| 1 | M | 62.6 | Low | 81.8 | Confident | 213 Ų | 213 | 116.2 Ų | 116.2 | 100% | 1.049 | 63% | 0.625 | S | S | * | * | | | | 0 | -32.1 | 0 | -76.1 | 175.8 | 175.7 | 0 | 0 | 113.8 | I3 M4 | M1-I3 PolarHBondContact O-N 3.33Å; M1-M4 PolarHBondContact O-N 3.44Å |
| 2 | T | 69.3 | Low | 82.8 | Confident | 127 Ų | 127 | 113.1 Ų | 113.1 | 78% | 0.779 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -67.5 | -27.6 | -178.9 | 27.8 | 0 | 0 | 0 | 0 | 115.9 | | |
| 3 | I | 71.6 | Confident | 83.7 | Confident | 138 Ų | 138 | 118.6 Ų | 118.6 | 71% | 0.708 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -72 | -38.8 | 178.3 | -58.2 | 174.4 | 0 | 0 | 0 | 111.5 | M1 G5 K6 | M1-I3 PolarHBondContact O-N 3.33Å; I3-G5 VanDerWaalsContact C-N 3.33Å; I3-G5 PolarHBondContact O-N 3.34Å; I3-K6 PolarHBondContact O-N 3.36Å |
| 4 | M | 74.3 | Confident | 84.5 | Confident | 137 Ų | 137 | 115 Ų | 115 | 68% | 0.675 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -66.2 | -34.5 | 177.1 | -75.1 | -152.2 | -78.2 | 0 | 0 | 112.4 | M1 K6 Q7 I8 | M1-M4 PolarHBondContact O-N 3.44Å; M4-K6 PolarHBondContact O-N 3.42Å; M4-Q7 PolarHBondContact O-N 3.45Å; M4-I8 WeakPolarHBondContact O-CD1 3.44Å; M4-I8 WeakPolarHBondContact O-CG1 3.38Å; M4-I8 PolarHBondContact O-N 3.49Å; M4-I8 VanDerWaalsContact O-N 3.16Å |
| 5 | G | 83.4 | Confident | 85.3 | Confident | 36 Ų | 36 | 112.5 Ų | 112.5 | 37% | 0.371 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -61.3 | -41.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | I3 I8 V9 | I3-G5 VanDerWaalsContact C-N 3.33Å; I3-G5 PolarHBondContact O-N 3.34Å; G5-I8 PolarHBondContact O-N 3.29Å; G5-V9 WeakPolarHBondContact O-CG2 3.42Å; G5-V9 PolarHBondContact O-N 3.47Å |
| 6 | K | 86.8 | Confident | 85.9 | Confident | 158 Ų | 158 | 109.7 Ų | 109.7 | 69% | 0.687 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -65.9 | -39.8 | 178.4 | -72.7 | -175.5 | 177.3 | -176.8 | 0 | 112.5 | I3 M4 V9 I10 | I3-K6 PolarHBondContact O-N 3.36Å; M4-K6 PolarHBondContact O-N 3.42Å; K6-V9 PolarHBondContact O-N 2.93Å; K6-I10 VanDerWaalsContact O-CG1 3.32Å; K6-I10 WeakPolarHBondContact O-CG1 3.35Å; K6-I10 PolarHBondContact O-N 3.15Å |
| 7 | Q | 88.4 | Confident | 86.5 | Confident | 126 Ų | 126 | 106.8 Ų | 106.8 | 59% | 0.589 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -64.7 | -42 | 178.1 | -68.2 | -66.7 | -9.9 | 0 | 0 | 112 | M4 V9 I10 A11 | M4-Q7 PolarHBondContact O-N 3.45Å; Q7-V9 VanDerWaalsContact C-N 3.34Å; Q7-V9 PolarHBondContact O-N 3.23Å; Q7-I10 PolarHBondContact O-N 3.19Å; Q7-A11 WeakPolarHBondContact O-CB 3.5Å; Q7-A11 PolarHBondContact O-N 3.46Å |
| 8 | I | 89.6 | Confident | 87.1 | Confident | 111 Ų | 111 | 107.8 Ų | 107.8 | 57% | 0.569 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -63.6 | -40.1 | 177.6 | -67 | 163 | 0 | 0 | 0 | 111.3 | M4 G5 A11 T12 | M4-I8 WeakPolarHBondContact O-CD1 3.44Å; M4-I8 WeakPolarHBondContact O-CG1 3.38Å; M4-I8 PolarHBondContact O-N 3.49Å; M4-I8 VanDerWaalsContact O-N 3.16Å; G5-I8 PolarHBondContact O-N 3.29Å; I8-A11 PolarHBondContact O-N 3.13Å; I8-T12 PolarHBondContact O-N 3.13Å; I8-T12 PolarHBondContact O-OG1 3.04Å |
| 9 | V | 90 | Very high | 87.6 | Confident | 79 Ų | 79 | 105.4 Ų | 105.4 | 48% | 0.479 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -63.2 | -52.3 | 176.6 | 174 | 0 | 0 | 0 | 0 | 109.7 | G5 K6 Q7 A11 T12 W13 | G5-V9 WeakPolarHBondContact O-CG2 3.42Å; G5-V9 PolarHBondContact O-N 3.47Å; K6-V9 PolarHBondContact O-N 2.93Å; Q7-V9 VanDerWaalsContact C-N 3.34Å; Q7-V9 PolarHBondContact O-N 3.23Å; V9-A11 VanDerWaalsContact C-N 3.29Å; V9-A11 PolarHBondContact O-N 3.06Å; V9-T12 WeakPolarHBondContact O-CB 3.44Å; V9-T12 PolarHBondContact O-N 3.37Å; V9-W13 PolarHBondContact O-N 3.18Å |
| 10 | I | 92.3 | Very high | 88 | Confident | 93 Ų | 93 | 103.9 Ų | 103.9 | 48% | 0.477 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -56 | -44.7 | 179.2 | -65.4 | 164.7 | 0 | 0 | 0 | 111.1 | K6 Q7 T12 W13 C14 | K6-I10 VanDerWaalsContact O-CG1 3.32Å; K6-I10 WeakPolarHBondContact O-CG1 3.35Å; K6-I10 PolarHBondContact O-N 3.15Å; Q7-I10 PolarHBondContact O-N 3.19Å; I10-T12 VanDerWaalsContact C-N 3.32Å; I10-T12 PolarHBondContact O-N 2.77Å; I10-W13 PolarHBondContact O-N 3.22Å; I10-C14 PolarHBondContact O-N 3.33Å; I10-C14 PolarHBondContact O-SG 3.11Å; I10-C14 VanDerWaalsContact O-SG 3.35Å |
| 11 | A | 91.8 | Very high | 88.4 | Confident | 60 Ų | 60 | 105.5 Ų | 105.5 | 50% | 0.496 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -60 | -40.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q7 I8 V9 C14 S15 | Q7-A11 WeakPolarHBondContact O-CB 3.5Å; Q7-A11 PolarHBondContact O-N 3.46Å; I8-A11 PolarHBondContact O-N 3.13Å; V9-A11 VanDerWaalsContact C-N 3.29Å; V9-A11 PolarHBondContact O-N 3.06Å; A11-C14 PolarHBondContact O-N 2.97Å; A11-S15 WeakPolarHBondContact O-CB 3.41Å; A11-S15 PolarHBondContact O-N 3.38Å |
| 12 | T | 93.1 | Very high | 90 | Very high | 79 Ų | 79 | 97.7 Ų | 97.7 | 49% | 0.485 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63 | -43.4 | 176.2 | -51.4 | 0 | 0 | 0 | 0 | 111.5 | I8 V9 I10 S15 T16 | I8-T12 PolarHBondContact O-N 3.13Å; I8-T12 PolarHBondContact O-OG1 3.04Å; V9-T12 WeakPolarHBondContact O-CB 3.44Å; V9-T12 PolarHBondContact O-N 3.37Å; I10-T12 VanDerWaalsContact C-N 3.32Å; I10-T12 PolarHBondContact O-N 2.77Å; T12-S15 PolarHBondContact O-N 3.09Å; T12-T16 WeakPolarHBondContact O-CG2 3.41Å; T12-T16 PolarHBondContact O-N 3.47Å; T12-T16 PolarHBondContact O-OG1 3.24Å |
| 13 | W | 95 | Very high | 91.3 | Very high | 185 Ų | 185 | 95.9 Ų | 95.9 | 70% | 0.701 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65.5 | -40 | 176.9 | -78.2 | 92.5 | 0 | 0 | 0 | 112.5 | V9 I10 S15 T16 A17 | V9-W13 PolarHBondContact O-N 3.18Å; I10-W13 PolarHBondContact O-N 3.22Å; W13-S15 VanDerWaalsContact C-N 3.34Å; W13-T16 PolarHBondContact O-OG1 3.33Å; W13-T16 VanDerWaalsContact O-OG1 3.05Å; W13-A17 VanDerWaalsContact O-CB 3.29Å; W13-A17 WeakPolarHBondContact O-CB 3.23Å; W13-A17 PolarHBondContact O-N 3.49Å |
| 14 | C | 95.1 | Very high | 92.5 | Very high | 68 Ų | 68 | 94.4 Ų | 94.4 | 46% | 0.459 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 174.2 | -68.5 | 0 | 0 | 0 | 0 | 111.3 | I10 A11 A17 L18 | I10-C14 PolarHBondContact O-N 3.33Å; I10-C14 PolarHBondContact O-SG 3.11Å; I10-C14 VanDerWaalsContact O-SG 3.35Å; A11-C14 PolarHBondContact O-N 2.97Å; C14-A17 PolarHBondContact O-N 3.48Å; C14-L18 WeakPolarHBondContact O-CB 3.39Å; C14-L18 VanDerWaalsContact O-CG 3.29Å; C14-L18 WeakPolarHBondContact O-CG 3.33Å; C14-L18 PolarHBondContact O-N 2.84Å |
| 15 | S | 95.6 | Very high | 93.5 | Very high | 77 Ų | 77 | 90.2 Ų | 90.2 | 54% | 0.538 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.9 | -43.8 | 178.6 | -172.7 | 0 | 0 | 0 | 0 | 112.3 | A11 T12 W13 L18 S19 | A11-S15 WeakPolarHBondContact O-CB 3.41Å; A11-S15 PolarHBondContact O-N 3.38Å; T12-S15 PolarHBondContact O-N 3.09Å; W13-S15 VanDerWaalsContact C-N 3.34Å; S15-L18 PolarHBondContact O-N 2.85Å; S15-S19 WeakPolarHBondContact O-CB 3.39Å; S15-S19 PolarHBondContact O-N 3.47Å; S15-S19 PolarHBondContact O-OG 3.32Å |
| 16 | T | 95.4 | Very high | 94.1 | Very high | 68 Ų | 68 | 92.7 Ų | 92.7 | 42% | 0.417 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.1 | -42 | 178.3 | 53.6 | 0 | 0 | 0 | 0 | 111 | T12 W13 L18 S19 C20 | T12-T16 WeakPolarHBondContact O-CG2 3.41Å; T12-T16 PolarHBondContact O-N 3.47Å; T12-T16 PolarHBondContact O-OG1 3.24Å; W13-T16 PolarHBondContact O-OG1 3.33Å; W13-T16 VanDerWaalsContact O-OG1 3.05Å; T16-L18 PolarHBondContact O-N 3.15Å; T16-S19 WeakPolarHBondContact CA-OG 3.44Å; T16-S19 PolarHBondContact O-N 2.96Å; T16-S19 PolarHBondContact O-OG 3.22Å; T16-C20 PolarHBondContact O-N 2.79Å; T16-C20 PolarHBondContact O-SG 3.16Å; T16-C20 VanDerWaalsContact O-SG 3.33Å |
| 17 | A | 96.3 | Very high | 94.5 | Very high | 61 Ų | 61 | 90.8 Ų | 90.8 | 50% | 0.504 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.1 | -44.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | W13 C14 C20 F21 | W13-A17 VanDerWaalsContact O-CB 3.29Å; W13-A17 WeakPolarHBondContact O-CB 3.23Å; W13-A17 PolarHBondContact O-N 3.49Å; C14-A17 PolarHBondContact O-N 3.48Å; A17-C20 PolarHBondContact O-N 3.35Å; A17-F21 PolarHBondContact O-N 2.8Å |
| 18 | L | 96.6 | Very high | 94.7 | Very high | 124 Ų | 124 | 90 Ų | 90 | 65% | 0.649 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.6 | -40.4 | 176 | -73.6 | 171 | 0 | 0 | 0 | 111.9 | C14 S15 T16 F21 A22 | C14-L18 WeakPolarHBondContact O-CB 3.39Å; C14-L18 VanDerWaalsContact O-CG 3.29Å; C14-L18 WeakPolarHBondContact O-CG 3.33Å; C14-L18 PolarHBondContact O-N 2.84Å; S15-L18 PolarHBondContact O-N 2.85Å; T16-L18 PolarHBondContact O-N 3.15Å; L18-F21 PolarHBondContact O-N 3.21Å; L18-A22 WeakPolarHBondContact O-CB 3.49Å; L18-A22 PolarHBondContact O-N 3.26Å |
| 19 | S | 97.3 | Very high | 95 | Very high | 62 Ų | 62 | 89.5 Ų | 89.5 | 43% | 0.434 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 176.9 | 72.8 | 0 | 0 | 0 | 0 | 112.4 | S15 T16 F21 A22 V23 | S15-S19 WeakPolarHBondContact O-CB 3.39Å; S15-S19 PolarHBondContact O-N 3.47Å; S15-S19 PolarHBondContact O-OG 3.32Å; T16-S19 WeakPolarHBondContact CA-OG 3.44Å; T16-S19 PolarHBondContact O-N 2.96Å; T16-S19 PolarHBondContact O-OG 3.22Å; S19-F21 PolarHBondContact O-N 2.77Å; S19-A22 PolarHBondContact O-N 3.48Å; S19-V23 WeakPolarHBondContact O-CG2 3.44Å; S19-V23 PolarHBondContact O-N 3.21Å |
| 20 | C | 96.1 | Very high | 95.1 | Very high | 76 Ų | 76 | 87.5 Ų | 87.5 | 51% | 0.514 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.9 | -40.3 | 176.1 | -69.8 | 0 | 0 | 0 | 0 | 111.6 | T16 A17 V23 L24 | T16-C20 PolarHBondContact O-N 2.79Å; T16-C20 PolarHBondContact O-SG 3.16Å; T16-C20 VanDerWaalsContact O-SG 3.33Å; A17-C20 PolarHBondContact O-N 3.35Å; C20-V23 PolarHBondContact O-N 3.39Å; C20-L24 WeakPolarHBondContact O-CB 3.3Å; C20-L24 WeakPolarHBondContact O-CG 3.48Å; C20-L24 PolarHBondContact O-N 3.44Å |
| 21 | F | 96.6 | Very high | 95.2 | Very high | 138 Ų | 138 | 86.7 Ų | 86.7 | 61% | 0.605 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.8 | -40.7 | 175.9 | -173 | -96.6 | 0 | 0 | 0 | 112.1 | A17 L18 S19 V23 L24 T25 | A17-F21 PolarHBondContact O-N 2.8Å; L18-F21 PolarHBondContact O-N 3.21Å; S19-F21 PolarHBondContact O-N 2.77Å; F21-V23 PolarHBondContact O-N 3.06Å; F21-L24 PolarHBondContact O-N 2.89Å; F21-T25 HydrophobicContact CD1-CG2 3.98Å; F21-T25 HydrophobicContact CE1-CG2 3.56Å; F21-T25 HydrophobicContact CE2-CG2 4.39Å; F21-T25 HydrophobicContact CZ-CG2 3.79Å; F21-T25 WeakPolarHBondContact O-CG2 3.47Å; F21-T25 PolarHBondContact O-N 3.03Å; F21-T25 PolarHBondContact O-OG1 2.87Å |
| 22 | A | 96.6 | Very high | 95.3 | Very high | 49 Ų | 49 | 85.9 Ų | 85.9 | 41% | 0.405 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.6 | -42.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | L18 S19 T25 C26 | L18-A22 WeakPolarHBondContact O-CB 3.49Å; L18-A22 PolarHBondContact O-N 3.26Å; S19-A22 PolarHBondContact O-N 3.48Å; A22-T25 WeakPolarHBondContact CA-OG1 3.35Å; A22-T25 PolarHBondContact O-OG1 3.34Å; A22-C26 WeakPolarHBondContact O-CB 3.32Å; A22-C26 PolarHBondContact O-N 3.26Å; A22-C26 PolarHBondContact O-SG 3.17Å |
| 23 | V | 96.4 | Very high | 95.3 | Very high | 88 Ų | 88 | 86.3 Ų | 86.3 | 53% | 0.533 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.8 | -41.9 | 176.8 | 175.6 | 0 | 0 | 0 | 0 | 111.3 | S19 C20 F21 C26 L27 | S19-V23 WeakPolarHBondContact O-CG2 3.44Å; S19-V23 PolarHBondContact O-N 3.21Å; C20-V23 PolarHBondContact O-N 3.39Å; F21-V23 PolarHBondContact O-N 3.06Å; V23-C26 PolarHBondContact O-N 3.42Å; V23-L27 HydrophobicContact CG1-CD1 4.08Å; V23-L27 HydrophobicContact CG1-CG 4.39Å; V23-L27 WeakPolarHBondContact O-CG 3.3Å; V23-L27 PolarHBondContact O-N 3.23Å |
| 24 | L | 96 | Very high | 95.2 | Very high | 107 Ų | 107 | 84.8 Ų | 84.8 | 56% | 0.56 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.5 | -42.9 | 177.6 | -75.7 | 171.4 | 0 | 0 | 0 | 112.2 | C20 F21 L27 V28 | C20-L24 WeakPolarHBondContact O-CB 3.3Å; C20-L24 WeakPolarHBondContact O-CG 3.48Å; C20-L24 PolarHBondContact O-N 3.44Å; F21-L24 PolarHBondContact O-N 2.89Å; L24-L27 PolarHBondContact O-N 3.35Å; L24-V28 WeakPolarHBondContact O-CG2 3.29Å; L24-V28 PolarHBondContact O-N 3.28Å |
| 25 | T | 95.6 | Very high | 95.2 | Very high | 49 Ų | 49 | 85.1 Ų | 85.1 | 30% | 0.301 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 175.2 | 48.9 | 0 | 0 | 0 | 0 | 111.4 | F21 A22 L27 V28 L29 | F21-T25 HydrophobicContact CD1-CG2 3.98Å; F21-T25 HydrophobicContact CE1-CG2 3.56Å; F21-T25 HydrophobicContact CE2-CG2 4.39Å; F21-T25 HydrophobicContact CZ-CG2 3.79Å; F21-T25 WeakPolarHBondContact O-CG2 3.47Å; F21-T25 PolarHBondContact O-N 3.03Å; F21-T25 PolarHBondContact O-OG1 2.87Å; A22-T25 WeakPolarHBondContact CA-OG1 3.35Å; A22-T25 PolarHBondContact O-OG1 3.34Å; T25-L27 PolarHBondContact O-N 2.95Å; T25-V28 PolarHBondContact O-N 2.92Å; T25-L29 VanDerWaalsContact O-CB 3.29Å; T25-L29 WeakPolarHBondContact O-CB 3.29Å; T25-L29 VanDerWaalsContact O-CG 3.27Å; T25-L29 WeakPolarHBondContact O-CG 3.47Å; T25-L29 PolarHBondContact O-N 3.38Å |
| 26 | C | 95.1 | Very high | 95 | Very high | 88 Ų | 88 | 87.4 Ų | 87.4 | 60% | 0.595 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.7 | -39.2 | 173.8 | -72.9 | 0 | 0 | 0 | 0 | 113.1 | A22 V23 V28 G30 | A22-C26 WeakPolarHBondContact O-CB 3.32Å; A22-C26 PolarHBondContact O-N 3.26Å; A22-C26 PolarHBondContact O-SG 3.17Å; V23-C26 PolarHBondContact O-N 3.42Å; C26-V28 VanDerWaalsContact C-N 3.32Å; C26-V28 PolarHBondContact O-N 2.86Å; C26-G30 WeakPolarHBondContact O-CA 3.41Å; C26-G30 PolarHBondContact O-N 2.9Å |
| 27 | L | 95.1 | Very high | 95 | Very high | 119 Ų | 119 | 87.7 Ų | 87.7 | 62% | 0.623 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -70.2 | -27.2 | 178.5 | -72.5 | 175.5 | 0 | 0 | 0 | 113.2 | V23 L24 T25 P31 | V23-L27 HydrophobicContact CG1-CD1 4.08Å; V23-L27 HydrophobicContact CG1-CG 4.39Å; V23-L27 WeakPolarHBondContact O-CG 3.3Å; V23-L27 PolarHBondContact O-N 3.23Å; L24-L27 PolarHBondContact O-N 3.35Å; T25-L27 PolarHBondContact O-N 2.95Å; L27-P31 WeakPolarHBondContact O-CD 3.41Å; L27-P31 WeakPolarHBondContact O-CG 3.33Å |
| 28 | V | 93.4 | Very high | 94.8 | Very high | 108 Ų | 108 | 87.5 Ų | 87.5 | 66% | 0.655 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -85.3 | -41.2 | 175.7 | 176.1 | 0 | 0 | 0 | 0 | 111.5 | L24 T25 C26 | L24-V28 WeakPolarHBondContact O-CG2 3.29Å; L24-V28 PolarHBondContact O-N 3.28Å; T25-V28 PolarHBondContact O-N 2.92Å; C26-V28 VanDerWaalsContact C-N 3.32Å; C26-V28 PolarHBondContact O-N 2.86Å |
| 29 | L | 95.1 | Very high | 94.7 | Very high | 101 Ų | 101 | 87 Ų | 87 | 53% | 0.529 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -75.8 | -34.5 | -178.7 | -68.7 | 173.1 | 0 | 0 | 0 | 112.8 | T25 A32 I33 | T25-L29 VanDerWaalsContact O-CB 3.29Å; T25-L29 WeakPolarHBondContact O-CB 3.29Å; T25-L29 VanDerWaalsContact O-CG 3.27Å; T25-L29 WeakPolarHBondContact O-CG 3.47Å; T25-L29 PolarHBondContact O-N 3.38Å; L29-A32 PolarHBondContact O-N 2.87Å; L29-I33 HydrophobicContact CB-CD1 4.36Å; L29-I33 WeakPolarHBondContact O-CG1 3.33Å; L29-I33 PolarHBondContact O-N 3.06Å |
| 30 | G | 93.5 | Very high | 94.5 | Very high | 37 Ų | 37 | 90.1 Ų | 90.1 | 38% | 0.381 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -54.4 | -53.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | C26 A32 I33 Y34 | C26-G30 WeakPolarHBondContact O-CA 3.41Å; C26-G30 PolarHBondContact O-N 2.9Å; G30-A32 PolarHBondContact O-N 2.94Å; G30-I33 PolarHBondContact O-N 3.22Å; G30-Y34 WeakPolarHBondContact O-CB 3.24Å; G30-Y34 PolarHBondContact O-N 3.36Å |
| 31 | P | 94.2 | Very high | 94.4 | Very high | 76 Ų | 76 | 94.5 Ų | 94.5 | 49% | 0.494 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 175.8 | -24.9 | 35 | 0 | 0 | 0 | 113.5 | L27 Y34 T35 | L27-P31 WeakPolarHBondContact O-CD 3.41Å; L27-P31 WeakPolarHBondContact O-CG 3.33Å; P31-Y34 PolarHBondContact O-N 3.35Å; P31-T35 WeakPolarHBondContact O-CG2 3.42Å; P31-T35 PolarHBondContact O-N 3.47Å; P31-T35 PolarHBondContact O-OG1 3.21Å |
| 32 | A | 93 | Very high | 94.2 | Very high | 43 Ų | 43 | 91.6 Ų | 91.6 | 36% | 0.355 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.9 | -39.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L29 G30 T35 Q36 | L29-A32 PolarHBondContact O-N 2.87Å; G30-A32 PolarHBondContact O-N 2.94Å; A32-T35 PolarHBondContact O-OG1 2.9Å; A32-Q36 WeakPolarHBondContact O-CG 3.41Å; A32-Q36 PolarHBondContact O-N 3.42Å |
| 33 | I | 93.1 | Very high | 94.1 | Very high | 89 Ų | 89 | 94.7 Ų | 94.7 | 46% | 0.456 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68.8 | -40.9 | 174.4 | -65 | 165.4 | 0 | 0 | 0 | 110 | L29 G30 T35 Q36 I37 | L29-I33 HydrophobicContact CB-CD1 4.36Å; L29-I33 WeakPolarHBondContact O-CG1 3.33Å; L29-I33 PolarHBondContact O-N 3.06Å; G30-I33 PolarHBondContact O-N 3.22Å; I33-T35 PolarHBondContact O-N 3.14Å; I33-Q36 PolarHBondContact O-N 3.46Å; I33-I37 HydrophobicContact CG2-CD1 3.65Å; I33-I37 HydrophobicContact CG2-CG1 4.3Å; I33-I37 VanDerWaalsContact O-CG1 3.31Å; I33-I37 WeakPolarHBondContact O-CG1 3.35Å; I33-I37 PolarHBondContact O-N 3.36Å |
| 34 | Y | 93.5 | Very high | 93.9 | Very high | 152 Ų | 152 | 94.8 Ų | 94.8 | 60% | 0.596 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.4 | -42 | 178 | -177.5 | -104 | 0 | 0 | 0 | 112.4 | G30 P31 I37 N38 | G30-Y34 WeakPolarHBondContact O-CB 3.24Å; G30-Y34 PolarHBondContact O-N 3.36Å; P31-Y34 PolarHBondContact O-N 3.35Å; Y34-I37 PolarHBondContact O-N 2.97Å; Y34-N38 VanDerWaalsContact CD1-ND2 3.28Å; Y34-N38 WeakPolarHBondContact CD1-ND2 3.26Å; Y34-N38 WeakPolarHBondContact CE1-ND2 3.38Å; Y34-N38 VanDerWaalsContact CZ-ND2 3.3Å; Y34-N38 VanDerWaalsContact O-CG 3.31Å; Y34-N38 PolarHBondContact O-N 2.97Å; Y34-N38 PolarHBondContact O-ND2 3.49Å; Y34-N38 VanDerWaalsContact O-ND2 3.13Å |
| 35 | T | 93.8 | Very high | 93.8 | Very high | 75 Ų | 75 | 93.8 Ų | 93.8 | 46% | 0.46 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -42.7 | 176 | 51.1 | 0 | 0 | 0 | 0 | 111.8 | P31 A32 I33 I37 N38 D39 | P31-T35 WeakPolarHBondContact O-CG2 3.42Å; P31-T35 PolarHBondContact O-N 3.47Å; P31-T35 PolarHBondContact O-OG1 3.21Å; A32-T35 PolarHBondContact O-OG1 2.9Å; I33-T35 PolarHBondContact O-N 3.14Å; T35-I37 PolarHBondContact O-N 2.96Å; T35-N38 PolarHBondContact O-N 3.48Å; T35-D39 PolarHBondContact O-N 3.26Å |
| 36 | Q | 93.2 | Very high | 93.6 | Very high | 125 Ų | 125 | 93.6 Ų | 93.6 | 58% | 0.584 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.5 | -40.7 | 177.1 | -73 | 177.7 | -4.5 | 0 | 0 | 112.7 | A32 I33 N38 D39 L40 | A32-Q36 WeakPolarHBondContact O-CG 3.41Å; A32-Q36 PolarHBondContact O-N 3.42Å; I33-Q36 PolarHBondContact O-N 3.46Å; Q36-N38 VanDerWaalsContact C-N 3.34Å; Q36-D39 PolarHBondContact O-N 2.88Å; Q36-L40 WeakPolarHBondContact O-CG 3.08Å; Q36-L40 PolarHBondContact O-N 3.36Å; Q36-L40 VanDerWaalsContact O-N 3.09Å |
| 37 | I | 94.3 | Very high | 93.5 | Very high | 75 Ų | 75 | 95.1 Ų | 95.1 | 39% | 0.385 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.5 | -43.3 | 176.2 | -70.8 | 168.1 | 0 | 0 | 0 | 110.1 | I33 Y34 T35 D39 L40 W41 | I33-I37 HydrophobicContact CG2-CD1 3.65Å; I33-I37 HydrophobicContact CG2-CG1 4.3Å; I33-I37 VanDerWaalsContact O-CG1 3.31Å; I33-I37 WeakPolarHBondContact O-CG1 3.35Å; I33-I37 PolarHBondContact O-N 3.36Å; Y34-I37 PolarHBondContact O-N 2.97Å; T35-I37 PolarHBondContact O-N 2.96Å; I37-D39 VanDerWaalsContact C-N 3.35Å; I37-D39 PolarHBondContact O-N 3.37Å; I37-L40 PolarHBondContact O-N 2.93Å; I37-W41 VanDerWaalsContact CG2-CD1 3.41Å; I37-W41 PolarHBondContact O-N 3Å |
| 38 | N | 93.2 | Very high | 93.2 | Very high | 57 Ų | 57 | 94.7 Ų | 94.7 | 31% | 0.305 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.3 | -39.8 | 177.6 | -71.7 | -33.4 | 0 | 0 | 0 | 112.6 | Y34 T35 Q36 L40 W41 V42 | Y34-N38 VanDerWaalsContact CD1-ND2 3.28Å; Y34-N38 WeakPolarHBondContact CD1-ND2 3.26Å; Y34-N38 WeakPolarHBondContact CE1-ND2 3.38Å; Y34-N38 VanDerWaalsContact CZ-ND2 3.3Å; Y34-N38 VanDerWaalsContact O-CG 3.31Å; Y34-N38 PolarHBondContact O-N 2.97Å; Y34-N38 PolarHBondContact O-ND2 3.49Å; Y34-N38 VanDerWaalsContact O-ND2 3.13Å; T35-N38 PolarHBondContact O-N 3.48Å; Q36-N38 VanDerWaalsContact C-N 3.34Å; N38-L40 VanDerWaalsContact C-N 3.33Å; N38-L40 PolarHBondContact O-N 3.33Å; N38-W41 PolarHBondContact O-N 3.42Å; N38-V42 WeakPolarHBondContact O-CG2 3.11Å; N38-V42 PolarHBondContact O-N 3.45Å |
| 39 | D | 93.6 | Very high | 93 | Very high | 114 Ų | 114 | 92.8 Ų | 92.8 | 61% | 0.61 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62.2 | -42.7 | 176.3 | -66.9 | -21.7 | 0 | 0 | 0 | 110.9 | T35 Q36 I37 W41 V42 E43 | T35-D39 PolarHBondContact O-N 3.26Å; Q36-D39 PolarHBondContact O-N 2.88Å; I37-D39 VanDerWaalsContact C-N 3.35Å; I37-D39 PolarHBondContact O-N 3.37Å; D39-W41 PolarHBondContact O-N 3.42Å; D39-V42 PolarHBondContact O-N 3.06Å; D39-E43 PolarHBondContact O-N 2.8Å |
| 40 | L | 93.3 | Very high | 92.8 | Very high | 126 Ų | 126 | 94.7 Ų | 94.7 | 66% | 0.66 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.2 | -40 | 174.3 | -72 | 170.6 | 0 | 0 | 0 | 112.8 | Q36 I37 N38 V42 E43 L44 | Q36-L40 WeakPolarHBondContact O-CG 3.08Å; Q36-L40 PolarHBondContact O-N 3.36Å; Q36-L40 VanDerWaalsContact O-N 3.09Å; I37-L40 PolarHBondContact O-N 2.93Å; N38-L40 VanDerWaalsContact C-N 3.33Å; N38-L40 PolarHBondContact O-N 3.33Å; L40-V42 VanDerWaalsContact C-N 3.31Å; L40-V42 PolarHBondContact O-N 3.39Å; L40-E43 PolarHBondContact O-N 3.45Å; L40-L44 WeakPolarHBondContact O-CB 3.19Å; L40-L44 PolarHBondContact O-N 3.31Å |
| 41 | W | 93.7 | Very high | 92.6 | Very high | 168 Ų | 168 | 99.6 Ų | 99.6 | 64% | 0.636 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64 | -37.4 | 175.8 | -81.5 | 109.7 | 0 | 0 | 0 | 112.1 | I37 N38 D39 D45 | I37-W41 VanDerWaalsContact CG2-CD1 3.41Å; I37-W41 PolarHBondContact O-N 3Å; N38-W41 PolarHBondContact O-N 3.42Å; D39-W41 PolarHBondContact O-N 3.42Å; W41-D45 WeakPolarHBondContact O-CB 3.31Å; W41-D45 PolarHBondContact O-N 3.32Å |
| 42 | V | 92.9 | Very high | 92.4 | Very high | 77 Ų | 77 | 102.5 Ų | 102.5 | 47% | 0.467 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.7 | -41.9 | 177.8 | 170.1 | 0 | 0 | 0 | 0 | 111.2 | N38 D39 L40 D45 S46 | N38-V42 WeakPolarHBondContact O-CG2 3.11Å; N38-V42 PolarHBondContact O-N 3.45Å; D39-V42 PolarHBondContact O-N 3.06Å; L40-V42 VanDerWaalsContact C-N 3.31Å; L40-V42 PolarHBondContact O-N 3.39Å; V42-D45 PolarHBondContact O-N 2.9Å; V42-S46 PolarHBondContact O-N 3.41Å; V42-S46 PolarHBondContact O-OG 2.67Å |
| 43 | E | 93.4 | Very high | 92.2 | Very high | 114 Ų | 114 | 107.2 Ų | 107.2 | 53% | 0.533 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.5 | -45.4 | 176.5 | -170.3 | 63.8 | -150.3 | 0 | 0 | 111.7 | D39 L40 D45 S46 E47 | D39-E43 PolarHBondContact O-N 2.8Å; L40-E43 PolarHBondContact O-N 3.45Å; E43-D45 VanDerWaalsContact C-N 3.3Å; E43-D45 PolarHBondContact O-N 3.36Å; E43-S46 WeakPolarHBondContact CA-OG 3.27Å; E43-S46 PolarHBondContact O-N 2.96Å; E43-S46 PolarHBondContact O-OG 3.37Å; E43-E47 PolarHBondContact O-N 2.97Å |
| 44 | L | 93.2 | Very high | 92.1 | Very high | 91 Ų | 91 | 106 Ų | 106 | 48% | 0.476 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.5 | -37 | 177.7 | -172.6 | 67.4 | 0 | 0 | 0 | 111.9 | L40 M48 | L40-L44 WeakPolarHBondContact O-CB 3.19Å; L40-L44 PolarHBondContact O-N 3.31Å; L44-M48 VanDerWaalsContact O-CB 3.24Å; L44-M48 WeakPolarHBondContact O-CB 3.32Å; L44-M48 PolarHBondContact O-N 3.2Å |
| 45 | D | 92.9 | Very high | 92 | Very high | 85 Ų | 85 | 100.9 Ų | 100.9 | 46% | 0.455 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68 | -35.6 | 176.3 | -165.4 | 48 | 0 | 0 | 0 | 111.6 | W41 V42 E43 S49 R433 | W41-D45 WeakPolarHBondContact O-CB 3.31Å; W41-D45 PolarHBondContact O-N 3.32Å; V42-D45 PolarHBondContact O-N 2.9Å; E43-D45 VanDerWaalsContact C-N 3.3Å; E43-D45 PolarHBondContact O-N 3.36Å; D45-S49 WeakPolarHBondContact O-CB 2.92Å; D45-S49 PolarHBondContact O-N 2.97Å; D45-S49 PolarHBondContact O-OG 3.02Å; D45-R433 IonicContact OD2-CZ 3.96Å |
| 46 | S | 93 | Very high | 92 | Very high | 46 Ų | 46 | 101 Ų | 101 | 32% | 0.322 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.6 | -47.6 | 172.6 | 43.1 | 0 | 0 | 0 | 0 | 112.6 | V42 E43 M48 S49 E50 | V42-S46 PolarHBondContact O-N 3.41Å; V42-S46 PolarHBondContact O-OG 2.67Å; E43-S46 WeakPolarHBondContact CA-OG 3.27Å; E43-S46 PolarHBondContact O-N 2.96Å; E43-S46 PolarHBondContact O-OG 3.37Å; S46-M48 VanDerWaalsContact C-N 3.3Å; S46-M48 PolarHBondContact O-N 3.28Å; S46-S49 PolarHBondContact O-N 3.14Å; S46-S49 VanDerWaalsContact O-N 3.14Å; S46-S49 PolarHBondContact O-OG 3.42Å; S46-E50 PolarHBondContact O-N 3.18Å |
| 47 | E | 91.5 | Very high | 91.8 | Very high | 119 Ų | 119 | 98.5 Ų | 98.5 | 56% | 0.556 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62 | -40.2 | 176.8 | -70.3 | -167.5 | 154.2 | 0 | 0 | 111.6 | E43 S49 E50 F51 | E43-E47 PolarHBondContact O-N 2.97Å; E47-S49 VanDerWaalsContact C-N 3.31Å; E47-S49 PolarHBondContact O-N 3.43Å; E47-E50 PolarHBondContact O-N 3.32Å; E47-F51 WeakPolarHBondContact O-CB 2.95Å; E47-F51 PolarHBondContact O-N 3.34Å |
| 48 | M | 89.6 | Confident | 91.7 | Very high | 110 Ų | 110 | 100.5 Ų | 100.5 | 54% | 0.542 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.4 | -37.5 | 176.3 | -170.9 | 61.9 | 60.5 | 0 | 0 | 111.7 | L44 S46 K52 | L44-M48 VanDerWaalsContact O-CB 3.24Å; L44-M48 WeakPolarHBondContact O-CB 3.32Å; L44-M48 PolarHBondContact O-N 3.2Å; S46-M48 VanDerWaalsContact C-N 3.3Å; S46-M48 PolarHBondContact O-N 3.28Å; M48-K52 WeakPolarHBondContact O-CB 3.39Å; M48-K52 PolarHBondContact O-N 3.4Å |
| 49 | S | 89 | Confident | 91.4 | Very high | 68 Ų | 68 | 105.1 Ų | 105.1 | 48% | 0.476 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.8 | -39.3 | 177.4 | 74.3 | 0 | 0 | 0 | 0 | 112.4 | D45 S46 E47 K52 E53 | D45-S49 WeakPolarHBondContact O-CB 2.92Å; D45-S49 PolarHBondContact O-N 2.97Å; D45-S49 PolarHBondContact O-OG 3.02Å; S46-S49 PolarHBondContact O-N 3.14Å; S46-S49 VanDerWaalsContact O-N 3.14Å; S46-S49 PolarHBondContact O-OG 3.42Å; E47-S49 VanDerWaalsContact C-N 3.31Å; E47-S49 PolarHBondContact O-N 3.43Å; S49-K52 PolarHBondContact O-N 2.93Å; S49-E53 PolarHBondContact O-N 3.39Å |
| 50 | E | 90.4 | Very high | 91.2 | Very high | 142 Ų | 142 | 106.3 Ų | 106.3 | 66% | 0.664 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.6 | -43.7 | 175.5 | -174.1 | 177.9 | 175.7 | 0 | 0 | 111.3 | S46 E47 K52 E53 S54 | S46-E50 PolarHBondContact O-N 3.18Å; E47-E50 PolarHBondContact O-N 3.32Å; E50-K52 VanDerWaalsContact C-N 3.27Å; E50-K52 PolarHBondContact O-N 3.4Å; E50-E53 PolarHBondContact O-N 3.47Å; E50-S54 WeakPolarHBondContact O-CB 3.16Å; E50-S54 PolarHBondContact O-N 2.71Å |
| 51 | F | 89.1 | Confident | 91.1 | Very high | 140 Ų | 140 | 105.6 Ų | 105.6 | 61% | 0.614 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.9 | -38.6 | 174.6 | -175.4 | -97.8 | 0 | 0 | 0 | 111.9 | E47 S55 | E47-F51 WeakPolarHBondContact O-CB 2.95Å; E47-F51 PolarHBondContact O-N 3.34Å; F51-S55 WeakPolarHBondContact CE1-OG 3.32Å; F51-S55 VanDerWaalsContact O-CB 3.29Å; F51-S55 WeakPolarHBondContact O-CB 3.18Å; F51-S55 PolarHBondContact O-N 3.18Å; F51-S55 PolarHBondContact O-OG 3.42Å |
| 52 | K | 89.9 | Confident | 90.7 | Very high | 137 Ų | 137 | 103 Ų | 103 | 60% | 0.596 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -67 | -44.3 | 177.6 | -170.6 | 172.1 | -177.8 | 144.1 | 0 | 111.9 | M48 S49 E50 S55 D56 | M48-K52 WeakPolarHBondContact O-CB 3.39Å; M48-K52 PolarHBondContact O-N 3.4Å; S49-K52 PolarHBondContact O-N 2.93Å; E50-K52 VanDerWaalsContact C-N 3.27Å; E50-K52 PolarHBondContact O-N 3.4Å; K52-S55 PolarHBondContact O-N 3.32Å; K52-D56 WeakPolarHBondContact O-CB 3.03Å; K52-D56 PolarHBondContact O-N 2.91Å |
| 53 | E | 90.1 | Very high | 90.3 | Very high | 141 Ų | 141 | 103 Ų | 103 | 66% | 0.659 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.3 | -44.4 | 177.1 | -171.9 | 171.9 | -173.8 | 0 | 0 | 111.4 | S49 E50 S55 D56 V57 | S49-E53 PolarHBondContact O-N 3.39Å; E50-E53 PolarHBondContact O-N 3.47Å; E53-S55 PolarHBondContact O-N 2.7Å; E53-D56 PolarHBondContact O-N 3.05Å; E53-V57 VanDerWaalsContact O-CG2 3.3Å; E53-V57 WeakPolarHBondContact O-CG2 3.47Å; E53-V57 PolarHBondContact O-N 2.92Å |
| 54 | S | 91.2 | Very high | 89.9 | Confident | 64 Ų | 64 | 99.8 Ų | 99.8 | 45% | 0.448 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.7 | -44.4 | 175.3 | -178.4 | 0 | 0 | 0 | 0 | 112.3 | E50 V57 L58 | E50-S54 WeakPolarHBondContact O-CB 3.16Å; E50-S54 PolarHBondContact O-N 2.71Å; S54-V57 PolarHBondContact O-N 3.48Å; S54-L58 WeakPolarHBondContact O-CG 3.36Å; S54-L58 PolarHBondContact O-N 3.38Å |
| 55 | S | 91.7 | Very high | 89.1 | Confident | 44 Ų | 44 | 101.5 Ų | 101.5 | 31% | 0.308 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 177.3 | -62.1 | 0 | 0 | 0 | 0 | 112.2 | F51 K52 E53 L58 W59 | F51-S55 WeakPolarHBondContact CE1-OG 3.32Å; F51-S55 VanDerWaalsContact O-CB 3.29Å; F51-S55 WeakPolarHBondContact O-CB 3.18Å; F51-S55 PolarHBondContact O-N 3.18Å; F51-S55 PolarHBondContact O-OG 3.42Å; K52-S55 PolarHBondContact O-N 3.32Å; E53-S55 PolarHBondContact O-N 2.7Å; S55-L58 PolarHBondContact O-N 3.14Å; S55-W59 VanDerWaalsContact O-CB 3.32Å; S55-W59 WeakPolarHBondContact O-CB 3.35Å; S55-W59 PolarHBondContact O-N 3.05Å |
| 56 | D | 92.5 | Very high | 88.6 | Confident | 77 Ų | 77 | 101.7 Ų | 101.7 | 41% | 0.412 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.1 | -38.2 | 177.5 | -80.7 | -14 | 0 | 0 | 0 | 111.8 | K52 E53 K60 | K52-D56 WeakPolarHBondContact O-CB 3.03Å; K52-D56 PolarHBondContact O-N 2.91Å; E53-D56 PolarHBondContact O-N 3.05Å; D56-K60 WeakPolarHBondContact O-CB 3.43Å; D56-K60 VanDerWaalsContact O-CG 3.29Å; D56-K60 WeakPolarHBondContact O-CG 2.95Å; D56-K60 PolarHBondContact O-N 3.36Å |
| 57 | V | 90.5 | Very high | 88 | Confident | 74 Ų | 74 | 102 Ų | 102 | 45% | 0.448 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65 | -49.1 | 174.2 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | E53 S54 W59 K60 E61 | E53-V57 VanDerWaalsContact O-CG2 3.3Å; E53-V57 WeakPolarHBondContact O-CG2 3.47Å; E53-V57 PolarHBondContact O-N 2.92Å; S54-V57 PolarHBondContact O-N 3.48Å; V57-W59 VanDerWaalsContact C-N 3.29Å; V57-W59 PolarHBondContact O-N 3.18Å; V57-K60 PolarHBondContact O-N 3.27Å; V57-E61 WeakPolarHBondContact O-CG 3.28Å; V57-E61 PolarHBondContact O-N 3.28Å |
| 58 | L | 90.3 | Very high | 87.3 | Confident | 116 Ų | 116 | 99.6 Ų | 99.6 | 61% | 0.607 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60 | -39.3 | 177.1 | -74.9 | 170.7 | 0 | 0 | 0 | 112.2 | S54 S55 E61 M62 | S54-L58 WeakPolarHBondContact O-CG 3.36Å; S54-L58 PolarHBondContact O-N 3.38Å; S55-L58 PolarHBondContact O-N 3.14Å; L58-E61 PolarHBondContact O-N 3.19Å; L58-M62 WeakPolarHBondContact O-CB 3.36Å; L58-M62 PolarHBondContact O-N 2.87Å |
| 59 | W | 88.2 | Confident | 86.8 | Confident | 155 Ų | 155 | 102.7 Ų | 102.7 | 59% | 0.587 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -67.3 | -40.8 | 178 | -166 | 69.9 | 0 | 0 | 0 | 111.9 | S55 V57 M62 I63 | S55-W59 VanDerWaalsContact O-CB 3.32Å; S55-W59 WeakPolarHBondContact O-CB 3.35Å; S55-W59 PolarHBondContact O-N 3.05Å; V57-W59 VanDerWaalsContact C-N 3.29Å; V57-W59 PolarHBondContact O-N 3.18Å; W59-M62 HydrophobicContact CG-CE 4.38Å; W59-M62 PolarHBondContact O-N 2.91Å; W59-I63 HydrophobicContact CD2-CD1 3.52Å; W59-I63 HydrophobicContact CD2-CG1 4.42Å; W59-I63 HydrophobicContact CE3-CD1 3.48Å; W59-I63 VanDerWaalsContact CE3-CD1 3.48Å; W59-I63 HydrophobicContact CG-CD1 4.31Å; W59-I63 HydrophobicContact CH2-CD1 3.58Å; W59-I63 HydrophobicContact CZ2-CD1 3.62Å; W59-I63 HydrophobicContact CZ3-CD1 3.5Å; W59-I63 VanDerWaalsContact O-CG1 3.3Å; W59-I63 WeakPolarHBondContact O-CG1 3.28Å; W59-I63 PolarHBondContact O-N 2.97Å |
| 60 | K | 89.4 | Confident | 86.1 | Confident | 139 Ų | 139 | 104 Ų | 104 | 60% | 0.604 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.5 | -44.9 | 173 | -76.3 | 170.7 | -176.5 | 168.1 | 0 | 112 | D56 V57 I63 A64 | D56-K60 WeakPolarHBondContact O-CB 3.43Å; D56-K60 VanDerWaalsContact O-CG 3.29Å; D56-K60 WeakPolarHBondContact O-CG 2.95Å; D56-K60 PolarHBondContact O-N 3.36Å; V57-K60 PolarHBondContact O-N 3.27Å; K60-I63 PolarHBondContact O-N 3Å; K60-A64 WeakPolarHBondContact O-CB 3.45Å; K60-A64 PolarHBondContact O-N 3.43Å |
| 61 | E | 91 | Very high | 85.2 | Confident | 111 Ų | 111 | 107.3 Ų | 107.3 | 52% | 0.519 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.6 | -42.4 | 175.8 | -73 | -63.8 | 144.3 | 0 | 0 | 111.5 | V57 L58 A64 M65 | V57-E61 WeakPolarHBondContact O-CG 3.28Å; V57-E61 PolarHBondContact O-N 3.28Å; L58-E61 PolarHBondContact O-N 3.19Å; E61-A64 PolarHBondContact O-N 2.78Å; E61-M65 WeakPolarHBondContact O-CG 3.27Å; E61-M65 PolarHBondContact O-N 3.49Å |
| 62 | M | 84.4 | Confident | 84.4 | Confident | 112 Ų | 112 | 109.8 Ų | 109.8 | 55% | 0.552 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.8 | -45.4 | 176.3 | -176.1 | -177.9 | 68.6 | 0 | 0 | 111.7 | L58 W59 A64 M65 D66 | L58-M62 WeakPolarHBondContact O-CB 3.36Å; L58-M62 PolarHBondContact O-N 2.87Å; W59-M62 HydrophobicContact CG-CE 4.38Å; W59-M62 PolarHBondContact O-N 2.91Å; M62-A64 VanDerWaalsContact C-N 3.34Å; M62-M65 PolarHBondContact O-N 3Å; M62-D66 PolarHBondContact O-N 2.93Å |
| 63 | I | 85.7 | Confident | 83.3 | Confident | 79 Ų | 79 | 109 Ų | 109 | 41% | 0.405 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.9 | -40.1 | 175.8 | -68.3 | 165.5 | 0 | 0 | 0 | 110.9 | W59 K60 D66 A67 | W59-I63 HydrophobicContact CD2-CD1 3.52Å; W59-I63 HydrophobicContact CD2-CG1 4.42Å; W59-I63 HydrophobicContact CE3-CD1 3.48Å; W59-I63 VanDerWaalsContact CE3-CD1 3.48Å; W59-I63 HydrophobicContact CG-CD1 4.31Å; W59-I63 HydrophobicContact CH2-CD1 3.58Å; W59-I63 HydrophobicContact CZ2-CD1 3.62Å; W59-I63 HydrophobicContact CZ3-CD1 3.5Å; W59-I63 VanDerWaalsContact O-CG1 3.3Å; W59-I63 WeakPolarHBondContact O-CG1 3.28Å; W59-I63 PolarHBondContact O-N 2.97Å; K60-I63 PolarHBondContact O-N 3Å; I63-D66 PolarHBondContact O-N 3.26Å; I63-A67 WeakPolarHBondContact O-CB 3.04Å; I63-A67 PolarHBondContact O-N 3.29Å |
| 64 | A | 84.4 | Confident | 82 | Confident | 46 Ų | 46 | 105.1 Ų | 105.1 | 38% | 0.38 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.6 | -39.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | K60 E61 M62 T68 | K60-A64 WeakPolarHBondContact O-CB 3.45Å; K60-A64 PolarHBondContact O-N 3.43Å; E61-A64 PolarHBondContact O-N 2.78Å; M62-A64 VanDerWaalsContact C-N 3.34Å; A64-T68 PolarHBondContact O-N 3.07Å; A64-T68 PolarHBondContact O-OG1 3.49Å |
| 65 | M | 77.3 | Confident | 80.5 | Confident | 127 Ų | 127 | 105.3 Ų | 105.3 | 63% | 0.626 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.7 | -39.3 | 173.2 | -71.6 | -152 | -169.9 | 0 | 0 | 112.2 | E61 M62 T68 R69 | E61-M65 WeakPolarHBondContact O-CG 3.27Å; E61-M65 PolarHBondContact O-N 3.49Å; M62-M65 PolarHBondContact O-N 3Å; M65-T68 WeakPolarHBondContact O-CB 3.44Å; M65-T68 PolarHBondContact O-N 3.27Å; M65-R69 PolarHBondContact O-N 3.09Å |
| 66 | D | 82.7 | Confident | 78.7 | Confident | 88 Ų | 88 | 113.2 Ų | 113.2 | 47% | 0.471 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.1 | -40.4 | 177.9 | -157.1 | 40.7 | 0 | 0 | 0 | 111.4 | M62 I63 T68 R69 L70 | M62-D66 PolarHBondContact O-N 2.93Å; I63-D66 PolarHBondContact O-N 3.26Å; D66-T68 VanDerWaalsContact C-N 3.26Å; D66-T68 PolarHBondContact O-N 3.5Å; D66-R69 CarbonylContact O-C 3.6Å; D66-R69 PolarHBondContact O-N 3.37Å; D66-R69 VanDerWaalsContact O-N 3.15Å; D66-L70 WeakPolarHBondContact O-CB 3.4Å; D66-L70 WeakPolarHBondContact O-CD1 3.5Å; D66-L70 WeakPolarHBondContact O-CG 3.29Å; D66-L70 PolarHBondContact O-N 3.02Å |
| 67 | A | 79.1 | Confident | 76.7 | Confident | 52 Ų | 52 | 118.7 Ų | 118.7 | 43% | 0.43 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -59.8 | -36.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | I63 R71 | I63-A67 WeakPolarHBondContact O-CB 3.04Å; I63-A67 PolarHBondContact O-N 3.29Å; A67-R71 PolarHBondContact O-N 3.23Å |
| 68 | T | 77.8 | Confident | 74.5 | Confident | 69 Ų | 69 | 118.9 Ų | 118.9 | 42% | 0.423 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -70 | -39.6 | 175.4 | -53.7 | 0 | 0 | 0 | 0 | 111.6 | A64 M65 D66 R72 | A64-T68 PolarHBondContact O-N 3.07Å; A64-T68 PolarHBondContact O-OG1 3.49Å; M65-T68 WeakPolarHBondContact O-CB 3.44Å; M65-T68 PolarHBondContact O-N 3.27Å; D66-T68 VanDerWaalsContact C-N 3.26Å; D66-T68 PolarHBondContact O-N 3.5Å; T68-R72 WeakPolarHBondContact O-CG 3.32Å; T68-R72 PolarHBondContact O-N 3.1Å; T68-R72 VanDerWaalsContact O-N 3.09Å |
| 69 | R | 78.9 | Confident | 72.5 | Confident | 175 Ų | 175 | 121.2 Ų | 121.2 | 66% | 0.66 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -65 | -45.5 | 173.4 | -79.1 | -175.1 | 177.1 | -166.3 | 0.6 | 111.6 | M65 D66 R71 R72 Q73 | M65-R69 PolarHBondContact O-N 3.09Å; D66-R69 CarbonylContact O-C 3.6Å; D66-R69 PolarHBondContact O-N 3.37Å; D66-R69 VanDerWaalsContact O-N 3.15Å; R69-R71 PolarHBondContact O-N 3.36Å; R69-R72 CarbonylContact O-C 3.57Å; R69-R72 PolarHBondContact O-N 2.76Å; R69-R72 VanDerWaalsContact O-N 3.11Å; R69-Q73 WeakPolarHBondContact O-CB 2.88Å; R69-Q73 WeakPolarHBondContact O-CG 3.11Å; R69-Q73 PolarHBondContact O-N 3.22Å |
| 70 | L | 72.9 | Confident | 70.5 | Confident | 95 Ų | 95 | 119.8 Ų | 119.8 | 50% | 0.497 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -60.5 | -42.2 | 176.2 | -79.8 | 157.1 | 0 | 0 | 0 | 111.4 | D66 R72 Q73 A74 | D66-L70 WeakPolarHBondContact O-CB 3.4Å; D66-L70 WeakPolarHBondContact O-CD1 3.5Å; D66-L70 WeakPolarHBondContact O-CG 3.29Å; D66-L70 PolarHBondContact O-N 3.02Å; L70-R72 PolarHBondContact O-N 2.95Å; L70-Q73 PolarHBondContact O-N 3.24Å; L70-A74 VanDerWaalsContact O-CB 3.23Å; L70-A74 WeakPolarHBondContact O-CB 3.24Å; L70-A74 PolarHBondContact O-N 3.34Å |
| 71 | R | 73.1 | Confident | 68.9 | Low | 212 Ų | 212 | 119.4 Ų | 119.4 | 80% | 0.8 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -60.9 | -41.4 | 171.9 | -88.7 | -172.4 | -178.9 | 162.7 | 1.5 | 112.7 | A67 R69 G75 | A67-R71 PolarHBondContact O-N 3.23Å; R69-R71 PolarHBondContact O-N 3.36Å; R71-G75 PolarHBondContact O-N 3.39Å; R71-G75 VanDerWaalsContact O-N 3.16Å |
| 72 | R | 71.1 | Confident | 67 | Low | 192 Ų | 192 | 119.6 Ų | 119.6 | 73% | 0.725 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69.1 | -38.3 | 176.7 | -70.7 | 178.9 | -174.3 | -173.7 | 3.3 | 112.2 | T68 R69 L70 G75 Y76 | T68-R72 WeakPolarHBondContact O-CG 3.32Å; T68-R72 PolarHBondContact O-N 3.1Å; T68-R72 VanDerWaalsContact O-N 3.09Å; R69-R72 CarbonylContact O-C 3.57Å; R69-R72 PolarHBondContact O-N 2.76Å; R69-R72 VanDerWaalsContact O-N 3.11Å; L70-R72 PolarHBondContact O-N 2.95Å; R72-G75 PolarHBondContact O-N 3.34Å; R72-Y76 PolarHBondContact O-N 3.3Å |
| 73 | Q | 68.4 | Low | 65.2 | Low | 122 Ų | 122 | 124 Ų | 124 | 57% | 0.57 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -69.6 | -38.8 | 176.3 | -76.9 | -178.3 | -20.3 | 0 | 0 | 112.1 | R69 L70 G75 Y76 Y77 | R69-Q73 WeakPolarHBondContact O-CB 2.88Å; R69-Q73 WeakPolarHBondContact O-CG 3.11Å; R69-Q73 PolarHBondContact O-N 3.22Å; L70-Q73 PolarHBondContact O-N 3.24Å; Q73-G75 PolarHBondContact O-N 3.27Å; Q73-Y76 PolarHBondContact O-N 3.2Å; Q73-Y77 PolarHBondContact O-N 3.49Å |
| 74 | A | 62 | Low | 63.2 | Low | 58 Ų | 58 | 123.5 Ų | 123.5 | 48% | 0.479 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -64.8 | -27.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L70 Y76 Y77 | L70-A74 VanDerWaalsContact O-CB 3.23Å; L70-A74 WeakPolarHBondContact O-CB 3.24Å; L70-A74 PolarHBondContact O-N 3.34Å; A74-Y76 VanDerWaalsContact C-N 3.31Å; A74-Y77 CarbonylContact O-C 3.54Å |
| 75 | G | 59.9 | Low | 61.5 | Low | 68 Ų | 68 | 127.9 Ų | 127.9 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -20 | 169.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | R71 R72 Q73 | R71-G75 PolarHBondContact O-N 3.39Å; R71-G75 VanDerWaalsContact O-N 3.16Å; R72-G75 PolarHBondContact O-N 3.34Å; Q73-G75 PolarHBondContact O-N 3.27Å |
| 76 | Y | 52.9 | Low | 59.8 | Low | 210 Ų | 210 | 128.5 Ų | 128.5 | 82% | 0.824 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | -31.1 | -179.1 | -130.5 | -89.7 | 0 | 0 | 0 | 112.8 | R72 Q73 A74 | R72-Y76 PolarHBondContact O-N 3.3Å; Q73-Y76 PolarHBondContact O-N 3.2Å; A74-Y76 VanDerWaalsContact C-N 3.31Å |
| 77 | Y | 51.9 | Low | 57.8 | Low | 193 Ų | 193 | 135.1 Ų | 135.1 | 76% | 0.757 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.3 | 91.5 | 168.5 | -76.1 | -86.5 | 0 | 0 | 0 | 108.5 | Q73 A74 Q79 | Q73-Y77 PolarHBondContact O-N 3.49Å; A74-Y77 CarbonylContact O-C 3.54Å; Y77-Q79 PolarHBondContact O-N 3.08Å |
| 78 | G | 42.7 | Very low | 56 | Low | 77 Ų | 77 | 137.1 Ų | 137.1 | 79% | 0.794 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53 | 101 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 79 | Q | 48.1 | Very low | 54.4 | Low | 166 Ų | 166 | 136 Ų | 136 | 78% | 0.776 | 74% | 0.735 | S | S | * | * | | | trans | -125 | 131.3 | 160.5 | -75.6 | -130.5 | -53.1 | 0 | 0 | 108.4 | Y77 V81 | Y77-Q79 PolarHBondContact O-N 3.08Å; Q79-V81 PolarHBondContact O-N 3.33Å |
| 80 | P | 47.8 | Very low | 52.7 | Low | 124 Ų | 124 | 134 Ų | 134 | 81% | 0.805 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -67 | 117.8 | 176.1 | 26.7 | -30.7 | 0 | 0 | 0 | 109.1 | | |
| 81 | V | 55.4 | Low | 51.2 | Low | 132 Ų | 132 | 137.1 Ų | 137.1 | 80% | 0.8 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -69 | 125.9 | 169.9 | -111.9 | 0 | 0 | 0 | 0 | 108.4 | Q79 E83 | Q79-V81 PolarHBondContact O-N 3.33Å; V81-E83 PolarHBondContact O-N 3.06Å |
| 82 | P | 51.3 | Low | 49.5 | Very low | 115 Ų | 115 | 131.5 Ų | 131.5 | 75% | 0.747 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 119 | 171.8 | 25.9 | -29.8 | 0 | 0 | 0 | 109.3 | G84 | P82-G84 PolarHBondContact O-N 3.43Š|
| 83 | E | 45.7 | Very low | 47.8 | Very low | 203 Ų | 203 | 125.9 Ų | 125.9 | 95% | 0.949 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | 112.8 | 167.7 | -67.8 | 172.5 | 145.2 | 0 | 0 | 108.6 | V81 | V81-E83 PolarHBondContact O-N 3.06Š|
| 84 | G | 44.9 | Very low | 46.4 | Very low | 70 Ų | 70 | 128.5 Ų | 128.5 | 72% | 0.722 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 165.6 | -8.8 | 175 | 0 | 0 | 0 | 0 | 0 | 119.3 | P82 | P82-G84 PolarHBondContact O-N 3.43Š|
| 85 | T | 47 | Very low | 45.2 | Very low | 138 Ų | 138 | 131.6 Ų | 131.6 | 85% | 0.847 | 79% | 0.788 | S | S | * | * | | | trans | -114.8 | 88.2 | 175.9 | 45.4 | 0 | 0 | 0 | 0 | 111.3 | Y87 | T85-Y87 VanDerWaalsContact C-N 3.3Å; T85-Y87 PolarHBondContact O-N 2.03Å |
| 86 | T | 41.6 | Very low | 43.9 | Very low | 139 Ų | 139 | 137.5 Ų | 137.5 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | | | trans | -64.5 | 88.3 | 168.1 | -49.6 | 0 | 0 | 0 | 0 | 109.2 | A88 | T86-A88 PolarHBondContact O-N 3.49Š|
| 87 | Y | 41.5 | Very low | 43.2 | Very low | 227 Ų | 227 | 133 Ų | 133 | 89% | 0.89 | 79% | 0.794 | S | S | * | * | | | trans | -80.5 | 105.5 | 159 | -151.8 | -92.8 | 0 | 0 | 0 | 106.7 | T85 G89 | T85-Y87 VanDerWaalsContact C-N 3.3Å; T85-Y87 PolarHBondContact O-N 2.03Å; Y87-G89 VanDerWaalsContact C-N 3.32Å; Y87-G89 PolarHBondContact O-N 2.78Å |
| 88 | A | 41.9 | Very low | 42.4 | Very low | 94 Ų | 94 | 129 Ų | 129 | 78% | 0.777 | 79% | 0.794 | S | S | * | * | | | trans | -67.6 | 87.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | T86 | T86-A88 PolarHBondContact O-N 3.49Š|
| 89 | G | 44.2 | Very low | 42.1 | Very low | 45 Ų | 45 | 137 Ų | 137 | 46% | 0.464 | 80% | 0.801 | S | S | . | * | | | trans | -75.2 | 155.4 | 159.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | Y87 I91 | Y87-G89 VanDerWaalsContact C-N 3.32Å; Y87-G89 PolarHBondContact O-N 2.78Å; G89-I91 PolarHBondContact O-N 2.05Å; G89-I91 VanDerWaalsContact O-N 3.14Å |
| 90 | P | 42.3 | Very low | 41.7 | Very low | 134 Ų | 134 | 135.1 Ų | 135.1 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | | | trans | -66.2 | 118.3 | -175.6 | 28.3 | -31.6 | 0 | 0 | 0 | 109.3 | A92 | P90-A92 PolarHBondContact O-N 2.94Š|
| 91 | I | 42.6 | Very low | 41 | Very low | 160 Ų | 160 | 135.4 Ų | 135.4 | 82% | 0.821 | 81% | 0.808 | S | S | * | * | | | trans | -71.2 | 101.9 | 179.1 | -60.5 | 174.2 | 0 | 0 | 0 | 107.9 | G89 G93 | G89-I91 PolarHBondContact O-N 2.05Å; G89-I91 VanDerWaalsContact O-N 3.14Å; I91-G93 PolarHBondContact O-N 3.44Å |
| 92 | A | 37.4 | Very low | 40.4 | Very low | 95 Ų | 95 | 132.4 Ų | 132.4 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | | | trans | -78 | 111.5 | 162.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | P90 | P90-A92 PolarHBondContact O-N 2.94Š|
| 93 | G | 34.6 | Very low | 39.8 | Very low | 73 Ų | 73 | 133.4 Ų | 133.4 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | | | trans | 46.9 | 94.9 | 154.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | I91 | I91-G93 PolarHBondContact O-N 3.44Š|
| 94 | Q | 39.5 | Very low | 39.3 | Very low | 178 Ų | 178 | 131.1 Ų | 131.1 | 83% | 0.832 | 80% | 0.803 | S | S | * | * | | | trans | -127.8 | 131.8 | 152 | -77 | -153.7 | -44 | 0 | 0 | 111.5 | | |
| 95 | P | 35.2 | Very low | 38.9 | Very low | 122 Ų | 122 | 132.2 Ų | 132.2 | 79% | 0.792 | 81% | 0.805 | S | S | * | * | | | trans | -80.5 | 137.6 | 175.9 | 32.1 | -29.8 | 0 | 0 | 0 | 110.8 | | |
| 96 | Q | 32.9 | Very low | 38.5 | Very low | 193 Ų | 193 | 130.5 Ų | 130.5 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | | | trans | -75.9 | 137.3 | 178.2 | -65.4 | -156.1 | -26.4 | 0 | 0 | 112.3 | | |
| 97 | P | 38.7 | Very low | 38.2 | Very low | 115 Ų | 115 | 131.3 Ų | 131.3 | 75% | 0.747 | 79% | 0.794 | S | S | * | * | | | trans | -99 | 112.7 | 159.7 | 19.9 | -2.7 | 0 | 0 | 0 | 111.5 | | |
| 98 | S | 35.6 | Very low | 37.9 | Very low | 108 Ų | 108 | 125.4 Ų | 125.4 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | | | trans | 32.5 | 115.3 | 139.6 | 53.1 | 0 | 0 | 0 | 0 | 120.7 | | |
| 99 | R | 35.1 | Very low | 37.3 | Very low | 246 Ų | 246 | 124.6 Ų | 124.6 | 93% | 0.928 | 79% | 0.787 | S | S | * | * | | | trans | -59.6 | 154.6 | 158.5 | -73.7 | 177.4 | 172 | -179.4 | -3.4 | 112.4 | | |
| 100 | P | 40.2 | Very low | 36.8 | Very low | 127 Ų | 127 | 128.4 Ų | 128.4 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | | | trans | -110.6 | 141.8 | 142.4 | 19.7 | -1.9 | 0 | 0 | 0 | 112.1 | | |
| 101 | S | 33.3 | Very low | 36.1 | Very low | 129 Ų | 129 | 131.1 Ų | 131.1 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | | | trans | -72.1 | 146.9 | -177.8 | -45 | 0 | 0 | 0 | 0 | 113.2 | | |
| 102 | G | 42.1 | Very low | 35.6 | Very low | 69 Ų | 69 | 131.3 Ų | 131.3 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | | | trans | -166.8 | 145.9 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 103 | P | 40.2 | Very low | 35.2 | Very low | 136 Ų | 136 | 134.1 Ų | 134.1 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | | | trans | -92.6 | 158.7 | -135.5 | 34.6 | -34.9 | 0 | 0 | 0 | 116.2 | | |
| 104 | I | 33.9 | Very low | 35.3 | Very low | 155 Ų | 155 | 137 Ų | 137 | 80% | 0.795 | 80% | 0.798 | S | S | * | * | | | trans | -64.4 | 132 | 179.1 | -62.3 | 162.1 | 0 | 0 | 0 | 111.1 | P106 | I104-P106 HydrophobicContact CG2-CB 4.23Å; I104-P106 HydrophobicContact CG2-CG 4.19Å |
| 105 | A | 38.1 | Very low | 34.9 | Very low | 94 Ų | 94 | 132.7 Ų | 132.7 | 78% | 0.777 | 79% | 0.785 | S | S | * | * | | | trans | -112.9 | 117.8 | 152.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | | |
| 106 | P | 38.5 | Very low | 34.7 | Very low | 101 Ų | 101 | 130.9 Ų | 130.9 | 66% | 0.656 | 79% | 0.788 | S | S | * | * | | | trans | -105.1 | 112.5 | 178.1 | 33.3 | -20.6 | 0 | 0 | 0 | 108.8 | I104 | I104-P106 HydrophobicContact CG2-CB 4.23Å; I104-P106 HydrophobicContact CG2-CG 4.19Å |
| 107 | I | 34.5 | Very low | 34.6 | Very low | 156 Ų | 156 | 124.3 Ų | 124.3 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | | | trans | -160.7 | 123.8 | 161.1 | 17.6 | -179 | 0 | 0 | 0 | 113.4 | | |
| 108 | S | 35 | Very low | 34.3 | Very low | 104 Ų | 104 | 122.2 Ų | 122.2 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | | | trans | 82.7 | 80.9 | 137.9 | -49.6 | 0 | 0 | 0 | 0 | 117.5 | V110 | S108-V110 PolarHBondContact O-N 3.46Š|
| 109 | G | 28.5 | Very low | 34.5 | Very low | 77 Ų | 77 | 124.7 Ų | 124.7 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | | | | 34.9 | 88.8 | 115.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 110 | V | 34.6 | Very low | 34.9 | Very low | 125 Ų | 125 | 117.8 Ų | 117.8 | 76% | 0.758 | 76% | 0.762 | S | S | * | * | | | trans | -116 | 86.6 | 138.2 | 178.6 | 0 | 0 | 0 | 0 | 105.3 | S108 Q112 | S108-V110 PolarHBondContact O-N 3.46Å; V110-Q112 HydrophobicContact CG1-CB 4.35Å; V110-Q112 HydrophobicContact CG1-CG 4.1Å; V110-Q112 PolarHBondContact O-N 3.39Å |
| 111 | Q | 27.2 | Very low | 35 | Very low | 190 Ų | 190 | 121.4 Ų | 121.4 | 89% | 0.888 | 77% | 0.77 | S | S | * | * | | | trans | -58.4 | 91.2 | 145.9 | -91.7 | 167 | -68 | 0 | 0 | 104.9 | E113 | Q111-E113 PolarHBondContact O-N 3.02Š|
| 112 | Q | 32.1 | Very low | 35.5 | Very low | 165 Ų | 165 | 119.1 Ų | 119.1 | 77% | 0.771 | 76% | 0.759 | S | S | * | * | | | trans | -71 | 90.4 | 148.8 | -108.9 | 174.4 | 10.4 | 0 | 0 | 104.4 | V110 V114 | V110-Q112 HydrophobicContact CG1-CB 4.35Å; V110-Q112 HydrophobicContact CG1-CG 4.1Å; V110-Q112 PolarHBondContact O-N 3.39Å; Q112-V114 PolarHBondContact O-N 3.24Å |
| 113 | E | 28.9 | Very low | 36.1 | Very low | 154 Ų | 154 | 118.4 Ų | 118.4 | 72% | 0.72 | 75% | 0.747 | S | S | * | * | | | trans | -37.6 | 89.1 | 141.3 | -163.7 | 176 | 115.3 | 0 | 0 | 106.5 | Q111 T115 | Q111-E113 PolarHBondContact O-N 3.02Å; E113-T115 HydrophobicContact CG-CG2 3.85Å; E113-T115 PolarHBondContact O-N 2.97Å; E113-T115 WeakPolarHBondContact OE1-CG2 3.21Å |
| 114 | V | 36.8 | Very low | 37.5 | Very low | 133 Ų | 133 | 114.3 Ų | 114.3 | 81% | 0.806 | 72% | 0.721 | S | S | * | * | | | trans | -67.6 | 81 | 149 | -170 | 0 | 0 | 0 | 0 | 101.6 | Q112 G116 | Q112-V114 PolarHBondContact O-N 3.24Å; V114-G116 PolarHBondContact O-N 3.47Å |
| 115 | T | 31.1 | Very low | 38.9 | Very low | 88 Ų | 88 | 110.8 Ų | 110.8 | 54% | 0.54 | 70% | 0.698 | S | S | . | * | | | trans | -36.3 | 122 | 156.3 | 31.9 | 0 | 0 | 0 | 0 | 103.9 | E113 G117 | E113-T115 HydrophobicContact CG-CG2 3.85Å; E113-T115 PolarHBondContact O-N 2.97Å; E113-T115 WeakPolarHBondContact OE1-CG2 3.21Å; T115-G117 PolarHBondContact O-N 3.31Å |
| 116 | G | 31.8 | Very low | 40.2 | Very low | 83 Ų | 83 | 112.1 Ų | 112.1 | 86% | 0.856 | 69% | 0.688 | S | S | * | * | | | trans | -58.7 | 71.8 | 158 | 0 | 0 | 0 | 0 | 0 | 107 | V114 G118 | V114-G116 PolarHBondContact O-N 3.47Å; G116-G118 PolarHBondContact O-N 3.23Å |
| 117 | G | 30.2 | Very low | 41.6 | Very low | 55 Ų | 55 | 112.2 Ų | 112.2 | 57% | 0.567 | 68% | 0.68 | S | S | * | * | | | trans | -68.4 | 97.4 | 157.4 | 0 | 0 | 0 | 0 | 0 | 102.7 | T115 L119 | T115-G117 PolarHBondContact O-N 3.31Å; G117-L119 PolarHBondContact O-N 3.38Å |
| 118 | G | 32.6 | Very low | 43.2 | Very low | 71 Ų | 71 | 110 Ų | 110 | 73% | 0.732 | 67% | 0.668 | S | S | * | * | | | trans | -45.6 | 108.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | G116 P120 | G116-G118 PolarHBondContact O-N 3.23Å; G118-P120 WeakPolarHBondContact O-CD 3.06Å; G118-P120 VanDerWaalsContact O-N 3.11Å |
| 119 | L | 40.3 | Very low | 44.8 | Very low | 160 Ų | 160 | 105.4 Ų | 105.4 | 84% | 0.838 | 64% | 0.635 | S | S | * | * | | | trans | -59.5 | 120.3 | 169.5 | -80.4 | 162.2 | 0 | 0 | 0 | 104.5 | G117 M121 | G117-L119 PolarHBondContact O-N 3.38Å; L119-M121 PolarHBondContact O-N 3.06Å |
| 120 | P | 42.6 | Very low | 46.8 | Very low | 101 Ų | 101 | 106.9 Ų | 106.9 | 66% | 0.656 | 62% | 0.622 | S | S | * | * | | | trans | -55 | 139.8 | -180 | 24 | -32.2 | 0 | 0 | 0 | 107.1 | G118 A122 | G118-P120 WeakPolarHBondContact O-CD 3.06Å; G118-P120 VanDerWaalsContact O-N 3.11Å; P120-A122 PolarHBondContact O-N 2.89Å |
| 121 | M | 42.8 | Very low | 48.5 | Very low | 203 Ų | 203 | 105.2 Ų | 105.2 | 100% | 1 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -65.2 | 29.3 | -175.2 | -64.8 | -172.4 | 67.6 | 0 | 0 | 114.1 | L119 | L119-M121 PolarHBondContact O-N 3.06Š|
| 122 | A | 44 | Very low | 50.5 | Low | 81 Ų | 81 | 98.7 Ų | 98.7 | 67% | 0.669 | 58% | 0.576 | S | S | * | * | | | trans | -151.7 | 55.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | P120 S124 | P120-A122 PolarHBondContact O-N 2.89Å; A122-S124 PolarHBondContact O-N 3.49Å |
| 123 | A | 55.5 | Low | 52.2 | Low | 55 Ų | 55 | 93.9 Ų | 93.9 | 46% | 0.455 | 55% | 0.554 | S | S | . | * | | | trans | -72.2 | 114.9 | 158.2 | 0 | 0 | 0 | 0 | 0 | 107 | M128 | A123-M128 HydrophobicContact CB-CG 3.95Š|
| 124 | S | 69 | Low | 54.2 | Low | 49 Ų | 49 | 95.3 Ų | 95.3 | 34% | 0.343 | 55% | 0.553 | S | S | . | * | | | trans | -60.4 | 152.9 | 176.5 | 67 | 0 | 0 | 0 | 0 | 109.6 | A122 E126 E127 M128 | A122-S124 PolarHBondContact O-N 3.49Å; S124-E126 PolarHBondContact O-N 3Å; S124-E127 PolarHBondContact N-OE2 2.63Å; S124-E127 PolarHBondContact O-N 3.25Å; S124-E127 WeakPolarHBondContact OG-CG 3.42Å; S124-E127 PolarHBondContact OG-N 2.75Å; S124-E127 PolarHBondContact OG-OE2 2.79Å; S124-M128 PolarHBondContact O-N 3.05Å |
| 125 | W | 62.9 | Low | 55.7 | Low | 81 Ų | 81 | 93 Ų | 93 | 31% | 0.307 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -48.6 | -34.1 | 174.2 | 171 | -100 | 0 | 0 | 0 | 112.9 | C129 P348 A349 R350 | W125-C129 WeakPolarHBondContact O-CB 3.48Å; W125-C129 PolarHBondContact O-N 3.5Å; W125-P348 HydrophobicContact CH2-CB 3.43Å; W125-P348 VanDerWaalsContact CH2-CB 3.43Å; W125-P348 HydrophobicContact CH2-CG 4.01Å; W125-P348 VanDerWaalsContact CH2-O 3.24Å; W125-P348 WeakPolarHBondContact CH2-O 3.45Å; W125-P348 HydrophobicContact CZ2-CB 4.07Å; W125-P348 HydrophobicContact CZ2-CG 4.16Å; W125-P348 WeakPolarHBondContact CZ2-O 3.48Å; W125-P348 HydrophobicContact CZ3-CB 4.17Å; W125-A349 WeakPolarHBondContact CH2-O 3.35Å; W125-A349 WeakPolarHBondContact CZ3-O 3.36Å; W125-R350 HydrophobicContact CZ2-CG 4.14Å |
| 126 | E | 66.4 | Low | 57.3 | Low | 123 Ų | 123 | 91.2 Ų | 91.2 | 58% | 0.575 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -67 | -46.1 | 179.9 | -68.7 | 170.4 | 155.8 | 0 | 0 | 111.3 | S124 C129 E130 | S124-E126 PolarHBondContact O-N 3Å; E126-C129 PolarHBondContact O-N 3.37Å; E126-E130 WeakPolarHBondContact O-CG 3.42Å; E126-E130 PolarHBondContact O-N 2.96Å |
| 127 | E | 67.3 | Low | 58.7 | Low | 103 Ų | 103 | 93.3 Ų | 93.3 | 48% | 0.481 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.4 | -38.6 | 176.4 | -71.1 | 167.5 | 124.9 | 0 | 0 | 112.5 | S124 E130 N131 | S124-E127 PolarHBondContact N-OE2 2.63Å; S124-E127 PolarHBondContact O-N 3.25Å; S124-E127 WeakPolarHBondContact OG-CG 3.42Å; S124-E127 PolarHBondContact OG-N 2.75Å; S124-E127 PolarHBondContact OG-OE2 2.79Å; E127-E130 PolarHBondContact O-N 3.28Å; E127-N131 WeakPolarHBondContact O-CB 3.38Å; E127-N131 PolarHBondContact O-N 2.04Å; E127-N131 PolarHBondContact O-ND2 3.29Å |
| 128 | M | 67.2 | Low | 60 | Low | 110 Ų | 110 | 90.9 Ų | 90.9 | 54% | 0.542 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.7 | -42.1 | 175.3 | -67.3 | -179.7 | 65.4 | 0 | 0 | 111.4 | A123 S124 W132 | A123-M128 HydrophobicContact CB-CG 3.95Å; S124-M128 PolarHBondContact O-N 3.05Å; M128-W132 VanDerWaalsContact O-CB 3.28Å; M128-W132 WeakPolarHBondContact O-CB 3.49Å; M128-W132 PolarHBondContact O-N 2.93Å |
| 129 | C | 69.4 | Low | 61.4 | Low | 7 Ų | 7 | 93.8 Ų | 93.8 | 5% | 0.047 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -68 | -41.9 | 177.9 | -177.5 | 0 | 0 | 0 | 0 | 111.7 | W125 E126 W132 I133 C147 | W125-C129 WeakPolarHBondContact O-CB 3.48Å; W125-C129 PolarHBondContact O-N 3.5Å; E126-C129 PolarHBondContact O-N 3.37Å; C129-W132 PolarHBondContact O-N 3.09Å; C129-I133 WeakPolarHBondContact O-CG1 3.37Å; C129-I133 PolarHBondContact O-N 3.37Å; C129-C147 VanDerWaalsContact C-SG 3.55Å; C129-C147 HydrophobicContact CB-CB 3.93Å; C129-C147 WeakPolarHBondContact CB-SG 3.47Å; C129-C147 WeakPolarHBondContact SG-CA 3.44Å; C129-C147 WeakPolarHBondContact SG-CB 3.34Å; C129-C147 CovalentContact SG-SG 2.04Å; C129-C147 PolarHBondContact SG-SG 3.05Å |
| 130 | E | 70.2 | Confident | 62.2 | Low | 108 Ų | 108 | 92 Ų | 92 | 51% | 0.505 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.8 | -44.4 | 176.4 | -76.5 | -152.5 | 171 | 0 | 0 | 112.6 | E126 E127 W132 I133 R134 | E126-E130 WeakPolarHBondContact O-CG 3.42Å; E126-E130 PolarHBondContact O-N 2.96Å; E127-E130 PolarHBondContact O-N 3.28Å; E130-W132 PolarHBondContact O-N 3.45Å; E130-I133 PolarHBondContact O-N 2.88Å; E130-R134 VanDerWaalsContact O-CB 3.32Å; E130-R134 WeakPolarHBondContact O-CB 3.47Å; E130-R134 PolarHBondContact O-N 3.5Å; E130-R134 IonicContact OE2-NH2 3.42Å; E130-R134 PolarHBondContact OE2-NH2 3.28Å |
| 131 | N | 70.9 | Confident | 62.8 | Low | 90 Ų | 90 | 93.5 Ų | 93.5 | 48% | 0.481 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.4 | -33.3 | 175.7 | -79.1 | -22.7 | 0 | 0 | 0 | 112.1 | E127 R134 S135 | E127-N131 WeakPolarHBondContact O-CB 3.38Å; E127-N131 PolarHBondContact O-N 2.04Å; E127-N131 PolarHBondContact O-ND2 3.29Å; N131-R134 PolarHBondContact O-N 3.42Å; N131-S135 WeakPolarHBondContact O-CB 3.35Å; N131-S135 PolarHBondContact O-N 2.93Å; N131-S135 PolarHBondContact O-OG 3.17Å |
| 132 | W | 68.9 | Low | 63.6 | Low | 52 Ų | 52 | 87.5 Ų | 87.5 | 20% | 0.197 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -70.7 | -40.4 | 176.7 | -169.6 | 88.2 | 0 | 0 | 0 | 112.7 | M128 C129 E130 S135 K137 C145 P346 P348 | M128-W132 VanDerWaalsContact O-CB 3.28Å; M128-W132 WeakPolarHBondContact O-CB 3.49Å; M128-W132 PolarHBondContact O-N 2.93Å; C129-W132 PolarHBondContact O-N 3.09Å; E130-W132 PolarHBondContact O-N 3.45Å; W132-S135 PolarHBondContact O-N 3.32Å; W132-K137 HydrophobicContact CD2-CB 4.13Å; W132-K137 HydrophobicContact CH2-CB 4.04Å; W132-K137 VanDerWaalsContact CH2-O 3.26Å; W132-K137 WeakPolarHBondContact CH2-O 3.29Å; W132-K137 HydrophobicContact CZ2-CB 3.58Å; W132-C145 HydrophobicContact CZ3-CB 4.36Å; W132-P346 HydrophobicContact CH2-CG 4.05Å; W132-P346 WeakPolarHBondContact CH2-O 3.41Å; W132-P346 HydrophobicContact CZ2-CB 4.22Å; W132-P346 HydrophobicContact CZ2-CG 3.87Å; W132-P346 WeakPolarHBondContact CZ2-O 3.32Å; W132-P348 HydrophobicContact CD2-CG 4.44Å; W132-P348 HydrophobicContact CE3-CG 4.37Å |
| 133 | I | 67 | Low | 63.9 | Low | 64 Ų | 64 | 84.7 Ų | 84.7 | 33% | 0.328 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64 | -44.8 | 171.9 | -68.7 | 175.2 | 0 | 0 | 0 | 110.4 | C129 E130 S135 G136 C147 | C129-I133 WeakPolarHBondContact O-CG1 3.37Å; C129-I133 PolarHBondContact O-N 3.37Å; E130-I133 PolarHBondContact O-N 2.88Å; I133-S135 PolarHBondContact O-N 2.88Å; I133-G136 PolarHBondContact O-N 3.27Å; I133-G136 VanDerWaalsContact O-N 3.1Å; I133-C147 WeakPolarHBondContact CD1-SG 3.37Å |
| 134 | R | 71.2 | Confident | 64.2 | Low | 184 Ų | 184 | 93.4 Ų | 93.4 | 69% | 0.694 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65 | -21.4 | 179.8 | -144.9 | 179.8 | -68.2 | 167.7 | -0.7 | 113 | E130 N131 G136 | E130-R134 VanDerWaalsContact O-CB 3.32Å; E130-R134 WeakPolarHBondContact O-CB 3.47Å; E130-R134 PolarHBondContact O-N 3.5Å; E130-R134 IonicContact OE2-NH2 3.42Å; E130-R134 PolarHBondContact OE2-NH2 3.28Å; N131-R134 PolarHBondContact O-N 3.42Å; R134-G136 PolarHBondContact O-N 2.95Å |
| 135 | S | 69.2 | Low | 63.6 | Low | 86 Ų | 86 | 92.2 Ų | 92.2 | 60% | 0.601 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | 5.8 | 174.4 | -60.3 | 0 | 0 | 0 | 0 | 114.2 | N131 W132 I133 K137 | N131-S135 WeakPolarHBondContact O-CB 3.35Å; N131-S135 PolarHBondContact O-N 2.93Å; N131-S135 PolarHBondContact O-OG 3.17Å; W132-S135 PolarHBondContact O-N 3.32Å; I133-S135 PolarHBondContact O-N 2.88Å; S135-K137 PolarHBondContact O-N 3.13Å |
| 136 | G | 64.1 | Low | 63.7 | Low | 49 Ų | 49 | 91.8 Ų | 91.8 | 51% | 0.505 | 49% | 0.485 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.3 | 2.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115 | I133 R134 G138 | I133-G136 PolarHBondContact O-N 3.27Å; I133-G136 VanDerWaalsContact O-N 3.1Å; R134-G136 PolarHBondContact O-N 2.95Å; G136-G138 VanDerWaalsContact C-N 3.35Å |
| 137 | K | 62 | Low | 63.6 | Low | 128 Ų | 128 | 87.2 Ų | 87.2 | 56% | 0.557 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.6 | -16.4 | 179.7 | -70.2 | -176.5 | 177.8 | 176.9 | 0 | 113.5 | W132 S135 | W132-K137 HydrophobicContact CD2-CB 4.13Å; W132-K137 HydrophobicContact CH2-CB 4.04Å; W132-K137 VanDerWaalsContact CH2-O 3.26Å; W132-K137 WeakPolarHBondContact CH2-O 3.29Å; W132-K137 HydrophobicContact CZ2-CB 3.58Å; S135-K137 PolarHBondContact O-N 3.13Å |
| 138 | G | 56.8 | Low | 63.2 | Low | 4 Ų | 4 | 89.4 Ų | 89.4 | 4% | 0.041 | 48% | 0.481 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.7 | -4.1 | -176.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | G136 C145 | G136-G138 VanDerWaalsContact C-N 3.35Å; G138-C145 PolarHBondContact O-N 2.96Å |
| 139 | D | 61.5 | Low | 62.8 | Low | 132 Ų | 132 | 90.6 Ų | 90.6 | 71% | 0.706 | 48% | 0.483 | S | S | * | . | | | trans | -124.2 | 41.9 | -169.7 | -143.6 | 17.4 | 0 | 0 | 0 | 112.3 | | |
| 140 | Q | 57.9 | Low | 61.8 | Low | 122 Ų | 122 | 95 Ų | 95 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | | | trans | -74.9 | 149.3 | 176.6 | -70.3 | -104.4 | -35.8 | 0 | 0 | 110.9 | G142 C143 | Q140-G142 PolarHBondContact O-N 3.05Å; Q140-C143 HydrophobicContact CB-CB 4.36Å; Q140-C143 PolarHBondContact O-N 3.45Å |
| 141 | P | 54.5 | Low | 61 | Low | 133 Ų | 133 | 97.1 Ų | 97.1 | 86% | 0.864 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.9 | 110.8 | 177.8 | -16.3 | 27.7 | 0 | 0 | 0 | 110.6 | | |
| 142 | G | 58.9 | Low | 60 | Low | 76 Ų | 76 | 102.8 Ų | 102.8 | 78% | 0.784 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 103.4 | -8.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | Q140 | Q140-G142 PolarHBondContact O-N 3.05Š|
| 143 | C | 51.6 | Low | 58.9 | Low | 22 Ų | 22 | 103.1 Ų | 103.1 | 15% | 0.149 | 56% | 0.557 | C | S | . | * | | | trans | -123.4 | 111.7 | 178.3 | -63.7 | 0 | 0 | 0 | 0 | 110.7 | Q140 C345 | Q140-C143 HydrophobicContact CB-CB 4.36Å; Q140-C143 PolarHBondContact O-N 3.45Å; C143-C345 HydrophobicContact CB-CB 3.91Å; C143-C345 WeakPolarHBondContact CB-SG 3.48Å; C143-C345 WeakPolarHBondContact SG-CB 3.45Å; C143-C345 CovalentContact SG-SG 2.03Å; C143-C345 PolarHBondContact SG-SG 3.45Å |
| 144 | R | 61.6 | Low | 58 | Low | 239 Ų | 239 | 105 Ų | 105 | 90% | 0.902 | 57% | 0.574 | S | S | * | * | | | trans | -106.7 | 91.5 | 164.3 | -82.7 | -177.9 | 90.8 | -178.1 | 8.4 | 109.7 | | |
| 145 | C | 55.6 | Low | 56.9 | Low | 24 Ų | 24 | 101 Ų | 101 | 16% | 0.162 | 58% | 0.58 | C | S | . | * | | | trans | -75.7 | 143.1 | 174.8 | -62.5 | 0 | 0 | 0 | 0 | 110.7 | W132 G138 C347 | W132-C145 HydrophobicContact CZ3-CB 4.36Å; G138-C145 PolarHBondContact O-N 2.96Å; C145-C347 HydrophobicContact CB-CB 4.05Å; C145-C347 WeakPolarHBondContact CB-SG 3.41Å; C145-C347 WeakPolarHBondContact SG-CB 3.49Å; C145-C347 CovalentContact SG-SG 2.05Å; C145-C347 PolarHBondContact SG-SG 3.1Å |
| 146 | S | 65.6 | Low | 55.7 | Low | 72 Ų | 72 | 99 Ų | 99 | 50% | 0.503 | 57% | 0.573 | S | S | . | * | | | trans | -141.6 | 124.2 | 178.1 | -169.5 | 0 | 0 | 0 | 0 | 110.7 | L148 K149 | S146-L148 PolarHBondContact O-N 2.85Å; S146-L148 VanDerWaalsContact O-N 3.1Å; S146-K149 PolarHBondContact O-N 2.93Å |
| 147 | C | 63.5 | Low | 54.9 | Low | 27 Ų | 27 | 104.6 Ų | 104.6 | 18% | 0.182 | 59% | 0.591 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -61.6 | -22 | -173.1 | -59.4 | 0 | 0 | 0 | 0 | 114.4 | C129 I133 | C129-C147 VanDerWaalsContact C-SG 3.55Å; C129-C147 HydrophobicContact CB-CB 3.93Å; C129-C147 WeakPolarHBondContact CB-SG 3.47Å; C129-C147 WeakPolarHBondContact SG-CA 3.44Å; C129-C147 WeakPolarHBondContact SG-CB 3.34Å; C129-C147 CovalentContact SG-SG 2.04Å; C129-C147 PolarHBondContact SG-SG 3.05Å; I133-C147 WeakPolarHBondContact CD1-SG 3.37Å |
| 148 | L | 60.8 | Low | 54.3 | Low | 148 Ų | 148 | 104.4 Ų | 104.4 | 78% | 0.775 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | -1.6 | -174 | -71.1 | 157.5 | 0 | 0 | 0 | 113.9 | S146 | S146-L148 PolarHBondContact O-N 2.85Å; S146-L148 VanDerWaalsContact O-N 3.1Å |
| 149 | K | 57.7 | Low | 53.7 | Low | 136 Ų | 136 | 107 Ų | 107 | 59% | 0.591 | 63% | 0.629 | S | S | * | * | | | trans | -129.3 | 109.9 | -173.4 | -110.6 | 165.9 | -177.1 | 165.8 | 0 | 111.7 | S146 K151 | S146-K149 PolarHBondContact O-N 2.93Å; K149-K151 HydrophobicContact CB-CD 4.36Å; K149-K151 HydrophobicContact CB-CG 4.07Å; K149-K151 HydrophobicContact CD-CD 4.1Å; K149-K151 HydrophobicContact CG-CD 4.21Å; K149-K151 HydrophobicContact CG-CG 4.25Å; K149-K151 PolarHBondContact O-N 3.26Å |
| 150 | A | 49.1 | Very low | 53.1 | Low | 99 Ų | 99 | 106.7 Ų | 106.7 | 82% | 0.818 | 63% | 0.634 | S | S | * | * | | | trans | -65.7 | 94.2 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |
| 151 | K | 51.9 | Low | 52.9 | Low | 152 Ų | 152 | 107 Ų | 107 | 66% | 0.661 | 65% | 0.647 | S | S | * | * | | | trans | -133.7 | 112 | -179.8 | -71.2 | -160.4 | 172.7 | -154.3 | 0 | 110.7 | K149 | K149-K151 HydrophobicContact CB-CD 4.36Å; K149-K151 HydrophobicContact CB-CG 4.07Å; K149-K151 HydrophobicContact CD-CD 4.1Å; K149-K151 HydrophobicContact CG-CD 4.21Å; K149-K151 HydrophobicContact CG-CG 4.25Å; K149-K151 PolarHBondContact O-N 3.26Å |
| 152 | K | 51.5 | Low | 52.6 | Low | 209 Ų | 209 | 103.5 Ų | 103.5 | 91% | 0.909 | 64% | 0.635 | S | S | * | * | | | trans | -42.7 | 136.9 | 155.4 | -86 | 170.8 | 172.6 | -179.2 | 0 | 108.5 | | |
| 153 | C | 44.1 | Very low | 52.2 | Low | 59 Ų | 59 | 106.1 Ų | 106.1 | 40% | 0.399 | 64% | 0.639 | S | S | . | * | P | Polyproline II helix | trans | -49.8 | 147.7 | 170.2 | -62.1 | 0 | 0 | 0 | 0 | 109.6 | A155 | C153-A155 PolarHBondContact O-N 3.1Š|
| 154 | P | 49.6 | Very low | 52.1 | Low | 104 Ų | 104 | 113.5 Ų | 113.5 | 68% | 0.675 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 138.7 | 170.7 | 23.5 | -32.3 | 0 | 0 | 0 | 108.9 | G156 | P154-G156 PolarHBondContact O-N 3.42Š|
| 155 | A | 46.7 | Very low | 51.4 | Low | 100 Ų | 100 | 105.4 Ų | 105.4 | 83% | 0.826 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 134.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | C153 | C153-A155 PolarHBondContact O-N 3.1Š|
| 156 | G | 44.7 | Very low | 50.9 | Low | 44 Ų | 44 | 112.6 Ų | 112.6 | 45% | 0.454 | 70% | 0.702 | S | S | . | * | P | Polyproline II helix | trans | -55.7 | 159.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | P154 | P154-G156 PolarHBondContact O-N 3.42Š|
| 157 | L | 46.5 | Very low | 50.4 | Low | 167 Ų | 167 | 114.3 Ų | 114.3 | 87% | 0.874 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 139.4 | 174.2 | -72.9 | 163.3 | 0 | 0 | 0 | 109.6 | G159 | L157-G159 PolarHBondContact O-N 3.46Š|
| 158 | P | 50.2 | Low | 49.8 | Very low | 124 Ų | 124 | 115.6 Ų | 115.6 | 81% | 0.805 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 132.5 | 173.7 | -26 | 33.8 | 0 | 0 | 0 | 110.1 | | |
| 159 | G | 44.5 | Very low | 49.3 | Very low | 59 Ų | 59 | 114.7 Ų | 114.7 | 61% | 0.608 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -57 | 156.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | L157 | L157-G159 PolarHBondContact O-N 3.46Š|
| 160 | P | 49 | Very low | 49 | Very low | 125 Ų | 125 | 116.9 Ų | 116.9 | 81% | 0.812 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 145.6 | 175.9 | 24.6 | -33.3 | 0 | 0 | 0 | 110.1 | G162 | P160-G162 PolarHBondContact O-N 2.67Š|
| 161 | P | 52.8 | Low | 49.1 | Very low | 127 Ų | 127 | 114.9 Ų | 114.9 | 83% | 0.825 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 136.7 | 172.3 | -25.3 | 33.4 | 0 | 0 | 0 | 110.1 | | |
| 162 | G | 48.8 | Very low | 48.8 | Very low | 61 Ų | 61 | 113.4 Ų | 113.4 | 63% | 0.629 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 154.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111 | P160 L164 | P160-G162 PolarHBondContact O-N 2.67Å; G162-L164 PolarHBondContact O-N 3.02Å |
| 163 | P | 50.8 | Low | 49.2 | Very low | 131 Ų | 131 | 109.4 Ų | 109.4 | 85% | 0.851 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 140.5 | 176.4 | 23.5 | -32.6 | 0 | 0 | 0 | 109.7 | G165 | P163-G165 PolarHBondContact O-N 3.44Š|
| 164 | L | 48.8 | Very low | 49.7 | Very low | 176 Ų | 176 | 109.9 Ų | 109.9 | 92% | 0.921 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 126.8 | 170.6 | -77.6 | 154.1 | 0 | 0 | 0 | 108 | G162 L166 | G162-L164 PolarHBondContact O-N 3.02Å; L164-L166 PolarHBondContact O-N 3.28Å |
| 165 | G | 47.4 | Very low | 50 | Low | 69 Ų | 69 | 113.8 Ų | 113.8 | 71% | 0.711 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 142.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | P163 S167 | P163-G165 PolarHBondContact O-N 3.44Å; G165-S167 PolarHBondContact O-N 2.85Å |
| 166 | L | 46 | Very low | 51 | Low | 176 Ų | 176 | 115 Ų | 115 | 92% | 0.921 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 128.1 | 176.4 | -68.5 | 168.1 | 0 | 0 | 0 | 108.6 | L164 G168 | L164-L166 PolarHBondContact O-N 3.28Å; L166-G168 PolarHBondContact O-N 2.95Å |
| 167 | S | 53.5 | Low | 51.6 | Low | 107 Ų | 107 | 116.4 Ų | 116.4 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -51 | 127.1 | 170.6 | 40.5 | 0 | 0 | 0 | 0 | 108 | G165 | G165-S167 PolarHBondContact O-N 2.85Š|
| 168 | G | 50.8 | Low | 52.2 | Low | 54 Ų | 54 | 118.4 Ų | 118.4 | 56% | 0.557 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 150.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | L166 H170 | L166-G168 PolarHBondContact O-N 2.95Å; G168-H170 PolarHBondContact O-N 3.07Å |
| 169 | P | 50.3 | Low | 52.8 | Low | 130 Ų | 130 | 117.1 Ų | 117.1 | 84% | 0.844 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 134.9 | 178.8 | 23.1 | -32.8 | 0 | 0 | 0 | 109.2 | G171 | P169-G171 PolarHBondContact O-N 3.02Š|
| 170 | H | 52 | Low | 53.1 | Low | 181 Ų | 181 | 117.5 Ų | 117.5 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 128.6 | 171 | -64 | -60.7 | 0 | 0 | 0 | 108 | G168 | G168-H170 PolarHBondContact O-N 3.07Š|
| 171 | G | 50.9 | Low | 53.5 | Low | 58 Ų | 58 | 123.4 Ų | 123.4 | 60% | 0.598 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 149.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | P169 | P169-G171 PolarHBondContact O-N 3.02Š|
| 172 | P | 46.7 | Very low | 53.8 | Low | 120 Ų | 120 | 124.8 Ų | 124.8 | 78% | 0.779 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -52 | 140.2 | 179.7 | 22.6 | -32.9 | 0 | 0 | 0 | 109.6 | G174 | P172-G174 PolarHBondContact O-N 3.02Š|
| 173 | P | 59.7 | Low | 53.5 | Low | 125 Ų | 125 | 125.1 Ų | 125.1 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -49 | 135.6 | 174.3 | -24.6 | 32.2 | 0 | 0 | 0 | 109.8 | Q175 | P173-Q175 PolarHBondContact O-N 2.91Š|
| 174 | G | 54.9 | Low | 53.4 | Low | 69 Ų | 69 | 128 Ų | 128 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 140.3 | 173 | 0 | 0 | 0 | 0 | 0 | 109.7 | P172 | P172-G174 PolarHBondContact O-N 3.02Š|
| 175 | Q | 54.6 | Low | 53.2 | Low | 187 Ų | 187 | 127.4 Ų | 127.4 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 135.5 | 176.5 | -72.3 | -179.9 | 6.2 | 0 | 0 | 109.3 | P173 G177 | P173-Q175 PolarHBondContact O-N 2.91Å; Q175-G177 PolarHBondContact O-N 3.36Å |
| 176 | P | 67.7 | Low | 53 | Low | 125 Ų | 125 | 130.8 Ų | 130.8 | 81% | 0.812 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 137.5 | 171.6 | -24.7 | 33.1 | 0 | 0 | 0 | 110.2 | | |
| 177 | G | 56.9 | Low | 53.1 | Low | 74 Ų | 74 | 133.8 Ų | 133.8 | 76% | 0.763 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 142.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110 | Q175 A179 | Q175-G177 PolarHBondContact O-N 3.36Å; G177-A179 PolarHBondContact O-N 3.19Å |
| 178 | K | 59.9 | Low | 52.4 | Low | 209 Ų | 209 | 133.1 Ų | 133.1 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 139.8 | 172.5 | -65.3 | -177.7 | 179.3 | -176.6 | 0 | 108.8 | G180 | K178-G180 PolarHBondContact O-N 3.25Š|
| 179 | A | 63.6 | Low | 52.1 | Low | 97 Ų | 97 | 139.6 Ų | 139.6 | 80% | 0.802 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 138.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | G177 | G177-A179 PolarHBondContact O-N 3.19Š|
| 180 | G | 50.1 | Low | 52 | Low | 66 Ų | 66 | 140.9 Ų | 140.9 | 68% | 0.68 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 146.6 | 171 | 0 | 0 | 0 | 0 | 0 | 109.5 | K178 D182 | K178-G180 PolarHBondContact O-N 3.25Å; G180-D182 PolarHBondContact O-N 2.68Å |
| 181 | R | 56.5 | Low | 51.7 | Low | 249 Ų | 249 | 140.1 Ų | 140.1 | 94% | 0.94 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 138.4 | 170.4 | -64.1 | -178.1 | -175.1 | -172.3 | 0.7 | 108.2 | G183 | R181-G183 PolarHBondContact O-N 3.34Š|
| 182 | D | 60.4 | Low | 51.3 | Low | 156 Ų | 156 | 143.5 Ų | 143.5 | 83% | 0.834 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 130.7 | 170.8 | -39.6 | -30.3 | 0 | 0 | 0 | 108.2 | G180 E184 | G180-D182 PolarHBondContact O-N 2.68Å; D182-E184 PolarHBondContact O-N 3.31Å |
| 183 | G | 41.7 | Very low | 51.1 | Low | 69 Ų | 69 | 147.3 Ų | 147.3 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 126.1 | 178 | 0 | 0 | 0 | 0 | 0 | 109.3 | R181 D185 | R181-G183 PolarHBondContact O-N 3.34Å; G183-D185 PolarHBondContact O-N 3.03Å |
| 184 | E | 49.2 | Very low | 50.3 | Low | 192 Ų | 192 | 151.6 Ų | 151.6 | 90% | 0.897 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 135 | 169 | -79.4 | -166.8 | 120.7 | 0 | 0 | 109.8 | D182 V186 | D182-E184 PolarHBondContact O-N 3.31Å; E184-V186 PolarHBondContact O-N 3.3Å |
| 185 | D | 43.5 | Very low | 49.9 | Very low | 162 Ų | 162 | 154.7 Ų | 154.7 | 87% | 0.866 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 119.5 | 176 | -64.3 | -40.3 | 0 | 0 | 0 | 110 | G183 R187 | G183-D185 PolarHBondContact O-N 3.03Å; D185-R187 PolarHBondContact O-N 2.85Å |
| 186 | V | 42.9 | Very low | 49.2 | Very low | 140 Ų | 140 | 151.9 Ų | 151.9 | 85% | 0.848 | 83% | 0.825 | S | S | * | * | | | trans | -66.8 | 107.7 | 177.1 | -177.3 | 0 | 0 | 0 | 0 | 108.8 | E184 A188 | E184-V186 PolarHBondContact O-N 3.3Å; V186-A188 PolarHBondContact O-N 2.95Å |
| 187 | R | 48.8 | Very low | 48.7 | Very low | 239 Ų | 239 | 153.3 Ų | 153.3 | 90% | 0.902 | 82% | 0.824 | S | S | * | * | | | trans | -71.6 | 119.3 | 167.1 | -165.2 | 172.8 | 179.9 | 160.2 | -1.3 | 108.5 | D185 E189 | D185-R187 PolarHBondContact O-N 2.85Å; R187-E189 PolarHBondContact O-N 3.48Å |
| 188 | A | 38.3 | Very low | 48.5 | Very low | 94 Ų | 94 | 158.9 Ų | 158.9 | 78% | 0.777 | 83% | 0.827 | S | S | * | * | | | trans | -67.5 | 111.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | V186 | V186-A188 PolarHBondContact O-N 2.95Š|
| 189 | E | 45.8 | Very low | 47.5 | Very low | 190 Ų | 190 | 154.4 Ų | 154.4 | 89% | 0.888 | 82% | 0.821 | S | S | * | * | | | trans | -114.7 | 102.8 | 166.1 | -147 | 163.6 | -157.6 | 0 | 0 | 107.6 | R187 | R187-E189 PolarHBondContact O-N 3.48Š|
| 190 | L | 47.1 | Very low | 46.9 | Very low | 156 Ų | 156 | 154.9 Ų | 154.9 | 82% | 0.817 | 82% | 0.816 | S | S | * | * | | | trans | -60.3 | 131.9 | 165.9 | -112.9 | 79.9 | 0 | 0 | 0 | 107.6 | | |
| 191 | M | 45.6 | Very low | 46.8 | Very low | 166 Ų | 166 | 157.8 Ų | 157.8 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | | | | 175.1 | 125.6 | 129.8 | -80.8 | -108.4 | 165.1 | 0 | 0 | 112.6 | | |
| 192 | T | 44.3 | Very low | 46.2 | Very low | 129 Ų | 129 | 152 Ų | 152 | 79% | 0.791 | 82% | 0.817 | S | S | * | * | | | trans | 72.3 | 85.1 | 144 | 58.8 | 0 | 0 | 0 | 0 | 121.5 | | |
| 193 | F | 41.6 | Very low | 45.6 | Very low | 199 Ų | 199 | 148.3 Ų | 148.3 | 87% | 0.873 | 82% | 0.816 | S | S | * | * | | | | 15.7 | 112.7 | 120.7 | -132.2 | -94.1 | 0 | 0 | 0 | 118.8 | | |
| 194 | R | 42.1 | Very low | 45.9 | Very low | 216 Ų | 216 | 150.1 Ų | 150.1 | 82% | 0.815 | 82% | 0.824 | S | S | * | * | | | | -176.6 | 129.7 | 116.5 | -102.7 | -176.8 | -179.7 | 161.7 | 0.8 | 113.4 | | |
| 195 | D | 48.1 | Very low | 45.8 | Very low | 133 Ų | 133 | 143.9 Ų | 143.9 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | | | trans | 77.2 | 97 | 148.5 | -48.5 | -28.6 | 0 | 0 | 0 | 120.4 | | |
| 196 | C | 39.3 | Very low | 46.7 | Very low | 128 Ų | 128 | 142.1 Ų | 142.1 | 87% | 0.865 | 81% | 0.809 | S | S | * | * | | | trans | -67.5 | 124.5 | 159.1 | -64.6 | 0 | 0 | 0 | 0 | 111.3 | | |
| 197 | I | 57.6 | Low | 47.7 | Very low | 155 Ų | 155 | 141.5 Ų | 141.5 | 80% | 0.795 | 81% | 0.807 | S | S | * | * | | | trans | -101.3 | 111.7 | 159.1 | -65 | 174.4 | 0 | 0 | 0 | 107.9 | | |
| 198 | K | 51 | Low | 47.9 | Very low | 192 Ų | 192 | 133.1 Ų | 133.1 | 84% | 0.835 | 80% | 0.796 | S | S | * | * | | | trans | -83.9 | 121.1 | 164 | -73.7 | 177.7 | -178.7 | 176.5 | 0 | 108.2 | P200 | K198-P200 WeakPolarHBondContact O-CD 3.29Š|
| 199 | C | 39.6 | Very low | 49.1 | Very low | 115 Ų | 115 | 134.7 Ų | 134.7 | 78% | 0.777 | 80% | 0.798 | S | S | * | * | | | trans | -102.3 | 107 | 159 | -78.9 | 0 | 0 | 0 | 0 | 109.1 | | |
| 200 | P | 52.1 | Low | 49.9 | Very low | 107 Ų | 107 | 131.9 Ų | 131.9 | 70% | 0.695 | 80% | 0.796 | S | S | * | * | | | trans | -82.2 | 129.8 | 161.9 | 32.3 | -25.1 | 0 | 0 | 0 | 108 | K198 | K198-P200 WeakPolarHBondContact O-CD 3.29Š|
| 201 | T | 46.9 | Very low | 49.7 | Very low | 127 Ų | 127 | 128.2 Ų | 128.2 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | | | trans | 70.9 | 112.5 | -177.4 | 72.4 | 0 | 0 | 0 | 0 | 112.8 | | |
| 202 | C | 43.3 | Very low | 50.1 | Low | 128 Ų | 128 | 125.5 Ų | 125.5 | 87% | 0.865 | 80% | 0.8 | S | S | * | * | | | | -178.8 | 121.5 | 98.4 | -71.7 | 0 | 0 | 0 | 0 | 104.7 | | |
| 203 | G | 48 | Very low | 50.4 | Low | 78 Ų | 78 | 128.7 Ų | 128.7 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | | | | 121.9 | 114.9 | 77.5 | 0 | 0 | 0 | 0 | 0 | 107.2 | | |
| 204 | A | 48.6 | Very low | 50.3 | Low | 106 Ų | 106 | 123 Ų | 123 | 88% | 0.876 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 136.6 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 205 | G | 47.6 | Very low | 50.4 | Low | 62 Ų | 62 | 116.9 Ų | 116.9 | 64% | 0.639 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68 | 149.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 206 | P | 62.1 | Low | 50.5 | Low | 125 Ų | 125 | 118.6 Ų | 118.6 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -66 | 140.2 | -178.4 | 26.6 | -33.5 | 0 | 0 | 0 | 111.7 | | |
| 207 | P | 63.4 | Low | 50.7 | Low | 126 Ų | 126 | 122.1 Ų | 122.1 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 138.7 | 169.8 | -22.7 | 33.5 | 0 | 0 | 0 | 111.8 | | |
| 208 | G | 52.8 | Low | 50.1 | Low | 64 Ų | 64 | 123.8 Ų | 123.8 | 66% | 0.66 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 156.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 209 | P | 65.1 | Low | 49.5 | Very low | 127 Ų | 127 | 120.5 Ų | 120.5 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 141.7 | -175.2 | 26.4 | -34.2 | 0 | 0 | 0 | 112.5 | G211 | P209-G211 PolarHBondContact O-N 2.88Š|
| 210 | P | 62.2 | Low | 49.7 | Very low | 131 Ų | 131 | 121.9 Ų | 121.9 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 132.1 | 172.4 | -22.4 | 33.4 | 0 | 0 | 0 | 112.4 | | |
| 211 | G | 43.1 | Very low | 49.2 | Very low | 79 Ų | 79 | 126 Ų | 126 | 81% | 0.814 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 140.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | P209 | P209-G211 PolarHBondContact O-N 2.88Š|
| 212 | A | 54.2 | Low | 48.5 | Very low | 108 Ų | 108 | 125.3 Ų | 125.3 | 89% | 0.893 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 140.9 | -169 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 213 | E | 49.7 | Very low | 48.2 | Very low | 196 Ų | 196 | 129.2 Ų | 129.2 | 92% | 0.916 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 131.5 | 175.7 | -165.8 | 172.5 | -179.7 | 0 | 0 | 111.1 | | |
| 214 | G | 39.1 | Very low | 48.1 | Very low | 79 Ų | 79 | 131.1 Ų | 131.1 | 81% | 0.814 | 80% | 0.796 | S | S | * | * | | | trans | -102.3 | 100.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 215 | A | 45.4 | Very low | 47.2 | Very low | 88 Ų | 88 | 132.8 Ų | 132.8 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | | | trans | -52.1 | 131.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 216 | E | 48.8 | Very low | 46.6 | Very low | 170 Ų | 170 | 133.1 Ų | 133.1 | 79% | 0.794 | 80% | 0.803 | S | S | * | * | | | | 93.9 | 131 | 75.8 | -157.1 | -168.6 | -178.4 | 0 | 0 | 112.7 | | |
| 217 | K | 45 | Very low | 45.5 | Very low | 202 Ų | 202 | 134.4 Ų | 134.4 | 88% | 0.878 | 81% | 0.808 | S | S | * | * | | | trans | -171.3 | 106.7 | 134.4 | -101 | 166.2 | -166.4 | -175.5 | 0 | 113 | | |
| 218 | K | 43.3 | Very low | 44.3 | Very low | 189 Ų | 189 | 137.6 Ų | 137.6 | 82% | 0.822 | 81% | 0.812 | S | S | * | * | | | | 85.1 | 97.8 | 122.9 | -148.4 | 167.4 | -174.4 | 176.5 | 0 | 120.6 | | |
| 219 | T | 40.3 | Very low | 43.9 | Very low | 124 Ų | 124 | 137.7 Ų | 137.7 | 76% | 0.761 | 81% | 0.813 | S | S | * | * | | | trans | -48.4 | 153.4 | 154.7 | 4.2 | 0 | 0 | 0 | 0 | 115.7 | | |
| 220 | L | 42 | Very low | 42.9 | Very low | 144 Ų | 144 | 140 Ų | 140 | 75% | 0.754 | 82% | 0.817 | S | S | * | * | | | | 154.3 | 114.1 | 101.4 | -162.5 | 87.6 | 0 | 0 | 0 | 112.8 | | |
| 221 | Y | 41.6 | Very low | 42.2 | Very low | 193 Ų | 193 | 138.5 Ų | 138.5 | 76% | 0.757 | 82% | 0.816 | S | S | * | * | | | | -159.8 | 114.6 | 128.5 | -153.6 | -101.7 | 0 | 0 | 0 | 110 | R223 | Y221-R223 PolarHBondContact OH-NH2 3.34Š|
| 222 | V | 32.4 | Very low | 42.2 | Very low | 112 Ų | 112 | 138.2 Ų | 138.2 | 68% | 0.679 | 81% | 0.813 | S | S | * | * | | | trans | -86.6 | 142.3 | -177.9 | 165.6 | 0 | 0 | 0 | 0 | 110.1 | | |
| 223 | R | 37.8 | Very low | 41.9 | Very low | 210 Ų | 210 | 137.5 Ų | 137.5 | 79% | 0.792 | 81% | 0.807 | S | S | * | * | | | trans | -155.4 | 118.9 | 141.8 | -110.1 | 178.8 | -120.2 | -152.8 | 3.1 | 111.8 | Y221 | Y221-R223 PolarHBondContact OH-NH2 3.34Š|
| 224 | S | 45.9 | Very low | 42.2 | Very low | 119 Ų | 119 | 133.2 Ų | 133.2 | 83% | 0.832 | 80% | 0.797 | S | S | * | * | | | trans | 84.8 | 112.5 | 158.6 | -146.4 | 0 | 0 | 0 | 0 | 118.5 | | |
| 225 | C | 29.1 | Very low | 42.5 | Very low | 140 Ų | 140 | 131.8 Ų | 131.8 | 95% | 0.946 | 78% | 0.782 | S | S | * | * | | | trans | -54.5 | 125.3 | 179.9 | -69.6 | 0 | 0 | 0 | 0 | 113.9 | | |
| 226 | G | 36.2 | Very low | 42.8 | Very low | 69 Ų | 69 | 138.1 Ų | 138.1 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | | | trans | -116.7 | 132.8 | 154.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | Q228 | G226-Q228 PolarHBondContact O-N 2.89Š|
| 227 | V | 39 | Very low | 43.5 | Very low | 152 Ų | 152 | 135.7 Ų | 135.7 | 92% | 0.921 | 79% | 0.786 | S | S | * | * | | | trans | -43.3 | 122.4 | 178.9 | -80 | 0 | 0 | 0 | 0 | 112.1 | G229 | V227-G229 PolarHBondContact O-N 3.06Š|
| 228 | Q | 38.2 | Very low | 43.4 | Very low | 194 Ų | 194 | 129.5 Ų | 129.5 | 91% | 0.907 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 118.1 | 175.5 | -167 | 172.1 | 13.7 | 0 | 0 | 108.5 | G226 | G226-Q228 PolarHBondContact O-N 2.89Š|
| 229 | G | 44.3 | Very low | 43.5 | Very low | 66 Ų | 66 | 130.7 Ų | 130.7 | 68% | 0.68 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 139.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | V227 | V227-G229 PolarHBondContact O-N 3.06Š|
| 230 | L | 42.9 | Very low | 44.3 | Very low | 175 Ų | 175 | 133.8 Ų | 133.8 | 92% | 0.916 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 137.4 | 172.8 | -75.3 | 146.8 | 0 | 0 | 0 | 110.2 | G232 | L230-G232 PolarHBondContact O-N 3.25Š|
| 231 | A | 47.5 | Very low | 44.3 | Very low | 99 Ų | 99 | 130.3 Ų | 130.3 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 134 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 232 | G | 42.7 | Very low | 44.6 | Very low | 73 Ų | 73 | 126.6 Ų | 126.6 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 143.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | L230 | L230-G232 PolarHBondContact O-N 3.25Š|
| 233 | A | 47.9 | Very low | 46 | Very low | 94 Ų | 94 | 128.6 Ų | 128.6 | 78% | 0.777 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 143.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | G235 | A233-G235 PolarHBondContact O-N 2.93Š|
| 234 | P | 57.5 | Low | 46.3 | Very low | 106 Ų | 106 | 122.1 Ų | 122.1 | 69% | 0.688 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 134.1 | 174.4 | -22.8 | 31.6 | 0 | 0 | 0 | 110.7 | R323 | P234-R323 VanDerWaalsContact C-NH2 3.33Š|
| 235 | G | 44.3 | Very low | 46.5 | Very low | 49 Ų | 49 | 124.5 Ų | 124.5 | 51% | 0.505 | 80% | 0.795 | S | S | . | * | P | Polyproline II helix | trans | -54.5 | 143.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A233 R323 | A233-G235 PolarHBondContact O-N 2.93Å; G235-R323 PolarHBondContact O-NH2 3.47Å |
| 236 | R | 52.1 | Low | 48.3 | Very low | 221 Ų | 221 | 123.5 Ų | 123.5 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 146.8 | 179.1 | -68.3 | -177.4 | 177.6 | -153 | -1.2 | 110.9 | | |
| 237 | P | 63.7 | Low | 49.1 | Very low | 119 Ų | 119 | 123.8 Ų | 123.8 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 144.9 | 167.8 | -24.3 | 33.9 | 0 | 0 | 0 | 110.9 | | |
| 238 | G | 43.3 | Very low | 49.8 | Very low | 71 Ų | 71 | 122.9 Ų | 122.9 | 73% | 0.732 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 146.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 239 | Y | 45.7 | Very low | 51.4 | Low | 214 Ų | 214 | 119.4 Ų | 119.4 | 84% | 0.839 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 143.1 | 173.3 | -66.6 | -79.2 | 0 | 0 | 0 | 110.1 | | |
| 240 | H | 56.8 | Low | 52.1 | Low | 189 Ų | 189 | 119.2 Ų | 119.2 | 88% | 0.875 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 141.4 | 168 | -66.3 | -90.5 | 0 | 0 | 0 | 109.3 | S242 | H240-S242 PolarHBondContact O-N 3.32Š|
| 241 | G | 41.5 | Very low | 53.1 | Low | 71 Ų | 71 | 116.7 Ų | 116.7 | 73% | 0.732 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 131.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 242 | S | 47.9 | Very low | 54 | Low | 116 Ų | 116 | 118 Ų | 118 | 81% | 0.811 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 136.5 | 172.6 | 46.9 | 0 | 0 | 0 | 0 | 109.6 | H240 G244 | H240-S242 PolarHBondContact O-N 3.32Å; S242-G244 PolarHBondContact O-N 3.28Å |
| 243 | N | 61.9 | Low | 54.8 | Low | 154 Ų | 154 | 117.9 Ų | 117.9 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 140.6 | 169.2 | -65.7 | -13.2 | 0 | 0 | 0 | 109.4 | L245 | N243-L245 PolarHBondContact O-N 2.98Š|
| 244 | G | 43.9 | Very low | 55.3 | Low | 74 Ų | 74 | 121.6 Ų | 121.6 | 76% | 0.763 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 139.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | S242 | S242-G244 PolarHBondContact O-N 3.28Š|
| 245 | L | 49.4 | Very low | 55.8 | Low | 169 Ų | 169 | 122.4 Ų | 122.4 | 89% | 0.885 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 139.8 | 173.8 | -76.1 | 146.5 | 0 | 0 | 0 | 109.5 | N243 | N243-L245 PolarHBondContact O-N 2.98Š|
| 246 | P | 67.6 | Low | 56.7 | Low | 118 Ų | 118 | 123.2 Ų | 123.2 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 143 | 168.5 | -23 | 32.9 | 0 | 0 | 0 | 110.7 | | |
| 247 | G | 52.2 | Low | 57.5 | Low | 75 Ų | 75 | 119 Ų | 119 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 143.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 248 | T | 54.5 | Low | 57.7 | Low | 133 Ų | 133 | 119.3 Ų | 119.3 | 82% | 0.816 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 138.7 | 176.2 | 49.7 | 0 | 0 | 0 | 0 | 110.2 | | |
| 249 | P | 70.9 | Confident | 58.6 | Low | 121 Ų | 121 | 119 Ų | 119 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 145.3 | 169.8 | -24.5 | 33.7 | 0 | 0 | 0 | 111.3 | | |
| 250 | G | 60.2 | Low | 59.9 | Low | 62 Ų | 62 | 115.3 Ų | 115.3 | 64% | 0.639 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 158.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 251 | P | 63.1 | Low | 60.4 | Low | 122 Ų | 122 | 114.4 Ų | 114.4 | 79% | 0.792 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 148 | 177.3 | 26.9 | -34.2 | 0 | 0 | 0 | 111.4 | | |
| 252 | P | 67.6 | Low | 61.3 | Low | 126 Ų | 126 | 113.8 Ų | 113.8 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 148.2 | 171.8 | -22.4 | 32.8 | 0 | 0 | 0 | 112 | | |
| 253 | G | 59.3 | Low | 62.6 | Low | 72 Ų | 72 | 114.1 Ų | 114.1 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 156.3 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 254 | L | 58.8 | Low | 63.2 | Low | 172 Ų | 172 | 113.1 Ų | 113.1 | 90% | 0.901 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 145 | 176.2 | -70.2 | 164.8 | 0 | 0 | 0 | 111.4 | | |
| 255 | P | 67.2 | Low | 64.3 | Low | 123 Ų | 123 | 112.7 Ų | 112.7 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 141.8 | 173 | -22.5 | 32.7 | 0 | 0 | 0 | 112.2 | | |
| 256 | G | 62.3 | Low | 65.5 | Low | 65 Ų | 65 | 111 Ų | 111 | 67% | 0.67 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 161.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 257 | P | 69.3 | Low | 66 | Low | 134 Ų | 134 | 115.3 Ų | 115.3 | 87% | 0.87 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 150.3 | 176.8 | 26.9 | -34.5 | 0 | 0 | 0 | 112.4 | | |
| 258 | S | 69.3 | Low | 66.7 | Low | 124 Ų | 124 | 114.5 Ų | 114.5 | 87% | 0.867 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 140.8 | 176.5 | -55.1 | 0 | 0 | 0 | 0 | 112.3 | | |
| 259 | G | 60.8 | Low | 67.6 | Low | 65 Ų | 65 | 114.5 Ų | 114.5 | 67% | 0.67 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 164.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 260 | P | 73.1 | Confident | 67.5 | Low | 137 Ų | 137 | 113.6 Ų | 113.6 | 89% | 0.89 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 156.5 | 178.4 | 28.9 | -34.8 | 0 | 0 | 0 | 113.5 | | |
| 261 | I | 67.9 | Low | 67.4 | Low | 170 Ų | 170 | 114.2 Ų | 114.2 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -69 | 133.4 | 176.8 | -65.5 | 169.4 | 0 | 0 | 0 | 110.8 | | |
| 262 | G | 60.3 | Low | 67.4 | Low | 58 Ų | 58 | 113.2 Ų | 113.2 | 60% | 0.598 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 158.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 263 | P | 74.3 | Confident | 66.8 | Low | 123 Ų | 123 | 112.8 Ų | 112.8 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 159.5 | -179.4 | 29.1 | -35.3 | 0 | 0 | 0 | 113.6 | | |
| 264 | P | 75.9 | Confident | 66.3 | Low | 132 Ų | 132 | 115.5 Ų | 115.5 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -60 | 146 | 176.8 | -22.8 | 33.3 | 0 | 0 | 0 | 114.3 | | |
| 265 | G | 65.6 | Low | 65.9 | Low | 66 Ų | 66 | 116.7 Ų | 116.7 | 68% | 0.68 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 159 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 266 | P | 75.5 | Confident | 65 | Low | 134 Ų | 134 | 118.4 Ų | 118.4 | 87% | 0.87 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 154.3 | 178.6 | 29 | -34.7 | 0 | 0 | 0 | 112.4 | | |
| 267 | K | 77.8 | Confident | 64.3 | Low | 207 Ų | 207 | 124.1 Ų | 124.1 | 90% | 0.9 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 137.4 | 177.3 | -172.6 | 178.4 | 179.5 | -178.7 | 0 | 111.2 | | |
| 268 | G | 66.5 | Low | 63.1 | Low | 58 Ų | 58 | 124.5 Ų | 124.5 | 60% | 0.598 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 155.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 269 | P | 73.4 | Confident | 61.9 | Low | 133 Ų | 133 | 127.9 Ų | 127.9 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 153.7 | -179.2 | 27.9 | -34.3 | 0 | 0 | 0 | 112.3 | | |
| 270 | A | 70.3 | Confident | 61.9 | Low | 102 Ų | 102 | 130.6 Ų | 130.6 | 84% | 0.843 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 141.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 271 | G | 57.5 | Low | 60.7 | Low | 75 Ų | 75 | 134 Ų | 134 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 133.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 272 | A | 62.6 | Low | 59.9 | Low | 102 Ų | 102 | 129.2 Ų | 129.2 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 133.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 273 | P | 54.4 | Low | 59.6 | Low | 116 Ų | 116 | 131.3 Ų | 131.3 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 118.6 | 177.3 | 33.2 | -28.2 | 0 | 0 | 0 | 111.9 | | |
| 274 | T | 49.9 | Very low | 58.7 | Low | 130 Ų | 130 | 135.3 Ų | 135.3 | 80% | 0.798 | 82% | 0.816 | S | S | * | * | | | trans | -149.2 | 113.6 | 158.3 | 53.1 | 0 | 0 | 0 | 0 | 115.3 | | |
| 275 | K | 50.8 | Low | 57.5 | Low | 196 Ų | 196 | 132.4 Ų | 132.4 | 85% | 0.852 | 81% | 0.81 | S | S | * | * | | | trans | 63 | 128.1 | 135.5 | -62 | -176 | 177.1 | -178.3 | 0 | 119.9 | | |
| 276 | I | 47.2 | Very low | 56.7 | Low | 159 Ų | 159 | 137.6 Ų | 137.6 | 82% | 0.815 | 82% | 0.821 | S | S | * | * | | | trans | 97.8 | 108.4 | 154.4 | -37.7 | -177.3 | 0 | 0 | 0 | 117.1 | | |
| 277 | K | 47.4 | Very low | 55.8 | Low | 186 Ų | 186 | 138 Ų | 138 | 81% | 0.809 | 82% | 0.821 | S | S | * | * | | | trans | 55.2 | 87.9 | 157 | -72.2 | 179.4 | 175.2 | -178.6 | 0 | 119.6 | | |
| 278 | V | 44.7 | Very low | 54.4 | Low | 141 Ų | 141 | 130.8 Ų | 130.8 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | | | trans | 37.6 | 89.6 | 137.9 | -164.1 | 0 | 0 | 0 | 0 | 117.1 | | |
| 279 | F | 43.9 | Very low | 53.9 | Low | 195 Ų | 195 | 134.2 Ų | 134.2 | 86% | 0.855 | 82% | 0.818 | S | S | * | * | | | trans | -127.4 | 149.4 | 141.1 | -81.7 | -87.1 | 0 | 0 | 0 | 108 | | |
| 280 | P | 60.3 | Low | 53.2 | Low | 122 Ų | 122 | 136.8 Ų | 136.8 | 79% | 0.792 | 82% | 0.819 | S | S | * | * | | | trans | -63.1 | 141.2 | -170.2 | 22.6 | -31.4 | 0 | 0 | 0 | 113.3 | G282 | P280-G282 PolarHBondContact O-N 3.45Š|
| 281 | K | 49.5 | Very low | 52 | Low | 208 Ų | 208 | 134.5 Ų | 134.5 | 90% | 0.904 | 81% | 0.805 | S | S | * | * | | | trans | -43.2 | 115.9 | -178.9 | -175 | 178 | -178.1 | 177.4 | 0 | 113.4 | | |
| 282 | G | 49.8 | Very low | 51.8 | Low | 70 Ų | 70 | 136.7 Ų | 136.7 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 145.1 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | P280 | P280-G282 PolarHBondContact O-N 3.45Š|
| 283 | A | 53.4 | Low | 51.4 | Low | 103 Ų | 103 | 137.7 Ų | 137.7 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 155.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | | |
| 284 | K | 56.2 | Low | 50.9 | Low | 206 Ų | 206 | 135.7 Ų | 135.7 | 90% | 0.896 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 131.4 | 178.8 | -167.3 | 178.7 | -177.6 | -176.6 | 0 | 110.7 | | |
| 285 | G | 49.8 | Very low | 51 | Low | 72 Ų | 72 | 137.4 Ų | 137.4 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 145.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 286 | L | 49.9 | Very low | 51 | Low | 175 Ų | 175 | 136.7 Ų | 136.7 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 145.3 | 177.7 | -67.9 | 164.2 | 0 | 0 | 0 | 111.4 | G288 | L286-G288 PolarHBondContact O-N 3.48Š|
| 287 | T | 56.7 | Low | 50.8 | Low | 141 Ų | 141 | 131.5 Ų | 131.5 | 87% | 0.865 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 132 | 170.3 | -52.2 | 0 | 0 | 0 | 0 | 109.6 | | |
| 288 | G | 48.8 | Very low | 51.1 | Low | 57 Ų | 57 | 129 Ų | 129 | 59% | 0.588 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 156.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L286 | L286-G288 PolarHBondContact O-N 3.48Š|
| 289 | P | 55.8 | Low | 51.1 | Low | 130 Ų | 130 | 127.1 Ų | 127.1 | 84% | 0.844 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -61 | 155 | 178.2 | 27.1 | -34.5 | 0 | 0 | 0 | 111.9 | G291 | P289-G291 PolarHBondContact O-N 2.95Š|
| 290 | Q | 57.6 | Low | 50.9 | Low | 187 Ų | 187 | 121 Ų | 121 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -56 | 136.6 | 171.4 | -174 | 175.5 | 9.8 | 0 | 0 | 109.9 | | |
| 291 | G | 45.8 | Very low | 50.2 | Low | 54 Ų | 54 | 125.2 Ų | 125.2 | 56% | 0.557 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 155 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | P289 | P289-G291 PolarHBondContact O-N 2.95Š|
| 292 | P | 52.9 | Low | 50.2 | Low | 121 Ų | 121 | 122.7 Ų | 122.7 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 154 | 177.7 | 26.1 | -34 | 0 | 0 | 0 | 111.4 | | |
| 293 | P | 55.4 | Low | 49.8 | Very low | 123 Ų | 123 | 123.6 Ų | 123.6 | 80% | 0.799 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 143.4 | 169.7 | -23.5 | 33.3 | 0 | 0 | 0 | 111 | | |
| 294 | G | 43.8 | Very low | 49.3 | Very low | 73 Ų | 73 | 123.3 Ų | 123.3 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 151.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 295 | D | 50.9 | Low | 48.9 | Very low | 167 Ų | 167 | 121 Ų | 121 | 89% | 0.893 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 140.9 | 178.7 | -65.3 | -40.3 | 0 | 0 | 0 | 111.3 | G297 | D295-G297 PolarHBondContact O-N 3.32Š|
| 296 | Q | 50.8 | Low | 48.5 | Very low | 180 Ų | 180 | 120.7 Ų | 120.7 | 84% | 0.841 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 130.3 | 174.1 | -173.2 | 177.6 | -31.6 | 0 | 0 | 109.1 | | |
| 297 | G | 42.9 | Very low | 48 | Very low | 51 Ų | 51 | 119 Ų | 119 | 53% | 0.526 | 77% | 0.774 | S | S | . | * | P | Polyproline II helix | trans | -54.9 | 149.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | D295 S299 | D295-G297 PolarHBondContact O-N 3.32Å; G297-S299 PolarHBondContact O-N 3.38Å |
| 298 | P | 53.6 | Low | 47.6 | Very low | 132 Ų | 132 | 118.6 Ų | 118.6 | 86% | 0.857 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 141.2 | 179.5 | 24.8 | -33.9 | 0 | 0 | 0 | 110.2 | G300 | P298-G300 PolarHBondContact O-N 2.93Š|
| 299 | S | 44.5 | Very low | 47.4 | Very low | 103 Ų | 103 | 118.3 Ų | 118.3 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 138.7 | 172.6 | -71.3 | 0 | 0 | 0 | 0 | 110.1 | G297 K301 | G297-S299 PolarHBondContact O-N 3.38Å; S299-K301 PolarHBondContact O-N 3.22Å |
| 300 | G | 41 | Very low | 47.2 | Very low | 67 Ų | 67 | 118.5 Ų | 118.5 | 69% | 0.691 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -52 | 135.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | P298 D302 | P298-G300 PolarHBondContact O-N 2.93Å; G300-D302 PolarHBondContact O-N 3.36Å |
| 301 | K | 46.1 | Very low | 46.7 | Very low | 210 Ų | 210 | 117.1 Ų | 117.1 | 91% | 0.913 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 124 | 176.5 | -63.3 | 177.1 | -179.8 | 177.5 | 0 | 107.9 | S299 A303 | S299-K301 PolarHBondContact O-N 3.22Å; K301-A303 PolarHBondContact O-N 3Å |
| 302 | D | 48 | Very low | 46.4 | Very low | 154 Ų | 154 | 117.5 Ų | 117.5 | 82% | 0.824 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 130.2 | 173.9 | -62.7 | -47.8 | 0 | 0 | 0 | 108.8 | G300 A304 | G300-D302 PolarHBondContact O-N 3.36Å; D302-A304 PolarHBondContact O-N 2.99Å |
| 303 | A | 41.7 | Very low | 46.4 | Very low | 89 Ų | 89 | 120.6 Ų | 120.6 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 126.7 | 167.9 | 0 | 0 | 0 | 0 | 0 | 106.5 | K301 D305 | K301-A303 PolarHBondContact O-N 3Å; A303-D305 PolarHBondContact O-N 3.05Å |
| 304 | A | 44.1 | Very low | 46.3 | Very low | 98 Ų | 98 | 120.6 Ų | 120.6 | 81% | 0.81 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 119.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 109 | D302 G306 | D302-A304 PolarHBondContact O-N 2.99Å; A304-G306 PolarHBondContact O-N 3.38Å; A304-G306 VanDerWaalsContact O-N 3.13Å |
| 305 | D | 47.3 | Very low | 46.2 | Very low | 156 Ų | 156 | 120.3 Ų | 120.3 | 83% | 0.834 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 123.7 | 174.2 | -72.1 | -44 | 0 | 0 | 0 | 108.2 | A303 T307 | A303-D305 PolarHBondContact O-N 3.05Å; D305-T307 PolarHBondContact O-N 3.49Å |
| 306 | G | 40.1 | Very low | 46.1 | Very low | 67 Ų | 67 | 119 Ų | 119 | 69% | 0.691 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 127.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | A304 T308 | A304-G306 PolarHBondContact O-N 3.38Å; A304-G306 VanDerWaalsContact O-N 3.13Å; G306-T308 PolarHBondContact O-N 3.49Å |
| 307 | T | 41 | Very low | 46.1 | Very low | 140 Ų | 140 | 116 Ų | 116 | 86% | 0.859 | 77% | 0.765 | S | S | * | * | | | trans | -50.7 | 112.9 | 179.9 | 49.3 | 0 | 0 | 0 | 0 | 109.1 | D305 G309 | D305-T307 PolarHBondContact O-N 3.49Å; T307-G309 PolarHBondContact O-N 2.96Å; T307-G309 VanDerWaalsContact O-N 3.15Å |
| 308 | T | 48.1 | Very low | 46.1 | Very low | 132 Ų | 132 | 116.9 Ų | 116.9 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 122.7 | 171.5 | -50.4 | 0 | 0 | 0 | 0 | 107.8 | G306 | G306-T308 PolarHBondContact O-N 3.49Š|
| 309 | G | 43.5 | Very low | 46.2 | Very low | 51 Ų | 51 | 120 Ų | 120 | 53% | 0.526 | 78% | 0.778 | S | S | . | * | P | Polyproline II helix | trans | -54.5 | 153.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | T307 I311 | T307-G309 PolarHBondContact O-N 2.96Å; T307-G309 VanDerWaalsContact O-N 3.15Å; G309-I311 PolarHBondContact O-N 2.95Å |
| 310 | P | 51.9 | Low | 46.6 | Very low | 133 Ų | 133 | 121.8 Ų | 121.8 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 131.3 | 179.4 | 24.3 | -33.4 | 0 | 0 | 0 | 109.4 | G312 | P310-G312 PolarHBondContact O-N 3.39Å; P310-G312 VanDerWaalsContact O-N 3.13Å |
| 311 | I | 48.2 | Very low | 46.7 | Very low | 159 Ų | 159 | 121 Ų | 121 | 82% | 0.815 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 121.2 | 173.5 | -64.6 | 167.9 | 0 | 0 | 0 | 106.9 | G309 Q313 | G309-I311 PolarHBondContact O-N 2.95Å; I311-Q313 PolarHBondContact O-N 3.35Å |
| 312 | G | 39.6 | Very low | 47.2 | Very low | 62 Ų | 62 | 117.2 Ų | 117.2 | 64% | 0.639 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 139.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | P310 | P310-G312 PolarHBondContact O-N 3.39Å; P310-G312 VanDerWaalsContact O-N 3.13Å |
| 313 | Q | 52.9 | Low | 47.2 | Very low | 186 Ų | 186 | 118.3 Ų | 118.3 | 87% | 0.869 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 138.6 | 178.9 | -69.9 | -171.1 | 18.5 | 0 | 0 | 109.7 | I311 G315 | I311-Q313 PolarHBondContact O-N 3.35Å; Q313-G315 PolarHBondContact O-N 3.48Å |
| 314 | P | 53.3 | Low | 47.1 | Very low | 122 Ų | 122 | 116.9 Ų | 116.9 | 79% | 0.792 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 131.3 | 174.5 | -25.4 | 33.5 | 0 | 0 | 0 | 109.8 | V316 | P314-V316 PolarHBondContact O-N 2.99Š|
| 315 | G | 41 | Very low | 47.1 | Very low | 68 Ų | 68 | 117.5 Ų | 117.5 | 70% | 0.701 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 140.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | Q313 | Q313-G315 PolarHBondContact O-N 3.48Š|
| 316 | V | 47.8 | Very low | 47.2 | Very low | 138 Ų | 138 | 116 Ų | 116 | 84% | 0.836 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 129 | 176.6 | -161.6 | 0 | 0 | 0 | 0 | 107.9 | P314 G318 | P314-V316 PolarHBondContact O-N 2.99Å; V316-G318 PolarHBondContact O-N 3.31Å |
| 317 | P | 52.2 | Low | 47.2 | Very low | 117 Ų | 117 | 116.2 Ų | 116.2 | 76% | 0.76 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 130 | 176.2 | -27.1 | 34.3 | 0 | 0 | 0 | 109.8 | Q319 | P317-Q319 PolarHBondContact O-N 2.97Š|
| 318 | G | 42.9 | Very low | 47.3 | Very low | 70 Ų | 70 | 118.9 Ų | 118.9 | 72% | 0.722 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 142.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | V316 T320 | V316-G318 PolarHBondContact O-N 3.31Å; G318-T320 PolarHBondContact O-N 2.93Å |
| 319 | Q | 54.5 | Low | 47.1 | Very low | 199 Ų | 199 | 117.2 Ų | 117.2 | 93% | 0.93 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 131.8 | 174.3 | -70.2 | -173.6 | 52.3 | 0 | 0 | 109.1 | P317 G321 | P317-Q319 PolarHBondContact O-N 2.97Å; Q319-G321 PolarHBondContact O-N 3.05Å |
| 320 | T | 53.5 | Low | 46.9 | Very low | 139 Ų | 139 | 118 Ų | 118 | 85% | 0.853 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 118.8 | 174.1 | -53.8 | 0 | 0 | 0 | 0 | 108.5 | G318 | G318-T320 PolarHBondContact O-N 2.93Š|
| 321 | G | 43.8 | Very low | 46.6 | Very low | 51 Ų | 51 | 123.5 Ų | 123.5 | 53% | 0.526 | 77% | 0.773 | S | S | . | * | P | Polyproline II helix | trans | -54.7 | 149.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | Q319 R323 | Q319-G321 PolarHBondContact O-N 3.05Å; G321-R323 PolarHBondContact O-N 2.71Å |
| 322 | P | 54.8 | Low | 46.5 | Very low | 131 Ų | 131 | 125.8 Ų | 125.8 | 85% | 0.851 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 142.4 | 176.7 | 25 | -33.9 | 0 | 0 | 0 | 109.5 | G324 | P322-G324 PolarHBondContact O-N 3.47Å; P322-G324 VanDerWaalsContact O-N 3.14Å |
| 323 | R | 48 | Very low | 46.5 | Very low | 176 Ų | 176 | 126.2 Ų | 126.2 | 66% | 0.664 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 124.8 | 174.4 | -171.2 | -176.4 | -158.6 | 159.2 | 7.8 | 108.2 | P234 G235 G321 S325 | P234-R323 VanDerWaalsContact C-NH2 3.33Å; G235-R323 PolarHBondContact O-NH2 3.47Å; G321-R323 PolarHBondContact O-N 2.71Å; R323-S325 PolarHBondContact O-N 3.33Å |
| 324 | G | 41.6 | Very low | 46.3 | Very low | 60 Ų | 60 | 125.4 Ų | 125.4 | 62% | 0.619 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 142.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | P322 | P322-G324 PolarHBondContact O-N 3.47Å; P322-G324 VanDerWaalsContact O-N 3.14Å |
| 325 | S | 42.9 | Very low | 46 | Very low | 110 Ų | 110 | 125.3 Ų | 125.3 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 142.2 | 172.9 | 15.5 | 0 | 0 | 0 | 0 | 109.4 | R323 G327 | R323-S325 PolarHBondContact O-N 3.33Å; S325-G327 PolarHBondContact O-N 2.94Å |
| 326 | P | 48.9 | Very low | 46 | Very low | 126 Ų | 126 | 125.4 Ų | 125.4 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 133.5 | 172.9 | -25.3 | 33.7 | 0 | 0 | 0 | 109.7 | | |
| 327 | G | 41.3 | Very low | 45.9 | Very low | 70 Ų | 70 | 126.2 Ų | 126.2 | 72% | 0.722 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 149.6 | 174 | 0 | 0 | 0 | 0 | 0 | 110.2 | S325 A329 | S325-G327 PolarHBondContact O-N 2.94Å; G327-A329 PolarHBondContact O-N 2.81Å |
| 328 | Q | 42.5 | Very low | 45.7 | Very low | 196 Ų | 196 | 126.4 Ų | 126.4 | 92% | 0.916 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 136.7 | 170.5 | -83.4 | -176.6 | 14.5 | 0 | 0 | 109.1 | G330 | Q328-G330 PolarHBondContact O-N 3.3Š|
| 329 | A | 44.9 | Very low | 45.6 | Very low | 98 Ų | 98 | 125.5 Ų | 125.5 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 128.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | G327 | G327-A329 PolarHBondContact O-N 2.81Š|
| 330 | G | 38.6 | Very low | 45 | Very low | 66 Ų | 66 | 122.1 Ų | 122.1 | 68% | 0.68 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 143.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | Q328 F332 | Q328-G330 PolarHBondContact O-N 3.3Å; G330-F332 PolarHBondContact O-N 3.03Å |
| 331 | R | 45 | Very low | 44.5 | Very low | 249 Ų | 249 | 121.9 Ų | 121.9 | 94% | 0.94 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 133.9 | 169.9 | -74.2 | -174.5 | 162.7 | -163 | -4.5 | 108.2 | G333 | R331-G333 PolarHBondContact O-N 3.45Š|
| 332 | F | 45.6 | Very low | 44.4 | Very low | 207 Ų | 207 | 122.5 Ų | 122.5 | 91% | 0.908 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 136.9 | 171.5 | -64.6 | -72.3 | 0 | 0 | 0 | 109.4 | G330 | G330-F332 PolarHBondContact O-N 3.03Š|
| 333 | G | 40.9 | Very low | 43.8 | Very low | 72 Ų | 72 | 124.5 Ų | 124.5 | 74% | 0.742 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 146.4 | 169.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | R331 | R331-G333 PolarHBondContact O-N 3.45Š|
| 334 | L | 47.4 | Very low | 43.8 | Very low | 169 Ų | 169 | 125.6 Ų | 125.6 | 89% | 0.885 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 142.7 | 169.5 | -72.7 | 149 | 0 | 0 | 0 | 109 | G336 | L334-G336 PolarHBondContact O-N 3.37Š|
| 335 | P | 47 | Very low | 44.1 | Very low | 119 Ų | 119 | 123.8 Ų | 123.8 | 77% | 0.773 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 133.1 | 170.7 | -25.4 | 33.8 | 0 | 0 | 0 | 110.1 | N337 | P335-N337 PolarHBondContact O-N 3.38Š|
| 336 | G | 41.7 | Very low | 44.8 | Very low | 71 Ų | 71 | 122.2 Ų | 122.2 | 73% | 0.732 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 141.9 | 174 | 0 | 0 | 0 | 0 | 0 | 109.9 | L334 | L334-G336 PolarHBondContact O-N 3.37Š|
| 337 | N | 46 | Very low | 44.9 | Very low | 155 Ų | 155 | 118.8 Ų | 118.8 | 83% | 0.829 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -53 | 146.7 | 169.1 | -71.1 | -40.6 | 0 | 0 | 0 | 109 | P335 G339 | P335-N337 PolarHBondContact O-N 3.38Å; N337-G339 PolarHBondContact O-N 3.05Å |
| 338 | P | 47.9 | Very low | 45.6 | Very low | 120 Ų | 120 | 117.7 Ų | 117.7 | 78% | 0.779 | 69% | 0.689 | S | S | * | * | | | trans | -44.8 | 130.1 | 170.1 | -26.6 | 34.2 | 0 | 0 | 0 | 109.6 | | |
| 339 | G | 40.1 | Very low | 46.1 | Very low | 51 Ų | 51 | 111.3 Ų | 111.3 | 53% | 0.526 | 67% | 0.67 | S | S | . | * | | | trans | -54.7 | 150.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110 | N337 D341 | N337-G339 PolarHBondContact O-N 3.05Å; G339-D341 PolarHBondContact O-N 3.2Å; G339-D341 VanDerWaalsContact O-N 3.08Å |
| 340 | P | 42.7 | Very low | 46.6 | Very low | 129 Ų | 129 | 115 Ų | 115 | 84% | 0.838 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -52.9 | 125.6 | 171.5 | 25.2 | -32.3 | 0 | 0 | 0 | 106.6 | S342 | P340-S342 PolarHBondContact O-N 3.07Š|
| 341 | D | 42.7 | Very low | 47.3 | Very low | 134 Ų | 134 | 116.1 Ų | 116.1 | 72% | 0.717 | 66% | 0.656 | S | S | * | * | | | trans | -38.7 | 120.2 | -174.5 | -59.3 | -49.1 | 0 | 0 | 0 | 109.3 | G339 M343 | G339-D341 PolarHBondContact O-N 3.2Å; G339-D341 VanDerWaalsContact O-N 3.08Å; D341-M343 PolarHBondContact O-N 3.22Å |
| 342 | S | 41.6 | Very low | 47 | Very low | 63 Ų | 63 | 110 Ų | 110 | 44% | 0.441 | 65% | 0.649 | S | S | . | * | S | Bend | trans | -54.1 | 105.3 | -179.5 | 53.8 | 0 | 0 | 0 | 0 | 107.7 | P340 Y344 | P340-S342 PolarHBondContact O-N 3.07Å; S342-Y344 PolarHBondContact O-N 3.05Å |
| 343 | M | 42.1 | Very low | 46.8 | Very low | 174 Ų | 174 | 106 Ų | 106 | 86% | 0.857 | 64% | 0.641 | S | S | * | * | S | Bend | trans | 34.9 | 82.2 | 169.7 | -156.5 | 82.9 | 133.1 | 0 | 0 | 113.1 | D341 C345 | D341-M343 PolarHBondContact O-N 3.22Å; M343-C345 PolarHBondContact O-N 3.37Å |
| 344 | Y | 48.8 | Very low | 46.5 | Very low | 198 Ų | 198 | 111 Ų | 111 | 78% | 0.776 | 64% | 0.643 | S | S | * | * | | | trans | -10.6 | 92.3 | 164.8 | -130.5 | -95.8 | 0 | 0 | 0 | 113.6 | S342 P346 | S342-Y344 PolarHBondContact O-N 3.05Å; Y344-P346 VanDerWaalsContact O-CD 3.27Å; Y344-P346 WeakPolarHBondContact O-CD 3.46Å |
| 345 | C | 48.2 | Very low | 45.8 | Very low | 23 Ų | 23 | 109.5 Ų | 109.5 | 16% | 0.155 | 64% | 0.643 | C | S | . | * | | | trans | -68.1 | 117.4 | 162.9 | -61.1 | 0 | 0 | 0 | 0 | 104.8 | C143 M343 C347 | C143-C345 HydrophobicContact CB-CB 3.91Å; C143-C345 WeakPolarHBondContact CB-SG 3.48Å; C143-C345 WeakPolarHBondContact SG-CB 3.45Å; C143-C345 CovalentContact SG-SG 2.03Å; C143-C345 PolarHBondContact SG-SG 3.45Å; M343-C345 PolarHBondContact O-N 3.37Å; C345-C347 PolarHBondContact O-N 3.45Å |
| 346 | P | 57.5 | Low | 45.2 | Very low | 76 Ų | 76 | 107 Ų | 107 | 49% | 0.494 | 64% | 0.639 | S | S | . | * | | | trans | -79.3 | 49.5 | -177.7 | 33.1 | -30.6 | 0 | 0 | 0 | 109.2 | W132 Y344 | W132-P346 HydrophobicContact CH2-CG 4.05Å; W132-P346 WeakPolarHBondContact CH2-O 3.41Å; W132-P346 HydrophobicContact CZ2-CB 4.22Å; W132-P346 HydrophobicContact CZ2-CG 3.87Å; W132-P346 WeakPolarHBondContact CZ2-O 3.32Å; Y344-P346 VanDerWaalsContact O-CD 3.27Å; Y344-P346 WeakPolarHBondContact O-CD 3.46Å |
| 347 | C | 49.9 | Very low | 45 | Very low | 54 Ų | 54 | 112 Ų | 112 | 37% | 0.365 | 64% | 0.643 | S | S | . | * | P | Polyproline II helix | trans | -63.1 | 127.8 | 171.4 | -53.4 | 0 | 0 | 0 | 0 | 106.3 | C145 C345 A349 | C145-C347 HydrophobicContact CB-CB 4.05Å; C145-C347 WeakPolarHBondContact CB-SG 3.41Å; C145-C347 WeakPolarHBondContact SG-CB 3.49Å; C145-C347 CovalentContact SG-SG 2.05Å; C145-C347 PolarHBondContact SG-SG 3.1Å; C345-C347 PolarHBondContact O-N 3.45Å; C347-A349 PolarHBondContact O-N 3.46Å; C347-A349 VanDerWaalsContact O-N 3.09Å |
| 348 | P | 55.9 | Low | 44.4 | Very low | 48 Ų | 48 | 114.1 Ų | 114.1 | 31% | 0.312 | 65% | 0.648 | S | S | . | * | P | Polyproline II helix | trans | -60.2 | 124.2 | -177.4 | 28.8 | -36.4 | 0 | 0 | 0 | 107.3 | W125 W132 | W125-P348 HydrophobicContact CH2-CB 3.43Å; W125-P348 VanDerWaalsContact CH2-CB 3.43Å; W125-P348 HydrophobicContact CH2-CG 4.01Å; W125-P348 VanDerWaalsContact CH2-O 3.24Å; W125-P348 WeakPolarHBondContact CH2-O 3.45Å; W125-P348 HydrophobicContact CZ2-CB 4.07Å; W125-P348 HydrophobicContact CZ2-CG 4.16Å; W125-P348 WeakPolarHBondContact CZ2-O 3.48Å; W125-P348 HydrophobicContact CZ3-CB 4.17Å; W132-P348 HydrophobicContact CD2-CG 4.44Å; W132-P348 HydrophobicContact CE3-CG 4.37Å |
| 349 | A | 54.4 | Low | 43.9 | Very low | 61 Ų | 61 | 112.3 Ų | 112.3 | 50% | 0.504 | 64% | 0.638 | S | S | . | * | P | Polyproline II helix | trans | -76.5 | 142.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | W125 C347 T351 | W125-A349 WeakPolarHBondContact CH2-O 3.35Å; W125-A349 WeakPolarHBondContact CZ3-O 3.36Å; C347-A349 PolarHBondContact O-N 3.46Å; C347-A349 VanDerWaalsContact O-N 3.09Å; A349-T351 PolarHBondContact O-N 3.16Å |
| 350 | R | 54.8 | Low | 43.5 | Very low | 176 Ų | 176 | 119.2 Ų | 119.2 | 66% | 0.664 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -63.2 | 36.6 | 179.1 | -71.2 | -171.1 | 175.3 | -158 | -3.4 | 114.5 | W125 | W125-R350 HydrophobicContact CZ2-CG 4.14Š|
| 351 | T | 52.5 | Low | 43.5 | Very low | 89 Ų | 89 | 121.3 Ų | 121.3 | 55% | 0.546 | 65% | 0.652 | S | S | . | * | S | Bend | trans | -122.8 | 120.6 | -175.6 | 52.3 | 0 | 0 | 0 | 0 | 108.8 | A349 V353 | A349-T351 PolarHBondContact O-N 3.16Å; T351-V353 PolarHBondContact O-N 3.5Å |
| 352 | P | 40.1 | Very low | 43 | Very low | 121 Ų | 121 | 119.1 Ų | 119.1 | 79% | 0.786 | 66% | 0.661 | S | S | * | * | | | trans | -73.3 | 93.9 | 175.2 | 30.7 | -30 | 0 | 0 | 0 | 107.7 | | |
| 353 | V | 40 | Very low | 42.7 | Very low | 122 Ų | 122 | 119.6 Ų | 119.6 | 74% | 0.739 | 68% | 0.676 | S | S | * | * | | | trans | -130.7 | 100.8 | 166 | -172.2 | 0 | 0 | 0 | 0 | 106.7 | T351 | T351-V353 PolarHBondContact O-N 3.5Š|
| 354 | F | 34.5 | Very low | 42.3 | Very low | 178 Ų | 178 | 122.7 Ų | 122.7 | 78% | 0.781 | 68% | 0.678 | S | S | * | * | | | trans | -57.1 | 136.3 | 175.1 | -73.5 | -90.4 | 0 | 0 | 0 | 110.1 | G356 | F354-G356 PolarHBondContact O-N 3.17Å; F354-G356 VanDerWaalsContact O-N 3.1Å |
| 355 | P | 33.4 | Very low | 42 | Very low | 137 Ų | 137 | 120.8 Ų | 120.8 | 89% | 0.89 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -77.2 | 95.6 | 167.7 | 30.3 | -27.3 | 0 | 0 | 0 | 107.8 | | |
| 356 | G | 34.4 | Very low | 41.3 | Very low | 66 Ų | 66 | 126.8 Ų | 126.8 | 68% | 0.68 | 71% | 0.709 | S | S | * | * | | | trans | 137 | 69.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | F354 | F354-G356 PolarHBondContact O-N 3.17Å; F354-G356 VanDerWaalsContact O-N 3.1Å |
| 357 | E | 36.8 | Very low | 40.3 | Very low | 178 Ų | 178 | 127 Ų | 127 | 83% | 0.832 | 73% | 0.725 | S | S | * | * | | | trans | -155.2 | 88.5 | 149.9 | -132.5 | 173.6 | 127.4 | 0 | 0 | 110.3 | S359 | E357-S359 PolarHBondContact O-N 3.4Š|
| 358 | E | 33.3 | Very low | 40 | Very low | 198 Ų | 198 | 129 Ų | 129 | 93% | 0.925 | 75% | 0.745 | S | S | * | * | | | trans | -72.8 | 98.4 | 160.4 | -162.9 | 175.9 | 137.9 | 0 | 0 | 106.7 | | |
| 359 | S | 37.3 | Very low | 39.1 | Very low | 83 Ų | 83 | 130 Ų | 130 | 58% | 0.58 | 77% | 0.765 | S | S | * | * | | | trans | -144.4 | 98.4 | 169.6 | -146.9 | 0 | 0 | 0 | 0 | 112 | E357 H361 | E357-S359 PolarHBondContact O-N 3.4Å; S359-H361 PolarHBondContact O-N 3.46Å |
| 360 | K | 33.6 | Very low | 38.3 | Very low | 196 Ų | 196 | 139.1 Ų | 139.1 | 85% | 0.852 | 79% | 0.786 | S | S | * | * | | | trans | -65.7 | 95.9 | 166.6 | -72.6 | -179.8 | 173 | 177.4 | 0 | 110.7 | | |
| 361 | H | 41.4 | Very low | 37.8 | Very low | 173 Ų | 173 | 136.6 Ų | 136.6 | 80% | 0.801 | 79% | 0.793 | S | S | * | * | | | trans | -152.3 | 104.7 | 157.1 | -71.2 | 91.1 | 0 | 0 | 0 | 106.5 | S359 | S359-H361 PolarHBondContact O-N 3.46Š|
| 362 | G | 33 | Very low | 36.9 | Very low | 88 Ų | 88 | 135.8 Ų | 135.8 | 91% | 0.907 | 80% | 0.801 | S | S | * | * | | | | 71.5 | 91.6 | 72.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 363 | G | 35 | Very low | 36.8 | Very low | 73 Ų | 73 | 136.1 Ų | 136.1 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | | | trans | 173 | 86.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | | |
| 364 | R | 34.2 | Very low | 36.4 | Very low | 239 Ų | 239 | 138 Ų | 138 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | | | trans | -57.5 | 127.1 | 169 | 170.4 | -170.5 | -94 | 176.9 | -8.9 | 111.2 | | |
| 365 | I | 41.2 | Very low | 36.3 | Very low | 158 Ų | 158 | 136 Ų | 136 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | | | trans | -135.6 | 94.8 | 157.2 | -15.7 | -174.6 | 0 | 0 | 0 | 110.9 | | |
| 366 | I | 35 | Very low | 36.4 | Very low | 149 Ų | 149 | 134.5 Ų | 134.5 | 76% | 0.764 | 79% | 0.787 | S | S | * | * | | | trans | 18.5 | 105.7 | 140 | -34.3 | 175.3 | 0 | 0 | 0 | 116.7 | | |
| 367 | G | 36.6 | Very low | 36.2 | Very low | 81 Ų | 81 | 141.2 Ų | 141.2 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | | | trans | -111.6 | 99 | 160.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 368 | A | 43.5 | Very low | 36.1 | Very low | 95 Ų | 95 | 136.1 Ų | 136.1 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | | | trans | -70 | 128.2 | 157.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 369 | G | 36.7 | Very low | 36.1 | Very low | 70 Ų | 70 | 131.3 Ų | 131.3 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | | | | 59.3 | 120.9 | 93.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 370 | R | 38.2 | Very low | 36.1 | Very low | 251 Ų | 251 | 138.9 Ų | 138.9 | 95% | 0.947 | 80% | 0.803 | S | S | * | * | | | cis | -166.5 | 172.7 | 21.9 | -100.4 | -176.4 | 178.6 | -167.5 | 0.3 | 109 | | |
| 371 | P | 43.4 | Very low | 36.9 | Very low | 124 Ų | 124 | 135.4 Ų | 135.4 | 81% | 0.805 | 80% | 0.801 | S | S | * | * | | | trans | -109.8 | 177.1 | -163.6 | 41.2 | -31.7 | 0 | 0 | 0 | 115.3 | | |
| 372 | G | 33.1 | Very low | 36.9 | Very low | 71 Ų | 71 | 130.9 Ų | 130.9 | 73% | 0.732 | 80% | 0.801 | S | S | * | * | | | trans | 104 | 146.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 373 | V | 37.5 | Very low | 37.2 | Very low | 128 Ų | 128 | 130.4 Ų | 130.4 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | | | cis | -157.4 | 165.1 | 19.7 | 164.3 | 0 | 0 | 0 | 0 | 107.4 | | |
| 374 | Q | 33.2 | Very low | 37.8 | Very low | 162 Ų | 162 | 133.2 Ų | 133.2 | 76% | 0.757 | 80% | 0.801 | S | S | * | * | | | trans | -40.3 | 179.1 | 175.2 | -61.7 | 154 | 36.6 | 0 | 0 | 117.6 | | |
| 375 | D | 32.7 | Very low | 37.9 | Very low | 137 Ų | 137 | 125.5 Ų | 125.5 | 73% | 0.733 | 80% | 0.796 | S | S | * | * | | | trans | 96.6 | 139.9 | 156.5 | -63.9 | -24.1 | 0 | 0 | 0 | 116.1 | | |
| 376 | V | 33.9 | Very low | 37.8 | Very low | 105 Ų | 105 | 128.6 Ų | 128.6 | 64% | 0.636 | 80% | 0.798 | S | S | * | * | | | cis | -178.3 | 146.3 | -14.6 | 111.2 | 0 | 0 | 0 | 0 | 104 | | |
| 377 | F | 31.7 | Very low | 37.9 | Very low | 206 Ų | 206 | 129.8 Ų | 129.8 | 90% | 0.904 | 80% | 0.797 | S | S | * | * | | | trans | 73 | 146.1 | 156.7 | -80.2 | -121.4 | 0 | 0 | 0 | 122.6 | | |
| 378 | G | 33.5 | Very low | 37.9 | Very low | 71 Ų | 71 | 134.1 Ų | 134.1 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | | | trans | 121.9 | 73.8 | 150.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 379 | A | 33.6 | Very low | 38.2 | Very low | 97 Ų | 97 | 134.2 Ų | 134.2 | 80% | 0.802 | 79% | 0.788 | S | S | * | * | | | | 72.1 | 102.2 | 92 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 380 | R | 37.8 | Very low | 38.3 | Very low | 243 Ų | 243 | 137.8 Ų | 137.8 | 92% | 0.917 | 80% | 0.796 | S | S | * | * | | | | 40 | 169.4 | 125.1 | -78.1 | -168.1 | 175.8 | -164.2 | 0.4 | 121.1 | | |
| 381 | P | 50.2 | Low | 38.4 | Very low | 122 Ų | 122 | 129.7 Ų | 129.7 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | | | cis | -141.4 | -179.5 | -44.3 | 40.1 | -22.4 | 0 | 0 | 0 | 112.9 | | |
| 382 | G | 40.5 | Very low | 38.2 | Very low | 79 Ų | 79 | 130.4 Ų | 130.4 | 81% | 0.814 | 79% | 0.793 | S | S | * | * | | | trans | 171.5 | 113.1 | 161.7 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 383 | G | 39.5 | Very low | 38.6 | Very low | 78 Ų | 78 | 133 Ų | 133 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | | | trans | -89.2 | -137.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 384 | P | 49.1 | Very low | 38.8 | Very low | 132 Ų | 132 | 129.9 Ų | 129.9 | 86% | 0.857 | 79% | 0.794 | S | S | * | * | | | cis | -141.5 | 173.7 | -28.2 | 39.4 | -21.7 | 0 | 0 | 0 | 115.6 | | |
| 385 | G | 35.7 | Very low | 38.9 | Very low | 77 Ų | 77 | 129.6 Ų | 129.6 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | | | trans | 76.3 | 151.1 | 152.7 | 0 | 0 | 0 | 0 | 0 | 116.8 | | |
| 386 | R | 39.4 | Very low | 39.2 | Very low | 223 Ų | 223 | 131 Ų | 131 | 84% | 0.842 | 80% | 0.798 | S | S | * | * | | | cis | -178.1 | 137.8 | 25.6 | -135 | 173.7 | -167.7 | -143.5 | 6.5 | 103.6 | | |
| 387 | F | 36 | Very low | 39.3 | Very low | 173 Ų | 173 | 132 Ų | 132 | 76% | 0.759 | 80% | 0.804 | S | S | * | * | | | | 167.1 | 141.4 | 77.9 | -123.6 | -81.5 | 0 | 0 | 0 | 108.2 | | |
| 388 | Q | 36.7 | Very low | 39.6 | Very low | 173 Ų | 173 | 125 Ų | 125 | 81% | 0.808 | 79% | 0.791 | S | S | * | * | | | trans | -86.6 | -161.7 | 167.8 | -58.5 | -175.2 | 0.5 | 0 | 0 | 110.1 | | |
| 389 | P | 49.5 | Very low | 39.9 | Very low | 96 Ų | 96 | 128.5 Ų | 128.5 | 62% | 0.623 | 80% | 0.798 | S | S | * | * | | | cis | -147.9 | -172.7 | 2.6 | 29.7 | -1.4 | 0 | 0 | 0 | 118.4 | | |
| 390 | T | 39.4 | Very low | 40 | Very low | 145 Ų | 145 | 127.4 Ų | 127.4 | 89% | 0.89 | 80% | 0.796 | S | S | * | * | | | trans | 105.7 | 135.7 | 146.5 | 70.4 | 0 | 0 | 0 | 0 | 119.6 | | |
| 391 | G | 39.8 | Very low | 40 | Very low | 82 Ų | 82 | 119.6 Ų | 119.6 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | | | trans | 149.4 | 67.4 | 163.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 392 | V | 39.9 | Very low | 39.4 | Very low | 138 Ų | 138 | 125.1 Ų | 125.1 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | | | trans | -76.7 | 149.2 | 174.8 | -95 | 0 | 0 | 0 | 0 | 113.3 | | |
| 393 | S | 42 | Very low | 39.2 | Very low | 125 Ų | 125 | 125 Ų | 125 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | | | | 166.5 | 141.9 | 120 | -77.3 | 0 | 0 | 0 | 0 | 115.2 | | |
| 394 | G | 41.1 | Very low | 39.1 | Very low | 63 Ų | 63 | 124.9 Ų | 124.9 | 65% | 0.649 | 79% | 0.788 | S | S | * | * | | | trans | 114.7 | 88.6 | 150.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | | |
| 395 | I | 35.8 | Very low | 39.1 | Very low | 156 Ų | 156 | 125.3 Ų | 125.3 | 80% | 0.8 | 79% | 0.791 | S | S | * | * | | | | 74.1 | 129.7 | 81.8 | -69.1 | 173.2 | 0 | 0 | 0 | 111.1 | | |
| 396 | Q | 38.2 | Very low | 39.2 | Very low | 166 Ų | 166 | 125 Ų | 125 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | | | cis | -169.4 | 139 | 6 | -109.3 | -171.6 | -37.4 | 0 | 0 | 106.8 | | |
| 397 | V | 35.5 | Very low | 39.4 | Very low | 127 Ų | 127 | 126.1 Ų | 126.1 | 77% | 0.77 | 79% | 0.791 | S | S | * | * | | | | 99.6 | 132.8 | 98 | 171.1 | 0 | 0 | 0 | 0 | 115.7 | | |
| 398 | G | 39.5 | Very low | 39.9 | Very low | 60 Ų | 60 | 123.7 Ų | 123.7 | 62% | 0.619 | 79% | 0.793 | S | S | * | * | | | trans | 135 | 62.3 | 152.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 399 | T | 39.3 | Very low | 40 | Very low | 143 Ų | 143 | 118.2 Ų | 118.2 | 88% | 0.877 | 78% | 0.783 | S | S | * | * | | | | 59.4 | 128.2 | 90.8 | 60.2 | 0 | 0 | 0 | 0 | 118 | | |
| 400 | G | 36.1 | Very low | 39.5 | Very low | 74 Ų | 74 | 120.2 Ų | 120.2 | 76% | 0.763 | 79% | 0.794 | S | S | * | * | | | trans | 129.4 | 81.8 | 159.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 401 | A | 37.2 | Very low | 39.3 | Very low | 80 Ų | 80 | 119.8 Ų | 119.8 | 66% | 0.661 | 79% | 0.79 | S | S | * | * | | | | 85.7 | 139.2 | 52.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 402 | Y | 37.1 | Very low | 39.1 | Very low | 237 Ų | 237 | 119.1 Ų | 119.1 | 93% | 0.929 | 78% | 0.783 | S | S | * | * | | | trans | 81.4 | 120.6 | 173.7 | -56.5 | -81.9 | 0 | 0 | 0 | 115.8 | | |
| 403 | G | 36.1 | Very low | 39 | Very low | 76 Ų | 76 | 121 Ų | 121 | 78% | 0.784 | 78% | 0.783 | S | S | * | * | | | cis | 147.4 | 116.6 | 13.4 | 0 | 0 | 0 | 0 | 0 | 104.8 | | |
| 404 | G | 38.6 | Very low | 38.6 | Very low | 77 Ų | 77 | 122.8 Ų | 122.8 | 79% | 0.794 | 78% | 0.781 | S | S | * | * | | | | 112.6 | 155.5 | 80.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 405 | P | 49.1 | Very low | 38.4 | Very low | 140 Ų | 140 | 123.4 Ų | 123.4 | 91% | 0.909 | 79% | 0.788 | S | S | * | * | | | trans | -133.3 | 178.3 | -131.1 | 38.2 | -21.1 | 0 | 0 | 0 | 116 | | |
| 406 | G | 37 | Very low | 38.5 | Very low | 70 Ų | 70 | 119.6 Ų | 119.6 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | | | trans | 132.3 | 153.8 | 149.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 407 | R | 43.8 | Very low | 38.4 | Very low | 247 Ų | 247 | 119.2 Ų | 119.2 | 93% | 0.932 | 80% | 0.796 | S | S | * | * | | | cis | -177.5 | 179.9 | -12.2 | -120.6 | -161.8 | -169.3 | -138.2 | 5.1 | 105.4 | | |
| 408 | P | 45.1 | Very low | 38.5 | Very low | 123 Ų | 123 | 116 Ų | 116 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | | | trans | -124.5 | -176.3 | -131.2 | 41.5 | -24.4 | 0 | 0 | 0 | 115.8 | | |
| 409 | G | 39.4 | Very low | 38.5 | Very low | 57 Ų | 57 | 119.2 Ų | 119.2 | 59% | 0.588 | 80% | 0.796 | S | S | * | * | | | trans | 172.8 | 111.8 | 157.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 410 | T | 40.1 | Very low | 38.3 | Very low | 139 Ų | 139 | 121.6 Ų | 121.6 | 85% | 0.853 | 80% | 0.797 | S | S | * | * | | | | 65.4 | 135.8 | 95.3 | 43.2 | 0 | 0 | 0 | 0 | 113.6 | | |
| 411 | V | 35 | Very low | 38.2 | Very low | 135 Ų | 135 | 121.6 Ų | 121.6 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | | | cis | -172.7 | 153.1 | 15 | 132 | 0 | 0 | 0 | 0 | 109 | | |
| 412 | G | 35.1 | Very low | 38.4 | Very low | 68 Ų | 68 | 124.1 Ų | 124.1 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | | | trans | 82.3 | 146.4 | 150 | 0 | 0 | 0 | 0 | 0 | 117.8 | | |
| 413 | Q | 38.5 | Very low | 38.2 | Very low | 177 Ų | 177 | 120.9 Ų | 120.9 | 83% | 0.827 | 80% | 0.804 | S | S | * | * | | | cis | -170 | 124.7 | 5.7 | -150.1 | 170.7 | 32.1 | 0 | 0 | 109.2 | | |
| 414 | I | 33.7 | Very low | 38.3 | Very low | 164 Ų | 164 | 122.9 Ų | 122.9 | 84% | 0.841 | 81% | 0.806 | S | S | * | * | | | trans | 34.3 | 133.5 | 133.2 | -27.7 | 164.8 | 0 | 0 | 0 | 121.5 | | |
| 415 | G | 35.6 | Very low | 37.9 | Very low | 76 Ų | 76 | 122.2 Ų | 122.2 | 78% | 0.784 | 80% | 0.799 | S | S | * | * | | | trans | 163 | 111.3 | 143.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | | |
| 416 | G | 38.1 | Very low | 37.5 | Very low | 76 Ų | 76 | 126.3 Ų | 126.3 | 78% | 0.784 | 80% | 0.798 | S | S | * | * | | | trans | 83.2 | 111.7 | 149.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | | |
| 417 | V | 36.9 | Very low | 37.2 | Very low | 158 Ų | 158 | 127 Ų | 127 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | | | cis | 81.5 | 122.3 | 44.7 | -171.5 | 0 | 0 | 0 | 0 | 115.3 | | |
| 418 | G | 36.7 | Very low | 36.9 | Very low | 59 Ų | 59 | 119 Ų | 119 | 61% | 0.608 | 80% | 0.799 | S | S | * | * | | | trans | 151.3 | 85.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 419 | T | 39.9 | Very low | 36.6 | Very low | 127 Ų | 127 | 121.7 Ų | 121.7 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | | | | 74.5 | 105.3 | 102.4 | 52.6 | 0 | 0 | 0 | 0 | 115.7 | | |
| 420 | Q | 34.7 | Very low | 36.5 | Very low | 193 Ų | 193 | 125 Ų | 125 | 90% | 0.902 | 81% | 0.812 | S | S | * | * | | | | 88.3 | 113.8 | 78.5 | -82.5 | -168.5 | 21.3 | 0 | 0 | 116.4 | | |
| 421 | G | 35.3 | Very low | 36.6 | Very low | 75 Ų | 75 | 124.7 Ų | 124.7 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | | | trans | 68.1 | 159 | 137.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | | |
| 422 | P | 41.6 | Very low | 36.6 | Very low | 132 Ų | 132 | 121.8 Ų | 121.8 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | | | cis | -136.5 | 176.2 | 33.7 | 38.7 | -19.2 | 0 | 0 | 0 | 117.1 | | |
| 423 | I | 31.9 | Very low | 36.7 | Very low | 170 Ų | 170 | 126.6 Ų | 126.6 | 87% | 0.872 | 80% | 0.804 | S | S | * | * | | | trans | -97.4 | 143.9 | -179.6 | -36.3 | 165.7 | 0 | 0 | 0 | 107.9 | | |
| 424 | S | 38.7 | Very low | 36.5 | Very low | 118 Ų | 118 | 122.8 Ų | 122.8 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | | | trans | -159.8 | 133.8 | 150.3 | -160.2 | 0 | 0 | 0 | 0 | 110.5 | | |
| 425 | G | 30.7 | Very low | 36.7 | Very low | 62 Ų | 62 | 121.4 Ų | 121.4 | 64% | 0.639 | 79% | 0.793 | S | S | * | * | | | trans | -124.6 | 159.5 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 426 | Y | 39.3 | Very low | 36.5 | Very low | 227 Ų | 227 | 127.2 Ų | 127.2 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | | | trans | -159.2 | 132.2 | 162.2 | -78.4 | -83.6 | 0 | 0 | 0 | 104.4 | | |
| 427 | G | 32 | Very low | 36.2 | Very low | 83 Ų | 83 | 129.8 Ų | 129.8 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | | | cis | 107.2 | 80.7 | 21.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 428 | G | 36.7 | Very low | 35.9 | Very low | 80 Ų | 80 | 128.1 Ų | 128.1 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | | | trans | -165.3 | 127.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 429 | Q | 39.1 | Very low | 35.6 | Very low | 180 Ų | 180 | 131.9 Ų | 131.9 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 164.1 | -163.5 | -57 | 177.9 | -69.3 | 0 | 0 | 115.9 | | |
| 430 | P | 37.2 | Very low | 35.5 | Very low | 127 Ų | 127 | 131.9 Ų | 131.9 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -99.9 | 132.4 | 147.6 | 33.4 | -23.1 | 0 | 0 | 0 | 111.3 | | |
| 431 | V | 41.4 | Very low | 35.3 | Very low | 131 Ų | 131 | 126.5 Ų | 126.5 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 119.7 | 177.1 | -175.7 | 0 | 0 | 0 | 0 | 108.9 | | |
| 432 | G | 36.3 | Very low | 35.2 | Very low | 74 Ų | 74 | 134.9 Ų | 134.9 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -83 | 128.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 433 | R | 36.7 | Very low | 34.9 | Very low | 170 Ų | 170 | 133.4 Ų | 133.4 | 64% | 0.642 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -83 | 148.4 | 173.6 | -66.8 | -178.5 | 175.4 | -174.1 | 1.5 | 111.2 | D45 | D45-R433 IonicContact OD2-CZ 3.96Š|
| 434 | P | 34.5 | Very low | 34.8 | Very low | 96 Ų | 96 | 128.9 Ų | 128.9 | 62% | 0.623 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 134.8 | 168.6 | 33 | -29.6 | 0 | 0 | 0 | 110.8 | Y436 | P434-Y436 HydrophobicContact CB-CE2 4.48Å; P434-Y436 HydrophobicContact CG-CE2 4.02Å |
| 435 | V | 36.5 | Very low | 34.8 | Very low | 135 Ų | 135 | 131.8 Ų | 131.8 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 120.3 | 169.6 | 175.5 | 0 | 0 | 0 | 0 | 108.3 | | |
| 436 | Y | 32.2 | Very low | 34.9 | Very low | 199 Ų | 199 | 134.3 Ų | 134.3 | 78% | 0.78 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -95.3 | 116.2 | 168.1 | -70.3 | -84.4 | 0 | 0 | 0 | 109.1 | P434 | P434-Y436 HydrophobicContact CB-CE2 4.48Å; P434-Y436 HydrophobicContact CG-CE2 4.02Å |
| 437 | T | 31.4 | Very low | 34.9 | Very low | 130 Ų | 130 | 133 Ų | 133 | 80% | 0.798 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 116 | 169.7 | -15.3 | 0 | 0 | 0 | 0 | 108.7 | | |
| 438 | V | 31 | Very low | 34.9 | Very low | 122 Ų | 122 | 132.2 Ų | 132.2 | 74% | 0.739 | 80% | 0.8 | S | S | * | * | | | trans | -99.5 | 107.9 | 169.4 | 176.9 | 0 | 0 | 0 | 0 | 108.3 | T440 | V438-T440 HydrophobicContact CG1-CG2 4.28Š|
| 439 | T | 30.1 | Very low | 35.1 | Very low | 138 Ų | 138 | 135.5 Ų | 135.5 | 85% | 0.847 | 80% | 0.804 | S | S | * | * | | | trans | -85.5 | 107.2 | 172.1 | -4.7 | 0 | 0 | 0 | 0 | 108.9 | | |
| 440 | T | 37.9 | Very low | 34.9 | Very low | 128 Ų | 128 | 137.8 Ų | 137.8 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | | | trans | -104.9 | 101.7 | 162.6 | 48.1 | 0 | 0 | 0 | 0 | 109.2 | V438 | V438-T440 HydrophobicContact CG1-CG2 4.28Š|
| 441 | G | 29.9 | Very low | 35.2 | Very low | 80 Ų | 80 | 136.5 Ų | 136.5 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | | | trans | -73.1 | 135.4 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 442 | R | 34.4 | Very low | 35 | Very low | 251 Ų | 251 | 138.1 Ų | 138.1 | 95% | 0.947 | 80% | 0.801 | S | S | * | * | | | trans | -132.7 | 123.6 | 163.1 | -142.8 | 173.8 | -174.6 | 158.8 | 0.8 | 109.7 | | |
| 443 | A | 35 | Very low | 35 | Very low | 100 Ų | 100 | 138.2 Ų | 138.2 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | | | trans | -62.6 | 146.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 444 | G | 30.8 | Very low | 34.9 | Very low | 75 Ų | 75 | 137.7 Ų | 137.7 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | | | trans | -78.8 | 153.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 445 | I | 37.9 | Very low | 35.1 | Very low | 179 Ų | 179 | 141.6 Ų | 141.6 | 92% | 0.918 | 83% | 0.826 | S | S | * | * | | | trans | -135.6 | 122.8 | 154.5 | 39.1 | 170.9 | 0 | 0 | 0 | 106.3 | | |
| 446 | S | 31.8 | Very low | 35.2 | Very low | 116 Ų | 116 | 138.5 Ų | 138.5 | 81% | 0.811 | 82% | 0.821 | S | S | * | * | | | trans | -110.6 | 128.1 | -177.7 | 53.7 | 0 | 0 | 0 | 0 | 109.6 | | |
| 447 | E | 39.1 | Very low | 35.3 | Very low | 199 Ų | 199 | 138.9 Ų | 138.9 | 93% | 0.93 | 83% | 0.83 | S | S | * | * | | | trans | -132.7 | 125.6 | 156 | -86.6 | -175.9 | 129.9 | 0 | 0 | 109.1 | | |
| 448 | G | 33.1 | Very low | 35.6 | Very low | 67 Ų | 67 | 136 Ų | 136 | 69% | 0.691 | 82% | 0.819 | S | S | * | * | | | trans | -68.3 | 163.2 | 169 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 449 | T | 40.3 | Very low | 35.8 | Very low | 149 Ų | 149 | 133.8 Ų | 133.8 | 91% | 0.914 | 82% | 0.821 | S | S | * | * | | | | -173.6 | 142.5 | 70.7 | -50.1 | 0 | 0 | 0 | 0 | 107.8 | | |
| 450 | R | 35.4 | Very low | 35.9 | Very low | 228 Ų | 228 | 137.3 Ų | 137.3 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | | | trans | -87.5 | -176.8 | 176.9 | -94.6 | -176.5 | 172.5 | -179.6 | -1.3 | 111.2 | | |
| 451 | P | 44.2 | Very low | 35.8 | Very low | 99 Ų | 99 | 135.9 Ų | 135.9 | 64% | 0.643 | 82% | 0.822 | S | S | * | * | | | cis | -138.3 | -168.6 | -37.2 | 36.4 | -17 | 0 | 0 | 0 | 112.7 | | |
| 452 | N | 37.1 | Very low | 36 | Very low | 166 Ų | 166 | 138.4 Ų | 138.4 | 89% | 0.888 | 82% | 0.821 | S | S | * | * | | | trans | 94.6 | 112.6 | 162.6 | -63.1 | -23.3 | 0 | 0 | 0 | 117.5 | | |
| 453 | G | 36.5 | Very low | 35.9 | Very low | 76 Ų | 76 | 131.8 Ų | 131.8 | 78% | 0.784 | 81% | 0.813 | S | S | * | * | | | trans | 166.6 | 108.2 | 167.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 454 | N | 34.4 | Very low | 36 | Very low | 158 Ų | 158 | 134.8 Ų | 134.8 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | | | trans | -57.2 | 166.1 | 170.7 | -76.1 | -40.3 | 0 | 0 | 0 | 112.2 | | |
| 455 | I | 38.6 | Very low | 36.2 | Very low | 179 Ų | 179 | 134.7 Ų | 134.7 | 92% | 0.918 | 81% | 0.813 | S | S | * | * | | | trans | 105.3 | 124.1 | 159.5 | -53.9 | 156.9 | 0 | 0 | 0 | 114.1 | | |
| 456 | G | 37.8 | Very low | 36.2 | Very low | 69 Ų | 69 | 132.8 Ų | 132.8 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | | | trans | 131.5 | 95.4 | 152.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | A458 | G456-A458 PolarHBondContact O-N 3.43Š|
| 457 | Q | 34.4 | Very low | 36.4 | Very low | 207 Ų | 207 | 133.2 Ų | 133.2 | 97% | 0.967 | 81% | 0.807 | S | S | * | * | | | trans | -50.9 | 132.4 | 159.1 | -69.9 | 169.4 | -24.8 | 0 | 0 | 110.1 | | |
| 458 | A | 38.1 | Very low | 36.6 | Very low | 69 Ų | 69 | 129.5 Ų | 129.5 | 57% | 0.57 | 80% | 0.8 | S | S | * | * | | | trans | -137.8 | 106 | 159.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | G456 | G456-A458 PolarHBondContact O-N 3.43Š|
| 459 | G | 35.1 | Very low | 36.7 | Very low | 77 Ų | 77 | 131.3 Ų | 131.3 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | | | trans | -72.8 | 144.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 460 | Y | 33.2 | Very low | 36.8 | Very low | 211 Ų | 211 | 136.3 Ų | 136.3 | 83% | 0.827 | 80% | 0.804 | S | S | * | * | | | trans | -109.5 | 104.5 | 169.3 | -41.4 | -77.1 | 0 | 0 | 0 | 107 | | |
| 461 | A | 35.1 | Very low | 37.1 | Very low | 99 Ų | 99 | 133.5 Ų | 133.5 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | | | trans | -83.7 | 123.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | | |
| 462 | V | 33.3 | Very low | 36.8 | Very low | 132 Ų | 132 | 132.1 Ų | 132.1 | 80% | 0.8 | 81% | 0.808 | S | S | * | * | | | trans | -91.9 | 106.4 | 168 | 175.6 | 0 | 0 | 0 | 0 | 107.2 | | |
| 463 | S | 33.7 | Very low | 37.3 | Very low | 113 Ų | 113 | 130.3 Ų | 130.3 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | | | trans | -76.1 | 124.1 | 170.2 | -80.6 | 0 | 0 | 0 | 0 | 110.3 | | |
| 464 | I | 35.6 | Very low | 37.5 | Very low | 163 Ų | 163 | 131.7 Ų | 131.7 | 84% | 0.836 | 81% | 0.81 | S | S | * | * | | | trans | -88.9 | 109.6 | 166.3 | -44.2 | 174.9 | 0 | 0 | 0 | 106.3 | | |
| 465 | G | 34.8 | Very low | 37.6 | Very low | 73 Ų | 73 | 128.1 Ų | 128.1 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.7 | 133 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 466 | T | 38.7 | Very low | 37.6 | Very low | 138 Ų | 138 | 122.8 Ų | 122.8 | 85% | 0.847 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 148.9 | -170 | -34.9 | 0 | 0 | 0 | 0 | 115.2 | | |
| 467 | V | 35.8 | Very low | 37.9 | Very low | 126 Ų | 126 | 125.4 Ų | 125.4 | 76% | 0.764 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 156 | 168.5 | -172.1 | 0 | 0 | 0 | 0 | 112 | | |
| 468 | P | 43.1 | Very low | 38.2 | Very low | 121 Ų | 121 | 119.1 Ų | 119.1 | 79% | 0.786 | 80% | 0.797 | S | S | * | * | | | trans | -124.8 | 130.8 | 146.1 | 34.5 | -22.2 | 0 | 0 | 0 | 113.5 | | |
| 469 | S | 35.3 | Very low | 38.5 | Very low | 104 Ų | 104 | 122 Ų | 122 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | | | trans | -57.8 | 143.7 | 168.9 | -53.4 | 0 | 0 | 0 | 0 | 113.4 | | |
| 470 | R | 42.1 | Very low | 38.7 | Very low | 254 Ų | 254 | 123 Ų | 123 | 96% | 0.958 | 81% | 0.805 | S | S | * | * | | | trans | -136.8 | 119.9 | 145.3 | -78.6 | -164.3 | -168.6 | -154.9 | 3.7 | 110.7 | | |
| 471 | I | 42.1 | Very low | 39.2 | Very low | 170 Ų | 170 | 121.5 Ų | 121.5 | 87% | 0.872 | 81% | 0.806 | S | S | * | * | | | trans | -88.9 | 142.5 | 170.6 | -67.7 | 163.5 | 0 | 0 | 0 | 107.8 | | |
| 472 | G | 37.7 | Very low | 39.4 | Very low | 69 Ų | 69 | 122.9 Ų | 122.9 | 71% | 0.711 | 80% | 0.804 | S | S | * | * | | | trans | 156.2 | 126.1 | 155.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 473 | P | 47.6 | Very low | 40.1 | Very low | 128 Ų | 128 | 122.2 Ų | 122.2 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | | | trans | -119.6 | -179.8 | -151.9 | 38.8 | -22.5 | 0 | 0 | 0 | 116 | | |
| 474 | A | 40.3 | Very low | 40.3 | Very low | 106 Ų | 106 | 126.8 Ų | 126.8 | 88% | 0.876 | 80% | 0.804 | S | S | * | * | | | trans | 85.3 | 127 | 151.3 | 0 | 0 | 0 | 0 | 0 | 120 | | |
| 475 | G | 37.8 | Very low | 40.6 | Very low | 82 Ų | 82 | 124.8 Ų | 124.8 | 85% | 0.845 | 80% | 0.804 | S | S | * | * | | | trans | 130.2 | 113.2 | 140.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | | |
| 476 | G | 38.7 | Very low | 41 | Very low | 68 Ų | 68 | 127.5 Ų | 127.5 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | | | trans | 109.6 | 91 | 132.8 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 477 | S | 43.6 | Very low | 41.5 | Very low | 123 Ų | 123 | 130.8 Ų | 130.8 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | | | | 54.1 | 122.5 | 125.5 | 61.2 | 0 | 0 | 0 | 0 | 122.2 | | |
| 478 | G | 40.5 | Very low | 41.9 | Very low | 75 Ų | 75 | 134.6 Ų | 134.6 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | | | | 107.6 | 124.4 | 117.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | | |
| 479 | P | 44.9 | Very low | 42.4 | Very low | 129 Ų | 129 | 132.6 Ų | 132.6 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | | | trans | -102.4 | 154.2 | -170.7 | 38.6 | -31.9 | 0 | 0 | 0 | 114 | | |
| 480 | S | 39 | Very low | 43.3 | Very low | 100 Ų | 100 | 137.7 Ų | 137.7 | 70% | 0.699 | 82% | 0.819 | S | S | * | * | | | trans | -171.4 | 134.1 | 156.1 | -124.8 | 0 | 0 | 0 | 0 | 114.8 | | |
| 481 | Q | 43.4 | Very low | 43.4 | Very low | 179 Ų | 179 | 135.2 Ų | 135.2 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | | | trans | 86 | 101.8 | 142.3 | -66.4 | 169.3 | 47.7 | 0 | 0 | 120.4 | | |
| 482 | T | 40.3 | Very low | 43.7 | Very low | 127 Ų | 127 | 137.3 Ų | 137.3 | 78% | 0.779 | 84% | 0.837 | S | S | * | * | | | trans | -63.1 | 160.1 | 145.6 | 50.9 | 0 | 0 | 0 | 0 | 111.3 | | |
| 483 | P | 47.2 | Very low | 44 | Very low | 118 Ų | 118 | 140.8 Ų | 140.8 | 77% | 0.766 | 84% | 0.843 | S | S | * | * | | | | -147.6 | 153.7 | 92.8 | 33 | -13.3 | 0 | 0 | 0 | 116.8 | | |
| 484 | Y | 36.8 | Very low | 43.8 | Very low | 210 Ų | 210 | 141.4 Ų | 141.4 | 82% | 0.824 | 84% | 0.844 | S | S | * | * | | | trans | 2.6 | 135 | 152 | -81.2 | -96.6 | 0 | 0 | 0 | 120.5 | I486 | Y484-I486 HydrophobicContact CD1-CG1 4.26Š|
| 485 | S | 42.3 | Very low | 44 | Very low | 121 Ų | 121 | 143.4 Ų | 143.4 | 85% | 0.846 | 84% | 0.842 | S | S | * | * | | | trans | -140.6 | 116 | 144.5 | -163.8 | 0 | 0 | 0 | 0 | 111.6 | | |
| 486 | I | 42.9 | Very low | 44.4 | Very low | 130 Ų | 130 | 147 Ų | 147 | 67% | 0.667 | 84% | 0.842 | S | S | * | * | | | trans | -82.2 | 130.3 | 178.3 | -64.1 | 166.8 | 0 | 0 | 0 | 108.8 | Y484 K488 | Y484-I486 HydrophobicContact CD1-CG1 4.26Å; I486-K488 HydrophobicContact CG2-CG 4.47Å |
| 487 | K | 49.6 | Very low | 44.7 | Very low | 207 Ų | 207 | 151.9 Ų | 151.9 | 90% | 0.9 | 85% | 0.85 | S | S | * | * | | | trans | -120.1 | 112.9 | 156.9 | -87.3 | -172.8 | 177.7 | -179.9 | 0 | 110.1 | | |
| 488 | K | 45.2 | Very low | 44.8 | Very low | 206 Ų | 206 | 153.9 Ų | 153.9 | 90% | 0.896 | 85% | 0.85 | S | S | * | * | | | trans | -65 | 135.6 | 171.2 | -75.1 | 176.5 | 172.3 | 175.8 | 0 | 110.6 | I486 | I486-K488 HydrophobicContact CG2-CG 4.47Š|
| 489 | G | 52.8 | Low | 45.1 | Very low | 79 Ų | 79 | 159.5 Ų | 159.5 | 81% | 0.814 | 86% | 0.855 | S | S | * | * | | | trans | -128.8 | 124.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109 | | |
| 490 | K | 54.4 | Low | 45.1 | Very low | 210 Ų | 210 | 161.8 Ų | 161.8 | 91% | 0.913 | 86% | 0.857 | S | S | * | * | | | trans | -80.7 | 140.9 | -156.7 | -153.8 | 173.8 | -176.9 | -176 | 0 | 112.4 | | |
| 491 | K | 45.3 | Very low | 45.6 | Very low | 203 Ų | 203 | 167 Ų | 167 | 88% | 0.883 | 87% | 0.87 | S | S | * | * | | | trans | -87 | 136.3 | 160.7 | -87.3 | -174.1 | 175.9 | -176.4 | 0 | 109.9 | | |
| 492 | T | 47.2 | Very low | 45.8 | Very low | 214 Ų | 214 | 165.9 Ų | 165.9 | 100% | 1.313 | 87% | 0.873 | S | S | * | * | | | trans | -133.8 | 0 | 139.7 | 14.2 | 0 | 0 | 0 | 0 | 106.4 | | |