| 1 | M | 71.7 | Confident | 89.6 | Confident | 195 Ų | 195 | 117.6 Ų | 117.6 | 96% | 0.961 | 59% | 0.588 | S | S | * | * | | | | 0 | -59.1 | 0 | -105.5 | -162.7 | -76.2 | 0 | 0 | 112.1 | E3 I4 M5 | M1-E3 PolarHBondContact O-N 3.42Å; M1-I4 WeakPolarHBondContact O-CB 3.45Å; M1-I4 PolarHBondContact O-N 2.68Å; M1-M5 PolarHBondContact O-N 3.48Å |
| 2 | L | 80.8 | Confident | 90.2 | Very high | 134 Ų | 134 | 115.3 Ų | 115.3 | 70% | 0.702 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -52.8 | -47.3 | -177 | -67.9 | 170.6 | 0 | 0 | 0 | 113.5 | I4 M5 E6 | L2-I4 VanDerWaalsContact C-N 3.26Å; L2-I4 PolarHBondContact O-N 2.71Å; L2-M5 HydrophobicContact CD2-CE 4.13Å; L2-M5 WeakPolarHBondContact O-CB 3.42Å; L2-M5 PolarHBondContact O-N 2.92Å; L2-E6 PolarHBondContact O-N 3.21Å |
| 3 | E | 85.1 | Confident | 90.8 | Very high | 163 Ų | 163 | 113.4 Ų | 113.4 | 76% | 0.762 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -59.9 | -32.5 | 177.5 | -60.6 | 162.8 | 126.7 | 0 | 0 | 113.8 | M1 M5 E6 S7 | M1-E3 PolarHBondContact O-N 3.42Å; E3-M5 VanDerWaalsContact C-N 3.34Å; E3-E6 PolarHBondContact O-N 3.25Å; E3-S7 WeakPolarHBondContact O-CB 3.48Å; E3-S7 PolarHBondContact O-N 3.02Å; E3-S7 PolarHBondContact O-OG 3.3Å |
| 4 | I | 89.5 | Confident | 91.3 | Very high | 121 Ų | 121 | 113.3 Ų | 113.3 | 62% | 0.621 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71 | -35.1 | 177.4 | -55.9 | 172.9 | 0 | 0 | 0 | 109.9 | M1 L2 S7 F8 | M1-I4 WeakPolarHBondContact O-CB 3.45Å; M1-I4 PolarHBondContact O-N 2.68Å; L2-I4 VanDerWaalsContact C-N 3.26Å; L2-I4 PolarHBondContact O-N 2.71Å; I4-S7 WeakPolarHBondContact CA-OG 3.39Å; I4-S7 PolarHBondContact O-OG 3.48Å; I4-F8 WeakPolarHBondContact O-CB 3.4Å; I4-F8 PolarHBondContact O-N 3.14Å |
| 5 | M | 89.9 | Confident | 91.7 | Very high | 104 Ų | 104 | 113.3 Ų | 113.3 | 51% | 0.512 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -74.4 | -36.4 | 175.5 | -171.4 | 166.5 | 61.9 | 0 | 0 | 111.9 | M1 L2 E3 F8 K9 | M1-M5 PolarHBondContact O-N 3.48Å; L2-M5 HydrophobicContact CD2-CE 4.13Å; L2-M5 WeakPolarHBondContact O-CB 3.42Å; L2-M5 PolarHBondContact O-N 2.92Å; E3-M5 VanDerWaalsContact C-N 3.34Å; M5-F8 PolarHBondContact O-N 3.48Å; M5-K9 WeakPolarHBondContact O-CG 3.23Å; M5-K9 PolarHBondContact O-N 3.03Å; M5-K9 VanDerWaalsContact O-N 3.14Å |
| 6 | E | 91.1 | Very high | 92.1 | Very high | 92 Ų | 92 | 113.4 Ų | 113.4 | 43% | 0.43 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -71.1 | -46.4 | 177.4 | -140.1 | 62.3 | -150.8 | 0 | 0 | 111.7 | L2 E3 F8 K9 D10 | L2-E6 PolarHBondContact O-N 3.21Å; E3-E6 PolarHBondContact O-N 3.25Å; E6-F8 PolarHBondContact O-N 3.23Å; E6-K9 WeakPolarHBondContact O-CB 3.44Å; E6-K9 PolarHBondContact O-N 3.22Å; E6-K9 VanDerWaalsContact OE1-CD 3.25Å; E6-K9 WeakPolarHBondContact OE1-CD 3.18Å; E6-K9 IonicContact OE1-NZ 2.71Å; E6-K9 PolarHBondContact OE1-NZ 2.95Å; E6-K9 IonicContact OE2-NZ 2.68Å; E6-K9 PolarHBondContact OE2-NZ 3.19Å; E6-D10 WeakPolarHBondContact O-CB 3.25Å; E6-D10 PolarHBondContact O-N 3.32Å |
| 7 | S | 93.1 | Very high | 92.5 | Very high | 70 Ų | 70 | 110.6 Ų | 110.6 | 49% | 0.49 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.4 | -28.9 | 174.1 | 52 | 0 | 0 | 0 | 0 | 113.3 | E3 I4 D10 L11 | E3-S7 WeakPolarHBondContact O-CB 3.48Å; E3-S7 PolarHBondContact O-N 3.02Å; E3-S7 PolarHBondContact O-OG 3.3Å; I4-S7 WeakPolarHBondContact CA-OG 3.39Å; I4-S7 PolarHBondContact O-OG 3.48Å; S7-D10 WeakPolarHBondContact O-CB 3.37Å; S7-L11 PolarHBondContact O-N 2.83Å; S7-L11 VanDerWaalsContact O-N 3.14Å |
| 8 | F | 95.8 | Very high | 92.8 | Very high | 123 Ų | 123 | 106.3 Ų | 106.3 | 54% | 0.539 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -70.8 | -42.1 | 171 | 179.3 | -107.1 | 0 | 0 | 0 | 113.1 | I4 M5 E6 L11 L12 | I4-F8 WeakPolarHBondContact O-CB 3.4Å; I4-F8 PolarHBondContact O-N 3.14Å; M5-F8 PolarHBondContact O-N 3.48Å; E6-F8 PolarHBondContact O-N 3.23Å; F8-L11 PolarHBondContact O-N 3.08Å; F8-L12 HydrophobicContact CD1-CD1 4.13Å; F8-L12 HydrophobicContact CE1-CD1 3.57Å; F8-L12 HydrophobicContact CE1-CG 4.3Å; F8-L12 HydrophobicContact CZ-CD1 3.84Å; F8-L12 HydrophobicContact CZ-CD2 4.39Å; F8-L12 HydrophobicContact CZ-CG 4.21Å; F8-L12 PolarHBondContact O-N 3.28Å; F8-L12 VanDerWaalsContact O-N 3.1Å |
| 9 | K | 95.7 | Very high | 93.1 | Very high | 100 Ų | 100 | 107.1 Ų | 107.1 | 44% | 0.435 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.2 | -46.4 | 171.7 | -67.4 | 166.8 | 179.4 | 167.8 | 0 | 111.1 | M5 E6 L11 L12 Q13 | M5-K9 WeakPolarHBondContact O-CG 3.23Å; M5-K9 PolarHBondContact O-N 3.03Å; M5-K9 VanDerWaalsContact O-N 3.14Å; E6-K9 WeakPolarHBondContact O-CB 3.44Å; E6-K9 PolarHBondContact O-N 3.22Å; E6-K9 VanDerWaalsContact OE1-CD 3.25Å; E6-K9 WeakPolarHBondContact OE1-CD 3.18Å; E6-K9 IonicContact OE1-NZ 2.71Å; E6-K9 PolarHBondContact OE1-NZ 2.95Å; E6-K9 IonicContact OE2-NZ 2.68Å; E6-K9 PolarHBondContact OE2-NZ 3.19Å; K9-L11 PolarHBondContact O-N 3.1Å; K9-L12 PolarHBondContact O-N 3.31Å; K9-L12 VanDerWaalsContact O-N 3.08Å; K9-Q13 WeakPolarHBondContact O-CB 3.44Å; K9-Q13 PolarHBondContact O-N 2.91Å |
| 10 | D | 96 | Very high | 93.3 | Very high | 78 Ų | 78 | 107 Ų | 107 | 42% | 0.417 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -53.1 | -41.7 | 176.6 | -107.2 | 34.9 | 0 | 0 | 0 | 112.2 | E6 S7 K14 | E6-D10 WeakPolarHBondContact O-CB 3.25Å; E6-D10 PolarHBondContact O-N 3.32Å; S7-D10 WeakPolarHBondContact O-CB 3.37Å; D10-K14 WeakPolarHBondContact O-CB 3.37Å; D10-K14 VanDerWaalsContact O-CD 3.23Å; D10-K14 WeakPolarHBondContact O-CD 3.5Å; D10-K14 WeakPolarHBondContact O-CG 3.44Å; D10-K14 PolarHBondContact O-N 2.87Å; D10-K14 IonicContact OD2-NZ 3.95Å; D10-K14 PolarHBondContact OD2-NZ 3.3Å |
| 11 | L | 96.8 | Very high | 93.6 | Very high | 114 Ų | 114 | 107.8 Ų | 107.8 | 60% | 0.597 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -68.9 | -41.8 | 177.4 | -178 | 61.5 | 0 | 0 | 0 | 111.9 | S7 F8 K9 L15 | S7-L11 PolarHBondContact O-N 2.83Å; S7-L11 VanDerWaalsContact O-N 3.14Å; F8-L11 PolarHBondContact O-N 3.08Å; K9-L11 PolarHBondContact O-N 3.1Å; L11-L15 WeakPolarHBondContact O-CB 3.5Å; L11-L15 PolarHBondContact O-N 2.69Å |
| 12 | L | 97.2 | Very high | 94.9 | Very high | 89 Ų | 89 | 104.5 Ų | 104.5 | 47% | 0.466 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.5 | -42.4 | 175 | -69.4 | 176.8 | 0 | 0 | 0 | 112.1 | F8 K9 L15 Q16 | F8-L12 HydrophobicContact CD1-CD1 4.13Å; F8-L12 HydrophobicContact CE1-CD1 3.57Å; F8-L12 HydrophobicContact CE1-CG 4.3Å; F8-L12 HydrophobicContact CZ-CD1 3.84Å; F8-L12 HydrophobicContact CZ-CD2 4.39Å; F8-L12 HydrophobicContact CZ-CG 4.21Å; F8-L12 PolarHBondContact O-N 3.28Å; F8-L12 VanDerWaalsContact O-N 3.1Å; K9-L12 PolarHBondContact O-N 3.31Å; K9-L12 VanDerWaalsContact O-N 3.08Å; L12-L15 PolarHBondContact O-N 3.14Å; L12-Q16 PolarHBondContact O-N 3Å |
| 13 | Q | 97.6 | Very high | 95.7 | Very high | 91 Ų | 91 | 100.4 Ų | 100.4 | 43% | 0.425 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.8 | -48.7 | 176.4 | 178.1 | 59.2 | 34 | 0 | 0 | 111 | K9 L15 Q16 E17 | K9-Q13 WeakPolarHBondContact O-CB 3.44Å; K9-Q13 PolarHBondContact O-N 2.91Å; Q13-L15 VanDerWaalsContact C-N 3.27Å; Q13-L15 PolarHBondContact O-N 3.06Å; Q13-Q16 PolarHBondContact O-N 3.23Å; Q13-E17 PolarHBondContact NE2-OE1 2.86Å; Q13-E17 WeakPolarHBondContact O-CG 3.35Å; Q13-E17 PolarHBondContact O-N 2.93Å |
| 14 | K | 97.8 | Very high | 96.3 | Very high | 112 Ų | 112 | 98 Ų | 98 | 49% | 0.487 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.4 | -34.6 | 176.5 | -71.9 | 159.9 | -164.1 | 155.6 | 0 | 112.4 | D10 A18 | D10-K14 WeakPolarHBondContact O-CB 3.37Å; D10-K14 VanDerWaalsContact O-CD 3.23Å; D10-K14 WeakPolarHBondContact O-CD 3.5Å; D10-K14 WeakPolarHBondContact O-CG 3.44Å; D10-K14 PolarHBondContact O-N 2.87Å; D10-K14 IonicContact OD2-NZ 3.95Å; D10-K14 PolarHBondContact OD2-NZ 3.3Å; K14-A18 VanDerWaalsContact O-CB 3.29Å; K14-A18 WeakPolarHBondContact O-CB 3.29Å; K14-A18 PolarHBondContact O-N 3.19Å |
| 15 | L | 98.1 | Very high | 96.8 | Very high | 113 Ų | 113 | 97.2 Ų | 97.2 | 59% | 0.592 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -69.8 | -43.3 | 174.3 | 179.1 | 62.5 | 0 | 0 | 0 | 112.2 | L11 L12 Q13 A18 H19 | L11-L15 WeakPolarHBondContact O-CB 3.5Å; L11-L15 PolarHBondContact O-N 2.69Å; L12-L15 PolarHBondContact O-N 3.14Å; Q13-L15 VanDerWaalsContact C-N 3.27Å; Q13-L15 PolarHBondContact O-N 3.06Å; L15-A18 PolarHBondContact O-N 3.42Å; L15-H19 WeakPolarHBondContact O-CB 3.41Å; L15-H19 PolarHBondContact O-N 2.85Å |
| 16 | Q | 97.9 | Very high | 97.2 | Very high | 115 Ų | 115 | 97.7 Ų | 97.7 | 54% | 0.537 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -58.9 | -50.9 | 174.9 | 177.1 | 178.2 | -34.1 | 0 | 0 | 110.7 | L12 Q13 A18 H19 E20 | L12-Q16 PolarHBondContact O-N 3Å; Q13-Q16 PolarHBondContact O-N 3.23Å; Q16-A18 VanDerWaalsContact C-N 3.31Å; Q16-A18 PolarHBondContact O-N 2.88Å; Q16-H19 PolarHBondContact O-N 3.29Å; Q16-E20 WeakPolarHBondContact O-CB 3.43Å; Q16-E20 PolarHBondContact O-N 2.99Å |
| 17 | E | 98.1 | Very high | 97.5 | Very high | 66 Ų | 66 | 99.4 Ų | 99.4 | 31% | 0.308 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.7 | -33.8 | 178.9 | -65.2 | 171 | -159.2 | 0 | 0 | 113.1 | Q13 R21 | Q13-E17 PolarHBondContact NE2-OE1 2.86Å; Q13-E17 WeakPolarHBondContact O-CG 3.35Å; Q13-E17 PolarHBondContact O-N 2.93Å; E17-R21 WeakPolarHBondContact O-CB 3.3Å; E17-R21 VanDerWaalsContact O-CG 3.26Å; E17-R21 WeakPolarHBondContact O-CG 3.35Å; E17-R21 PolarHBondContact O-N 2.99Å; E17-R21 PolarHBondContact O-NE 2.77Å; E17-R21 VanDerWaalsContact O-NE 3.17Å; E17-R21 IonicContact OE2-CZ 2.77Å; E17-R21 IonicContact OE2-NH1 3.83Å; E17-R21 PolarHBondContact OE2-NH1 2.98Å; E17-R21 IonicContact OE2-NH2 3.89Å |
| 18 | A | 98.1 | Very high | 97.8 | Very high | 34 Ų | 34 | 100.7 Ų | 100.7 | 28% | 0.281 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.4 | -45.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | K14 L15 Q16 E22 | K14-A18 VanDerWaalsContact O-CB 3.29Å; K14-A18 WeakPolarHBondContact O-CB 3.29Å; K14-A18 PolarHBondContact O-N 3.19Å; L15-A18 PolarHBondContact O-N 3.42Å; Q16-A18 VanDerWaalsContact C-N 3.31Å; Q16-A18 PolarHBondContact O-N 2.88Å; A18-E22 WeakPolarHBondContact O-CG 3.26Å; A18-E22 PolarHBondContact O-N 3.17Å |
| 19 | H | 98.4 | Very high | 97.9 | Very high | 120 Ų | 120 | 99.3 Ų | 99.3 | 56% | 0.556 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.6 | -43.3 | 175 | -178.3 | 57.1 | 0 | 0 | 0 | 112.3 | L15 Q16 E22 V23 | L15-H19 WeakPolarHBondContact O-CB 3.41Å; L15-H19 PolarHBondContact O-N 2.85Å; Q16-H19 PolarHBondContact O-N 3.29Å; H19-E22 PolarHBondContact O-N 2.87Å; H19-V23 WeakPolarHBondContact O-CB 3.39Å; H19-V23 VanDerWaalsContact O-CG2 3.29Å; H19-V23 WeakPolarHBondContact O-CG2 3.42Å; H19-V23 PolarHBondContact O-N 3.22Å |
| 20 | E | 98.3 | Very high | 98.1 | Very high | 105 Ų | 105 | 99.3 Ų | 99.3 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.9 | -47.6 | 178.6 | -170 | 160.2 | -149 | 0 | 0 | 111.4 | Q16 E22 V23 E24 | Q16-E20 WeakPolarHBondContact O-CB 3.43Å; Q16-E20 PolarHBondContact O-N 2.99Å; E20-E22 PolarHBondContact O-N 3.39Å; E20-V23 PolarHBondContact O-N 3.34Å; E20-E24 WeakPolarHBondContact O-CG 3.4Å; E20-E24 PolarHBondContact O-N 3.03Å |
| 21 | R | 98.4 | Very high | 98.2 | Very high | 124 Ų | 124 | 102.8 Ų | 102.8 | 47% | 0.468 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.2 | -40.6 | 173.9 | -72.1 | 178.7 | -66.2 | -110.7 | -1.7 | 112.9 | E17 V25 | E17-R21 WeakPolarHBondContact O-CB 3.3Å; E17-R21 VanDerWaalsContact O-CG 3.26Å; E17-R21 WeakPolarHBondContact O-CG 3.35Å; E17-R21 PolarHBondContact O-N 2.99Å; E17-R21 PolarHBondContact O-NE 2.77Å; E17-R21 VanDerWaalsContact O-NE 3.17Å; E17-R21 IonicContact OE2-CZ 2.77Å; E17-R21 IonicContact OE2-NH1 3.83Å; E17-R21 PolarHBondContact OE2-NH1 2.98Å; E17-R21 IonicContact OE2-NH2 3.89Å; R21-V25 VanDerWaalsContact O-CG2 3.31Å; R21-V25 WeakPolarHBondContact O-CG2 3.47Å; R21-V25 PolarHBondContact O-N 2.97Å |
| 22 | E | 98.4 | Very high | 98.3 | Very high | 127 Ų | 127 | 102 Ų | 102 | 59% | 0.593 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.6 | -41 | 175.1 | -76.8 | -179.3 | -175 | 0 | 0 | 112 | A18 H19 E20 V25 L26 | A18-E22 WeakPolarHBondContact O-CG 3.26Å; A18-E22 PolarHBondContact O-N 3.17Å; H19-E22 PolarHBondContact O-N 2.87Å; E20-E22 PolarHBondContact O-N 3.39Å; E22-V25 PolarHBondContact O-N 3.03Å; E22-L26 WeakPolarHBondContact O-CB 3.44Å; E22-L26 VanDerWaalsContact O-CG 3.28Å; E22-L26 WeakPolarHBondContact O-CG 3.29Å; E22-L26 PolarHBondContact O-N 3.29Å |
| 23 | V | 98.6 | Very high | 98.3 | Very high | 48 Ų | 48 | 102.5 Ų | 102.5 | 29% | 0.291 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 175.9 | 166 | 0 | 0 | 0 | 0 | 111.3 | H19 E20 L26 Q27 | H19-V23 WeakPolarHBondContact O-CB 3.39Å; H19-V23 VanDerWaalsContact O-CG2 3.29Å; H19-V23 WeakPolarHBondContact O-CG2 3.42Å; H19-V23 PolarHBondContact O-N 3.22Å; E20-V23 PolarHBondContact O-N 3.34Å; V23-L26 PolarHBondContact O-N 3.39Å; V23-Q27 HydrophobicContact CG1-CG 4.43Å; V23-Q27 VanDerWaalsContact CG1-NE2 3.34Å; V23-Q27 WeakPolarHBondContact O-CB 3.28Å; V23-Q27 VanDerWaalsContact O-CG 3.3Å; V23-Q27 WeakPolarHBondContact O-CG 3.37Å; V23-Q27 PolarHBondContact O-N 3.23Å |
| 24 | E | 98.4 | Very high | 98.4 | Very high | 113 Ų | 113 | 101.8 Ų | 101.8 | 53% | 0.528 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.8 | -48.7 | 173.4 | -73.4 | -176 | 143.6 | 0 | 0 | 111.9 | E20 L26 Q27 V28 | E20-E24 WeakPolarHBondContact O-CG 3.4Å; E20-E24 PolarHBondContact O-N 3.03Å; E24-L26 VanDerWaalsContact C-N 3.32Å; E24-L26 PolarHBondContact O-N 3.44Å; E24-Q27 PolarHBondContact O-N 2.86Å; E24-V28 WeakPolarHBondContact O-CG2 3.31Å; E24-V28 PolarHBondContact O-N 2.93Å |
| 25 | V | 98.4 | Very high | 98.4 | Very high | 103 Ų | 103 | 101.2 Ų | 101.2 | 62% | 0.624 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60 | -41.9 | 178 | 168.2 | 0 | 0 | 0 | 0 | 111.2 | R21 E22 K29 | R21-V25 VanDerWaalsContact O-CG2 3.31Å; R21-V25 WeakPolarHBondContact O-CG2 3.47Å; R21-V25 PolarHBondContact O-N 2.97Å; E22-V25 PolarHBondContact O-N 3.03Å; V25-K29 WeakPolarHBondContact O-CB 3.34Å; V25-K29 PolarHBondContact O-N 3.39Å |
| 26 | L | 98.6 | Very high | 98.4 | Very high | 114 Ų | 114 | 101.1 Ų | 101.1 | 60% | 0.597 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.9 | -42 | 175.8 | -71.9 | 171.2 | 0 | 0 | 0 | 112.2 | E22 V23 E24 K29 V30 | E22-L26 WeakPolarHBondContact O-CB 3.44Å; E22-L26 VanDerWaalsContact O-CG 3.28Å; E22-L26 WeakPolarHBondContact O-CG 3.29Å; E22-L26 PolarHBondContact O-N 3.29Å; V23-L26 PolarHBondContact O-N 3.39Å; E24-L26 VanDerWaalsContact C-N 3.32Å; E24-L26 PolarHBondContact O-N 3.44Å; L26-K29 PolarHBondContact O-N 2.86Å; L26-V30 WeakPolarHBondContact O-CG2 3.4Å; L26-V30 PolarHBondContact O-N 3.22Å |
| 27 | Q | 98.6 | Very high | 98.5 | Very high | 129 Ų | 129 | 103 Ų | 103 | 60% | 0.603 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.2 | -45.8 | 175.1 | -74.8 | -178.4 | 35.6 | 0 | 0 | 111.8 | V23 E24 K29 V30 K31 | V23-Q27 HydrophobicContact CG1-CG 4.43Å; V23-Q27 VanDerWaalsContact CG1-NE2 3.34Å; V23-Q27 WeakPolarHBondContact O-CB 3.28Å; V23-Q27 VanDerWaalsContact O-CG 3.3Å; V23-Q27 WeakPolarHBondContact O-CG 3.37Å; V23-Q27 PolarHBondContact O-N 3.23Å; E24-Q27 PolarHBondContact O-N 2.86Å; Q27-K29 VanDerWaalsContact C-N 3.31Å; Q27-K29 PolarHBondContact O-N 3.34Å; Q27-V30 PolarHBondContact O-N 3.4Å; Q27-K31 WeakPolarHBondContact O-CB 3.44Å; Q27-K31 PolarHBondContact O-N 2.89Å |
| 28 | V | 98.6 | Very high | 98.5 | Very high | 97 Ų | 97 | 101.4 Ų | 101.4 | 59% | 0.588 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.1 | -43.7 | 174.4 | 170.8 | 0 | 0 | 0 | 0 | 110.4 | E24 K31 E32 | E24-V28 WeakPolarHBondContact O-CG2 3.31Å; E24-V28 PolarHBondContact O-N 2.93Å; V28-K31 PolarHBondContact O-N 3.05Å; V28-E32 WeakPolarHBondContact O-CB 3.41Å; V28-E32 PolarHBondContact O-N 3.44Å |
| 29 | K | 98.7 | Very high | 98.5 | Very high | 93 Ų | 93 | 103.6 Ų | 103.6 | 40% | 0.404 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.4 | -37.8 | -179.6 | -164.7 | 51.1 | 160.3 | -177.6 | 0 | 113.2 | V25 L26 Q27 K31 E32 L33 | V25-K29 WeakPolarHBondContact O-CB 3.34Å; V25-K29 PolarHBondContact O-N 3.39Å; L26-K29 PolarHBondContact O-N 2.86Å; Q27-K29 VanDerWaalsContact C-N 3.31Å; Q27-K29 PolarHBondContact O-N 3.34Å; K29-K31 VanDerWaalsContact C-N 3.33Å; K29-E32 HydrophobicContact CD-CB 4.42Å; K29-E32 WeakPolarHBondContact CD-OE2 3.39Å; K29-E32 IonicContact NZ-OE1 2.83Å; K29-E32 PolarHBondContact NZ-OE1 2.98Å; K29-E32 IonicContact NZ-OE2 3.08Å; K29-E32 PolarHBondContact NZ-OE2 3.37Å; K29-E32 PolarHBondContact O-N 3.01Å; K29-L33 HydrophobicContact CD-CG 4.45Å; K29-L33 HydrophobicContact CG-CD1 4.21Å; K29-L33 WeakPolarHBondContact O-CB 3.25Å; K29-L33 VanDerWaalsContact O-CG 3.26Å; K29-L33 WeakPolarHBondContact O-CG 3.26Å; K29-L33 PolarHBondContact O-N 3.47Å |
| 30 | V | 98.7 | Very high | 98.5 | Very high | 101 Ų | 101 | 100.8 Ų | 100.8 | 61% | 0.612 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.2 | -41.8 | 172.1 | 168.8 | 0 | 0 | 0 | 0 | 110.8 | L26 Q27 L33 S34 | L26-V30 WeakPolarHBondContact O-CG2 3.4Å; L26-V30 PolarHBondContact O-N 3.22Å; Q27-V30 PolarHBondContact O-N 3.4Å; V30-L33 PolarHBondContact O-N 2.96Å; V30-S34 VanDerWaalsContact O-CB 3.25Å; V30-S34 WeakPolarHBondContact O-CB 3.21Å; V30-S34 PolarHBondContact O-N 3.45Å |
| 31 | K | 98.5 | Very high | 98.5 | Very high | 150 Ų | 150 | 99.6 Ų | 99.6 | 65% | 0.652 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.7 | -43.3 | 176.1 | -171 | 174.9 | -177.8 | 176.3 | 0 | 112.2 | Q27 V28 K29 S34 N35 | Q27-K31 WeakPolarHBondContact O-CB 3.44Å; Q27-K31 PolarHBondContact O-N 2.89Å; V28-K31 PolarHBondContact O-N 3.05Å; K29-K31 VanDerWaalsContact C-N 3.33Å; K31-S34 PolarHBondContact O-N 2.88Å; K31-N35 WeakPolarHBondContact O-CB 3.48Å; K31-N35 VanDerWaalsContact O-CG 3.24Å; K31-N35 PolarHBondContact O-N 3.01Å; K31-N35 PolarHBondContact O-ND2 2.89Å |
| 32 | E | 98.5 | Very high | 98.5 | Very high | 98 Ų | 98 | 100.3 Ų | 100.3 | 46% | 0.458 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.8 | -49.9 | 174.6 | -170.6 | -152.7 | 123.4 | 0 | 0 | 111.6 | V28 K29 S34 N35 K36 | V28-E32 WeakPolarHBondContact O-CB 3.41Å; V28-E32 PolarHBondContact O-N 3.44Å; K29-E32 HydrophobicContact CD-CB 4.42Å; K29-E32 WeakPolarHBondContact CD-OE2 3.39Å; K29-E32 IonicContact NZ-OE1 2.83Å; K29-E32 PolarHBondContact NZ-OE1 2.98Å; K29-E32 IonicContact NZ-OE2 3.08Å; K29-E32 PolarHBondContact NZ-OE2 3.37Å; K29-E32 PolarHBondContact O-N 3.01Å; E32-S34 PolarHBondContact O-N 3.48Å; E32-N35 PolarHBondContact O-N 3.49Å; E32-K36 WeakPolarHBondContact O-CB 3.45Å; E32-K36 PolarHBondContact O-N 3.35Å |
| 33 | L | 98.6 | Very high | 98.5 | Very high | 100 Ų | 100 | 101.9 Ų | 101.9 | 52% | 0.524 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.6 | -37.1 | 179.3 | -70 | 172.2 | 0 | 0 | 0 | 112.3 | K29 V30 K36 K37 | K29-L33 HydrophobicContact CD-CG 4.45Å; K29-L33 HydrophobicContact CG-CD1 4.21Å; K29-L33 WeakPolarHBondContact O-CB 3.25Å; K29-L33 VanDerWaalsContact O-CG 3.26Å; K29-L33 WeakPolarHBondContact O-CG 3.26Å; K29-L33 PolarHBondContact O-N 3.47Å; V30-L33 PolarHBondContact O-N 2.96Å; L33-K36 PolarHBondContact O-N 3.48Å; L33-K37 WeakPolarHBondContact O-CB 3.46Å; L33-K37 PolarHBondContact O-N 2.95Å |
| 34 | S | 98.5 | Very high | 98.5 | Very high | 75 Ų | 75 | 105.1 Ų | 105.1 | 52% | 0.524 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.9 | -47 | 174.4 | -171.4 | 0 | 0 | 0 | 0 | 111.7 | V30 K31 E32 K36 K37 G38 | V30-S34 VanDerWaalsContact O-CB 3.25Å; V30-S34 WeakPolarHBondContact O-CB 3.21Å; V30-S34 PolarHBondContact O-N 3.45Å; K31-S34 PolarHBondContact O-N 2.88Å; E32-S34 PolarHBondContact O-N 3.48Å; S34-K36 PolarHBondContact O-N 2.93Å; S34-K37 PolarHBondContact O-N 3.4Å; S34-G38 PolarHBondContact O-N 3.44Å |
| 35 | N | 98.6 | Very high | 98.5 | Very high | 101 Ų | 101 | 105.6 Ų | 105.6 | 54% | 0.54 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60 | -45.6 | 174.7 | -72.8 | -14 | 0 | 0 | 0 | 111.5 | K31 E32 G38 C39 | K31-N35 WeakPolarHBondContact O-CB 3.48Å; K31-N35 VanDerWaalsContact O-CG 3.24Å; K31-N35 PolarHBondContact O-N 3.01Å; K31-N35 PolarHBondContact O-ND2 2.89Å; E32-N35 PolarHBondContact O-N 3.49Å; N35-G38 PolarHBondContact O-N 3.13Å; N35-C39 PolarHBondContact O-N 2.9Å; N35-C39 PolarHBondContact O-SG 2.68Å |
| 36 | K | 98.4 | Very high | 98.6 | Very high | 111 Ų | 111 | 106.8 Ų | 106.8 | 48% | 0.483 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.4 | -46.4 | 178.1 | 178.3 | 51.6 | 175.7 | 146 | 0 | 111.7 | E32 L33 S34 G38 C39 D40 | E32-K36 WeakPolarHBondContact O-CB 3.45Å; E32-K36 PolarHBondContact O-N 3.35Å; L33-K36 PolarHBondContact O-N 3.48Å; S34-K36 PolarHBondContact O-N 2.93Å; K36-G38 VanDerWaalsContact C-N 3.31Å; K36-G38 PolarHBondContact O-N 3.38Å; K36-C39 PolarHBondContact O-N 3.13Å; K36-D40 WeakPolarHBondContact CD-OD2 3.32Å; K36-D40 WeakPolarHBondContact CE-OD2 3.43Å; K36-D40 IonicContact NZ-OD1 2.8Å; K36-D40 PolarHBondContact NZ-OD1 3Å; K36-D40 IonicContact NZ-OD2 2.69Å; K36-D40 PolarHBondContact NZ-OD2 3.48Å; K36-D40 PolarHBondContact O-N 3.47Å |
| 37 | K | 98.5 | Very high | 98.6 | Very high | 153 Ų | 153 | 106 Ų | 106 | 67% | 0.665 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -55.1 | -46 | 172.8 | -179.7 | -176.9 | 176 | -176.1 | 0 | 111.3 | L33 S34 C39 D40 T41 | L33-K37 WeakPolarHBondContact O-CB 3.46Å; L33-K37 PolarHBondContact O-N 2.95Å; S34-K37 PolarHBondContact O-N 3.4Å; K37-C39 PolarHBondContact O-N 3.12Å; K37-D40 PolarHBondContact O-N 3.4Å; K37-T41 PolarHBondContact O-N 2.88Å; K37-T41 PolarHBondContact O-OG1 3.46Å; K37-T41 VanDerWaalsContact O-OG1 3.04Å |
| 38 | G | 98.4 | Very high | 98.6 | Very high | 33 Ų | 33 | 106.5 Ų | 106.5 | 34% | 0.34 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.8 | -42.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | S34 N35 K36 T41 K42 | S34-G38 PolarHBondContact O-N 3.44Å; N35-G38 PolarHBondContact O-N 3.13Å; K36-G38 VanDerWaalsContact C-N 3.31Å; K36-G38 PolarHBondContact O-N 3.38Å; G38-T41 PolarHBondContact O-N 3.04Å; G38-K42 WeakPolarHBondContact O-CG 3.41Å; G38-K42 PolarHBondContact O-N 2.88Å; G38-K42 VanDerWaalsContact O-N 3.13Å |
| 39 | C | 98.3 | Very high | 98.6 | Very high | 80 Ų | 80 | 105.4 Ų | 105.4 | 54% | 0.541 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.6 | -41.3 | 174.3 | -67.6 | 0 | 0 | 0 | 0 | 112.5 | N35 K36 K37 K42 R43 | N35-C39 PolarHBondContact O-N 2.9Å; N35-C39 PolarHBondContact O-SG 2.68Å; K36-C39 PolarHBondContact O-N 3.13Å; K37-C39 PolarHBondContact O-N 3.12Å; C39-K42 PolarHBondContact O-N 3.44Å; C39-R43 WeakPolarHBondContact O-CB 3.47Å; C39-R43 PolarHBondContact O-N 3.01Å |
| 40 | D | 98.5 | Very high | 98.6 | Very high | 62 Ų | 62 | 109.2 Ų | 109.2 | 33% | 0.332 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -71.1 | -31.6 | 179 | -69.4 | -34.5 | 0 | 0 | 0 | 112.5 | K36 K37 M44 | K36-D40 WeakPolarHBondContact CD-OD2 3.32Å; K36-D40 WeakPolarHBondContact CE-OD2 3.43Å; K36-D40 IonicContact NZ-OD1 2.8Å; K36-D40 PolarHBondContact NZ-OD1 3Å; K36-D40 IonicContact NZ-OD2 2.69Å; K36-D40 PolarHBondContact NZ-OD2 3.48Å; K36-D40 PolarHBondContact O-N 3.47Å; K37-D40 PolarHBondContact O-N 3.4Å; D40-M44 WeakPolarHBondContact O-CB 3.44Å; D40-M44 PolarHBondContact O-N 2.96Å |
| 41 | T | 98.6 | Very high | 98.6 | Very high | 80 Ų | 80 | 107.4 Ų | 107.4 | 49% | 0.491 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.1 | -47.5 | 169.6 | -58.9 | 0 | 0 | 0 | 0 | 111.6 | K37 G38 R43 M44 E45 | K37-T41 PolarHBondContact O-N 2.88Å; K37-T41 PolarHBondContact O-OG1 3.46Å; K37-T41 VanDerWaalsContact O-OG1 3.04Å; G38-T41 PolarHBondContact O-N 3.04Å; T41-R43 PolarHBondContact O-N 3.4Å; T41-M44 WeakPolarHBondContact O-CB 3.49Å; T41-M44 PolarHBondContact O-N 3.21Å; T41-M44 VanDerWaalsContact O-N 3.13Å; T41-E45 PolarHBondContact O-N 3.24Å |
| 42 | K | 98.6 | Very high | 98.6 | Very high | 138 Ų | 138 | 105.8 Ų | 105.8 | 60% | 0.6 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.7 | -46.5 | 176.4 | -71.4 | 178.6 | 179 | -175.3 | 0 | 112.1 | G38 C39 M44 E45 E46 | G38-K42 WeakPolarHBondContact O-CG 3.41Å; G38-K42 PolarHBondContact O-N 2.88Å; G38-K42 VanDerWaalsContact O-N 3.13Å; C39-K42 PolarHBondContact O-N 3.44Å; K42-M44 PolarHBondContact O-N 3.2Å; K42-E45 WeakPolarHBondContact O-CB 3.36Å; K42-E45 PolarHBondContact O-N 3.03Å; K42-E45 VanDerWaalsContact O-N 3.11Å; K42-E46 WeakPolarHBondContact O-CG 3.24Å; K42-E46 PolarHBondContact O-N 3.03Å |
| 43 | R | 98.8 | Very high | 98.6 | Very high | 161 Ų | 161 | 107.2 Ų | 107.2 | 61% | 0.608 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.3 | -33.5 | 175.7 | -177.2 | 175 | 177.3 | -106 | -2.5 | 112.5 | C39 T41 L47 | C39-R43 WeakPolarHBondContact O-CB 3.47Å; C39-R43 PolarHBondContact O-N 3.01Å; T41-R43 PolarHBondContact O-N 3.4Å; R43-L47 VanDerWaalsContact O-CG 3.29Å; R43-L47 WeakPolarHBondContact O-CG 3.42Å; R43-L47 PolarHBondContact O-N 3.05Å |
| 44 | M | 98.6 | Very high | 98.6 | Very high | 115 Ų | 115 | 108 Ų | 108 | 57% | 0.567 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -71.6 | -40.6 | 175.4 | -171.8 | 178 | -69.1 | 0 | 0 | 111.9 | D40 T41 K42 L47 F48 | D40-M44 WeakPolarHBondContact O-CB 3.44Å; D40-M44 PolarHBondContact O-N 2.96Å; T41-M44 WeakPolarHBondContact O-CB 3.49Å; T41-M44 PolarHBondContact O-N 3.21Å; T41-M44 VanDerWaalsContact O-N 3.13Å; K42-M44 PolarHBondContact O-N 3.2Å; M44-L47 PolarHBondContact O-N 2.69Å; M44-F48 HydrophobicContact CG-CD2 3.84Å; M44-F48 HydrophobicContact CG-CE2 3.57Å; M44-F48 VanDerWaalsContact O-CD2 3.24Å; M44-F48 WeakPolarHBondContact O-CD2 3.01Å; M44-F48 PolarHBondContact O-N 2.87Å; M44-F48 HydrophobicContact SD-CE2 4Å |
| 45 | E | 98.6 | Very high | 98.6 | Very high | 124 Ų | 124 | 109.7 Ų | 109.7 | 58% | 0.579 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.9 | -42 | 175.4 | -173.4 | 175.2 | -167.7 | 0 | 0 | 112.5 | T41 K42 L47 F48 T49 | T41-E45 PolarHBondContact O-N 3.24Å; K42-E45 WeakPolarHBondContact O-CB 3.36Å; K42-E45 PolarHBondContact O-N 3.03Å; K42-E45 VanDerWaalsContact O-N 3.11Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 3.42Å; E45-F48 PolarHBondContact O-N 3.3Å; E45-T49 WeakPolarHBondContact O-CG2 3.25Å; E45-T49 PolarHBondContact O-N 3.48Å; E45-T49 PolarHBondContact O-OG1 2.94Å |
| 46 | E | 98.7 | Very high | 98.6 | Very high | 127 Ų | 127 | 108.2 Ų | 108.2 | 59% | 0.593 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.1 | -40.7 | 171.7 | -72.1 | 168.6 | -164.9 | 0 | 0 | 112.3 | K42 T49 R50 | K42-E46 WeakPolarHBondContact O-CG 3.24Å; K42-E46 PolarHBondContact O-N 3.03Å; E46-T49 WeakPolarHBondContact CA-OG1 3.29Å; E46-T49 PolarHBondContact O-OG1 2.94Å; E46-T49 VanDerWaalsContact O-OG1 3.05Å; E46-R50 VanDerWaalsContact O-CB 3.25Å; E46-R50 WeakPolarHBondContact O-CB 3.4Å; E46-R50 PolarHBondContact O-N 3.44Å |
| 47 | L | 98.6 | Very high | 98.7 | Very high | 97 Ų | 97 | 109.1 Ų | 109.1 | 51% | 0.508 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -70.5 | -39.3 | 176.6 | -72.6 | 170.7 | 0 | 0 | 0 | 112.2 | R43 M44 E45 N51 | R43-L47 VanDerWaalsContact O-CG 3.29Å; R43-L47 WeakPolarHBondContact O-CG 3.42Å; R43-L47 PolarHBondContact O-N 3.05Å; M44-L47 PolarHBondContact O-N 2.69Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 3.42Å; L47-N51 WeakPolarHBondContact O-CB 3.44Å; L47-N51 PolarHBondContact O-N 3.11Å |
| 48 | F | 98.8 | Very high | 98.7 | Very high | 141 Ų | 141 | 107.9 Ų | 107.9 | 62% | 0.618 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.2 | -46.4 | 175.3 | -83.8 | -59.5 | 0 | 0 | 0 | 112.3 | M44 E45 N51 Q52 | M44-F48 HydrophobicContact CG-CD2 3.84Å; M44-F48 HydrophobicContact CG-CE2 3.57Å; M44-F48 VanDerWaalsContact O-CD2 3.24Å; M44-F48 WeakPolarHBondContact O-CD2 3.01Å; M44-F48 PolarHBondContact O-N 2.87Å; M44-F48 HydrophobicContact SD-CE2 4Å; E45-F48 PolarHBondContact O-N 3.3Å; F48-N51 PolarHBondContact O-N 3.27Å; F48-Q52 WeakPolarHBondContact O-CB 3.32Å; F48-Q52 PolarHBondContact O-N 2.81Å |
| 49 | T | 98.8 | Very high | 98.7 | Very high | 73 Ų | 73 | 111.9 Ų | 111.9 | 45% | 0.448 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.2 | -43.7 | 177.9 | 48.9 | 0 | 0 | 0 | 0 | 111.6 | E45 E46 N51 Q52 Q53 | E45-T49 WeakPolarHBondContact O-CG2 3.25Å; E45-T49 PolarHBondContact O-N 3.48Å; E45-T49 PolarHBondContact O-OG1 2.94Å; E46-T49 WeakPolarHBondContact CA-OG1 3.29Å; E46-T49 PolarHBondContact O-OG1 2.94Å; E46-T49 VanDerWaalsContact O-OG1 3.05Å; T49-N51 PolarHBondContact O-N 2.95Å; T49-Q52 PolarHBondContact O-N 2.91Å; T49-Q53 WeakPolarHBondContact O-CG 3.38Å; T49-Q53 PolarHBondContact O-N 3.3Å |
| 50 | R | 98.8 | Very high | 98.7 | Very high | 174 Ų | 174 | 110.9 Ų | 110.9 | 66% | 0.657 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.5 | -38.3 | 173.5 | -173.8 | 175.7 | 178.8 | 178.9 | -0.7 | 112.9 | E46 Q53 M54 | E46-R50 VanDerWaalsContact O-CB 3.25Å; E46-R50 WeakPolarHBondContact O-CB 3.4Å; E46-R50 PolarHBondContact O-N 3.44Å; R50-Q53 PolarHBondContact O-N 2.7Å; R50-M54 WeakPolarHBondContact O-CB 3.48Å; R50-M54 PolarHBondContact O-N 3.08Å |
| 51 | N | 98.8 | Very high | 98.7 | Very high | 63 Ų | 63 | 113.1 Ų | 113.1 | 34% | 0.337 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.1 | -37.8 | 176 | -173.7 | -98 | 0 | 0 | 0 | 111.9 | L47 F48 T49 M54 K55 | L47-N51 WeakPolarHBondContact O-CB 3.44Å; L47-N51 PolarHBondContact O-N 3.11Å; F48-N51 PolarHBondContact O-N 3.27Å; T49-N51 PolarHBondContact O-N 2.95Å; N51-M54 PolarHBondContact O-N 2.83Å; N51-K55 WeakPolarHBondContact O-CG 3.21Å; N51-K55 PolarHBondContact O-N 3.03Å; N51-K55 WeakPolarHBondContact OD1-CE 3.18Å; N51-K55 PolarHBondContact OD1-NZ 3.26Å |
| 52 | Q | 98.8 | Very high | 98.7 | Very high | 116 Ų | 116 | 113.4 Ų | 113.4 | 54% | 0.542 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68 | -40.4 | 175 | -172.6 | 60.3 | 18.9 | 0 | 0 | 112 | F48 T49 K55 E56 | F48-Q52 WeakPolarHBondContact O-CB 3.32Å; F48-Q52 PolarHBondContact O-N 2.81Å; T49-Q52 PolarHBondContact O-N 2.91Å; Q52-K55 PolarHBondContact O-N 3.23Å; Q52-E56 PolarHBondContact O-N 2.74Å |
| 53 | Q | 98.8 | Very high | 98.7 | Very high | 128 Ų | 128 | 111.4 Ų | 111.4 | 60% | 0.598 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.7 | -45.3 | 171.6 | -72.7 | 171.2 | -3.3 | 0 | 0 | 111.7 | T49 R50 K55 E56 Q57 | T49-Q53 WeakPolarHBondContact O-CG 3.38Å; T49-Q53 PolarHBondContact O-N 3.3Å; R50-Q53 PolarHBondContact O-N 2.7Å; Q53-K55 PolarHBondContact O-N 3.36Å; Q53-E56 PolarHBondContact O-N 3.24Å; Q53-Q57 WeakPolarHBondContact O-CG 3.37Å; Q53-Q57 PolarHBondContact O-N 2.7Å |
| 54 | M | 98.8 | Very high | 98.7 | Very high | 115 Ų | 115 | 108.2 Ų | 108.2 | 57% | 0.567 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -58.4 | -45.5 | 176.8 | -175.9 | -165.2 | -65.1 | 0 | 0 | 112 | R50 N51 E56 Q57 Q58 | R50-M54 WeakPolarHBondContact O-CB 3.48Å; R50-M54 PolarHBondContact O-N 3.08Å; N51-M54 PolarHBondContact O-N 2.83Å; M54-E56 PolarHBondContact O-N 3.05Å; M54-Q57 PolarHBondContact O-N 3.47Å; M54-Q58 PolarHBondContact O-N 2.98Å |
| 55 | K | 98.8 | Very high | 98.7 | Very high | 111 Ų | 111 | 106.6 Ų | 106.6 | 48% | 0.483 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60 | -42.7 | 176 | -76.5 | 163.3 | 170.9 | 160.2 | 0 | 112.2 | N51 Q52 Q53 Q58 R59 | N51-K55 WeakPolarHBondContact O-CG 3.21Å; N51-K55 PolarHBondContact O-N 3.03Å; N51-K55 WeakPolarHBondContact OD1-CE 3.18Å; N51-K55 PolarHBondContact OD1-NZ 3.26Å; Q52-K55 PolarHBondContact O-N 3.23Å; Q53-K55 PolarHBondContact O-N 3.36Å; K55-Q58 PolarHBondContact O-N 3.4Å; K55-R59 WeakPolarHBondContact O-CB 3.43Å; K55-R59 PolarHBondContact O-N 2.91Å |
| 56 | E | 98.8 | Very high | 98.7 | Very high | 70 Ų | 70 | 107 Ų | 107 | 33% | 0.327 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -70 | -38.7 | 178.6 | -176.4 | 56.7 | -160.8 | 0 | 0 | 112.2 | Q52 Q53 M54 Q58 R59 L60 | Q52-E56 PolarHBondContact O-N 2.74Å; Q53-E56 PolarHBondContact O-N 3.24Å; M54-E56 PolarHBondContact O-N 3.05Å; E56-Q58 VanDerWaalsContact C-N 3.33Å; E56-Q58 PolarHBondContact O-N 3.45Å; E56-R59 VanDerWaalsContact CD-NE 3.31Å; E56-R59 WeakPolarHBondContact O-CB 3.46Å; E56-R59 PolarHBondContact O-N 3.46Å; E56-R59 IonicContact OE1-CZ 2.68Å; E56-R59 VanDerWaalsContact OE1-CZ 3.3Å; E56-R59 IonicContact OE1-NE 3.3Å; E56-R59 PolarHBondContact OE1-NE 3.04Å; E56-R59 VanDerWaalsContact OE1-NE 3.08Å; E56-R59 IonicContact OE1-NH2 2.7Å; E56-R59 PolarHBondContact OE1-NH2 2.9Å; E56-R59 WeakPolarHBondContact OE2-CD 3.48Å; E56-R59 IonicContact OE2-CZ 2.69Å; E56-R59 IonicContact OE2-NE 3.82Å; E56-R59 PolarHBondContact OE2-NE 3.26Å; E56-R59 IonicContact OE2-NH2 3.57Å; E56-L60 HydrophobicContact CG-CD1 4.17Å; E56-L60 WeakPolarHBondContact O-CB 3.48Å; E56-L60 WeakPolarHBondContact O-CG 3.34Å; E56-L60 PolarHBondContact O-N 3.38Å |
| 57 | Q | 98.8 | Very high | 98.7 | Very high | 130 Ų | 130 | 105 Ų | 105 | 61% | 0.607 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.9 | -41.7 | 171.3 | -69.4 | -60.2 | -70.5 | 0 | 0 | 111.7 | Q53 M54 L60 L61 | Q53-Q57 WeakPolarHBondContact O-CG 3.37Å; Q53-Q57 PolarHBondContact O-N 2.7Å; M54-Q57 PolarHBondContact O-N 3.47Å; Q57-L60 PolarHBondContact O-N 2.97Å; Q57-L61 WeakPolarHBondContact O-CB 3.46Å; Q57-L61 PolarHBondContact O-N 2.93Å |
| 58 | Q | 98.7 | Very high | 98.6 | Very high | 128 Ų | 128 | 104.5 Ų | 104.5 | 60% | 0.598 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.6 | -42.6 | 174.9 | -170.9 | 175.4 | 6.5 | 0 | 0 | 111.7 | M54 K55 E56 L61 T62 | M54-Q58 PolarHBondContact O-N 2.98Å; K55-Q58 PolarHBondContact O-N 3.4Å; E56-Q58 VanDerWaalsContact C-N 3.33Å; E56-Q58 PolarHBondContact O-N 3.45Å; Q58-L61 PolarHBondContact O-N 3.4Å; Q58-T62 PolarHBondContact O-N 2.94Å; Q58-T62 PolarHBondContact O-OG1 3.5Å; Q58-T62 VanDerWaalsContact O-OG1 3.12Å |
| 59 | R | 98.8 | Very high | 98.5 | Very high | 116 Ų | 116 | 101.7 Ų | 101.7 | 44% | 0.438 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.1 | -50 | 175.9 | -165.8 | -165.4 | 70.5 | 67.9 | 5.2 | 111.4 | K55 E56 L61 T62 E63 | K55-R59 WeakPolarHBondContact O-CB 3.43Å; K55-R59 PolarHBondContact O-N 2.91Å; E56-R59 VanDerWaalsContact CD-NE 3.31Å; E56-R59 WeakPolarHBondContact O-CB 3.46Å; E56-R59 PolarHBondContact O-N 3.46Å; E56-R59 IonicContact OE1-CZ 2.68Å; E56-R59 VanDerWaalsContact OE1-CZ 3.3Å; E56-R59 IonicContact OE1-NE 3.3Å; E56-R59 PolarHBondContact OE1-NE 3.04Å; E56-R59 VanDerWaalsContact OE1-NE 3.08Å; E56-R59 IonicContact OE1-NH2 2.7Å; E56-R59 PolarHBondContact OE1-NH2 2.9Å; E56-R59 WeakPolarHBondContact OE2-CD 3.48Å; E56-R59 IonicContact OE2-CZ 2.69Å; E56-R59 IonicContact OE2-NE 3.82Å; E56-R59 PolarHBondContact OE2-NE 3.26Å; E56-R59 IonicContact OE2-NH2 3.57Å; R59-L61 PolarHBondContact O-N 2.81Å; R59-T62 PolarHBondContact O-N 3.37Å; R59-E63 IonicContact CZ-OE2 3.03Å; R59-E63 IonicContact NH1-OE2 3.23Å; R59-E63 PolarHBondContact NH1-OE2 2.97Å; R59-E63 IonicContact NH2-OE2 2.81Å; R59-E63 WeakPolarHBondContact O-CB 3.41Å; R59-E63 PolarHBondContact O-N 2.9Å |
| 60 | L | 98.8 | Very high | 98.4 | Very high | 60 Ų | 60 | 102 Ų | 102 | 31% | 0.314 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.4 | -38.7 | 177.9 | -71.3 | 168.1 | 0 | 0 | 0 | 112.1 | E56 Q57 E63 N64 | E56-L60 HydrophobicContact CG-CD1 4.17Å; E56-L60 WeakPolarHBondContact O-CB 3.48Å; E56-L60 WeakPolarHBondContact O-CG 3.34Å; E56-L60 PolarHBondContact O-N 3.38Å; Q57-L60 PolarHBondContact O-N 2.97Å; L60-E63 PolarHBondContact O-N 2.69Å; L60-N64 WeakPolarHBondContact O-CB 3.45Å; L60-N64 PolarHBondContact O-N 3.5Å; L60-N64 PolarHBondContact O-ND2 3.3Å |
| 61 | L | 98.8 | Very high | 98.2 | Very high | 108 Ų | 108 | 102.4 Ų | 102.4 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.9 | -46.3 | 175.4 | 179.6 | 59.6 | 0 | 0 | 0 | 111.5 | Q57 Q58 R59 E63 N64 I65 | Q57-L61 WeakPolarHBondContact O-CB 3.46Å; Q57-L61 PolarHBondContact O-N 2.93Å; Q58-L61 PolarHBondContact O-N 3.4Å; R59-L61 PolarHBondContact O-N 2.81Å; L61-E63 VanDerWaalsContact C-N 3.32Å; L61-E63 PolarHBondContact O-N 2.92Å; L61-N64 PolarHBondContact O-N 3.35Å; L61-I65 HydrophobicContact CD1-CD1 4.15Å; L61-I65 HydrophobicContact CD1-CG1 4.41Å; L61-I65 HydrophobicContact CG-CD1 4Å; L61-I65 VanDerWaalsContact O-CG1 3.3Å; L61-I65 WeakPolarHBondContact O-CG1 3.5Å; L61-I65 PolarHBondContact O-N 3.26Å |
| 62 | T | 98.8 | Very high | 97.9 | Very high | 86 Ų | 86 | 106 Ų | 106 | 53% | 0.528 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.6 | -39.1 | 175.5 | -58.6 | 0 | 0 | 0 | 0 | 112.1 | Q58 R59 I65 K66 | Q58-T62 PolarHBondContact O-N 2.94Å; Q58-T62 PolarHBondContact O-OG1 3.5Å; Q58-T62 VanDerWaalsContact O-OG1 3.12Å; R59-T62 PolarHBondContact O-N 3.37Å; T62-I65 PolarHBondContact O-N 2.89Å; T62-K66 WeakPolarHBondContact O-CB 3.38Å; T62-K66 PolarHBondContact O-N 3.46Å |
| 63 | E | 98.6 | Very high | 97.8 | Very high | 97 Ų | 97 | 108.1 Ų | 108.1 | 45% | 0.453 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.8 | -41 | 176.2 | -171.2 | 172.8 | 177.5 | 0 | 0 | 112.4 | R59 L60 L61 T67 | R59-E63 IonicContact CZ-OE2 3.03Å; R59-E63 IonicContact NH1-OE2 3.23Å; R59-E63 PolarHBondContact NH1-OE2 2.97Å; R59-E63 IonicContact NH2-OE2 2.81Å; R59-E63 WeakPolarHBondContact O-CB 3.41Å; R59-E63 PolarHBondContact O-N 2.9Å; L60-E63 PolarHBondContact O-N 2.69Å; L61-E63 VanDerWaalsContact C-N 3.32Å; L61-E63 PolarHBondContact O-N 2.92Å; E63-T67 WeakPolarHBondContact O-CB 3.3Å; E63-T67 PolarHBondContact O-N 2.94Å; E63-T67 PolarHBondContact O-OG1 3.35Å |
| 64 | N | 98.7 | Very high | 97.5 | Very high | 94 Ų | 94 | 105.7 Ų | 105.7 | 50% | 0.503 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65 | -44.6 | 173.8 | -84.5 | -83.2 | 0 | 0 | 0 | 112.2 | L60 L61 K66 T67 L68 | L60-N64 WeakPolarHBondContact O-CB 3.45Å; L60-N64 PolarHBondContact O-N 3.5Å; L60-N64 PolarHBondContact O-ND2 3.3Å; L61-N64 PolarHBondContact O-N 3.35Å; N64-K66 PolarHBondContact O-N 3.35Å; N64-T67 PolarHBondContact O-N 3.36Å; N64-L68 WeakPolarHBondContact O-CG 3.42Å; N64-L68 PolarHBondContact O-N 2.89Å |
| 65 | I | 98.6 | Very high | 97.1 | Very high | 80 Ų | 80 | 102.9 Ų | 102.9 | 41% | 0.41 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -57.6 | -50.8 | 175.7 | -69.9 | 164.4 | 0 | 0 | 0 | 110.2 | L61 T62 T67 L68 E69 | L61-I65 HydrophobicContact CD1-CD1 4.15Å; L61-I65 HydrophobicContact CD1-CG1 4.41Å; L61-I65 HydrophobicContact CG-CD1 4Å; L61-I65 VanDerWaalsContact O-CG1 3.3Å; L61-I65 WeakPolarHBondContact O-CG1 3.5Å; L61-I65 PolarHBondContact O-N 3.26Å; T62-I65 PolarHBondContact O-N 2.89Å; I65-T67 VanDerWaalsContact C-N 3.25Å; I65-T67 PolarHBondContact O-N 3.42Å; I65-L68 PolarHBondContact O-N 3.17Å; I65-E69 HydrophobicContact CG2-CG 4.42Å; I65-E69 WeakPolarHBondContact O-CG 3.31Å; I65-E69 PolarHBondContact O-N 2.78Å |
| 66 | K | 98.6 | Very high | 96.8 | Very high | 134 Ų | 134 | 102.2 Ų | 102.2 | 58% | 0.583 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -57.8 | -37.5 | 177.3 | -174.6 | 179.1 | -179.8 | -177.9 | 0 | 112.5 | T62 N64 N70 | T62-K66 WeakPolarHBondContact O-CB 3.38Å; T62-K66 PolarHBondContact O-N 3.46Å; N64-K66 PolarHBondContact O-N 3.35Å; K66-N70 WeakPolarHBondContact O-CB 3.41Å; K66-N70 PolarHBondContact O-N 3.27Å; K66-N70 PolarHBondContact O-ND2 3.47Å; K66-N70 PolarHBondContact O-OD1 2.93Å |
| 67 | T | 97.8 | Very high | 96.4 | Very high | 85 Ų | 85 | 102.5 Ų | 102.5 | 52% | 0.521 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -69.7 | -43.1 | 177.5 | -58.3 | 0 | 0 | 0 | 0 | 111.9 | E63 N64 I65 N70 R71 | E63-T67 WeakPolarHBondContact O-CB 3.3Å; E63-T67 PolarHBondContact O-N 2.94Å; E63-T67 PolarHBondContact O-OG1 3.35Å; N64-T67 PolarHBondContact O-N 3.36Å; I65-T67 VanDerWaalsContact C-N 3.25Å; I65-T67 PolarHBondContact O-N 3.42Å; T67-N70 PolarHBondContact O-N 3.46Å; T67-R71 PolarHBondContact O-N 3Å |
| 68 | L | 97.4 | Very high | 96.2 | Very high | 86 Ų | 86 | 102.8 Ų | 102.8 | 45% | 0.45 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.3 | -44.2 | 175.7 | -70.8 | 170.8 | 0 | 0 | 0 | 111.7 | N64 I65 N70 R71 L72 | N64-L68 WeakPolarHBondContact O-CG 3.42Å; N64-L68 PolarHBondContact O-N 2.89Å; I65-L68 PolarHBondContact O-N 3.17Å; L68-N70 VanDerWaalsContact C-N 3.34Å; L68-N70 PolarHBondContact O-N 3.49Å; L68-R71 PolarHBondContact O-N 3.44Å; L68-L72 WeakPolarHBondContact O-CG 3.36Å; L68-L72 PolarHBondContact O-N 3.12Å |
| 69 | E | 96.8 | Very high | 96.1 | Very high | 81 Ų | 81 | 104.5 Ų | 104.5 | 38% | 0.379 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -58.8 | -43.4 | 172.7 | -72.6 | -178.5 | -161.7 | 0 | 0 | 112.2 | I65 R71 L72 R73 | I65-E69 HydrophobicContact CG2-CG 4.42Å; I65-E69 WeakPolarHBondContact O-CG 3.31Å; I65-E69 PolarHBondContact O-N 2.78Å; E69-R71 VanDerWaalsContact C-N 3.31Å; E69-R71 PolarHBondContact O-N 2.96Å; E69-L72 PolarHBondContact O-N 3.5Å; E69-R73 VanDerWaalsContact CB-NH2 3.27Å; E69-R73 WeakPolarHBondContact O-CB 3.44Å; E69-R73 WeakPolarHBondContact O-CG 3.39Å; E69-R73 PolarHBondContact O-N 3.18Å; E69-R73 IonicContact OE2-CZ 2.74Å; E69-R73 VanDerWaalsContact OE2-CZ 3.23Å; E69-R73 IonicContact OE2-NH1 2.64Å; E69-R73 PolarHBondContact OE2-NH1 3Å; E69-R73 IonicContact OE2-NH2 3.66Å; E69-R73 PolarHBondContact OE2-NH2 3.48Å |
| 70 | N | 96.6 | Very high | 95.9 | Very high | 80 Ų | 80 | 101.1 Ų | 101.1 | 43% | 0.428 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.9 | -38.9 | 177.4 | -76.7 | -8.6 | 0 | 0 | 0 | 111.5 | K66 T67 L68 R73 A74 | K66-N70 WeakPolarHBondContact O-CB 3.41Å; K66-N70 PolarHBondContact O-N 3.27Å; K66-N70 PolarHBondContact O-ND2 3.47Å; K66-N70 PolarHBondContact O-OD1 2.93Å; T67-N70 PolarHBondContact O-N 3.46Å; L68-N70 VanDerWaalsContact C-N 3.34Å; L68-N70 PolarHBondContact O-N 3.49Å; N70-R73 PolarHBondContact O-N 3Å; N70-R73 PolarHBondContact OD1-NH2 3.3Å; N70-A74 WeakPolarHBondContact O-CB 3.44Å; N70-A74 PolarHBondContact O-N 2.82Å |
| 71 | R | 94.2 | Very high | 95.8 | Very high | 182 Ų | 182 | 100.5 Ų | 100.5 | 69% | 0.687 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.1 | -36.1 | 174 | -166.3 | 178.6 | 71.5 | -179.8 | 2.6 | 112.4 | T67 L68 E69 | T67-R71 PolarHBondContact O-N 3Å; L68-R71 PolarHBondContact O-N 3.44Å; E69-R71 VanDerWaalsContact C-N 3.31Å; E69-R71 PolarHBondContact O-N 2.96Å |
| 72 | L | 93 | Very high | 95.8 | Very high | 140 Ų | 140 | 99.3 Ų | 99.3 | 73% | 0.733 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.9 | -41.4 | 173.8 | -69.7 | 169.3 | 0 | 0 | 0 | 111.8 | L68 E69 A74 G75 | L68-L72 WeakPolarHBondContact O-CG 3.36Å; L68-L72 PolarHBondContact O-N 3.12Å; E69-L72 PolarHBondContact O-N 3.5Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 2.8Å; L72-G75 PolarHBondContact O-N 2.74Å |
| 73 | R | 95.6 | Very high | 95.8 | Very high | 159 Ų | 159 | 99.5 Ų | 99.5 | 60% | 0.6 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -67 | -27.5 | 175.2 | -75.4 | -173.3 | -76.1 | -99.9 | 1 | 113.5 | E69 N70 G75 | E69-R73 VanDerWaalsContact CB-NH2 3.27Å; E69-R73 WeakPolarHBondContact O-CB 3.44Å; E69-R73 WeakPolarHBondContact O-CG 3.39Å; E69-R73 PolarHBondContact O-N 3.18Å; E69-R73 IonicContact OE2-CZ 2.74Å; E69-R73 VanDerWaalsContact OE2-CZ 3.23Å; E69-R73 IonicContact OE2-NH1 2.64Å; E69-R73 PolarHBondContact OE2-NH1 3Å; E69-R73 IonicContact OE2-NH2 3.66Å; E69-R73 PolarHBondContact OE2-NH2 3.48Å; N70-R73 PolarHBondContact O-N 3Å; N70-R73 PolarHBondContact OD1-NH2 3.3Å; R73-G75 PolarHBondContact O-N 3.44Å |
| 74 | A | 93.8 | Very high | 95.7 | Very high | 78 Ų | 78 | 100.5 Ų | 100.5 | 65% | 0.645 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.2 | -18.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | N70 L72 | N70-A74 WeakPolarHBondContact O-CB 3.44Å; N70-A74 PolarHBondContact O-N 2.82Å; L72-A74 VanDerWaalsContact C-N 3.31Å; L72-A74 PolarHBondContact O-N 2.8Å |
| 75 | G | 90.1 | Very high | 95.7 | Very high | 55 Ų | 55 | 100.9 Ų | 100.9 | 57% | 0.567 | 53% | 0.526 | S | S | * | . | | | trans | 73.6 | -137.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | L72 R73 | L72-G75 PolarHBondContact O-N 2.74Å; R73-G75 PolarHBondContact O-N 3.44Å |
| 76 | L | 90.8 | Very high | 95.7 | Very high | 98 Ų | 98 | 100.8 Ų | 100.8 | 51% | 0.513 | 53% | 0.529 | S | S | . | . | S | Bend | trans | -76.8 | 137.2 | 177.2 | -65 | 179.4 | 0 | 0 | 0 | 110.4 | C80 T81 Q84 | L76-C80 HydrophobicContact CB-CB 4.08Å; L76-C80 HydrophobicContact CD2-CB 4.21Å; L76-T81 PolarHBondContact O-OG1 3.33Å; L76-Q84 VanDerWaalsContact CD1-OE1 3.26Å |
| 77 | C | 91.6 | Very high | 95.7 | Very high | 76 Ų | 76 | 97.3 Ų | 97.3 | 51% | 0.514 | 53% | 0.526 | S | S | . | . | | | trans | -70.7 | 156.2 | 170.5 | 66.7 | 0 | 0 | 0 | 0 | 111.3 | R79 C80 T81 | C77-R79 PolarHBondContact O-N 2.93Å; C77-C80 WeakPolarHBondContact O-CA 3.47Å; C77-C80 WeakPolarHBondContact O-CB 3.43Å; C77-C80 PolarHBondContact O-N 3.46Å; C77-T81 PolarHBondContact O-N 3.46Å; C77-T81 PolarHBondContact O-OG1 3.38Å |
| 78 | D | 94.5 | Very high | 95.7 | Very high | 136 Ų | 136 | 99.8 Ų | 99.8 | 73% | 0.727 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -48.1 | -39.8 | -174.1 | -46.2 | -36.8 | 0 | 0 | 0 | 113.6 | C80 T81 V82 | D78-C80 PolarHBondContact O-N 2.83Å; D78-T81 PolarHBondContact O-N 3.47Å; D78-V82 WeakPolarHBondContact O-CB 3.42Å; D78-V82 VanDerWaalsContact O-CG2 3.31Å; D78-V82 WeakPolarHBondContact O-CG2 3.45Å; D78-V82 PolarHBondContact O-N 3.45Å |
| 79 | R | 96.6 | Very high | 95.8 | Very high | 163 Ų | 163 | 102.1 Ų | 102.1 | 62% | 0.615 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.7 | -43.5 | 177.1 | -162.5 | -166 | 74 | -175.2 | 0.8 | 112 | C77 T83 | C77-R79 PolarHBondContact O-N 2.93Å; R79-T83 WeakPolarHBondContact O-CB 3.45Å; R79-T83 PolarHBondContact O-N 3.2Å; R79-T83 PolarHBondContact O-OG1 2.94Å |
| 80 | C | 95.3 | Very high | 95.9 | Very high | 46 Ų | 46 | 107.3 Ų | 107.3 | 31% | 0.311 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -71 | -39 | 177.2 | -67.9 | 0 | 0 | 0 | 0 | 111.5 | L76 C77 D78 T83 Q84 | L76-C80 HydrophobicContact CB-CB 4.08Å; L76-C80 HydrophobicContact CD2-CB 4.21Å; C77-C80 WeakPolarHBondContact O-CA 3.47Å; C77-C80 WeakPolarHBondContact O-CB 3.43Å; C77-C80 PolarHBondContact O-N 3.46Å; D78-C80 PolarHBondContact O-N 2.83Å; C80-T83 PolarHBondContact O-N 2.99Å; C80-Q84 WeakPolarHBondContact O-CB 3.35Å; C80-Q84 PolarHBondContact O-N 2.8Å |
| 81 | T | 96.4 | Very high | 96 | Very high | 47 Ų | 47 | 108 Ų | 108 | 29% | 0.288 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60 | -50.4 | 174.4 | -52.9 | 0 | 0 | 0 | 0 | 111.1 | L76 C77 D78 T83 Q84 E85 | L76-T81 PolarHBondContact O-OG1 3.33Å; C77-T81 PolarHBondContact O-N 3.46Å; C77-T81 PolarHBondContact O-OG1 3.38Å; D78-T81 PolarHBondContact O-N 3.47Å; T81-T83 PolarHBondContact O-N 2.83Å; T81-Q84 WeakPolarHBondContact O-CB 3.46Å; T81-Q84 PolarHBondContact O-N 3.02Å; T81-Q84 VanDerWaalsContact O-N 3.14Å; T81-E85 WeakPolarHBondContact O-CG 3.28Å; T81-E85 PolarHBondContact O-N 3.22Å |
| 82 | V | 98.2 | Very high | 96.2 | Very high | 83 Ų | 83 | 104.5 Ų | 104.5 | 50% | 0.503 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.5 | -40 | 175.6 | 171 | 0 | 0 | 0 | 0 | 111.7 | D78 E85 V86 | D78-V82 WeakPolarHBondContact O-CB 3.42Å; D78-V82 VanDerWaalsContact O-CG2 3.31Å; D78-V82 WeakPolarHBondContact O-CG2 3.45Å; D78-V82 PolarHBondContact O-N 3.45Å; V82-E85 PolarHBondContact O-N 3.46Å; V82-V86 HydrophobicContact CG1-CG2 4.36Å; V82-V86 WeakPolarHBondContact O-CB 3.42Å; V82-V86 VanDerWaalsContact O-CG2 3.28Å; V82-V86 WeakPolarHBondContact O-CG2 3.49Å; V82-V86 PolarHBondContact O-N 3Å |
| 83 | T | 98.1 | Very high | 96.4 | Very high | 89 Ų | 89 | 102.9 Ų | 102.9 | 55% | 0.546 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.5 | -42.2 | 173.8 | -61.7 | 0 | 0 | 0 | 0 | 112 | R79 C80 T81 A87 | R79-T83 WeakPolarHBondContact O-CB 3.45Å; R79-T83 PolarHBondContact O-N 3.2Å; R79-T83 PolarHBondContact O-OG1 2.94Å; C80-T83 PolarHBondContact O-N 2.99Å; T81-T83 PolarHBondContact O-N 2.83Å; T83-A87 WeakPolarHBondContact O-CB 3.47Å; T83-A87 PolarHBondContact O-N 2.86Å |
| 84 | Q | 97.9 | Very high | 96.6 | Very high | 119 Ų | 119 | 102.1 Ų | 102.1 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66 | -41.3 | 176.8 | -172.1 | -178.8 | 12 | 0 | 0 | 111.8 | L76 C80 T81 A87 K88 | L76-Q84 VanDerWaalsContact CD1-OE1 3.26Å; C80-Q84 WeakPolarHBondContact O-CB 3.35Å; C80-Q84 PolarHBondContact O-N 2.8Å; T81-Q84 WeakPolarHBondContact O-CB 3.46Å; T81-Q84 PolarHBondContact O-N 3.02Å; T81-Q84 VanDerWaalsContact O-N 3.14Å; Q84-A87 PolarHBondContact O-N 2.99Å; Q84-K88 VanDerWaalsContact O-CB 3.25Å; Q84-K88 WeakPolarHBondContact O-CB 3.43Å; Q84-K88 PolarHBondContact O-N 3.28Å |
| 85 | E | 98.1 | Very high | 96.8 | Very high | 101 Ų | 101 | 102.8 Ų | 102.8 | 47% | 0.472 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.4 | -43.8 | 175.6 | -75.5 | -178.2 | -167.6 | 0 | 0 | 112.5 | T81 V82 K88 R89 | T81-E85 WeakPolarHBondContact O-CG 3.28Å; T81-E85 PolarHBondContact O-N 3.22Å; V82-E85 PolarHBondContact O-N 3.46Å; E85-K88 PolarHBondContact O-N 2.93Å; E85-R89 VanDerWaalsContact O-CB 3.29Å; E85-R89 WeakPolarHBondContact O-CB 3.42Å; E85-R89 PolarHBondContact O-N 3Å |
| 86 | V | 98.4 | Very high | 97.2 | Very high | 78 Ų | 78 | 103 Ų | 103 | 47% | 0.473 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.5 | -43.1 | 176.7 | 168.7 | 0 | 0 | 0 | 0 | 110.9 | V82 R89 R90 | V82-V86 HydrophobicContact CG1-CG2 4.36Å; V82-V86 WeakPolarHBondContact O-CB 3.42Å; V82-V86 VanDerWaalsContact O-CG2 3.28Å; V82-V86 WeakPolarHBondContact O-CG2 3.49Å; V82-V86 PolarHBondContact O-N 3Å; V86-R89 PolarHBondContact O-N 3.24Å; V86-R90 WeakPolarHBondContact O-CB 3.37Å; V86-R90 PolarHBondContact O-N 3.32Å |
| 87 | A | 98.4 | Very high | 97.6 | Very high | 62 Ų | 62 | 101.7 Ų | 101.7 | 51% | 0.512 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62 | -46 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | T83 Q84 R90 Q91 | T83-A87 WeakPolarHBondContact O-CB 3.47Å; T83-A87 PolarHBondContact O-N 2.86Å; Q84-A87 PolarHBondContact O-N 2.99Å; A87-R90 PolarHBondContact O-N 3.33Å; A87-Q91 PolarHBondContact O-N 3.1Å |
| 88 | K | 98.6 | Very high | 97.9 | Very high | 136 Ų | 136 | 105.3 Ų | 105.3 | 59% | 0.591 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.4 | -45.5 | 177.3 | -177.3 | 179.2 | 178.2 | -177.8 | 0 | 112.1 | Q84 E85 Q91 Q92 | Q84-K88 VanDerWaalsContact O-CB 3.25Å; Q84-K88 WeakPolarHBondContact O-CB 3.43Å; Q84-K88 PolarHBondContact O-N 3.28Å; E85-K88 PolarHBondContact O-N 2.93Å; K88-Q91 PolarHBondContact O-N 3.5Å; K88-Q92 WeakPolarHBondContact O-CG 3.28Å; K88-Q92 PolarHBondContact O-N 3.42Å |
| 89 | R | 98.6 | Very high | 98.1 | Very high | 136 Ų | 136 | 103.4 Ų | 103.4 | 51% | 0.513 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62 | -46.7 | 178.2 | -173.5 | -178.7 | -63.2 | 138 | 9 | 111.1 | E85 V86 Q91 Q92 E93 | E85-R89 VanDerWaalsContact O-CB 3.29Å; E85-R89 WeakPolarHBondContact O-CB 3.42Å; E85-R89 PolarHBondContact O-N 3Å; V86-R89 PolarHBondContact O-N 3.24Å; R89-Q91 VanDerWaalsContact C-N 3.3Å; R89-Q91 PolarHBondContact O-N 3.12Å; R89-Q92 WeakPolarHBondContact O-CB 3.47Å; R89-Q92 PolarHBondContact O-N 3.42Å; R89-Q92 VanDerWaalsContact O-N 3.11Å; R89-E93 HydrophobicContact CG-CG 4.46Å; R89-E93 WeakPolarHBondContact CG-OE1 3.45Å; R89-E93 WeakPolarHBondContact O-CG 3.44Å; R89-E93 PolarHBondContact O-N 3.19Å |
| 90 | R | 98.6 | Very high | 98.2 | Very high | 189 Ų | 189 | 100.5 Ų | 100.5 | 71% | 0.713 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.7 | -35.2 | 178.1 | -170 | 174.4 | -177.9 | 174.1 | 1.3 | 112.9 | V86 A87 Y94 | V86-R90 WeakPolarHBondContact O-CB 3.37Å; V86-R90 PolarHBondContact O-N 3.32Å; A87-R90 PolarHBondContact O-N 3.33Å; R90-Y94 WeakPolarHBondContact O-CB 3.34Å; R90-Y94 PolarHBondContact O-N 2.88Å |
| 91 | Q | 98.6 | Very high | 98.4 | Very high | 96 Ų | 96 | 101.4 Ų | 101.4 | 45% | 0.449 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.8 | -44.8 | 172.3 | -177.4 | 63.2 | 21.2 | 0 | 0 | 111.5 | A87 K88 R89 Y94 E95 | A87-Q91 PolarHBondContact O-N 3.1Å; K88-Q91 PolarHBondContact O-N 3.5Å; R89-Q91 VanDerWaalsContact C-N 3.3Å; R89-Q91 PolarHBondContact O-N 3.12Å; Q91-Y94 PolarHBondContact O-N 2.8Å; Q91-E95 PolarHBondContact NE2-OE1 3.32Å; Q91-E95 WeakPolarHBondContact O-CG 3.46Å; Q91-E95 PolarHBondContact O-N 3.29Å |
| 92 | Q | 98.7 | Very high | 98.5 | Very high | 108 Ų | 108 | 103.9 Ų | 103.9 | 51% | 0.505 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.9 | -40.2 | 177.1 | -69.2 | 175.2 | -48.9 | 0 | 0 | 112.2 | K88 R89 E95 A96 | K88-Q92 WeakPolarHBondContact O-CG 3.28Å; K88-Q92 PolarHBondContact O-N 3.42Å; R89-Q92 WeakPolarHBondContact O-CB 3.47Å; R89-Q92 PolarHBondContact O-N 3.42Å; R89-Q92 VanDerWaalsContact O-N 3.11Å; Q92-E95 PolarHBondContact O-N 3.32Å; Q92-A96 WeakPolarHBondContact O-CB 3.34Å; Q92-A96 PolarHBondContact O-N 3.41Å |
| 93 | E | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 105.7 Ų | 105.7 | 50% | 0.495 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -42.1 | 174.3 | -71.8 | 163.6 | 177.8 | 0 | 0 | 111.7 | R89 S97 | R89-E93 HydrophobicContact CG-CG 4.46Å; R89-E93 WeakPolarHBondContact CG-OE1 3.45Å; R89-E93 WeakPolarHBondContact O-CG 3.44Å; R89-E93 PolarHBondContact O-N 3.19Å; E93-S97 VanDerWaalsContact O-CB 3.32Å; E93-S97 WeakPolarHBondContact O-CB 3.24Å; E93-S97 PolarHBondContact O-N 2.92Å; E93-S97 PolarHBondContact O-OG 3.14Å |
| 94 | Y | 98.8 | Very high | 98.6 | Very high | 143 Ų | 143 | 108.1 Ų | 108.1 | 56% | 0.561 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.6 | -45.5 | 175.2 | 174.3 | -105.2 | 0 | 0 | 0 | 112.2 | R90 Q91 S97 R98 | R90-Y94 WeakPolarHBondContact O-CB 3.34Å; R90-Y94 PolarHBondContact O-N 2.88Å; Q91-Y94 PolarHBondContact O-N 2.8Å; Y94-S97 PolarHBondContact O-N 3.49Å; Y94-R98 VanDerWaalsContact O-CB 3.3Å; Y94-R98 WeakPolarHBondContact O-CB 3.45Å; Y94-R98 PolarHBondContact O-N 3.3Å |
| 95 | E | 98.6 | Very high | 98.6 | Very high | 91 Ų | 91 | 107.1 Ų | 107.1 | 43% | 0.425 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 177.9 | -75 | 172.1 | -173.5 | 0 | 0 | 112.1 | Q91 Q92 R98 I99 | Q91-E95 PolarHBondContact NE2-OE1 3.32Å; Q91-E95 WeakPolarHBondContact O-CG 3.46Å; Q91-E95 PolarHBondContact O-N 3.29Å; Q92-E95 PolarHBondContact O-N 3.32Å; E95-R98 PolarHBondContact O-N 2.98Å; E95-I99 VanDerWaalsContact O-CG1 3.29Å; E95-I99 WeakPolarHBondContact O-CG1 3.29Å; E95-I99 PolarHBondContact O-N 3.41Å |
| 96 | A | 98.6 | Very high | 98.6 | Very high | 59 Ų | 59 | 106.3 Ų | 106.3 | 49% | 0.488 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.2 | -47.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q92 R98 I99 Q100 | Q92-A96 WeakPolarHBondContact O-CB 3.34Å; Q92-A96 PolarHBondContact O-N 3.41Å; A96-R98 VanDerWaalsContact C-N 3.31Å; A96-R98 PolarHBondContact O-N 2.85Å; A96-I99 PolarHBondContact O-N 3.05Å; A96-Q100 PolarHBondContact O-N 3.48Å |
| 97 | S | 98.6 | Very high | 98.6 | Very high | 72 Ų | 72 | 107.4 Ų | 107.4 | 50% | 0.503 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.4 | -38.6 | 177.4 | -57.1 | 0 | 0 | 0 | 0 | 112.2 | E93 Y94 S101 | E93-S97 VanDerWaalsContact O-CB 3.32Å; E93-S97 WeakPolarHBondContact O-CB 3.24Å; E93-S97 PolarHBondContact O-N 2.92Å; E93-S97 PolarHBondContact O-OG 3.14Å; Y94-S97 PolarHBondContact O-N 3.49Å; S97-S101 WeakPolarHBondContact O-CB 3.25Å; S97-S101 PolarHBondContact O-N 3.19Å |
| 98 | R | 98.6 | Very high | 98.6 | Very high | 152 Ų | 152 | 109.2 Ų | 109.2 | 57% | 0.574 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67.4 | -42.4 | 176.3 | -178.7 | 178.2 | 175.6 | -127.8 | -1.1 | 111.8 | Y94 E95 A96 S101 L102 | Y94-R98 VanDerWaalsContact O-CB 3.3Å; Y94-R98 WeakPolarHBondContact O-CB 3.45Å; Y94-R98 PolarHBondContact O-N 3.3Å; E95-R98 PolarHBondContact O-N 2.98Å; A96-R98 VanDerWaalsContact C-N 3.31Å; A96-R98 PolarHBondContact O-N 2.85Å; R98-S101 PolarHBondContact O-N 3.42Å; R98-L102 HydrophobicContact CG-CD1 4.4Å; R98-L102 WeakPolarHBondContact O-CG 3.47Å; R98-L102 PolarHBondContact O-N 2.79Å |
| 99 | I | 98.7 | Very high | 98.6 | Very high | 96 Ų | 96 | 105.3 Ų | 105.3 | 49% | 0.492 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.8 | -45 | 175.4 | -70 | 164.8 | 0 | 0 | 0 | 110.3 | E95 A96 S101 L102 Q103 | E95-I99 VanDerWaalsContact O-CG1 3.29Å; E95-I99 WeakPolarHBondContact O-CG1 3.29Å; E95-I99 PolarHBondContact O-N 3.41Å; A96-I99 PolarHBondContact O-N 3.05Å; I99-S101 PolarHBondContact O-N 3.15Å; I99-L102 PolarHBondContact O-N 3.06Å; I99-Q103 WeakPolarHBondContact O-CG 3.42Å; I99-Q103 PolarHBondContact O-N 3.41Å |
| 100 | Q | 98.6 | Very high | 98.6 | Very high | 102 Ų | 102 | 100.1 Ų | 100.1 | 48% | 0.477 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.2 | -46.9 | 175.4 | -178.1 | 177.7 | -5.6 | 0 | 0 | 111.6 | A96 L102 Q103 H104 | A96-Q100 PolarHBondContact O-N 3.48Å; Q100-L102 VanDerWaalsContact C-N 3.32Å; Q100-L102 PolarHBondContact O-N 3.34Å; Q100-Q103 WeakPolarHBondContact O-CB 3.34Å; Q100-Q103 PolarHBondContact O-N 3.49Å; Q100-Q103 VanDerWaalsContact O-N 3.12Å; Q100-H104 PolarHBondContact NE2-NE2 3.22Å; Q100-H104 PolarHBondContact O-CD2 3.48Å; Q100-H104 VanDerWaalsContact O-CD2 3.24Å; Q100-H104 PolarHBondContact O-N 3.11Å |
| 101 | S | 98.6 | Very high | 98.6 | Very high | 65 Ų | 65 | 95.9 Ų | 95.9 | 46% | 0.455 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -56.4 | -45 | 176.5 | -179.2 | 0 | 0 | 0 | 0 | 112.1 | S97 R98 I99 Q103 H104 I105 | S97-S101 WeakPolarHBondContact O-CB 3.25Å; S97-S101 PolarHBondContact O-N 3.19Å; R98-S101 PolarHBondContact O-N 3.42Å; I99-S101 PolarHBondContact O-N 3.15Å; S101-Q103 PolarHBondContact O-N 3.08Å; S101-H104 PolarHBondContact O-N 3.45Å; S101-I105 VanDerWaalsContact O-CG1 3.29Å; S101-I105 WeakPolarHBondContact O-CG1 3.32Å; S101-I105 PolarHBondContact O-N 3.48Å |
| 102 | L | 98.8 | Very high | 98.6 | Very high | 98 Ų | 98 | 95.8 Ų | 95.8 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.2 | -35.2 | 176.1 | -69 | 169.2 | 0 | 0 | 0 | 113.1 | R98 I99 Q100 S106 | R98-L102 HydrophobicContact CG-CD1 4.4Å; R98-L102 WeakPolarHBondContact O-CG 3.47Å; R98-L102 PolarHBondContact O-N 2.79Å; I99-L102 PolarHBondContact O-N 3.06Å; Q100-L102 VanDerWaalsContact C-N 3.32Å; Q100-L102 PolarHBondContact O-N 3.34Å; L102-S106 WeakPolarHBondContact O-CB 3.35Å; L102-S106 PolarHBondContact O-N 3.39Å |
| 103 | Q | 98.6 | Very high | 98.6 | Very high | 122 Ų | 122 | 93.6 Ų | 93.6 | 57% | 0.57 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.6 | -44 | 173.6 | -71.9 | 169.2 | -13.6 | 0 | 0 | 111.8 | I99 Q100 S101 S106 L107 | I99-Q103 WeakPolarHBondContact O-CG 3.42Å; I99-Q103 PolarHBondContact O-N 3.41Å; Q100-Q103 WeakPolarHBondContact O-CB 3.34Å; Q100-Q103 PolarHBondContact O-N 3.49Å; Q100-Q103 VanDerWaalsContact O-N 3.12Å; S101-Q103 PolarHBondContact O-N 3.08Å; Q103-S106 WeakPolarHBondContact O-CB 3.48Å; Q103-S106 PolarHBondContact O-N 2.98Å; Q103-L107 PolarHBondContact O-N 3.49Å |
| 104 | H | 98.8 | Very high | 98.6 | Very high | 139 Ų | 139 | 92.2 Ų | 92.2 | 64% | 0.644 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.8 | -42.9 | 175.3 | -82.1 | -110.7 | 0 | 0 | 0 | 111.7 | Q100 S101 S106 L107 L108 | Q100-H104 PolarHBondContact NE2-NE2 3.22Å; Q100-H104 PolarHBondContact O-CD2 3.48Å; Q100-H104 VanDerWaalsContact O-CD2 3.24Å; Q100-H104 PolarHBondContact O-N 3.11Å; S101-H104 PolarHBondContact O-N 3.45Å; H104-S106 VanDerWaalsContact C-N 3.34Å; H104-S106 PolarHBondContact O-N 2.9Å; H104-L107 PolarHBondContact O-N 3.03Å; H104-L108 WeakPolarHBondContact O-CG 3.4Å; H104-L108 PolarHBondContact O-N 3.34Å |
| 105 | I | 98.6 | Very high | 98.6 | Very high | 99 Ų | 99 | 90.1 Ų | 90.1 | 51% | 0.508 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.3 | -42.1 | 174.3 | -68.7 | 163.7 | 0 | 0 | 0 | 111.2 | S101 A109 | S101-I105 VanDerWaalsContact O-CG1 3.29Å; S101-I105 WeakPolarHBondContact O-CG1 3.32Å; S101-I105 PolarHBondContact O-N 3.48Å; I105-A109 VanDerWaalsContact O-CB 3.29Å; I105-A109 WeakPolarHBondContact O-CB 3.41Å; I105-A109 PolarHBondContact O-N 2.83Å |
| 106 | S | 98.6 | Very high | 98.6 | Very high | 83 Ų | 83 | 93 Ų | 93 | 58% | 0.58 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.9 | -40.9 | 177.6 | -169.4 | 0 | 0 | 0 | 0 | 112.3 | L102 Q103 H104 A109 G110 | L102-S106 WeakPolarHBondContact O-CB 3.35Å; L102-S106 PolarHBondContact O-N 3.39Å; Q103-S106 WeakPolarHBondContact O-CB 3.48Å; Q103-S106 PolarHBondContact O-N 2.98Å; H104-S106 VanDerWaalsContact C-N 3.34Å; H104-S106 PolarHBondContact O-N 2.9Å; S106-A109 PolarHBondContact O-N 3.26Å; S106-G110 PolarHBondContact O-N 2.73Å |
| 107 | L | 98.6 | Very high | 98.6 | Very high | 102 Ų | 102 | 96.1 Ų | 96.1 | 53% | 0.534 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.5 | -50.9 | 176.1 | -177.9 | 149 | 0 | 0 | 0 | 111.4 | Q103 H104 A109 G110 E111 | Q103-L107 PolarHBondContact O-N 3.49Å; H104-L107 PolarHBondContact O-N 3.03Å; L107-A109 VanDerWaalsContact C-N 3.29Å; L107-A109 PolarHBondContact O-N 3Å; L107-G110 WeakPolarHBondContact O-CA 3.29Å; L107-G110 PolarHBondContact O-N 3.31Å; L107-E111 HydrophobicContact CD2-CG 4.29Å; L107-E111 WeakPolarHBondContact CD2-OE1 3.42Å; L107-E111 PolarHBondContact O-N 3.43Å |
| 108 | L | 98.7 | Very high | 98.6 | Very high | 100 Ų | 100 | 98 Ų | 98 | 52% | 0.524 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -37.5 | 176.7 | -69.8 | 169.8 | 0 | 0 | 0 | 112.1 | H104 M112 | H104-L108 WeakPolarHBondContact O-CG 3.4Å; H104-L108 PolarHBondContact O-N 3.34Å; L108-M112 VanDerWaalsContact O-CB 3.26Å; L108-M112 WeakPolarHBondContact O-CB 3.45Å; L108-M112 VanDerWaalsContact O-CG 3.25Å; L108-M112 WeakPolarHBondContact O-CG 3.2Å; L108-M112 PolarHBondContact O-N 2.7Å |
| 109 | A | 98.6 | Very high | 98.6 | Very high | 53 Ų | 53 | 94.7 Ų | 94.7 | 44% | 0.438 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.3 | -42.6 | 173 | 0 | 0 | 0 | 0 | 0 | 111.4 | I105 S106 L107 M112 T113 | I105-A109 VanDerWaalsContact O-CB 3.29Å; I105-A109 WeakPolarHBondContact O-CB 3.41Å; I105-A109 PolarHBondContact O-N 2.83Å; S106-A109 PolarHBondContact O-N 3.26Å; L107-A109 VanDerWaalsContact C-N 3.29Å; L107-A109 PolarHBondContact O-N 3Å; A109-M112 PolarHBondContact O-N 2.88Å; A109-T113 WeakPolarHBondContact O-CG2 3.32Å; A109-T113 PolarHBondContact O-N 3.14Å |
| 110 | G | 98.6 | Very high | 98.6 | Very high | 28 Ų | 28 | 94.7 Ų | 94.7 | 29% | 0.289 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58 | -54 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | S106 L107 M112 T113 N114 | S106-G110 PolarHBondContact O-N 2.73Å; L107-G110 WeakPolarHBondContact O-CA 3.29Å; L107-G110 PolarHBondContact O-N 3.31Å; G110-M112 VanDerWaalsContact C-N 3.32Å; G110-M112 PolarHBondContact O-N 3.11Å; G110-T113 WeakPolarHBondContact O-CA 3.3Å; G110-T113 PolarHBondContact O-N 3.04Å; G110-T113 PolarHBondContact O-OG1 3.29Å; G110-N114 PolarHBondContact O-N 3.37Å |
| 111 | E | 98.5 | Very high | 98.5 | Very high | 99 Ų | 99 | 95.7 Ų | 95.7 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -55 | -47 | 175.1 | -69.1 | 177.2 | 159.5 | 0 | 0 | 111.4 | L107 T113 N114 L115 | L107-E111 HydrophobicContact CD2-CG 4.29Å; L107-E111 WeakPolarHBondContact CD2-OE1 3.42Å; L107-E111 PolarHBondContact O-N 3.43Å; E111-T113 PolarHBondContact O-N 2.7Å; E111-N114 PolarHBondContact O-N 2.99Å; E111-L115 WeakPolarHBondContact O-CG 3.44Å; E111-L115 PolarHBondContact O-N 2.64Å |
| 112 | M | 98.5 | Very high | 98.5 | Very high | 94 Ų | 94 | 97.3 Ų | 97.3 | 46% | 0.463 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64 | -22.3 | 174.9 | -75.8 | -66.2 | -64.9 | 0 | 0 | 113.8 | L108 A109 G110 L115 R116 | L108-M112 VanDerWaalsContact O-CB 3.26Å; L108-M112 WeakPolarHBondContact O-CB 3.45Å; L108-M112 VanDerWaalsContact O-CG 3.25Å; L108-M112 WeakPolarHBondContact O-CG 3.2Å; L108-M112 PolarHBondContact O-N 2.7Å; A109-M112 PolarHBondContact O-N 2.88Å; G110-M112 VanDerWaalsContact C-N 3.32Å; G110-M112 PolarHBondContact O-N 3.11Å; M112-L115 HydrophobicContact SD-CD1 4.44Å; M112-R116 VanDerWaalsContact C-NH1 3.27Å; M112-R116 WeakPolarHBondContact O-CD 3.29Å; M112-R116 WeakPolarHBondContact O-CG 3.38Å; M112-R116 PolarHBondContact O-NH1 3.25Å |
| 113 | T | 98.4 | Very high | 98.5 | Very high | 63 Ų | 63 | 98.5 Ų | 98.5 | 39% | 0.387 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -80 | -32.5 | 168.1 | 68.5 | 0 | 0 | 0 | 0 | 112.7 | A109 G110 E111 R116 K117 | A109-T113 WeakPolarHBondContact O-CG2 3.32Å; A109-T113 PolarHBondContact O-N 3.14Å; G110-T113 WeakPolarHBondContact O-CA 3.3Å; G110-T113 PolarHBondContact O-N 3.04Å; G110-T113 PolarHBondContact O-OG1 3.29Å; E111-T113 PolarHBondContact O-N 2.7Å; T113-R116 PolarHBondContact O-N 3.33Å; T113-K117 VanDerWaalsContact O-CG 3.31Å; T113-K117 WeakPolarHBondContact O-CG 3.44Å; T113-K117 PolarHBondContact O-N 2.92Å; T113-K117 VanDerWaalsContact O-N 3.13Å |
| 114 | N | 98.6 | Very high | 98.4 | Very high | 76 Ų | 76 | 97.9 Ų | 97.9 | 41% | 0.406 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -71.7 | -47.3 | 178.3 | -68.4 | -15.8 | 0 | 0 | 0 | 111.2 | G110 E111 R116 K117 E118 | G110-N114 PolarHBondContact O-N 3.37Å; E111-N114 PolarHBondContact O-N 2.99Å; N114-R116 PolarHBondContact O-N 2.9Å; N114-K117 WeakPolarHBondContact O-CA 3.36Å; N114-K117 WeakPolarHBondContact O-CB 3.29Å; N114-K117 PolarHBondContact O-N 3.34Å; N114-K117 PolarHBondContact OD1-NZ 2.99Å; N114-E118 PolarHBondContact O-N 3.04Å |
| 115 | L | 98.6 | Very high | 98.4 | Very high | 99 Ų | 99 | 94.4 Ų | 94.4 | 52% | 0.518 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57 | -34 | 173.2 | -68.4 | 172.5 | 0 | 0 | 0 | 112.5 | E111 M112 N119 | E111-L115 WeakPolarHBondContact O-CG 3.44Å; E111-L115 PolarHBondContact O-N 2.64Å; M112-L115 HydrophobicContact SD-CD1 4.44Å; L115-N119 WeakPolarHBondContact O-CB 3.35Å; L115-N119 PolarHBondContact O-N 3.37Å |
| 116 | R | 98.4 | Very high | 98.3 | Very high | 153 Ų | 153 | 93.8 Ų | 93.8 | 58% | 0.577 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -68.9 | -39.8 | 173 | -76.3 | 177.8 | -167.1 | 111.1 | -12.4 | 112.8 | M112 T113 N114 L120 | M112-R116 VanDerWaalsContact C-NH1 3.27Å; M112-R116 WeakPolarHBondContact O-CD 3.29Å; M112-R116 WeakPolarHBondContact O-CG 3.38Å; M112-R116 PolarHBondContact O-NH1 3.25Å; T113-R116 PolarHBondContact O-N 3.33Å; N114-R116 PolarHBondContact O-N 2.9Å; R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 PolarHBondContact O-N 2.87Å |
| 117 | K | 98.4 | Very high | 98.2 | Very high | 123 Ų | 123 | 92.6 Ų | 92.6 | 54% | 0.535 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.8 | -44.7 | 175.3 | -65.7 | 162 | -160.4 | 159.8 | 0 | 111 | T113 N114 L120 K121 | T113-K117 VanDerWaalsContact O-CG 3.31Å; T113-K117 WeakPolarHBondContact O-CG 3.44Å; T113-K117 PolarHBondContact O-N 2.92Å; T113-K117 VanDerWaalsContact O-N 3.13Å; N114-K117 WeakPolarHBondContact O-CA 3.36Å; N114-K117 WeakPolarHBondContact O-CB 3.29Å; N114-K117 PolarHBondContact O-N 3.34Å; N114-K117 PolarHBondContact OD1-NZ 2.99Å; K117-L120 PolarHBondContact O-N 3.39Å; K117-K121 PolarHBondContact O-N 3.35Å |
| 118 | E | 98.4 | Very high | 98.1 | Very high | 111 Ų | 111 | 91.2 Ų | 91.2 | 52% | 0.519 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.1 | -43.6 | 177.2 | -70.8 | 169.7 | -175.4 | 0 | 0 | 111.3 | N114 L120 K121 L122 | N114-E118 PolarHBondContact O-N 3.04Å; E118-L120 VanDerWaalsContact C-N 3.3Å; E118-L120 PolarHBondContact O-N 2.92Å; E118-K121 PolarHBondContact O-N 2.93Å; E118-L122 WeakPolarHBondContact O-CB 3.26Å; E118-L122 VanDerWaalsContact O-CG 3.28Å; E118-L122 WeakPolarHBondContact O-CG 3.48Å; E118-L122 PolarHBondContact O-N 3.34Å |
| 119 | N | 98.1 | Very high | 97.9 | Very high | 83 Ų | 83 | 92 Ų | 92 | 44% | 0.444 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.1 | -30.8 | 175.6 | -170.4 | -101.6 | 0 | 0 | 0 | 113.1 | L115 K123 | L115-N119 WeakPolarHBondContact O-CB 3.35Å; L115-N119 PolarHBondContact O-N 3.37Å; N119-K123 WeakPolarHBondContact O-CD 3.31Å; N119-K123 VanDerWaalsContact O-CG 3.3Å; N119-K123 WeakPolarHBondContact O-CG 3.36Å; N119-K123 PolarHBondContact O-N 3.42Å; N119-K123 VanDerWaalsContact OD1-CE 3.28Å; N119-K123 WeakPolarHBondContact OD1-CE 3.17Å; N119-K123 PolarHBondContact OD1-NZ 2.93Å |
| 120 | L | 98.5 | Very high | 97.7 | Very high | 97 Ų | 97 | 98 Ų | 98 | 51% | 0.508 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -69.2 | -50.7 | 171.5 | -178.9 | 63.9 | 0 | 0 | 0 | 110.8 | R116 K117 E118 L122 K123 E124 | R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 PolarHBondContact O-N 2.87Å; K117-L120 PolarHBondContact O-N 3.39Å; E118-L120 VanDerWaalsContact C-N 3.3Å; E118-L120 PolarHBondContact O-N 2.92Å; L120-L122 VanDerWaalsContact C-N 3.33Å; L120-L122 PolarHBondContact O-N 3.11Å; L120-K123 WeakPolarHBondContact O-CA 3.14Å; L120-K123 WeakPolarHBondContact O-CB 3.44Å; L120-K123 PolarHBondContact O-N 3.23Å; L120-E124 PolarHBondContact O-N 3.24Å |
| 121 | K | 98.3 | Very high | 97.5 | Very high | 123 Ų | 123 | 99.4 Ų | 99.4 | 54% | 0.535 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -56.6 | -45.7 | 176.6 | -169 | -157.1 | 166.5 | -164.4 | 0 | 111.7 | K117 E118 K123 E124 D125 | K117-K121 PolarHBondContact O-N 3.35Å; E118-K121 PolarHBondContact O-N 2.93Å; K121-K123 PolarHBondContact O-N 2.75Å; K121-E124 CarbonylContact O-C 3.58Å; K121-E124 WeakPolarHBondContact O-CA 3.4Å; K121-E124 WeakPolarHBondContact O-CB 3.41Å; K121-E124 PolarHBondContact O-N 3.08Å; K121-D125 WeakPolarHBondContact CE-OD2 3.25Å; K121-D125 IonicContact NZ-OD2 2.7Å; K121-D125 VanDerWaalsContact O-CG 3.32Å; K121-D125 PolarHBondContact O-N 3.12Å |
| 122 | L | 98.3 | Very high | 97.2 | Very high | 99 Ų | 99 | 98.1 Ų | 98.1 | 52% | 0.518 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -29.4 | 177.2 | -72 | 170.1 | 0 | 0 | 0 | 112.6 | E118 L120 I126 | E118-L122 WeakPolarHBondContact O-CB 3.26Å; E118-L122 VanDerWaalsContact O-CG 3.28Å; E118-L122 WeakPolarHBondContact O-CG 3.48Å; E118-L122 PolarHBondContact O-N 3.34Å; L120-L122 VanDerWaalsContact C-N 3.33Å; L120-L122 PolarHBondContact O-N 3.11Å; L122-I126 WeakPolarHBondContact O-CB 3.47Å; L122-I126 VanDerWaalsContact O-CD1 3.31Å; L122-I126 WeakPolarHBondContact O-CD1 3.44Å; L122-I126 WeakPolarHBondContact O-CG1 3.2Å; L122-I126 PolarHBondContact O-N 2.94Å |
| 123 | K | 98 | Very high | 96.7 | Very high | 122 Ų | 122 | 99.6 Ų | 99.6 | 53% | 0.53 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -72.7 | -37.8 | 171.9 | -74.9 | 162.6 | 174.8 | 159.4 | 0 | 112.1 | N119 L120 K121 A127 | N119-K123 WeakPolarHBondContact O-CD 3.31Å; N119-K123 VanDerWaalsContact O-CG 3.3Å; N119-K123 WeakPolarHBondContact O-CG 3.36Å; N119-K123 PolarHBondContact O-N 3.42Å; N119-K123 VanDerWaalsContact OD1-CE 3.28Å; N119-K123 WeakPolarHBondContact OD1-CE 3.17Å; N119-K123 PolarHBondContact OD1-NZ 2.93Å; L120-K123 WeakPolarHBondContact O-CA 3.14Å; L120-K123 WeakPolarHBondContact O-CB 3.44Å; L120-K123 PolarHBondContact O-N 3.23Å; K121-K123 PolarHBondContact O-N 2.75Å; K123-A127 VanDerWaalsContact O-CB 3.3Å; K123-A127 WeakPolarHBondContact O-CB 3.5Å; K123-A127 PolarHBondContact O-N 3.09Å |
| 124 | E | 97.8 | Very high | 96 | Very high | 110 Ų | 110 | 102.4 Ų | 102.4 | 51% | 0.514 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.2 | -46 | 173.9 | -66.2 | 164.3 | 178.9 | 0 | 0 | 110.8 | L120 K121 I126 A127 S128 | L120-E124 PolarHBondContact O-N 3.24Å; K121-E124 CarbonylContact O-C 3.58Å; K121-E124 WeakPolarHBondContact O-CA 3.4Å; K121-E124 WeakPolarHBondContact O-CB 3.41Å; K121-E124 PolarHBondContact O-N 3.08Å; E124-I126 PolarHBondContact O-N 2.95Å; E124-A127 PolarHBondContact O-N 3.27Å; E124-S128 WeakPolarHBondContact O-CB 3.28Å; E124-S128 PolarHBondContact O-N 2.92Å |
| 125 | D | 97.3 | Very high | 94.9 | Very high | 65 Ų | 65 | 102.4 Ų | 102.4 | 35% | 0.348 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58.7 | -45.9 | 174.2 | -67.2 | -31.7 | 0 | 0 | 0 | 110.9 | K121 S128 L129 | K121-D125 WeakPolarHBondContact CE-OD2 3.25Å; K121-D125 IonicContact NZ-OD2 2.7Å; K121-D125 VanDerWaalsContact O-CG 3.32Å; K121-D125 PolarHBondContact O-N 3.12Å; D125-S128 PolarHBondContact O-N 3.37Å; D125-L129 WeakPolarHBondContact O-CG 3.35Å; D125-L129 PolarHBondContact O-N 3.2Å |
| 126 | I | 97.3 | Very high | 93.5 | Very high | 87 Ų | 87 | 101.7 Ų | 101.7 | 45% | 0.446 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.6 | -39.9 | 175.7 | -73.4 | 165.6 | 0 | 0 | 0 | 112.2 | L122 E124 R130 | L122-I126 WeakPolarHBondContact O-CB 3.47Å; L122-I126 VanDerWaalsContact O-CD1 3.31Å; L122-I126 WeakPolarHBondContact O-CD1 3.44Å; L122-I126 WeakPolarHBondContact O-CG1 3.2Å; L122-I126 PolarHBondContact O-N 2.94Å; E124-I126 PolarHBondContact O-N 2.95Å; I126-R130 VanDerWaalsContact O-CG 3.32Å; I126-R130 WeakPolarHBondContact O-CG 3.28Å; I126-R130 PolarHBondContact O-N 3.07Å |
| 127 | A | 96.7 | Very high | 91.6 | Very high | 57 Ų | 57 | 96.8 Ų | 96.8 | 47% | 0.471 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.6 | -41.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | K123 E124 R130 A131 | K123-A127 VanDerWaalsContact O-CB 3.3Å; K123-A127 WeakPolarHBondContact O-CB 3.5Å; K123-A127 PolarHBondContact O-N 3.09Å; E124-A127 PolarHBondContact O-N 3.27Å; A127-R130 PolarHBondContact O-N 3.42Å; A127-A131 PolarHBondContact O-N 3.48Å |
| 128 | S | 96 | Very high | 89.5 | Confident | 73 Ų | 73 | 97.7 Ų | 97.7 | 51% | 0.51 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.1 | -49.4 | 173.8 | -174.3 | 0 | 0 | 0 | 0 | 111.6 | E124 D125 R130 A131 T132 | E124-S128 WeakPolarHBondContact O-CB 3.28Å; E124-S128 PolarHBondContact O-N 2.92Å; D125-S128 PolarHBondContact O-N 3.37Å; S128-R130 VanDerWaalsContact C-N 3.33Å; S128-R130 PolarHBondContact O-N 2.91Å; S128-A131 PolarHBondContact O-N 2.96Å; S128-A131 VanDerWaalsContact O-N 3.12Å; S128-T132 PolarHBondContact O-N 3.27Å |
| 129 | L | 95.6 | Very high | 87.4 | Confident | 117 Ų | 117 | 100.6 Ų | 100.6 | 61% | 0.613 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -59.9 | -41 | 178 | -72.8 | 166 | 0 | 0 | 0 | 112.2 | D125 T132 L133 | D125-L129 WeakPolarHBondContact O-CG 3.35Å; D125-L129 PolarHBondContact O-N 3.2Å; L129-T132 WeakPolarHBondContact CA-OG1 3.4Å; L129-T132 PolarHBondContact O-N 2.91Å; L129-T132 PolarHBondContact O-OG1 3.46Å; L129-L133 PolarHBondContact O-N 2.94Å |
| 130 | R | 94.4 | Very high | 84.9 | Confident | 179 Ų | 179 | 103 Ų | 103 | 68% | 0.675 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.3 | -44.1 | 173.9 | -73 | 173.6 | -177.8 | -165.2 | -0.1 | 112.2 | I126 A127 S128 T132 L133 E134 | I126-R130 VanDerWaalsContact O-CG 3.32Å; I126-R130 WeakPolarHBondContact O-CG 3.28Å; I126-R130 PolarHBondContact O-N 3.07Å; A127-R130 PolarHBondContact O-N 3.42Å; S128-R130 VanDerWaalsContact C-N 3.33Å; S128-R130 PolarHBondContact O-N 2.91Å; R130-T132 VanDerWaalsContact C-N 3.32Å; R130-T132 PolarHBondContact O-N 3.45Å; R130-L133 PolarHBondContact O-N 2.95Å; R130-E134 PolarHBondContact O-N 3.33Å |
| 131 | A | 93.1 | Very high | 82.3 | Confident | 57 Ų | 57 | 103.9 Ų | 103.9 | 47% | 0.471 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -62.7 | -37.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A127 S128 S135 | A127-A131 PolarHBondContact O-N 3.48Å; S128-A131 PolarHBondContact O-N 2.96Å; S128-A131 VanDerWaalsContact O-N 3.12Å; A131-S135 WeakPolarHBondContact O-CB 3.3Å; A131-S135 PolarHBondContact O-N 3.32Å; A131-S135 PolarHBondContact O-OG 3.31Å |
| 132 | T | 91.6 | Very high | 79.8 | Confident | 72 Ų | 72 | 105 Ų | 105 | 44% | 0.442 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -68.3 | -39.2 | 173.4 | 59 | 0 | 0 | 0 | 0 | 112.5 | S128 L129 R130 S135 C136 | S128-T132 PolarHBondContact O-N 3.27Å; L129-T132 WeakPolarHBondContact CA-OG1 3.4Å; L129-T132 PolarHBondContact O-N 2.91Å; L129-T132 PolarHBondContact O-OG1 3.46Å; R130-T132 VanDerWaalsContact C-N 3.32Å; R130-T132 PolarHBondContact O-N 3.45Å; T132-S135 PolarHBondContact O-N 2.91Å; T132-C136 PolarHBondContact O-N 3Å; T132-C136 PolarHBondContact O-SG 3.4Å; T132-C136 VanDerWaalsContact O-SG 3.37Å |
| 133 | L | 88.6 | Confident | 77.1 | Confident | 125 Ų | 125 | 108 Ų | 108 | 65% | 0.654 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -63.2 | -44 | 176.7 | 180 | 61.5 | 0 | 0 | 0 | 111.6 | L129 R130 C136 S137 | L129-L133 PolarHBondContact O-N 2.94Å; R130-L133 PolarHBondContact O-N 2.95Å; L133-C136 PolarHBondContact O-N 2.91Å; L133-S137 WeakPolarHBondContact O-CB 3.37Å; L133-S137 PolarHBondContact O-N 2.93Å |
| 134 | E | 83.9 | Confident | 74.1 | Confident | 122 Ų | 122 | 107.2 Ų | 107.2 | 57% | 0.57 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -62.4 | -44.3 | 175.9 | -152.2 | 68.2 | -106.1 | 0 | 0 | 111.1 | R130 C136 S137 E138 | R130-E134 PolarHBondContact O-N 3.33Å; E134-C136 VanDerWaalsContact C-N 3.28Å; E134-C136 PolarHBondContact O-N 2.76Å; E134-S137 VanDerWaalsContact O-CB 3.29Å; E134-S137 WeakPolarHBondContact O-CB 3.33Å; E134-S137 PolarHBondContact O-N 3.4Å; E134-S137 VanDerWaalsContact O-N 3.09Å; E134-E138 WeakPolarHBondContact O-CG 3.4Å; E134-E138 PolarHBondContact O-N 3.36Å |
| 135 | S | 76.3 | Confident | 71.6 | Confident | 76 Ų | 76 | 108.1 Ų | 108.1 | 53% | 0.531 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -62.1 | -33.6 | 177.3 | -57.3 | 0 | 0 | 0 | 0 | 112.9 | A131 T132 | A131-S135 WeakPolarHBondContact O-CB 3.3Å; A131-S135 PolarHBondContact O-N 3.32Å; A131-S135 PolarHBondContact O-OG 3.31Å; T132-S135 PolarHBondContact O-N 2.91Å |
| 136 | C | 67.8 | Low | 69 | Low | 85 Ų | 85 | 111.4 Ų | 111.4 | 57% | 0.574 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -78.8 | -30.1 | 173.4 | -69.7 | 0 | 0 | 0 | 0 | 113.1 | T132 L133 E134 H139 N140 | T132-C136 PolarHBondContact O-N 3Å; T132-C136 PolarHBondContact O-SG 3.4Å; T132-C136 VanDerWaalsContact O-SG 3.37Å; L133-C136 PolarHBondContact O-N 2.91Å; E134-C136 VanDerWaalsContact C-N 3.28Å; E134-C136 PolarHBondContact O-N 2.76Å; C136-H139 PolarHBondContact O-N 2.91Å; C136-N140 PolarHBondContact O-N 3.36Å |
| 137 | S | 58.9 | Low | 66.4 | Low | 50 Ų | 50 | 113.6 Ų | 113.6 | 35% | 0.35 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -62.1 | -52.6 | 173.6 | -172.5 | 0 | 0 | 0 | 0 | 110.5 | L133 E134 H139 N140 N141 | L133-S137 WeakPolarHBondContact O-CB 3.37Å; L133-S137 PolarHBondContact O-N 2.93Å; E134-S137 VanDerWaalsContact O-CB 3.29Å; E134-S137 WeakPolarHBondContact O-CB 3.33Å; E134-S137 PolarHBondContact O-N 3.4Å; E134-S137 VanDerWaalsContact O-N 3.09Å; S137-H139 PolarHBondContact O-N 2.96Å; S137-H139 VanDerWaalsContact O-N 3.16Å; S137-N140 PolarHBondContact O-N 3.43Å; S137-N141 PolarHBondContact O-N 2.93Å; S137-N141 PolarHBondContact O-ND2 3.33Å |
| 138 | E | 53.8 | Low | 63.4 | Low | 141 Ų | 141 | 119.1 Ų | 119.1 | 66% | 0.659 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -53.4 | -36.3 | 176.7 | -72.5 | -75.7 | 102.4 | 0 | 0 | 112.8 | E134 | E134-E138 WeakPolarHBondContact O-CG 3.4Å; E134-E138 PolarHBondContact O-N 3.36Å |
| 139 | H | 54.9 | Low | 60.9 | Low | 172 Ų | 172 | 121.6 Ų | 121.6 | 80% | 0.796 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -81.2 | -16.3 | 178.7 | -97.9 | 62 | 0 | 0 | 0 | 115.2 | C136 S137 | C136-H139 PolarHBondContact O-N 2.91Å; S137-H139 PolarHBondContact O-N 2.96Å; S137-H139 VanDerWaalsContact O-N 3.16Å |
| 140 | N | 45.4 | Very low | 58.1 | Low | 134 Ų | 134 | 126 Ų | 126 | 72% | 0.717 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -101.3 | -2.3 | -176 | -154.7 | 29.3 | 0 | 0 | 0 | 113.6 | C136 S137 N142 | C136-N140 PolarHBondContact O-N 3.36Å; S137-N140 PolarHBondContact O-N 3.43Å; N140-N142 PolarHBondContact O-N 3.03Å |
| 141 | N | 45.2 | Very low | 55.4 | Low | 115 Ų | 115 | 125.5 Ų | 125.5 | 62% | 0.615 | 69% | 0.685 | S | S | * | * | | | trans | -76 | 34.3 | 179.2 | -75.8 | -39.5 | 0 | 0 | 0 | 114.5 | S137 | S137-N141 PolarHBondContact O-N 2.93Å; S137-N141 PolarHBondContact O-ND2 3.33Å |
| 142 | N | 44.8 | Very low | 52.9 | Low | 148 Ų | 148 | 127.5 Ų | 127.5 | 79% | 0.791 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -119.3 | 44.3 | 170.7 | -88.4 | -47.9 | 0 | 0 | 0 | 111.5 | N140 | N140-N142 PolarHBondContact O-N 3.03Š|
| 143 | N | 41.2 | Very low | 51 | Low | 162 Ų | 162 | 130 Ų | 130 | 87% | 0.866 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -170.4 | 146 | 151.9 | -98.7 | -40 | 0 | 0 | 0 | 115 | | |
| 144 | S | 36.6 | Very low | 48.2 | Very low | 104 Ų | 104 | 130.7 Ų | 130.7 | 73% | 0.727 | 72% | 0.717 | S | S | * | * | | | trans | 75.1 | 88.4 | 150.7 | -164.5 | 0 | 0 | 0 | 0 | 122.3 | | |
| 145 | V | 44.6 | Very low | 46.1 | Very low | 129 Ų | 129 | 132.7 Ų | 132.7 | 78% | 0.782 | 73% | 0.731 | S | S | * | * | | | | 53.5 | 115.5 | 124.4 | -174.5 | 0 | 0 | 0 | 0 | 121.1 | | |
| 146 | D | 41.3 | Very low | 44.2 | Very low | 135 Ų | 135 | 136.5 Ų | 136.5 | 72% | 0.722 | 74% | 0.744 | S | S | * | * | | | trans | -13.5 | 117.4 | 148.1 | -178.2 | -1.4 | 0 | 0 | 0 | 118.2 | K148 | D146-K148 PolarHBondContact OD1-N 2.88Š|
| 147 | V | 42.8 | Very low | 42.5 | Very low | 133 Ų | 133 | 137.9 Ų | 137.9 | 81% | 0.806 | 76% | 0.755 | S | S | * | * | | | trans | -136.1 | 89 | 146.9 | -172.1 | 0 | 0 | 0 | 0 | 111.8 | | |
| 148 | K | 35.4 | Very low | 41.8 | Very low | 172 Ų | 172 | 141.4 Ų | 141.4 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | | | trans | -4.9 | 115.5 | 146.2 | -169 | 161.5 | -168.6 | 156.7 | 0 | 117.7 | D146 | D146-K148 PolarHBondContact OD1-N 2.88Š|
| 149 | P | 42.8 | Very low | 40.7 | Very low | 126 Ų | 126 | 138.2 Ų | 138.2 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | | | trans | -72.8 | 141.2 | 174.9 | 29.7 | -34.2 | 0 | 0 | 0 | 112.7 | | |
| 150 | K | 36.3 | Very low | 39.7 | Very low | 208 Ų | 208 | 135.2 Ų | 135.2 | 90% | 0.904 | 79% | 0.786 | S | S | * | * | | | trans | -108.5 | 153.7 | 167.6 | -80.2 | -162.8 | 174.4 | -173.1 | 0 | 111.1 | | |
| 151 | M | 37.3 | Very low | 39.5 | Very low | 170 Ų | 170 | 135.4 Ų | 135.4 | 84% | 0.837 | 79% | 0.792 | S | S | * | * | | | trans | -94.6 | 151.9 | -173.7 | -62.3 | 179.6 | 66.1 | 0 | 0 | 114 | | |
| 152 | S | 41.8 | Very low | 39.1 | Very low | 99 Ų | 99 | 134.5 Ų | 134.5 | 69% | 0.692 | 80% | 0.801 | S | S | * | * | | | trans | 70.6 | 162.8 | 148 | -65 | 0 | 0 | 0 | 0 | 117.8 | | |
| 153 | P | 51.7 | Low | 38.5 | Very low | 123 Ų | 123 | 135.7 Ų | 135.7 | 80% | 0.799 | 81% | 0.806 | S | S | * | * | | | cis | -127 | -175.8 | 11.1 | 42.8 | -27.3 | 0 | 0 | 0 | 116.8 | | |
| 154 | D | 29.3 | Very low | 38.4 | Very low | 141 Ų | 141 | 134.4 Ų | 134.4 | 75% | 0.754 | 80% | 0.804 | S | S | * | * | | | trans | -72.2 | 159.3 | -171.9 | -48.4 | -98.9 | 0 | 0 | 0 | 116.8 | | |
| 155 | L | 39 | Very low | 38.1 | Very low | 164 Ų | 164 | 134.1 Ų | 134.1 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | | | trans | -142.5 | 99.3 | 143.6 | -77.6 | -175.6 | 0 | 0 | 0 | 112.4 | | |
| 156 | L | 37 | Very low | 37.7 | Very low | 156 Ų | 156 | 134.1 Ų | 134.1 | 82% | 0.817 | 81% | 0.805 | S | S | * | * | | | trans | 48.3 | 107.7 | 141.1 | -55.9 | 173.7 | 0 | 0 | 0 | 121.3 | | |
| 157 | S | 31.6 | Very low | 37.2 | Very low | 114 Ų | 114 | 133.9 Ų | 133.9 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | | | | 21.4 | 164.6 | 115.9 | -107.7 | 0 | 0 | 0 | 0 | 122.6 | | |
| 158 | P | 44.3 | Very low | 36.9 | Very low | 124 Ų | 124 | 135.5 Ų | 135.5 | 81% | 0.805 | 81% | 0.81 | S | S | * | * | | | cis | -133 | 173.8 | -6.5 | 40 | -23.6 | 0 | 0 | 0 | 114.8 | | |
| 159 | G | 31.1 | Very low | 36.7 | Very low | 73 Ų | 73 | 132.6 Ų | 132.6 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | | | trans | 169.5 | 52.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | V161 | G159-V161 PolarHBondContact O-N 3.21Š|
| 160 | A | 34.5 | Very low | 36.2 | Very low | 109 Ų | 109 | 138.2 Ų | 138.2 | 90% | 0.901 | 82% | 0.817 | S | S | * | * | | | trans | -78.4 | 110.7 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | | |
| 161 | V | 42.1 | Very low | 35.8 | Very low | 138 Ų | 138 | 133.2 Ų | 133.2 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | | | trans | -112.8 | 108.9 | 161.8 | -78.4 | 0 | 0 | 0 | 0 | 109.3 | G159 | G159-V161 PolarHBondContact O-N 3.21Š|
| 162 | A | 35.6 | Very low | 35.3 | Very low | 97 Ų | 97 | 135.3 Ų | 135.3 | 80% | 0.802 | 81% | 0.806 | S | S | * | * | | | trans | -79.1 | 130.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 163 | L | 32.8 | Very low | 34.8 | Very low | 172 Ų | 172 | 137.8 Ų | 137.8 | 90% | 0.901 | 81% | 0.812 | S | S | * | * | | | trans | -72 | 136.4 | 164.9 | -74.2 | 108.1 | 0 | 0 | 0 | 110 | | |
| 164 | V | 37.7 | Very low | 33.8 | Very low | 136 Ų | 136 | 140 Ų | 140 | 82% | 0.824 | 81% | 0.811 | S | S | * | * | | | trans | -114.2 | 111.8 | 169.5 | 179.7 | 0 | 0 | 0 | 0 | 108.8 | | |
| 165 | S | 32.2 | Very low | 33.8 | Very low | 98 Ų | 98 | 141.6 Ų | 141.6 | 69% | 0.685 | 82% | 0.819 | S | S | * | * | | | trans | -80.1 | 140.1 | 168.9 | -62.5 | 0 | 0 | 0 | 0 | 110.2 | T167 | S165-T167 PolarHBondContact O-N 3.2Š|
| 166 | P | 36.3 | Very low | 33.4 | Very low | 129 Ų | 129 | 137.8 Ų | 137.8 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | | | trans | -79.6 | 111 | -179.9 | 30.7 | -33.3 | 0 | 0 | 0 | 111.6 | | |
| 167 | T | 30.6 | Very low | 33 | Very low | 129 Ų | 129 | 137.9 Ų | 137.9 | 79% | 0.791 | 81% | 0.813 | S | S | * | * | | | trans | -100.5 | 121.4 | 167.7 | -61 | 0 | 0 | 0 | 0 | 109.7 | S165 | S165-T167 PolarHBondContact O-N 3.2Š|
| 168 | I | 36.3 | Very low | 33 | Very low | 167 Ų | 167 | 135.8 Ų | 135.8 | 86% | 0.856 | 81% | 0.809 | S | S | * | * | | | trans | -78 | 124.8 | 173.7 | -61.8 | 168.8 | 0 | 0 | 0 | 108.8 | | |
| 169 | S | 29.8 | Very low | 32.4 | Very low | 111 Ų | 111 | 137 Ų | 137 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | | | trans | -126.1 | 153.4 | 173.6 | 59.2 | 0 | 0 | 0 | 0 | 111.4 | | |
| 170 | R | 32.5 | Very low | 32.3 | Very low | 245 Ų | 245 | 138.9 Ų | 138.9 | 93% | 0.925 | 81% | 0.805 | S | S | * | * | | | trans | -103.2 | 134 | -173.8 | -67 | 168 | 165.4 | 166.8 | -8.5 | 111.6 | | |
| 171 | S | 27.5 | Very low | 32 | Very low | 102 Ų | 102 | 141.7 Ų | 141.7 | 71% | 0.713 | 80% | 0.804 | S | S | * | * | | | trans | -94.7 | 140.9 | 132.7 | 48.6 | 0 | 0 | 0 | 0 | 107 | | |
| 172 | R | 27.8 | Very low | 31.6 | Very low | 214 Ų | 214 | 141 Ų | 141 | 81% | 0.808 | 80% | 0.8 | S | S | * | * | | | cis | 71.7 | 80 | 18.6 | -158.6 | -175.5 | -174.5 | 172 | 4 | 115 | | |
| 173 | D | 30.4 | Very low | 31.5 | Very low | 151 Ų | 151 | 145.9 Ų | 145.9 | 81% | 0.807 | 80% | 0.803 | S | S | * | * | | | trans | -109.1 | 154.1 | 153.9 | -64.6 | -67.3 | 0 | 0 | 0 | 110 | | |
| 174 | Q | 31.5 | Very low | 31.6 | Very low | 169 Ų | 169 | 142.8 Ų | 142.8 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | | | trans | -145.1 | 134.3 | 164.5 | -93.6 | -170.6 | 6.1 | 0 | 0 | 108.2 | | |
| 175 | L | 29.3 | Very low | 31.1 | Very low | 175 Ų | 175 | 144.7 Ų | 144.7 | 92% | 0.916 | 79% | 0.792 | S | S | * | * | | | trans | -146.9 | 144.6 | 152.7 | -141.1 | 78.9 | 0 | 0 | 0 | 108.5 | | |
| 176 | A | 31.7 | Very low | 31.1 | Very low | 84 Ų | 84 | 145.1 Ų | 145.1 | 69% | 0.694 | 80% | 0.801 | S | S | * | * | | | trans | -80.1 | 176.3 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109 | | |
| 177 | D | 27.4 | Very low | 30.8 | Very low | 159 Ų | 159 | 145.8 Ų | 145.8 | 85% | 0.85 | 80% | 0.798 | S | S | * | * | | | cis | -155.1 | 169 | 15 | -162.1 | -4.6 | 0 | 0 | 0 | 108.9 | | |
| 178 | G | 31.7 | Very low | 30.9 | Very low | 70 Ų | 70 | 147 Ų | 147 | 72% | 0.722 | 79% | 0.794 | S | S | * | * | | | trans | 165.6 | 2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 122.5 | | |
| 179 | D | 31.1 | Very low | 30.7 | Very low | 150 Ų | 150 | 150.9 Ų | 150.9 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | | | trans | 63.2 | 154.9 | 152.4 | -135.1 | -8.1 | 0 | 0 | 0 | 123.8 | | |
| 180 | V | 29.7 | Very low | 30.7 | Very low | 111 Ų | 111 | 149.4 Ų | 149.4 | 67% | 0.673 | 80% | 0.801 | S | S | * | * | | | trans | 50.1 | 104 | 164.2 | -167.1 | 0 | 0 | 0 | 0 | 121 | | |
| 181 | L | 27.4 | Very low | 30.6 | Very low | 168 Ų | 168 | 146.6 Ų | 146.6 | 88% | 0.88 | 80% | 0.798 | S | S | * | * | | | | -166.1 | 145.3 | 94.3 | -171.4 | 59.2 | 0 | 0 | 0 | 111.8 | | |
| 182 | V | 34.7 | Very low | 31.1 | Very low | 124 Ų | 124 | 150.5 Ų | 150.5 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | | | trans | -99.5 | 134 | -169.4 | 173.4 | 0 | 0 | 0 | 0 | 113.1 | | |
| 183 | K | 34.4 | Very low | 31.7 | Very low | 199 Ų | 199 | 147.3 Ų | 147.3 | 87% | 0.865 | 81% | 0.809 | S | S | * | * | | | trans | -154.2 | 130.4 | 136.3 | -136.8 | 168.4 | -177.9 | 173.1 | 0 | 116.2 | | |
| 184 | T | 34.2 | Very low | 31.7 | Very low | 107 Ų | 107 | 147.6 Ų | 147.6 | 66% | 0.656 | 81% | 0.806 | S | S | * | * | | | trans | -56.6 | 167.2 | 158 | 31.8 | 0 | 0 | 0 | 0 | 112.6 | | |
| 185 | E | 27 | Very low | 31.9 | Very low | 177 Ų | 177 | 146 Ų | 146 | 83% | 0.827 | 81% | 0.812 | S | S | * | * | | | cis | 177.8 | 144.5 | -2 | 158.5 | 179.6 | -155.3 | 0 | 0 | 107.1 | | |
| 186 | A | 32.1 | Very low | 32.4 | Very low | 107 Ų | 107 | 149.1 Ų | 149.1 | 88% | 0.884 | 81% | 0.811 | S | S | * | * | | | trans | -167.2 | 150.5 | 163.9 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 187 | D | 29.2 | Very low | 32.6 | Very low | 143 Ų | 143 | 152 Ų | 152 | 77% | 0.765 | 81% | 0.814 | S | S | * | * | | | trans | -87.8 | 165.1 | -153.1 | -157.7 | 22.5 | 0 | 0 | 0 | 118 | | |
| 188 | H | 33 | Very low | 32.9 | Very low | 154 Ų | 154 | 152.7 Ų | 152.7 | 71% | 0.713 | 82% | 0.817 | S | S | * | * | | | trans | -32.7 | 157.8 | 172.1 | -67.4 | -48.7 | 0 | 0 | 0 | 124 | | |
| 189 | R | 32.1 | Very low | 33.5 | Very low | 248 Ų | 248 | 161.1 Ų | 161.1 | 94% | 0.936 | 83% | 0.827 | S | S | * | * | | | trans | 77.8 | 134.5 | 147.2 | -83.7 | -165.9 | -67.7 | -132.5 | -1.4 | 121.3 | | |
| 190 | G | 29.6 | Very low | 33.4 | Very low | 81 Ų | 81 | 165.4 Ų | 165.4 | 84% | 0.835 | 83% | 0.832 | S | S | * | * | | | trans | 171.1 | 129.2 | 165.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 191 | E | 30.2 | Very low | 33.6 | Very low | 185 Ų | 185 | 165.9 Ų | 165.9 | 86% | 0.864 | 84% | 0.835 | S | S | * | * | | | trans | -94.6 | 159.2 | -178.2 | -74.6 | 166.9 | 123.4 | 0 | 0 | 112.7 | | |
| 192 | E | 39.7 | Very low | 33.7 | Very low | 185 Ų | 185 | 165.1 Ų | 165.1 | 86% | 0.864 | 83% | 0.832 | S | S | * | * | | | trans | 19.1 | 99.2 | 156.6 | -57.9 | -172.9 | 168.2 | 0 | 0 | 119.6 | | |
| 193 | T | 40.1 | Very low | 33.6 | Very low | 146 Ų | 146 | 167.9 Ų | 167.9 | 90% | 0.896 | 84% | 0.837 | S | S | * | * | | | trans | -169 | 63.8 | 145.6 | 11.3 | 0 | 0 | 0 | 0 | 116.3 | | |
| 194 | E | 30 | Very low | 33.3 | Very low | 157 Ų | 157 | 163.9 Ų | 163.9 | 73% | 0.734 | 83% | 0.834 | S | S | * | * | | | trans | -143.5 | 88.3 | 158.8 | -155.1 | 166 | -157 | 0 | 0 | 115.9 | | |
| 195 | C | 34.9 | Very low | 33.1 | Very low | 136 Ų | 136 | 163.9 Ų | 163.9 | 92% | 0.919 | 84% | 0.838 | S | S | * | * | S | Bend | trans | -136.5 | 33.2 | 167.3 | -87.1 | 0 | 0 | 0 | 0 | 111.9 | | |
| 196 | R | 40.1 | Very low | 33.3 | Very low | 240 Ų | 240 | 165.3 Ų | 165.3 | 91% | 0.906 | 84% | 0.842 | S | S | * | * | | | trans | -133.5 | 7.1 | -174.2 | -80.4 | -163.9 | 172.2 | -147.8 | 0.5 | 117.2 | | |
| 197 | L | 36.5 | Very low | 33.2 | Very low | 144 Ų | 144 | 168.4 Ų | 168.4 | 75% | 0.754 | 84% | 0.839 | S | S | * | * | S | Bend | trans | -114.2 | 32.1 | -175 | -145.2 | 77.1 | 0 | 0 | 0 | 116.7 | | |
| 198 | L | 34.1 | Very low | 33.5 | Very low | 175 Ų | 175 | 167.5 Ų | 167.5 | 92% | 0.916 | 84% | 0.838 | S | S | * | * | S | Bend | trans | -143.1 | 39.7 | 174.3 | -112.6 | 167.4 | 0 | 0 | 0 | 114.2 | | |
| 199 | R | 42.8 | Very low | 33.4 | Very low | 247 Ų | 247 | 170.6 Ų | 170.6 | 93% | 0.932 | 85% | 0.845 | S | S | * | * | | | trans | -129.3 | 43 | -178.1 | -146.4 | -176.5 | -153.8 | -139.9 | 7 | 115.7 | | |
| 200 | R | 30.3 | Very low | 33.4 | Very low | 239 Ų | 239 | 167.2 Ų | 167.2 | 90% | 0.902 | 84% | 0.837 | S | S | * | * | | | trans | -158.7 | 125.8 | 165.7 | -92.5 | 177.2 | 178.2 | 162.9 | -0.9 | 104.6 | | |
| 201 | T | 32.7 | Very low | 33.5 | Very low | 121 Ų | 121 | 169.3 Ų | 169.3 | 74% | 0.742 | 84% | 0.836 | S | S | * | * | | | cis | -151.6 | 177.8 | 33.5 | 50.1 | 0 | 0 | 0 | 0 | 108.7 | | |
| 202 | N | 29.6 | Very low | 33.6 | Very low | 153 Ų | 153 | 169.1 Ų | 169.1 | 82% | 0.818 | 84% | 0.835 | S | S | * | * | | | cis | -129.5 | 156.6 | 4.2 | -98.2 | -56.5 | 0 | 0 | 0 | 110.3 | | |
| 203 | Q | 33.4 | Very low | 33.8 | Very low | 181 Ų | 181 | 165.9 Ų | 165.9 | 85% | 0.846 | 83% | 0.83 | S | S | * | * | | | trans | -140.6 | 158.5 | 171 | -169.6 | 177.8 | 10.3 | 0 | 0 | 108.8 | | |
| 204 | S | 28.6 | Very low | 33.4 | Very low | 116 Ų | 116 | 165.2 Ų | 165.2 | 81% | 0.811 | 83% | 0.826 | S | S | * | * | | | trans | 75.2 | 146.9 | -171.8 | 82.5 | 0 | 0 | 0 | 0 | 114.6 | | |
| 205 | S | 28.8 | Very low | 33.6 | Very low | 106 Ų | 106 | 165.8 Ų | 165.8 | 74% | 0.741 | 83% | 0.833 | S | S | * | * | | | cis | -135.3 | 149.2 | -6 | 49 | 0 | 0 | 0 | 0 | 111.1 | | |
| 206 | F | 32.2 | Very low | 33.4 | Very low | 207 Ų | 207 | 164 Ų | 164 | 91% | 0.908 | 83% | 0.828 | S | S | * | * | | | trans | -101.2 | 105 | 171.5 | -132 | -88.2 | 0 | 0 | 0 | 107.4 | | |
| 207 | E | 29.7 | Very low | 32.9 | Very low | 173 Ų | 173 | 157.6 Ų | 157.6 | 81% | 0.808 | 82% | 0.82 | S | S | * | * | | | trans | -98.3 | 111.4 | -178.3 | -166 | 151.4 | -126.3 | 0 | 0 | 110.5 | Y209 | E207-Y209 PolarHBondContact O-N 3.48Š|
| 208 | V | 35.7 | Very low | 32.5 | Very low | 123 Ų | 123 | 156 Ų | 156 | 75% | 0.745 | 82% | 0.821 | S | S | * | * | | | trans | -82 | 99.9 | -172.3 | 178.2 | 0 | 0 | 0 | 0 | 110.1 | K210 | V208-K210 PolarHBondContact O-N 2.91Š|
| 209 | Y | 30.7 | Very low | 32.4 | Very low | 220 Ų | 220 | 159.1 Ų | 159.1 | 86% | 0.863 | 82% | 0.821 | S | S | * | * | | | trans | -75.5 | 113.8 | 177 | -135.3 | -89.7 | 0 | 0 | 0 | 111.6 | E207 | E207-Y209 PolarHBondContact O-N 3.48Š|
| 210 | K | 31 | Very low | 31.6 | Very low | 176 Ų | 176 | 155.1 Ų | 155.1 | 77% | 0.765 | 81% | 0.81 | S | S | * | * | | | trans | -72.8 | 134 | 169.1 | -77 | -179.7 | 174.9 | 176.8 | 0 | 110.2 | V208 | V208-K210 PolarHBondContact O-N 2.91Š|
| 211 | P | 33.3 | Very low | 31.7 | Very low | 125 Ų | 125 | 149.5 Ų | 149.5 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | | | trans | -78.7 | 128.5 | 161.4 | 31.7 | -30.9 | 0 | 0 | 0 | 110.2 | | |
| 212 | Q | 31.9 | Very low | 31.4 | Very low | 181 Ų | 181 | 150.7 Ų | 150.7 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | | | trans | -140.2 | 155.1 | 158.4 | -100.2 | -135.1 | -40.6 | 0 | 0 | 110.5 | | |
| 213 | P | 43.7 | Very low | 31.5 | Very low | 117 Ų | 117 | 151.8 Ų | 151.8 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | | | trans | -92.3 | 124.6 | -145.2 | 32.9 | -35.1 | 0 | 0 | 0 | 114.4 | | |
| 214 | T | 31.8 | Very low | 31.1 | Very low | 133 Ų | 133 | 153.7 Ų | 153.7 | 82% | 0.816 | 80% | 0.799 | S | S | * | * | | | trans | -95.2 | 107.2 | 160.8 | 30.4 | 0 | 0 | 0 | 0 | 110.8 | | |
| 215 | L | 32.8 | Very low | 31.4 | Very low | 169 Ų | 169 | 153.1 Ų | 153.1 | 89% | 0.885 | 79% | 0.79 | S | S | * | * | | | trans | 34.6 | 111.6 | 150 | -73.3 | 150.1 | 0 | 0 | 0 | 118.1 | | |
| 216 | A | 31 | Very low | 31.4 | Very low | 99 Ų | 99 | 154.6 Ų | 154.6 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | | | trans | -57.1 | 139.1 | 173 | 0 | 0 | 0 | 0 | 0 | 113 | S218 | A216-S218 PolarHBondContact O-N 2.88Å; A216-S218 VanDerWaalsContact O-N 3.09Å |
| 217 | S | 31 | Very low | 31.5 | Very low | 104 Ų | 104 | 155.8 Ų | 155.8 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | | | trans | -68.8 | 100.4 | 165.9 | 40.8 | 0 | 0 | 0 | 0 | 109.8 | W219 | S217-W219 PolarHBondContact O-N 2.89Š|
| 218 | S | 28.4 | Very low | 31.3 | Very low | 112 Ų | 112 | 151.6 Ų | 151.6 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | | | trans | -67.3 | 117.7 | 176 | 54.2 | 0 | 0 | 0 | 0 | 110.5 | A216 K220 | A216-S218 PolarHBondContact O-N 2.88Å; A216-S218 VanDerWaalsContact O-N 3.09Å; S218-K220 PolarHBondContact O-N 2.97Å |
| 219 | W | 30.2 | Very low | 31 | Very low | 240 Ų | 240 | 149.2 Ų | 149.2 | 91% | 0.909 | 79% | 0.792 | S | S | * | * | | | trans | -69.1 | 124.9 | 172.2 | -68.4 | 25.8 | 0 | 0 | 0 | 108.4 | S217 | S217-W219 PolarHBondContact O-N 2.89Š|
| 220 | K | 27.2 | Very low | 30.8 | Very low | 163 Ų | 163 | 146 Ų | 146 | 71% | 0.709 | 79% | 0.785 | S | S | * | * | | | trans | -127.2 | 93.6 | 170.7 | -116.1 | -165.6 | 175.5 | -157.6 | 0 | 111.4 | S218 E222 | S218-K220 PolarHBondContact O-N 2.97Å; K220-E222 WeakPolarHBondContact CD-OE1 3.48Å; K220-E222 WeakPolarHBondContact CE-OE1 3.31Å; K220-E222 IonicContact NZ-OE1 3.84Å; K220-E222 PolarHBondContact NZ-OE1 3Å |
| 221 | T | 32.3 | Very low | 30.8 | Very low | 120 Ų | 120 | 145.5 Ų | 145.5 | 74% | 0.736 | 78% | 0.783 | S | S | * | * | | | trans | -76.3 | 117.2 | 159 | -58.1 | 0 | 0 | 0 | 0 | 108.2 | | |
| 222 | E | 26.3 | Very low | 30.6 | Very low | 147 Ų | 147 | 144.2 Ų | 144.2 | 69% | 0.687 | 78% | 0.777 | S | S | * | * | | | trans | -121.6 | 89.8 | 168.5 | -72.9 | -167.5 | -173.7 | 0 | 0 | 110.8 | K220 | K220-E222 WeakPolarHBondContact CD-OE1 3.48Å; K220-E222 WeakPolarHBondContact CE-OE1 3.31Å; K220-E222 IonicContact NZ-OE1 3.84Å; K220-E222 PolarHBondContact NZ-OE1 3Å |
| 223 | H | 31.3 | Very low | 30.7 | Very low | 176 Ų | 176 | 142.8 Ų | 142.8 | 82% | 0.815 | 77% | 0.773 | S | S | * | * | | | trans | -78.2 | 131.6 | 148.9 | -80.3 | -82.3 | 0 | 0 | 0 | 108.3 | | |
| 224 | R | 25.6 | Very low | 30.1 | Very low | 220 Ų | 220 | 145.4 Ų | 145.4 | 83% | 0.83 | 78% | 0.775 | S | S | * | * | | | trans | -142.8 | 132 | 148.8 | -136.1 | -174.6 | -161 | -75.8 | 2.8 | 112.3 | | |
| 225 | V | 34.3 | Very low | 30 | Very low | 104 Ų | 104 | 143.9 Ų | 143.9 | 63% | 0.63 | 78% | 0.776 | S | S | * | * | | | trans | -105.7 | 142.6 | 167.5 | 169.8 | 0 | 0 | 0 | 0 | 108 | R227 | V225-R227 HydrophobicContact CG1-CG 4.14Š|
| 226 | N | 29.2 | Very low | 30 | Very low | 138 Ų | 138 | 142.8 Ų | 142.8 | 74% | 0.738 | 77% | 0.77 | S | S | * | * | | | trans | -163.6 | 133.5 | 136.9 | -96.5 | -4.1 | 0 | 0 | 0 | 106.5 | | |
| 227 | R | 33.9 | Very low | 30 | Very low | 232 Ų | 232 | 145.2 Ų | 145.2 | 88% | 0.875 | 77% | 0.77 | S | S | * | * | | | cis | 75.2 | 139.1 | 34.3 | -76.9 | -160.4 | 171.1 | -142.5 | 1.3 | 115.7 | V225 | V225-R227 HydrophobicContact CG1-CG 4.14Š|
| 228 | G | 25.6 | Very low | 30.2 | Very low | 85 Ų | 85 | 147.7 Ų | 147.7 | 88% | 0.876 | 77% | 0.769 | S | S | * | * | | | trans | 91.2 | 122.1 | -164.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 229 | G | 28.2 | Very low | 30.3 | Very low | 73 Ų | 73 | 150.6 Ų | 150.6 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | | | cis | 171.2 | 163.8 | 3.8 | 0 | 0 | 0 | 0 | 0 | 105.8 | | |
| 230 | E | 27.8 | Very low | 30.2 | Very low | 151 Ų | 151 | 144 Ų | 144 | 71% | 0.706 | 76% | 0.761 | S | S | * | * | | | cis | -157.5 | 172.2 | 12.4 | -46.5 | 170.9 | 90.9 | 0 | 0 | 109.2 | | |
| 231 | K | 31.5 | Very low | 30.4 | Very low | 167 Ų | 167 | 141.6 Ų | 141.6 | 73% | 0.726 | 76% | 0.764 | S | S | * | * | | | trans | 65.2 | 155.1 | 151.2 | -67.7 | 153.9 | -166.8 | 161.3 | 0 | 118.4 | | |
| 232 | S | 28.5 | Very low | 30.3 | Very low | 98 Ų | 98 | 143.4 Ų | 143.4 | 69% | 0.685 | 77% | 0.768 | S | S | * | * | | | cis | -167.6 | 165.1 | -29.8 | -156.3 | 0 | 0 | 0 | 0 | 110.7 | | |
| 233 | I | 32.9 | Very low | 30.5 | Very low | 151 Ų | 151 | 144.7 Ų | 144.7 | 77% | 0.774 | 77% | 0.774 | S | S | * | * | | | trans | 73.1 | 141.6 | 158.8 | -70.7 | 154.6 | 0 | 0 | 0 | 118.5 | | |
| 234 | E | 32.5 | Very low | 30.4 | Very low | 172 Ų | 172 | 142.6 Ų | 142.6 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | | | trans | -81.1 | 159.2 | 175.7 | -50.6 | 107 | 119.6 | 0 | 0 | 114.2 | | |
| 235 | A | 28.2 | Very low | 30.6 | Very low | 100 Ų | 100 | 139.3 Ų | 139.3 | 83% | 0.826 | 77% | 0.772 | S | S | * | * | | | trans | -144.5 | 132.3 | 147.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 236 | L | 34.8 | Very low | 30.5 | Very low | 147 Ų | 147 | 142.9 Ų | 142.9 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | | | trans | -72.1 | 146.5 | 164.1 | -126.2 | 69.7 | 0 | 0 | 0 | 108.5 | | |
| 237 | D | 29 | Very low | 30.5 | Very low | 150 Ų | 150 | 144.3 Ų | 144.3 | 80% | 0.802 | 79% | 0.788 | S | S | * | * | | | | -158.9 | 151.8 | 113.1 | -119.2 | -22.1 | 0 | 0 | 0 | 113.3 | | |
| 238 | Q | 36.5 | Very low | 30.4 | Very low | 155 Ų | 155 | 143.5 Ų | 143.5 | 72% | 0.724 | 79% | 0.785 | S | S | * | * | | | trans | -101.7 | 154.6 | 166.1 | -57.5 | 175.2 | 9.3 | 0 | 0 | 107.6 | | |
| 239 | H | 29.6 | Very low | 30.5 | Very low | 174 Ų | 174 | 148.1 Ų | 148.1 | 81% | 0.806 | 78% | 0.781 | S | S | * | * | | | trans | 177.6 | 121.1 | 135.1 | -95.1 | -60.8 | 0 | 0 | 0 | 113.8 | | |
| 240 | S | 29.4 | Very low | 30.4 | Very low | 101 Ų | 101 | 153 Ų | 153 | 71% | 0.706 | 78% | 0.781 | S | S | * | * | | | trans | 39.2 | 107.7 | 145.9 | 56.2 | 0 | 0 | 0 | 0 | 122.4 | | |
| 241 | S | 31.6 | Very low | 30.5 | Very low | 112 Ų | 112 | 150.2 Ų | 150.2 | 78% | 0.783 | 78% | 0.778 | S | S | * | * | | | | 4.9 | 138.1 | 126.9 | -44.4 | 0 | 0 | 0 | 0 | 121.3 | | |
| 242 | I | 30.2 | Very low | 30.4 | Very low | 158 Ų | 158 | 147.7 Ų | 147.7 | 81% | 0.81 | 78% | 0.781 | S | S | * | * | | | trans | -136.8 | 132.3 | 133 | -67.5 | -170.6 | 0 | 0 | 0 | 109.9 | | |
| 243 | H | 30.2 | Very low | 30.6 | Very low | 174 Ų | 174 | 148 Ų | 148 | 81% | 0.806 | 78% | 0.783 | S | S | * | * | | | trans | -92.3 | 143.5 | 162.5 | -92.6 | -98.8 | 0 | 0 | 0 | 109.9 | | |
| 244 | T | 28.3 | Very low | 30.7 | Very low | 133 Ų | 133 | 146.1 Ų | 146.1 | 82% | 0.816 | 78% | 0.784 | S | S | * | * | | | trans | -127.1 | 122.1 | 168.2 | -46.6 | 0 | 0 | 0 | 0 | 110.6 | | |
| 245 | L | 29.2 | Very low | 31.4 | Very low | 150 Ų | 150 | 143.8 Ų | 143.8 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | | | trans | -91.7 | 169.7 | -179 | -109.2 | 96.9 | 0 | 0 | 0 | 113.3 | | |
| 246 | H | 34.3 | Very low | 31.5 | Very low | 180 Ų | 180 | 145.1 Ų | 145.1 | 83% | 0.833 | 79% | 0.787 | S | S | * | * | | | trans | -51.9 | 154.3 | 172.5 | -64 | -64.8 | 0 | 0 | 0 | 114.5 | | |
| 247 | L | 27.4 | Very low | 31.4 | Very low | 167 Ų | 167 | 141.6 Ų | 141.6 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | | | trans | -134.6 | 149 | 151.6 | -152.5 | 74.3 | 0 | 0 | 0 | 111.8 | | |
| 248 | R | 32 | Very low | 31.8 | Very low | 216 Ų | 216 | 143.2 Ų | 143.2 | 82% | 0.815 | 79% | 0.789 | S | S | * | * | | | trans | -144.6 | 127.9 | -167.8 | 178.8 | -170.4 | -178.5 | -149.2 | 4.6 | 111.2 | | |
| 249 | K | 27.9 | Very low | 31.9 | Very low | 181 Ų | 181 | 142.3 Ų | 142.3 | 79% | 0.787 | 79% | 0.794 | S | S | * | * | | | trans | -138.4 | 138.1 | 168.6 | -63.8 | -178.2 | 178.1 | 179.1 | 0 | 107.5 | | |
| 250 | K | 26.1 | Very low | 32.5 | Very low | 177 Ų | 177 | 144.8 Ų | 144.8 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | | | cis | 72.2 | 125 | 32.5 | -68.1 | -166.8 | 172.8 | -174.3 | 0 | 113.5 | | |
| 251 | S | 29.6 | Very low | 33.1 | Very low | 91 Ų | 91 | 145.5 Ų | 145.5 | 64% | 0.636 | 80% | 0.798 | S | S | * | * | | | cis | -164.8 | 165.2 | -2.2 | -75.7 | 0 | 0 | 0 | 0 | 111.5 | | |
| 252 | S | 30.6 | Very low | 33.5 | Very low | 114 Ų | 114 | 146 Ų | 146 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | | | trans | 60.9 | 156 | 147.8 | 44.9 | 0 | 0 | 0 | 0 | 119.3 | | |
| 253 | S | 33 | Very low | 34 | Very low | 104 Ų | 104 | 149.4 Ų | 149.4 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | | | cis | 177.8 | 157.9 | -8.9 | 46.9 | 0 | 0 | 0 | 0 | 106.3 | | |
| 254 | S | 33.8 | Very low | 34.5 | Very low | 112 Ų | 112 | 146.5 Ų | 146.5 | 78% | 0.783 | 80% | 0.801 | S | S | * | * | | | cis | -172 | -160.3 | -8.2 | -82.5 | 0 | 0 | 0 | 0 | 104.8 | | |
| 255 | P | 47.5 | Very low | 35.3 | Very low | 124 Ų | 124 | 145.5 Ų | 145.5 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | | | cis | -134.4 | -145.7 | -7.4 | 45.6 | -25.4 | 0 | 0 | 0 | 113.2 | | |
| 256 | S | 30.4 | Very low | 35.8 | Very low | 128 Ų | 128 | 145.8 Ų | 145.8 | 90% | 0.895 | 80% | 0.795 | S | S | * | * | | | trans | 82.4 | 148.4 | 167.9 | -154.5 | 0 | 0 | 0 | 0 | 118.5 | | |
| 257 | G | 32.3 | Very low | 36.3 | Very low | 73 Ų | 73 | 144.9 Ų | 144.9 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | | | trans | 95.2 | 93 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 258 | E | 38.3 | Very low | 37.3 | Very low | 184 Ų | 184 | 141.1 Ų | 141.1 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | | | trans | -99.2 | 110.8 | 176.9 | 178.8 | 170.9 | -142.5 | 0 | 0 | 112.2 | | |
| 259 | V | 39.1 | Very low | 38.1 | Very low | 136 Ų | 136 | 136.8 Ų | 136.8 | 82% | 0.824 | 78% | 0.784 | S | S | * | * | | | trans | -143.3 | 132.9 | 161.3 | -177.4 | 0 | 0 | 0 | 0 | 109.6 | | |
| 260 | R | 42.2 | Very low | 39.3 | Very low | 226 Ų | 226 | 135.1 Ų | 135.1 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 128.2 | 175 | -75.9 | -77.5 | -176.7 | 118.7 | 2.2 | 111.5 | | |
| 261 | P | 40.4 | Very low | 40 | Very low | 116 Ų | 116 | 132.1 Ų | 132.1 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 137.2 | 147.8 | 33 | -27.4 | 0 | 0 | 0 | 110.7 | | |
| 262 | S | 40 | Very low | 40.9 | Very low | 122 Ų | 122 | 133.5 Ų | 133.5 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 144.2 | 179.7 | -62.9 | 0 | 0 | 0 | 0 | 112.3 | | |
| 263 | R | 42.3 | Very low | 41.9 | Very low | 230 Ų | 230 | 136.2 Ų | 136.2 | 87% | 0.868 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 132.8 | 170.1 | -68.8 | -175 | 176.7 | -156 | -0.9 | 110.3 | V265 | R263-V265 PolarHBondContact O-N 3.25Š|
| 264 | P | 40.2 | Very low | 42.4 | Very low | 112 Ų | 112 | 137.2 Ų | 137.2 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 124.4 | 161.6 | 29.2 | -31.7 | 0 | 0 | 0 | 109.4 | I266 | P264-I266 PolarHBondContact O-N 3.02Š|
| 265 | V | 44.1 | Very low | 43.3 | Very low | 113 Ų | 113 | 140.8 Ų | 140.8 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | | | trans | -83.8 | 104.6 | 169.7 | 177.7 | 0 | 0 | 0 | 0 | 107.7 | R263 H267 | R263-V265 PolarHBondContact O-N 3.25Å; V265-H267 PolarHBondContact O-N 2.75Å; V265-H267 VanDerWaalsContact O-N 3.12Å |
| 266 | I | 39.9 | Very low | 43.1 | Very low | 155 Ų | 155 | 140.9 Ų | 140.9 | 80% | 0.795 | 80% | 0.795 | S | S | * | * | | | trans | -78.1 | 97.9 | 176.2 | -56.6 | 177.8 | 0 | 0 | 0 | 108.2 | P264 | P264-I266 PolarHBondContact O-N 3.02Š|
| 267 | H | 45.8 | Very low | 43.5 | Very low | 161 Ų | 161 | 142.5 Ų | 142.5 | 75% | 0.745 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 124.9 | 167.6 | -75.9 | -92.8 | 0 | 0 | 0 | 109.8 | V265 | V265-H267 PolarHBondContact O-N 2.75Å; V265-H267 VanDerWaalsContact O-N 3.12Å |
| 268 | A | 47.6 | Very low | 44 | Very low | 89 Ų | 89 | 148.6 Ų | 148.6 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 128.9 | 167.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 269 | P | 49.3 | Very low | 44 | Very low | 124 Ų | 124 | 146.1 Ų | 146.1 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 137.2 | 178.9 | 28.2 | -33.7 | 0 | 0 | 0 | 111.2 | | |
| 270 | I | 53 | Low | 43.7 | Very low | 147 Ų | 147 | 142.7 Ų | 142.7 | 75% | 0.754 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -71 | 136.8 | 175.6 | -61.1 | 170.9 | 0 | 0 | 0 | 109 | C272 | I270-C272 PolarHBondContact O-N 2.94Š|
| 271 | P | 40.6 | Very low | 43.8 | Very low | 113 Ų | 113 | 139 Ų | 139 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | | | trans | -63.1 | 105.9 | 174.4 | -23.1 | 34.5 | 0 | 0 | 0 | 112.1 | H273 | P271-H273 PolarHBondContact O-N 3.13Š|
| 272 | C | 49.1 | Very low | 43.5 | Very low | 121 Ų | 121 | 140.2 Ų | 140.2 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 116.4 | 173.8 | -70.8 | 0 | 0 | 0 | 0 | 110.7 | I270 | I270-C272 PolarHBondContact O-N 2.94Š|
| 273 | H | 51.8 | Low | 43.5 | Very low | 171 Ų | 171 | 139.9 Ų | 139.9 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -64 | 139.3 | 169.5 | -65.6 | -89.7 | 0 | 0 | 0 | 110.8 | P271 K275 | P271-H273 PolarHBondContact O-N 3.13Å; H273-K275 PolarHBondContact O-N 2.81Å |
| 274 | P | 43 | Very low | 43.2 | Very low | 125 Ų | 125 | 136.8 Ų | 136.8 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 127.3 | 175 | 27.6 | -33.7 | 0 | 0 | 0 | 110.2 | | |
| 275 | K | 52.1 | Low | 43.4 | Very low | 187 Ų | 187 | 135.9 Ų | 135.9 | 81% | 0.813 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 146.6 | 172.6 | -68.5 | -179 | 179.4 | 177.4 | 0 | 109.8 | H273 I277 | H273-K275 PolarHBondContact O-N 2.81Å; K275-I277 PolarHBondContact O-N 3.31Å |
| 276 | P | 43.1 | Very low | 42.9 | Very low | 125 Ų | 125 | 141.8 Ų | 141.8 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 130.6 | 176.6 | 26.5 | -34.1 | 0 | 0 | 0 | 110.6 | | |
| 277 | I | 40.2 | Very low | 43 | Very low | 162 Ų | 162 | 140 Ų | 140 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 129.9 | 175.6 | -58.2 | 176 | 0 | 0 | 0 | 108 | K275 | K275-I277 PolarHBondContact O-N 3.31Š|
| 278 | K | 41.8 | Very low | 42.4 | Very low | 202 Ų | 202 | 140.5 Ų | 140.5 | 88% | 0.878 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 127.5 | 172.1 | -66.4 | -179.7 | 177.8 | -177.7 | 0 | 108.9 | G280 | K278-G280 PolarHBondContact O-N 3.22Š|
| 279 | S | 38.8 | Very low | 41.7 | Very low | 131 Ų | 131 | 142.4 Ų | 142.4 | 92% | 0.916 | 82% | 0.816 | S | S | * | * | | | trans | -64.4 | 99.2 | 178.2 | -49.9 | 0 | 0 | 0 | 0 | 111.3 | | |
| 280 | G | 32.7 | Very low | 41.1 | Very low | 65 Ų | 65 | 145.6 Ų | 145.6 | 67% | 0.67 | 82% | 0.82 | S | S | * | * | | | trans | -102.3 | 122.8 | 167.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | K278 V282 | K278-G280 PolarHBondContact O-N 3.22Å; G280-V282 PolarHBondContact O-N 2.85Å |
| 281 | T | 43.9 | Very low | 40.1 | Very low | 148 Ų | 148 | 141.8 Ų | 141.8 | 91% | 0.908 | 82% | 0.817 | S | S | * | * | | | trans | -70.2 | 121.6 | 177.8 | 44.7 | 0 | 0 | 0 | 0 | 111.1 | | |
| 282 | V | 34.3 | Very low | 40.8 | Very low | 141 Ų | 141 | 142.2 Ų | 142.2 | 86% | 0.855 | 82% | 0.82 | S | S | * | * | | | trans | -125.4 | 128.7 | 165.9 | 177.5 | 0 | 0 | 0 | 0 | 107.5 | G280 | G280-V282 PolarHBondContact O-N 2.85Š|
| 283 | S | 40.3 | Very low | 40.2 | Very low | 115 Ų | 115 | 142 Ų | 142 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 142.8 | -170.2 | -48.4 | 0 | 0 | 0 | 0 | 112.9 | | |
| 284 | L | 36.2 | Very low | 39.6 | Very low | 165 Ų | 165 | 145 Ų | 145 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 147.1 | 161 | -75 | 166.2 | 0 | 0 | 0 | 110 | | |
| 285 | P | 42.7 | Very low | 39.2 | Very low | 94 Ų | 94 | 142.1 Ų | 142.1 | 61% | 0.61 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -79.5 | 163 | 174.1 | 33.8 | -35 | 0 | 0 | 0 | 112.1 | | |
| 286 | W | 35 | Very low | 39.2 | Very low | 237 Ų | 237 | 139.7 Ų | 139.7 | 90% | 0.898 | 81% | 0.812 | S | S | * | * | | | trans | 78.1 | 114.2 | 177.6 | -48.6 | 113.8 | 0 | 0 | 0 | 115.8 | | |
| 287 | P | 42.3 | Very low | 38.8 | Very low | 116 Ų | 116 | 143.1 Ų | 143.1 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | | | trans | -86.4 | 153.4 | -179.6 | 35.4 | -34.7 | 0 | 0 | 0 | 112.3 | | |
| 288 | L | 31.6 | Very low | 38.6 | Very low | 172 Ų | 172 | 139.8 Ų | 139.8 | 90% | 0.901 | 82% | 0.816 | S | S | * | * | | | trans | -114.7 | 134.4 | 155.4 | -71.6 | 172.8 | 0 | 0 | 0 | 107.8 | | |
| 289 | S | 32.7 | Very low | 38.3 | Very low | 130 Ų | 130 | 134.5 Ų | 134.5 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | | | trans | -69.9 | 133.4 | -170.5 | -53.5 | 0 | 0 | 0 | 0 | 112.5 | | |
| 290 | E | 37.2 | Very low | 37.9 | Very low | 190 Ų | 190 | 135.8 Ų | 135.8 | 89% | 0.888 | 81% | 0.812 | S | S | * | * | | | trans | -112.3 | 132 | 176.8 | -165.6 | 159.9 | -137.2 | 0 | 0 | 110.4 | | |
| 291 | G | 32.1 | Very low | 37.7 | Very low | 68 Ų | 68 | 135.8 Ų | 135.8 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | | | trans | -84.2 | 144.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 292 | P | 55.2 | Low | 37.1 | Very low | 121 Ų | 121 | 133.8 Ų | 133.8 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | | | trans | -90.9 | -176.2 | -169.9 | 37.4 | -38.7 | 0 | 0 | 0 | 114.8 | | |
| 293 | N | 37.8 | Very low | 37.1 | Very low | 117 Ų | 117 | 134.6 Ų | 134.6 | 63% | 0.626 | 81% | 0.81 | S | S | * | * | | | trans | 77 | 133 | 170.8 | -79.1 | -15.5 | 0 | 0 | 0 | 117 | | |
| 294 | W | 38.2 | Very low | 37.6 | Very low | 234 Ų | 234 | 134.6 Ų | 134.6 | 89% | 0.886 | 81% | 0.807 | S | S | * | * | | | cis | -135.2 | 166 | -5.7 | -60.8 | 93 | 0 | 0 | 0 | 107 | | |
| 295 | G | 35.5 | Very low | 37.3 | Very low | 65 Ų | 65 | 130.7 Ų | 130.7 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | | | cis | 135.1 | 112.1 | 18.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | | |
| 296 | P | 50.8 | Low | 36.8 | Very low | 135 Ų | 135 | 133.3 Ų | 133.3 | 88% | 0.877 | 81% | 0.807 | S | S | * | * | | | trans | -92.3 | 163.3 | -168.4 | 35.9 | -36.2 | 0 | 0 | 0 | 114.5 | | |
| 297 | M | 34.6 | Very low | 36.5 | Very low | 197 Ų | 197 | 130 Ų | 130 | 97% | 0.97 | 80% | 0.801 | S | S | * | * | | | trans | -125.8 | 163.9 | 173.6 | -113.3 | -167.7 | 173.2 | 0 | 0 | 113.9 | | |
| 298 | A | 36.8 | Very low | 36.3 | Very low | 93 Ų | 93 | 131.9 Ų | 131.9 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | | | trans | -51.8 | 149.3 | -169.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 299 | A | 35.3 | Very low | 36.9 | Very low | 91 Ų | 91 | 129 Ų | 129 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | | | cis | 89 | 158.6 | 30.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 300 | V | 30.2 | Very low | 37 | Very low | 157 Ų | 157 | 127.9 Ų | 127.9 | 95% | 0.952 | 79% | 0.789 | S | S | * | * | | | trans | 75 | 134.1 | -163.5 | -170.1 | 0 | 0 | 0 | 0 | 112.9 | | |
| 301 | G | 29.1 | Very low | 36.7 | Very low | 65 Ų | 65 | 131 Ų | 131 | 67% | 0.67 | 79% | 0.792 | S | S | * | * | | | cis | 171.1 | 179.4 | -7.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | | |
| 302 | A | 31.1 | Very low | 36.7 | Very low | 106 Ų | 106 | 131.1 Ų | 131.1 | 88% | 0.876 | 79% | 0.794 | S | S | * | * | | | trans | 71.5 | 124.9 | 172 | 0 | 0 | 0 | 0 | 0 | 120 | | |
| 303 | N | 34.1 | Very low | 36 | Very low | 159 Ų | 159 | 131.8 Ų | 131.8 | 85% | 0.85 | 80% | 0.798 | S | S | * | * | | | trans | -83.2 | 175.8 | 151.1 | -70.2 | -60.8 | 0 | 0 | 0 | 108.6 | | |
| 304 | P | 51.7 | Low | 35.8 | Very low | 114 Ų | 114 | 134.2 Ų | 134.2 | 74% | 0.74 | 81% | 0.806 | S | S | * | * | | | cis | -144.5 | 178.5 | 13 | 44.8 | -26.2 | 0 | 0 | 0 | 118 | | |
| 305 | A | 30.4 | Very low | 35.5 | Very low | 84 Ų | 84 | 129.6 Ų | 129.6 | 69% | 0.694 | 80% | 0.797 | S | S | * | * | | | trans | 72.4 | 139.6 | 137.8 | 0 | 0 | 0 | 0 | 0 | 124.2 | | |
| 306 | L | 30.9 | Very low | 35.3 | Very low | 148 Ų | 148 | 131.7 Ų | 131.7 | 78% | 0.775 | 80% | 0.802 | S | S | * | * | | | trans | 81.6 | 143.6 | 149.9 | -101.9 | 75.5 | 0 | 0 | 0 | 122.1 | | |
| 307 | Q | 29.9 | Very low | 34.3 | Very low | 168 Ų | 168 | 135.6 Ų | 135.6 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | | | trans | 74.4 | 105.3 | 152.9 | -70.2 | 174.2 | 95.5 | 0 | 0 | 121.5 | | |
| 308 | N | 37.1 | Very low | 34.1 | Very low | 155 Ų | 155 | 133.8 Ų | 133.8 | 83% | 0.829 | 79% | 0.793 | S | S | * | * | | | trans | -59.3 | 150.5 | 133.3 | -111.9 | -23 | 0 | 0 | 0 | 109 | | |
| 309 | P | 43.9 | Very low | 33.8 | Very low | 111 Ų | 111 | 134.6 Ų | 134.6 | 72% | 0.721 | 79% | 0.793 | S | S | * | * | | | | -155.8 | 167.7 | 70 | 42.1 | -22.8 | 0 | 0 | 0 | 118.9 | | |
| 310 | S | 34.7 | Very low | 33.4 | Very low | 108 Ų | 108 | 135.9 Ų | 135.9 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | | | trans | 41.8 | 117.7 | 140.2 | -169 | 0 | 0 | 0 | 0 | 121.3 | | |
| 311 | R | 30.9 | Very low | 33.6 | Very low | 254 Ų | 254 | 136.6 Ų | 136.6 | 96% | 0.958 | 79% | 0.794 | S | S | * | * | | | | -163.5 | 149.5 | 125.4 | -111.4 | 172.5 | -175.6 | -160.9 | 0.9 | 112 | | |
| 312 | G | 33.3 | Very low | 33.8 | Very low | 71 Ų | 71 | 141.3 Ų | 141.3 | 73% | 0.732 | 80% | 0.802 | S | S | * | * | | | trans | -149.6 | 168.9 | 166 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 313 | P | 40.3 | Very low | 34.3 | Very low | 135 Ų | 135 | 140.3 Ų | 140.3 | 88% | 0.877 | 79% | 0.787 | S | S | * | * | | | trans | -121.6 | 178.6 | 159.9 | 35.2 | -22.4 | 0 | 0 | 0 | 113.1 | | |
| 314 | H | 33.5 | Very low | 34.4 | Very low | 169 Ų | 169 | 138.8 Ų | 138.8 | 78% | 0.782 | 79% | 0.785 | S | S | * | * | | | trans | -116.4 | 153 | -158.3 | -110.8 | -115.5 | 0 | 0 | 0 | 114.4 | | |
| 315 | L | 31.7 | Very low | 33.4 | Very low | 136 Ų | 136 | 139.9 Ų | 139.9 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | | | trans | 66.7 | 157.2 | 150.8 | -64.9 | 163.5 | 0 | 0 | 0 | 117 | | |
| 316 | S | 30.8 | Very low | 33.5 | Very low | 110 Ų | 110 | 141.5 Ų | 141.5 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | | | cis | -133.6 | 129.9 | 20.8 | -69.3 | 0 | 0 | 0 | 0 | 111.7 | | |
| 317 | R | 29.4 | Very low | 33.5 | Very low | 216 Ų | 216 | 143.1 Ų | 143.1 | 82% | 0.815 | 79% | 0.794 | S | S | * | * | | | | 61.8 | 104.5 | 87.6 | -177.4 | -166.1 | -84.3 | -128 | 0.2 | 114.8 | | |
| 318 | L | 32 | Very low | 33.3 | Very low | 159 Ų | 159 | 138.9 Ų | 138.9 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | | | | -154.7 | 143.8 | 117.8 | -107.5 | 172.8 | 0 | 0 | 0 | 109.8 | | |
| 319 | S | 30.7 | Very low | 33 | Very low | 111 Ų | 111 | 138 Ų | 138 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | | | trans | -150.4 | 137.9 | 179.1 | -55.2 | 0 | 0 | 0 | 0 | 109.3 | | |
| 320 | S | 26.1 | Very low | 32.4 | Very low | 118 Ų | 118 | 138.4 Ų | 138.4 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | | | trans | -136.3 | 95.1 | 176 | -65.2 | 0 | 0 | 0 | 0 | 110.1 | | |
| 321 | L | 34.6 | Very low | 32 | Very low | 172 Ų | 172 | 142.9 Ų | 142.9 | 90% | 0.901 | 79% | 0.788 | S | S | * | * | | | trans | -114.6 | 129.5 | 164.6 | -79.4 | 169.8 | 0 | 0 | 0 | 108 | | |
| 322 | I | 33.3 | Very low | 31.9 | Very low | 163 Ų | 163 | 139.8 Ų | 139.8 | 84% | 0.836 | 78% | 0.776 | S | S | * | * | | | trans | -148.4 | 159.7 | 165.9 | 11.6 | 178.2 | 0 | 0 | 0 | 108.3 | | |
| 323 | P | 40.2 | Very low | 31.8 | Very low | 85 Ų | 85 | 143.8 Ų | 143.8 | 55% | 0.552 | 78% | 0.776 | S | S | * | * | | | | -137 | -172.9 | -114 | 43.6 | -26.9 | 0 | 0 | 0 | 114 | I325 | P323-I325 HydrophobicContact CG-CD1 4.26Å; P323-I325 HydrophobicContact CG-CG1 4.05Å |
| 324 | P | 36.6 | Very low | 31.2 | Very low | 127 Ų | 127 | 142.7 Ų | 142.7 | 83% | 0.825 | 76% | 0.763 | S | S | * | * | | | trans | -87.8 | 118.8 | 151.7 | 32.6 | -28.1 | 0 | 0 | 0 | 110.6 | | |
| 325 | I | 30.7 | Very low | 31.2 | Very low | 138 Ų | 138 | 144.1 Ų | 144.1 | 71% | 0.708 | 77% | 0.767 | S | S | * | * | | | trans | -96.9 | 138.3 | 169.1 | -79.4 | 159.5 | 0 | 0 | 0 | 109.5 | P323 | P323-I325 HydrophobicContact CG-CD1 4.26Å; P323-I325 HydrophobicContact CG-CG1 4.05Å |
| 326 | S | 31.9 | Very low | 31.1 | Very low | 117 Ų | 117 | 140.9 Ų | 140.9 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | | | trans | -115.4 | 114 | 171.7 | -63.9 | 0 | 0 | 0 | 0 | 111 | | |
| 327 | Q | 30.9 | Very low | 31.1 | Very low | 183 Ų | 183 | 141.4 Ų | 141.4 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | | | trans | -147.3 | 153.2 | 158.8 | -65.7 | -171 | 3.7 | 0 | 0 | 108.2 | | |
| 328 | A | 27.2 | Very low | 31 | Very low | 78 Ų | 78 | 136.8 Ų | 136.8 | 65% | 0.645 | 77% | 0.771 | S | S | * | * | | | cis | 163.9 | 151.9 | -33.9 | 0 | 0 | 0 | 0 | 0 | 106.6 | | |
| 329 | T | 30.4 | Very low | 30.7 | Very low | 137 Ų | 137 | 139.6 Ų | 139.6 | 84% | 0.84 | 77% | 0.771 | S | S | * | * | | | trans | 70.2 | 149.8 | -177.9 | 83.7 | 0 | 0 | 0 | 0 | 114.2 | | |
| 330 | T | 30.6 | Very low | 30.7 | Very low | 119 Ų | 119 | 141.5 Ų | 141.5 | 73% | 0.73 | 77% | 0.767 | S | S | * | * | | | cis | -133.4 | 150 | 10.6 | 49.6 | 0 | 0 | 0 | 0 | 115.2 | | |
| 331 | R | 26.5 | Very low | 30.6 | Very low | 202 Ų | 202 | 140.8 Ų | 140.8 | 76% | 0.762 | 76% | 0.762 | S | S | * | * | | | trans | 82.3 | 117.9 | 139.6 | -89.2 | -177.6 | 175.4 | -168.5 | 0 | 122.2 | | |
| 332 | R | 29 | Very low | 30.3 | Very low | 189 Ų | 189 | 141.2 Ų | 141.2 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | | | trans | 81.7 | 113 | 139.1 | -60.4 | -128.1 | -104.6 | -132.5 | 1.4 | 116.2 | | |
| 333 | H | 32.2 | Very low | 30.2 | Very low | 155 Ų | 155 | 141.7 Ų | 141.7 | 72% | 0.718 | 76% | 0.756 | S | S | * | * | | | | 74 | 134.2 | 92.1 | -77 | -85.9 | 0 | 0 | 0 | 111.4 | | |
| 334 | D | 27.3 | Very low | 29.8 | Very low | 112 Ų | 112 | 146.4 Ų | 146.4 | 60% | 0.599 | 77% | 0.77 | S | S | * | * | | | cis | -156.9 | 156.6 | 15.8 | -114.5 | -32 | 0 | 0 | 0 | 112.8 | | |
| 335 | F | 33.2 | Very low | 29.4 | Very low | 200 Ų | 200 | 146 Ų | 146 | 88% | 0.877 | 77% | 0.771 | S | S | * | * | | | trans | 53 | 156.3 | 170.2 | -60.7 | -70.2 | 0 | 0 | 0 | 118.3 | | |
| 336 | G | 28.7 | Very low | 29.7 | Very low | 68 Ų | 68 | 145.7 Ų | 145.7 | 70% | 0.701 | 78% | 0.775 | S | S | * | * | | | cis | 179.8 | 139.2 | -5.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 337 | S | 31.4 | Very low | 29.9 | Very low | 121 Ų | 121 | 145.7 Ų | 145.7 | 85% | 0.846 | 77% | 0.773 | S | S | * | * | | | trans | -61.9 | 144.7 | -178.4 | 53 | 0 | 0 | 0 | 0 | 114 | | |
| 338 | S | 26.9 | Very low | 30.1 | Very low | 119 Ų | 119 | 145.7 Ų | 145.7 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | | | | -165.7 | 175.1 | 102.9 | -153.6 | 0 | 0 | 0 | 0 | 113.1 | | |
| 339 | W | 26.1 | Very low | 30.8 | Very low | 218 Ų | 218 | 147.6 Ų | 147.6 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | | | trans | -109.7 | 166.8 | -171 | -110.4 | 36.1 | 0 | 0 | 0 | 113 | | |
| 340 | Q | 30.1 | Very low | 31.3 | Very low | 150 Ų | 150 | 146.8 Ų | 146.8 | 70% | 0.701 | 78% | 0.775 | S | S | * | * | | | trans | 73.6 | 127.7 | 149.9 | -78.7 | 178 | -3.9 | 0 | 0 | 122.1 | | |
| 341 | S | 26 | Very low | 31.5 | Very low | 104 Ų | 104 | 150.8 Ų | 150.8 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | | | | 56 | 127.4 | 129.2 | -55.6 | 0 | 0 | 0 | 0 | 121.3 | | |
| 342 | Q | 27.8 | Very low | 31.9 | Very low | 180 Ų | 180 | 149.9 Ų | 149.9 | 84% | 0.841 | 79% | 0.787 | S | S | * | * | | | | 161.3 | 135.9 | 102.1 | -173.2 | 145 | -72.2 | 0 | 0 | 113.1 | | |
| 343 | K | 30.3 | Very low | 32.6 | Very low | 173 Ų | 173 | 146.7 Ų | 146.7 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | | | trans | -14.3 | 148.8 | 165.7 | -60.5 | 173.2 | -179.7 | 175.3 | 0 | 120.5 | | |
| 344 | Q | 31.2 | Very low | 32.8 | Very low | 184 Ų | 184 | 144.7 Ų | 144.7 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | | | trans | 66.9 | 116.7 | 147 | -71.9 | 165.4 | -46.1 | 0 | 0 | 119.6 | | |
| 345 | S | 29.3 | Very low | 33.1 | Very low | 119 Ų | 119 | 145.7 Ų | 145.7 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | | | | -173.8 | 162.2 | 117 | -165.5 | 0 | 0 | 0 | 0 | 111.5 | | |
| 346 | T | 36.8 | Very low | 33.2 | Very low | 131 Ų | 131 | 141 Ų | 141 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | | | trans | -112.1 | 125.8 | 176.5 | -55.3 | 0 | 0 | 0 | 0 | 110.6 | | |
| 347 | P | 36.7 | Very low | 33.2 | Very low | 118 Ų | 118 | 146.8 Ų | 146.8 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 148.9 | 165.5 | -4.1 | 24.3 | 0 | 0 | 0 | 112.8 | | |
| 348 | Q | 34.9 | Very low | 33.4 | Very low | 182 Ų | 182 | 146.7 Ų | 146.7 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 160 | 168.4 | -84.8 | -166.7 | -10 | 0 | 0 | 112.5 | | |
| 349 | P | 41.3 | Very low | 33.7 | Very low | 118 Ų | 118 | 150.5 Ų | 150.5 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 142.7 | 178.2 | 32.9 | -35.2 | 0 | 0 | 0 | 113.3 | | |
| 350 | P | 40.5 | Very low | 33.9 | Very low | 120 Ų | 120 | 150.8 Ų | 150.8 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 123.4 | 171.2 | 33 | -31.5 | 0 | 0 | 0 | 113.2 | | |
| 351 | K | 35.4 | Very low | 33.9 | Very low | 203 Ų | 203 | 154.8 Ų | 154.8 | 88% | 0.883 | 80% | 0.799 | S | S | * | * | | | trans | 27 | 125.5 | 143.4 | -58.7 | 179.1 | -178.7 | 179.1 | 0 | 120.2 | | |
| 352 | E | 34 | Very low | 34.2 | Very low | 183 Ų | 183 | 157 Ų | 157 | 86% | 0.855 | 80% | 0.8 | S | S | * | * | | | trans | -71.6 | 161.3 | 165.3 | -52.3 | 171.9 | 138.5 | 0 | 0 | 113.1 | | |
| 353 | P | 45.7 | Very low | 35 | Very low | 123 Ų | 123 | 153.3 Ų | 153.3 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | | | trans | -101.6 | 115.7 | 148.6 | 33.5 | -26 | 0 | 0 | 0 | 111.6 | | |
| 354 | T | 34.9 | Very low | 35.1 | Very low | 113 Ų | 113 | 154.4 Ų | 154.4 | 69% | 0.693 | 80% | 0.8 | S | S | * | * | | | trans | -40.4 | 136.6 | 173 | -52.2 | 0 | 0 | 0 | 0 | 116.2 | V356 | T354-V356 HydrophobicContact CG2-CG2 3.64Š|
| 355 | V | 33.2 | Very low | 35 | Very low | 133 Ų | 133 | 153.1 Ų | 153.1 | 81% | 0.806 | 80% | 0.798 | S | S | * | * | | | trans | -129.1 | 127.6 | 148.3 | 179.8 | 0 | 0 | 0 | 0 | 108.5 | | |
| 356 | V | 35.7 | Very low | 35.3 | Very low | 101 Ų | 101 | 153.9 Ų | 153.9 | 61% | 0.612 | 79% | 0.792 | S | S | * | * | | | trans | -93.3 | 128.7 | -173.6 | -179.7 | 0 | 0 | 0 | 0 | 111.1 | T354 T358 | T354-V356 HydrophobicContact CG2-CG2 3.64Å; V356-T358 HydrophobicContact CG1-CG2 3.92Å |
| 357 | F | 29.1 | Very low | 35.1 | Very low | 190 Ų | 190 | 154.8 Ų | 154.8 | 83% | 0.833 | 79% | 0.787 | S | S | * | * | | | trans | -131.8 | 108.5 | 157.1 | -97.6 | -84.3 | 0 | 0 | 0 | 110.2 | | |
| 358 | T | 36.7 | Very low | 34.9 | Very low | 118 Ų | 118 | 155.2 Ų | 155.2 | 72% | 0.724 | 78% | 0.783 | S | S | * | * | | | trans | -85.6 | 122.5 | 177.9 | 50 | 0 | 0 | 0 | 0 | 111 | V356 | V356-T358 HydrophobicContact CG1-CG2 3.92Š|
| 359 | F | 31.7 | Very low | 34.6 | Very low | 200 Ų | 200 | 155 Ų | 155 | 88% | 0.877 | 78% | 0.782 | S | S | * | * | | | trans | -118.5 | 133.6 | 157.8 | -92.3 | -83.1 | 0 | 0 | 0 | 111.1 | R361 | F359-R361 PolarHBondContact O-N 3.33Š|
| 360 | R | 31.6 | Very low | 34.2 | Very low | 224 Ų | 224 | 154.4 Ų | 154.4 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -73 | 118.1 | -169.1 | 179 | -175.2 | -73.1 | -169.7 | -3.9 | 110.7 | M362 | R360-M362 PolarHBondContact O-N 3.41Š|
| 361 | R | 29 | Very low | 33.6 | Very low | 233 Ų | 233 | 158 Ų | 158 | 88% | 0.879 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 126.4 | 163.9 | -177.8 | -178.8 | -66.4 | -179.1 | -0.4 | 108.7 | F359 | F359-R361 PolarHBondContact O-N 3.33Š|
| 362 | M | 32 | Very low | 33.5 | Very low | 150 Ų | 150 | 153 Ų | 153 | 74% | 0.739 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 141.3 | 166 | -73.7 | -64.8 | -69 | 0 | 0 | 109.5 | R360 | R360-M362 PolarHBondContact O-N 3.41Š|
| 363 | P | 45.8 | Very low | 33.5 | Very low | 103 Ų | 103 | 154.8 Ų | 154.8 | 67% | 0.669 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 148.6 | 179.9 | 33.6 | -35.2 | 0 | 0 | 0 | 111.9 | | |
| 364 | E | 30.7 | Very low | 32.8 | Very low | 197 Ų | 197 | 154 Ų | 154 | 92% | 0.921 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -66 | 145.7 | 153.4 | -65.2 | 153.8 | 134.4 | 0 | 0 | 108.2 | | |
| 365 | N | 30.9 | Very low | 32.8 | Very low | 156 Ų | 156 | 156.1 Ų | 156.1 | 83% | 0.834 | 76% | 0.76 | S | S | * | * | | | trans | -141.2 | 160 | 173.6 | -158.5 | 17.6 | 0 | 0 | 0 | 112.2 | | |
| 366 | I | 34.9 | Very low | 32.8 | Very low | 136 Ų | 136 | 158.3 Ų | 158.3 | 70% | 0.697 | 76% | 0.759 | S | S | * | * | | | trans | -102 | 154.5 | -160.2 | -75 | 162.7 | 0 | 0 | 0 | 111.4 | | |
| 367 | E | 31.7 | Very low | 32.4 | Very low | 149 Ų | 149 | 161 Ų | 161 | 70% | 0.696 | 77% | 0.765 | S | S | * | * | | | trans | 20.6 | 136.3 | 159.1 | -71.6 | -174.6 | 97.1 | 0 | 0 | 123.2 | | |
| 368 | N | 33.2 | Very low | 32.4 | Very low | 128 Ų | 128 | 156.8 Ų | 156.8 | 68% | 0.684 | 76% | 0.759 | S | S | * | * | | | trans | 50.9 | 120.2 | 131.6 | -44 | -18 | 0 | 0 | 0 | 120.5 | | |
| 369 | E | 29.1 | Very low | 33.3 | Very low | 177 Ų | 177 | 156.4 Ų | 156.4 | 83% | 0.827 | 76% | 0.758 | S | S | * | * | | | | -167.5 | 175.4 | 107 | -108.2 | -135.5 | 112.3 | 0 | 0 | 113.1 | | |
| 370 | T | 31.7 | Very low | 34.5 | Very low | 105 Ų | 105 | 152.5 Ų | 152.5 | 64% | 0.644 | 75% | 0.753 | S | S | * | * | | | trans | -125 | 143.5 | -174.6 | 60.3 | 0 | 0 | 0 | 0 | 112.6 | | |
| 371 | K | 28.9 | Very low | 34.5 | Very low | 195 Ų | 195 | 147.4 Ų | 147.4 | 85% | 0.848 | 75% | 0.752 | S | S | * | * | | | | 172.9 | 173 | 128.7 | -92.1 | 149.9 | -166.7 | 154 | 0 | 112.9 | | |
| 372 | A | 33.1 | Very low | 34.7 | Very low | 98 Ų | 98 | 145.7 Ų | 145.7 | 81% | 0.81 | 75% | 0.751 | S | S | * | * | | | trans | -125 | -155.6 | -166.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 373 | R | 33.5 | Very low | 34.7 | Very low | 222 Ų | 222 | 144.2 Ų | 144.2 | 84% | 0.838 | 75% | 0.75 | S | S | * | * | | | trans | 86 | 147.3 | 178.9 | -84.4 | -167.9 | 163.2 | -161.3 | -0.5 | 116.4 | | |
| 374 | E | 32.2 | Very low | 33.8 | Very low | 107 Ų | 107 | 147.5 Ų | 147.5 | 50% | 0.5 | 76% | 0.757 | S | S | . | * | | | cis | -142.8 | 141.6 | 0.7 | -80.9 | -139.4 | 136.5 | 0 | 0 | 115 | | |
| 375 | K | 34.9 | Very low | 34 | Very low | 157 Ų | 157 | 147.2 Ų | 147.2 | 68% | 0.683 | 75% | 0.753 | S | S | * | * | | | trans | 57.5 | 163 | 131.8 | -62.1 | 179.7 | -171.6 | 145.6 | 0 | 125.2 | | |
| 376 | K | 32.5 | Very low | 33.8 | Very low | 178 Ų | 178 | 145.8 Ų | 145.8 | 77% | 0.774 | 75% | 0.749 | S | S | * | * | | | trans | 74.6 | 137.4 | 172 | -81 | -179.8 | 166 | -94.3 | 0 | 115.6 | | |
| 377 | E | 27.5 | Very low | 33.6 | Very low | 157 Ų | 157 | 145 Ų | 145 | 73% | 0.734 | 76% | 0.756 | S | S | * | * | | | cis | -154.4 | 174.3 | -6.7 | -150.2 | 152.1 | 164.9 | 0 | 0 | 110.5 | | |
| 378 | S | 29.8 | Very low | 33.5 | Very low | 103 Ų | 103 | 140.9 Ų | 140.9 | 72% | 0.72 | 75% | 0.754 | S | S | * | * | | | trans | -161.7 | -173.4 | -177 | 71.9 | 0 | 0 | 0 | 0 | 110.4 | | |
| 379 | P | 54.7 | Low | 33.3 | Very low | 109 Ų | 109 | 143.7 Ų | 143.7 | 71% | 0.708 | 76% | 0.762 | S | S | * | * | | | cis | -130.2 | -130.2 | -10 | 39.1 | -16.4 | 0 | 0 | 0 | 109.2 | | |
| 380 | P | 57.3 | Low | 33.3 | Very low | 118 Ų | 118 | 143 Ų | 143 | 77% | 0.766 | 76% | 0.759 | S | S | * | * | | | cis | -130.4 | 171.2 | -31.4 | 35.4 | -17.5 | 0 | 0 | 0 | 116.4 | | |
| 381 | S | 30.6 | Very low | 33.4 | Very low | 117 Ų | 117 | 143.3 Ų | 143.3 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | | | trans | -136.5 | -161.4 | 162.8 | 71.8 | 0 | 0 | 0 | 0 | 112.3 | | |
| 382 | K | 32.8 | Very low | 33.7 | Very low | 197 Ų | 197 | 145.1 Ų | 145.1 | 86% | 0.857 | 76% | 0.758 | S | S | * | * | | | trans | -152.7 | 163.4 | -163.7 | -68.2 | 177.7 | -176.5 | 173.4 | 0 | 111.5 | | |
| 383 | T | 32.7 | Very low | 34 | Very low | 119 Ų | 119 | 148.9 Ų | 148.9 | 73% | 0.73 | 76% | 0.759 | S | S | * | * | | | cis | -174 | 166.6 | -24 | -79.3 | 0 | 0 | 0 | 0 | 107.5 | | |
| 384 | Q | 27 | Very low | 34.1 | Very low | 172 Ų | 172 | 143.3 Ų | 143.3 | 80% | 0.804 | 75% | 0.754 | S | S | * | * | | | trans | 82.5 | 121.7 | 161.9 | -133.8 | 159 | -28.2 | 0 | 0 | 115.5 | | |
| 385 | K | 34.3 | Very low | 34.1 | Very low | 191 Ų | 191 | 144 Ų | 144 | 83% | 0.83 | 77% | 0.77 | S | S | * | * | | | cis | 74.3 | 138.8 | 41.2 | -65.1 | -164.5 | 173.2 | -172.4 | 0 | 113.1 | | |
| 386 | V | 28.5 | Very low | 34.2 | Very low | 126 Ų | 126 | 144.7 Ų | 144.7 | 76% | 0.764 | 78% | 0.781 | S | S | * | * | | | cis | -163.6 | 168.2 | 6.7 | 106.8 | 0 | 0 | 0 | 0 | 111.7 | | |
| 387 | S | 30 | Very low | 34.7 | Very low | 121 Ų | 121 | 138.6 Ų | 138.6 | 85% | 0.846 | 77% | 0.769 | S | S | * | * | | | trans | 73 | 149.6 | 167.3 | -139.1 | 0 | 0 | 0 | 0 | 117.5 | | |
| 388 | G | 30 | Very low | 35.5 | Very low | 62 Ų | 62 | 137.5 Ų | 137.5 | 64% | 0.639 | 78% | 0.776 | S | S | * | * | | | cis | -179.9 | -178.4 | -2.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | | |
| 389 | E | 28.1 | Very low | 36.5 | Very low | 186 Ų | 186 | 139.8 Ų | 139.8 | 87% | 0.869 | 78% | 0.779 | S | S | * | * | | | trans | -45.2 | 164.4 | 173.4 | -82.7 | 144.8 | 124.2 | 0 | 0 | 117.2 | | |
| 390 | E | 29.5 | Very low | 36.1 | Very low | 162 Ų | 162 | 140.7 Ų | 140.7 | 76% | 0.757 | 78% | 0.778 | S | S | * | * | | | cis | -166.2 | 161.2 | 1.9 | 150.4 | 178 | -151.2 | 0 | 0 | 111.8 | | |
| 391 | L | 32.9 | Very low | 35.4 | Very low | 113 Ų | 113 | 142.1 Ų | 142.1 | 59% | 0.592 | 78% | 0.779 | S | S | * | * | | | trans | 20.4 | 114.7 | 155.3 | -171.7 | 75.7 | 0 | 0 | 0 | 121.2 | | |
| 392 | R | 36.9 | Very low | 35.9 | Very low | 232 Ų | 232 | 141.7 Ų | 141.7 | 88% | 0.875 | 78% | 0.775 | S | S | * | * | | | | -147.1 | 147 | 128.1 | -90.6 | -46.6 | -163.5 | -125.2 | 4.9 | 112.1 | | |
| 393 | E | 38.6 | Very low | 36 | Very low | 177 Ų | 177 | 139.4 Ų | 139.4 | 83% | 0.827 | 77% | 0.773 | S | S | * | * | | | trans | -119.3 | 129 | -177.6 | 176 | 178.5 | -162.9 | 0 | 0 | 108.6 | | |
| 394 | S | 35.9 | Very low | 36.1 | Very low | 105 Ų | 105 | 144.8 Ų | 144.8 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | | | trans | -160.6 | 110.3 | 173.3 | 60.1 | 0 | 0 | 0 | 0 | 114.3 | | |
| 395 | S | 30.8 | Very low | 36.5 | Very low | 121 Ų | 121 | 140.4 Ų | 140.4 | 85% | 0.846 | 77% | 0.773 | S | S | * | * | | | trans | 61.9 | 120.4 | 137.4 | -52.1 | 0 | 0 | 0 | 0 | 121.7 | | |
| 396 | D | 38.6 | Very low | 36.5 | Very low | 172 Ų | 172 | 140.3 Ų | 140.3 | 92% | 0.92 | 77% | 0.773 | S | S | * | * | | | trans | -68.2 | 156.7 | 160.7 | -173.9 | 13.7 | 0 | 0 | 0 | 112.3 | | |
| 397 | G | 42.1 | Very low | 36.7 | Very low | 50 Ų | 50 | 140.8 Ų | 140.8 | 52% | 0.515 | 78% | 0.776 | S | S | . | * | | | trans | 172.4 | 129.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 398 | P | 44.4 | Very low | 37 | Very low | 134 Ų | 134 | 144.3 Ų | 144.3 | 87% | 0.87 | 78% | 0.776 | S | S | * | * | | | trans | -77.2 | 139.1 | -170.7 | 30.2 | -35.3 | 0 | 0 | 0 | 113.8 | | |
| 399 | L | 49.8 | Very low | 37.6 | Very low | 152 Ų | 152 | 146.6 Ų | 146.6 | 80% | 0.796 | 78% | 0.779 | S | S | * | * | | | trans | -79.5 | 115.8 | 177.5 | -120.7 | 69.5 | 0 | 0 | 0 | 111.8 | L401 | L399-L401 HydrophobicContact CD2-CD1 4.16Å; L399-L401 HydrophobicContact CD2-CD2 4.48Å; L399-L401 HydrophobicContact CD2-CG 4.32Å |
| 400 | D | 47 | Very low | 37.6 | Very low | 127 Ų | 127 | 145.3 Ų | 145.3 | 68% | 0.679 | 78% | 0.778 | S | S | * | * | | | trans | -85.1 | 138.7 | 156.7 | -176.9 | 9 | 0 | 0 | 0 | 109.1 | S402 | D400-S402 WeakPolarHBondContact OD1-CB 3.13Å; D400-S402 PolarHBondContact OD1-N 2.88Å; D400-S402 VanDerWaalsContact OD1-N 3.08Å; D400-S402 PolarHBondContact OD1-OG 3.28Å |
| 401 | L | 43.7 | Very low | 37.8 | Very low | 149 Ų | 149 | 146.1 Ų | 146.1 | 78% | 0.78 | 78% | 0.782 | S | S | * | * | | | trans | -138.7 | 46.3 | 179.4 | -71.7 | -179.6 | 0 | 0 | 0 | 111.4 | L399 D403 | L399-L401 HydrophobicContact CD2-CD1 4.16Å; L399-L401 HydrophobicContact CD2-CD2 4.48Å; L399-L401 HydrophobicContact CD2-CG 4.32Å; L401-D403 PolarHBondContact O-N 2.97Å |
| 402 | S | 39.4 | Very low | 38.5 | Very low | 107 Ų | 107 | 146.2 Ų | 146.2 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | | | trans | -84.3 | 74.4 | 174.7 | -59.3 | 0 | 0 | 0 | 0 | 112.6 | D400 | D400-S402 WeakPolarHBondContact OD1-CB 3.13Å; D400-S402 PolarHBondContact OD1-N 2.88Å; D400-S402 VanDerWaalsContact OD1-N 3.08Å; D400-S402 PolarHBondContact OD1-OG 3.28Å |
| 403 | D | 36 | Very low | 37.9 | Very low | 150 Ų | 150 | 138.6 Ų | 138.6 | 80% | 0.802 | 78% | 0.783 | S | S | * | * | | | trans | -149.9 | 123.5 | 173.3 | -161.7 | 0.2 | 0 | 0 | 0 | 114.8 | L401 | L401-D403 PolarHBondContact O-N 2.97Š|
| 404 | R | 35.3 | Very low | 37.5 | Very low | 231 Ų | 231 | 136.5 Ų | 136.5 | 87% | 0.872 | 78% | 0.778 | S | S | * | * | | | | -175.4 | 107.4 | 127.3 | -163.1 | 155.9 | -177.2 | 122.2 | -10.3 | 112 | | |
| 405 | A | 34.6 | Very low | 37.2 | Very low | 81 Ų | 81 | 137.7 Ų | 137.7 | 67% | 0.669 | 78% | 0.776 | S | S | * | * | | | trans | -87.7 | 157.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 406 | K | 34.7 | Very low | 37.1 | Very low | 189 Ų | 189 | 139.3 Ų | 139.3 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | | | trans | 155.2 | 141.7 | 158.7 | -89.9 | 158.3 | -173.1 | -172.2 | 0 | 109.2 | | |
| 407 | T | 33.3 | Very low | 37 | Very low | 135 Ų | 135 | 136.3 Ų | 136.3 | 83% | 0.828 | 77% | 0.767 | S | S | * | * | | | cis | -156.6 | 160.8 | -5.6 | -0.5 | 0 | 0 | 0 | 0 | 109.7 | | |
| 408 | K | 35.2 | Very low | 37.9 | Very low | 196 Ų | 196 | 139.2 Ų | 139.2 | 85% | 0.852 | 78% | 0.777 | S | S | * | * | | | trans | -108.3 | 158.1 | 167.8 | -120 | 177.4 | -176.9 | -178.4 | 0 | 108.9 | | |
| 409 | P | 42.8 | Very low | 37.1 | Very low | 109 Ų | 109 | 140.8 Ų | 140.8 | 71% | 0.708 | 78% | 0.776 | S | S | * | * | | | | -151.7 | 166.2 | 94.7 | 40.4 | -23 | 0 | 0 | 0 | 117.6 | | |
| 410 | N | 29.1 | Very low | 36.2 | Very low | 159 Ų | 159 | 137.9 Ų | 137.9 | 85% | 0.85 | 78% | 0.775 | S | S | * | * | | | trans | 78 | 151.3 | 153.4 | -61.8 | -8.1 | 0 | 0 | 0 | 122.7 | | |
| 411 | Q | 32.6 | Very low | 35.4 | Very low | 179 Ų | 179 | 140.2 Ų | 140.2 | 84% | 0.836 | 79% | 0.786 | S | S | * | * | | | trans | -133.6 | -174.6 | -178.6 | -107.1 | -132 | -15.8 | 0 | 0 | 106.6 | | |
| 412 | P | 46.8 | Very low | 35 | Very low | 116 Ų | 116 | 141.5 Ų | 141.5 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | | | cis | -134.4 | -164.7 | 16.8 | 43.2 | -24.1 | 0 | 0 | 0 | 114.4 | | |
| 413 | G | 25.6 | Very low | 34.3 | Very low | 71 Ų | 71 | 142.9 Ų | 142.9 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | | | trans | 159.2 | 91.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 414 | N | 29.4 | Very low | 34.1 | Very low | 134 Ų | 134 | 145.4 Ų | 145.4 | 72% | 0.717 | 80% | 0.803 | S | S | * | * | | | trans | -69.9 | 152.7 | -174.5 | -90.3 | 46.8 | 0 | 0 | 0 | 117.5 | | |
| 415 | D | 29.9 | Very low | 33.7 | Very low | 129 Ų | 129 | 138 Ų | 138 | 69% | 0.69 | 80% | 0.799 | S | S | * | * | | | trans | 71.4 | 148.5 | 134.5 | -54.3 | -19.8 | 0 | 0 | 0 | 125.5 | | |
| 416 | D | 28.5 | Very low | 33.5 | Very low | 155 Ų | 155 | 141.7 Ų | 141.7 | 83% | 0.829 | 81% | 0.808 | S | S | * | * | | | trans | 78.9 | 144.7 | 152.1 | -69.3 | -20 | 0 | 0 | 0 | 125.7 | | |
| 417 | S | 37.8 | Very low | 33.3 | Very low | 109 Ų | 109 | 138.4 Ų | 138.4 | 76% | 0.762 | 80% | 0.804 | S | S | * | * | | | trans | -151 | 175.8 | 170.1 | -63.4 | 0 | 0 | 0 | 0 | 105.3 | | |
| 418 | P | 59.6 | Low | 33.2 | Very low | 112 Ų | 112 | 139.5 Ų | 139.5 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | | | cis | -127.8 | -163.9 | -4.6 | 42.2 | -26 | 0 | 0 | 0 | 111.4 | | |
| 419 | I | 29 | Very low | 32.9 | Very low | 166 Ų | 166 | 141 Ų | 141 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | | | | -177.1 | 155 | 126.5 | -96.8 | 160.2 | 0 | 0 | 0 | 109.7 | | |
| 420 | A | 30.1 | Very low | 32.3 | Very low | 92 Ų | 92 | 139.9 Ų | 139.9 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | | | trans | -113.6 | 162.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 421 | L | 30.2 | Very low | 33.2 | Very low | 175 Ų | 175 | 138.3 Ų | 138.3 | 92% | 0.916 | 79% | 0.793 | S | S | * | * | | | trans | -151.4 | 156.1 | 160.4 | -111.7 | 172.4 | 0 | 0 | 0 | 111.2 | | |
| 422 | Q | 34.4 | Very low | 33.2 | Very low | 176 Ų | 176 | 136 Ų | 136 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | | | trans | -116.6 | 161.6 | -179.4 | -60.7 | 175.8 | -2 | 0 | 0 | 110.6 | | |
| 423 | C | 25.9 | Very low | 32.8 | Very low | 136 Ų | 136 | 140.1 Ų | 140.1 | 92% | 0.919 | 79% | 0.787 | S | S | * | * | | | trans | -158.1 | 159.2 | 148.1 | -102.7 | 0 | 0 | 0 | 0 | 111.3 | | |
| 424 | E | 31.4 | Very low | 33.1 | Very low | 203 Ų | 203 | 142.8 Ų | 142.8 | 95% | 0.949 | 78% | 0.784 | S | S | * | * | | | trans | -103.8 | 176.4 | -170.1 | -59.5 | 175.7 | 111.6 | 0 | 0 | 113.4 | | |
| 425 | G | 27.4 | Very low | 33.3 | Very low | 77 Ų | 77 | 141.5 Ų | 141.5 | 79% | 0.794 | 78% | 0.781 | S | S | * | * | | | trans | 173.4 | 106.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 426 | D | 29.7 | Very low | 33.4 | Very low | 158 Ų | 158 | 141.7 Ų | 141.7 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | | | trans | -76.8 | 164.1 | -178.2 | -82.6 | -64.4 | 0 | 0 | 0 | 115.8 | | |
| 427 | T | 30 | Very low | 33.5 | Very low | 120 Ų | 120 | 140.5 Ų | 140.5 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | | | | 160.7 | 118.2 | 117.5 | -70 | 0 | 0 | 0 | 0 | 114.7 | | |
| 428 | Q | 32.3 | Very low | 33.2 | Very low | 158 Ų | 158 | 139.6 Ų | 139.6 | 74% | 0.738 | 78% | 0.78 | S | S | * | * | | | trans | 46 | 161.2 | 149.2 | -61.8 | -169.9 | 6.2 | 0 | 0 | 121 | | |
| 429 | R | 28.4 | Very low | 31.7 | Very low | 226 Ų | 226 | 142.1 Ų | 142.1 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | | | cis | -158.7 | 169.6 | 18.8 | -142.1 | 166.7 | -150.6 | -125.8 | 4.8 | 112 | | |
| 430 | S | 30.6 | Very low | 32.5 | Very low | 86 Ų | 86 | 139.2 Ų | 139.2 | 60% | 0.601 | 78% | 0.777 | S | S | * | * | | | trans | -76.3 | 169.8 | 178.4 | -150.1 | 0 | 0 | 0 | 0 | 113.8 | D432 | S430-D432 PolarHBondContact OG-OD2 2.72Š|
| 431 | P | 48.5 | Very low | 32.4 | Very low | 126 Ų | 126 | 140.5 Ų | 140.5 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | | | | -147.4 | 165.7 | 81.9 | 41.8 | -25.1 | 0 | 0 | 0 | 118.2 | | |
| 432 | D | 31.8 | Very low | 32.2 | Very low | 130 Ų | 130 | 138 Ų | 138 | 70% | 0.695 | 77% | 0.773 | S | S | * | * | | | trans | -100 | 178.4 | 175.1 | -43.5 | -124.3 | 0 | 0 | 0 | 110.5 | S430 | S430-D432 PolarHBondContact OG-OD2 2.72Š|
| 433 | R | 37.6 | Very low | 31.9 | Very low | 203 Ų | 203 | 135 Ų | 135 | 77% | 0.766 | 77% | 0.771 | S | S | * | * | | | cis | -170.9 | 170.6 | 2.2 | -143.3 | 176.3 | 141.8 | 163.1 | -0.9 | 110.9 | | |
| 434 | N | 32.8 | Very low | 32.7 | Very low | 127 Ų | 127 | 134.1 Ų | 134.1 | 68% | 0.679 | 76% | 0.764 | S | S | * | * | | | trans | 67.6 | 157.1 | 147.4 | -85 | 16.8 | 0 | 0 | 0 | 118.4 | | |
| 435 | V | 33.3 | Very low | 32.6 | Very low | 107 Ų | 107 | 130.1 Ų | 130.1 | 65% | 0.648 | 76% | 0.758 | S | S | * | * | | | cis | -160.3 | 154.1 | -7.6 | 104.3 | 0 | 0 | 0 | 0 | 113.8 | | |
| 436 | N | 31.8 | Very low | 32.6 | Very low | 133 Ų | 133 | 133.9 Ų | 133.9 | 71% | 0.711 | 76% | 0.76 | S | S | * | * | | | trans | 57.6 | 118.6 | 154.8 | -65.9 | -0.5 | 0 | 0 | 0 | 126.3 | | |
| 437 | T | 31.9 | Very low | 32.5 | Very low | 130 Ų | 130 | 133 Ų | 133 | 80% | 0.798 | 75% | 0.753 | S | S | * | * | | | | 67.4 | 109.5 | 115.5 | -47.1 | 0 | 0 | 0 | 0 | 123.1 | | |
| 438 | A | 30.7 | Very low | 32.4 | Very low | 91 Ų | 91 | 133.2 Ų | 133.2 | 75% | 0.752 | 76% | 0.76 | S | S | * | * | | | | -171 | 161.4 | 127.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 439 | I | 29 | Very low | 32.3 | Very low | 164 Ų | 164 | 132.5 Ų | 132.5 | 84% | 0.841 | 76% | 0.76 | S | S | * | * | | | trans | -154.4 | 172 | 179.1 | 2.1 | 172.8 | 0 | 0 | 0 | 107.6 | | |
| 440 | P | 45.7 | Very low | 32.6 | Very low | 105 Ų | 105 | 128 Ų | 128 | 68% | 0.682 | 76% | 0.76 | S | S | * | * | | | cis | -145.8 | -169.3 | 0.7 | 46 | -26.7 | 0 | 0 | 0 | 118.1 | | |
| 441 | V | 27.2 | Very low | 32.4 | Very low | 120 Ų | 120 | 128.6 Ų | 128.6 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | | | trans | 67.2 | 129.8 | 152.9 | 178.2 | 0 | 0 | 0 | 0 | 120.9 | | |
| 442 | S | 25.7 | Very low | 31.5 | Very low | 123 Ų | 123 | 128.1 Ų | 128.1 | 86% | 0.86 | 76% | 0.764 | S | S | * | * | | | trans | -129.7 | 145.7 | 148.5 | -66.8 | 0 | 0 | 0 | 0 | 109.8 | | |
| 443 | S | 27.7 | Very low | 31.3 | Very low | 111 Ų | 111 | 126.8 Ų | 126.8 | 78% | 0.776 | 77% | 0.765 | S | S | * | * | | | trans | -141.6 | 135.5 | 172.5 | -65.1 | 0 | 0 | 0 | 0 | 110.4 | | |
| 444 | P | 43 | Very low | 30.9 | Very low | 118 Ų | 118 | 122.2 Ų | 122.2 | 77% | 0.766 | 76% | 0.764 | S | S | * | * | | | trans | -128.4 | 164.9 | 174.6 | 40.6 | -29 | 0 | 0 | 0 | 116 | | |
| 445 | S | 28.7 | Very low | 30.9 | Very low | 120 Ų | 120 | 121.3 Ų | 121.3 | 84% | 0.839 | 77% | 0.768 | S | S | * | * | | | trans | 86.3 | 130.8 | 154.3 | -55.1 | 0 | 0 | 0 | 0 | 120 | | |
| 446 | L | 27.2 | Very low | 30.7 | Very low | 156 Ų | 156 | 122.7 Ų | 122.7 | 82% | 0.817 | 78% | 0.777 | S | S | * | * | | | trans | -124.3 | 135.8 | 169.5 | -75.2 | 170.6 | 0 | 0 | 0 | 110.7 | | |
| 447 | I | 28.2 | Very low | 30.8 | Very low | 138 Ų | 138 | 122.5 Ų | 122.5 | 71% | 0.708 | 78% | 0.782 | S | S | * | * | | | trans | 44.5 | 120.4 | 137.1 | -52.9 | 172.7 | 0 | 0 | 0 | 119.1 | | |
| 448 | S | 27.3 | Very low | 30.6 | Very low | 126 Ų | 126 | 122 Ų | 122 | 88% | 0.881 | 77% | 0.774 | S | S | * | * | | | trans | -154.4 | 145.7 | 132.4 | -82.2 | 0 | 0 | 0 | 0 | 111 | | |
| 449 | L | 30.4 | Very low | 30.6 | Very low | 143 Ų | 143 | 126.3 Ų | 126.3 | 75% | 0.749 | 78% | 0.776 | S | S | * | * | | | trans | -104 | 168.7 | -177.6 | -74.9 | 153.1 | 0 | 0 | 0 | 110.6 | | |
| 450 | P | 35.9 | Very low | 30.5 | Very low | 130 Ų | 130 | 125.5 Ų | 125.5 | 84% | 0.844 | 77% | 0.768 | S | S | * | * | | | | -136.3 | 156.9 | 94.1 | 37.2 | -25.8 | 0 | 0 | 0 | 114.9 | | |
| 451 | S | 26.9 | Very low | 29.7 | Very low | 100 Ų | 100 | 129.1 Ų | 129.1 | 70% | 0.699 | 78% | 0.776 | S | S | * | * | | | trans | -89 | 163.7 | -177.7 | -44.6 | 0 | 0 | 0 | 0 | 113.3 | | |
| 452 | S | 28 | Very low | 29.6 | Very low | 115 Ų | 115 | 132.5 Ų | 132.5 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | | | trans | -165.8 | 133.8 | 131.2 | -82.5 | 0 | 0 | 0 | 0 | 115 | | |
| 453 | S | 28.7 | Very low | 29.7 | Very low | 103 Ų | 103 | 134.4 Ų | 134.4 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | | | trans | 49.2 | 96.7 | 149 | 60.8 | 0 | 0 | 0 | 0 | 122.4 | | |
| 454 | S | 29.5 | Very low | 29.6 | Very low | 107 Ų | 107 | 137.5 Ų | 137.5 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | | | | -7 | 158.7 | 114.1 | 56.5 | 0 | 0 | 0 | 0 | 119.2 | | |
| 455 | S | 31.4 | Very low | 28.8 | Very low | 107 Ų | 107 | 138.3 Ų | 138.3 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | | | cis | 174.5 | 154.2 | -13.7 | 55.5 | 0 | 0 | 0 | 0 | 109.5 | | |
| 456 | T | 30.2 | Very low | 28.6 | Very low | 137 Ų | 137 | 137.4 Ų | 137.4 | 84% | 0.84 | 78% | 0.776 | S | S | * | * | | | trans | -137.2 | 150.7 | 157.1 | 45 | 0 | 0 | 0 | 0 | 111.7 | | |
| 457 | P | 34 | Very low | 28.5 | Very low | 128 Ų | 128 | 135.5 Ų | 135.5 | 83% | 0.831 | 77% | 0.767 | S | S | * | * | | | trans | -93.2 | 167.5 | -167 | 36.6 | -37 | 0 | 0 | 0 | 115.2 | | |
| 458 | I | 28.4 | Very low | 28.6 | Very low | 121 Ų | 121 | 138 Ų | 138 | 62% | 0.621 | 78% | 0.775 | S | S | * | * | | | trans | -95 | 147.6 | 173.7 | -65.4 | 156.8 | 0 | 0 | 0 | 109.8 | | |
| 459 | K | 28.8 | Very low | 28.7 | Very low | 181 Ų | 181 | 138.7 Ų | 138.7 | 79% | 0.787 | 77% | 0.769 | S | S | * | * | | | trans | 174.7 | 156.2 | 141.2 | -96.3 | -155.8 | -178.7 | -147.4 | 0 | 109.1 | | |
| 460 | Q | 28.3 | Very low | 28.7 | Very low | 147 Ų | 147 | 140.9 Ų | 140.9 | 69% | 0.687 | 78% | 0.775 | S | S | * | * | | | cis | -169 | 152.8 | -31.1 | -128.2 | -177.8 | -51.8 | 0 | 0 | 105 | | |
| 461 | E | 27.3 | Very low | 28.3 | Very low | 180 Ų | 180 | 142.4 Ų | 142.4 | 84% | 0.841 | 77% | 0.771 | S | S | * | * | | | trans | -68.3 | 158.2 | 173 | -64.9 | 123.3 | 112.6 | 0 | 0 | 112.8 | | |
| 462 | Q | 26.4 | Very low | 28.3 | Very low | 192 Ų | 192 | 143.4 Ų | 143.4 | 90% | 0.897 | 77% | 0.772 | S | S | * | * | | | trans | -146.1 | 127 | 142.2 | -167.3 | 157.4 | -1.9 | 0 | 0 | 109.6 | | |
| 463 | E | 27.7 | Very low | 28.3 | Very low | 163 Ų | 163 | 146.5 Ų | 146.5 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | | | trans | -76 | 162.1 | 175.5 | -64 | 176.8 | 108.4 | 0 | 0 | 111.6 | | |
| 464 | L | 24.5 | Very low | 28.3 | Very low | 175 Ų | 175 | 149 Ų | 149 | 92% | 0.916 | 78% | 0.78 | S | S | * | * | | | trans | -143 | 138.4 | 154.4 | -150 | 116.2 | 0 | 0 | 0 | 109.6 | | |
| 465 | I | 27.6 | Very low | 28.5 | Very low | 136 Ų | 136 | 152 Ų | 152 | 70% | 0.697 | 78% | 0.782 | S | S | * | * | | | trans | -116.5 | 141.5 | -174.6 | -60 | 167.2 | 0 | 0 | 0 | 108.1 | | |
| 466 | S | 24.2 | Very low | 28.5 | Very low | 100 Ų | 100 | 153.7 Ų | 153.7 | 70% | 0.699 | 78% | 0.782 | S | S | * | * | | | trans | -166.9 | 122.1 | 143.9 | -112.8 | 0 | 0 | 0 | 0 | 112.2 | | |
| 467 | D | 24.8 | Very low | 28.6 | Very low | 117 Ų | 117 | 156 Ų | 156 | 63% | 0.626 | 78% | 0.781 | S | S | * | * | | | trans | 43.4 | 123.8 | 132.8 | -46.3 | -61.4 | 0 | 0 | 0 | 121.5 | | |
| 468 | H | 30.1 | Very low | 28.4 | Very low | 189 Ų | 189 | 158 Ų | 158 | 88% | 0.875 | 78% | 0.776 | S | S | * | * | | | | -146.5 | 132.6 | 120.9 | -106.9 | 50.3 | 0 | 0 | 0 | 109.2 | | |
| 469 | N | 28.7 | Very low | 28.4 | Very low | 141 Ų | 141 | 158.5 Ų | 158.5 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | | | trans | -100.2 | 149.6 | 171 | -73 | -64.9 | 0 | 0 | 0 | 109.5 | | |
| 470 | H | 31.8 | Very low | 28.3 | Very low | 189 Ų | 189 | 158 Ų | 158 | 88% | 0.875 | 78% | 0.777 | S | S | * | * | | | trans | -150.6 | 152.4 | 149.7 | -114.4 | -68.2 | 0 | 0 | 0 | 112.3 | | |
| 471 | E | 26.6 | Very low | 28.5 | Very low | 162 Ų | 162 | 154.9 Ų | 154.9 | 76% | 0.757 | 78% | 0.776 | S | S | * | * | | | trans | -78.3 | 160.1 | -165.8 | -88.3 | 175.2 | 94.3 | 0 | 0 | 117.2 | | |
| 472 | V | 28.1 | Very low | 28.4 | Very low | 121 Ų | 121 | 152.6 Ų | 152.6 | 73% | 0.733 | 77% | 0.77 | S | S | * | * | | | trans | 56.3 | 113 | 138.7 | 177.2 | 0 | 0 | 0 | 0 | 118.8 | | |
| 473 | E | 27.3 | Very low | 28.6 | Very low | 180 Ų | 180 | 148.1 Ų | 148.1 | 84% | 0.841 | 75% | 0.752 | S | S | * | * | | | | -152.8 | 146.7 | 102.3 | -112.6 | -166.3 | 147.2 | 0 | 0 | 111 | | |
| 474 | D | 29.6 | Very low | 28.8 | Very low | 157 Ų | 157 | 148.4 Ų | 148.4 | 84% | 0.84 | 75% | 0.751 | S | S | * | * | | | trans | -129.2 | 129.8 | -178.9 | -160 | -0.7 | 0 | 0 | 0 | 108.3 | | |
| 475 | Q | 31.9 | Very low | 29 | Very low | 168 Ų | 168 | 145.6 Ų | 145.6 | 79% | 0.785 | 74% | 0.741 | S | S | * | * | | | trans | -154.9 | 113.3 | 179.7 | -162.3 | 154.2 | 111.7 | 0 | 0 | 114.6 | | |
| 476 | D | 32.3 | Very low | 29.1 | Very low | 143 Ų | 143 | 147.6 Ų | 147.6 | 77% | 0.765 | 75% | 0.747 | S | S | * | * | | | trans | -57.3 | 144.1 | 172.9 | -83.9 | -60.9 | 0 | 0 | 0 | 114.9 | | |
| 477 | K | 31.3 | Very low | 29.5 | Very low | 186 Ų | 186 | 151.1 Ų | 151.1 | 81% | 0.809 | 75% | 0.753 | S | S | * | * | | | | -175.7 | 141.6 | 107 | -97 | 146.6 | -165 | 158.2 | 0 | 115.2 | | |
| 478 | K | 30.7 | Very low | 29.9 | Very low | 169 Ų | 169 | 152.4 Ų | 152.4 | 74% | 0.735 | 77% | 0.765 | S | S | * | * | | | | 22.8 | 146.5 | 128.2 | -75.5 | -178.3 | 154 | -141.7 | 0 | 119.3 | | |
| 479 | E | 27.7 | Very low | 30 | Very low | 132 Ų | 132 | 151.6 Ų | 151.6 | 62% | 0.617 | 77% | 0.767 | S | S | * | * | | | cis | -159 | -173.7 | 25.8 | -141.7 | 144.8 | -154.2 | 0 | 0 | 114 | | |
| 480 | E | 28.2 | Very low | 30.2 | Very low | 171 Ų | 171 | 147.8 Ų | 147.8 | 80% | 0.799 | 76% | 0.761 | S | S | * | * | | | trans | -30.2 | 161.3 | 166.5 | -69.3 | 172.9 | 93.8 | 0 | 0 | 118.4 | | |
| 481 | A | 30.9 | Very low | 30.7 | Very low | 82 Ų | 82 | 148.9 Ų | 148.9 | 68% | 0.678 | 76% | 0.763 | S | S | * | * | | | cis | -171.5 | -160 | -14.7 | 0 | 0 | 0 | 0 | 0 | 106.8 | | |
| 482 | N | 26.1 | Very low | 31.1 | Very low | 132 Ų | 132 | 151 Ų | 151 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | | | cis | -160.2 | -175.8 | 3.2 | -157.6 | 17.7 | 0 | 0 | 0 | 111.9 | | |
| 483 | D | 29.8 | Very low | 31.5 | Very low | 98 Ų | 98 | 150.8 Ų | 150.8 | 52% | 0.524 | 77% | 0.769 | S | S | . | * | | | trans | 65.2 | 93.8 | 150.9 | -76.6 | -44.4 | 0 | 0 | 0 | 122.6 | | |
| 484 | K | 32.5 | Very low | 32.2 | Very low | 168 Ų | 168 | 147.7 Ų | 147.7 | 73% | 0.73 | 76% | 0.764 | S | S | * | * | | | | 59.7 | 124.4 | 112.7 | -67.7 | -174.2 | -166.2 | 99.1 | 0 | 122.3 | | |
| 485 | T | 29.1 | Very low | 32.3 | Very low | 117 Ų | 117 | 145.4 Ų | 145.4 | 72% | 0.718 | 76% | 0.755 | S | S | * | * | | | | 75.6 | 138.3 | 129.6 | -58.4 | 0 | 0 | 0 | 0 | 117.5 | | |
| 486 | E | 28.5 | Very low | 32.6 | Very low | 177 Ų | 177 | 144.6 Ų | 144.6 | 83% | 0.827 | 76% | 0.756 | S | S | * | * | | | cis | -141.2 | -164.4 | 6.7 | -149.1 | 150.4 | -128.6 | 0 | 0 | 113.9 | | |
| 487 | Q | 33.7 | Very low | 32.9 | Very low | 175 Ų | 175 | 143.7 Ų | 143.7 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | | | trans | -82.8 | 147.6 | -172.8 | -51.1 | 169.5 | 17.5 | 0 | 0 | 113.8 | | |
| 488 | T | 33 | Very low | 33.2 | Very low | 143 Ų | 143 | 142.2 Ų | 142.2 | 88% | 0.877 | 76% | 0.756 | S | S | * | * | | | trans | -146.9 | 158.9 | 145.7 | 32.7 | 0 | 0 | 0 | 0 | 111.2 | | |
| 489 | N | 32.5 | Very low | 33.6 | Very low | 173 Ų | 173 | 139.2 Ų | 139.2 | 93% | 0.925 | 76% | 0.756 | S | S | * | * | | | trans | -82 | 140.6 | -167.2 | -70.2 | -76.5 | 0 | 0 | 0 | 114 | | |
| 490 | G | 32 | Very low | 34.6 | Very low | 60 Ų | 60 | 141 Ų | 141 | 62% | 0.619 | 77% | 0.769 | S | S | * | * | | | trans | -169.6 | 125.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | K492 | G490-K492 PolarHBondContact O-N 3.28Š|
| 491 | K | 43 | Very low | 35.6 | Very low | 213 Ų | 213 | 142.2 Ų | 142.2 | 93% | 0.926 | 77% | 0.766 | S | S | * | * | | | trans | -71.8 | 107 | 180 | -65.6 | 169.6 | -178.1 | 172.6 | 0 | 110.1 | V493 | K491-V493 PolarHBondContact O-N 2.8Š|
| 492 | K | 34.3 | Very low | 36.5 | Very low | 205 Ų | 205 | 144.3 Ų | 144.3 | 89% | 0.891 | 77% | 0.773 | S | S | * | * | | | trans | -84.8 | 102.2 | -178.4 | -66.9 | -175.9 | -179.2 | 179.4 | 0 | 111.9 | G490 | G490-K492 PolarHBondContact O-N 3.28Š|
| 493 | V | 37.8 | Very low | 37.3 | Very low | 118 Ų | 118 | 141.5 Ų | 141.5 | 72% | 0.715 | 77% | 0.768 | S | S | * | * | | | trans | -87.7 | 127.8 | 158.6 | 178.7 | 0 | 0 | 0 | 0 | 107.8 | K491 V495 | K491-V493 PolarHBondContact O-N 2.8Å; V493-V495 VanDerWaalsContact C-N 3.3Å; V493-V495 HydrophobicContact CG1-CG2 4.19Å; V493-V495 PolarHBondContact O-N 3.36Å |
| 494 | P | 40.6 | Very low | 38.1 | Very low | 115 Ų | 115 | 142.4 Ų | 142.4 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | | | trans | -76.8 | 78.9 | 178.2 | 31.6 | -34.6 | 0 | 0 | 0 | 111.1 | L496 | P494-L496 PolarHBondContact O-N 3.04Š|
| 495 | V | 32.8 | Very low | 38.9 | Very low | 108 Ų | 108 | 139.3 Ų | 139.3 | 66% | 0.655 | 77% | 0.767 | S | S | * | * | | | trans | -75.2 | 101.9 | 167.3 | -176.6 | 0 | 0 | 0 | 0 | 108.3 | V493 T497 | V493-V495 VanDerWaalsContact C-N 3.3Å; V493-V495 HydrophobicContact CG1-CG2 4.19Å; V493-V495 PolarHBondContact O-N 3.36Å; V495-T497 VanDerWaalsContact C-N 3.3Å; V495-T497 HydrophobicContact CG1-CG2 4.05Å; V495-T497 PolarHBondContact O-N 3Å |
| 496 | L | 36.9 | Very low | 39.7 | Very low | 152 Ų | 152 | 143.6 Ų | 143.6 | 80% | 0.796 | 77% | 0.77 | S | S | * | * | | | trans | -73.6 | 80.3 | 176.4 | -68.1 | 175.3 | 0 | 0 | 0 | 110.9 | P494 L498 | P494-L496 PolarHBondContact O-N 3.04Å; L496-L498 VanDerWaalsContact C-N 3.29Å; L496-L498 PolarHBondContact O-N 3.25Å |
| 497 | T | 39.7 | Very low | 40.7 | Very low | 124 Ų | 124 | 140.9 Ų | 140.9 | 76% | 0.761 | 76% | 0.76 | S | S | * | * | | | trans | -71.2 | 83.2 | 168.9 | 52.7 | 0 | 0 | 0 | 0 | 110.3 | V495 S499 | V495-T497 VanDerWaalsContact C-N 3.3Å; V495-T497 HydrophobicContact CG1-CG2 4.05Å; V495-T497 PolarHBondContact O-N 3Å; T497-S499 PolarHBondContact O-N 2.89Å; T497-S499 VanDerWaalsContact O-N 3.11Å |
| 498 | L | 38.3 | Very low | 41.6 | Very low | 154 Ų | 154 | 138.8 Ų | 138.8 | 81% | 0.806 | 75% | 0.751 | S | S | * | * | | | trans | -63.4 | 110 | 171.2 | -71.4 | 172.1 | 0 | 0 | 0 | 109.8 | L496 L500 | L496-L498 VanDerWaalsContact C-N 3.29Å; L496-L498 PolarHBondContact O-N 3.25Å; L498-L500 PolarHBondContact O-N 3.48Å; L498-L500 VanDerWaalsContact O-N 3.08Å |
| 499 | S | 38.9 | Very low | 42.6 | Very low | 106 Ų | 106 | 135.9 Ų | 135.9 | 74% | 0.741 | 73% | 0.733 | S | S | * | * | | | trans | -71.6 | 100.2 | -175.8 | -175.1 | 0 | 0 | 0 | 0 | 111.7 | T497 R501 | T497-S499 PolarHBondContact O-N 2.89Å; T497-S499 VanDerWaalsContact O-N 3.11Å; S499-R501 PolarHBondContact O-N 3Å |
| 500 | L | 47.2 | Very low | 43.4 | Very low | 170 Ų | 170 | 133.3 Ų | 133.3 | 89% | 0.89 | 72% | 0.719 | S | S | * | * | | | trans | -80.9 | 67.6 | 174.2 | -71.5 | 177 | 0 | 0 | 0 | 112.3 | L498 | L498-L500 PolarHBondContact O-N 3.48Å; L498-L500 VanDerWaalsContact O-N 3.08Å |
| 501 | R | 49.9 | Very low | 44.4 | Very low | 197 Ų | 197 | 134.4 Ų | 134.4 | 74% | 0.743 | 71% | 0.713 | S | S | * | * | | | trans | -134.9 | 111.3 | 156.1 | -66 | -172.4 | 179.9 | -168.3 | 0.9 | 107.2 | S499 | S499-R501 PolarHBondContact O-N 3Š|
| 502 | P | 50.4 | Low | 45 | Very low | 126 Ų | 126 | 127 Ų | 127 | 82% | 0.818 | 69% | 0.688 | S | S | * | * | S | Bend | | -141.8 | 95.8 | 81.6 | 35.2 | -18 | 0 | 0 | 0 | 113.7 | | |
| 503 | A | 42.3 | Very low | 45.8 | Very low | 73 Ų | 73 | 120 Ų | 120 | 60% | 0.603 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -120.6 | -42.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | V505 R506 | A503-V505 PolarHBondContact O-N 2.99Å; A503-R506 PolarHBondContact O-N 2.97Å |
| 504 | L | 47.4 | Very low | 46.3 | Very low | 117 Ų | 117 | 120.1 Ų | 120.1 | 61% | 0.613 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -37.7 | -171.7 | -63.1 | 172.9 | 0 | 0 | 0 | 113.8 | R506 L507 E508 | L504-R506 PolarHBondContact O-N 3.35Å; L504-R506 VanDerWaalsContact O-N 3.14Å; L504-L507 PolarHBondContact O-N 3.33Å; L504-E508 PolarHBondContact O-N 2.88Å |
| 505 | V | 49.2 | Very low | 46.8 | Very low | 102 Ų | 102 | 121.5 Ų | 121.5 | 62% | 0.618 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -60.4 | -27.2 | -177.8 | -174.9 | 0 | 0 | 0 | 0 | 112.7 | A503 T509 | A503-V505 PolarHBondContact O-N 2.99Å; V505-T509 WeakPolarHBondContact O-CG2 3.32Å; V505-T509 PolarHBondContact O-N 3.43Å; V505-T509 PolarHBondContact O-OG1 3.04Å |
| 506 | R | 46.4 | Very low | 47.5 | Very low | 208 Ų | 208 | 123.2 Ų | 123.2 | 79% | 0.785 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -82.7 | -13.7 | 177.4 | -80.1 | -172.1 | 173.7 | 172.9 | -0.8 | 114.4 | A503 L504 T509 L510 | A503-R506 PolarHBondContact O-N 2.97Å; L504-R506 PolarHBondContact O-N 3.35Å; L504-R506 VanDerWaalsContact O-N 3.14Å; R506-T509 WeakPolarHBondContact CA-OG1 3.3Å; R506-T509 PolarHBondContact O-OG1 3.39Å; R506-L510 WeakPolarHBondContact O-CD1 3.33Å; R506-L510 WeakPolarHBondContact O-CG 3.46Å |
| 507 | L | 48.9 | Very low | 47.8 | Very low | 119 Ų | 119 | 123.3 Ų | 123.3 | 62% | 0.623 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -90.4 | -42.4 | 174.9 | -167.5 | 63.9 | 0 | 0 | 0 | 110.9 | L504 T509 L510 T511 | L504-L507 PolarHBondContact O-N 3.33Å; L507-T509 VanDerWaalsContact C-N 3.31Å; L507-T509 PolarHBondContact O-N 2.94Å; L507-L510 PolarHBondContact O-N 3.03Å; L507-L510 VanDerWaalsContact O-N 3.15Å; L507-T511 PolarHBondContact O-N 2.77Å; L507-T511 PolarHBondContact O-OG1 3.09Å |
| 508 | E | 52.8 | Low | 47.9 | Very low | 132 Ų | 132 | 124.8 Ų | 124.8 | 62% | 0.617 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -67.2 | -28.7 | -179.9 | -168.2 | 165.7 | -132 | 0 | 0 | 113.3 | L504 T511 S512 | L504-E508 PolarHBondContact O-N 2.88Å; E508-T511 PolarHBondContact O-OG1 2.86Å; E508-T511 VanDerWaalsContact O-OG1 3.05Å; E508-S512 VanDerWaalsContact O-CB 3.24Å; E508-S512 WeakPolarHBondContact O-CB 3.45Å; E508-S512 PolarHBondContact O-N 2.97Å; E508-S512 VanDerWaalsContact O-N 3.11Å; E508-S512 PolarHBondContact O-OG 3Å |
| 509 | T | 53.5 | Low | 48 | Very low | 81 Ų | 81 | 121.6 Ų | 121.6 | 50% | 0.497 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -72.8 | -30.5 | 172.1 | 39 | 0 | 0 | 0 | 0 | 113.1 | V505 R506 L507 A513 | V505-T509 WeakPolarHBondContact O-CG2 3.32Å; V505-T509 PolarHBondContact O-N 3.43Å; V505-T509 PolarHBondContact O-OG1 3.04Å; R506-T509 WeakPolarHBondContact CA-OG1 3.3Å; R506-T509 PolarHBondContact O-OG1 3.39Å; L507-T509 VanDerWaalsContact C-N 3.31Å; L507-T509 PolarHBondContact O-N 2.94Å; T509-A513 WeakPolarHBondContact O-CB 3.35Å; T509-A513 PolarHBondContact O-N 3.23Å |
| 510 | L | 49 | Very low | 48.2 | Very low | 120 Ų | 120 | 123.4 Ų | 123.4 | 63% | 0.628 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -76.8 | -40.3 | 177.5 | -69.4 | 172.8 | 0 | 0 | 0 | 112.1 | R506 L507 A513 L514 | R506-L510 WeakPolarHBondContact O-CD1 3.33Å; R506-L510 WeakPolarHBondContact O-CG 3.46Å; L507-L510 PolarHBondContact O-N 3.03Å; L507-L510 VanDerWaalsContact O-N 3.15Å; L510-A513 PolarHBondContact O-N 3.37Å; L510-L514 PolarHBondContact O-N 3.43Å; L510-L514 VanDerWaalsContact O-N 3.12Å |
| 511 | T | 53 | Low | 47.9 | Very low | 83 Ų | 83 | 120.5 Ų | 120.5 | 51% | 0.509 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -64.1 | -41.9 | 171.3 | 50.3 | 0 | 0 | 0 | 0 | 111.5 | L507 E508 A513 L514 Q515 | L507-T511 PolarHBondContact O-N 2.77Å; L507-T511 PolarHBondContact O-OG1 3.09Å; E508-T511 PolarHBondContact O-OG1 2.86Å; E508-T511 VanDerWaalsContact O-OG1 3.05Å; T511-A513 VanDerWaalsContact C-N 3.26Å; T511-A513 PolarHBondContact O-N 3.22Å; T511-L514 PolarHBondContact O-N 2.94Å; T511-Q515 PolarHBondContact O-N 2.9Å; T511-Q515 VanDerWaalsContact O-N 3.1Å |
| 512 | S | 56.5 | Low | 47.3 | Very low | 56 Ų | 56 | 115.8 Ų | 115.8 | 39% | 0.392 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -62.6 | -29.4 | 174.9 | -63.5 | 0 | 0 | 0 | 0 | 113.7 | E508 K516 | E508-S512 VanDerWaalsContact O-CB 3.24Å; E508-S512 WeakPolarHBondContact O-CB 3.45Å; E508-S512 PolarHBondContact O-N 2.97Å; E508-S512 VanDerWaalsContact O-N 3.11Å; E508-S512 PolarHBondContact O-OG 3Å; S512-K516 WeakPolarHBondContact O-CD 3.32Å; S512-K516 VanDerWaalsContact O-CG 3.28Å; S512-K516 WeakPolarHBondContact O-CG 3.41Å; S512-K516 PolarHBondContact O-N 3.29Å |
| 513 | A | 50.7 | Low | 46.5 | Very low | 58 Ų | 58 | 118 Ų | 118 | 48% | 0.479 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -73.6 | -43.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | T509 L510 T511 K516 Q517 | T509-A513 WeakPolarHBondContact O-CB 3.35Å; T509-A513 PolarHBondContact O-N 3.23Å; L510-A513 PolarHBondContact O-N 3.37Å; T511-A513 VanDerWaalsContact C-N 3.26Å; T511-A513 PolarHBondContact O-N 3.22Å; A513-K516 PolarHBondContact O-N 2.96Å; A513-Q517 PolarHBondContact O-N 3.33Å |
| 514 | L | 48.4 | Very low | 45.9 | Very low | 122 Ų | 122 | 117.9 Ų | 117.9 | 64% | 0.639 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -60.7 | -48.8 | 179.5 | -140.9 | 77 | 0 | 0 | 0 | 111.6 | L510 T511 K516 Q517 E518 | L510-L514 PolarHBondContact O-N 3.43Å; L510-L514 VanDerWaalsContact O-N 3.12Å; T511-L514 PolarHBondContact O-N 2.94Å; L514-K516 PolarHBondContact O-N 2.74Å; L514-Q517 PolarHBondContact O-N 3.05Å; L514-E518 PolarHBondContact O-N 3.12Å |
| 515 | Q | 51.2 | Low | 45.3 | Very low | 144 Ų | 144 | 122.2 Ų | 122.2 | 67% | 0.673 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -69 | -21.8 | -177.8 | -162.5 | 170.7 | 10.6 | 0 | 0 | 113.4 | T511 S519 | T511-Q515 PolarHBondContact O-N 2.9Å; T511-Q515 VanDerWaalsContact O-N 3.1Å; Q515-S519 PolarHBondContact O-OG 3.27Å |
| 516 | K | 47.8 | Very low | 44.5 | Very low | 144 Ų | 144 | 126.5 Ų | 126.5 | 63% | 0.626 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -79.2 | -16.4 | 171.2 | -77.4 | 178.3 | -179.1 | 179.6 | 0 | 113.7 | S512 A513 L514 S519 I520 | S512-K516 WeakPolarHBondContact O-CD 3.32Å; S512-K516 VanDerWaalsContact O-CG 3.28Å; S512-K516 WeakPolarHBondContact O-CG 3.41Å; S512-K516 PolarHBondContact O-N 3.29Å; A513-K516 PolarHBondContact O-N 2.96Å; L514-K516 PolarHBondContact O-N 2.74Å; K516-S519 WeakPolarHBondContact CA-OG 3.47Å; K516-I520 WeakPolarHBondContact O-CD1 3.4Å; K516-I520 WeakPolarHBondContact O-CG1 3.44Å |
| 517 | Q | 42.8 | Very low | 43.7 | Very low | 154 Ų | 154 | 126.1 Ų | 126.1 | 72% | 0.72 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -85.6 | -32.8 | 178.1 | -159.5 | 168.2 | 19.8 | 0 | 0 | 112.2 | A513 L514 | A513-Q517 PolarHBondContact O-N 3.33Å; L514-Q517 PolarHBondContact O-N 3.05Å |
| 518 | E | 40.9 | Very low | 42.7 | Very low | 155 Ų | 155 | 126.2 Ų | 126.2 | 72% | 0.724 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -71.2 | -33 | 175.1 | -65 | -173.8 | 128.6 | 0 | 0 | 112.7 | L514 I520 S521 | L514-E518 PolarHBondContact O-N 3.12Å; E518-I520 VanDerWaalsContact C-N 3.3Å; E518-I520 PolarHBondContact O-N 2.99Å; E518-S521 PolarHBondContact O-N 3.46Å |
| 519 | S | 40.7 | Very low | 42.1 | Very low | 86 Ų | 86 | 125.9 Ų | 125.9 | 60% | 0.601 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | 0.1 | -172.9 | 40.6 | 0 | 0 | 0 | 0 | 115.6 | Q515 K516 | Q515-S519 PolarHBondContact O-OG 3.27Å; K516-S519 WeakPolarHBondContact CA-OG 3.47Å |
| 520 | I | 43.4 | Very low | 40.8 | Very low | 145 Ų | 145 | 127.8 Ų | 127.8 | 74% | 0.744 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | -11.8 | 177.6 | -57.3 | 171.8 | 0 | 0 | 0 | 111.7 | K516 E518 S522 | K516-I520 WeakPolarHBondContact O-CD1 3.4Å; K516-I520 WeakPolarHBondContact O-CG1 3.44Å; E518-I520 VanDerWaalsContact C-N 3.3Å; E518-I520 PolarHBondContact O-N 2.99Å; I520-S522 PolarHBondContact O-N 3.16Å |
| 521 | S | 39.8 | Very low | 40 | Very low | 108 Ų | 108 | 128.7 Ų | 128.7 | 76% | 0.755 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -89.7 | 7.8 | -169.5 | -167.4 | 0 | 0 | 0 | 0 | 116 | E518 | E518-S521 PolarHBondContact O-N 3.46Š|
| 522 | S | 38.6 | Very low | 38.8 | Very low | 99 Ų | 99 | 129.3 Ų | 129.3 | 69% | 0.692 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -141.7 | 62.1 | -171 | 69.5 | 0 | 0 | 0 | 0 | 116 | I520 | I520-S522 PolarHBondContact O-N 3.16Š|
| 523 | N | 32.7 | Very low | 37.6 | Very low | 172 Ų | 172 | 131.4 Ų | 131.4 | 92% | 0.92 | 75% | 0.751 | S | S | * | * | | | trans | -156.3 | 155.5 | 149.3 | -136.2 | -31.5 | 0 | 0 | 0 | 112.8 | | |
| 524 | G | 29.6 | Very low | 37.4 | Very low | 70 Ų | 70 | 134.7 Ų | 134.7 | 72% | 0.722 | 77% | 0.768 | S | S | * | * | | | trans | 114.8 | 70.3 | 171 | 0 | 0 | 0 | 0 | 0 | 117.3 | | |
| 525 | K | 36.5 | Very low | 36.5 | Very low | 208 Ų | 208 | 134 Ų | 134 | 90% | 0.904 | 77% | 0.772 | S | S | * | * | | | trans | -111.5 | 107 | 154.9 | -88.6 | -173.6 | 175.7 | 179.1 | 0 | 109.5 | | |
| 526 | Q | 31.8 | Very low | 35.5 | Very low | 192 Ų | 192 | 133.8 Ų | 133.8 | 90% | 0.897 | 78% | 0.78 | S | S | * | * | | | trans | -157.7 | 108.3 | 157.8 | -117.1 | 171.5 | 32.3 | 0 | 0 | 114.7 | | |
| 527 | K | 28.9 | Very low | 34.7 | Very low | 200 Ų | 200 | 131.9 Ų | 131.9 | 87% | 0.87 | 79% | 0.785 | S | S | * | * | | | trans | 47.1 | 103.2 | 132.4 | -154.4 | 174.4 | -171.2 | 179.7 | 0 | 119.5 | | |
| 528 | C | 28.6 | Very low | 34 | Very low | 121 Ų | 121 | 130.3 Ų | 130.3 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | | | trans | -79.2 | 149.7 | 159.7 | -51.4 | 0 | 0 | 0 | 0 | 111.8 | | |
| 529 | P | 39.4 | Very low | 33.5 | Very low | 126 Ų | 126 | 127.6 Ų | 127.6 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | | | trans | -84.8 | 162.5 | 158.1 | 35.5 | -32.3 | 0 | 0 | 0 | 111.5 | | |
| 530 | S | 27.6 | Very low | 32.9 | Very low | 120 Ų | 120 | 129 Ų | 129 | 84% | 0.839 | 81% | 0.805 | S | S | * | * | | | trans | -129.6 | 129.6 | 178 | 173 | 0 | 0 | 0 | 0 | 110.5 | | |
| 531 | V | 30.3 | Very low | 32.4 | Very low | 139 Ų | 139 | 127.3 Ų | 127.3 | 84% | 0.842 | 81% | 0.806 | S | S | * | * | | | trans | -150.5 | 140.7 | 167.8 | -162.8 | 0 | 0 | 0 | 0 | 110.2 | | |
| 532 | A | 29.4 | Very low | 32 | Very low | 96 Ų | 96 | 130.5 Ų | 130.5 | 79% | 0.793 | 81% | 0.809 | S | S | * | * | | | trans | 61.3 | 111.2 | 161.8 | 0 | 0 | 0 | 0 | 0 | 120.4 | | |
| 533 | S | 30.1 | Very low | 31.5 | Very low | 100 Ų | 100 | 130.2 Ų | 130.2 | 70% | 0.699 | 81% | 0.807 | S | S | * | * | | | trans | -87.5 | 170.1 | 145 | -150.2 | 0 | 0 | 0 | 0 | 108.8 | | |
| 534 | P | 47.6 | Very low | 31.4 | Very low | 127 Ų | 127 | 130 Ų | 130 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | | | | -139.8 | 173.7 | 68.1 | 36.2 | -17.3 | 0 | 0 | 0 | 115.8 | | |
| 535 | C | 28.8 | Very low | 31.4 | Very low | 108 Ų | 108 | 130.8 Ų | 130.8 | 73% | 0.73 | 80% | 0.799 | S | S | * | * | | | trans | -92.8 | 165.9 | -177.2 | -52.4 | 0 | 0 | 0 | 0 | 113.4 | | |
| 536 | V | 30.6 | Very low | 31.1 | Very low | 140 Ų | 140 | 126.4 Ų | 126.4 | 85% | 0.848 | 80% | 0.795 | S | S | * | * | | | trans | -157.7 | 139.8 | 134.7 | -103 | 0 | 0 | 0 | 0 | 113.5 | | |
| 537 | S | 30.6 | Very low | 31.1 | Very low | 104 Ų | 104 | 120.8 Ų | 120.8 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | | | trans | 58.8 | 99.2 | 144.3 | -56.8 | 0 | 0 | 0 | 0 | 123.3 | | |
| 538 | S | 28.7 | Very low | 31.2 | Very low | 121 Ų | 121 | 118.3 Ų | 118.3 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | | | | 56.7 | 149.2 | 103.2 | -54.6 | 0 | 0 | 0 | 0 | 124.2 | | |
| 539 | A | 29.4 | Very low | 31.2 | Very low | 98 Ų | 98 | 121.2 Ų | 121.2 | 81% | 0.81 | 78% | 0.779 | S | S | * | * | | | trans | 72.5 | 129.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | | |
| 540 | S | 29 | Very low | 31 | Very low | 115 Ų | 115 | 120.1 Ų | 120.1 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | | | cis | 92.3 | 84.5 | 23.4 | -171 | 0 | 0 | 0 | 0 | 116 | | |
| 541 | S | 32.7 | Very low | 31 | Very low | 109 Ų | 109 | 121.9 Ų | 121.9 | 76% | 0.762 | 78% | 0.781 | S | S | * | * | | | trans | -168.8 | 115.5 | 146.4 | -79.7 | 0 | 0 | 0 | 0 | 107.5 | | |
| 542 | Q | 30.6 | Very low | 31.1 | Very low | 175 Ų | 175 | 120.5 Ų | 120.5 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | | | | 69 | 108.2 | 89.3 | -72.1 | -163.1 | 25.4 | 0 | 0 | 115.7 | | |
| 543 | S | 29.4 | Very low | 31.2 | Very low | 94 Ų | 94 | 120.1 Ų | 120.1 | 66% | 0.657 | 77% | 0.769 | S | S | * | * | | | | 70 | 117.8 | 126.5 | -53.7 | 0 | 0 | 0 | 0 | 121.5 | | |
| 544 | L | 30.8 | Very low | 31.2 | Very low | 166 Ų | 166 | 123.6 Ų | 123.6 | 87% | 0.869 | 78% | 0.779 | S | S | * | * | | | trans | 69.3 | 155.6 | 142.2 | -59 | 169.4 | 0 | 0 | 0 | 117 | | |
| 545 | S | 28.1 | Very low | 30.5 | Very low | 87 Ų | 87 | 124.5 Ų | 124.5 | 61% | 0.608 | 78% | 0.777 | S | S | * | * | | | cis | -172 | 153 | -24.1 | 51.3 | 0 | 0 | 0 | 0 | 109.4 | | |
| 546 | S | 31.3 | Very low | 30.7 | Very low | 116 Ų | 116 | 126.5 Ų | 126.5 | 81% | 0.811 | 78% | 0.776 | S | S | * | * | | | trans | 63.8 | 169 | 162.6 | 76.9 | 0 | 0 | 0 | 0 | 116.3 | | |
| 547 | A | 30.3 | Very low | 30.7 | Very low | 75 Ų | 75 | 127.4 Ų | 127.4 | 62% | 0.62 | 77% | 0.77 | S | S | * | * | | | cis | -169.1 | 164.2 | -42 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 548 | N | 31.6 | Very low | 30.7 | Very low | 147 Ų | 147 | 131 Ų | 131 | 79% | 0.786 | 78% | 0.776 | S | S | * | * | | | trans | 69.9 | 113.4 | 159.5 | -63.6 | 6 | 0 | 0 | 0 | 116 | | |
| 549 | E | 29.7 | Very low | 30.7 | Very low | 182 Ų | 182 | 129 Ų | 129 | 85% | 0.85 | 77% | 0.773 | S | S | * | * | | | | 83.4 | 105.6 | 77.6 | -70.5 | -92.5 | 174.9 | 0 | 0 | 112.3 | | |
| 550 | A | 33.8 | Very low | 30.9 | Very low | 103 Ų | 103 | 132.9 Ų | 132.9 | 85% | 0.851 | 77% | 0.772 | S | S | * | * | | | trans | -158.3 | 103.1 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 551 | D | 28.6 | Very low | 31 | Very low | 157 Ų | 157 | 133.1 Ų | 133.1 | 84% | 0.84 | 77% | 0.774 | S | S | * | * | | | trans | -62.9 | 146 | 169.9 | -179.4 | 18.2 | 0 | 0 | 0 | 112.2 | | |
| 552 | S | 31.4 | Very low | 30.8 | Very low | 111 Ų | 111 | 131.3 Ų | 131.3 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | | | trans | -175.9 | 126.1 | 136.7 | -170.4 | 0 | 0 | 0 | 0 | 112.8 | | |
| 553 | S | 32.5 | Very low | 31.7 | Very low | 87 Ų | 87 | 129 Ų | 129 | 61% | 0.608 | 77% | 0.773 | S | S | * | * | | | trans | -50.9 | 145.7 | 155.5 | 170.9 | 0 | 0 | 0 | 0 | 113.9 | | |
| 554 | L | 30.6 | Very low | 31.6 | Very low | 174 Ų | 174 | 134.8 Ų | 134.8 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | | | | -157.7 | 170.9 | 118.4 | -135.9 | 78.6 | 0 | 0 | 0 | 111.6 | | |
| 555 | D | 31.3 | Very low | 31.6 | Very low | 146 Ų | 146 | 134.1 Ų | 134.1 | 78% | 0.781 | 77% | 0.772 | S | S | * | * | | | trans | -121.9 | -172.8 | -161.3 | -139.8 | -41.5 | 0 | 0 | 0 | 113.1 | | |
| 556 | E | 32.9 | Very low | 31.7 | Very low | 150 Ų | 150 | 139.2 Ų | 139.2 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | | | trans | 93.9 | 136.5 | 159 | -72 | -93.6 | 106 | 0 | 0 | 123 | | |
| 557 | Q | 30.4 | Very low | 31.7 | Very low | 158 Ų | 158 | 138 Ų | 138 | 74% | 0.738 | 78% | 0.775 | S | S | * | * | | | trans | 89.7 | 100.5 | 144.9 | -81.1 | 173.9 | 49.5 | 0 | 0 | 124.8 | | |
| 558 | E | 30.7 | Very low | 31.8 | Very low | 181 Ų | 181 | 143.9 Ų | 143.9 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | | | trans | 32.6 | 131 | 133.3 | -64.9 | -146.4 | 101.6 | 0 | 0 | 123.2 | | |
| 559 | G | 30.3 | Very low | 32 | Very low | 77 Ų | 77 | 141.8 Ų | 141.8 | 79% | 0.794 | 79% | 0.79 | S | S | * | * | | | trans | -152.7 | 35.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 560 | K | 32.6 | Very low | 31.9 | Very low | 180 Ų | 180 | 136.3 Ų | 136.3 | 78% | 0.783 | 78% | 0.782 | S | S | * | * | | | trans | 30 | 137.3 | 162.7 | -77.7 | 171.4 | 178.3 | 159.2 | 0 | 122.4 | | |
| 561 | S | 32.3 | Very low | 32 | Very low | 121 Ų | 121 | 142.8 Ų | 142.8 | 85% | 0.846 | 79% | 0.785 | S | S | * | * | | | trans | 76.9 | 124 | 146 | 66 | 0 | 0 | 0 | 0 | 121.3 | | |
| 562 | G | 27.3 | Very low | 32.3 | Very low | 70 Ų | 70 | 145.7 Ų | 145.7 | 72% | 0.722 | 78% | 0.784 | S | S | * | * | | | trans | -92.8 | -149.4 | 152.5 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 563 | P | 49.3 | Very low | 32.6 | Very low | 128 Ų | 128 | 151.3 Ų | 151.3 | 83% | 0.831 | 79% | 0.788 | S | S | * | * | | | cis | -135 | -162.9 | 14.5 | 42.6 | -24.5 | 0 | 0 | 0 | 113.9 | | |
| 564 | R | 28.1 | Very low | 32.8 | Very low | 215 Ų | 215 | 156.1 Ų | 156.1 | 81% | 0.811 | 80% | 0.798 | S | S | * | * | | | | 150.7 | 111.3 | 119.6 | -168.7 | 166.4 | -163.3 | -129.2 | 7.5 | 116.4 | | |
| 565 | Q | 30.5 | Very low | 33 | Very low | 151 Ų | 151 | 158.5 Ų | 158.5 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | | | trans | 43.6 | 124.1 | 141.1 | -70.8 | 175.4 | -15.7 | 0 | 0 | 121.5 | | |
| 566 | K | 30.9 | Very low | 33 | Very low | 194 Ų | 194 | 159.1 Ų | 159.1 | 84% | 0.843 | 80% | 0.797 | S | S | * | * | | | | 60.4 | 139.1 | 90.2 | -69.3 | -176.3 | -179.5 | -178.9 | 0 | 114.8 | | |
| 567 | S | 31.3 | Very low | 33.1 | Very low | 90 Ų | 90 | 161.5 Ų | 161.5 | 63% | 0.629 | 80% | 0.8 | S | S | * | * | | | cis | -179.9 | 179.5 | 3.1 | 50.2 | 0 | 0 | 0 | 0 | 112.4 | | |
| 568 | K | 31.9 | Very low | 33.4 | Very low | 200 Ų | 200 | 161.1 Ų | 161.1 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | | | trans | 80.1 | 165.3 | 162.5 | -59.1 | 172 | -176.7 | 177.2 | 0 | 118.7 | | |
| 569 | A | 35.6 | Very low | 33.4 | Very low | 102 Ų | 102 | 158 Ų | 158 | 84% | 0.843 | 79% | 0.79 | S | S | * | * | | | cis | -179.9 | 152 | -43.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 570 | G | 28.6 | Very low | 33.9 | Very low | 68 Ų | 68 | 160.8 Ų | 160.8 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | | | trans | 112.8 | 125 | 164.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 571 | R | 34.9 | Very low | 34.1 | Very low | 238 Ų | 238 | 160.9 Ų | 160.9 | 90% | 0.898 | 80% | 0.796 | S | S | * | * | | | | 64.2 | 135.6 | 61.7 | -65.8 | -169.1 | -176.2 | -106.3 | 13.9 | 112.5 | | |
| 572 | R | 35.8 | Very low | 34.4 | Very low | 218 Ų | 218 | 162.1 Ų | 162.1 | 82% | 0.823 | 80% | 0.798 | S | S | * | * | | | cis | -176 | 178.9 | 39.3 | -145.1 | 174.7 | -175.8 | -166.7 | 2.4 | 112.2 | | |
| 573 | R | 36.1 | Very low | 34.7 | Very low | 230 Ų | 230 | 165.1 Ų | 165.1 | 87% | 0.868 | 80% | 0.797 | S | S | * | * | | | trans | 87.9 | 147.8 | 170.2 | -56.5 | 168.8 | 179.6 | 165.7 | 0.3 | 114.8 | | |
| 574 | K | 37.3 | Very low | 34.4 | Very low | 187 Ų | 187 | 170.4 Ų | 170.4 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | | | cis | -154.7 | 125 | -13.8 | -109.4 | 177.5 | 177.6 | -174.9 | 0 | 105.8 | | |
| 575 | R | 34.8 | Very low | 34.7 | Very low | 225 Ų | 225 | 167.2 Ų | 167.2 | 85% | 0.849 | 80% | 0.8 | S | S | * | * | | | | 62.5 | 108.6 | 85.3 | -170.1 | -153.8 | -83 | -152.5 | -3 | 115.9 | | |
| 576 | L | 32.4 | Very low | 35 | Very low | 158 Ų | 158 | 165.8 Ų | 165.8 | 83% | 0.827 | 81% | 0.807 | S | S | * | * | | | | -156.9 | 157.4 | 126.4 | -139.3 | 71.5 | 0 | 0 | 0 | 111.7 | | |
| 577 | R | 33.5 | Very low | 35.2 | Very low | 201 Ų | 201 | 164 Ų | 164 | 76% | 0.758 | 81% | 0.807 | S | S | * | * | | | trans | -118.4 | 156.7 | 161.6 | -70.9 | -164.4 | -170.7 | -179.9 | 0.4 | 107.8 | D579 | R577-D579 WeakPolarHBondContact CD-OD2 3.29Å; R577-D579 IonicContact CZ-OD2 2.76Å; R577-D579 IonicContact NE-OD2 3.67Å; R577-D579 IonicContact NH1-OD2 3.83Å; R577-D579 PolarHBondContact NH1-OD2 3.31Å |
| 578 | I | 36.4 | Very low | 35.4 | Very low | 149 Ų | 149 | 166.1 Ų | 166.1 | 76% | 0.764 | 82% | 0.816 | S | S | * | * | | | trans | -134.7 | 129.5 | 140.3 | -84.2 | 170.1 | 0 | 0 | 0 | 105.8 | T580 | I578-T580 HydrophobicContact CG2-CG2 4.31Š|
| 579 | D | 32.4 | Very low | 35.6 | Very low | 116 Ų | 116 | 163 Ų | 163 | 62% | 0.62 | 81% | 0.809 | S | S | * | * | | | trans | -113.3 | 133.7 | 168.1 | -57.3 | -60.8 | 0 | 0 | 0 | 106 | R577 | R577-D579 WeakPolarHBondContact CD-OD2 3.29Å; R577-D579 IonicContact CZ-OD2 2.76Å; R577-D579 IonicContact NE-OD2 3.67Å; R577-D579 IonicContact NH1-OD2 3.83Å; R577-D579 PolarHBondContact NH1-OD2 3.31Å |
| 580 | T | 40.1 | Very low | 35.4 | Very low | 135 Ų | 135 | 167.8 Ų | 167.8 | 83% | 0.828 | 81% | 0.81 | S | S | * | * | | | trans | -135.8 | 128 | 167.4 | 48 | 0 | 0 | 0 | 0 | 110.7 | I578 | I578-T580 HydrophobicContact CG2-CG2 4.31Š|
| 581 | E | 37.3 | Very low | 35.6 | Very low | 183 Ų | 183 | 173.6 Ų | 173.6 | 86% | 0.855 | 82% | 0.816 | S | S | * | * | | | trans | -80.6 | 145 | -171.9 | 178.3 | 177.4 | -140.3 | 0 | 0 | 112.6 | | |
| 582 | T | 37.8 | Very low | 35.5 | Very low | 146 Ų | 146 | 171.7 Ų | 171.7 | 90% | 0.896 | 82% | 0.817 | S | S | * | * | | | trans | -163.7 | 124.8 | 137.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 583 | D | 34.2 | Very low | 35.5 | Very low | 133 Ų | 133 | 169.6 Ų | 169.6 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | | | trans | -89.4 | 146.3 | 171.5 | 169.5 | 40.2 | 0 | 0 | 0 | 111.1 | | |
| 584 | R | 42.3 | Very low | 35.4 | Very low | 239 Ų | 239 | 166.8 Ų | 166.8 | 90% | 0.902 | 81% | 0.813 | S | S | * | * | | | trans | -177.2 | 112.5 | 151.1 | -108.9 | 167.2 | -175.4 | 157.8 | 4.9 | 113.1 | | |
| 585 | D | 35.1 | Very low | 35.4 | Very low | 148 Ų | 148 | 168.7 Ų | 168.7 | 79% | 0.791 | 82% | 0.816 | S | S | * | * | | | trans | -64.6 | 149.4 | 163.3 | -78.8 | -45 | 0 | 0 | 0 | 113.2 | | |
| 586 | S | 36.9 | Very low | 35.5 | Very low | 122 Ų | 122 | 168.7 Ų | 168.7 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | | | trans | -165.9 | 117.8 | 146.5 | -81.2 | 0 | 0 | 0 | 0 | 111.8 | | |
| 587 | D | 35.1 | Very low | 35.8 | Very low | 157 Ų | 157 | 168.7 Ų | 168.7 | 84% | 0.84 | 82% | 0.815 | S | S | * | * | | | trans | -64.3 | 148.1 | 168.1 | -117.9 | -48.5 | 0 | 0 | 0 | 112 | | |
| 588 | T | 35.7 | Very low | 36 | Very low | 134 Ų | 134 | 168 Ų | 168 | 82% | 0.822 | 82% | 0.817 | S | S | * | * | | | trans | -168.7 | 106.4 | 137.7 | 11.4 | 0 | 0 | 0 | 0 | 114.4 | | |
| 589 | N | 34.8 | Very low | 36 | Very low | 134 Ų | 134 | 168.1 Ų | 168.1 | 72% | 0.717 | 82% | 0.818 | S | S | * | * | | | trans | -30 | 127.8 | 157 | 178.7 | -7.9 | 0 | 0 | 0 | 115.4 | | |
| 590 | K | 32.3 | Very low | 36.4 | Very low | 203 Ų | 203 | 168.5 Ų | 168.5 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | | | trans | -126 | 121.8 | 163.9 | -94.6 | 178.2 | 177.8 | 168.2 | 0 | 112.1 | | |
| 591 | K | 33.4 | Very low | 36.4 | Very low | 189 Ų | 189 | 168.4 Ų | 168.4 | 82% | 0.822 | 82% | 0.824 | S | S | * | * | | | trans | -69.8 | 136.7 | 174.1 | -64.1 | 173.3 | 178.7 | 174.5 | 0 | 110.9 | | |
| 592 | H | 31.9 | Very low | 36.3 | Very low | 198 Ų | 198 | 171 Ų | 171 | 92% | 0.917 | 83% | 0.825 | S | S | * | * | | | trans | -65.9 | 138.1 | 159.5 | -96.8 | -74.9 | 0 | 0 | 0 | 110 | | |
| 593 | Q | 36 | Very low | 36.5 | Very low | 174 Ų | 174 | 170.4 Ų | 170.4 | 81% | 0.813 | 82% | 0.822 | S | S | * | * | | | trans | -127.9 | 113.2 | 170.5 | -163 | 177.1 | 36.8 | 0 | 0 | 109.3 | R595 | Q593-R595 PolarHBondContact O-N 3Š|
| 594 | E | 33.7 | Very low | 36.9 | Very low | 171 Ų | 171 | 173.3 Ų | 173.3 | 80% | 0.799 | 83% | 0.831 | S | S | * | * | | | trans | -79.3 | 116.6 | -173 | -171.8 | -178.7 | -134.5 | 0 | 0 | 111.2 | R596 | E594-R596 PolarHBondContact O-N 3.43Š|
| 595 | R | 37 | Very low | 36.9 | Very low | 228 Ų | 228 | 171.2 Ų | 171.2 | 86% | 0.86 | 83% | 0.832 | S | S | * | * | | | trans | -91.7 | 94.9 | 179.2 | -72.8 | -174.8 | 175.9 | 178.4 | -0.9 | 111.3 | Q593 I597 | Q593-R595 PolarHBondContact O-N 3Å; R595-I597 PolarHBondContact O-N 3.2Å |
| 596 | R | 36.9 | Very low | 37.4 | Very low | 224 Ų | 224 | 175.8 Ų | 175.8 | 85% | 0.845 | 84% | 0.838 | S | S | * | * | | | trans | -68.2 | 120.9 | 167.5 | -76.3 | -179.7 | 165.6 | -169.1 | -7.4 | 110.9 | E594 | E594-R596 PolarHBondContact O-N 3.43Š|
| 597 | I | 38.4 | Very low | 37.4 | Very low | 158 Ų | 158 | 175.2 Ų | 175.2 | 81% | 0.81 | 83% | 0.834 | S | S | * | * | | | trans | -81.5 | 131.7 | 171.5 | -59.8 | 175.8 | 0 | 0 | 0 | 108.8 | R595 I599 | R595-I597 PolarHBondContact O-N 3.2Å; I597-I599 HydrophobicContact CG2-CG1 4.4Å |
| 598 | K | 38.3 | Very low | 38.7 | Very low | 188 Ų | 188 | 173.5 Ų | 173.5 | 82% | 0.817 | 83% | 0.831 | S | S | * | * | | | trans | -113.7 | 108.9 | 178.3 | -173 | 178.3 | -179.1 | -178.3 | 0 | 109.2 | | |
| 599 | I | 37.3 | Very low | 39 | Very low | 150 Ų | 150 | 176.6 Ų | 176.6 | 77% | 0.769 | 86% | 0.859 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 123.8 | 179.2 | -58.9 | 175.2 | 0 | 0 | 0 | 109 | I597 | I597-I599 HydrophobicContact CG2-CG1 4.4Š|
| 600 | T | 39.4 | Very low | 39.2 | Very low | 124 Ų | 124 | 178.8 Ų | 178.8 | 76% | 0.761 | 87% | 0.866 | S | S | * | * | P | Polyproline II helix | trans | -102.2 | 117.1 | 170.2 | 33.9 | 0 | 0 | 0 | 0 | 110 | | |
| 601 | V | 40.8 | Very low | 39.6 | Very low | 134 Ų | 134 | 177.5 Ų | 177.5 | 81% | 0.812 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 133.6 | 170.7 | 179.7 | 0 | 0 | 0 | 0 | 108.6 | | |
| 602 | R | 35.6 | Very low | 39.9 | Very low | 236 Ų | 236 | 176.8 Ų | 176.8 | 89% | 0.891 | 87% | 0.867 | S | S | * | * | P | Polyproline II helix | trans | -85.8 | 137.6 | 168.1 | -77.9 | -177.2 | 163.6 | 107.2 | -5.6 | 109.5 | | |
| 603 | T | 41 | Very low | 40.4 | Very low | 135 Ų | 135 | 175.6 Ų | 175.6 | 83% | 0.828 | 86% | 0.864 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 135.4 | 163.7 | 46.9 | 0 | 0 | 0 | 0 | 109.4 | | |
| 604 | E | 42.5 | Very low | 40.7 | Very low | 194 Ų | 194 | 175.7 Ų | 175.7 | 91% | 0.907 | 87% | 0.868 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 151.9 | 171.7 | -66.3 | -175.5 | 124.7 | 0 | 0 | 111.4 | | |
| 605 | E | 42.6 | Very low | 41.2 | Very low | 195 Ų | 195 | 176 Ų | 176 | 91% | 0.911 | 87% | 0.872 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 157.1 | 174.9 | -69 | -164.5 | 120.1 | 0 | 0 | 112.1 | | |
| 606 | R | 45.9 | Very low | 41.5 | Very low | 243 Ų | 243 | 172.3 Ų | 172.3 | 92% | 0.917 | 87% | 0.873 | S | S | * | * | | | trans | -107.1 | 112.9 | -175.5 | -179.3 | -179.4 | -178.3 | 176.4 | 1.2 | 109.7 | | |
| 607 | S | 37.5 | Very low | 41.8 | Very low | 111 Ų | 111 | 168.3 Ų | 168.3 | 78% | 0.776 | 88% | 0.875 | S | S | * | * | | | trans | -57.5 | 140 | 177.5 | -50 | 0 | 0 | 0 | 0 | 112.3 | | |
| 608 | P | 61.6 | Low | 42.1 | Very low | 120 Ų | 120 | 169.2 Ų | 169.2 | 78% | 0.779 | 88% | 0.881 | S | S | * | * | | | trans | -82.9 | 152.5 | 170.6 | 34.4 | -33.8 | 0 | 0 | 0 | 112.2 | | |
| 609 | S | 42.6 | Very low | 42.4 | Very low | 200 Ų | 200 | 167.5 Ų | 167.5 | 100% | 1.399 | 89% | 0.886 | S | S | * | * | | | trans | 10.6 | 0 | 163.5 | -62.4 | 0 | 0 | 0 | 0 | 119.3 | | |