 | Very high | 96.4 | Very high | 153 Ų | 153 | 78 Ų | 78 | 58% | 0.577 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -58.8 | -34.7 | 176 | -74.3 | 179 | -76.1 | 173.5 | -8.1 | 113.9 | A89 Q91 S97 | A89-R93 WeakPolarHBondContact O-CG 3.29Å; A89-R93 PolarHBondContact O-N 3.32Å; A89-R93 PolarHBondContact O-NE 3.38Å; Q91-R93 PolarHBondContact O-N 3.5Å; R93-S97 WeakPolarHBondContact O-CB 3.1Å; R93-S97 PolarHBondContact O-N 2.85Å; R93-S97 VanDerWaalsContact O-N 3.1Å |
| 94 | R | 92.4 | Very high | 96.5 | Very high | 81 Ų | 81 | 80 Ų | 80 | 31% | 0.306 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -75.4 | -36.3 | 175.1 | -69.1 | -165.4 | -50.2 | -76.5 | 12.7 | 112.7 | E6 S90 Q91 L92 S98 | E6-R94 IonicContact OE1-CZ 2.61Å; E6-R94 IonicContact OE1-NE 2.63Å; E6-R94 PolarHBondContact OE1-NE 3.35Å; E6-R94 IonicContact OE1-NH2 2.62Å; E6-R94 PolarHBondContact OE1-NH2 2.98Å; S90-R94 WeakPolarHBondContact O-CG 3.37Å; S90-R94 PolarHBondContact O-N 3.3Å; S90-R94 PolarHBondContact O-NH1 3.01Å; S90-R94 PolarHBondContact OG-NH1 3.4Å; Q91-R94 PolarHBondContact O-N 3.14Å; Q91-R94 VanDerWaalsContact O-N 3.12Å; L92-R94 VanDerWaalsContact C-N 3.3Å; L92-R94 PolarHBondContact O-N 2.8Å; R94-S98 WeakPolarHBondContact O-CB 3.47Å; R94-S98 PolarHBondContact O-N 3.28Å; R94-S98 PolarHBondContact O-OG 3.02Å |
| 95 | M | 96.9 | Very high | 96.6 | Very high | 108 Ų | 108 | 82.6 Ų | 82.6 | 53% | 0.532 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -66.5 | -44.9 | 174.6 | -177.1 | 169.2 | 63.5 | 0 | 0 | 111.2 | Q91 L92 S98 I99 | Q91-M95 PolarHBondContact O-N 3.38Å; L92-M95 HydrophobicContact CD2-CE 3.71Å; L92-M95 PolarHBondContact O-N 2.9Å; L92-M95 VanDerWaalsContact O-N 3.14Å; M95-S98 WeakPolarHBondContact O-CB 3.43Å; M95-S98 PolarHBondContact O-N 3.01Å; M95-I99 HydrophobicContact CG-CD1 3.91Å; M95-I99 VanDerWaalsContact O-CG1 3.3Å; M95-I99 WeakPolarHBondContact O-CG1 3.35Å; M95-I99 PolarHBondContact O-N 3.48Å |
| 96 | E | 96.6 | Very high | 96.7 | Very high | 111 Ų | 111 | 81.6 Ų | 81.6 | 52% | 0.519 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -55.7 | -51.4 | 171.7 | -179.2 | -172.2 | -175.1 | 0 | 0 | 111.7 | L92 S98 I99 N100 | L92-E96 WeakPolarHBondContact O-CB 3.3Å; L92-E96 PolarHBondContact O-N 3.45Å; E96-S98 PolarHBondContact O-N 3.47Å; E96-I99 PolarHBondContact O-N 2.86Å; E96-I99 VanDerWaalsContact O-N 3.11Å; E96-N100 PolarHBondContact O-N 2.95Å |
| 97 | S | 97.2 | Very high | 96.8 | Very high | 80 Ų | 80 | 80.6 Ų | 80.6 | 56% | 0.559 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -56.6 | -39.1 | 175.9 | -174.8 | 0 | 0 | 0 | 0 | 112.5 | R93 N100 H101 | R93-S97 WeakPolarHBondContact O-CB 3.1Å; R93-S97 PolarHBondContact O-N 2.85Å; R93-S97 VanDerWaalsContact O-N 3.1Å; S97-N100 PolarHBondContact O-N 2.59Å; S97-H101 PolarHBondContact O-N 3.2Å; S97-H101 VanDerWaalsContact O-N 3.12Å |
| 98 | S | 97.4 | Very high | 96.9 | Very high | 68 Ų | 68 | 84.7 Ų | 84.7 | 48% | 0.476 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -68.2 | -41.3 | 176.5 | -56.6 | 0 | 0 | 0 | 0 | 112.4 | R94 M95 E96 H101 I102 | R94-S98 WeakPolarHBondContact O-CB 3.47Å; R94-S98 PolarHBondContact O-N 3.28Å; R94-S98 PolarHBondContact O-OG 3.02Å; M95-S98 WeakPolarHBondContact O-CB 3.43Å; M95-S98 PolarHBondContact O-N 3.01Å; E96-S98 PolarHBondContact O-N 3.47Å; S98-H101 PolarHBondContact O-N 2.81Å; S98-I102 WeakPolarHBondContact O-CD1 3.28Å; S98-I102 WeakPolarHBondContact O-CG1 3.48Å; S98-I102 PolarHBondContact O-N 3.01Å |
| 99 | I | 97.6 | Very high | 97.1 | Very high | 96 Ų | 96 | 86.9 Ų | 86.9 | 49% | 0.492 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.5 | -42 | 175.4 | -70.7 | 164.4 | 0 | 0 | 0 | 110.6 | M95 E96 H101 I102 S103 | M95-I99 HydrophobicContact CG-CD1 3.91Å; M95-I99 VanDerWaalsContact O-CG1 3.3Å; M95-I99 WeakPolarHBondContact O-CG1 3.35Å; M95-I99 PolarHBondContact O-N 3.48Å; E96-I99 PolarHBondContact O-N 2.86Å; E96-I99 VanDerWaalsContact O-N 3.11Å; I99-H101 VanDerWaalsContact C-N 3.34Å; I99-H101 PolarHBondContact O-N 3.04Å; I99-I102 CarbonylContact O-C 3.54Å; I99-I102 WeakPolarHBondContact O-CB 3.2Å; I99-I102 PolarHBondContact O-N 3.2Å; I99-I102 VanDerWaalsContact O-N 3.13Å; I99-S103 PolarHBondContact O-N 2.84Å |
| 100 | N | 98.3 | Very high | 97.2 | Very high | 80 Ų | 80 | 91.5 Ų | 91.5 | 43% | 0.428 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.6 | -40.1 | 177.2 | -71.5 | -19.2 | 0 | 0 | 0 | 111.7 | E96 S97 S103 Q104 | E96-N100 PolarHBondContact O-N 2.95Å; S97-N100 PolarHBondContact O-N 2.59Å; N100-S103 PolarHBondContact O-N 2.89Å; N100-Q104 WeakPolarHBondContact O-CG 3.25Å; N100-Q104 PolarHBondContact O-N 3.44Å |
| 101 | H | 97.9 | Very high | 97.4 | Very high | 121 Ų | 121 | 94.7 Ų | 94.7 | 56% | 0.56 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -66.8 | -35.2 | 173.3 | -171.5 | 62.9 | 0 | 0 | 0 | 112.9 | S97 S98 I99 T105 | S97-H101 PolarHBondContact O-N 3.2Å; S97-H101 VanDerWaalsContact O-N 3.12Å; S98-H101 PolarHBondContact O-N 2.81Å; I99-H101 VanDerWaalsContact C-N 3.34Å; I99-H101 PolarHBondContact O-N 3.04Å; H101-T105 WeakPolarHBondContact O-CB 3.41Å; H101-T105 PolarHBondContact O-N 2.9Å; H101-T105 PolarHBondContact O-OG1 3.23Å |
| 102 | I | 98.4 | Very high | 97.7 | Very high | 106 Ų | 106 | 99.1 Ų | 99.1 | 54% | 0.544 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.5 | -44 | 172.2 | -70.4 | 160.1 | 0 | 0 | 0 | 110.8 | S98 I99 T105 V106 | S98-I102 WeakPolarHBondContact O-CD1 3.28Å; S98-I102 WeakPolarHBondContact O-CG1 3.48Å; S98-I102 PolarHBondContact O-N 3.01Å; I99-I102 CarbonylContact O-C 3.54Å; I99-I102 WeakPolarHBondContact O-CB 3.2Å; I99-I102 PolarHBondContact O-N 3.2Å; I99-I102 VanDerWaalsContact O-N 3.13Å; I102-T105 WeakPolarHBondContact O-CB 3.36Å; I102-T105 PolarHBondContact O-N 3.05Å; I102-V106 WeakPolarHBondContact O-CG2 3.23Å; I102-V106 PolarHBondContact O-N 3.4Å |
| 103 | S | 98.6 | Very high | 97.8 | Very high | 57 Ų | 57 | 97.2 Ų | 97.2 | 40% | 0.399 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.1 | -55.8 | 175.8 | -165.6 | 0 | 0 | 0 | 0 | 110.4 | I99 N100 T105 V106 D107 | I99-S103 PolarHBondContact O-N 2.84Å; N100-S103 PolarHBondContact O-N 2.89Å; S103-T105 PolarHBondContact O-N 3.01Å; S103-T105 VanDerWaalsContact O-N 3.11Å; S103-V106 CarbonylContact O-C 3.51Å; S103-V106 WeakPolarHBondContact O-CA 3.03Å; S103-V106 WeakPolarHBondContact O-CB 3.27Å; S103-V106 PolarHBondContact O-N 3.48Å; S103-D107 VanDerWaalsContact O-CG 3.22Å; S103-D107 PolarHBondContact O-N 3.47Å; S103-D107 PolarHBondContact OG-OD2 2.74Å |
| 104 | Q | 98.6 | Very high | 98 | Very high | 113 Ų | 113 | 92.4 Ų | 92.4 | 53% | 0.528 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -52.3 | -39.8 | 176.8 | -69.9 | 171.2 | 5.8 | 0 | 0 | 112.2 | N100 D107 I108 | N100-Q104 WeakPolarHBondContact O-CG 3.25Å; N100-Q104 PolarHBondContact O-N 3.44Å; Q104-D107 PolarHBondContact O-N 3.04Å; Q104-I108 WeakPolarHBondContact O-CB 3.48Å; Q104-I108 WeakPolarHBondContact O-CD1 3.09Å; Q104-I108 WeakPolarHBondContact O-CG1 3.31Å; Q104-I108 PolarHBondContact O-N 3.24Å |
| 105 | T | 98.7 | Very high | 98.3 | Very high | 76 Ų | 76 | 96.5 Ų | 96.5 | 47% | 0.466 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.8 | -40.7 | 176.2 | -61.3 | 0 | 0 | 0 | 0 | 112.3 | H101 I102 S103 H109 | H101-T105 WeakPolarHBondContact O-CB 3.41Å; H101-T105 PolarHBondContact O-N 2.9Å; H101-T105 PolarHBondContact O-OG1 3.23Å; I102-T105 WeakPolarHBondContact O-CB 3.36Å; I102-T105 PolarHBondContact O-N 3.05Å; S103-T105 PolarHBondContact O-N 3.01Å; S103-T105 VanDerWaalsContact O-N 3.11Å; T105-H109 VanDerWaalsContact O-CB 3.31Å; T105-H109 WeakPolarHBondContact O-CB 3.24Å; T105-H109 PolarHBondContact O-N 3.47Å |
| 106 | V | 98.8 | Very high | 98.3 | Very high | 69 Ų | 69 | 99.8 Ų | 99.8 | 42% | 0.418 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67 | -44.9 | 174.1 | 171.5 | 0 | 0 | 0 | 0 | 111 | I102 S103 H109 K110 | I102-V106 WeakPolarHBondContact O-CG2 3.23Å; I102-V106 PolarHBondContact O-N 3.4Å; S103-V106 CarbonylContact O-C 3.51Å; S103-V106 WeakPolarHBondContact O-CA 3.03Å; S103-V106 WeakPolarHBondContact O-CB 3.27Å; S103-V106 PolarHBondContact O-N 3.48Å; V106-H109 CarbonylContact O-C 3.54Å; V106-H109 WeakPolarHBondContact O-CA 3.45Å; V106-H109 WeakPolarHBondContact O-CB 3.26Å; V106-H109 PolarHBondContact O-N 3.03Å; V106-K110 HydrophobicContact CG1-CG 4.16Å; V106-K110 VanDerWaalsContact O-CG 3.24Å; V106-K110 WeakPolarHBondContact O-CG 3.41Å; V106-K110 PolarHBondContact O-N 2.91Å |
| 107 | D | 98.6 | Very high | 98.4 | Very high | 89 Ų | 89 | 100.6 Ų | 100.6 | 48% | 0.476 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.5 | -45.8 | -179 | -61.3 | -42.5 | 0 | 0 | 0 | 111 | S103 Q104 H109 K110 E111 | S103-D107 VanDerWaalsContact O-CG 3.22Å; S103-D107 PolarHBondContact O-N 3.47Å; S103-D107 PolarHBondContact OG-OD2 2.74Å; Q104-D107 PolarHBondContact O-N 3.04Å; D107-H109 VanDerWaalsContact C-N 3.27Å; D107-H109 PolarHBondContact O-N 3.45Å; D107-K110 PolarHBondContact O-N 3.44Å; D107-E111 WeakPolarHBondContact O-CB 3.34Å; D107-E111 PolarHBondContact O-N 3.46Å |
| 108 | I | 98.7 | Very high | 98.5 | Very high | 90 Ų | 90 | 101.7 Ų | 101.7 | 46% | 0.462 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.4 | -36.9 | 170.9 | -71.7 | 167 | 0 | 0 | 0 | 111.3 | Q104 K112 | Q104-I108 WeakPolarHBondContact O-CB 3.48Å; Q104-I108 WeakPolarHBondContact O-CD1 3.09Å; Q104-I108 WeakPolarHBondContact O-CG1 3.31Å; Q104-I108 PolarHBondContact O-N 3.24Å; I108-K112 HydrophobicContact CG2-CD 3.84Å; I108-K112 VanDerWaalsContact CG2-CE 3.47Å; I108-K112 VanDerWaalsContact O-CB 3.25Å; I108-K112 WeakPolarHBondContact O-CB 3.07Å; I108-K112 WeakPolarHBondContact O-CD 3.39Å; I108-K112 WeakPolarHBondContact O-CG 3.3Å; I108-K112 PolarHBondContact O-N 2.97Å |
| 109 | H | 98.9 | Very high | 98.5 | Very high | 118 Ų | 118 | 99.7 Ų | 99.7 | 55% | 0.546 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.3 | -46.4 | 175.6 | 178.7 | 96.4 | 0 | 0 | 0 | 112 | T105 V106 D107 E111 K112 V113 | T105-H109 VanDerWaalsContact O-CB 3.31Å; T105-H109 WeakPolarHBondContact O-CB 3.24Å; T105-H109 PolarHBondContact O-N 3.47Å; V106-H109 CarbonylContact O-C 3.54Å; V106-H109 WeakPolarHBondContact O-CA 3.45Å; V106-H109 WeakPolarHBondContact O-CB 3.26Å; V106-H109 PolarHBondContact O-N 3.03Å; D107-H109 VanDerWaalsContact C-N 3.27Å; D107-H109 PolarHBondContact O-N 3.45Å; H109-E111 PolarHBondContact O-N 2.84Å; H109-K112 PolarHBondContact O-N 2.96Å; H109-V113 WeakPolarHBondContact O-CG2 3.26Å; H109-V113 PolarHBondContact O-N 3.09Å |
| 110 | K | 98.8 | Very high | 98.5 | Very high | 137 Ų | 137 | 101 Ų | 101 | 60% | 0.596 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58 | -48.4 | 177.7 | -68.4 | -77.2 | -176.3 | 173.8 | 0 | 110.7 | V106 D107 V113 A114 | V106-K110 HydrophobicContact CG1-CG 4.16Å; V106-K110 VanDerWaalsContact O-CG 3.24Å; V106-K110 WeakPolarHBondContact O-CG 3.41Å; V106-K110 PolarHBondContact O-N 2.91Å; D107-K110 PolarHBondContact O-N 3.44Å; K110-V113 PolarHBondContact O-N 3.43Å; K110-A114 PolarHBondContact O-N 2.67Å |
| 111 | E | 98.8 | Very high | 98.5 | Very high | 85 Ų | 85 | 104 Ų | 104 | 40% | 0.397 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.2 | -38 | 177.3 | 177.8 | 65.2 | 163 | 0 | 0 | 112.1 | D107 H109 V113 A114 R115 | D107-E111 WeakPolarHBondContact O-CB 3.34Å; D107-E111 PolarHBondContact O-N 3.46Å; H109-E111 PolarHBondContact O-N 2.84Å; E111-V113 VanDerWaalsContact C-N 3.33Å; E111-V113 PolarHBondContact O-N 3.14Å; E111-A114 PolarHBondContact O-N 2.84Å; E111-R115 HydrophobicContact CG-CG 4.37Å; E111-R115 VanDerWaalsContact O-CB 3.28Å; E111-R115 WeakPolarHBondContact O-CB 3.5Å; E111-R115 WeakPolarHBondContact O-CG 3.39Å; E111-R115 PolarHBondContact O-N 3.29Å; E111-R115 IonicContact OE1-CZ 2.72Å; E111-R115 IonicContact OE1-NE 2.75Å; E111-R115 PolarHBondContact OE1-NE 3.31Å; E111-R115 IonicContact OE1-NH2 3.18Å; E111-R115 PolarHBondContact OE1-NH2 3.27Å |
| 112 | K | 98.8 | Very high | 98.5 | Very high | 137 Ų | 137 | 103 Ų | 103 | 60% | 0.596 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.4 | -34.4 | 173.2 | -79.8 | 169.4 | -178.8 | 168 | 0 | 113 | I108 H109 R116 | I108-K112 HydrophobicContact CG2-CD 3.84Å; I108-K112 VanDerWaalsContact CG2-CE 3.47Å; I108-K112 VanDerWaalsContact O-CB 3.25Å; I108-K112 WeakPolarHBondContact O-CB 3.07Å; I108-K112 WeakPolarHBondContact O-CD 3.39Å; I108-K112 WeakPolarHBondContact O-CG 3.3Å; I108-K112 PolarHBondContact O-N 2.97Å; H109-K112 PolarHBondContact O-N 2.96Å; K112-R116 VanDerWaalsContact O-CB 3.32Å; K112-R116 WeakPolarHBondContact O-CB 3.46Å; K112-R116 PolarHBondContact O-N 2.89Å; K112-R116 VanDerWaalsContact O-N 3.09Å |
| 113 | V | 98.8 | Very high | 98.5 | Very high | 66 Ų | 66 | 104.4 Ų | 104.4 | 40% | 0.4 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -71 | -48.3 | 173.9 | 171.1 | 0 | 0 | 0 | 0 | 110.3 | H109 K110 E111 R115 R116 E117 | H109-V113 WeakPolarHBondContact O-CG2 3.26Å; H109-V113 PolarHBondContact O-N 3.09Å; K110-V113 PolarHBondContact O-N 3.43Å; E111-V113 VanDerWaalsContact C-N 3.33Å; E111-V113 PolarHBondContact O-N 3.14Å; V113-R115 PolarHBondContact O-N 2.98Å; V113-R116 WeakPolarHBondContact O-CB 3.33Å; V113-R116 PolarHBondContact O-N 2.99Å; V113-R116 VanDerWaalsContact O-N 3.16Å; V113-E117 PolarHBondContact O-N 3.11Å |
| 114 | A | 98.6 | Very high | 98.4 | Very high | 52 Ų | 52 | 108.2 Ų | 108.2 | 43% | 0.43 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59 | -46.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K110 E111 R116 E117 I118 | K110-A114 PolarHBondContact O-N 2.67Å; E111-A114 PolarHBondContact O-N 2.84Å; A114-R116 VanDerWaalsContact C-N 3.33Å; A114-R116 PolarHBondContact O-N 3.18Å; A114-E117 PolarHBondContact O-N 2.8Å; A114-I118 WeakPolarHBondContact O-CG2 3.47Å; A114-I118 PolarHBondContact O-N 3.49Å |
| 115 | R | 98.5 | Very high | 98.3 | Very high | 167 Ų | 167 | 111.7 Ų | 111.7 | 63% | 0.63 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.9 | -31.5 | 175.6 | -73.3 | -168.8 | -172.5 | -168.1 | 8.8 | 113.6 | E111 V113 G119 | E111-R115 HydrophobicContact CG-CG 4.37Å; E111-R115 VanDerWaalsContact O-CB 3.28Å; E111-R115 WeakPolarHBondContact O-CB 3.5Å; E111-R115 WeakPolarHBondContact O-CG 3.39Å; E111-R115 PolarHBondContact O-N 3.29Å; E111-R115 IonicContact OE1-CZ 2.72Å; E111-R115 IonicContact OE1-NE 2.75Å; E111-R115 PolarHBondContact OE1-NE 3.31Å; E111-R115 IonicContact OE1-NH2 3.18Å; E111-R115 PolarHBondContact OE1-NH2 3.27Å; V113-R115 PolarHBondContact O-N 2.98Å; R115-G119 WeakPolarHBondContact O-CA 3.42Å; R115-G119 PolarHBondContact O-N 3.34Å |
| 116 | R | 98.3 | Very high | 98.1 | Very high | 177 Ų | 177 | 115.6 Ų | 115.6 | 67% | 0.668 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -66.4 | -47.1 | 172.5 | -179.1 | -177.1 | -64.4 | 166.8 | 0.1 | 110.6 | K112 V113 A114 G119 I120 | K112-R116 VanDerWaalsContact O-CB 3.32Å; K112-R116 WeakPolarHBondContact O-CB 3.46Å; K112-R116 PolarHBondContact O-N 2.89Å; K112-R116 VanDerWaalsContact O-N 3.09Å; V113-R116 WeakPolarHBondContact O-CB 3.33Å; V113-R116 PolarHBondContact O-N 2.99Å; V113-R116 VanDerWaalsContact O-N 3.16Å; A114-R116 VanDerWaalsContact C-N 3.33Å; A114-R116 PolarHBondContact O-N 3.18Å; R116-G119 WeakPolarHBondContact O-CA 3.49Å; R116-G119 PolarHBondContact O-N 2.92Å; R116-G119 VanDerWaalsContact O-N 3.17Å; R116-I120 PolarHBondContact O-N 3Å |
| 117 | E | 98.6 | Very high | 97.9 | Very high | 128 Ų | 128 | 117.9 Ų | 117.9 | 60% | 0.598 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -64.4 | -50.3 | -175.8 | -156.6 | 67.3 | -171.7 | 0 | 0 | 111.8 | V113 A114 G119 I120 | V113-E117 PolarHBondContact O-N 3.11Å; A114-E117 PolarHBondContact O-N 2.8Å; E117-G119 PolarHBondContact O-N 3.14Å; E117-I120 PolarHBondContact O-N 2.73Å |
| 118 | I | 98.4 | Very high | 97.6 | Very high | 103 Ų | 103 | 118 Ų | 118 | 53% | 0.528 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -65.8 | -30.6 | 173.4 | -168.1 | 58.8 | 0 | 0 | 0 | 111.8 | A114 I120 L121 | A114-I118 WeakPolarHBondContact O-CG2 3.47Å; A114-I118 PolarHBondContact O-N 3.49Å; I118-I120 VanDerWaalsContact C-N 3.26Å; I118-I120 PolarHBondContact O-N 2.82Å; I118-L121 HydrophobicContact CD1-CD1 4.27Å; I118-L121 WeakPolarHBondContact O-CA 3.49Å; I118-L121 WeakPolarHBondContact O-CB 3.38Å; I118-L121 PolarHBondContact O-N 3.13Å |
| 119 | G | 98.4 | Very high | 97.4 | Very high | 27 Ų | 27 | 124.4 Ų | 124.4 | 28% | 0.278 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -59.3 | -33 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | R115 R116 E117 L121 T122 | R115-G119 WeakPolarHBondContact O-CA 3.42Å; R115-G119 PolarHBondContact O-N 3.34Å; R116-G119 WeakPolarHBondContact O-CA 3.49Å; R116-G119 PolarHBondContact O-N 2.92Å; R116-G119 VanDerWaalsContact O-N 3.17Å; E117-G119 PolarHBondContact O-N 3.14Å; G119-L121 PolarHBondContact O-N 3.44Å; G119-T122 PolarHBondContact O-N 3.11Å; G119-T122 PolarHBondContact O-OG1 2.85Å |
| 120 | I | 98.1 | Very high | 97.2 | Very high | 122 Ų | 122 | 123.5 Ų | 123.5 | 63% | 0.626 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.1 | -29.4 | 173.5 | -63.5 | 163.8 | 0 | 0 | 0 | 111.5 | R116 E117 I118 | R116-I120 PolarHBondContact O-N 3Å; E117-I120 PolarHBondContact O-N 2.73Å; I118-I120 VanDerWaalsContact C-N 3.26Å; I118-I120 PolarHBondContact O-N 2.82Å |
| 121 | L | 98.3 | Very high | 97 | Very high | 143 Ų | 143 | 123.4 Ų | 123.4 | 75% | 0.749 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | 7.8 | 179 | -52.8 | -178.8 | 0 | 0 | 0 | 113.1 | I118 G119 | I118-L121 HydrophobicContact CD1-CD1 4.27Å; I118-L121 WeakPolarHBondContact O-CA 3.49Å; I118-L121 WeakPolarHBondContact O-CB 3.38Å; I118-L121 PolarHBondContact O-N 3.13Å; G119-L121 PolarHBondContact O-N 3.44Å |
| 122 | T | 97.9 | Very high | 96.8 | Very high | 100 Ų | 100 | 129.8 Ų | 129.8 | 61% | 0.613 | 66% | 0.66 | S | S | * | * | trans | -107.6 | 154.6 | -179.7 | 67.4 | 0 | 0 | 0 | 0 | 113.3 | G119 | G119-T122 PolarHBondContact O-N 3.11Å; G119-T122 PolarHBondContact O-OG1 2.85Å | ||
| 123 | T | 97.3 | Very high | 96.5 | Very high | 137 Ų | 137 | 130.3 Ų | 130.3 | 84% | 0.84 | 67% | 0.667 | S | S | * | * | trans | -141.2 | 163.4 | 165.7 | -171.9 | 0 | 0 | 0 | 0 | 109.3 | K125 | T123-K125 PolarHBondContact O-N 3.18Š| ||
| 124 | N | 96.6 | Very high | 96.3 | Very high | 137 Ų | 137 | 133 Ų | 133 | 73% | 0.733 | 68% | 0.678 | S | S | * | * | trans | -66.2 | 122.7 | -178.7 | -75.4 | -37.2 | 0 | 0 | 0 | 111 | N126 | N124-N126 PolarHBondContact O-N 3.26Å; N124-N126 PolarHBondContact O-OD1 3.44Å | ||
| 125 | K | 96.3 | Very high | 96 | Very high | 186 Ų | 186 | 133.7 Ų | 133.7 | 81% | 0.809 | 68% | 0.684 | S | S | * | * | trans | -79.5 | 104.2 | 166.6 | 58.7 | 176 | -172.9 | 177 | 0 | 109.4 | T123 T127 | T123-K125 PolarHBondContact O-N 3.18Å; K125-T127 HydrophobicContact CD-CG2 4.48Å; K125-T127 HydrophobicContact CG-CG2 4.39Å; K125-T127 PolarHBondContact O-N 2.84Å | ||
| 126 | N | 94.4 | Very high | 95.8 | Very high | 158 Ų | 158 | 130 Ų | 130 | 85% | 0.845 | 68% | 0.681 | S | S | * | * | trans | -73.5 | 60.3 | 178 | -63.9 | 90.5 | 0 | 0 | 0 | 112.5 | N124 | N124-N126 PolarHBondContact O-N 3.26Å; N124-N126 PolarHBondContact O-OD1 3.44Å | ||
| 127 | T | 94.6 | Very high | 95.5 | Very high | 116 Ų | 116 | 128.4 Ų | 128.4 | 71% | 0.712 | 69% | 0.692 | S | S | * | * | trans | -86.2 | 116 | 175.8 | -176 | 0 | 0 | 0 | 0 | 110.6 | K125 | K125-T127 HydrophobicContact CD-CG2 4.48Å; K125-T127 HydrophobicContact CG-CG2 4.39Å; K125-T127 PolarHBondContact O-N 2.84Å | ||
| 128 | A | 93.3 | Very high | 95.3 | Very high | 93 Ų | 93 | 128.9 Ų | 128.9 | 77% | 0.769 | 70% | 0.698 | S | S | * | * | trans | -107.4 | 128.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 129 | R | 94.6 | Very high | 94.9 | Very high | 223 Ų | 223 | 130 Ų | 130 | 84% | 0.842 | 71% | 0.705 | S | S | * | * | trans | -89 | 110.1 | 174.8 | -173.1 | 178.4 | -176 | -87.3 | 7.4 | 109.6 | ||||
| 130 | T | 93.8 | Very high | 94.7 | Very high | 100 Ų | 100 | 137.3 Ų | 137.3 | 61% | 0.613 | 73% | 0.732 | S | S | * | * | trans | -106.1 | 161.6 | 175.9 | -168.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 131 | H | 94.8 | Very high | 94.4 | Very high | 135 Ų | 135 | 141.6 Ų | 141.6 | 63% | 0.625 | 74% | 0.74 | S | S | * | * | trans | -77.8 | 141.4 | 171.1 | -73.8 | -111.5 | 0 | 0 | 0 | 110 | I133 I134 | H131-I133 PolarHBondContact O-N 3.49Å; H131-I133 VanDerWaalsContact O-N 3.17Å; H131-I134 HydrophobicContact CB-CG1 4.21Å | ||
| 132 | K | 94.5 | Very high | 94.2 | Very high | 218 Ų | 218 | 141.2 Ų | 141.2 | 95% | 0.948 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -58.8 | -28.2 | 179.1 | -67.6 | -173.5 | 178 | -176.5 | 0 | 113.4 | ||
| 133 | I | 93.3 | Very high | 94 | Very high | 148 Ų | 148 | 142.9 Ų | 142.9 | 76% | 0.759 | 76% | 0.756 | S | S | * | * | trans | -134.3 | 125 | 173.7 | -57.4 | 175.6 | 0 | 0 | 0 | 106.1 | H131 | H131-I133 PolarHBondContact O-N 3.49Å; H131-I133 VanDerWaalsContact O-N 3.17Å | ||
| 134 | I | 94.3 | Very high | 93.8 | Very high | 123 Ų | 123 | 145.8 Ų | 145.8 | 63% | 0.631 | 75% | 0.751 | S | S | * | * | trans | -109.4 | 110.3 | 166.7 | -62 | 171.4 | 0 | 0 | 0 | 105.8 | H131 | H131-I134 HydrophobicContact CB-CG1 4.21Š| ||
| 135 | A | 92.7 | Very high | 93.8 | Very high | 66 Ų | 66 | 148 Ų | 148 | 55% | 0.545 | 75% | 0.751 | S | S | . | * | trans | -70.4 | 140.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | L139 | A135-L139 HydrophobicContact CB-CD2 4.36Š| ||
| 136 | P | 93.1 | Very high | 93.6 | Very high | 89 Ų | 89 | 144 Ų | 144 | 58% | 0.578 | 74% | 0.737 | S | S | * | * | trans | -65.5 | 141 | 176.1 | 27.9 | -34 | 0 | 0 | 0 | 110.5 | N138 L139 | P136-N138 CarbonylContact O-C 3.52Å; P136-N138 PolarHBondContact O-N 3.26Å; P136-L139 HydrophobicContact CG-CD2 4.32Å | ||
| 137 | T | 92.6 | Very high | 93.5 | Very high | 145 Ų | 145 | 146.9 Ų | 146.9 | 89% | 0.89 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -54.3 | -31.5 | -177 | -41.7 | 0 | 0 | 0 | 0 | 113.3 | ||
| 138 | N | 93.4 | Very high | 93.4 | Very high | 137 Ų | 137 | 150 Ų | 150 | 73% | 0.733 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -109.8 | 107 | 169.2 | -66.8 | -71 | 0 | 0 | 0 | 108.6 | P136 | P136-N138 CarbonylContact O-C 3.52Å; P136-N138 PolarHBondContact O-N 3.26Å |
| 139 | L | 91.3 | Very high | 93.3 | Very high | 128 Ų | 128 | 151 Ų | 151 | 67% | 0.67 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 143 | 167.8 | -61.8 | 178.2 | 0 | 0 | 0 | 109.8 | A135 P136 R141 | A135-L139 HydrophobicContact CB-CD2 4.36Å; P136-L139 HydrophobicContact CG-CD2 4.32Å; L139-R141 PolarHBondContact O-N 3.01Å |
| 140 | E | 93.1 | Very high | 93.2 | Very high | 180 Ų | 180 | 146.6 Ų | 146.6 | 84% | 0.841 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 130.5 | 176.2 | -169.5 | -179.5 | 160.1 | 0 | 0 | 110.4 | P142 | E140-P142 WeakPolarHBondContact O-CD 3.42Š|
| 141 | R | 92.3 | Very high | 92.9 | Very high | 212 Ų | 212 | 146.5 Ų | 146.5 | 80% | 0.8 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -83 | 121.6 | -178 | -65.4 | -178.2 | -179.2 | 177.9 | 0.9 | 109.3 | L139 V143 | L139-R141 PolarHBondContact O-N 3.01Å; R141-V143 PolarHBondContact O-N 2.9Å |
| 142 | P | 93.3 | Very high | 92.7 | Very high | 135 Ų | 135 | 148.8 Ų | 148.8 | 88% | 0.877 | 73% | 0.731 | S | S | * | * | trans | -57 | 109.2 | -179.9 | -27.4 | 36.1 | 0 | 0 | 0 | 112.5 | E140 R144 | E140-P142 WeakPolarHBondContact O-CD 3.42Å; P142-R144 PolarHBondContact O-N 3.1Å | ||
| 143 | V | 94 | Very high | 92.4 | Very high | 134 Ų | 134 | 142.5 Ų | 142.5 | 81% | 0.812 | 71% | 0.707 | S | S | * | * | trans | -78.6 | 115.8 | -178.9 | -177 | 0 | 0 | 0 | 0 | 109.4 | R141 Y145 | R141-V143 PolarHBondContact O-N 2.9Å; V143-Y145 PolarHBondContact O-N 2.76Å | ||
| 144 | R | 94.6 | Very high | 92.3 | Very high | 199 Ų | 199 | 140.5 Ų | 140.5 | 75% | 0.751 | 70% | 0.702 | S | S | * | * | trans | -66.5 | 121.5 | 176.1 | -176.2 | 174.1 | 66.8 | 100.9 | -1.9 | 110.2 | P142 | P142-R144 PolarHBondContact O-N 3.1Š| ||
| 145 | Y | 94.8 | Very high | 92.2 | Very high | 183 Ų | 183 | 140.1 Ų | 140.1 | 72% | 0.718 | 70% | 0.7 | S | S | * | * | trans | -57.7 | 136.5 | 173.2 | 176.3 | -106 | 0 | 0 | 0 | 111.8 | V143 R147 | V143-Y145 PolarHBondContact O-N 2.76Å; Y145-R147 HydrophobicContact CE1-CG 3.56Å | ||
| 146 | I | 92 | Very high | 91.9 | Very high | 103 Ų | 103 | 138.1 Ų | 138.1 | 53% | 0.528 | 68% | 0.68 | S | S | . | * | trans | -132.6 | 125 | 175.8 | -62.8 | 174.3 | 0 | 0 | 0 | 107.3 | K148 | I146-K148 PolarHBondContact O-N 3.12Š| ||
| 147 | R | 92.9 | Very high | 91.7 | Very high | 217 Ų | 217 | 140.4 Ų | 140.4 | 82% | 0.819 | 69% | 0.688 | S | S | * | * | trans | -67.3 | 112.6 | 172.1 | -64.4 | -177.2 | 71.6 | -141.8 | 1.2 | 109 | Y145 | Y145-R147 HydrophobicContact CE1-CG 3.56Š| ||
| 148 | K | 92.9 | Very high | 91.6 | Very high | 181 Ų | 181 | 138.5 Ų | 138.5 | 79% | 0.787 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 148.4 | 162.8 | -63.5 | -173.9 | 179.3 | -175 | 0 | 108.8 | I146 | I146-K148 PolarHBondContact O-N 3.12Š|
| 149 | P | 90.6 | Very high | 91.4 | Very high | 115 Ų | 115 | 135.3 Ų | 135.3 | 75% | 0.747 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 167.8 | 164.9 | 30.9 | -35.1 | 0 | 0 | 0 | 110.3 | D151 | P149-D151 PolarHBondContact O-N 2.75Š|
| 150 | I | 92.1 | Very high | 91.1 | Very high | 130 Ų | 130 | 138.5 Ų | 138.5 | 67% | 0.667 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 119.7 | 170.1 | -58.7 | 174.8 | 0 | 0 | 0 | 107.5 | Y152 | I150-Y152 HydrophobicContact CG2-CD1 4.03Å; I150-Y152 HydrophobicContact CG2-CD2 4.37Å; I150-Y152 HydrophobicContact CG2-CE1 3.64Å; I150-Y152 HydrophobicContact CG2-CE2 4.02Å; I150-Y152 HydrophobicContact CG2-CG 4.37Å |
| 151 | D | 89.3 | Confident | 90.5 | Very high | 98 Ų | 98 | 131.5 Ų | 131.5 | 52% | 0.524 | 66% | 0.662 | S | S | . | * | trans | -103.7 | 104.8 | 174.7 | -174.2 | -10.3 | 0 | 0 | 0 | 107.9 | P149 N153 V154 | P149-D151 PolarHBondContact O-N 2.75Å; D151-N153 PolarHBondContact O-N 2.75Å; D151-N153 PolarHBondContact OD1-N 2.84Å; D151-V154 HydrophobicContact CB-CB 4.47Å; D151-V154 WeakPolarHBondContact O-CG1 3.49Å | ||
| 152 | Y | 88.6 | Confident | 89.9 | Confident | 184 Ų | 184 | 127.9 Ų | 127.9 | 72% | 0.722 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | -17.2 | -179.6 | -66 | -70.9 | 0 | 0 | 0 | 112.5 | I150 | I150-Y152 HydrophobicContact CG2-CD1 4.03Å; I150-Y152 HydrophobicContact CG2-CD2 4.37Å; I150-Y152 HydrophobicContact CG2-CE1 3.64Å; I150-Y152 HydrophobicContact CG2-CE2 4.02Å; I150-Y152 HydrophobicContact CG2-CG 4.37Å |
| 153 | N | 89.1 | Confident | 89.3 | Confident | 85 Ų | 85 | 126.2 Ų | 126.2 | 46% | 0.455 | 64% | 0.643 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.5 | -2.1 | -174.2 | -56.2 | 15.2 | 0 | 0 | 0 | 111.8 | D151 L155 D156 | D151-N153 PolarHBondContact O-N 2.75Å; D151-N153 PolarHBondContact OD1-N 2.84Å; N153-L155 PolarHBondContact O-N 3.14Å; N153-D156 VanDerWaalsContact O-CB 3.31Å; N153-D156 WeakPolarHBondContact O-CB 3.44Å; N153-D156 PolarHBondContact O-N 3.01Å |
| 154 | V | 92.1 | Very high | 88.1 | Confident | 106 Ų | 106 | 127.9 Ų | 127.9 | 64% | 0.642 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -10 | -176.7 | 78.2 | 0 | 0 | 0 | 0 | 114.1 | D151 | D151-V154 HydrophobicContact CB-CB 4.47Å; D151-V154 WeakPolarHBondContact O-CG1 3.49Å |
| 155 | L | 90.8 | Very high | 86.3 | Confident | 115 Ų | 115 | 127.4 Ų | 127.4 | 60% | 0.602 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.3 | 4.4 | 175.2 | -58.4 | 179 | 0 | 0 | 0 | 113.4 | N153 D157 V158 | N153-L155 PolarHBondContact O-N 3.14Å; L155-D157 PolarHBondContact O-N 3.29Å; L155-D157 VanDerWaalsContact O-N 3.14Å; L155-V158 HydrophobicContact CD2-CG2 4.14Å; L155-V158 WeakPolarHBondContact O-CB 3.45Å; L155-V158 PolarHBondContact O-N 3.29Å |
| 156 | D | 87.9 | Confident | 84.3 | Confident | 24 Ų | 24 | 121.7 Ų | 121.7 | 13% | 0.128 | 64% | 0.644 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -61.9 | -23.5 | -176.6 | -85.9 | 12.5 | 0 | 0 | 0 | 113.8 | N153 G161 K163 | N153-D156 VanDerWaalsContact O-CB 3.31Å; N153-D156 WeakPolarHBondContact O-CB 3.44Å; N153-D156 PolarHBondContact O-N 3.01Å; D156-G161 WeakPolarHBondContact O-CA 3.41Å; D156-K163 HydrophobicContact CB-CD 4.16Å; D156-K163 HydrophobicContact CB-CG 4.12Å; D156-K163 WeakPolarHBondContact OD2-CG 3.43Å |
| 157 | D | 88.5 | Confident | 82 | Confident | 137 Ų | 137 | 124.1 Ų | 124.1 | 73% | 0.733 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.7 | 8.5 | 177.2 | -64.9 | -58.4 | 0 | 0 | 0 | 112.7 | L155 K163 | L155-D157 PolarHBondContact O-N 3.29Å; L155-D157 VanDerWaalsContact O-N 3.14Å; D157-K163 VanDerWaalsContact CG-NZ 3.3Å; D157-K163 IonicContact OD1-NZ 2.65Å; D157-K163 PolarHBondContact OD1-NZ 3.32Å; D157-K163 IonicContact OD2-NZ 3.37Å; D157-K163 PolarHBondContact OD2-NZ 2.98Å |
| 158 | V | 90.4 | Very high | 80.2 | Confident | 105 Ų | 105 | 121.9 Ų | 121.9 | 64% | 0.636 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.4 | 93.3 | 179.1 | -176.1 | 0 | 0 | 0 | 0 | 110 | L155 | L155-V158 HydrophobicContact CD2-CG2 4.14Å; L155-V158 WeakPolarHBondContact O-CB 3.45Å; L155-V158 PolarHBondContact O-N 3.29Å |
| 159 | G | 88.8 | Confident | 78 | Confident | 70 Ų | 70 | 121 Ų | 121 | 72% | 0.722 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 84.3 | -126.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 160 | H | 84.8 | Confident | 76.3 | Confident | 195 Ų | 195 | 120.5 Ų | 120.5 | 90% | 0.903 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.9 | 65.6 | -179.6 | -64 | 94.2 | 0 | 0 | 0 | 110.5 | ||
| 161 | G | 81.2 | Confident | 74.1 | Confident | 33 Ų | 33 | 120.7 Ų | 120.7 | 34% | 0.34 | 67% | 0.674 | S | S | . | * | trans | -67.1 | 146 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | D156 | D156-G161 WeakPolarHBondContact O-CA 3.41Š| ||
| 162 | V | 78.7 | Confident | 72.4 | Confident | 136 Ų | 136 | 127.7 Ų | 127.7 | 82% | 0.824 | 69% | 0.693 | S | S | * | * | trans | -108.7 | 87.7 | -175.1 | -177.8 | 0 | 0 | 0 | 0 | 109.7 | Q164 | V162-Q164 PolarHBondContact O-N 3.29Š| ||
| 163 | K | 81.2 | Confident | 70.2 | Confident | 100 Ų | 100 | 123.4 Ų | 123.4 | 44% | 0.435 | 70% | 0.696 | S | S | . | * | trans | -69.3 | 124 | -172.3 | -46.5 | -151.7 | 179.6 | -151.5 | 0 | 111.6 | D156 D157 H165 | D156-K163 HydrophobicContact CB-CD 4.16Å; D156-K163 HydrophobicContact CB-CG 4.12Å; D156-K163 WeakPolarHBondContact OD2-CG 3.43Å; D157-K163 VanDerWaalsContact CG-NZ 3.3Å; D157-K163 IonicContact OD1-NZ 2.65Å; D157-K163 PolarHBondContact OD1-NZ 3.32Å; D157-K163 IonicContact OD2-NZ 3.37Å; D157-K163 PolarHBondContact OD2-NZ 2.98Å; K163-H165 PolarHBondContact O-N 3.01Å | ||
| 164 | Q | 69.6 | Low | 68 | Low | 169 Ų | 169 | 123 Ų | 123 | 79% | 0.79 | 71% | 0.711 | S | S | * | * | trans | -68.2 | 95.6 | -175.2 | -169.9 | 177.6 | 28.5 | 0 | 0 | 112.6 | V162 G166 | V162-Q164 PolarHBondContact O-N 3.29Å; Q164-G166 PolarHBondContact O-N 3.38Å | ||
| 165 | H | 56.5 | Low | 65.8 | Low | 190 Ų | 190 | 124.7 Ų | 124.7 | 88% | 0.88 | 72% | 0.722 | S | S | * | * | trans | -81.3 | 101 | 173.4 | -95.2 | 52.2 | 0 | 0 | 0 | 111.7 | K163 | K163-H165 PolarHBondContact O-N 3.01Š| ||
| 166 | G | 52.6 | Low | 63.7 | Low | 63 Ų | 63 | 127.4 Ų | 127.4 | 65% | 0.649 | 74% | 0.736 | S | S | * | * | trans | 162.4 | 125.2 | 163.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | Q164 | Q164-G166 PolarHBondContact O-N 3.38Š| ||
| 167 | N | 43.3 | Very low | 61.6 | Low | 154 Ų | 154 | 131.6 Ų | 131.6 | 82% | 0.824 | 77% | 0.767 | S | S | * | * | trans | 57.4 | 116.4 | 164.4 | -87.9 | -4.3 | 0 | 0 | 0 | 120.5 | Q169 | N167-Q169 PolarHBondContact O-N 3.22Š| ||
| 168 | N | 55 | Low | 59.7 | Low | 169 Ų | 169 | 135.6 Ų | 135.6 | 90% | 0.904 | 77% | 0.772 | S | S | * | * | trans | -62.3 | 111.9 | 153.7 | -80.6 | -64.5 | 0 | 0 | 0 | 110.9 | ||||
| 169 | Q | 46.9 | Very low | 57.5 | Low | 163 Ų | 163 | 136.9 Ų | 136.9 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | trans | -129.3 | 118.7 | 150 | -73.2 | -162.6 | -2 | 0 | 0 | 109.7 | N167 V171 | N167-Q169 PolarHBondContact O-N 3.22Å; Q169-V171 PolarHBondContact O-N 2.78Å | ||
| 170 | A | 54.1 | Low | 55.5 | Low | 104 Ų | 104 | 139.2 Ų | 139.2 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | trans | -73.7 | 87.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | R172 | A170-R172 PolarHBondContact O-N 3.47Š| ||
| 171 | V | 47.2 | Very low | 53.8 | Low | 135 Ų | 135 | 135.3 Ų | 135.3 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | -60.3 | 112.3 | 174.1 | 179.2 | 0 | 0 | 0 | 0 | 108.8 | Q169 A173 | Q169-V171 PolarHBondContact O-N 2.78Å; V171-A173 PolarHBondContact O-N 2.88Å | ||
| 172 | R | 53.1 | Low | 52.3 | Low | 244 Ų | 244 | 139.5 Ų | 139.5 | 92% | 0.921 | 79% | 0.79 | S | S | * | * | trans | -64.4 | 89.4 | 177.3 | -80.7 | 177.8 | 162.1 | 175.5 | -5.6 | 111 | A170 | A170-R172 PolarHBondContact O-N 3.47Š| ||
| 173 | A | 42.7 | Very low | 51 | Low | 95 Ų | 95 | 139.2 Ų | 139.2 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -63.3 | 133.8 | 155.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | V171 | V171-A173 PolarHBondContact O-N 2.88Š| ||
| 174 | G | 43 | Very low | 49.5 | Very low | 75 Ų | 75 | 143.9 Ų | 143.9 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | -63.2 | 144.2 | -168.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | L176 | G174-L176 PolarHBondContact O-N 3.11Š| ||
| 175 | T | 45.4 | Very low | 48.5 | Very low | 143 Ų | 143 | 144.5 Ų | 144.5 | 88% | 0.877 | 81% | 0.812 | S | S | * | * | trans | -67.5 | 110.4 | 173.6 | 48.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 176 | L | 45.8 | Very low | 48.2 | Very low | 171 Ų | 171 | 140.9 Ų | 140.9 | 90% | 0.895 | 81% | 0.805 | S | S | * | * | trans | -117.2 | 143 | 156.4 | -73.1 | 177.1 | 0 | 0 | 0 | 109.3 | G174 | G174-L176 PolarHBondContact O-N 3.11Š| ||
| 177 | S | 44 | Very low | 48.1 | Very low | 112 Ų | 112 | 144 Ų | 144 | 78% | 0.783 | 81% | 0.814 | S | S | * | * | trans | -70.1 | 143.3 | -151.7 | -58.5 | 0 | 0 | 0 | 0 | 115.2 | T179 | S177-T179 PolarHBondContact O-N 3.21Š| ||
| 178 | R | 49.2 | Very low | 48.2 | Very low | 221 Ų | 221 | 141.9 Ų | 141.9 | 83% | 0.834 | 81% | 0.811 | S | S | * | * | trans | -44.9 | 104.1 | 162.7 | 174.6 | -174.5 | 125.8 | -132.5 | 1.6 | 111.2 | ||||
| 179 | T | 44.9 | Very low | 48 | Very low | 132 Ų | 132 | 139.1 Ų | 139.1 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -89 | 138.2 | 160.4 | 48.6 | 0 | 0 | 0 | 0 | 109.1 | S177 | S177-T179 PolarHBondContact O-N 3.21Š|
| 180 | N | 45.7 | Very low | 47.9 | Very low | 119 Ų | 119 | 137.6 Ų | 137.6 | 64% | 0.636 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 152.6 | -178.5 | -72 | -22.1 | 0 | 0 | 0 | 111 | ||
| 181 | P | 49.2 | Very low | 47.3 | Very low | 113 Ų | 113 | 141.1 Ų | 141.1 | 73% | 0.734 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 135.3 | 176.3 | 26 | -34.6 | 0 | 0 | 0 | 110.7 | ||
| 182 | P | 49.6 | Very low | 47.5 | Very low | 122 Ų | 122 | 141 Ų | 141 | 79% | 0.792 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 142.4 | 171.8 | 28 | -33.8 | 0 | 0 | 0 | 109.9 | ||
| 183 | T | 52.9 | Low | 46.7 | Very low | 130 Ų | 130 | 132.8 Ų | 132.8 | 80% | 0.798 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 145.5 | -175.3 | 43 | 0 | 0 | 0 | 0 | 112.2 | K185 | T183-K185 PolarHBondContact O-N 3.01Š|
| 184 | Q | 48.7 | Very low | 46.7 | Very low | 198 Ų | 198 | 140.8 Ų | 140.8 | 93% | 0.925 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -73.7 | 88 | 175.1 | -64.7 | -175.2 | 27.2 | 0 | 0 | 110.8 | ||
| 185 | K | 49.6 | Very low | 46.4 | Very low | 182 Ų | 182 | 140.9 Ų | 140.9 | 79% | 0.791 | 81% | 0.814 | S | S | * | * | trans | -137.5 | 135.5 | 155.4 | -73.5 | -166 | 175.6 | -175 | 0 | 109.8 | T183 | T183-K185 PolarHBondContact O-N 3.01Š| ||
| 186 | P | 48.2 | Very low | 46.2 | Very low | 114 Ų | 114 | 140.2 Ų | 140.2 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 150.7 | 164.4 | 30.7 | -34.1 | 0 | 0 | 0 | 109.4 | S188 | P186-S188 PolarHBondContact O-N 3.34Š|
| 187 | P | 51.8 | Low | 46 | Very low | 129 Ų | 129 | 140.4 Ų | 140.4 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 122.3 | 172.7 | 27.9 | -33 | 0 | 0 | 0 | 109.9 | ||
| 188 | S | 44.9 | Very low | 45.6 | Very low | 109 Ų | 109 | 139 Ų | 139 | 76% | 0.762 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 147.7 | 169.6 | -57.3 | 0 | 0 | 0 | 0 | 110.6 | P186 | P186-S188 PolarHBondContact O-N 3.34Š|
| 189 | P | 50 | Low | 45.5 | Very low | 110 Ų | 110 | 139.4 Ų | 139.4 | 71% | 0.714 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 151.4 | 172.7 | 28.5 | -35.2 | 0 | 0 | 0 | 111 | M191 | P189-M191 PolarHBondContact O-N 2.91Š|
| 190 | P | 46.7 | Very low | 45.4 | Very low | 131 Ų | 131 | 139.6 Ų | 139.6 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 118.2 | 179.7 | 27.3 | -33.7 | 0 | 0 | 0 | 111.2 | ||
| 191 | M | 41.4 | Very low | 45.1 | Very low | 178 Ų | 178 | 140.2 Ų | 140.2 | 88% | 0.877 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 141.4 | 164.7 | -81.8 | -77.4 | -166.3 | 0 | 0 | 110.3 | P189 G193 | P189-M191 PolarHBondContact O-N 2.91Å; M191-G193 PolarHBondContact O-N 3.04Å |
| 192 | S | 49.8 | Very low | 45.2 | Very low | 132 Ų | 132 | 140.7 Ų | 140.7 | 92% | 0.923 | 82% | 0.824 | S | S | * | * | trans | -72.4 | 81.7 | 177 | 32 | 0 | 0 | 0 | 0 | 112 | ||||
| 193 | G | 37 | Very low | 44.7 | Very low | 72 Ų | 72 | 144.9 Ų | 144.9 | 74% | 0.742 | 83% | 0.826 | S | S | * | * | trans | -95 | 115.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | M191 G195 | M191-G193 PolarHBondContact O-N 3.04Å; G193-G195 PolarHBondContact O-N 3.41Å | ||
| 194 | R | 42.7 | Very low | 44.3 | Very low | 264 Ų | 264 | 147.6 Ų | 147.6 | 100% | 0.996 | 83% | 0.826 | S | S | * | * | trans | -75.5 | 111.4 | 174.6 | 178.4 | -175.3 | -178.2 | -170.7 | 2.3 | 110.5 | ||||
| 195 | G | 36.3 | Very low | 44.2 | Very low | 76 Ų | 76 | 144.4 Ų | 144.4 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | trans | -151.8 | 132.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | G193 | G193-G195 PolarHBondContact O-N 3.41Š| ||
| 196 | T | 42.8 | Very low | 44.4 | Very low | 129 Ų | 129 | 142.6 Ų | 142.6 | 79% | 0.791 | 82% | 0.818 | S | S | * | * | trans | -89.4 | 152.4 | -169.8 | 43 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 197 | L | 41.3 | Very low | 44.6 | Very low | 175 Ų | 175 | 145.5 Ų | 145.5 | 92% | 0.916 | 82% | 0.822 | S | S | * | * | trans | 60.6 | 122 | 161 | -84.8 | 79.3 | 0 | 0 | 0 | 118.8 | ||||
| 198 | G | 35.4 | Very low | 44.9 | Very low | 84 Ų | 84 | 145.3 Ų | 145.3 | 87% | 0.866 | 82% | 0.821 | S | S | * | * | trans | -178.3 | 132.6 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 199 | R | 45.6 | Very low | 45.5 | Very low | 229 Ų | 229 | 146.9 Ų | 146.9 | 86% | 0.864 | 83% | 0.826 | S | S | * | * | trans | -114.7 | 157.1 | -168.3 | -151.6 | -178.4 | -157.4 | -142.6 | 7.9 | 111.9 | ||||
| 200 | N | 43.3 | Very low | 46 | Very low | 136 Ų | 136 | 150.5 Ų | 150.5 | 73% | 0.727 | 83% | 0.83 | S | S | * | * | trans | 55.9 | 99.6 | 162.6 | 50.9 | -107 | 0 | 0 | 0 | 119.9 | ||||
| 201 | T | 41 | Very low | 46.3 | Very low | 131 Ų | 131 | 149.5 Ų | 149.5 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | trans | -126.2 | 145.4 | 145.3 | 54.8 | 0 | 0 | 0 | 0 | 109.8 | Y203 | T201-Y203 PolarHBondContact O-N 2.99Š| ||
| 202 | P | 49.8 | Very low | 47 | Very low | 123 Ų | 123 | 147.1 Ų | 147.1 | 80% | 0.799 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -97.1 | 45.7 | -166.4 | 39.2 | -38.2 | 0 | 0 | 0 | 114.5 | ||
| 203 | Y | 38.7 | Very low | 47.7 | Very low | 211 Ų | 211 | 147.2 Ų | 147.2 | 83% | 0.827 | 82% | 0.817 | S | S | * | * | trans | -124.2 | 94.9 | 170.3 | -83.7 | -84.1 | 0 | 0 | 0 | 110.5 | T201 T205 | T201-Y203 PolarHBondContact O-N 2.99Å; Y203-T205 PolarHBondContact O-N 3.12Å | ||
| 204 | K | 45.3 | Very low | 48.5 | Very low | 186 Ų | 186 | 149.2 Ų | 149.2 | 81% | 0.809 | 81% | 0.814 | S | S | * | * | trans | -82.2 | 93.1 | 178.1 | -173.3 | -179.4 | -177.6 | -177.8 | 0 | 109.7 | L206 | K204-L206 PolarHBondContact O-N 3.32Š| ||
| 205 | T | 47.5 | Very low | 49.1 | Very low | 131 Ų | 131 | 141.1 Ų | 141.1 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 125.1 | 161.8 | -45.1 | 0 | 0 | 0 | 0 | 108 | Y203 | Y203-T205 PolarHBondContact O-N 3.12Š|
| 206 | L | 52.4 | Low | 49.9 | Very low | 144 Ų | 144 | 145 Ų | 145 | 75% | 0.754 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 139.2 | 176.8 | -63.2 | 177 | 0 | 0 | 0 | 109.3 | K204 | K204-L206 PolarHBondContact O-N 3.32Š|
| 207 | E | 53 | Low | 50.1 | Low | 175 Ų | 175 | 145.7 Ų | 145.7 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -64 | 143.9 | 173.5 | -67.6 | -172.3 | 168 | 0 | 0 | 110.1 | V209 | E207-V209 PolarHBondContact O-N 3.05Å; E207-V209 VanDerWaalsContact O-N 3.1Å |
| 208 | P | 57.5 | Low | 50.5 | Low | 126 Ų | 126 | 147.7 Ų | 147.7 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 116.9 | 175.8 | -24.5 | 34.7 | 0 | 0 | 0 | 111.2 | K210 | P208-K210 PolarHBondContact O-N 2.95Š|
| 209 | V | 58.3 | Low | 50.7 | Low | 141 Ų | 141 | 151.6 Ų | 151.6 | 86% | 0.855 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 122.4 | 174.2 | 180 | 0 | 0 | 0 | 0 | 108.4 | E207 | E207-V209 PolarHBondContact O-N 3.05Å; E207-V209 VanDerWaalsContact O-N 3.1Å |
| 210 | K | 61.2 | Low | 50.5 | Low | 187 Ų | 187 | 146.9 Ų | 146.9 | 81% | 0.813 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 139 | 176.2 | -77.8 | -176 | 175.6 | 178.8 | 0 | 110 | P208 | P208-K210 PolarHBondContact O-N 2.95Š|
| 211 | P | 52.1 | Low | 50.1 | Low | 109 Ų | 109 | 145.3 Ų | 145.3 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 150.9 | 171 | 28.4 | -34.8 | 0 | 0 | 0 | 110.2 | T213 | P211-T213 PolarHBondContact O-N 3.46Š|
| 212 | P | 56.7 | Low | 50 | Low | 128 Ų | 128 | 145.5 Ų | 145.5 | 83% | 0.831 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 124.7 | -177.4 | 26.9 | -34.2 | 0 | 0 | 0 | 111.4 | ||
| 213 | T | 63 | Low | 49.3 | Very low | 134 Ų | 134 | 143.6 Ų | 143.6 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 128.3 | 169.3 | -46.1 | 0 | 0 | 0 | 0 | 109.4 | P211 | P211-T213 PolarHBondContact O-N 3.46Š|
| 214 | V | 53.7 | Low | 49.3 | Very low | 114 Ų | 114 | 145.4 Ų | 145.4 | 69% | 0.691 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 136.1 | 170.7 | -171.9 | 0 | 0 | 0 | 0 | 108.8 | ||
| 215 | P | 55.5 | Low | 48.7 | Very low | 94 Ų | 94 | 145.2 Ų | 145.2 | 61% | 0.61 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 146.2 | 171.6 | -24.6 | 35.1 | 0 | 0 | 0 | 112.3 | D217 | P215-D217 PolarHBondContact O-N 3.12Š|
| 216 | N | 53.4 | Low | 47.9 | Very low | 159 Ų | 159 | 141.8 Ų | 141.8 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | G | 310 helix | trans | -73.3 | -6.6 | -173.9 | -76 | -41.6 | 0 | 0 | 0 | 114.2 | Y218 | N216-Y218 PolarHBondContact O-N 3.27Š|
| 217 | D | 47.9 | Very low | 47.1 | Very low | 143 Ų | 143 | 140.5 Ų | 140.5 | 77% | 0.765 | 79% | 0.793 | S | S | * | * | G | 310 helix | trans | -76 | 7 | -169.1 | -45.9 | -71.4 | 0 | 0 | 0 | 114.4 | P215 | P215-D217 PolarHBondContact O-N 3.12Š|
| 218 | Y | 48.4 | Very low | 46.2 | Very low | 216 Ų | 216 | 140.9 Ų | 140.9 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | G | 310 helix | trans | -123.6 | 43.7 | -179.9 | -96.3 | -86.9 | 0 | 0 | 0 | 113.9 | N216 | N216-Y218 PolarHBondContact O-N 3.27Š|
| 219 | M | 40 | Very low | 45.1 | Very low | 166 Ų | 166 | 143.8 Ų | 143.8 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -123.6 | 99.4 | 153.4 | -87.8 | -150.7 | 69.2 | 0 | 0 | 111.4 | S221 | M219-S221 PolarHBondContact O-N 3.38Š| ||
| 220 | T | 41.8 | Very low | 43.8 | Very low | 130 Ų | 130 | 140.3 Ų | 140.3 | 80% | 0.798 | 79% | 0.79 | S | S | * | * | trans | -69.7 | 112.5 | 172.8 | -51.8 | 0 | 0 | 0 | 0 | 110.6 | P222 | T220-P222 WeakPolarHBondContact O-CD 3.47Š| ||
| 221 | S | 34.7 | Very low | 42.6 | Very low | 103 Ų | 103 | 139.5 Ų | 139.5 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | trans | -65.6 | 121.2 | 175.7 | -55.4 | 0 | 0 | 0 | 0 | 112 | M219 A223 | M219-S221 PolarHBondContact O-N 3.38Å; S221-A223 VanDerWaalsContact C-N 3.29Å; S221-A223 PolarHBondContact O-N 2.91Å | ||
| 222 | P | 39.5 | Very low | 41.8 | Very low | 135 Ų | 135 | 141.3 Ų | 141.3 | 88% | 0.877 | 79% | 0.788 | S | S | * | * | trans | -83.4 | 67.1 | 179.2 | 34.6 | -35.3 | 0 | 0 | 0 | 111.5 | T220 | T220-P222 WeakPolarHBondContact O-CD 3.47Š| ||
| 223 | A | 34.8 | Very low | 40.7 | Very low | 83 Ų | 83 | 141.4 Ų | 141.4 | 69% | 0.686 | 78% | 0.782 | S | S | * | * | trans | -151.4 | 45 | -172.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | S221 | S221-A223 VanDerWaalsContact C-N 3.29Å; S221-A223 PolarHBondContact O-N 2.91Å | ||
| 224 | R | 38 | Very low | 39.3 | Very low | 249 Ų | 249 | 140.5 Ų | 140.5 | 94% | 0.94 | 78% | 0.78 | S | S | * | * | trans | -152.3 | 98.8 | 156.1 | -81.2 | -154.4 | -179.2 | -108.1 | -4.7 | 113.3 | ||||
| 225 | L | 33.7 | Very low | 39 | Very low | 182 Ų | 182 | 141.4 Ų | 141.4 | 95% | 0.953 | 79% | 0.789 | S | S | * | * | trans | -162.5 | 141.3 | 148.5 | -112.9 | 164.9 | 0 | 0 | 0 | 108 | ||||
| 226 | G | 30.6 | Very low | 38 | Very low | 60 Ų | 60 | 140.6 Ų | 140.6 | 62% | 0.619 | 80% | 0.798 | S | S | * | * | trans | -115.1 | 163.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 227 | S | 36 | Very low | 37.3 | Very low | 117 Ų | 117 | 144.5 Ų | 144.5 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | 56.3 | 94.4 | 160.2 | -57.8 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 228 | Q | 33.2 | Very low | 36.7 | Very low | 183 Ų | 183 | 144.4 Ų | 144.4 | 86% | 0.855 | 81% | 0.805 | S | S | * | * | -173.3 | 145 | 115.4 | -103 | 173.2 | 62.7 | 0 | 0 | 113.9 | |||||
| 229 | H | 34.9 | Very low | 35.9 | Very low | 186 Ų | 186 | 139 Ų | 139 | 86% | 0.861 | 81% | 0.805 | S | S | * | * | trans | 34.3 | 128.4 | 151.4 | -86.2 | 84.4 | 0 | 0 | 0 | 122.1 | ||||
| 230 | G | 31.2 | Very low | 35.7 | Very low | 68 Ų | 68 | 136.5 Ų | 136.5 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | 120.9 | 93.9 | 118.2 | 0 | 0 | 0 | 0 | 0 | 120 | |||||
| 231 | Q | 34.6 | Very low | 35.4 | Very low | 170 Ų | 170 | 137.5 Ų | 137.5 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | trans | 60.3 | 134 | 141.7 | -75.3 | -165.9 | 18.6 | 0 | 0 | 123.2 | ||||
| 232 | Q | 35.6 | Very low | 35.4 | Very low | 147 Ų | 147 | 140.3 Ų | 140.3 | 69% | 0.687 | 81% | 0.81 | S | S | * | * | trans | 86.8 | 119.1 | 143.7 | -73.7 | 179.9 | 66.4 | 0 | 0 | 122.3 | ||||
| 233 | N | 34.1 | Very low | 35 | Very low | 131 Ų | 131 | 142 Ų | 142 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | trans | 79.6 | 99.2 | 136 | -61 | -8.6 | 0 | 0 | 0 | 122.7 | ||||
| 234 | S | 33.9 | Very low | 34.9 | Very low | 114 Ų | 114 | 149.6 Ų | 149.6 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | 89.5 | 141.4 | 127.3 | -58.9 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 235 | P | 46.8 | Very low | 34.7 | Very low | 134 Ų | 134 | 143.5 Ų | 143.5 | 87% | 0.87 | 81% | 0.81 | S | S | * | * | trans | -94.6 | 146.2 | -166.8 | 36.7 | -36.1 | 0 | 0 | 0 | 115.1 | ||||
| 236 | G | 34.6 | Very low | 34.5 | Very low | 77 Ų | 77 | 146.5 Ų | 146.5 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | -120.5 | 130.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 237 | R | 38 | Very low | 34.6 | Very low | 241 Ų | 241 | 150.3 Ų | 150.3 | 91% | 0.909 | 82% | 0.821 | S | S | * | * | trans | -59.2 | 148.1 | 177 | -62.5 | 166.4 | 162.7 | 176.9 | -5.8 | 113.1 | ||||
| 238 | T | 36.3 | Very low | 34.3 | Very low | 141 Ų | 141 | 153.7 Ų | 153.7 | 87% | 0.865 | 82% | 0.823 | S | S | * | * | -167.9 | 143.3 | 105 | 26.3 | 0 | 0 | 0 | 0 | 112 | |||||
| 239 | A | 32.4 | Very low | 34.1 | Very low | 103 Ų | 103 | 151.1 Ų | 151.1 | 85% | 0.851 | 83% | 0.826 | S | S | * | * | trans | -96.7 | 141.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 240 | S | 35.8 | Very low | 33.9 | Very low | 113 Ų | 113 | 145.5 Ų | 145.5 | 79% | 0.79 | 82% | 0.818 | S | S | * | * | trans | -99.8 | 108.9 | -175.6 | -65.9 | 0 | 0 | 0 | 0 | 112 | N242 | S240-N242 PolarHBondContact O-N 3.34Š| ||
| 241 | L | 33.8 | Very low | 33.8 | Very low | 151 Ų | 151 | 148.6 Ų | 148.6 | 79% | 0.791 | 83% | 0.828 | S | S | * | * | trans | -86 | 95 | -177.2 | -171.9 | 74.8 | 0 | 0 | 0 | 112 | Q243 | L241-Q243 PolarHBondContact O-N 3.09Š| ||
| 242 | N | 34.6 | Very low | 33.7 | Very low | 161 Ų | 161 | 146.3 Ų | 146.3 | 86% | 0.861 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 123.5 | 175.8 | -85.2 | -28.1 | 0 | 0 | 0 | 112.3 | S240 | S240-N242 PolarHBondContact O-N 3.34Š|
| 243 | Q | 31.1 | Very low | 33.4 | Very low | 172 Ų | 172 | 143.3 Ų | 143.3 | 80% | 0.804 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -101 | 120.4 | 173.5 | -77.8 | 170.3 | 73.6 | 0 | 0 | 110.5 | L241 | L241-Q243 PolarHBondContact O-N 3.09Š|
| 244 | R | 32.9 | Very low | 33.2 | Very low | 241 Ų | 241 | 140.9 Ų | 140.9 | 91% | 0.909 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 131.2 | 175.9 | -155.4 | 177.6 | -169.4 | -167.4 | 4 | 110.1 | ||
| 245 | P | 33.8 | Very low | 33.1 | Very low | 121 Ų | 121 | 142 Ų | 142 | 79% | 0.786 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 139.9 | 177.3 | -17.8 | 31.2 | 0 | 0 | 0 | 112 | ||
| 246 | R | 30.8 | Very low | 32.2 | Very low | 245 Ų | 245 | 139.4 Ų | 139.4 | 93% | 0.925 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 133.6 | 165.3 | -76.7 | -171.9 | 174.6 | -174 | -1.6 | 110.2 | ||
| 247 | T | 31.4 | Very low | 32 | Very low | 141 Ų | 141 | 141.6 Ų | 141.6 | 87% | 0.865 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 157.3 | 170.1 | 42.7 | 0 | 0 | 0 | 0 | 111 | ||
| 248 | H | 31.4 | Very low | 31.7 | Very low | 187 Ų | 187 | 141.6 Ų | 141.6 | 87% | 0.866 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 141.6 | 177.8 | -69.7 | -85.1 | 0 | 0 | 0 | 112 | ||
| 249 | S | 29 | Very low | 31.3 | Very low | 130 Ų | 130 | 144.4 Ų | 144.4 | 91% | 0.909 | 86% | 0.858 | S | S | * | * | trans | -142.1 | 161 | 157.7 | -74.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 250 | G | 29.5 | Very low | 31.2 | Very low | 68 Ų | 68 | 146.4 Ų | 146.4 | 70% | 0.701 | 85% | 0.854 | S | S | * | * | trans | -155 | -163.5 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 251 | S | 29.1 | Very low | 31 | Very low | 132 Ų | 132 | 146 Ų | 146 | 92% | 0.923 | 85% | 0.851 | S | S | * | * | trans | 72.5 | 150.1 | -158.4 | -61.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 252 | S | 33.3 | Very low | 30.9 | Very low | 123 Ų | 123 | 142.3 Ų | 142.3 | 86% | 0.86 | 85% | 0.85 | S | S | * | * | cis | -135.6 | 166.5 | -3.1 | 45.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 253 | G | 29.3 | Very low | 30.9 | Very low | 84 Ų | 84 | 140.9 Ų | 140.9 | 87% | 0.866 | 85% | 0.853 | S | S | * | * | trans | -105.3 | 168.3 | -170.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 254 | G | 29.2 | Very low | 31 | Very low | 80 Ų | 80 | 138.5 Ų | 138.5 | 83% | 0.825 | 86% | 0.855 | S | S | * | * | trans | -145.8 | 146.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 255 | S | 31.3 | Very low | 31.3 | Very low | 137 Ų | 137 | 134.6 Ų | 134.6 | 96% | 0.958 | 85% | 0.85 | S | S | * | * | trans | -106.8 | 138 | -168.6 | -58.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 256 | G | 27.9 | Very low | 31.3 | Very low | 79 Ų | 79 | 134.7 Ų | 134.7 | 81% | 0.814 | 85% | 0.851 | S | S | * | * | trans | -158.9 | 134.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 257 | S | 31.1 | Very low | 31.4 | Very low | 123 Ų | 123 | 131 Ų | 131 | 86% | 0.86 | 85% | 0.848 | S | S | * | * | trans | -42.2 | 144.3 | -168.5 | -52.6 | 0 | 0 | 0 | 0 | 119 | ||||
| 258 | R | 31 | Very low | 31.4 | Very low | 241 Ų | 241 | 128.6 Ų | 128.6 | 91% | 0.909 | 84% | 0.842 | S | S | * | * | trans | -59.7 | 150.3 | 148.3 | -75.9 | 169.2 | 152.6 | 158.1 | -9.1 | 109.8 | ||||
| 259 | E | 29.8 | Very low | 31.4 | Very low | 201 Ų | 201 | 126.3 Ų | 126.3 | 94% | 0.939 | 84% | 0.841 | S | S | * | * | -150 | 171.6 | 123.9 | -79.9 | -131.2 | 117.9 | 0 | 0 | 110.1 | |||||
| 260 | N | 29.2 | Very low | 31.7 | Very low | 144 Ų | 144 | 125.6 Ų | 125.6 | 77% | 0.77 | 83% | 0.834 | S | S | * | * | trans | -89 | 141.4 | -158.3 | 160.9 | 64.9 | 0 | 0 | 0 | 115.5 | ||||
| 261 | S | 31.7 | Very low | 31.8 | Very low | 105 Ų | 105 | 128.6 Ų | 128.6 | 73% | 0.734 | 84% | 0.838 | S | S | * | * | 168.8 | 150.8 | 127.4 | -78.7 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 262 | G | 31.3 | Very low | 32.1 | Very low | 74 Ų | 74 | 128 Ų | 128 | 76% | 0.763 | 83% | 0.831 | S | S | * | * | trans | 94.2 | 100.1 | 139.6 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 263 | S | 35.8 | Very low | 31.9 | Very low | 131 Ų | 131 | 127.8 Ų | 127.8 | 92% | 0.916 | 83% | 0.83 | S | S | * | * | trans | -83.3 | 141 | 162.3 | -58.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 264 | S | 32.3 | Very low | 32.2 | Very low | 122 Ų | 122 | 131.6 Ų | 131.6 | 85% | 0.853 | 83% | 0.828 | S | S | * | * | trans | -137.5 | 130.5 | 173.4 | -68.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 265 | I | 39.1 | Very low | 32.5 | Very low | 159 Ų | 159 | 133.5 Ų | 133.5 | 82% | 0.815 | 83% | 0.826 | S | S | * | * | trans | -118 | 139.5 | 169.1 | -71.5 | 178.9 | 0 | 0 | 0 | 106.8 | ||||
| 266 | P | 34.9 | Very low | 32.6 | Very low | 123 Ų | 123 | 134.9 Ų | 134.9 | 80% | 0.799 | 82% | 0.823 | S | S | * | * | trans | -77 | 148.3 | -166.9 | 30.3 | -36.9 | 0 | 0 | 0 | 114 | ||||
| 267 | I | 32.1 | Very low | 32.9 | Very low | 167 Ų | 167 | 136.7 Ų | 136.7 | 86% | 0.856 | 82% | 0.823 | S | S | * | * | trans | -129.3 | 150.6 | 168.4 | -66.6 | -177.3 | 0 | 0 | 0 | 108.6 | ||||
| 268 | A | 30.5 | Very low | 32.9 | Very low | 91 Ų | 91 | 134.1 Ų | 134.1 | 75% | 0.752 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 157.5 | -163.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 269 | V | 31.7 | Very low | 33.4 | Very low | 139 Ų | 139 | 129 Ų | 129 | 84% | 0.842 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -92.6 | 127.6 | 176.3 | -179.9 | 0 | 0 | 0 | 0 | 110.6 | ||
| 270 | P | 35.7 | Very low | 33.5 | Very low | 115 Ų | 115 | 126 Ų | 126 | 75% | 0.747 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 156.4 | 171.2 | -10.8 | 28.5 | 0 | 0 | 0 | 113.8 | ||
| 271 | T | 31.6 | Very low | 33.7 | Very low | 130 Ų | 130 | 126 Ų | 126 | 80% | 0.798 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 141.2 | 177 | -42.8 | 0 | 0 | 0 | 0 | 112.9 | ||
| 272 | P | 34.5 | Very low | 33.8 | Very low | 120 Ų | 120 | 125.9 Ų | 125.9 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 150 | 175.1 | 31.5 | -35.9 | 0 | 0 | 0 | 113.2 | ||
| 273 | S | 30.7 | Very low | 33.7 | Very low | 118 Ų | 118 | 128.3 Ų | 128.3 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -126.8 | 158 | 175.7 | -77 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 274 | I | 34.1 | Very low | 33.5 | Very low | 164 Ų | 164 | 125.6 Ų | 125.6 | 84% | 0.841 | 82% | 0.817 | S | S | * | * | trans | -68.1 | 138.8 | -169.3 | -62.6 | 162.6 | 0 | 0 | 0 | 112.3 | ||||
| 275 | P | 35.6 | Very low | 34.2 | Very low | 120 Ų | 120 | 126.4 Ų | 126.4 | 78% | 0.779 | 82% | 0.82 | S | S | * | * | trans | -81.9 | 141.9 | 171.3 | 33.4 | -34.1 | 0 | 0 | 0 | 112.3 | ||||
| 276 | N | 34.6 | Very low | 33.7 | Very low | 166 Ų | 166 | 122.2 Ų | 122.2 | 89% | 0.888 | 82% | 0.815 | S | S | * | * | trans | -139.8 | 130.5 | 158.9 | -173.9 | 38.9 | 0 | 0 | 0 | 108.9 | ||||
| 277 | S | 32.7 | Very low | 33.6 | Very low | 118 Ų | 118 | 125.1 Ų | 125.1 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | -110.9 | 123.7 | -170.8 | 46.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 278 | G | 32.6 | Very low | 33.5 | Very low | 69 Ų | 69 | 120.8 Ų | 120.8 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | trans | -142.1 | 135.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 279 | P | 41.7 | Very low | 34.2 | Very low | 134 Ų | 134 | 122.4 Ų | 122.4 | 87% | 0.87 | 82% | 0.823 | S | S | * | * | trans | -85.7 | 143.1 | -167.6 | 31.9 | -35.1 | 0 | 0 | 0 | 115.5 | ||||
| 280 | V | 30.8 | Very low | 34 | Very low | 138 Ų | 138 | 120.3 Ų | 120.3 | 84% | 0.836 | 82% | 0.82 | S | S | * | * | trans | -37.7 | 138.9 | 166.7 | -178.6 | 0 | 0 | 0 | 0 | 116 | ||||
| 281 | V | 34 | Very low | 35 | Very low | 144 Ų | 144 | 120.3 Ų | 120.3 | 87% | 0.873 | 82% | 0.82 | S | S | * | * | trans | -151.7 | 156.4 | 138.4 | -106.7 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 282 | A | 32.7 | Very low | 34.9 | Very low | 101 Ų | 101 | 120.3 Ų | 120.3 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -58.8 | 174.2 | -164.4 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 283 | S | 29.6 | Very low | 34.8 | Very low | 125 Ų | 125 | 118.9 Ų | 118.9 | 87% | 0.874 | 81% | 0.813 | S | S | * | * | trans | -116.4 | 125.8 | -170.8 | -56 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 284 | G | 31.2 | Very low | 34.9 | Very low | 74 Ų | 74 | 119.9 Ų | 119.9 | 76% | 0.763 | 80% | 0.804 | S | S | * | * | trans | 76.8 | -177.6 | 150.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 285 | P | 46.9 | Very low | 34.7 | Very low | 140 Ų | 140 | 121 Ų | 121 | 91% | 0.909 | 80% | 0.803 | S | S | * | * | cis | -132.1 | 166.3 | -9.1 | 40.4 | -25.9 | 0 | 0 | 0 | 115.1 | ||||
| 286 | G | 29.5 | Very low | 34.5 | Very low | 70 Ų | 70 | 117.8 Ų | 117.8 | 72% | 0.722 | 79% | 0.792 | S | S | * | * | trans | 137.7 | 119.9 | 148.5 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 287 | L | 32.9 | Very low | 34.4 | Very low | 184 Ų | 184 | 116.6 Ų | 116.6 | 96% | 0.963 | 79% | 0.791 | S | S | * | * | trans | 56.4 | 129.6 | 137.9 | -52.2 | 177 | 0 | 0 | 0 | 122.5 | ||||
| 288 | G | 29.8 | Very low | 34.5 | Very low | 77 Ų | 77 | 118.2 Ų | 118.2 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | 115.9 | 138.7 | 142.8 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 289 | P | 45.1 | Very low | 34.5 | Very low | 125 Ų | 125 | 118.4 Ų | 118.4 | 81% | 0.812 | 78% | 0.779 | S | S | * | * | trans | -121.1 | 138.2 | -176.9 | 38.4 | -25.9 | 0 | 0 | 0 | 116.9 | ||||
| 290 | A | 28.4 | Very low | 34.2 | Very low | 95 Ų | 95 | 121.8 Ų | 121.8 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | 63.7 | 171.2 | 151.2 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 291 | P | 55.2 | Low | 34.3 | Very low | 114 Ų | 114 | 121.5 Ų | 121.5 | 74% | 0.74 | 76% | 0.764 | S | S | * | * | cis | -123.2 | -136.1 | -45.2 | 36 | -18.8 | 0 | 0 | 0 | 111.2 | ||||
| 292 | V | 30.6 | Very low | 34.3 | Very low | 130 Ų | 130 | 121.4 Ų | 121.4 | 79% | 0.788 | 76% | 0.757 | S | S | * | * | trans | 63.8 | 133.7 | -178.4 | -65.2 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 293 | S | 31.7 | Very low | 34.1 | Very low | 91 Ų | 91 | 120.6 Ų | 120.6 | 64% | 0.636 | 75% | 0.746 | S | S | * | * | 71.9 | 139.4 | 60.9 | -128.3 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 294 | Q | 32.4 | Very low | 34.2 | Very low | 138 Ų | 138 | 124.5 Ų | 124.5 | 65% | 0.645 | 74% | 0.741 | S | S | * | * | cis | -165.7 | 163.3 | 13 | -151.7 | 159.3 | -46.3 | 0 | 0 | 112 | ||||
| 295 | F | 30.6 | Very low | 34.4 | Very low | 187 Ų | 187 | 128.3 Ų | 128.3 | 82% | 0.82 | 74% | 0.739 | S | S | * | * | trans | 64.3 | 154.9 | 167.1 | -60.1 | -66.7 | 0 | 0 | 0 | 118.7 | ||||
| 296 | G | 31 | Very low | 33.6 | Very low | 53 Ų | 53 | 128.3 Ų | 128.3 | 55% | 0.546 | 73% | 0.731 | S | S | . | * | cis | 160 | 169.8 | -12.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 297 | T | 33.8 | Very low | 34.6 | Very low | 141 Ų | 141 | 129.9 Ų | 129.9 | 87% | 0.865 | 73% | 0.729 | S | S | * | * | trans | 70.4 | 153.4 | 173.3 | 83.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 298 | I | 34.6 | Very low | 34.5 | Very low | 153 Ų | 153 | 126 Ų | 126 | 79% | 0.785 | 72% | 0.717 | S | S | * | * | cis | -162.4 | 160.7 | -4.9 | -125.4 | -179.7 | 0 | 0 | 0 | 106.9 | ||||
| 299 | S | 31.2 | Very low | 34.4 | Very low | 72 Ų | 72 | 129.6 Ų | 129.6 | 50% | 0.503 | 72% | 0.718 | S | S | . | * | cis | -161.2 | 151.1 | 6.3 | -116.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 300 | R | 37.1 | Very low | 33.6 | Very low | 205 Ų | 205 | 128.7 Ų | 128.7 | 77% | 0.774 | 72% | 0.715 | S | S | * | * | trans | 65.4 | 146.1 | 135.2 | -67.4 | -176.7 | -173 | -93.4 | -3.4 | 121.5 | ||||
| 301 | Q | 32.5 | Very low | 33.7 | Very low | 132 Ų | 132 | 130 Ų | 130 | 62% | 0.617 | 72% | 0.718 | S | S | * | * | cis | -156.2 | 151 | -7.9 | -84.9 | -122.6 | -117.3 | 0 | 0 | 112.7 | ||||
| 302 | I | 32.7 | Very low | 32.6 | Very low | 142 Ų | 142 | 130.7 Ų | 130.7 | 73% | 0.728 | 72% | 0.72 | S | S | * | * | trans | 71.1 | 139 | 140.4 | -75.3 | 167.5 | 0 | 0 | 0 | 119.8 | ||||
| 303 | S | 29.6 | Very low | 32.5 | Very low | 84 Ų | 84 | 130 Ų | 130 | 59% | 0.587 | 72% | 0.721 | S | S | * | * | cis | -173.9 | 149.1 | -18.3 | -165.4 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 304 | R | 32 | Very low | 32.5 | Very low | 208 Ų | 208 | 133.4 Ų | 133.4 | 79% | 0.785 | 73% | 0.729 | S | S | * | * | trans | 68.1 | 149.4 | 157.5 | -75.6 | 163.3 | -176.7 | -141.5 | 5.5 | 118.8 | ||||
| 305 | H | 34.8 | Very low | 32.4 | Very low | 153 Ų | 153 | 132.7 Ų | 132.7 | 71% | 0.708 | 73% | 0.733 | S | S | * | * | cis | -139.4 | 164.4 | 1.6 | -115.9 | -63.5 | 0 | 0 | 0 | 112.1 | ||||
| 306 | N | 30.4 | Very low | 32.3 | Very low | 140 Ų | 140 | 128.9 Ų | 128.9 | 75% | 0.749 | 73% | 0.73 | S | S | * | * | trans | -134.2 | 177.4 | 176 | -150.6 | 30.1 | 0 | 0 | 0 | 106.5 | ||||
| 307 | P | 49.5 | Very low | 32.4 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 68% | 0.675 | 74% | 0.741 | S | S | * | * | cis | -121.4 | -156.3 | 7.1 | 26.9 | 1.4 | 0 | 0 | 0 | 111.8 | ||||
| 308 | S | 31.1 | Very low | 32.4 | Very low | 101 Ų | 101 | 131.2 Ų | 131.2 | 71% | 0.706 | 74% | 0.743 | S | S | * | * | cis | -160.8 | 157.6 | 23.3 | -53.3 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 309 | N | 27.8 | Very low | 32.2 | Very low | 154 Ų | 154 | 127.1 Ų | 127.1 | 82% | 0.824 | 74% | 0.738 | S | S | * | * | trans | 44.3 | 103 | 148 | -72 | 14.6 | 0 | 0 | 0 | 123 | ||||
| 310 | S | 29.8 | Very low | 32.2 | Very low | 106 Ų | 106 | 129.3 Ų | 129.3 | 74% | 0.741 | 75% | 0.749 | S | S | * | * | trans | -36.7 | 155.9 | 132 | 53.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 311 | S | 29.3 | Very low | 31.9 | Very low | 122 Ų | 122 | 128.8 Ų | 128.8 | 85% | 0.853 | 75% | 0.748 | S | S | * | * | -154.8 | 166.7 | 129.7 | 60.8 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 312 | V | 31.6 | Very low | 31.8 | Very low | 129 Ų | 129 | 132.5 Ų | 132.5 | 78% | 0.782 | 76% | 0.757 | S | S | * | * | trans | -135.7 | 138.3 | -167.5 | -155.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 313 | S | 28.9 | Very low | 31.7 | Very low | 115 Ų | 115 | 136.4 Ų | 136.4 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | trans | -164 | 138 | 157.5 | -79.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 314 | M | 32.1 | Very low | 31.6 | Very low | 163 Ų | 163 | 136.8 Ų | 136.8 | 80% | 0.803 | 77% | 0.771 | S | S | * | * | cis | 112.1 | 135.6 | 18.5 | -75.5 | -78.9 | -85 | 0 | 0 | 112.4 | ||||
| 315 | V | 29.6 | Very low | 33 | Very low | 122 Ų | 122 | 132.4 Ų | 132.4 | 74% | 0.739 | 77% | 0.769 | S | S | * | * | trans | 79.3 | 101.8 | 160.7 | 177.1 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 316 | S | 30.1 | Very low | 32.9 | Very low | 107 Ų | 107 | 130.3 Ų | 130.3 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | 59.6 | 109.4 | 124.3 | -49.7 | 0 | 0 | 0 | 0 | 124.5 | |||||
| 317 | A | 33.1 | Very low | 33.1 | Very low | 94 Ų | 94 | 129.8 Ų | 129.8 | 78% | 0.777 | 77% | 0.773 | S | S | * | * | 32.2 | 126.5 | 119.8 | 0 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 318 | T | 32.3 | Very low | 32.2 | Very low | 150 Ų | 150 | 131.3 Ų | 131.3 | 92% | 0.92 | 78% | 0.781 | S | S | * | * | -163.9 | -178.4 | 120 | 12.4 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 319 | G | 31.5 | Very low | 32.4 | Very low | 66 Ų | 66 | 131.3 Ų | 131.3 | 68% | 0.68 | 78% | 0.781 | S | S | * | * | trans | -78.8 | -162.4 | -176 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 320 | T | 30.7 | Very low | 32.7 | Very low | 119 Ų | 119 | 131 Ų | 131 | 73% | 0.73 | 78% | 0.775 | S | S | * | * | cis | -166.3 | 160.5 | 9.3 | -17 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 321 | Y | 30.5 | Very low | 32.8 | Very low | 193 Ų | 193 | 134.3 Ų | 134.3 | 76% | 0.757 | 78% | 0.776 | S | S | * | * | trans | 63.5 | 121.1 | 155.2 | -65.5 | -55.3 | 0 | 0 | 0 | 124.5 | ||||
| 322 | R | 31.1 | Very low | 33 | Very low | 210 Ų | 210 | 133.7 Ų | 133.7 | 79% | 0.792 | 77% | 0.772 | S | S | * | * | 59.9 | 111.7 | 129.9 | -66.6 | -178.4 | -170 | -89.8 | 4.4 | 123.3 | |||||
| 323 | R | 30 | Very low | 34.2 | Very low | 225 Ų | 225 | 133.1 Ų | 133.1 | 85% | 0.849 | 77% | 0.77 | S | S | * | * | 64.1 | 97.4 | 109 | -161.7 | -173 | -148.2 | -132.6 | 7.8 | 120.7 | |||||
| 324 | A | 27.9 | Very low | 34.3 | Very low | 92 Ų | 92 | 135.2 Ų | 135.2 | 76% | 0.76 | 77% | 0.767 | S | S | * | * | 42.4 | 166.7 | 117.9 | 0 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 325 | P | 61.7 | Low | 34.4 | Very low | 116 Ų | 116 | 133.6 Ų | 133.6 | 75% | 0.753 | 76% | 0.76 | S | S | * | * | cis | -136.8 | -174.9 | -35 | 39 | -21.8 | 0 | 0 | 0 | 113.7 | ||||
| 326 | S | 32.1 | Very low | 34.6 | Very low | 108 Ų | 108 | 135.7 Ų | 135.7 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | trans | 169.9 | 128.2 | 140.2 | -77.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 327 | V | 34.8 | Very low | 34.6 | Very low | 129 Ų | 129 | 134.5 Ų | 134.5 | 78% | 0.782 | 77% | 0.772 | S | S | * | * | 65.7 | 114.9 | 74.2 | -177.6 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 328 | T | 30.8 | Very low | 34.5 | Very low | 136 Ų | 136 | 133.5 Ų | 133.5 | 83% | 0.834 | 77% | 0.77 | S | S | * | * | 176.5 | 158.1 | 128.5 | -69.7 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 329 | S | 35.3 | Very low | 34.7 | Very low | 102 Ų | 102 | 132.8 Ų | 132.8 | 71% | 0.713 | 77% | 0.766 | S | S | * | * | trans | -111.3 | -174.2 | -177.1 | 65.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 330 | Q | 34.1 | Very low | 35.3 | Very low | 148 Ų | 148 | 135.8 Ų | 135.8 | 69% | 0.692 | 77% | 0.774 | S | S | * | * | 152.1 | 158.5 | 112.1 | -155 | 166.7 | 23.3 | 0 | 0 | 114.1 | |||||
| 331 | F | 31.5 | Very low | 35.3 | Very low | 175 Ų | 175 | 133.7 Ų | 133.7 | 77% | 0.768 | 78% | 0.776 | S | S | * | * | trans | 89.4 | 142.7 | 162.7 | -64.7 | -72.3 | 0 | 0 | 0 | 123.4 | ||||
| 332 | S | 33.3 | Very low | 35.4 | Very low | 109 Ų | 109 | 136.5 Ų | 136.5 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -143.6 | 171.3 | 164.4 | -40.4 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 333 | P | 56.1 | Low | 35.4 | Very low | 116 Ų | 116 | 130.1 Ų | 130.1 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | -161.1 | -173.1 | 64.5 | 41.1 | -16.9 | 0 | 0 | 0 | 119 | |||||
| 334 | H | 31.5 | Very low | 35.5 | Very low | 160 Ų | 160 | 128.1 Ų | 128.1 | 74% | 0.741 | 79% | 0.787 | S | S | * | * | trans | 96.1 | 113 | 139.4 | -112.7 | -117 | 0 | 0 | 0 | 125 | ||||
| 335 | I | 35.3 | Very low | 35.8 | Very low | 129 Ų | 129 | 131.3 Ų | 131.3 | 66% | 0.662 | 79% | 0.791 | S | S | * | * | trans | 61.1 | 124.9 | 141 | 65.9 | 173.1 | 0 | 0 | 0 | 127.4 | ||||
| 336 | N | 33.5 | Very low | 34.5 | Very low | 166 Ų | 166 | 131.2 Ų | 131.2 | 89% | 0.888 | 79% | 0.793 | S | S | * | * | trans | 53.5 | 127 | 135.3 | -69.9 | 2.1 | 0 | 0 | 0 | 124.8 | ||||
| 337 | G | 29.9 | Very low | 34.7 | Very low | 81 Ų | 81 | 135 Ų | 135 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | 158.5 | 95.2 | 142 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 338 | G | 30.2 | Very low | 34.8 | Very low | 73 Ų | 73 | 134.7 Ų | 134.7 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | trans | 73.6 | 102.5 | 144 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 339 | T | 36.6 | Very low | 35.4 | Very low | 135 Ų | 135 | 135 Ų | 135 | 83% | 0.828 | 81% | 0.806 | S | S | * | * | trans | 4.8 | 157.7 | 139.2 | 52.6 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 340 | P | 44.7 | Very low | 35.9 | Very low | 129 Ų | 129 | 134.3 Ų | 134.3 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | cis | -137.9 | 158.3 | -26.5 | 37.9 | -20.8 | 0 | 0 | 0 | 114.9 | ||||
| 341 | G | 31.3 | Very low | 36.9 | Very low | 76 Ų | 76 | 132.7 Ų | 132.7 | 78% | 0.784 | 81% | 0.809 | S | S | * | * | trans | -166.1 | 140.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 342 | Y | 31.9 | Very low | 38 | Very low | 252 Ų | 252 | 130 Ų | 130 | 99% | 0.988 | 81% | 0.809 | S | S | * | * | trans | -56.3 | 138.8 | -174.8 | -78.4 | -105.4 | 0 | 0 | 0 | 115.1 | ||||
| 343 | G | 31.2 | Very low | 39 | Very low | 76 Ų | 76 | 130.4 Ų | 130.4 | 78% | 0.784 | 81% | 0.809 | S | S | * | * | trans | -173.6 | 132.4 | 168 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 344 | Q | 32.5 | Very low | 39.1 | Very low | 183 Ų | 183 | 130.6 Ų | 130.6 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | trans | -73.4 | 138 | -174.3 | -63.6 | 176.4 | -42.2 | 0 | 0 | 113.6 | ||||
| 345 | N | 33.4 | Very low | 40 | Very low | 159 Ų | 159 | 129 Ų | 129 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | 168 | 128.3 | 111.1 | -88.1 | -40.1 | 0 | 0 | 0 | 111.7 | |||||
| 346 | S | 35.3 | Very low | 40.6 | Very low | 113 Ų | 113 | 131.2 Ų | 131.2 | 79% | 0.79 | 82% | 0.824 | S | S | * | * | trans | -120.6 | 121.3 | 174.6 | 55.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 347 | M | 36 | Very low | 41 | Very low | 187 Ų | 187 | 129 Ų | 129 | 92% | 0.921 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 130.8 | 172 | -65.5 | 179.7 | 177 | 0 | 0 | 110.4 | V349 | M347-V349 PolarHBondContact O-N 3.44Š|
| 348 | S | 36.2 | Very low | 41.4 | Very low | 124 Ų | 124 | 133.7 Ų | 133.7 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 118.9 | 172.6 | -61.3 | 0 | 0 | 0 | 0 | 110.9 | ||
| 349 | V | 43.5 | Very low | 41.5 | Very low | 141 Ų | 141 | 138.6 Ų | 138.6 | 86% | 0.855 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 127.6 | 168.5 | 178.3 | 0 | 0 | 0 | 0 | 108.7 | M347 | M347-V349 PolarHBondContact O-N 3.44Š|
| 350 | A | 45.9 | Very low | 41.5 | Very low | 88 Ų | 88 | 137.1 Ų | 137.1 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 140.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 351 | P | 55 | Low | 41 | Very low | 115 Ų | 115 | 137.1 Ų | 137.1 | 75% | 0.747 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 156.3 | 173.6 | 32.3 | -35 | 0 | 0 | 0 | 112.1 | ||
| 352 | P | 54.4 | Low | 41.1 | Very low | 117 Ų | 117 | 141.9 Ų | 141.9 | 76% | 0.76 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 155.4 | 177.8 | 31.9 | -35.9 | 0 | 0 | 0 | 112.9 | ||
| 353 | P | 54.3 | Low | 41.7 | Very low | 118 Ų | 118 | 136.8 Ų | 136.8 | 77% | 0.766 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 155.3 | 176.5 | 31.7 | -35.7 | 0 | 0 | 0 | 112.9 | ||
| 354 | P | 59 | Low | 42.1 | Very low | 120 Ų | 120 | 138.9 Ų | 138.9 | 78% | 0.779 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 158.9 | 178.1 | 32.5 | -36.1 | 0 | 0 | 0 | 113.2 | ||
| 355 | P | 48.6 | Very low | 42.4 | Very low | 128 Ų | 128 | 136.9 Ų | 136.9 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 152.3 | 178.4 | 31.9 | -35.8 | 0 | 0 | 0 | 113.1 | ||
| 356 | M | 49 | Very low | 42.5 | Very low | 174 Ų | 174 | 136 Ų | 136 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -94.2 | 137.7 | 178.7 | -166.9 | -179.4 | -62.1 | 0 | 0 | 110.6 | ||
| 357 | P | 42.3 | Very low | 42.4 | Very low | 121 Ų | 121 | 133.5 Ų | 133.5 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 137.8 | 178.2 | 29.3 | -34.4 | 0 | 0 | 0 | 111.6 | ||
| 358 | Q | 37.5 | Very low | 42.1 | Very low | 178 Ų | 178 | 134.3 Ų | 134.3 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 145.5 | 170.8 | -71.2 | -164.8 | -7 | 0 | 0 | 111.6 | ||
| 359 | L | 33.5 | Very low | 42 | Very low | 176 Ų | 176 | 134.7 Ų | 134.7 | 92% | 0.921 | 79% | 0.79 | S | S | * | * | trans | -112.3 | 107.4 | 167.9 | -84.1 | 162.2 | 0 | 0 | 0 | 109 | ||||
| 360 | T | 36.1 | Very low | 41.4 | Very low | 104 Ų | 104 | 132.2 Ų | 132.2 | 64% | 0.638 | 79% | 0.785 | S | S | * | * | trans | -90.4 | 136.1 | 168.2 | 48.2 | 0 | 0 | 0 | 0 | 109.7 | Q362 | T360-Q362 PolarHBondContact O-N 3.1Š| ||
| 361 | P | 34.7 | Very low | 40.7 | Very low | 129 Ų | 129 | 139 Ų | 139 | 84% | 0.838 | 79% | 0.792 | S | S | * | * | trans | -73.7 | 125.9 | 170.7 | 29.8 | -32 | 0 | 0 | 0 | 109.9 | ||||
| 362 | Q | 33.3 | Very low | 39.6 | Very low | 176 Ų | 176 | 141 Ų | 141 | 82% | 0.822 | 79% | 0.793 | S | S | * | * | trans | -119.4 | 134.8 | 162.4 | -88.6 | -158.7 | 59.7 | 0 | 0 | 110.4 | T360 | T360-Q362 PolarHBondContact O-N 3.1Š| ||
| 363 | I | 43.7 | Very low | 38.4 | Very low | 145 Ų | 145 | 141.4 Ų | 141.4 | 74% | 0.744 | 78% | 0.784 | S | S | * | * | trans | -93.5 | 137.4 | 171.9 | -59.3 | 162.4 | 0 | 0 | 0 | 108.1 | L365 | I363-L365 HydrophobicContact CG2-CD1 3.95Š| ||
| 364 | P | 40.7 | Very low | 37.2 | Very low | 120 Ų | 120 | 142.7 Ų | 142.7 | 78% | 0.779 | 78% | 0.78 | S | S | * | * | trans | -113.6 | 125.1 | 149.1 | 0.2 | 20.7 | 0 | 0 | 0 | 111 | ||||
| 365 | L | 37.2 | Very low | 35.8 | Very low | 141 Ų | 141 | 141 Ų | 141 | 74% | 0.738 | 77% | 0.771 | S | S | * | * | trans | -87.2 | 168.4 | 160.2 | -114.7 | 71.6 | 0 | 0 | 0 | 109.8 | I363 | I363-L365 HydrophobicContact CG2-CD1 3.95Š| ||
| 366 | T | 36.7 | Very low | 35 | Very low | 142 Ų | 142 | 142.8 Ų | 142.8 | 87% | 0.871 | 77% | 0.772 | S | S | * | * | trans | 71.6 | 146.6 | 177.8 | 78.3 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 367 | G | 31.8 | Very low | 34.2 | Very low | 59 Ų | 59 | 138.8 Ų | 138.8 | 61% | 0.608 | 77% | 0.767 | S | S | * | * | cis | 161.7 | 167.1 | -8.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 368 | F | 30 | Very low | 33.8 | Very low | 204 Ų | 204 | 140.3 Ų | 140.3 | 90% | 0.895 | 77% | 0.768 | S | S | * | * | trans | 68.6 | 145.3 | 171.7 | -68.6 | -97.2 | 0 | 0 | 0 | 117.4 | ||||
| 369 | V | 34.1 | Very low | 33.5 | Very low | 133 Ų | 133 | 138.4 Ų | 138.4 | 81% | 0.806 | 77% | 0.769 | S | S | * | * | cis | -156.4 | 170.1 | -22.2 | 98.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 370 | A | 30.6 | Very low | 34.1 | Very low | 89 Ų | 89 | 135.7 Ų | 135.7 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | trans | -83.4 | 162.6 | -165.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 371 | R | 31.4 | Very low | 34.3 | Very low | 231 Ų | 231 | 137.1 Ų | 137.1 | 87% | 0.872 | 77% | 0.771 | S | S | * | * | trans | -154.2 | 127.6 | 140.2 | -134.8 | 169.5 | 179.8 | 93.3 | 2 | 107.7 | ||||
| 372 | M | 32.2 | Very low | 34.9 | Very low | 156 Ų | 156 | 136.2 Ų | 136.2 | 77% | 0.768 | 77% | 0.765 | S | S | * | * | 58.1 | 130.7 | 67.1 | -92.9 | 174.9 | 169.2 | 0 | 0 | 113 | |||||
| 373 | Q | 30 | Very low | 36 | Very low | 125 Ų | 125 | 133.4 Ų | 133.4 | 58% | 0.584 | 76% | 0.762 | S | S | * | * | cis | -162.9 | 179.4 | 9.7 | -167.2 | 162.7 | -66.3 | 0 | 0 | 113.3 | ||||
| 374 | E | 28.1 | Very low | 36.5 | Very low | 145 Ų | 145 | 132.3 Ų | 132.3 | 68% | 0.678 | 76% | 0.764 | S | S | * | * | trans | 75.4 | 152.3 | 168.2 | -84.2 | 84.6 | -144.1 | 0 | 0 | 118.9 | ||||
| 375 | S | 30 | Very low | 36.8 | Very low | 84 Ų | 84 | 132.2 Ų | 132.2 | 59% | 0.587 | 76% | 0.764 | S | S | * | * | cis | -178.5 | 145 | -31.7 | 54.7 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 376 | I | 31.9 | Very low | 37.4 | Very low | 167 Ų | 167 | 131 Ų | 131 | 86% | 0.856 | 76% | 0.764 | S | S | * | * | trans | 66.2 | 141 | 147.2 | -65.4 | 161.1 | 0 | 0 | 0 | 116.2 | ||||
| 377 | A | 32.8 | Very low | 38.4 | Very low | 90 Ų | 90 | 129.7 Ų | 129.7 | 74% | 0.744 | 76% | 0.758 | S | S | * | * | cis | -148.6 | 177.9 | 6.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 378 | D | 32.8 | Very low | 38.9 | Very low | 153 Ų | 153 | 133 Ų | 133 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -57.6 | 149.1 | 170.8 | -70.9 | -88.9 | 0 | 0 | 0 | 116.5 | ||||
| 379 | T | 32.7 | Very low | 39.3 | Very low | 137 Ų | 137 | 130.5 Ų | 130.5 | 84% | 0.84 | 77% | 0.765 | S | S | * | * | -168.5 | 154.4 | 125.2 | 12.7 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 380 | P | 44.6 | Very low | 39.5 | Very low | 119 Ų | 119 | 132.3 Ų | 132.3 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -91 | 156.7 | -165.5 | 35.4 | -36.2 | 0 | 0 | 0 | 115.5 | ||
| 381 | T | 41.6 | Very low | 39.7 | Very low | 135 Ų | 135 | 135 Ų | 135 | 83% | 0.828 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -69 | 135.7 | 176 | -37.5 | 0 | 0 | 0 | 0 | 112.6 | ||
| 382 | P | 46.1 | Very low | 40.4 | Very low | 110 Ų | 110 | 129.4 Ų | 129.4 | 71% | 0.714 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 150.6 | 174.7 | 31.7 | -35.3 | 0 | 0 | 0 | 112.7 | ||
| 383 | P | 57.3 | Low | 40.8 | Very low | 117 Ų | 117 | 129.7 Ų | 129.7 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -77 | 158.2 | 176.3 | 32.5 | -35.8 | 0 | 0 | 0 | 113 | ||
| 384 | P | 53.6 | Low | 41 | Very low | 121 Ų | 121 | 133.8 Ų | 133.8 | 79% | 0.786 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 157.4 | 175.9 | 30.8 | -35.6 | 0 | 0 | 0 | 113.1 | ||
| 385 | P | 47.1 | Very low | 41.5 | Very low | 119 Ų | 119 | 134.6 Ų | 134.6 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 156.4 | -175.5 | 32.8 | -36.5 | 0 | 0 | 0 | 114 | ||
| 386 | P | 51.2 | Low | 42.5 | Very low | 116 Ų | 116 | 137.1 Ų | 137.1 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 157.9 | 178.7 | 34 | -36.3 | 0 | 0 | 0 | 113.6 | ||
| 387 | P | 56.5 | Low | 43.3 | Very low | 114 Ų | 114 | 134.3 Ų | 134.3 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 161.8 | 167.3 | 34.4 | -35.4 | 0 | 0 | 0 | 112 | ||
| 388 | P | 43.3 | Very low | 44.2 | Very low | 129 Ų | 129 | 135.5 Ų | 135.5 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 138.6 | 176.3 | 33.6 | -33.4 | 0 | 0 | 0 | 112.9 | ||
| 389 | D | 36.5 | Very low | 44.9 | Very low | 151 Ų | 151 | 133.7 Ų | 133.7 | 81% | 0.807 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 147.9 | 167.1 | -74.8 | -53.6 | 0 | 0 | 0 | 111.7 | ||
| 390 | D | 38.5 | Very low | 45.5 | Very low | 170 Ų | 170 | 132.7 Ų | 132.7 | 91% | 0.909 | 79% | 0.786 | S | S | * | * | trans | -148.5 | 143.5 | 147.5 | -122.3 | -32.1 | 0 | 0 | 0 | 109.8 | ||||
| 391 | L | 36 | Very low | 45.7 | Very low | 145 Ų | 145 | 132.6 Ų | 132.6 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | trans | -106.8 | 176.5 | -162.1 | -75.2 | 171.9 | 0 | 0 | 0 | 111.6 | ||||
| 392 | P | 45.4 | Very low | 46 | Very low | 114 Ų | 114 | 131.5 Ų | 131.5 | 74% | 0.74 | 78% | 0.78 | S | S | * | * | cis | -141.9 | 163.7 | 15.8 | 42.2 | -23.1 | 0 | 0 | 0 | 119.6 | ||||
| 393 | M | 40.1 | Very low | 45.9 | Very low | 163 Ų | 163 | 131.3 Ų | 131.3 | 80% | 0.803 | 78% | 0.779 | S | S | * | * | trans | 13.2 | 131.8 | 149.9 | -53.5 | -149.3 | -55.8 | 0 | 0 | 121.3 | ||||
| 394 | F | 35.5 | Very low | 45.2 | Very low | 211 Ų | 211 | 131.4 Ų | 131.4 | 93% | 0.925 | 78% | 0.78 | S | S | * | * | trans | -150.5 | 132.3 | 130.4 | -111.6 | -73.8 | 0 | 0 | 0 | 113 | ||||
| 395 | D | 38.6 | Very low | 44.7 | Very low | 162 Ų | 162 | 131.3 Ų | 131.3 | 87% | 0.866 | 78% | 0.777 | S | S | * | * | trans | 66.7 | 148.6 | 168.7 | -140.7 | 4.4 | 0 | 0 | 0 | 120.1 | ||||
| 396 | D | 50.8 | Low | 44.1 | Very low | 137 Ų | 137 | 132.9 Ų | 132.9 | 73% | 0.733 | 78% | 0.779 | S | S | * | * | trans | -125.2 | 106.2 | -167.4 | 177.9 | 23.7 | 0 | 0 | 0 | 111.6 | ||||
| 397 | S | 49.2 | Very low | 43.9 | Very low | 108 Ų | 108 | 137.8 Ų | 137.8 | 76% | 0.755 | 78% | 0.784 | S | S | * | * | trans | -164.1 | 120.2 | 166.4 | -81 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 398 | P | 51.3 | Low | 42.7 | Very low | 115 Ų | 115 | 141.8 Ų | 141.8 | 75% | 0.747 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 142.9 | 177.2 | 28.7 | -34 | 0 | 0 | 0 | 111.6 | ||
| 399 | P | 46.8 | Very low | 42.2 | Very low | 114 Ų | 114 | 142.9 Ų | 142.9 | 74% | 0.74 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 153.8 | 171.9 | 29.7 | -34.9 | 0 | 0 | 0 | 111.1 | ||
| 400 | P | 44.9 | Very low | 42.6 | Very low | 116 Ų | 116 | 144.2 Ų | 144.2 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 145.4 | 176.7 | 27.9 | -34.9 | 0 | 0 | 0 | 111.2 | ||
| 401 | P | 49.3 | Very low | 42.6 | Very low | 117 Ų | 117 | 145.3 Ų | 145.3 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 147.9 | -175.6 | 28.1 | -35.3 | 0 | 0 | 0 | 112.3 | ||
| 402 | P | 48.1 | Very low | 42.6 | Very low | 112 Ų | 112 | 142.6 Ų | 142.6 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 155.3 | 168.3 | 30.3 | -34.9 | 0 | 0 | 0 | 110.8 | ||
| 403 | P | 44.8 | Very low | 41.9 | Very low | 106 Ų | 106 | 143.8 Ų | 143.8 | 69% | 0.688 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 153.2 | 172.7 | 29.1 | -35.1 | 0 | 0 | 0 | 111 | V405 | P403-V405 PolarHBondContact O-N 3.46Š|
| 404 | P | 42 | Very low | 41.8 | Very low | 119 Ų | 119 | 141.7 Ų | 141.7 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 136 | -179.8 | -22.3 | 33.5 | 0 | 0 | 0 | 112 | ||
| 405 | V | 43.7 | Very low | 41.9 | Very low | 120 Ų | 120 | 138.4 Ų | 138.4 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | trans | -122.8 | 97.3 | 166.3 | -165 | 0 | 0 | 0 | 0 | 105.2 | P403 Y407 | P403-V405 PolarHBondContact O-N 3.46Å; V405-Y407 PolarHBondContact O-N 3.4Å | ||
| 406 | D | 34.6 | Very low | 42.1 | Very low | 152 Ų | 152 | 138.5 Ų | 138.5 | 81% | 0.813 | 78% | 0.777 | S | S | * | * | trans | -68.3 | 132.3 | -179.5 | -71 | -47 | 0 | 0 | 0 | 110.1 | ||||
| 407 | Y | 46 | Very low | 41.6 | Very low | 219 Ų | 219 | 139.9 Ų | 139.9 | 86% | 0.859 | 78% | 0.776 | S | S | * | * | trans | -102.8 | 109.3 | 167.1 | -73.7 | -104.7 | 0 | 0 | 0 | 107.5 | V405 | V405-Y407 PolarHBondContact O-N 3.4Š| ||
| 408 | E | 31.3 | Very low | 41.3 | Very low | 198 Ų | 198 | 141.4 Ų | 141.4 | 93% | 0.925 | 78% | 0.776 | S | S | * | * | trans | -125.7 | 143.7 | 155.7 | -70.7 | -163.3 | 140.5 | 0 | 0 | 108.1 | ||||
| 409 | D | 33.8 | Very low | 41.4 | Very low | 152 Ų | 152 | 139 Ų | 139 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | -121.5 | 143.4 | -163.7 | -141.3 | -12.3 | 0 | 0 | 0 | 111.2 | ||||
| 410 | E | 44.2 | Very low | 41.6 | Very low | 179 Ų | 179 | 139.1 Ų | 139.1 | 84% | 0.836 | 76% | 0.758 | S | S | * | * | trans | 64.1 | 155.1 | 167.7 | -50 | -154.7 | 119.1 | 0 | 0 | 121.7 | ||||
| 411 | E | 38.2 | Very low | 42 | Very low | 192 Ų | 192 | 142.5 Ų | 142.5 | 90% | 0.897 | 76% | 0.757 | S | S | * | * | S | Bend | trans | 66.5 | 140.7 | 178.3 | -65.7 | -143.9 | 106.6 | 0 | 0 | 122 | ||
| 412 | A | 35.9 | Very low | 42.2 | Very low | 89 Ų | 89 | 139.8 Ų | 139.8 | 74% | 0.736 | 74% | 0.744 | S | S | * | * | trans | 67 | 40 | 157.7 | 0 | 0 | 0 | 0 | 0 | 120.7 | V414 | A412-V414 PolarHBondContact O-N 2.82Š| ||
| 413 | T | 30.2 | Very low | 42.6 | Very low | 138 Ų | 138 | 143.1 Ų | 143.1 | 85% | 0.847 | 76% | 0.756 | S | S | * | * | trans | -72.8 | 54.6 | 162.8 | 44.9 | 0 | 0 | 0 | 0 | 113.9 | L415 | T413-L415 PolarHBondContact O-N 2.89Å; T413-L415 VanDerWaalsContact O-N 3.08Å | ||
| 414 | V | 37.8 | Very low | 43.4 | Very low | 119 Ų | 119 | 141.1 Ų | 141.1 | 72% | 0.721 | 76% | 0.755 | S | S | * | * | trans | -67 | 106.4 | 165.5 | 179 | 0 | 0 | 0 | 0 | 108.2 | A412 K416 | A412-V414 PolarHBondContact O-N 2.82Å; V414-K416 PolarHBondContact O-N 3.44Å | ||
| 415 | L | 39.2 | Very low | 44.8 | Very low | 142 Ų | 142 | 137.9 Ų | 137.9 | 74% | 0.743 | 73% | 0.731 | S | S | * | * | trans | -61 | 103.4 | -179.7 | -69.7 | 173.3 | 0 | 0 | 0 | 110.9 | T413 F417 | T413-L415 PolarHBondContact O-N 2.89Å; T413-L415 VanDerWaalsContact O-N 3.08Å; L415-F417 HydrophobicContact CB-CD2 4.44Å; L415-F417 HydrophobicContact CB-CE2 4.4Å; L415-F417 PolarHBondContact O-N 3Å | ||
| 416 | K | 42.8 | Very low | 46.3 | Very low | 165 Ų | 165 | 134.7 Ų | 134.7 | 72% | 0.717 | 71% | 0.713 | S | S | * | * | trans | -65.8 | 101.6 | 165.2 | -84.3 | -170.8 | 169.8 | -171 | 0 | 109.9 | V414 D418 | V414-K416 PolarHBondContact O-N 3.44Å; K416-D418 PolarHBondContact O-N 3.23Å | ||
| 417 | F | 40.3 | Very low | 48 | Very low | 165 Ų | 165 | 136.9 Ų | 136.9 | 72% | 0.724 | 72% | 0.718 | S | S | * | * | trans | -79.2 | 99.6 | 154.7 | -83.2 | -95.4 | 0 | 0 | 0 | 108.1 | L415 D419 | L415-F417 HydrophobicContact CB-CD2 4.44Å; L415-F417 HydrophobicContact CB-CE2 4.4Å; L415-F417 PolarHBondContact O-N 3Å; F417-D419 PolarHBondContact O-N 3.48Å; F417-D419 VanDerWaalsContact O-N 3.08Å | ||
| 418 | D | 43 | Very low | 49.6 | Very low | 140 Ų | 140 | 130.7 Ų | 130.7 | 75% | 0.749 | 69% | 0.693 | S | S | * | * | trans | -70.3 | 99 | 169 | -72.8 | -53.9 | 0 | 0 | 0 | 109.1 | K416 P420 | K416-D418 PolarHBondContact O-N 3.23Å; D418-P420 WeakPolarHBondContact O-CD 3.32Å | ||
| 419 | D | 52.1 | Low | 52 | Low | 65 Ų | 65 | 122.1 Ų | 122.1 | 35% | 0.348 | 66% | 0.657 | S | S | . | * | trans | -67.1 | 117.9 | 173.9 | -179.2 | -9.8 | 0 | 0 | 0 | 110 | F417 Y421 A422 | F417-D419 PolarHBondContact O-N 3.48Å; F417-D419 VanDerWaalsContact O-N 3.08Å; D419-Y421 PolarHBondContact O-N 2.92Å; D419-Y421 PolarHBondContact OD1-N 3.23Å; D419-A422 PolarHBondContact O-N 3.26Å | ||
| 420 | P | 51.5 | Low | 54.5 | Low | 116 Ų | 116 | 116.3 Ų | 116.3 | 75% | 0.753 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | 2.4 | -179.2 | 29.6 | -35.8 | 0 | 0 | 0 | 114.7 | D418 | D418-P420 WeakPolarHBondContact O-CD 3.32Š|
| 421 | Y | 52.6 | Low | 56.2 | Low | 187 Ų | 187 | 117.4 Ų | 117.4 | 73% | 0.733 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.6 | 12.6 | 178.8 | -65.6 | -77.1 | 0 | 0 | 0 | 115.3 | D419 D423 G424 | D419-Y421 PolarHBondContact O-N 2.92Å; D419-Y421 PolarHBondContact OD1-N 3.23Å; Y421-D423 PolarHBondContact O-N 2.91Å; Y421-G424 PolarHBondContact O-N 3.35Å |
| 422 | A | 54.3 | Low | 58.3 | Low | 61 Ų | 61 | 114.3 Ų | 114.3 | 50% | 0.504 | 62% | 0.619 | S | S | . | * | G | 310 helix | trans | -56 | -20.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | D419 G424 D425 | D419-A422 PolarHBondContact O-N 3.26Å; A422-G424 PolarHBondContact O-N 2.78Å; A422-D425 PolarHBondContact O-N 3.07Å |
| 423 | D | 56.3 | Low | 60.7 | Low | 181 Ų | 181 | 113.4 Ų | 113.4 | 97% | 0.968 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -61.3 | -7.4 | 175 | -86 | -27.1 | 0 | 0 | 0 | 114.5 | Y421 | Y421-D423 PolarHBondContact O-N 2.91Š|
| 424 | G | 61.3 | Low | 63.5 | Low | 65 Ų | 65 | 111.2 Ų | 111.2 | 67% | 0.67 | 58% | 0.579 | S | S | * | * | G | 310 helix | trans | -94.8 | -10.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | Y421 A422 | Y421-G424 PolarHBondContact O-N 3.35Å; A422-G424 PolarHBondContact O-N 2.78Å |
| 425 | D | 71.3 | Confident | 66 | Low | 51 Ų | 51 | 107 Ų | 107 | 27% | 0.273 | 55% | 0.551 | S | S | . | * | trans | -88.5 | 145.7 | -164.6 | -79.9 | -14 | 0 | 0 | 0 | 114.9 | A422 A429 K436 Y460 | A422-D425 PolarHBondContact O-N 3.07Å; D425-A429 HydrophobicContact CB-CB 4.39Å; D425-K436 IonicContact OD1-NZ 2.7Å; D425-K436 PolarHBondContact OD1-NZ 3Å; D425-K436 IonicContact OD2-NZ 2.69Å; D425-K436 PolarHBondContact OD2-NZ 2.9Å; D425-Y460 PolarHBondContact OD1-OH 3.23Å; D425-Y460 VanDerWaalsContact OD1-OH 3.1Å; D425-Y460 PolarHBondContact OD2-OH 3.3Å | ||
| 426 | P | 75.4 | Confident | 68.5 | Low | 52 Ų | 52 | 102.2 Ų | 102.2 | 34% | 0.338 | 52% | 0.524 | S | S | . | . | trans | -71.9 | 150.5 | -175.3 | 30.3 | -35.5 | 0 | 0 | 0 | 111.9 | W428 A429 | P426-W428 HydrophobicContact CB-CD2 4.46Å; P426-W428 HydrophobicContact CB-CG 4.4Å; P426-W428 HydrophobicContact CG-CD2 4Å; P426-W428 VanDerWaalsContact CG-CE2 3.45Å; P426-W428 HydrophobicContact CG-CG 4.43Å; P426-W428 HydrophobicContact CG-CH2 4.3Å; P426-W428 HydrophobicContact CG-CZ2 3.64Å; P426-W428 PolarHBondContact O-N 2.78Å; P426-A429 HydrophobicContact CG-CB 4.41Å; P426-A429 VanDerWaalsContact O-CB 3.31Å; P426-A429 WeakPolarHBondContact O-CB 3.5Å; P426-A429 PolarHBondContact O-N 2.7Å | ||
| 427 | Q | 71.6 | Confident | 70.9 | Confident | 198 Ų | 198 | 94.4 Ų | 94.4 | 93% | 0.925 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.8 | -20.9 | -176.6 | -164.5 | 73.8 | 75.5 | 0 | 0 | 115.5 | ||
| 428 | W | 78.4 | Confident | 73.5 | Confident | 89 Ų | 89 | 88.4 Ų | 88.4 | 34% | 0.337 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.5 | -11.5 | 177.8 | 60.6 | -108.4 | 0 | 0 | 0 | 114.4 | P426 Y460 V473 N475 | P426-W428 HydrophobicContact CB-CD2 4.46Å; P426-W428 HydrophobicContact CB-CG 4.4Å; P426-W428 HydrophobicContact CG-CD2 4Å; P426-W428 VanDerWaalsContact CG-CE2 3.45Å; P426-W428 HydrophobicContact CG-CG 4.43Å; P426-W428 HydrophobicContact CG-CH2 4.3Å; P426-W428 HydrophobicContact CG-CZ2 3.64Å; P426-W428 PolarHBondContact O-N 2.78Å; W428-Y460 HydrophobicContact CH2-CD2 4.27Å; W428-Y460 AromaticContact CH2-CE2 3.78Å; W428-Y460 HydrophobicContact CH2-CE2 3.78Å; W428-Y460 AromaticContact CZ3-CD2 3.82Å; W428-Y460 HydrophobicContact CZ3-CD2 3.82Å; W428-Y460 AromaticContact CZ3-CE2 3.67Å; W428-Y460 HydrophobicContact CZ3-CE2 3.67Å; W428-V473 HydrophobicContact CE3-CG1 4.13Å; W428-V473 HydrophobicContact CZ3-CG1 4.3Å; W428-N475 VanDerWaalsContact CZ3-N 3.25Å |
| 429 | A | 82.4 | Confident | 75.9 | Confident | 19 Ų | 19 | 81.8 Ų | 81.8 | 16% | 0.157 | 43% | 0.432 | C | S | . | . | S | Bend | trans | -64.5 | 137.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | D425 P426 Y460 | D425-A429 HydrophobicContact CB-CB 4.39Å; P426-A429 HydrophobicContact CG-CB 4.41Å; P426-A429 VanDerWaalsContact O-CB 3.31Å; P426-A429 WeakPolarHBondContact O-CB 3.5Å; P426-A429 PolarHBondContact O-N 2.7Å; A429-Y460 HydrophobicContact CB-CD2 4.31Å; A429-Y460 HydrophobicContact CB-CE1 4.07Å; A429-Y460 HydrophobicContact CB-CE2 3.87Å |
| 430 | P | 85.2 | Confident | 78 | Confident | 30 Ų | 30 | 81.4 Ų | 81.4 | 20% | 0.195 | 43% | 0.43 | C | S | . | . | trans | -65.1 | 142.5 | 176.2 | 29 | -35 | 0 | 0 | 0 | 110 | N432 Y433 Y460 V462 V473 | P430-N432 VanDerWaalsContact C-N 3.3Å; P430-Y433 HydrophobicContact CG-CD1 4.4Å; P430-Y433 WeakPolarHBondContact O-CD1 3.35Å; P430-Y460 HydrophobicContact CG-CG 4.16Å; P430-V462 HydrophobicContact CB-CG2 4.47Å; P430-V462 HydrophobicContact CG-CG2 4.24Å; P430-V473 HydrophobicContact CB-CG2 4.32Å; P430-V473 HydrophobicContact CG-CB 4.15Å; P430-V473 HydrophobicContact CG-CG2 3.9Å | ||
| 431 | K | 79.4 | Confident | 79.9 | Confident | 202 Ų | 202 | 82.1 Ų | 82.1 | 88% | 0.878 | 42% | 0.418 | S | S | * | . | S | Bend | trans | -74.9 | -21.7 | 177.4 | -66.8 | -174.6 | 178.1 | -177.1 | 0 | 113.6 | ||
| 432 | N | 83.6 | Confident | 81.9 | Confident | 127 Ų | 127 | 78.1 Ų | 78.1 | 68% | 0.679 | 41% | 0.41 | S | S | * | . | S | Bend | trans | -120.3 | 119 | 176.3 | -63.1 | 10.6 | 0 | 0 | 0 | 107.1 | P430 | P430-N432 VanDerWaalsContact C-N 3.3Š|
| 433 | Y | 86.4 | Confident | 83.8 | Confident | 69 Ų | 69 | 76.7 Ų | 76.7 | 27% | 0.271 | 39% | 0.391 | S | S | . | . | trans | -147.1 | 155.4 | 171.9 | 57.3 | -92.3 | 0 | 0 | 0 | 108.8 | P430 E435 K436 Y460 V461 | P430-Y433 HydrophobicContact CG-CD1 4.4Å; P430-Y433 WeakPolarHBondContact O-CD1 3.35Å; Y433-E435 WeakPolarHBondContact CD2-O 3.45Å; Y433-K436 HydrophobicContact CE2-CB 4.26Å; Y433-Y460 AromaticContact CD1-CD1 3.76Å; Y433-Y460 HydrophobicContact CD1-CD1 3.76Å; Y433-Y460 HydrophobicContact CD2-CD1 4.2Å; Y433-Y460 AromaticContact CE1-CD1 3.68Å; Y433-Y460 HydrophobicContact CE1-CD1 3.68Å; Y433-Y460 HydrophobicContact CE1-CE1 4.08Å; Y433-Y460 HydrophobicContact CE2-CD1 4.13Å; Y433-Y460 HydrophobicContact CG-CD1 4.01Å; Y433-Y460 AromaticContact CZ-CD1 3.87Å; Y433-V461 CarbonylContact C-O 3.5Å; Y433-V461 WeakPolarHBondContact CA-O 3.25Å; Y433-V461 WeakPolarHBondContact CB-O 3.36Å | ||
| 434 | I | 88.2 | Confident | 85.6 | Confident | 92 Ų | 92 | 73.1 Ų | 73.1 | 47% | 0.472 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -77.8 | -46.7 | 179.3 | -60.5 | 175.2 | 0 | 0 | 0 | 110 | V461 V462 | I434-V461 PolarHBondContact N-O 3.01Å; I434-V462 WeakPolarHBondContact CD1-O 3.31Å |
| 435 | E | 90.3 | Very high | 87 | Confident | 30 Ų | 30 | 74.2 Ų | 74.2 | 14% | 0.14 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.1 | 171.5 | 177.5 | 64.5 | 168.9 | 159.6 | 0 | 0 | 112 | Y433 V437 V461 K464 S488 | Y433-E435 WeakPolarHBondContact CD2-O 3.45Å; E435-V437 HydrophobicContact CG-CG1 3.83Å; E435-V461 HydrophobicContact CG-CB 3.95Å; E435-V461 HydrophobicContact CG-CG2 3.92Å; E435-V461 PolarHBondContact O-N 2.74Å; E435-K464 WeakPolarHBondContact OE1-CE 3.3Å; E435-K464 IonicContact OE1-NZ 3.11Å; E435-K464 PolarHBondContact OE1-NZ 2.69Å; E435-S488 VanDerWaalsContact OE2-CB 3.26Å; E435-S488 WeakPolarHBondContact OE2-CB 3.31Å; E435-S488 PolarHBondContact OE2-OG 2.65Å |
| 436 | K | 92.1 | Very high | 87.6 | Confident | 42 Ų | 42 | 78.7 Ų | 78.7 | 18% | 0.183 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 121.6 | 178.3 | -159.5 | 177.2 | -170.9 | 157.1 | 0 | 108.7 | D425 Y433 I458 Y460 I489 | D425-K436 IonicContact OD1-NZ 2.7Å; D425-K436 PolarHBondContact OD1-NZ 3Å; D425-K436 IonicContact OD2-NZ 2.69Å; D425-K436 PolarHBondContact OD2-NZ 2.9Å; Y433-K436 HydrophobicContact CE2-CB 4.26Å; K436-I458 HydrophobicContact CG-CG2 4.01Å; K436-Y460 HydrophobicContact CD-CE1 3.96Å; K436-Y460 VanDerWaalsContact CE-OH 3.31Å; K436-Y460 WeakPolarHBondContact CE-OH 3.15Å; K436-Y460 HydrophobicContact CG-CD1 4.19Å; K436-Y460 HydrophobicContact CG-CE1 4Å; K436-Y460 PolarHBondContact NZ-OH 3.17Å; K436-I489 HydrophobicContact CG-CD1 4.25Å; K436-I489 WeakPolarHBondContact O-CB 3.43Å; K436-I489 WeakPolarHBondContact O-CG1 3.48Å; K436-I489 PolarHBondContact O-N 3.39Å |
| 437 | V | 93.6 | Very high | 88.3 | Confident | 1 Ų | 1 | 81.2 Ų | 81.2 | 1% | 0.006 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.6 | 152.2 | -174 | -55 | 0 | 0 | 0 | 0 | 111 | E435 I459 V461 F481 V486 E487 | E435-V437 HydrophobicContact CG-CG1 3.83Å; V437-I459 HydrophobicContact CG2-CB 3.84Å; V437-I459 PolarHBondContact N-O 2.95Å; V437-I459 PolarHBondContact O-N 3.23Å; V437-V461 HydrophobicContact CB-CG2 4.41Å; V437-V461 HydrophobicContact CG1-CG2 3.68Å; V437-V461 HydrophobicContact CG2-CG2 3.79Å; V437-F481 HydrophobicContact CG2-CZ 4.46Å; V437-V486 HydrophobicContact CB-CB 3.92Å; V437-V486 HydrophobicContact CB-CG2 4.08Å; V437-V486 HydrophobicContact CG1-CG2 4.37Å; V437-V486 HydrophobicContact CG2-CB 3.73Å; V437-V486 HydrophobicContact CG2-CG1 3.86Å; V437-V486 HydrophobicContact CG2-CG2 3.89Å; V437-E487 CarbonylContact C-O 3.49Å; V437-E487 VanDerWaalsContact CA-O 3.28Å; V437-E487 WeakPolarHBondContact CA-O 3.4Å; V437-E487 WeakPolarHBondContact CB-O 3.44Å |
| 438 | V | 94.3 | Very high | 89.1 | Confident | 39 Ų | 39 | 81.1 Ų | 81.1 | 24% | 0.236 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 134.8 | 172.6 | 62.9 | 0 | 0 | 0 | 0 | 109.4 | I440 A457 I458 V486 E487 I489 | V438-I440 PolarHBondContact O-N 2.7Å; V438-A457 CarbonylContact C-O 3.54Å; V438-A457 WeakPolarHBondContact CA-O 3.39Å; V438-I458 HydrophobicContact CB-CD1 4.46Å; V438-I458 HydrophobicContact CG2-CD1 4.37Å; V438-V486 CarbonylContact O-C 3.58Å; V438-V486 WeakPolarHBondContact O-CA 3.41Å; V438-E487 HydrophobicContact CG1-CB 4.38Å; V438-E487 PolarHBondContact N-O 2.94Å; V438-E487 PolarHBondContact O-N 3.01Å; V438-I489 HydrophobicContact CB-CD1 3.87Å; V438-I489 HydrophobicContact CB-CG1 3.91Å; V438-I489 HydrophobicContact CG1-CG1 4.09Å |
| 439 | A | 94.4 | Very high | 89.7 | Confident | 2 Ų | 2 | 81 Ų | 81 | 2% | 0.017 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.9 | 128.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | F453 M454 G456 A457 Y485 | A439-F453 HydrophobicContact CB-CD2 3.44Å; A439-F453 VanDerWaalsContact CB-CD2 3.44Å; A439-F453 HydrophobicContact CB-CE2 3.53Å; A439-M454 VanDerWaalsContact CB-O 3.3Å; A439-M454 WeakPolarHBondContact CB-O 3.28Å; A439-G456 PolarHBondContact O-N 3.24Å; A439-A457 HydrophobicContact CB-CB 4.22Å; A439-A457 PolarHBondContact N-O 3.42Å; A439-Y485 WeakPolarHBondContact CA-O 3.39Å |
| 440 | I | 95.2 | Very high | 90.2 | Very high | 57 Ų | 57 | 80.5 Ų | 80.5 | 29% | 0.292 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -99.3 | -5.9 | 176.3 | 57.2 | 164.3 | 0 | 0 | 0 | 113 | V438 Y485 E487 | V438-I440 PolarHBondContact O-N 2.7Å; I440-Y485 WeakPolarHBondContact CG1-O 3.41Å; I440-Y485 PolarHBondContact N-O 2.99Å; I440-E487 HydrophobicContact CG2-CB 3.86Å |
| 441 | Y | 92.5 | Very high | 90.6 | Very high | 130 Ų | 130 | 79.2 Ų | 79.2 | 51% | 0.51 | 39% | 0.385 | S | S | . | . | S | Bend | trans | -145.5 | 159.4 | 172.8 | -55.8 | -61.1 | 0 | 0 | 0 | 110.2 | Y485 | Y441-Y485 HydrophobicContact CD2-CD1 4.2Å; Y441-Y485 HydrophobicContact CD2-CG 4.4Å; Y441-Y485 HydrophobicContact CG-CD1 4.45Å |
| 442 | D | 93.8 | Very high | 91.3 | Very high | 104 Ų | 104 | 72.6 Ų | 72.6 | 56% | 0.556 | 36% | 0.362 | S | S | * | . | trans | -64.8 | 142.8 | 164.9 | -66.2 | -29 | 0 | 0 | 0 | 110.8 | M454 E455 | D442-M454 WeakPolarHBondContact OD1-CA 3.3Å; D442-M454 WeakPolarHBondContact OD1-CB 3.24Å; D442-E455 PolarHBondContact OD1-N 3.25Å | ||
| 443 | Y | 94.3 | Very high | 91.8 | Very high | 30 Ų | 30 | 67.1 Ų | 67.1 | 12% | 0.118 | 33% | 0.332 | C | S | . | . | B | Isolated β-bridge | trans | -137.4 | 128.4 | 171.1 | -174 | -95.9 | 0 | 0 | 0 | 110.6 | E450 L451 T452 F453 W469 P482 Y485 | Y443-E450 HydrophobicContact CE1-CB 4.47Å; Y443-E450 PolarHBondContact OH-OE2 3.26Å; Y443-L451 WeakPolarHBondContact CD1-O 3.42Å; Y443-T452 WeakPolarHBondContact O-CA 3.41Å; Y443-F453 VanDerWaalsContact CB-CZ 3.45Å; Y443-F453 HydrophobicContact CD1-CE1 4.13Å; Y443-F453 HydrophobicContact CD1-CZ 4.46Å; Y443-F453 HydrophobicContact CG-CE1 4.26Å; Y443-F453 HydrophobicContact CG-CZ 4.14Å; Y443-F453 PolarHBondContact N-O 3.23Å; Y443-F453 PolarHBondContact O-N 3.32Å; Y443-W469 WeakPolarHBondContact OH-CH2 3.45Å; Y443-P482 HydrophobicContact CD2-CG 3.78Å; Y443-P482 HydrophobicContact CE2-CG 3.58Å; Y443-Y485 HydrophobicContact CD2-CD1 4.04Å; Y443-Y485 AromaticContact CD2-CE1 3.98Å; Y443-Y485 HydrophobicContact CD2-CE1 3.98Å; Y443-Y485 HydrophobicContact CD2-CG 4.49Å |
| 444 | T | 93.1 | Very high | 92.2 | Very high | 107 Ų | 107 | 70.3 Ų | 70.3 | 66% | 0.656 | 35% | 0.351 | S | S | * | . | trans | -113.4 | 133 | 174.3 | -56.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 445 | Q | 91.4 | Very high | 92.4 | Very high | 87 Ų | 87 | 72.4 Ų | 72.4 | 41% | 0.407 | 36% | 0.359 | S | S | . | . | trans | -59.5 | 133.7 | 178.5 | 68.8 | -165.1 | 92.4 | 0 | 0 | 112.5 | K447 E450 T452 | Q445-K447 WeakPolarHBondContact CB-O 3.44Å; Q445-K447 PolarHBondContact NE2-O 3.38Å; Q445-K447 VanDerWaalsContact NE2-O 3.07Å; Q445-E450 HydrophobicContact CB-CB 3.67Å; Q445-E450 WeakPolarHBondContact CB-O 3.38Å; Q445-T452 WeakPolarHBondContact CB-OG1 3.44Å; Q445-T452 VanDerWaalsContact CG-OG1 3.23Å; Q445-T452 WeakPolarHBondContact CG-OG1 3.49Å; Q445-T452 PolarHBondContact N-OG1 2.92Å; Q445-T452 PolarHBondContact OE1-OG1 3.44Å | ||
| 446 | D | 84.6 | Confident | 92.4 | Very high | 146 Ų | 146 | 73.2 Ų | 73.2 | 78% | 0.781 | 38% | 0.375 | S | S | * | . | S | Bend | trans | -93.1 | -21.9 | 169.1 | -166 | 48.8 | 0 | 0 | 0 | 110.8 | E450 | D446-E450 PolarHBondContact N-OE2 3.07Š|
| 447 | K | 90.3 | Very high | 92.4 | Very high | 105 Ų | 105 | 72.1 Ų | 72.1 | 46% | 0.457 | 37% | 0.374 | S | S | . | . | S | Bend | trans | -123.6 | 172.4 | 178.4 | -51.3 | -168.6 | -148.3 | 78 | 0 | 113.3 | Q445 D449 E450 | Q445-K447 WeakPolarHBondContact CB-O 3.44Å; Q445-K447 PolarHBondContact NE2-O 3.38Å; Q445-K447 VanDerWaalsContact NE2-O 3.07Å; K447-D449 WeakPolarHBondContact CB-OD1 3.35Å; K447-E450 HydrophobicContact CB-CG 4.19Å; K447-E450 IonicContact NZ-OE1 2.75Å; K447-E450 PolarHBondContact NZ-OE1 3Å |
| 448 | E | 86.9 | Confident | 92.4 | Very high | 196 Ų | 196 | 75.2 Ų | 75.2 | 92% | 0.916 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -20 | 179.9 | -62.4 | -174.3 | 173.3 | 0 | 0 | 113.4 | ||
| 449 | D | 91.1 | Very high | 92.3 | Very high | 87 Ų | 87 | 73.4 Ų | 73.4 | 47% | 0.465 | 38% | 0.379 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.5 | -1.1 | 177.6 | 57.6 | -46.6 | 0 | 0 | 0 | 114.1 | K447 G479 L480 | K447-D449 WeakPolarHBondContact CB-OD1 3.35Å; D449-G479 WeakPolarHBondContact O-CA 3.33Å; D449-L480 PolarHBondContact O-N 3.37Å |
| 450 | E | 94 | Very high | 92.3 | Very high | 8 Ų | 8 | 73.5 Ų | 73.5 | 4% | 0.037 | 38% | 0.379 | C | S | . | . | B | Isolated β-bridge | trans | -99.4 | 148.9 | -176.5 | -71.2 | 176.1 | -166.4 | 0 | 0 | 113.6 | Y443 Q445 D446 K447 W469 L480 | Y443-E450 HydrophobicContact CE1-CB 4.47Å; Y443-E450 PolarHBondContact OH-OE2 3.26Å; Q445-E450 HydrophobicContact CB-CB 3.67Å; Q445-E450 WeakPolarHBondContact CB-O 3.38Å; D446-E450 PolarHBondContact N-OE2 3.07Å; K447-E450 HydrophobicContact CB-CG 4.19Å; K447-E450 IonicContact NZ-OE1 2.75Å; K447-E450 PolarHBondContact NZ-OE1 3Å; E450-W469 HydrophobicContact CG-CH2 4.37Å; E450-W469 HydrophobicContact CG-CZ3 3.87Å; E450-W469 WeakPolarHBondContact OE1-CH2 3.35Å; E450-L480 CarbonylContact C-O 3.58Å; E450-L480 WeakPolarHBondContact CA-O 3.49Å |
| 451 | L | 93.3 | Very high | 92.3 | Very high | 3 Ų | 3 | 70.8 Ų | 70.8 | 2% | 0.016 | 37% | 0.365 | C | S | . | . | trans | -97.6 | 112.2 | -173.4 | -176.4 | 68.5 | 0 | 0 | 0 | 112.3 | Y443 F453 I459 C474 V477 L480 F481 | Y443-L451 WeakPolarHBondContact CD1-O 3.42Å; L451-F453 HydrophobicContact CD2-CD1 4.37Å; L451-F453 HydrophobicContact CG-CD1 4.25Å; L451-F453 WeakPolarHBondContact O-CD1 3.13Å; L451-F453 WeakPolarHBondContact O-CE1 3.2Å; L451-I459 HydrophobicContact CD2-CD1 4.4Å; L451-I459 HydrophobicContact CD2-CG2 3.92Å; L451-C474 HydrophobicContact CD1-CB 4.34Å; L451-C474 HydrophobicContact CD2-CB 3.97Å; L451-C474 HydrophobicContact CG-CB 4.46Å; L451-V477 HydrophobicContact CD1-CB 4.07Å; L451-V477 HydrophobicContact CD1-CG1 3.91Å; L451-V477 WeakPolarHBondContact CD1-O 3.34Å; L451-L480 PolarHBondContact N-O 3.16Å; L451-F481 HydrophobicContact CB-CD1 4.46Å; L451-F481 HydrophobicContact CD2-CD1 3.96Å; L451-F481 HydrophobicContact CD2-CE1 4.32Å | ||
| 452 | T | 93.8 | Very high | 92.3 | Very high | 63 Ų | 63 | 67.3 Ų | 67.3 | 39% | 0.387 | 36% | 0.357 | S | S | . | . | trans | -76.7 | 131.7 | 172.8 | -64.5 | 0 | 0 | 0 | 0 | 112.5 | Y443 Q445 | Y443-T452 WeakPolarHBondContact O-CA 3.41Å; Q445-T452 WeakPolarHBondContact CB-OG1 3.44Å; Q445-T452 VanDerWaalsContact CG-OG1 3.23Å; Q445-T452 WeakPolarHBondContact CG-OG1 3.49Å; Q445-T452 PolarHBondContact N-OG1 2.92Å; Q445-T452 PolarHBondContact OE1-OG1 3.44Å | ||
| 453 | F | 94.8 | Very high | 92.2 | Very high | 11 Ų | 11 | 67.3 Ų | 67.3 | 5% | 0.048 | 35% | 0.352 | C | S | . | . | B | Isolated β-bridge | trans | -152.9 | 172.3 | 175.2 | 56.7 | -96.8 | 0 | 0 | 0 | 113.1 | A439 Y443 L451 A457 I459 F481 V486 | A439-F453 HydrophobicContact CB-CD2 3.44Å; A439-F453 VanDerWaalsContact CB-CD2 3.44Å; A439-F453 HydrophobicContact CB-CE2 3.53Å; Y443-F453 VanDerWaalsContact CB-CZ 3.45Å; Y443-F453 HydrophobicContact CD1-CE1 4.13Å; Y443-F453 HydrophobicContact CD1-CZ 4.46Å; Y443-F453 HydrophobicContact CG-CE1 4.26Å; Y443-F453 HydrophobicContact CG-CZ 4.14Å; Y443-F453 PolarHBondContact N-O 3.23Å; Y443-F453 PolarHBondContact O-N 3.32Å; L451-F453 HydrophobicContact CD2-CD1 4.37Å; L451-F453 HydrophobicContact CG-CD1 4.25Å; L451-F453 WeakPolarHBondContact O-CD1 3.13Å; L451-F453 WeakPolarHBondContact O-CE1 3.2Å; F453-A457 HydrophobicContact CB-CB 4.01Å; F453-I459 HydrophobicContact CB-CD1 4.47Å; F453-I459 HydrophobicContact CD1-CD1 3.54Å; F453-I459 HydrophobicContact CD2-CD1 4.12Å; F453-I459 HydrophobicContact CE1-CD1 3.64Å; F453-I459 HydrophobicContact CE2-CD1 4.21Å; F453-I459 HydrophobicContact CG-CD1 3.79Å; F453-I459 HydrophobicContact CZ-CD1 3.97Å; F453-F481 HydrophobicContact CE1-CB 3.6Å; F453-F481 HydrophobicContact CE1-CD2 4.11Å; F453-F481 AromaticContact CE1-CG 3.86Å; F453-F481 HydrophobicContact CE1-CG 3.86Å; F453-F481 HydrophobicContact CZ-CB 4.2Å; F453-F481 HydrophobicContact CZ-CD2 4.2Å; F453-F481 HydrophobicContact CZ-CG 4.38Å; F453-V486 HydrophobicContact CZ-CG1 4.49Å |
| 454 | M | 95 | Very high | 92.2 | Very high | 136 Ų | 136 | 70.1 Ų | 70.1 | 67% | 0.67 | 37% | 0.365 | S | S | * | . | trans | -115.1 | 161.2 | 178.9 | -63.2 | 177.6 | -63.1 | 0 | 0 | 111.3 | A439 D442 G456 A457 | A439-M454 VanDerWaalsContact CB-O 3.3Å; A439-M454 WeakPolarHBondContact CB-O 3.28Å; D442-M454 WeakPolarHBondContact OD1-CA 3.3Å; D442-M454 WeakPolarHBondContact OD1-CB 3.24Å; M454-G456 PolarHBondContact O-N 2.98Å; M454-A457 WeakPolarHBondContact O-CB 3.45Å; M454-A457 PolarHBondContact O-N 3.44Å | ||
| 455 | E | 92.6 | Very high | 92.1 | Very high | 137 Ų | 137 | 66.9 Ų | 66.9 | 64% | 0.64 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51 | 134.1 | 169.5 | -171.8 | -174.6 | 143.7 | 0 | 0 | 110.9 | D442 A457 | D442-E455 PolarHBondContact OD1-N 3.25Å; E455-A457 VanDerWaalsContact C-N 3.31Å; E455-A457 PolarHBondContact O-N 3.09Å |
| 456 | G | 89.7 | Confident | 91.9 | Very high | 46 Ų | 46 | 71.3 Ų | 71.3 | 47% | 0.474 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 80.1 | -0.4 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | A439 M454 | A439-G456 PolarHBondContact O-N 3.24Å; M454-G456 PolarHBondContact O-N 2.98Å |
| 457 | A | 91.8 | Very high | 92 | Very high | 20 Ų | 20 | 69.5 Ų | 69.5 | 17% | 0.165 | 36% | 0.36 | C | S | . | . | trans | -65.9 | 143.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | V438 A439 F453 M454 E455 | V438-A457 CarbonylContact C-O 3.54Å; V438-A457 WeakPolarHBondContact CA-O 3.39Å; A439-A457 HydrophobicContact CB-CB 4.22Å; A439-A457 PolarHBondContact N-O 3.42Å; F453-A457 HydrophobicContact CB-CB 4.01Å; M454-A457 WeakPolarHBondContact O-CB 3.45Å; M454-A457 PolarHBondContact O-N 3.44Å; E455-A457 VanDerWaalsContact C-N 3.31Å; E455-A457 PolarHBondContact O-N 3.09Å | ||
| 458 | I | 92.9 | Very high | 92 | Very high | 66 Ų | 66 | 66.3 Ų | 66.3 | 34% | 0.338 | 36% | 0.357 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 124.1 | 176.8 | -52.6 | -63.7 | 0 | 0 | 0 | 108.9 | K436 V438 Y460 C474 I489 | K436-I458 HydrophobicContact CG-CG2 4.01Å; V438-I458 HydrophobicContact CB-CD1 4.46Å; V438-I458 HydrophobicContact CG2-CD1 4.37Å; I458-Y460 HydrophobicContact CG2-CE2 4.25Å; I458-C474 PolarHBondContact O-SG 3.38Å; I458-I489 HydrophobicContact CD1-CD1 3.55Å; I458-I489 HydrophobicContact CG2-CD1 4.3Å |
| 459 | I | 94 | Very high | 92.4 | Very high | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 136.3 | -179.7 | -43.4 | -179.3 | 0 | 0 | 0 | 109.1 | V437 L451 F453 C474 F481 V486 | V437-I459 HydrophobicContact CG2-CB 3.84Å; V437-I459 PolarHBondContact N-O 2.95Å; V437-I459 PolarHBondContact O-N 3.23Å; L451-I459 HydrophobicContact CD2-CD1 4.4Å; L451-I459 HydrophobicContact CD2-CG2 3.92Å; F453-I459 HydrophobicContact CB-CD1 4.47Å; F453-I459 HydrophobicContact CD1-CD1 3.54Å; F453-I459 HydrophobicContact CD2-CD1 4.12Å; F453-I459 HydrophobicContact CE1-CD1 3.64Å; F453-I459 HydrophobicContact CE2-CD1 4.21Å; F453-I459 HydrophobicContact CG-CD1 3.79Å; F453-I459 HydrophobicContact CZ-CD1 3.97Å; I459-C474 HydrophobicContact CG1-CB 4.17Å; I459-C474 HydrophobicContact CG2-CB 4.4Å; I459-F481 HydrophobicContact CB-CZ 4.49Å; I459-F481 HydrophobicContact CD1-CE1 4.47Å; I459-F481 HydrophobicContact CD1-CE2 4.35Å; I459-F481 HydrophobicContact CD1-CZ 4.28Å; I459-F481 HydrophobicContact CG2-CE1 3.71Å; I459-F481 HydrophobicContact CG2-CZ 3.88Å; I459-V486 HydrophobicContact CD1-CG1 4.09Å |
| 460 | Y | 94.1 | Very high | 92.6 | Very high | 4 Ų | 4 | 57.8 Ų | 57.8 | 2% | 0.016 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 111.7 | 174.2 | -60.7 | -96.5 | 0 | 0 | 0 | 108.2 | D425 W428 A429 P430 Y433 K436 I458 V462 G472 V473 | D425-Y460 PolarHBondContact OD1-OH 3.23Å; D425-Y460 VanDerWaalsContact OD1-OH 3.1Å; D425-Y460 PolarHBondContact OD2-OH 3.3Å; W428-Y460 HydrophobicContact CH2-CD2 4.27Å; W428-Y460 AromaticContact CH2-CE2 3.78Å; W428-Y460 HydrophobicContact CH2-CE2 3.78Å; W428-Y460 AromaticContact CZ3-CD2 3.82Å; W428-Y460 HydrophobicContact CZ3-CD2 3.82Å; W428-Y460 AromaticContact CZ3-CE2 3.67Å; W428-Y460 HydrophobicContact CZ3-CE2 3.67Å; A429-Y460 HydrophobicContact CB-CD2 4.31Å; A429-Y460 HydrophobicContact CB-CE1 4.07Å; A429-Y460 HydrophobicContact CB-CE2 3.87Å; P430-Y460 HydrophobicContact CG-CG 4.16Å; Y433-Y460 AromaticContact CD1-CD1 3.76Å; Y433-Y460 HydrophobicContact CD1-CD1 3.76Å; Y433-Y460 HydrophobicContact CD2-CD1 4.2Å; Y433-Y460 AromaticContact CE1-CD1 3.68Å; Y433-Y460 HydrophobicContact CE1-CD1 3.68Å; Y433-Y460 HydrophobicContact CE1-CE1 4.08Å; Y433-Y460 HydrophobicContact CE2-CD1 4.13Å; Y433-Y460 HydrophobicContact CG-CD1 4.01Å; Y433-Y460 AromaticContact CZ-CD1 3.87Å; K436-Y460 HydrophobicContact CD-CE1 3.96Å; K436-Y460 VanDerWaalsContact CE-OH 3.31Å; K436-Y460 WeakPolarHBondContact CE-OH 3.15Å; K436-Y460 HydrophobicContact CG-CD1 4.19Å; K436-Y460 HydrophobicContact CG-CE1 4Å; K436-Y460 PolarHBondContact NZ-OH 3.17Å; I458-Y460 HydrophobicContact CG2-CE2 4.25Å; Y460-V462 PolarHBondContact O-N 2.96Å; Y460-G472 CarbonylContact O-C 3.54Å; Y460-G472 WeakPolarHBondContact O-CA 3.4Å; Y460-V473 PolarHBondContact N-O 2.97Å; Y460-V473 PolarHBondContact O-N 3.29Å |
| 461 | V | 94.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.2 | 114.9 | -177.7 | 179.7 | 0 | 0 | 0 | 0 | 108.7 | Y433 I434 E435 V437 K463 K464 F470 F481 | Y433-V461 CarbonylContact C-O 3.5Å; Y433-V461 WeakPolarHBondContact CA-O 3.25Å; Y433-V461 WeakPolarHBondContact CB-O 3.36Å; I434-V461 PolarHBondContact N-O 3.01Å; E435-V461 HydrophobicContact CG-CB 3.95Å; E435-V461 HydrophobicContact CG-CG2 3.92Å; E435-V461 PolarHBondContact O-N 2.74Å; V437-V461 HydrophobicContact CB-CG2 4.41Å; V437-V461 HydrophobicContact CG1-CG2 3.68Å; V437-V461 HydrophobicContact CG2-CG2 3.79Å; V461-K463 WeakPolarHBondContact CG1-O 3.44Å; V461-K464 HydrophobicContact CG1-CG 3.88Å; V461-F470 HydrophobicContact CG1-CB 4.32Å; V461-F470 HydrophobicContact CG2-CD2 4.44Å; V461-F481 HydrophobicContact CG2-CZ 4.27Å |
| 462 | V | 92.9 | Very high | 92.7 | Very high | 58 Ų | 58 | 60.5 Ų | 60.5 | 35% | 0.352 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.1 | -34.4 | 177.8 | 179.7 | 0 | 0 | 0 | 0 | 110.7 | P430 I434 Y460 E471 V473 | P430-V462 HydrophobicContact CB-CG2 4.47Å; P430-V462 HydrophobicContact CG-CG2 4.24Å; I434-V462 WeakPolarHBondContact CD1-O 3.31Å; Y460-V462 PolarHBondContact O-N 2.96Å; V462-E471 PolarHBondContact N-O 3.38Å; V462-V473 HydrophobicContact CG2-CG2 3.95Å |
| 463 | K | 92.5 | Very high | 92.7 | Very high | 104 Ų | 104 | 58 Ų | 58 | 45% | 0.452 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.4 | 152.5 | 179.4 | -165.9 | -172.7 | 173.4 | -143.4 | 0 | 111.2 | V461 N465 F470 E471 | V461-K463 WeakPolarHBondContact CG1-O 3.44Å; K463-N465 VanDerWaalsContact CE-OD1 3.29Å; K463-N465 WeakPolarHBondContact CE-OD1 3.36Å; K463-N465 PolarHBondContact NZ-OD1 3.3Å; K463-F470 WeakPolarHBondContact O-CA 3.44Å; K463-E471 HydrophobicContact CB-CB 3.89Å; K463-E471 PolarHBondContact N-O 2.95Å; K463-E471 VanDerWaalsContact N-O 3.1Å; K463-E471 PolarHBondContact O-N 3.06Å |
| 464 | K | 93.6 | Very high | 92.5 | Very high | 89 Ų | 89 | 57.8 Ų | 57.8 | 39% | 0.387 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.9 | 136.4 | 165.3 | -59.1 | -171.8 | 172.7 | -174.1 | 0 | 108.9 | E435 V461 F470 | E435-K464 WeakPolarHBondContact OE1-CE 3.3Å; E435-K464 IonicContact OE1-NZ 3.11Å; E435-K464 PolarHBondContact OE1-NZ 2.69Å; V461-K464 HydrophobicContact CG1-CG 3.88Å; K464-F470 HydrophobicContact CB-CD1 3.73Å; K464-F470 HydrophobicContact CB-CE1 3.91Å; K464-F470 HydrophobicContact CD-CD1 4.06Å; K464-F470 HydrophobicContact CD-CE1 3.67Å; K464-F470 HydrophobicContact CD-CE2 4.38Å; K464-F470 HydrophobicContact CD-CZ 3.86Å; K464-F470 HydrophobicContact CG-CD1 3.56Å; K464-F470 HydrophobicContact CG-CE1 3.72Å; K464-F470 HydrophobicContact CG-CG 4.04Å; K464-F470 HydrophobicContact CG-CZ 4.28Å |
| 465 | N | 91.1 | Very high | 92.1 | Very high | 38 Ų | 38 | 57.1 Ų | 57.1 | 20% | 0.203 | 31% | 0.307 | C | S | . | . | trans | -103 | 154.1 | 172.6 | -63.5 | -15.5 | 0 | 0 | 0 | 110.2 | K463 D467 G468 W469 | K463-N465 VanDerWaalsContact CE-OD1 3.29Å; K463-N465 WeakPolarHBondContact CE-OD1 3.36Å; K463-N465 PolarHBondContact NZ-OD1 3.3Å; N465-D467 WeakPolarHBondContact CB-OD1 3.47Å; N465-D467 PolarHBondContact O-N 2.79Å; N465-G468 PolarHBondContact O-N 3.28Å; N465-W469 WeakPolarHBondContact CB-O 3.42Å; N465-W469 PolarHBondContact N-O 3.29Å | ||
| 466 | D | 86 | Confident | 91.8 | Very high | 181 Ų | 181 | 52.7 Ų | 52.7 | 97% | 0.968 | 30% | 0.298 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -8.3 | -179.5 | -54.4 | -61 | 0 | 0 | 0 | 114 | G468 | D466-G468 VanDerWaalsContact C-N 3.3Š|
| 467 | D | 87.6 | Confident | 91.8 | Very high | 108 Ų | 108 | 54.8 Ų | 54.8 | 58% | 0.578 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -3.8 | 174 | 59.5 | 20.4 | 0 | 0 | 0 | 113.6 | N465 W469 | N465-D467 WeakPolarHBondContact CB-OD1 3.47Å; N465-D467 PolarHBondContact O-N 2.79Å; D467-W469 WeakPolarHBondContact OD1-CB 3.21Å; D467-W469 PolarHBondContact OD1-N 3.17Å |
| 468 | G | 90.4 | Very high | 91.9 | Very high | 38 Ų | 38 | 57.7 Ų | 57.7 | 39% | 0.392 | 32% | 0.318 | S | S | . | . | S | Bend | trans | 91 | 1.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | N465 D466 G483 | N465-G468 PolarHBondContact O-N 3.28Å; D466-G468 VanDerWaalsContact C-N 3.3Å; G468-G483 PolarHBondContact O-N 3.32Å |
| 469 | W | 94.4 | Very high | 91.9 | Very high | 72 Ų | 72 | 55 Ų | 55 | 27% | 0.273 | 31% | 0.305 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.1 | 138.1 | 172.4 | -68.3 | 74.7 | 0 | 0 | 0 | 111.4 | Y443 E450 N465 D467 L480 F481 | Y443-W469 WeakPolarHBondContact OH-CH2 3.45Å; E450-W469 HydrophobicContact CG-CH2 4.37Å; E450-W469 HydrophobicContact CG-CZ3 3.87Å; E450-W469 WeakPolarHBondContact OE1-CH2 3.35Å; N465-W469 WeakPolarHBondContact CB-O 3.42Å; N465-W469 PolarHBondContact N-O 3.29Å; D467-W469 WeakPolarHBondContact OD1-CB 3.21Å; D467-W469 PolarHBondContact OD1-N 3.17Å; W469-L480 HydrophobicContact CE3-CB 4.04Å; W469-F481 WeakPolarHBondContact CA-O 3.43Å |
| 470 | F | 95.3 | Very high | 92 | Very high | 32 Ų | 32 | 56.9 Ų | 56.9 | 14% | 0.14 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | 143.4 | 175.4 | -60 | -12.8 | 0 | 0 | 0 | 109.4 | V461 K463 K464 L480 F481 G483 V486 | V461-F470 HydrophobicContact CG1-CB 4.32Å; V461-F470 HydrophobicContact CG2-CD2 4.44Å; K463-F470 WeakPolarHBondContact O-CA 3.44Å; K464-F470 HydrophobicContact CB-CD1 3.73Å; K464-F470 HydrophobicContact CB-CE1 3.91Å; K464-F470 HydrophobicContact CD-CD1 4.06Å; K464-F470 HydrophobicContact CD-CE1 3.67Å; K464-F470 HydrophobicContact CD-CE2 4.38Å; K464-F470 HydrophobicContact CD-CZ 3.86Å; K464-F470 HydrophobicContact CG-CD1 3.56Å; K464-F470 HydrophobicContact CG-CE1 3.72Å; K464-F470 HydrophobicContact CG-CG 4.04Å; K464-F470 HydrophobicContact CG-CZ 4.28Å; F470-L480 CarbonylContact O-C 3.49Å; F470-L480 WeakPolarHBondContact O-CA 3.49Å; F470-F481 HydrophobicContact CB-CD2 4.47Å; F470-F481 HydrophobicContact CB-CE1 4.03Å; F470-F481 HydrophobicContact CB-CE2 3.92Å; F470-F481 HydrophobicContact CB-CZ 3.69Å; F470-F481 HydrophobicContact CD2-CE2 4.06Å; F470-F481 HydrophobicContact CD2-CZ 4.29Å; F470-F481 HydrophobicContact CG-CE2 4.47Å; F470-F481 PolarHBondContact N-O 2.86Å; F470-F481 VanDerWaalsContact O-CD1 3.31Å; F470-F481 WeakPolarHBondContact O-CD1 3.32Å; F470-F481 PolarHBondContact O-N 3.06Å; F470-G483 VanDerWaalsContact CE2-CA 3.47Å; F470-V486 HydrophobicContact CD2-CG2 4.25Å; F470-V486 HydrophobicContact CE2-CG2 4.24Å |
| 471 | E | 94.9 | Very high | 92.1 | Very high | 68 Ų | 68 | 56.7 Ų | 56.7 | 32% | 0.318 | 32% | 0.315 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 130.8 | 170.4 | -166 | -171.7 | 158.1 | 0 | 0 | 107.9 | V462 K463 T478 L480 | V462-E471 PolarHBondContact N-O 3.38Å; K463-E471 HydrophobicContact CB-CB 3.89Å; K463-E471 PolarHBondContact N-O 2.95Å; K463-E471 VanDerWaalsContact N-O 3.1Å; K463-E471 PolarHBondContact O-N 3.06Å; E471-T478 HydrophobicContact CG-CG2 4.31Å; E471-L480 HydrophobicContact CB-CD2 3.94Å; E471-L480 HydrophobicContact CG-CD2 4.3Å |
| 472 | G | 94.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -161.4 | 174 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y460 T478 G479 | Y460-G472 CarbonylContact O-C 3.54Å; Y460-G472 WeakPolarHBondContact O-CA 3.4Å; G472-T478 WeakPolarHBondContact O-CA 3.39Å; G472-G479 PolarHBondContact N-O 3.45Å; G472-G479 VanDerWaalsContact N-O 3.09Å; G472-G479 PolarHBondContact O-N 3.26Å; G472-G479 VanDerWaalsContact O-N 3.1Å |
| 473 | V | 94.1 | Very high | 92.1 | Very high | 11 Ų | 11 | 55.1 Ų | 55.1 | 7% | 0.067 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 126.6 | -175.9 | -171.4 | 0 | 0 | 0 | 0 | 110.4 | W428 P430 Y460 V462 V477 T478 | W428-V473 HydrophobicContact CE3-CG1 4.13Å; W428-V473 HydrophobicContact CZ3-CG1 4.3Å; P430-V473 HydrophobicContact CB-CG2 4.32Å; P430-V473 HydrophobicContact CG-CB 4.15Å; P430-V473 HydrophobicContact CG-CG2 3.9Å; Y460-V473 PolarHBondContact N-O 2.97Å; Y460-V473 PolarHBondContact O-N 3.29Å; V462-V473 HydrophobicContact CG2-CG2 3.95Å; V473-V477 VanDerWaalsContact CA-O 3.31Å; V473-V477 WeakPolarHBondContact CA-O 3.4Å; V473-T478 HydrophobicContact CG2-CG2 4.3Å |
| 474 | C | 91.9 | Very high | 92.2 | Very high | 5 Ų | 5 | 55.5 Ų | 55.5 | 3% | 0.034 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 130.6 | 169.9 | -172.5 | 0 | 0 | 0 | 0 | 109.8 | L451 I458 I459 G476 V477 | L451-C474 HydrophobicContact CD1-CB 4.34Å; L451-C474 HydrophobicContact CD2-CB 3.97Å; L451-C474 HydrophobicContact CG-CB 4.46Å; I458-C474 PolarHBondContact O-SG 3.38Å; I459-C474 HydrophobicContact CG1-CB 4.17Å; I459-C474 HydrophobicContact CG2-CB 4.4Å; C474-G476 PolarHBondContact O-N 3.01Å; C474-V477 PolarHBondContact N-O 3.2Å; C474-V477 PolarHBondContact O-N 3.18Å |
| 475 | N | 86.4 | Confident | 92.3 | Very high | 123 Ų | 123 | 55 Ų | 55 | 66% | 0.658 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 24.1 | -178.5 | -58.8 | -49 | 0 | 0 | 0 | 115.3 | W428 | W428-N475 VanDerWaalsContact CZ3-N 3.25Š|
| 476 | G | 85.1 | Confident | 92.4 | Very high | 44 Ų | 44 | 54 Ų | 54 | 45% | 0.454 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 83.6 | 5.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | C474 | C474-G476 PolarHBondContact O-N 3.01Š|
| 477 | V | 90.2 | Very high | 92.7 | Very high | 89 Ų | 89 | 51.4 Ų | 51.4 | 54% | 0.539 | 29% | 0.289 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.4 | 134.8 | 169.4 | -177.1 | 0 | 0 | 0 | 0 | 108.7 | L451 V473 C474 | L451-V477 HydrophobicContact CD1-CB 4.07Å; L451-V477 HydrophobicContact CD1-CG1 3.91Å; L451-V477 WeakPolarHBondContact CD1-O 3.34Å; V473-V477 VanDerWaalsContact CA-O 3.31Å; V473-V477 WeakPolarHBondContact CA-O 3.4Å; C474-V477 PolarHBondContact N-O 3.2Å; C474-V477 PolarHBondContact O-N 3.18Å |
| 478 | T | 92.9 | Very high | 92.8 | Very high | 82 Ų | 82 | 49 Ų | 49 | 50% | 0.503 | 28% | 0.28 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103 | 141.4 | 173.6 | -48.7 | 0 | 0 | 0 | 0 | 109.7 | E471 G472 V473 | E471-T478 HydrophobicContact CG-CG2 4.31Å; G472-T478 WeakPolarHBondContact O-CA 3.39Å; V473-T478 HydrophobicContact CG2-CG2 4.3Å |
| 479 | G | 94.2 | Very high | 92.4 | Very high | 8 Ų | 8 | 50 Ų | 50 | 8% | 0.082 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -175.4 | 177 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | D449 G472 | D449-G479 WeakPolarHBondContact O-CA 3.33Å; G472-G479 PolarHBondContact N-O 3.45Å; G472-G479 VanDerWaalsContact N-O 3.09Å; G472-G479 PolarHBondContact O-N 3.26Å; G472-G479 VanDerWaalsContact O-N 3.1Å |
| 480 | L | 95.4 | Very high | 91 | Very high | 41 Ų | 41 | 53.4 Ų | 53.4 | 22% | 0.215 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.8 | 144.2 | 176.8 | -68.4 | 172.5 | 0 | 0 | 0 | 112.1 | D449 E450 L451 W469 F470 E471 | D449-L480 PolarHBondContact O-N 3.37Å; E450-L480 CarbonylContact C-O 3.58Å; E450-L480 WeakPolarHBondContact CA-O 3.49Å; L451-L480 PolarHBondContact N-O 3.16Å; W469-L480 HydrophobicContact CE3-CB 4.04Å; F470-L480 CarbonylContact O-C 3.49Å; F470-L480 WeakPolarHBondContact O-CA 3.49Å; E471-L480 HydrophobicContact CB-CD2 3.94Å; E471-L480 HydrophobicContact CG-CD2 4.3Å |
| 481 | F | 95.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.2 | 154 | 173.3 | 62.9 | -85.8 | 0 | 0 | 0 | 112.5 | V437 L451 F453 I459 V461 W469 F470 G483 V486 | V437-F481 HydrophobicContact CG2-CZ 4.46Å; L451-F481 HydrophobicContact CB-CD1 4.46Å; L451-F481 HydrophobicContact CD2-CD1 3.96Å; L451-F481 HydrophobicContact CD2-CE1 4.32Å; F453-F481 HydrophobicContact CE1-CB 3.6Å; F453-F481 HydrophobicContact CE1-CD2 4.11Å; F453-F481 AromaticContact CE1-CG 3.86Å; F453-F481 HydrophobicContact CE1-CG 3.86Å; F453-F481 HydrophobicContact CZ-CB 4.2Å; F453-F481 HydrophobicContact CZ-CD2 4.2Å; F453-F481 HydrophobicContact CZ-CG 4.38Å; I459-F481 HydrophobicContact CB-CZ 4.49Å; I459-F481 HydrophobicContact CD1-CE1 4.47Å; I459-F481 HydrophobicContact CD1-CE2 4.35Å; I459-F481 HydrophobicContact CD1-CZ 4.28Å; I459-F481 HydrophobicContact CG2-CE1 3.71Å; I459-F481 HydrophobicContact CG2-CZ 3.88Å; V461-F481 HydrophobicContact CG2-CZ 4.27Å; W469-F481 WeakPolarHBondContact CA-O 3.43Å; F470-F481 HydrophobicContact CB-CD2 4.47Å; F470-F481 HydrophobicContact CB-CE1 4.03Å; F470-F481 HydrophobicContact CB-CE2 3.92Å; F470-F481 HydrophobicContact CB-CZ 3.69Å; F470-F481 HydrophobicContact CD2-CE2 4.06Å; F470-F481 HydrophobicContact CD2-CZ 4.29Å; F470-F481 HydrophobicContact CG-CE2 4.47Å; F470-F481 PolarHBondContact N-O 2.86Å; F470-F481 VanDerWaalsContact O-CD1 3.31Å; F470-F481 WeakPolarHBondContact O-CD1 3.32Å; F470-F481 PolarHBondContact O-N 3.06Å; F481-G483 PolarHBondContact O-N 2.95Å; F481-V486 HydrophobicContact CD2-CG1 4.07Å; F481-V486 HydrophobicContact CE2-CB 4.4Å; F481-V486 HydrophobicContact CE2-CG1 3.57Å; F481-V486 HydrophobicContact CE2-CG2 3.88Å; F481-V486 HydrophobicContact CZ-CG1 4.48Å |
| 482 | P | 95.2 | Very high | 85.9 | Confident | 12 Ų | 12 | 68.1 Ų | 68.1 | 8% | 0.078 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 123 | 177.9 | 26.4 | -35.4 | 0 | 0 | 0 | 111.7 | Y443 N484 Y485 | Y443-P482 HydrophobicContact CD2-CG 3.78Å; Y443-P482 HydrophobicContact CE2-CG 3.58Å; P482-N484 PolarHBondContact O-N 2.94Å; P482-Y485 HydrophobicContact CB-CD2 3.81Å; P482-Y485 HydrophobicContact CB-CE2 4.2Å; P482-Y485 HydrophobicContact CG-CD2 3.36Å; P482-Y485 HydrophobicContact CG-CE2 3.75Å; P482-Y485 HydrophobicContact CG-CG 3.88Å; P482-Y485 PolarHBondContact O-N 3.14Å |
| 483 | G | 92.4 | Very high | 83 | Confident | 13 Ų | 13 | 73.2 Ų | 73.2 | 13% | 0.134 | 40% | 0.4 | C | S | . | . | G | 310 helix | trans | -63.7 | -14.9 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | G468 F470 F481 Y485 V486 | G468-G483 PolarHBondContact O-N 3.32Å; F470-G483 VanDerWaalsContact CE2-CA 3.47Å; F481-G483 PolarHBondContact O-N 2.95Å; G483-Y485 VanDerWaalsContact C-N 3.31Å; G483-V486 WeakPolarHBondContact O-CG2 3.47Å |
| 484 | N | 95.4 | Very high | 80 | Confident | 112 Ų | 112 | 85.5 Ų | 85.5 | 60% | 0.599 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | -84.4 | 1.7 | 175.8 | 77 | -88.7 | 0 | 0 | 0 | 114.3 | P482 | P482-N484 PolarHBondContact O-N 2.94Š|
| 485 | Y | 94.1 | Very high | 79.4 | Confident | 77 Ų | 77 | 89.6 Ų | 89.6 | 30% | 0.302 | 48% | 0.478 | S | S | . | . | G | 310 helix | trans | -95.9 | 4.2 | 175.2 | -79.9 | -117.3 | 0 | 0 | 0 | 112.6 | A439 I440 Y441 Y443 P482 G483 | A439-Y485 WeakPolarHBondContact CA-O 3.39Å; I440-Y485 WeakPolarHBondContact CG1-O 3.41Å; I440-Y485 PolarHBondContact N-O 2.99Å; Y441-Y485 HydrophobicContact CD2-CD1 4.2Å; Y441-Y485 HydrophobicContact CD2-CG 4.4Å; Y441-Y485 HydrophobicContact CG-CD1 4.45Å; Y443-Y485 HydrophobicContact CD2-CD1 4.04Å; Y443-Y485 AromaticContact CD2-CE1 3.98Å; Y443-Y485 HydrophobicContact CD2-CE1 3.98Å; Y443-Y485 HydrophobicContact CD2-CG 4.49Å; P482-Y485 HydrophobicContact CB-CD2 3.81Å; P482-Y485 HydrophobicContact CB-CE2 4.2Å; P482-Y485 HydrophobicContact CG-CD2 3.36Å; P482-Y485 HydrophobicContact CG-CE2 3.75Å; P482-Y485 HydrophobicContact CG-CG 3.88Å; P482-Y485 PolarHBondContact O-N 3.14Å; G483-Y485 VanDerWaalsContact C-N 3.31Å |
| 486 | V | 93.4 | Very high | 79 | Confident | 17 Ų | 17 | 87.8 Ų | 87.8 | 10% | 0.103 | 47% | 0.468 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.7 | 159.2 | -176.1 | -60.4 | 0 | 0 | 0 | 0 | 112.7 | V437 V438 F453 I459 F470 F481 G483 | V437-V486 HydrophobicContact CB-CB 3.92Å; V437-V486 HydrophobicContact CB-CG2 4.08Å; V437-V486 HydrophobicContact CG1-CG2 4.37Å; V437-V486 HydrophobicContact CG2-CB 3.73Å; V437-V486 HydrophobicContact CG2-CG1 3.86Å; V437-V486 HydrophobicContact CG2-CG2 3.89Å; V438-V486 CarbonylContact O-C 3.58Å; V438-V486 WeakPolarHBondContact O-CA 3.41Å; F453-V486 HydrophobicContact CZ-CG1 4.49Å; I459-V486 HydrophobicContact CD1-CG1 4.09Å; F470-V486 HydrophobicContact CD2-CG2 4.25Å; F470-V486 HydrophobicContact CE2-CG2 4.24Å; F481-V486 HydrophobicContact CD2-CG1 4.07Å; F481-V486 HydrophobicContact CE2-CB 4.4Å; F481-V486 HydrophobicContact CE2-CG1 3.57Å; F481-V486 HydrophobicContact CE2-CG2 3.88Å; F481-V486 HydrophobicContact CZ-CG1 4.48Å; G483-V486 WeakPolarHBondContact O-CG2 3.47Å |
| 487 | E | 92.6 | Very high | 78.7 | Confident | 127 Ų | 127 | 90.2 Ų | 90.2 | 59% | 0.593 | 47% | 0.469 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 141.1 | 173.2 | -173.7 | 171.5 | -151.6 | 0 | 0 | 110.5 | V437 V438 I440 | V437-E487 CarbonylContact C-O 3.49Å; V437-E487 VanDerWaalsContact CA-O 3.28Å; V437-E487 WeakPolarHBondContact CA-O 3.4Å; V437-E487 WeakPolarHBondContact CB-O 3.44Å; V438-E487 HydrophobicContact CG1-CB 4.38Å; V438-E487 PolarHBondContact N-O 2.94Å; V438-E487 PolarHBondContact O-N 3.01Å; I440-E487 HydrophobicContact CG2-CB 3.86Å |
| 488 | S | 89.2 | Confident | 78 | Confident | 58 Ų | 58 | 90.3 Ų | 90.3 | 41% | 0.406 | 47% | 0.465 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.9 | 131.5 | -178.9 | -55.8 | 0 | 0 | 0 | 0 | 112 | E435 M490 | E435-S488 VanDerWaalsContact OE2-CB 3.26Å; E435-S488 WeakPolarHBondContact OE2-CB 3.31Å; E435-S488 PolarHBondContact OE2-OG 2.65Å; S488-M490 PolarHBondContact O-N 3.37Å; S488-M490 VanDerWaalsContact O-N 3.14Å |
| 489 | I | 83 | Confident | 77.1 | Confident | 60 Ų | 60 | 90.8 Ų | 90.8 | 31% | 0.308 | 46% | 0.463 | S | S | . | . | trans | -76.6 | -0.9 | -173.8 | -62.4 | -179.8 | 0 | 0 | 0 | 113.1 | K436 V438 I458 H491 | K436-I489 HydrophobicContact CG-CD1 4.25Å; K436-I489 WeakPolarHBondContact O-CB 3.43Å; K436-I489 WeakPolarHBondContact O-CG1 3.48Å; K436-I489 PolarHBondContact O-N 3.39Å; V438-I489 HydrophobicContact CB-CD1 3.87Å; V438-I489 HydrophobicContact CB-CG1 3.91Å; V438-I489 HydrophobicContact CG1-CG1 4.09Å; I458-I489 HydrophobicContact CD1-CD1 3.55Å; I458-I489 HydrophobicContact CG2-CD1 4.3Å; I489-H491 VanDerWaalsContact C-N 3.31Å; I489-H491 PolarHBondContact O-N 3.35Å | ||
| 490 | M | 65.2 | Low | 75.9 | Confident | 143 Ų | 143 | 96.3 Ų | 96.3 | 70% | 0.704 | 49% | 0.488 | S | S | * | . | trans | -61.7 | 81.7 | -179.6 | -66.2 | -66.9 | -86.5 | 0 | 0 | 112.6 | S488 Y492 | S488-M490 PolarHBondContact O-N 3.37Å; S488-M490 VanDerWaalsContact O-N 3.14Å; M490-Y492 PolarHBondContact O-N 3.22Å | ||
| 491 | H | 43.5 | Very low | 74.6 | Confident | 181 Ų | 181 | 100.3 Ų | 100.3 | 84% | 0.838 | 51% | 0.507 | S | S | * | . | P | Polyproline II helix | trans | -64.4 | 131.9 | 174.9 | -100.8 | 52.1 | 0 | 0 | 0 | 110.9 | I489 A493 | I489-H491 VanDerWaalsContact C-N 3.31Å; I489-H491 PolarHBondContact O-N 3.35Å; H491-A493 PolarHBondContact O-N 2.93Å |
| 492 | Y | 38.5 | Very low | 72.9 | Confident | 227 Ų | 227 | 108 Ų | 108 | 89% | 0.89 | 55% | 0.547 | S | S | * | . | P | Polyproline II helix | trans | -57.2 | 130.4 | 166.5 | -66 | -87.2 | 0 | 0 | 0 | 110 | M490 | M490-Y492 PolarHBondContact O-N 3.22Š|
| 493 | A | 34.4 | Very low | 71.1 | Confident | 108 Ų | 108 | 116 Ų | 116 | 89% | 0.893 | 59% | 0.586 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 130.1 | 166 | 0 | 0 | 0 | 0 | 0 | 109.3 | H491 | H491-A493 PolarHBondContact O-N 2.93Š|
| 494 | E | 31.1 | Very low | 69.1 | Low | 269 Ų | 269 | 125.4 Ų | 125.4 | 100% | 1.257 | 63% | 0.627 | S | S | * | * | trans | -96.3 | 0 | 178.3 | -168.2 | 178.8 | -136.3 | 0 | 0 | 111.4 |
Retrieved 494 of 494 residues in 561.2 ms
(Link to these results)