| 1 | M | 53.4 | Low | 78.6 | Confident | 239 Ų | 239 | 117.6 Ų | 117.6 | 100% | 1.177 | 65% | 0.651 | S | S | * | * | | | | 0 | 119.4 | 0 | -81.5 | 165.9 | 161.2 | 0 | 0 | 107.7 | C3 | M1-C3 PolarHBondContact O-N 2.91Š|
| 2 | V | 69.5 | Low | 79.8 | Confident | 137 Ų | 137 | 112.9 Ų | 112.9 | 83% | 0.83 | 63% | 0.632 | S | S | * | * | | | trans | -77.1 | 115.3 | 175.7 | -180 | 0 | 0 | 0 | 0 | 107.8 | Q4 | V2-Q4 VanDerWaalsContact C-N 3.26Å; V2-Q4 PolarHBondContact O-N 3.45Å |
| 3 | C | 62.2 | Low | 81 | Confident | 119 Ų | 119 | 111.4 Ų | 111.4 | 80% | 0.804 | 63% | 0.627 | S | S | * | * | | | trans | -70.2 | 87.9 | 168.7 | -70 | 0 | 0 | 0 | 0 | 108.6 | M1 D5 | M1-C3 PolarHBondContact O-N 2.91Å; C3-D5 PolarHBondContact O-N 3.22Å |
| 4 | Q | 65.5 | Low | 82 | Confident | 108 Ų | 108 | 107 Ų | 107 | 51% | 0.505 | 61% | 0.612 | S | S | . | * | | | trans | -65.6 | 114.8 | 165.6 | -92.3 | -171.9 | -13 | 0 | 0 | 109.1 | V2 T8 K9 | V2-Q4 VanDerWaalsContact C-N 3.26Å; V2-Q4 PolarHBondContact O-N 3.45Å; Q4-T8 WeakPolarHBondContact CB-OG1 3.47Å; Q4-K9 HydrophobicContact CB-CG 4.38Å |
| 5 | D | 77.5 | Confident | 83 | Confident | 116 Ų | 116 | 104.1 Ų | 104.1 | 62% | 0.62 | 61% | 0.606 | S | S | * | * | | | trans | -52.4 | 140.3 | 173.1 | -63 | -60.5 | 0 | 0 | 0 | 110.6 | C3 P7 T8 | C3-D5 PolarHBondContact O-N 3.22Å; D5-P7 VanDerWaalsContact C-N 3.31Å; D5-P7 HydrophobicContact CB-CG 4.08Å; D5-T8 PolarHBondContact O-N 3.26Å; D5-T8 PolarHBondContact O-OG1 3.35Å |
| 6 | A | 83.3 | Confident | 83.9 | Confident | 63 Ų | 63 | 103.8 Ų | 103.8 | 52% | 0.521 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -40.7 | -46.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | T8 K9 Y10 | A6-T8 VanDerWaalsContact C-N 3.31Å; A6-T8 PolarHBondContact O-N 3.26Å; A6-K9 PolarHBondContact O-N 3.33Å; A6-Y10 WeakPolarHBondContact O-CD2 3.46Å; A6-Y10 PolarHBondContact O-N 3.24Å |
| 7 | P | 89.1 | Confident | 84.7 | Confident | 92 Ų | 92 | 102.5 Ų | 102.5 | 60% | 0.597 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -56.5 | -35.3 | 177.6 | 21 | -35.6 | 0 | 0 | 0 | 114.9 | D5 K9 Y10 A11 | D5-P7 VanDerWaalsContact C-N 3.31Å; D5-P7 HydrophobicContact CB-CG 4.08Å; P7-K9 VanDerWaalsContact C-N 3.27Å; P7-K9 PolarHBondContact O-N 2.87Å; P7-Y10 PolarHBondContact O-N 3.13Å; P7-A11 WeakPolarHBondContact O-CB 3.46Å; P7-A11 PolarHBondContact O-N 3.38Å |
| 8 | T | 89.1 | Confident | 85.4 | Confident | 60 Ų | 60 | 103.8 Ų | 103.8 | 37% | 0.368 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -69.1 | -28.8 | -176.4 | 67.6 | 0 | 0 | 0 | 0 | 112.2 | Q4 D5 A6 S12 | Q4-T8 WeakPolarHBondContact CB-OG1 3.47Å; D5-T8 PolarHBondContact O-N 3.26Å; D5-T8 PolarHBondContact O-OG1 3.35Å; A6-T8 VanDerWaalsContact C-N 3.31Å; A6-T8 PolarHBondContact O-N 3.26Å; T8-S12 PolarHBondContact O-N 3.26Å; T8-S12 VanDerWaalsContact O-N 3.13Å; T8-S12 PolarHBondContact O-OG 3.02Å |
| 9 | K | 88.5 | Confident | 86.1 | Confident | 115 Ų | 115 | 100.1 Ų | 100.1 | 50% | 0.5 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -73.9 | -39 | 176.4 | -61.7 | -176.9 | -176.6 | 178.4 | 0 | 112.1 | Q4 A6 P7 S12 V13 | Q4-K9 HydrophobicContact CB-CG 4.38Å; A6-K9 PolarHBondContact O-N 3.33Å; P7-K9 VanDerWaalsContact C-N 3.27Å; P7-K9 PolarHBondContact O-N 2.87Å; K9-S12 PolarHBondContact O-OG 3.16Å; K9-S12 VanDerWaalsContact O-OG 3.11Å; K9-V13 VanDerWaalsContact O-CG2 3.31Å; K9-V13 WeakPolarHBondContact O-CG2 3.39Å; K9-V13 PolarHBondContact O-N 3.15Å; K9-V13 VanDerWaalsContact O-N 3.14Å |
| 10 | Y | 92.5 | Very high | 86.7 | Confident | 181 Ų | 181 | 98.9 Ų | 98.9 | 71% | 0.71 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67.1 | -39.8 | 173.5 | -69.6 | -69.7 | 0 | 0 | 0 | 111.6 | A6 P7 V13 A14 | A6-Y10 WeakPolarHBondContact O-CD2 3.46Å; A6-Y10 PolarHBondContact O-N 3.24Å; P7-Y10 PolarHBondContact O-N 3.13Å; Y10-V13 PolarHBondContact O-N 3.39Å; Y10-A14 VanDerWaalsContact O-CB 3.26Å; Y10-A14 WeakPolarHBondContact O-CB 3.41Å; Y10-A14 PolarHBondContact O-N 2.85Å |
| 11 | A | 93.8 | Very high | 87.2 | Confident | 64 Ų | 64 | 99.7 Ų | 99.7 | 53% | 0.529 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -61.9 | -44.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | P7 A14 A15 | P7-A11 WeakPolarHBondContact O-CB 3.46Å; P7-A11 PolarHBondContact O-N 3.38Å; A11-A14 PolarHBondContact O-N 2.9Å; A11-A15 WeakPolarHBondContact O-CB 3.11Å; A11-A15 PolarHBondContact O-N 3.22Å |
| 12 | S | 93.4 | Very high | 89.3 | Confident | 61 Ų | 61 | 90.9 Ų | 90.9 | 43% | 0.427 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.4 | -41.3 | 178.4 | 61.3 | 0 | 0 | 0 | 0 | 112.7 | T8 K9 A15 V16 | T8-S12 PolarHBondContact O-N 3.26Å; T8-S12 VanDerWaalsContact O-N 3.13Å; T8-S12 PolarHBondContact O-OG 3.02Å; K9-S12 PolarHBondContact O-OG 3.16Å; K9-S12 VanDerWaalsContact O-OG 3.11Å; S12-A15 PolarHBondContact O-N 2.99Å; S12-V16 WeakPolarHBondContact O-CG2 3.48Å; S12-V16 PolarHBondContact O-N 3.06Å |
| 13 | V | 94.7 | Very high | 90.7 | Very high | 93 Ų | 93 | 89.4 Ų | 89.4 | 56% | 0.564 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.7 | -43.9 | 174.9 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | K9 Y10 A15 V16 V17 | K9-V13 VanDerWaalsContact O-CG2 3.31Å; K9-V13 WeakPolarHBondContact O-CG2 3.39Å; K9-V13 PolarHBondContact O-N 3.15Å; K9-V13 VanDerWaalsContact O-N 3.14Å; Y10-V13 PolarHBondContact O-N 3.39Å; V13-A15 PolarHBondContact O-N 2.88Å; V13-V16 PolarHBondContact O-N 3.39Å; V13-V17 HydrophobicContact CG1-CG2 4.4Å; V13-V17 WeakPolarHBondContact O-CG2 3.41Å; V13-V17 PolarHBondContact O-N 3.06Å |
| 14 | A | 96.1 | Very high | 92.3 | Very high | 50 Ų | 50 | 87.9 Ų | 87.9 | 41% | 0.413 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.6 | -42.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y10 A11 V17 L18 | Y10-A14 VanDerWaalsContact O-CB 3.26Å; Y10-A14 WeakPolarHBondContact O-CB 3.41Å; Y10-A14 PolarHBondContact O-N 2.85Å; A11-A14 PolarHBondContact O-N 2.9Å; A14-V17 PolarHBondContact O-N 3.29Å; A14-L18 WeakPolarHBondContact O-CB 3.47Å; A14-L18 WeakPolarHBondContact O-CG 3.38Å; A14-L18 PolarHBondContact O-N 3.14Å |
| 15 | A | 96.7 | Very high | 93.9 | Very high | 63 Ų | 63 | 89.3 Ų | 89.3 | 52% | 0.521 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.9 | -43.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A11 S12 V13 L18 G19 | A11-A15 WeakPolarHBondContact O-CB 3.11Å; A11-A15 PolarHBondContact O-N 3.22Å; S12-A15 PolarHBondContact O-N 2.99Å; V13-A15 PolarHBondContact O-N 2.88Å; A15-L18 PolarHBondContact O-N 3.22Å; A15-G19 PolarHBondContact O-N 2.94Å |
| 16 | V | 97.5 | Very high | 94.8 | Very high | 99 Ų | 99 | 87.6 Ų | 87.6 | 60% | 0.6 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.8 | -43.7 | 176.3 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | S12 V13 G19 V20 | S12-V16 WeakPolarHBondContact O-CG2 3.48Å; S12-V16 PolarHBondContact O-N 3.06Å; V13-V16 PolarHBondContact O-N 3.39Å; V16-G19 PolarHBondContact O-N 2.67Å; V16-V20 HydrophobicContact CG1-CG2 4.48Å; V16-V20 WeakPolarHBondContact O-CG2 3.15Å; V16-V20 PolarHBondContact O-N 3.49Å |
| 17 | V | 97.8 | Very high | 95.4 | Very high | 83 Ų | 83 | 89.8 Ų | 89.8 | 50% | 0.503 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.7 | -44 | 177.9 | 171 | 0 | 0 | 0 | 0 | 111.4 | V13 A14 G19 V20 M21 | V13-V17 HydrophobicContact CG1-CG2 4.4Å; V13-V17 WeakPolarHBondContact O-CG2 3.41Å; V13-V17 PolarHBondContact O-N 3.06Å; A14-V17 PolarHBondContact O-N 3.29Å; V17-G19 PolarHBondContact O-N 3.49Å; V17-V20 PolarHBondContact O-N 3.36Å; V17-M21 HydrophobicContact CG1-CG 4.49Å; V17-M21 WeakPolarHBondContact O-CB 3.44Å; V17-M21 VanDerWaalsContact O-CG 3.3Å; V17-M21 WeakPolarHBondContact O-CG 3.27Å; V17-M21 PolarHBondContact O-N 3.45Å |
| 18 | L | 97.5 | Very high | 95.8 | Very high | 125 Ų | 125 | 90.6 Ų | 90.6 | 65% | 0.654 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.8 | -39.6 | 175.8 | -70.7 | 172.4 | 0 | 0 | 0 | 112.1 | A14 A15 M21 A22 | A14-L18 WeakPolarHBondContact O-CB 3.47Å; A14-L18 WeakPolarHBondContact O-CG 3.38Å; A14-L18 PolarHBondContact O-N 3.14Å; A15-L18 PolarHBondContact O-N 3.22Å; L18-M21 PolarHBondContact O-N 2.05Å; L18-A22 WeakPolarHBondContact O-CB 3.22Å; L18-A22 PolarHBondContact O-N 3.42Å |
| 19 | G | 98.1 | Very high | 96.1 | Very high | 33 Ų | 33 | 90 Ų | 90 | 34% | 0.34 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.6 | -46.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | A15 V16 V17 A22 I23 | A15-G19 PolarHBondContact O-N 2.94Å; V16-G19 PolarHBondContact O-N 2.67Å; V17-G19 PolarHBondContact O-N 3.49Å; G19-A22 PolarHBondContact O-N 3.17Å; G19-I23 WeakPolarHBondContact O-CG1 3.32Å; G19-I23 PolarHBondContact O-N 3.24Å |
| 20 | V | 97.9 | Very high | 96.5 | Very high | 76 Ų | 76 | 87.3 Ų | 87.3 | 46% | 0.461 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.3 | -42.8 | 176.3 | 172.3 | 0 | 0 | 0 | 0 | 111.2 | V16 V17 A22 I23 L24 | V16-V20 HydrophobicContact CG1-CG2 4.48Å; V16-V20 WeakPolarHBondContact O-CG2 3.15Å; V16-V20 PolarHBondContact O-N 3.49Å; V17-V20 PolarHBondContact O-N 3.36Å; V20-A22 PolarHBondContact O-N 3.42Å; V20-I23 PolarHBondContact O-N 3.19Å; V20-L24 HydrophobicContact CG1-CD1 3.95Å; V20-L24 HydrophobicContact CG1-CG 4.38Å; V20-L24 WeakPolarHBondContact O-CB 3.29Å; V20-L24 WeakPolarHBondContact O-CG 3.5Å; V20-L24 PolarHBondContact O-N 3.03Å |
| 21 | M | 97.7 | Very high | 96.6 | Very high | 117 Ų | 117 | 81.9 Ų | 81.9 | 58% | 0.576 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63 | -39.6 | 176.5 | -72.3 | -62.3 | -64.1 | 0 | 0 | 112.5 | V17 L18 L24 F25 | V17-M21 HydrophobicContact CG1-CG 4.49Å; V17-M21 WeakPolarHBondContact O-CB 3.44Å; V17-M21 VanDerWaalsContact O-CG 3.3Å; V17-M21 WeakPolarHBondContact O-CG 3.27Å; V17-M21 PolarHBondContact O-N 3.45Å; L18-M21 PolarHBondContact O-N 2.05Å; M21-L24 PolarHBondContact O-N 2.68Å; M21-F25 WeakPolarHBondContact O-CB 3.48Å; M21-F25 PolarHBondContact O-N 3Å |
| 22 | A | 97.9 | Very high | 96.7 | Very high | 53 Ų | 53 | 84.6 Ų | 84.6 | 44% | 0.438 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.9 | -43.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | L18 G19 V20 F25 C26 | L18-A22 WeakPolarHBondContact O-CB 3.22Å; L18-A22 PolarHBondContact O-N 3.42Å; G19-A22 PolarHBondContact O-N 3.17Å; V20-A22 PolarHBondContact O-N 3.42Å; A22-F25 PolarHBondContact O-N 2.89Å; A22-C26 PolarHBondContact O-N 3.16Å; A22-C26 PolarHBondContact O-SG 2.95Å |
| 23 | I | 97.5 | Very high | 96.8 | Very high | 107 Ų | 107 | 86 Ų | 86 | 55% | 0.549 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -44.1 | 176.8 | -67.7 | 165.4 | 0 | 0 | 0 | 111 | G19 V20 F25 C26 I27 | G19-I23 WeakPolarHBondContact O-CG1 3.32Å; G19-I23 PolarHBondContact O-N 3.24Å; V20-I23 PolarHBondContact O-N 3.19Å; I23-F25 VanDerWaalsContact C-N 3.33Å; I23-F25 PolarHBondContact O-N 2.65Å; I23-C26 PolarHBondContact O-N 2.87Å; I23-I27 HydrophobicContact CG2-CD1 3.79Å; I23-I27 HydrophobicContact CG2-CG1 4.47Å; I23-I27 WeakPolarHBondContact O-CG1 3.47Å; I23-I27 PolarHBondContact O-N 2.89Å |
| 24 | L | 97.2 | Very high | 96.8 | Very high | 86 Ų | 86 | 84.1 Ų | 84.1 | 45% | 0.45 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62 | -39.9 | 175.7 | -72.3 | 172.3 | 0 | 0 | 0 | 112 | V20 M21 I27 I28 | V20-L24 HydrophobicContact CG1-CD1 3.95Å; V20-L24 HydrophobicContact CG1-CG 4.38Å; V20-L24 WeakPolarHBondContact O-CB 3.29Å; V20-L24 WeakPolarHBondContact O-CG 3.5Å; V20-L24 PolarHBondContact O-N 3.03Å; M21-L24 PolarHBondContact O-N 2.68Å; L24-I27 PolarHBondContact O-N 3.26Å; L24-I28 WeakPolarHBondContact O-CG1 3.42Å; L24-I28 PolarHBondContact O-N 3.31Å |
| 25 | F | 97.2 | Very high | 96.8 | Very high | 139 Ų | 139 | 84.2 Ų | 84.2 | 61% | 0.61 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.1 | -45.5 | 174.1 | -175.3 | -101.9 | 0 | 0 | 0 | 111.6 | M21 A22 I23 I27 I28 V29 | M21-F25 WeakPolarHBondContact O-CB 3.48Å; M21-F25 PolarHBondContact O-N 3Å; A22-F25 PolarHBondContact O-N 2.89Å; I23-F25 VanDerWaalsContact C-N 3.33Å; I23-F25 PolarHBondContact O-N 2.65Å; F25-I27 VanDerWaalsContact C-N 3.34Å; F25-I27 PolarHBondContact O-N 2.74Å; F25-I28 PolarHBondContact O-N 3.18Å; F25-I28 VanDerWaalsContact O-N 3.17Å; F25-V29 HydrophobicContact CD1-CG2 4.1Å; F25-V29 HydrophobicContact CD2-CG2 4.21Å; F25-V29 HydrophobicContact CE1-CG2 3.75Å; F25-V29 HydrophobicContact CE2-CG2 3.87Å; F25-V29 HydrophobicContact CG-CG2 4.33Å; F25-V29 HydrophobicContact CZ-CG2 3.63Å; F25-V29 WeakPolarHBondContact O-CB 3.29Å; F25-V29 WeakPolarHBondContact O-CG2 3.36Å; F25-V29 PolarHBondContact O-N 3.46Å |
| 26 | C | 96.9 | Very high | 96.8 | Very high | 80 Ų | 80 | 87.1 Ų | 87.1 | 54% | 0.541 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.9 | -41.3 | 174.8 | -67.8 | 0 | 0 | 0 | 0 | 112.7 | A22 I23 I28 V29 A30 | A22-C26 PolarHBondContact O-N 3.16Å; A22-C26 PolarHBondContact O-SG 2.95Å; I23-C26 PolarHBondContact O-N 2.87Å; C26-I28 VanDerWaalsContact C-N 3.28Å; C26-I28 PolarHBondContact O-N 3.07Å; C26-V29 PolarHBondContact O-N 3.46Å; C26-A30 VanDerWaalsContact O-CB 3.24Å; C26-A30 WeakPolarHBondContact O-CB 3.21Å; C26-A30 PolarHBondContact O-N 3.16Å |
| 27 | I | 96.6 | Very high | 96.7 | Very high | 108 Ų | 108 | 85.6 Ų | 85.6 | 55% | 0.554 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.5 | -28.2 | 177.7 | -69.1 | 167.5 | 0 | 0 | 0 | 112.1 | I23 L24 F25 P31 | I23-I27 HydrophobicContact CG2-CD1 3.79Å; I23-I27 HydrophobicContact CG2-CG1 4.47Å; I23-I27 WeakPolarHBondContact O-CG1 3.47Å; I23-I27 PolarHBondContact O-N 2.89Å; L24-I27 PolarHBondContact O-N 3.26Å; F25-I27 VanDerWaalsContact C-N 3.34Å; F25-I27 PolarHBondContact O-N 2.74Å; I27-P31 WeakPolarHBondContact O-CD 3.36Å; I27-P31 VanDerWaalsContact O-CG 3.26Å; I27-P31 WeakPolarHBondContact O-CG 3.26Å |
| 28 | I | 96.2 | Very high | 96.5 | Very high | 110 Ų | 110 | 87.9 Ų | 87.9 | 56% | 0.564 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -83.5 | -39.2 | 176 | -67 | 165.2 | 0 | 0 | 0 | 111.5 | L24 F25 C26 P31 Q32 | L24-I28 WeakPolarHBondContact O-CG1 3.42Å; L24-I28 PolarHBondContact O-N 3.31Å; F25-I28 PolarHBondContact O-N 3.18Å; F25-I28 VanDerWaalsContact O-N 3.17Å; C26-I28 VanDerWaalsContact C-N 3.28Å; C26-I28 PolarHBondContact O-N 3.07Å; I28-P31 WeakPolarHBondContact O-CD 3.47Å; I28-P31 WeakPolarHBondContact O-CG 3.37Å; I28-Q32 VanDerWaalsContact O-CG 3.28Å; I28-Q32 WeakPolarHBondContact O-CG 3.21Å |
| 29 | V | 97.1 | Very high | 96.4 | Very high | 46 Ų | 46 | 87.2 Ų | 87.2 | 28% | 0.279 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -78 | -38 | -176.2 | 171.4 | 0 | 0 | 0 | 0 | 112.7 | F25 C26 Q32 I33 | F25-V29 HydrophobicContact CD1-CG2 4.1Å; F25-V29 HydrophobicContact CD2-CG2 4.21Å; F25-V29 HydrophobicContact CE1-CG2 3.75Å; F25-V29 HydrophobicContact CE2-CG2 3.87Å; F25-V29 HydrophobicContact CG-CG2 4.33Å; F25-V29 HydrophobicContact CZ-CG2 3.63Å; F25-V29 WeakPolarHBondContact O-CB 3.29Å; F25-V29 WeakPolarHBondContact O-CG2 3.36Å; F25-V29 PolarHBondContact O-N 3.46Å; C26-V29 PolarHBondContact O-N 3.46Å; V29-Q32 WeakPolarHBondContact O-CB 3.43Å; V29-Q32 PolarHBondContact O-N 2.73Å; V29-Q32 VanDerWaalsContact O-N 3.15Å; V29-I33 HydrophobicContact CG1-CD1 3.58Å; V29-I33 HydrophobicContact CG1-CG1 4.05Å; V29-I33 WeakPolarHBondContact O-CG1 3.42Å; V29-I33 PolarHBondContact O-N 3.04Å |
| 30 | A | 95.7 | Very high | 96.3 | Very high | 60 Ų | 60 | 90.6 Ų | 90.6 | 50% | 0.496 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -54.4 | -47.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | C26 S34 | C26-A30 VanDerWaalsContact O-CB 3.24Å; C26-A30 WeakPolarHBondContact O-CB 3.21Å; C26-A30 PolarHBondContact O-N 3.16Å; A30-S34 PolarHBondContact O-N 3.47Å |
| 31 | P | 95.9 | Very high | 96.1 | Very high | 66 Ų | 66 | 95 Ų | 95 | 43% | 0.429 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -71.1 | -28 | 177.2 | 27.2 | -34.9 | 0 | 0 | 0 | 113.5 | I27 I28 S34 A35 | I27-P31 WeakPolarHBondContact O-CD 3.36Å; I27-P31 VanDerWaalsContact O-CG 3.26Å; I27-P31 WeakPolarHBondContact O-CG 3.26Å; I28-P31 WeakPolarHBondContact O-CD 3.47Å; I28-P31 WeakPolarHBondContact O-CG 3.37Å; P31-S34 VanDerWaalsContact CA-OG 3.3Å; P31-S34 WeakPolarHBondContact CA-OG 3.43Å; P31-S34 PolarHBondContact O-N 3.42Å; P31-S34 PolarHBondContact O-OG 3.42Å; P31-A35 WeakPolarHBondContact O-CB 3.46Å; P31-A35 PolarHBondContact O-N 3.32Å |
| 32 | Q | 95.7 | Very high | 96 | Very high | 122 Ų | 122 | 93.8 Ų | 93.8 | 57% | 0.57 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.1 | -50.2 | 173.9 | -65.9 | -75 | -51.8 | 0 | 0 | 110.4 | I28 V29 S34 A35 E36 | I28-Q32 VanDerWaalsContact O-CG 3.28Å; I28-Q32 WeakPolarHBondContact O-CG 3.21Å; V29-Q32 WeakPolarHBondContact O-CB 3.43Å; V29-Q32 PolarHBondContact O-N 2.73Å; V29-Q32 VanDerWaalsContact O-N 3.15Å; Q32-S34 VanDerWaalsContact C-N 3.31Å; Q32-S34 PolarHBondContact O-N 3.36Å; Q32-A35 WeakPolarHBondContact O-CB 3.37Å; Q32-A35 PolarHBondContact O-N 2.8Å; Q32-A35 VanDerWaalsContact O-N 3.15Å; Q32-E36 PolarHBondContact O-N 3.43Å |
| 33 | I | 95.6 | Very high | 95.9 | Very high | 89 Ų | 89 | 97 Ų | 97 | 46% | 0.456 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.5 | -41 | 175.2 | -63.4 | 173.4 | 0 | 0 | 0 | 110.7 | V29 A35 E36 V37 | V29-I33 HydrophobicContact CG1-CD1 3.58Å; V29-I33 HydrophobicContact CG1-CG1 4.05Å; V29-I33 WeakPolarHBondContact O-CG1 3.42Å; V29-I33 PolarHBondContact O-N 3.04Å; I33-A35 VanDerWaalsContact C-N 3.28Å; I33-A35 PolarHBondContact O-N 3.28Å; I33-E36 PolarHBondContact O-N 3.18Å; I33-V37 HydrophobicContact CG2-CG2 4.19Å; I33-V37 WeakPolarHBondContact O-CB 3.39Å; I33-V37 VanDerWaalsContact O-CG2 3.26Å; I33-V37 WeakPolarHBondContact O-CG2 3.48Å; I33-V37 PolarHBondContact O-N 3.23Å |
| 34 | S | 94.6 | Very high | 95.9 | Very high | 55 Ų | 55 | 96.8 Ų | 96.8 | 39% | 0.385 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.7 | -31.4 | 178.6 | 72.2 | 0 | 0 | 0 | 0 | 113.1 | A30 P31 Q32 Q38 | A30-S34 PolarHBondContact O-N 3.47Å; P31-S34 VanDerWaalsContact CA-OG 3.3Å; P31-S34 WeakPolarHBondContact CA-OG 3.43Å; P31-S34 PolarHBondContact O-N 3.42Å; P31-S34 PolarHBondContact O-OG 3.42Å; Q32-S34 VanDerWaalsContact C-N 3.31Å; Q32-S34 PolarHBondContact O-N 3.36Å; S34-Q38 WeakPolarHBondContact O-CB 3.5Å; S34-Q38 WeakPolarHBondContact O-CG 3.4Å; S34-Q38 PolarHBondContact O-N 3.44Å |
| 35 | A | 95.3 | Very high | 95.8 | Very high | 52 Ų | 52 | 96.1 Ų | 96.1 | 43% | 0.43 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -71.5 | -46.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | P31 Q32 I33 V37 Q38 D39 | P31-A35 WeakPolarHBondContact O-CB 3.46Å; P31-A35 PolarHBondContact O-N 3.32Å; Q32-A35 WeakPolarHBondContact O-CB 3.37Å; Q32-A35 PolarHBondContact O-N 2.8Å; Q32-A35 VanDerWaalsContact O-N 3.15Å; I33-A35 VanDerWaalsContact C-N 3.28Å; I33-A35 PolarHBondContact O-N 3.28Å; A35-V37 VanDerWaalsContact C-N 3.33Å; A35-V37 PolarHBondContact O-N 3.32Å; A35-Q38 PolarHBondContact O-N 3.48Å; A35-D39 PolarHBondContact O-N 3.48Å |
| 36 | E | 96.1 | Very high | 95.7 | Very high | 124 Ų | 124 | 95.5 Ų | 95.5 | 58% | 0.579 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.2 | -43.7 | 173.5 | -69.4 | 177.9 | 177.6 | 0 | 0 | 111.6 | Q32 I33 Q38 D39 I40 | Q32-E36 PolarHBondContact O-N 3.43Å; I33-E36 PolarHBondContact O-N 3.18Å; E36-Q38 PolarHBondContact O-N 3.19Å; E36-D39 PolarHBondContact O-N 2.96Å; E36-I40 WeakPolarHBondContact O-CD1 3.19Å; E36-I40 VanDerWaalsContact O-CG1 3.3Å; E36-I40 WeakPolarHBondContact O-CG1 3.14Å; E36-I40 PolarHBondContact O-N 3.41Å |
| 37 | V | 95.7 | Very high | 95.7 | Very high | 66 Ų | 66 | 97.5 Ų | 97.5 | 40% | 0.4 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.1 | -40.8 | 176.3 | 168.8 | 0 | 0 | 0 | 0 | 111.3 | I33 A35 I40 W41 | I33-V37 HydrophobicContact CG2-CG2 4.19Å; I33-V37 WeakPolarHBondContact O-CB 3.39Å; I33-V37 VanDerWaalsContact O-CG2 3.26Å; I33-V37 WeakPolarHBondContact O-CG2 3.48Å; I33-V37 PolarHBondContact O-N 3.23Å; A35-V37 VanDerWaalsContact C-N 3.33Å; A35-V37 PolarHBondContact O-N 3.32Å; V37-I40 PolarHBondContact O-N 3.27Å; V37-W41 PolarHBondContact O-N 2.86Å |
| 38 | Q | 93.9 | Very high | 95.6 | Very high | 131 Ų | 131 | 96.4 Ų | 96.4 | 61% | 0.612 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.7 | -40.5 | 175.4 | -80.2 | 173.3 | 1.2 | 0 | 0 | 112.5 | S34 A35 E36 W41 T42 | S34-Q38 WeakPolarHBondContact O-CB 3.5Å; S34-Q38 WeakPolarHBondContact O-CG 3.4Å; S34-Q38 PolarHBondContact O-N 3.44Å; A35-Q38 PolarHBondContact O-N 3.48Å; E36-Q38 PolarHBondContact O-N 3.19Å; Q38-W41 PolarHBondContact O-N 3.31Å; Q38-T42 PolarHBondContact O-N 3.42Å; Q38-T42 PolarHBondContact O-OG1 2.95Å |
| 39 | D | 95.9 | Very high | 95.5 | Very high | 112 Ų | 112 | 96.9 Ų | 96.9 | 60% | 0.599 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.5 | -51.4 | 176.3 | -159.6 | 33.2 | 0 | 0 | 0 | 110.5 | A35 E36 W41 T42 E43 | A35-D39 PolarHBondContact O-N 3.48Å; E36-D39 PolarHBondContact O-N 2.96Å; D39-W41 VanDerWaalsContact C-N 3.33Å; D39-W41 PolarHBondContact O-N 3.45Å; D39-T42 PolarHBondContact O-N 2.84Å; D39-T42 PolarHBondContact O-OG1 2.86Å; D39-E43 PolarHBondContact O-N 3.13Å |
| 40 | I | 94.9 | Very high | 95.4 | Very high | 103 Ų | 103 | 99.4 Ų | 99.4 | 53% | 0.528 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.8 | -41.9 | 175.4 | -65.6 | 163.3 | 0 | 0 | 0 | 111.8 | E36 V37 T42 E43 F44 | E36-I40 WeakPolarHBondContact O-CD1 3.19Å; E36-I40 VanDerWaalsContact O-CG1 3.3Å; E36-I40 WeakPolarHBondContact O-CG1 3.14Å; E36-I40 PolarHBondContact O-N 3.41Å; V37-I40 PolarHBondContact O-N 3.27Å; I40-T42 VanDerWaalsContact C-N 3.33Å; I40-T42 PolarHBondContact O-N 3.39Å; I40-E43 PolarHBondContact O-N 2.68Å; I40-F44 WeakPolarHBondContact O-CB 3.48Å; I40-F44 PolarHBondContact O-N 3.4Å |
| 41 | W | 95.5 | Very high | 95.4 | Very high | 170 Ų | 170 | 103.8 Ų | 103.8 | 64% | 0.644 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.7 | -39.5 | 174.8 | -82.4 | 112.9 | 0 | 0 | 0 | 111.7 | V37 Q38 D39 F44 D45 | V37-W41 PolarHBondContact O-N 2.86Å; Q38-W41 PolarHBondContact O-N 3.31Å; D39-W41 VanDerWaalsContact C-N 3.33Å; D39-W41 PolarHBondContact O-N 3.45Å; W41-F44 HydrophobicContact CZ3-CD1 4.48Å; W41-D45 WeakPolarHBondContact O-CB 3.12Å; W41-D45 PolarHBondContact O-N 3.41Å |
| 42 | T | 95.5 | Very high | 95.3 | Very high | 90 Ų | 90 | 109.2 Ų | 109.2 | 55% | 0.552 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -70.6 | -35.9 | 178 | 56.2 | 0 | 0 | 0 | 0 | 113.4 | Q38 D39 I40 Q46 | Q38-T42 PolarHBondContact O-N 3.42Å; Q38-T42 PolarHBondContact O-OG1 2.95Å; D39-T42 PolarHBondContact O-N 2.84Å; D39-T42 PolarHBondContact O-OG1 2.86Å; I40-T42 VanDerWaalsContact C-N 3.33Å; I40-T42 PolarHBondContact O-N 3.39Å; T42-Q46 WeakPolarHBondContact O-CB 3.26Å; T42-Q46 PolarHBondContact O-N 3.29Å |
| 43 | E | 96 | Very high | 95.2 | Very high | 121 Ų | 121 | 106.2 Ų | 106.2 | 57% | 0.565 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.4 | -51.6 | 172.7 | -175.2 | 174.2 | -150.4 | 0 | 0 | 110.8 | D39 I40 D45 Q46 E47 | D39-E43 PolarHBondContact O-N 3.13Å; I40-E43 PolarHBondContact O-N 2.68Å; E43-D45 VanDerWaalsContact C-N 3.31Å; E43-D45 PolarHBondContact O-N 3.43Å; E43-Q46 WeakPolarHBondContact O-CA 3.21Å; E43-Q46 WeakPolarHBondContact O-CB 3.5Å; E43-Q46 PolarHBondContact O-N 2.61Å; E43-E47 PolarHBondContact O-N 3.15Å |
| 44 | F | 96 | Very high | 95.2 | Very high | 102 Ų | 102 | 105 Ų | 105 | 45% | 0.447 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.6 | -39.1 | 178.1 | -175.9 | -107.8 | 0 | 0 | 0 | 112.7 | I40 W41 Q46 E47 M48 | I40-F44 WeakPolarHBondContact O-CB 3.48Å; I40-F44 PolarHBondContact O-N 3.4Å; W41-F44 HydrophobicContact CZ3-CD1 4.48Å; F44-Q46 VanDerWaalsContact C-N 3.27Å; F44-Q46 PolarHBondContact O-N 3.18Å; F44-E47 PolarHBondContact O-N 3.38Å; F44-M48 HydrophobicContact CD1-CE 3.6Å; F44-M48 HydrophobicContact CD1-CG 4.35Å; F44-M48 HydrophobicContact CD1-SD 4.16Å; F44-M48 HydrophobicContact CE1-CE 3.44Å; F44-M48 VanDerWaalsContact CE1-CE 3.44Å; F44-M48 HydrophobicContact CE1-CG 3.97Å; F44-M48 HydrophobicContact CE1-SD 3.46Å; F44-M48 WeakPolarHBondContact CE1-SD 3.21Å; F44-M48 HydrophobicContact CE2-CG 4.44Å; F44-M48 HydrophobicContact CZ-CE 4.37Å; F44-M48 HydrophobicContact CZ-CG 4.02Å; F44-M48 HydrophobicContact CZ-SD 3.84Å; F44-M48 WeakPolarHBondContact O-CB 3.34Å; F44-M48 WeakPolarHBondContact O-CG 3.41Å; F44-M48 PolarHBondContact O-N 3.37Å |
| 45 | D | 95.9 | Very high | 95.3 | Very high | 73 Ų | 73 | 104.4 Ų | 104.4 | 39% | 0.39 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -73.9 | -18.3 | 178.1 | -153.6 | 50.4 | 0 | 0 | 0 | 112.3 | W41 E43 M48 K49 | W41-D45 WeakPolarHBondContact O-CB 3.12Å; W41-D45 PolarHBondContact O-N 3.41Å; E43-D45 VanDerWaalsContact C-N 3.31Å; E43-D45 PolarHBondContact O-N 3.43Å; D45-M48 WeakPolarHBondContact OD1-CE 3.35Å; D45-K49 WeakPolarHBondContact O-CD 3.48Å; D45-K49 WeakPolarHBondContact O-CE 3.3Å; D45-K49 WeakPolarHBondContact O-CG 3.48Å; D45-K49 PolarHBondContact O-NZ 3.18Å; D45-K49 IonicContact OD2-NZ 2.72Å; D45-K49 PolarHBondContact OD2-NZ 3.44Å |
| 46 | Q | 95.5 | Very high | 95.3 | Very high | 126 Ų | 126 | 106.9 Ų | 106.9 | 59% | 0.589 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -79.8 | -49.5 | 167.3 | -176.4 | 176.6 | -39.7 | 0 | 0 | 110.8 | T42 E43 F44 M48 K49 D50 | T42-Q46 WeakPolarHBondContact O-CB 3.26Å; T42-Q46 PolarHBondContact O-N 3.29Å; E43-Q46 WeakPolarHBondContact O-CA 3.21Å; E43-Q46 WeakPolarHBondContact O-CB 3.5Å; E43-Q46 PolarHBondContact O-N 2.61Å; F44-Q46 VanDerWaalsContact C-N 3.27Å; F44-Q46 PolarHBondContact O-N 3.18Å; Q46-M48 VanDerWaalsContact C-N 3.29Å; Q46-M48 PolarHBondContact O-N 3Å; Q46-K49 WeakPolarHBondContact O-CA 3.36Å; Q46-K49 WeakPolarHBondContact O-CB 3.42Å; Q46-K49 PolarHBondContact O-N 3.27Å; Q46-D50 PolarHBondContact O-N 3.38Å |
| 47 | E | 95.5 | Very high | 95.2 | Very high | 122 Ų | 122 | 105.4 Ų | 105.4 | 57% | 0.57 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -57.4 | -40 | 176.5 | -69.4 | -162.5 | 143 | 0 | 0 | 112.3 | E43 F44 K49 D50 F51 | E43-E47 PolarHBondContact O-N 3.15Å; F44-E47 PolarHBondContact O-N 3.38Å; E47-K49 VanDerWaalsContact C-N 3.32Å; E47-K49 PolarHBondContact O-N 3.14Å; E47-D50 PolarHBondContact O-N 3.37Å; E47-F51 WeakPolarHBondContact O-CB 3.28Å; E47-F51 PolarHBondContact O-N 3.22Å |
| 48 | M | 94.6 | Very high | 95.1 | Very high | 85 Ų | 85 | 107 Ų | 107 | 42% | 0.419 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.2 | -34.9 | 174.4 | -79.9 | -161.8 | -63.5 | 0 | 0 | 112.9 | F44 D45 Q46 R52 | F44-M48 HydrophobicContact CD1-CE 3.6Å; F44-M48 HydrophobicContact CD1-CG 4.35Å; F44-M48 HydrophobicContact CD1-SD 4.16Å; F44-M48 HydrophobicContact CE1-CE 3.44Å; F44-M48 VanDerWaalsContact CE1-CE 3.44Å; F44-M48 HydrophobicContact CE1-CG 3.97Å; F44-M48 HydrophobicContact CE1-SD 3.46Å; F44-M48 WeakPolarHBondContact CE1-SD 3.21Å; F44-M48 HydrophobicContact CE2-CG 4.44Å; F44-M48 HydrophobicContact CZ-CE 4.37Å; F44-M48 HydrophobicContact CZ-CG 4.02Å; F44-M48 HydrophobicContact CZ-SD 3.84Å; F44-M48 WeakPolarHBondContact O-CB 3.34Å; F44-M48 WeakPolarHBondContact O-CG 3.41Å; F44-M48 PolarHBondContact O-N 3.37Å; D45-M48 WeakPolarHBondContact OD1-CE 3.35Å; Q46-M48 VanDerWaalsContact C-N 3.29Å; Q46-M48 PolarHBondContact O-N 3Å; M48-R52 WeakPolarHBondContact O-CB 3.49Å; M48-R52 PolarHBondContact O-N 3.23Å |
| 49 | K | 94.8 | Very high | 95 | Very high | 120 Ų | 120 | 108.5 Ų | 108.5 | 52% | 0.522 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -69.5 | -42.8 | 175.9 | -71.8 | 163.8 | -165.8 | 126.5 | 0 | 110.6 | D45 Q46 E47 R52 A53 | D45-K49 WeakPolarHBondContact O-CD 3.48Å; D45-K49 WeakPolarHBondContact O-CE 3.3Å; D45-K49 WeakPolarHBondContact O-CG 3.48Å; D45-K49 PolarHBondContact O-NZ 3.18Å; D45-K49 IonicContact OD2-NZ 2.72Å; D45-K49 PolarHBondContact OD2-NZ 3.44Å; Q46-K49 WeakPolarHBondContact O-CA 3.36Å; Q46-K49 WeakPolarHBondContact O-CB 3.42Å; Q46-K49 PolarHBondContact O-N 3.27Å; E47-K49 VanDerWaalsContact C-N 3.32Å; E47-K49 PolarHBondContact O-N 3.14Å; K49-R52 PolarHBondContact O-N 2.98Å; K49-A53 WeakPolarHBondContact O-CB 3.3Å; K49-A53 PolarHBondContact O-N 2.88Å |
| 50 | D | 95 | Very high | 94.8 | Very high | 98 Ų | 98 | 108.2 Ų | 108.2 | 52% | 0.524 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.2 | -43.3 | 177.6 | -69.8 | -18.2 | 0 | 0 | 0 | 111.7 | Q46 E47 R52 A53 S54 | Q46-D50 PolarHBondContact O-N 3.38Å; E47-D50 PolarHBondContact O-N 3.37Å; D50-R52 VanDerWaalsContact C-N 3.33Å; D50-R52 PolarHBondContact O-N 3.45Å; D50-A53 PolarHBondContact O-N 2.96Å; D50-S54 WeakPolarHBondContact O-CB 3.37Å; D50-S54 PolarHBondContact O-N 3.49Å |
| 51 | F | 94.9 | Very high | 94.6 | Very high | 152 Ų | 152 | 108 Ų | 108 | 67% | 0.667 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.7 | -38.9 | 173.9 | -172 | -92.4 | 0 | 0 | 0 | 112.1 | E47 S55 | E47-F51 WeakPolarHBondContact O-CB 3.28Å; E47-F51 PolarHBondContact O-N 3.22Å; F51-S55 VanDerWaalsContact CE1-OG 3.29Å; F51-S55 WeakPolarHBondContact CE1-OG 3.39Å; F51-S55 VanDerWaalsContact O-CB 3.26Å; F51-S55 WeakPolarHBondContact O-CB 3.46Å; F51-S55 PolarHBondContact O-N 3.28Å; F51-S55 PolarHBondContact O-OG 3.31Å |
| 52 | R | 94.4 | Very high | 94.3 | Very high | 180 Ų | 180 | 105.3 Ų | 105.3 | 68% | 0.679 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -68.6 | -40 | 176.5 | -167.4 | 175.7 | -164.2 | 165.9 | 4.4 | 112 | M48 K49 D50 N56 | M48-R52 WeakPolarHBondContact O-CB 3.49Å; M48-R52 PolarHBondContact O-N 3.23Å; K49-R52 PolarHBondContact O-N 2.98Å; D50-R52 VanDerWaalsContact C-N 3.33Å; D50-R52 PolarHBondContact O-N 3.45Å; R52-N56 WeakPolarHBondContact O-CB 3.26Å; R52-N56 PolarHBondContact O-N 3.28Å; R52-N56 PolarHBondContact O-ND2 3.43Å |
| 53 | A | 94.5 | Very high | 93.8 | Very high | 60 Ų | 60 | 106 Ų | 106 | 50% | 0.496 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.2 | -47.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | K49 D50 N56 L57 | K49-A53 WeakPolarHBondContact O-CB 3.3Å; K49-A53 PolarHBondContact O-N 2.88Å; D50-A53 PolarHBondContact O-N 2.96Å; A53-N56 PolarHBondContact O-N 3.41Å; A53-L57 WeakPolarHBondContact O-CB 3.38Å; A53-L57 PolarHBondContact O-N 3.45Å |
| 54 | S | 95.3 | Very high | 93.1 | Very high | 62 Ų | 62 | 107 Ų | 107 | 43% | 0.434 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61 | -46.2 | 175.8 | -176.3 | 0 | 0 | 0 | 0 | 112.4 | D50 N56 L57 I58 | D50-S54 WeakPolarHBondContact O-CB 3.37Å; D50-S54 PolarHBondContact O-N 3.49Å; S54-N56 PolarHBondContact O-N 2.89Å; S54-L57 PolarHBondContact O-N 3.44Å; S54-I58 WeakPolarHBondContact O-CG1 3.24Å; S54-I58 PolarHBondContact O-N 3.34Å |
| 55 | S | 96 | Very high | 92.3 | Very high | 44 Ų | 44 | 107.3 Ų | 107.3 | 31% | 0.308 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.5 | -42.5 | 177.4 | -62.4 | 0 | 0 | 0 | 0 | 112.3 | F51 I58 W59 | F51-S55 VanDerWaalsContact CE1-OG 3.29Å; F51-S55 WeakPolarHBondContact CE1-OG 3.39Å; F51-S55 VanDerWaalsContact O-CB 3.26Å; F51-S55 WeakPolarHBondContact O-CB 3.46Å; F51-S55 PolarHBondContact O-N 3.28Å; F51-S55 PolarHBondContact O-OG 3.31Å; S55-I58 PolarHBondContact O-N 3.49Å; S55-W59 WeakPolarHBondContact O-CB 3.33Å; S55-W59 PolarHBondContact O-N 2.77Å |
| 56 | N | 95.2 | Very high | 91 | Very high | 103 Ų | 103 | 110.7 Ų | 110.7 | 55% | 0.551 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.9 | -40.9 | 176.2 | -73 | -16.2 | 0 | 0 | 0 | 111.7 | R52 A53 S54 W59 E60 | R52-N56 WeakPolarHBondContact O-CB 3.26Å; R52-N56 PolarHBondContact O-N 3.28Å; R52-N56 PolarHBondContact O-ND2 3.43Å; A53-N56 PolarHBondContact O-N 3.41Å; S54-N56 PolarHBondContact O-N 2.89Å; N56-W59 PolarHBondContact O-N 3.43Å; N56-E60 WeakPolarHBondContact O-CB 2.98Å; N56-E60 PolarHBondContact O-N 3.32Å |
| 57 | L | 94.6 | Very high | 89.6 | Confident | 93 Ų | 93 | 111 Ų | 111 | 49% | 0.487 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.5 | -46.8 | 176.9 | -174.8 | 154.8 | 0 | 0 | 0 | 111.2 | A53 S54 W59 E60 E61 | A53-L57 WeakPolarHBondContact O-CB 3.38Å; A53-L57 PolarHBondContact O-N 3.45Å; S54-L57 PolarHBondContact O-N 3.44Å; L57-W59 VanDerWaalsContact C-N 3.28Å; L57-W59 PolarHBondContact O-N 2.9Å; L57-E60 PolarHBondContact O-N 3.19Å; L57-E61 HydrophobicContact CD2-CG 4.14Å; L57-E61 PolarHBondContact O-N 3.38Å |
| 58 | I | 94 | Very high | 87.9 | Confident | 101 Ų | 101 | 111 Ų | 111 | 52% | 0.518 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.3 | -38.3 | 176 | -66.5 | 165 | 0 | 0 | 0 | 110.9 | S54 S55 E61 L62 | S54-I58 WeakPolarHBondContact O-CG1 3.24Å; S54-I58 PolarHBondContact O-N 3.34Å; S55-I58 PolarHBondContact O-N 3.49Å; I58-E61 PolarHBondContact O-N 3.41Å; I58-L62 VanDerWaalsContact O-CB 3.27Å; I58-L62 WeakPolarHBondContact O-CB 3.41Å; I58-L62 PolarHBondContact O-N 2.86Å |
| 59 | W | 92.1 | Very high | 86.1 | Confident | 162 Ų | 162 | 118.4 Ų | 118.4 | 61% | 0.614 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -68.8 | -38.2 | 177.3 | -158.1 | 83.4 | 0 | 0 | 0 | 112.2 | S55 N56 L57 L62 M63 | S55-W59 WeakPolarHBondContact O-CB 3.33Å; S55-W59 PolarHBondContact O-N 2.77Å; N56-W59 PolarHBondContact O-N 3.43Å; L57-W59 VanDerWaalsContact C-N 3.28Å; L57-W59 PolarHBondContact O-N 2.9Å; W59-L62 PolarHBondContact O-N 2.87Å; W59-M63 HydrophobicContact CD2-CE 4.35Å; W59-M63 HydrophobicContact CD2-CG 4.36Å; W59-M63 HydrophobicContact CE3-CE 4.44Å; W59-M63 HydrophobicContact CE3-CG 4.07Å; W59-M63 HydrophobicContact CH2-CE 3.47Å; W59-M63 VanDerWaalsContact CH2-CE 3.47Å; W59-M63 HydrophobicContact CZ2-CE 3.3Å; W59-M63 HydrophobicContact CZ3-CE 4.04Å; W59-M63 HydrophobicContact CZ3-CG 4.15Å; W59-M63 WeakPolarHBondContact O-CB 3.32Å; W59-M63 VanDerWaalsContact O-CG 3.32Å; W59-M63 WeakPolarHBondContact O-CG 3.43Å; W59-M63 PolarHBondContact O-N 3.33Å |
| 60 | E | 91.7 | Very high | 84.1 | Confident | 105 Ų | 105 | 117.9 Ų | 117.9 | 49% | 0.491 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66 | -41 | 173.2 | -165.4 | -172.5 | 159.6 | 0 | 0 | 111.8 | N56 L57 M63 K64 | N56-E60 WeakPolarHBondContact O-CB 2.98Å; N56-E60 PolarHBondContact O-N 3.32Å; L57-E60 PolarHBondContact O-N 3.19Å; E60-M63 PolarHBondContact O-N 3.1Å; E60-K64 VanDerWaalsContact CD-NZ 3.32Å; E60-K64 HydrophobicContact CG-CD 4.46Å; E60-K64 WeakPolarHBondContact O-CB 3.3Å; E60-K64 VanDerWaalsContact O-CG 3.29Å; E60-K64 WeakPolarHBondContact O-CG 3.49Å; E60-K64 PolarHBondContact O-N 3.32Å; E60-K64 WeakPolarHBondContact OE1-CE 3.34Å; E60-K64 IonicContact OE1-NZ 3.39Å; E60-K64 PolarHBondContact OE1-NZ 3.28Å |
| 61 | E | 90.8 | Very high | 82.1 | Confident | 99 Ų | 99 | 122.1 Ų | 122.1 | 46% | 0.463 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -65.2 | -40.8 | 172.9 | -74.6 | -166.3 | 165.4 | 0 | 0 | 112.3 | L57 I58 M63 K64 M65 | L57-E61 HydrophobicContact CD2-CG 4.14Å; L57-E61 PolarHBondContact O-N 3.38Å; I58-E61 PolarHBondContact O-N 3.41Å; E61-M63 VanDerWaalsContact C-N 3.34Å; E61-M63 PolarHBondContact O-N 2.97Å; E61-K64 PolarHBondContact O-N 2.98Å; E61-M65 HydrophobicContact CB-CE 3.87Å; E61-M65 WeakPolarHBondContact O-CB 3.33Å; E61-M65 WeakPolarHBondContact O-CE 3.34Å; E61-M65 WeakPolarHBondContact O-CG 3.48Å; E61-M65 PolarHBondContact O-N 3.32Å |
| 62 | L | 88 | Confident | 80.2 | Confident | 113 Ų | 113 | 125.3 Ų | 125.3 | 59% | 0.592 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -63.4 | -39.1 | 176.2 | -172.2 | 70.6 | 0 | 0 | 0 | 111.7 | I58 W59 M65 | I58-L62 VanDerWaalsContact O-CB 3.27Å; I58-L62 WeakPolarHBondContact O-CB 3.41Å; I58-L62 PolarHBondContact O-N 2.86Å; W59-L62 PolarHBondContact O-N 2.87Å; L62-M65 CarbonylContact O-C 3.27Å; L62-M65 VanDerWaalsContact O-C 3.27Å; L62-M65 PolarHBondContact O-N 3.26Å |
| 63 | M | 84.8 | Confident | 78.1 | Confident | 104 Ų | 104 | 121.9 Ų | 121.9 | 51% | 0.512 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -71.3 | -33.2 | 174.7 | -72.8 | -64.6 | -176.7 | 0 | 0 | 112.9 | W59 E60 E61 M65 D66 | W59-M63 HydrophobicContact CD2-CE 4.35Å; W59-M63 HydrophobicContact CD2-CG 4.36Å; W59-M63 HydrophobicContact CE3-CE 4.44Å; W59-M63 HydrophobicContact CE3-CG 4.07Å; W59-M63 HydrophobicContact CH2-CE 3.47Å; W59-M63 VanDerWaalsContact CH2-CE 3.47Å; W59-M63 HydrophobicContact CZ2-CE 3.3Å; W59-M63 HydrophobicContact CZ3-CE 4.04Å; W59-M63 HydrophobicContact CZ3-CG 4.15Å; W59-M63 WeakPolarHBondContact O-CB 3.32Å; W59-M63 VanDerWaalsContact O-CG 3.32Å; W59-M63 WeakPolarHBondContact O-CG 3.43Å; W59-M63 PolarHBondContact O-N 3.33Å; E60-M63 PolarHBondContact O-N 3.1Å; E61-M63 VanDerWaalsContact C-N 3.34Å; E61-M63 PolarHBondContact O-N 2.97Å; M63-M65 VanDerWaalsContact C-N 3.33Å; M63-D66 PolarHBondContact O-N 3.4Å |
| 64 | K | 82.6 | Confident | 76.2 | Confident | 144 Ų | 144 | 124 Ų | 124 | 63% | 0.626 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -71.7 | -30.3 | 171 | -72.5 | 167.5 | -175.3 | 165.5 | 0 | 112 | E60 E61 D66 | E60-K64 VanDerWaalsContact CD-NZ 3.32Å; E60-K64 HydrophobicContact CG-CD 4.46Å; E60-K64 WeakPolarHBondContact O-CB 3.3Å; E60-K64 VanDerWaalsContact O-CG 3.29Å; E60-K64 WeakPolarHBondContact O-CG 3.49Å; E60-K64 PolarHBondContact O-N 3.32Å; E60-K64 WeakPolarHBondContact OE1-CE 3.34Å; E60-K64 IonicContact OE1-NZ 3.39Å; E60-K64 PolarHBondContact OE1-NZ 3.28Å; E61-K64 PolarHBondContact O-N 2.98Å; K64-D66 PolarHBondContact O-N 3.4Å |
| 65 | M | 78.2 | Confident | 74.3 | Confident | 108 Ų | 108 | 131.6 Ų | 131.6 | 53% | 0.532 | 64% | 0.644 | S | S | . | * | | | trans | -79.7 | 50 | 166.6 | -72.4 | -176.9 | -95.1 | 0 | 0 | 111.4 | E61 L62 M63 L67 | E61-M65 HydrophobicContact CB-CE 3.87Å; E61-M65 WeakPolarHBondContact O-CB 3.33Å; E61-M65 WeakPolarHBondContact O-CE 3.34Å; E61-M65 WeakPolarHBondContact O-CG 3.48Å; E61-M65 PolarHBondContact O-N 3.32Å; L62-M65 CarbonylContact O-C 3.27Å; L62-M65 VanDerWaalsContact O-C 3.27Å; L62-M65 PolarHBondContact O-N 3.26Å; M63-M65 VanDerWaalsContact C-N 3.33Å; M65-L67 PolarHBondContact O-N 3.2Å |
| 66 | D | 68.7 | Low | 72.3 | Confident | 144 Ų | 144 | 133 Ų | 133 | 77% | 0.77 | 67% | 0.666 | S | S | * | * | | | trans | -67.6 | 66.2 | 157.3 | -130.6 | -14.1 | 0 | 0 | 0 | 108.1 | M63 K64 | M63-D66 PolarHBondContact O-N 3.4Å; K64-D66 PolarHBondContact O-N 3.4Å |
| 67 | L | 66.8 | Low | 70 | Confident | 132 Ų | 132 | 133 Ų | 133 | 69% | 0.691 | 68% | 0.679 | S | S | * | * | | | trans | -49 | 123.1 | 171.1 | -78.9 | 143.6 | 0 | 0 | 0 | 106 | M65 R69 | M65-L67 PolarHBondContact O-N 3.2Å; L67-R69 PolarHBondContact O-N 3.35Å |
| 68 | P | 59.5 | Low | 68 | Low | 121 Ų | 121 | 137 Ų | 137 | 79% | 0.786 | 70% | 0.698 | S | S | * | * | | | trans | -57.1 | 107.9 | -179.7 | 22.9 | -32.6 | 0 | 0 | 0 | 106.7 | S70 | P68-S70 PolarHBondContact O-N 3.2Š|
| 69 | R | 57.4 | Low | 65.8 | Low | 242 Ų | 242 | 138.9 Ų | 138.9 | 91% | 0.913 | 72% | 0.716 | S | S | * | * | | | trans | -71.4 | 77.4 | -175.3 | -166.8 | 178.7 | -170.6 | 179.8 | 4.4 | 106.9 | L67 K71 | L67-R69 PolarHBondContact O-N 3.35Å; R69-K71 PolarHBondContact O-N 3.32Å |
| 70 | S | 50.8 | Low | 64 | Low | 109 Ų | 109 | 134.6 Ų | 134.6 | 76% | 0.762 | 72% | 0.722 | S | S | * | * | | | trans | -48.9 | 109.9 | 178.9 | 179.3 | 0 | 0 | 0 | 0 | 105.7 | P68 R72 | P68-S70 PolarHBondContact O-N 3.2Å; S70-R72 PolarHBondContact O-N 3.44Å |
| 71 | K | 54.3 | Low | 62.1 | Low | 187 Ų | 187 | 135.1 Ų | 135.1 | 81% | 0.813 | 74% | 0.737 | S | S | * | * | | | trans | -51.7 | 121.6 | -179.6 | -86 | 179.2 | 169.5 | 174.8 | 0 | 105.6 | R69 S73 | R69-K71 PolarHBondContact O-N 3.32Å; K71-S73 PolarHBondContact O-N 3.14Å |
| 72 | R | 54.1 | Low | 60.1 | Low | 218 Ų | 218 | 142.1 Ų | 142.1 | 82% | 0.823 | 76% | 0.76 | S | S | * | * | | | trans | -70.3 | 55.9 | 175.1 | -163.2 | -177.1 | -173.5 | -161.3 | 3.5 | 110 | S70 T74 | S70-R72 PolarHBondContact O-N 3.44Å; R72-T74 PolarHBondContact O-N 3.47Å |
| 73 | S | 51 | Low | 58.3 | Low | 108 Ų | 108 | 142.7 Ų | 142.7 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | | | trans | -82.2 | 66.5 | 173 | -164.6 | 0 | 0 | 0 | 0 | 107.1 | K71 | K71-S73 PolarHBondContact O-N 3.14Š|
| 74 | T | 54.1 | Low | 56.5 | Low | 105 Ų | 105 | 143.2 Ų | 143.2 | 64% | 0.644 | 78% | 0.784 | S | S | * | * | | | trans | -134.8 | 27.7 | -174.3 | -31.3 | 0 | 0 | 0 | 0 | 111.4 | R72 | R72-T74 PolarHBondContact O-N 3.47Š|
| 75 | Y | 55.2 | Low | 54.7 | Low | 222 Ų | 222 | 143.6 Ų | 143.6 | 87% | 0.871 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -150.1 | 95.4 | 160.5 | -74.3 | -70.9 | 0 | 0 | 0 | 107.4 | | |
| 76 | G | 53.5 | Low | 52.9 | Low | 74 Ų | 74 | 147.2 Ų | 147.2 | 76% | 0.763 | 81% | 0.812 | S | S | * | * | S | Bend | trans | 166.9 | -38 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | M78 | G76-M78 PolarHBondContact O-N 3.16Š|
| 77 | A | 48.6 | Very low | 51.5 | Low | 101 Ų | 101 | 145.4 Ų | 145.4 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | | | trans | -90.5 | 84.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | P79 | A77-P79 WeakPolarHBondContact O-CD 3.49Š|
| 78 | M | 51.8 | Low | 50.4 | Low | 179 Ų | 179 | 144.3 Ų | 144.3 | 88% | 0.882 | 82% | 0.815 | S | S | * | * | | | trans | -71.6 | 121.3 | 164.7 | -70.9 | -168.7 | -175.2 | 0 | 0 | 109.4 | G76 G80 | G76-M78 PolarHBondContact O-N 3.16Å; M78-G80 VanDerWaalsContact C-N 3.29Å; M78-G80 PolarHBondContact O-N 3.01Å |
| 79 | P | 48.9 | Very low | 49.4 | Very low | 140 Ų | 140 | 142.4 Ų | 142.4 | 91% | 0.909 | 82% | 0.818 | S | S | * | * | | | trans | -79.2 | 76.6 | 178.2 | 32.6 | -34 | 0 | 0 | 0 | 110.3 | A77 | A77-P79 WeakPolarHBondContact O-CD 3.49Š|
| 80 | G | 53.4 | Low | 48.6 | Very low | 71 Ų | 71 | 136.1 Ų | 136.1 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | | | trans | -112.9 | -24.4 | -172.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | M78 | M78-G80 VanDerWaalsContact C-N 3.29Å; M78-G80 PolarHBondContact O-N 3.01Å |
| 81 | S | 52.1 | Low | 48.4 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 81% | 0.811 | 81% | 0.813 | S | S | * | * | | | trans | -116.4 | 86.1 | -169.6 | 55.2 | 0 | 0 | 0 | 0 | 112.9 | P83 | S81-P83 WeakPolarHBondContact O-CD 3.36Š|
| 82 | R | 48 | Very low | 47.8 | Very low | 246 Ų | 246 | 136.2 Ų | 136.2 | 93% | 0.928 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 128.2 | 165.2 | -71.7 | 178.5 | 167.4 | -171 | -4.8 | 110.5 | | |
| 83 | P | 50.9 | Low | 47.3 | Very low | 126 Ų | 126 | 129.6 Ų | 129.6 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -90.8 | 140.9 | 141.1 | 32.1 | -27.5 | 0 | 0 | 0 | 109.6 | S81 | S81-P83 WeakPolarHBondContact O-CD 3.36Š|
| 84 | S | 47.6 | Very low | 47.1 | Very low | 114 Ų | 114 | 129.1 Ų | 129.1 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 130.8 | -171.8 | 51.7 | 0 | 0 | 0 | 0 | 114 | | |
| 85 | T | 45.1 | Very low | 46.8 | Very low | 153 Ų | 153 | 130.7 Ų | 130.7 | 94% | 0.939 | 82% | 0.824 | S | S | * | * | | | trans | -150.2 | 162 | 141.5 | -25.6 | 0 | 0 | 0 | 0 | 110.4 | | |
| 86 | F | 38.7 | Very low | 46.4 | Very low | 184 Ų | 184 | 123.5 Ų | 123.5 | 81% | 0.807 | 82% | 0.818 | S | S | * | * | | | trans | -117.5 | 131.2 | -146.9 | -161.9 | -92.9 | 0 | 0 | 0 | 111.5 | V88 | F86-V88 HydrophobicContact CD1-CG2 4.12Å; F86-V88 HydrophobicContact CE1-CG2 3.56Å; F86-V88 HydrophobicContact CZ-CG2 3.84Å |
| 87 | A | 40.4 | Very low | 46.1 | Very low | 105 Ų | 105 | 128.7 Ų | 128.7 | 87% | 0.868 | 82% | 0.822 | S | S | * | * | | | trans | -153.6 | 117.2 | 162.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 88 | V | 42.4 | Very low | 46.2 | Very low | 109 Ų | 109 | 130.6 Ų | 130.6 | 66% | 0.661 | 82% | 0.823 | S | S | * | * | | | trans | -108.2 | 137.1 | -175.5 | 172.3 | 0 | 0 | 0 | 0 | 109.5 | F86 V90 | F86-V88 HydrophobicContact CD1-CG2 4.12Å; F86-V88 HydrophobicContact CE1-CG2 3.56Å; F86-V88 HydrophobicContact CZ-CG2 3.84Å; V88-V90 HydrophobicContact CG1-CG2 3.92Å |
| 89 | G | 39.9 | Very low | 45.8 | Very low | 82 Ų | 82 | 125.7 Ų | 125.7 | 85% | 0.845 | 82% | 0.818 | S | S | * | * | | | trans | -142.6 | 98.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 90 | V | 40.4 | Very low | 45.5 | Very low | 109 Ų | 109 | 123.2 Ų | 123.2 | 66% | 0.661 | 82% | 0.818 | S | S | * | * | | | trans | -108.3 | 129.7 | -179.7 | 173.6 | 0 | 0 | 0 | 0 | 109.2 | V88 T92 | V88-V90 HydrophobicContact CG1-CG2 3.92Å; V90-T92 HydrophobicContact CG1-CG2 4.01Å |
| 91 | I | 45.5 | Very low | 45.4 | Very low | 176 Ų | 176 | 123.1 Ų | 123.1 | 90% | 0.903 | 82% | 0.817 | S | S | * | * | | | trans | -141.6 | 139.4 | 154.1 | -40.4 | 176.5 | 0 | 0 | 0 | 108.6 | | |
| 92 | T | 42.4 | Very low | 45.2 | Very low | 122 Ų | 122 | 123 Ų | 123 | 75% | 0.748 | 81% | 0.814 | S | S | * | * | | | trans | -122.4 | 150.4 | -165.2 | 47.9 | 0 | 0 | 0 | 0 | 113.9 | V90 | V90-T92 HydrophobicContact CG1-CG2 4.01Š|
| 93 | G | 42.9 | Very low | 44.9 | Very low | 80 Ų | 80 | 115 Ų | 115 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | | | trans | 92.8 | 154.2 | 162 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 94 | A | 47.8 | Very low | 44.3 | Very low | 97 Ų | 97 | 118 Ų | 118 | 80% | 0.802 | 80% | 0.804 | S | S | * | * | | | cis | -159.7 | 162.2 | -16.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | | |
| 95 | P | 48.1 | Very low | 43.9 | Very low | 138 Ų | 138 | 119.6 Ų | 119.6 | 90% | 0.896 | 80% | 0.803 | S | S | * | * | | | trans | -106.5 | 158.9 | -159.9 | 38.9 | -34.5 | 0 | 0 | 0 | 117.4 | | |
| 96 | G | 46.9 | Very low | 43.6 | Very low | 72 Ų | 72 | 118.2 Ų | 118.2 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | | | trans | 141.6 | 138.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 97 | E | 45.8 | Very low | 43.6 | Very low | 183 Ų | 183 | 115.3 Ų | 115.3 | 86% | 0.855 | 79% | 0.792 | S | S | * | * | | | cis | -147.9 | 152.9 | -2.3 | -93.5 | -174.2 | 110.4 | 0 | 0 | 110.8 | | |
| 98 | V | 51.3 | Low | 43.5 | Very low | 140 Ų | 140 | 115 Ų | 115 | 85% | 0.848 | 79% | 0.79 | S | S | * | * | | | trans | 28.1 | 118.8 | 153 | -165 | 0 | 0 | 0 | 0 | 120.6 | | |
| 99 | G | 43.7 | Very low | 43.4 | Very low | 76 Ų | 76 | 120.9 Ų | 120.9 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | | | trans | 150.4 | 99.7 | 147.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 100 | G | 41.9 | Very low | 43.4 | Very low | 89 Ų | 89 | 122.9 Ų | 122.9 | 92% | 0.918 | 80% | 0.798 | S | S | * | * | | | trans | 63.1 | 98.9 | 151 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 101 | G | 52.4 | Low | 43.6 | Very low | 68 Ų | 68 | 125.6 Ų | 125.6 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | | | trans | -127.1 | 176.2 | 162.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 102 | P | 47.7 | Very low | 43.3 | Very low | 114 Ų | 114 | 122.2 Ų | 122.2 | 74% | 0.74 | 81% | 0.805 | S | S | * | * | | | cis | -121.2 | 111.5 | 6.4 | 34.9 | -18.3 | 0 | 0 | 0 | 113.4 | Y104 | P102-Y104 HydrophobicContact CB-CD1 4.19Å; P102-Y104 HydrophobicContact CB-CE1 3.8Å |
| 103 | G | 41.4 | Very low | 43.2 | Very low | 79 Ų | 79 | 119.7 Ų | 119.7 | 81% | 0.814 | 80% | 0.804 | S | S | * | * | | | trans | -119.5 | 93.8 | 155.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 104 | Y | 38.5 | Very low | 43.3 | Very low | 187 Ų | 187 | 122.5 Ų | 122.5 | 73% | 0.733 | 81% | 0.807 | S | S | * | * | | | trans | -167.6 | 157 | 176.3 | 63.9 | -99.1 | 0 | 0 | 0 | 111.2 | P102 | P102-Y104 HydrophobicContact CB-CD1 4.19Å; P102-Y104 HydrophobicContact CB-CE1 3.8Å |
| 105 | L | 39 | Very low | 42.9 | Very low | 149 Ų | 149 | 121.7 Ų | 121.7 | 78% | 0.78 | 81% | 0.809 | S | S | * | * | | | cis | -149.6 | 129.8 | -8.3 | -126.8 | 151.2 | 0 | 0 | 0 | 107.1 | | |
| 106 | T | 39 | Very low | 42.6 | Very low | 123 Ų | 123 | 120.2 Ų | 120.2 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -83.2 | 147.4 | 158.9 | 46.7 | 0 | 0 | 0 | 0 | 109.2 | | |
| 107 | T | 37.4 | Very low | 42.4 | Very low | 123 Ų | 123 | 122 Ų | 122 | 76% | 0.755 | 82% | 0.816 | S | S | * | * | | | trans | 72.5 | 99.3 | 166 | -46 | 0 | 0 | 0 | 0 | 117.3 | | |
| 108 | A | 39.7 | Very low | 42.3 | Very low | 100 Ų | 100 | 116.9 Ų | 116.9 | 83% | 0.826 | 81% | 0.813 | S | S | * | * | | | trans | -135.2 | 125 | 149.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 109 | R | 39.3 | Very low | 41.6 | Very low | 232 Ų | 232 | 114.1 Ų | 114.1 | 88% | 0.875 | 81% | 0.812 | S | S | * | * | | | trans | -88.7 | 145.9 | 180 | -54.8 | 163.6 | 83.3 | -177.8 | 8.5 | 109.6 | | |
| 110 | P | 41.6 | Very low | 41.4 | Very low | 123 Ų | 123 | 117 Ų | 117 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | | | trans | -106.7 | 112.8 | 150.9 | 22.2 | -7.3 | 0 | 0 | 0 | 111.4 | | |
| 111 | I | 43.8 | Very low | 41.2 | Very low | 167 Ų | 167 | 118.5 Ų | 118.5 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | | | trans | 14.1 | 132.1 | 138.9 | -58.9 | 167.5 | 0 | 0 | 0 | 117.6 | | |
| 112 | A | 38.1 | Very low | 40.7 | Very low | 104 Ų | 104 | 121.1 Ų | 121.1 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | | | trans | -73.6 | 146 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 113 | G | 42.3 | Very low | 40.2 | Very low | 70 Ų | 70 | 119 Ų | 119 | 72% | 0.722 | 81% | 0.811 | S | S | * | * | | | trans | -141.2 | 135.4 | 159.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 114 | P | 43.4 | Very low | 40.2 | Very low | 138 Ų | 138 | 126.2 Ų | 126.2 | 90% | 0.896 | 82% | 0.816 | S | S | * | * | | | trans | -95.3 | 150.8 | -157.4 | 35.4 | -36.1 | 0 | 0 | 0 | 115.3 | | |
| 115 | G | 40.5 | Very low | 40.1 | Very low | 81 Ų | 81 | 123.7 Ų | 123.7 | 84% | 0.835 | 82% | 0.819 | S | S | * | * | | | trans | 104.2 | 88.5 | 143.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 116 | A | 40.7 | Very low | 40.1 | Very low | 106 Ų | 106 | 121.9 Ų | 121.9 | 88% | 0.876 | 82% | 0.819 | S | S | * | * | | | | -172.1 | 142 | 127.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 117 | A | 42.9 | Very low | 40.6 | Very low | 111 Ų | 111 | 122.3 Ų | 122.3 | 92% | 0.917 | 82% | 0.822 | S | S | * | * | | | trans | -88.3 | 153.9 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 118 | G | 43.2 | Very low | 40.8 | Very low | 75 Ų | 75 | 119.3 Ų | 119.3 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | | | trans | 159.8 | 91.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 119 | G | 38.2 | Very low | 40.9 | Very low | 82 Ų | 82 | 121.3 Ų | 121.3 | 85% | 0.845 | 82% | 0.82 | S | S | * | * | | | trans | -77.4 | 148.4 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | | |
| 120 | V | 38.7 | Very low | 41.1 | Very low | 137 Ų | 137 | 113.6 Ų | 113.6 | 83% | 0.83 | 81% | 0.812 | S | S | * | * | | | trans | -123.1 | 112 | 158.4 | 177.2 | 0 | 0 | 0 | 0 | 107.9 | V122 | V120-V122 HydrophobicContact CG1-CG2 4.22Š|
| 121 | S | 38.3 | Very low | 41.3 | Very low | 119 Ų | 119 | 115 Ų | 115 | 83% | 0.832 | 82% | 0.818 | S | S | * | * | | | trans | -101.8 | 113.6 | 169 | 55.4 | 0 | 0 | 0 | 0 | 109.3 | | |
| 122 | V | 41.7 | Very low | 41.1 | Very low | 123 Ų | 123 | 110 Ų | 110 | 75% | 0.745 | 81% | 0.809 | S | S | * | * | | | trans | -127.2 | 113.1 | 161 | -179.6 | 0 | 0 | 0 | 0 | 106.5 | V120 | V120-V122 HydrophobicContact CG1-CG2 4.22Š|
| 123 | G | 37.4 | Very low | 41.4 | Very low | 69 Ų | 69 | 115.5 Ų | 115.5 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | | | trans | -79.5 | 136.5 | -178 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 124 | Y | 39.9 | Very low | 41.7 | Very low | 231 Ų | 231 | 118.8 Ų | 118.8 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | | | trans | -79.7 | 118.6 | 162.7 | -77.7 | -93.7 | 0 | 0 | 0 | 108.9 | S126 | Y124-S126 PolarHBondContact O-N 3.33Å; Y124-S126 VanDerWaalsContact O-N 3.16Å |
| 125 | V | 37.9 | Very low | 41.7 | Very low | 134 Ų | 134 | 115.6 Ų | 115.6 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | | | trans | -74.5 | 103.7 | 169.4 | 175.5 | 0 | 0 | 0 | 0 | 108.3 | T127 | V125-T127 HydrophobicContact CG1-CG2 4.44Å; V125-T127 PolarHBondContact O-N 2.84Å |
| 126 | S | 39.2 | Very low | 41.9 | Very low | 111 Ų | 111 | 117.2 Ų | 117.2 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | | | trans | -81.6 | 102.8 | 167.7 | 169.2 | 0 | 0 | 0 | 0 | 109.4 | Y124 G128 | Y124-S126 PolarHBondContact O-N 3.33Å; Y124-S126 VanDerWaalsContact O-N 3.16Å; S126-G128 PolarHBondContact O-N 3.42Å; S126-G128 VanDerWaalsContact O-N 3.15Å |
| 127 | T | 48.9 | Very low | 42 | Very low | 133 Ų | 133 | 115.2 Ų | 115.2 | 82% | 0.816 | 80% | 0.802 | S | S | * | * | | | trans | -73.8 | 100 | 167.1 | 36.1 | 0 | 0 | 0 | 0 | 110.1 | V125 | V125-T127 HydrophobicContact CG1-CG2 4.44Å; V125-T127 PolarHBondContact O-N 2.84Å |
| 128 | G | 42 | Very low | 42.1 | Very low | 59 Ų | 59 | 118.9 Ų | 118.9 | 61% | 0.608 | 81% | 0.806 | S | S | * | * | | | trans | -72.9 | 166.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | S126 | S126-G128 PolarHBondContact O-N 3.42Å; S126-G128 VanDerWaalsContact O-N 3.15Å |
| 129 | P | 41.9 | Very low | 42 | Very low | 142 Ų | 142 | 118.8 Ų | 118.8 | 92% | 0.922 | 81% | 0.805 | S | S | * | * | | | trans | -92.4 | 157 | -172.1 | 36.4 | -35.6 | 0 | 0 | 0 | 113.9 | | |
| 130 | G | 42.9 | Very low | 42.3 | Very low | 70 Ų | 70 | 120.4 Ų | 120.4 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | | | trans | 150.8 | 105.8 | 155.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | | |
| 131 | V | 45.5 | Very low | 42.6 | Very low | 152 Ų | 152 | 117.7 Ų | 117.7 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | | | trans | 179.9 | 116.2 | 132.8 | -88.1 | 0 | 0 | 0 | 0 | 106.1 | | |
| 132 | G | 40.1 | Very low | 42.8 | Very low | 64 Ų | 64 | 115.7 Ų | 115.7 | 66% | 0.66 | 81% | 0.807 | S | S | * | * | | | | 79.6 | 121.8 | 82.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 133 | Y | 44.4 | Very low | 43.3 | Very low | 219 Ų | 219 | 116.6 Ų | 116.6 | 86% | 0.859 | 82% | 0.816 | S | S | * | * | | | cis | -157.8 | 158.4 | 20.8 | -90.2 | -97.3 | 0 | 0 | 0 | 111.7 | | |
| 134 | T | 47.7 | Very low | 43.6 | Very low | 138 Ų | 138 | 117 Ų | 117 | 85% | 0.847 | 82% | 0.82 | S | S | * | * | | | trans | 47.5 | 135 | 154.8 | 56.9 | 0 | 0 | 0 | 0 | 120.6 | | |
| 135 | G | 44 | Very low | 43.7 | Very low | 71 Ų | 71 | 110.1 Ų | 110.1 | 73% | 0.732 | 82% | 0.819 | S | S | * | * | | | cis | 167 | 157 | 1 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 136 | A | 44.2 | Very low | 44 | Very low | 115 Ų | 115 | 109 Ų | 109 | 95% | 0.95 | 82% | 0.824 | S | S | * | * | | | trans | 64.5 | 137.4 | -174.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 137 | G | 42.8 | Very low | 44.3 | Very low | 64 Ų | 64 | 109.1 Ų | 109.1 | 66% | 0.66 | 83% | 0.832 | S | S | * | * | | | cis | 148.1 | 113.3 | -9.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 138 | L | 45.3 | Very low | 44 | Very low | 189 Ų | 189 | 106.5 Ų | 106.5 | 99% | 0.99 | 83% | 0.832 | S | S | * | * | | | trans | 67.4 | 150.8 | 170.8 | -45.4 | 170.2 | 0 | 0 | 0 | 114.4 | | |
| 139 | G | 41.8 | Very low | 44 | Very low | 73 Ų | 73 | 107.1 Ų | 107.1 | 75% | 0.753 | 84% | 0.838 | S | S | * | * | | | cis | 178.5 | 148.9 | -4 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 140 | A | 44.1 | Very low | 43.9 | Very low | 116 Ų | 116 | 110.3 Ų | 110.3 | 96% | 0.959 | 84% | 0.838 | S | S | * | * | | | trans | -74.9 | 147 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | | |
| 141 | G | 44.5 | Very low | 43.9 | Very low | 80 Ų | 80 | 112.2 Ų | 112.2 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | | | trans | -166.5 | 130.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 142 | G | 42.7 | Very low | 43.9 | Very low | 76 Ų | 76 | 111.2 Ų | 111.2 | 78% | 0.784 | 83% | 0.83 | S | S | * | * | | | trans | -83.1 | 175.9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 143 | P | 52.4 | Low | 44.2 | Very low | 142 Ų | 142 | 112.3 Ų | 112.3 | 92% | 0.922 | 83% | 0.833 | S | S | * | * | | | trans | -88 | 148.9 | -169.7 | 34.6 | -35.2 | 0 | 0 | 0 | 114.2 | | |
| 144 | G | 44 | Very low | 44.3 | Very low | 78 Ų | 78 | 108.2 Ų | 108.2 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | | | trans | -152.7 | 134.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 145 | G | 42.1 | Very low | 44.1 | Very low | 86 Ų | 86 | 105.3 Ų | 105.3 | 89% | 0.887 | 83% | 0.83 | S | S | * | * | | | trans | -89.2 | 174.7 | -165.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | | |
| 146 | A | 43.5 | Very low | 44.1 | Very low | 111 Ų | 111 | 106.6 Ų | 106.6 | 92% | 0.917 | 83% | 0.834 | S | S | * | * | | | trans | -154.7 | 146.1 | 157.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 147 | A | 44.7 | Very low | 44 | Very low | 113 Ų | 113 | 106.2 Ų | 106.2 | 93% | 0.934 | 83% | 0.831 | S | S | * | * | | | trans | -101.5 | 152.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 148 | G | 42.9 | Very low | 43.9 | Very low | 79 Ų | 79 | 107.2 Ų | 107.2 | 81% | 0.814 | 84% | 0.841 | S | S | * | * | | | trans | 178.3 | 128 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 149 | G | 42.8 | Very low | 43.8 | Very low | 72 Ų | 72 | 101.1 Ų | 101.1 | 74% | 0.742 | 82% | 0.824 | S | S | * | * | | | cis | 104.8 | 74.8 | 2.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 150 | F | 40.2 | Very low | 44.2 | Very low | 209 Ų | 209 | 109.3 Ų | 109.3 | 92% | 0.917 | 83% | 0.834 | S | S | * | * | | | | -167.4 | 169.4 | 128.3 | -123.2 | -95.4 | 0 | 0 | 0 | 111.9 | | |
| 151 | T | 43 | Very low | 44.2 | Very low | 110 Ų | 110 | 107.4 Ų | 107.4 | 68% | 0.675 | 83% | 0.826 | S | S | * | * | | | trans | -97.1 | 165.2 | -164.5 | 55.3 | 0 | 0 | 0 | 0 | 114 | | |
| 152 | T | 45 | Very low | 44.8 | Very low | 131 Ų | 131 | 109.7 Ų | 109.7 | 80% | 0.804 | 83% | 0.826 | S | S | * | * | | | | 157.6 | 147.3 | 109 | -52.7 | 0 | 0 | 0 | 0 | 112.9 | | |
| 153 | A | 45.9 | Very low | 45.1 | Very low | 86 Ų | 86 | 112 Ų | 112 | 71% | 0.711 | 83% | 0.83 | S | S | * | * | | | trans | -50.6 | 166.1 | -169.4 | 0 | 0 | 0 | 0 | 0 | 121 | | |
| 154 | P | 47.5 | Very low | 44.6 | Very low | 134 Ų | 134 | 109.3 Ų | 109.3 | 87% | 0.87 | 83% | 0.829 | S | S | * | * | | | trans | -97.3 | 163.7 | 177.7 | 39.2 | -36.2 | 0 | 0 | 0 | 115.5 | | |
| 155 | G | 41.8 | Very low | 44.6 | Very low | 76 Ų | 76 | 109.2 Ų | 109.2 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | | | trans | 160 | 162.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 156 | A | 44.1 | Very low | 44.7 | Very low | 98 Ų | 98 | 110.6 Ų | 110.6 | 81% | 0.81 | 83% | 0.83 | S | S | * | * | | | cis | -166.8 | 157 | -18.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 157 | A | 43.7 | Very low | 44.6 | Very low | 107 Ų | 107 | 109 Ų | 109 | 88% | 0.884 | 82% | 0.824 | S | S | * | * | | | trans | 70.2 | 136.7 | 155.8 | 0 | 0 | 0 | 0 | 0 | 122.7 | | |
| 158 | G | 40.4 | Very low | 44.6 | Very low | 85 Ų | 85 | 110.4 Ų | 110.4 | 88% | 0.876 | 82% | 0.822 | S | S | * | * | | | trans | 89.6 | 137.8 | 156.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 159 | G | 43.3 | Very low | 44.7 | Very low | 62 Ų | 62 | 112.9 Ų | 112.9 | 64% | 0.639 | 82% | 0.823 | S | S | * | * | | | cis | 155.4 | 145.9 | -6 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 160 | Y | 50.2 | Low | 44.6 | Very low | 244 Ų | 244 | 113.2 Ų | 113.2 | 96% | 0.957 | 83% | 0.827 | S | S | * | * | | | trans | 77.5 | 118.6 | 164.7 | -51.8 | -79.9 | 0 | 0 | 0 | 121.4 | | |
| 161 | G | 43.5 | Very low | 44.8 | Very low | 76 Ų | 76 | 110 Ų | 110 | 78% | 0.784 | 82% | 0.824 | S | S | * | * | | | | 107.9 | 109.1 | 111.2 | 0 | 0 | 0 | 0 | 0 | 119.7 | | |
| 162 | P | 56.3 | Low | 44.9 | Very low | 129 Ų | 129 | 110.8 Ų | 110.8 | 84% | 0.838 | 83% | 0.831 | S | S | * | * | | | trans | -111.5 | 157.9 | 176.6 | 39.3 | -31.3 | 0 | 0 | 0 | 114.8 | | |
| 163 | S | 49 | Very low | 44.5 | Very low | 123 Ų | 123 | 108.1 Ų | 108.1 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | | | trans | -176.4 | 136.9 | 151.9 | 57.7 | 0 | 0 | 0 | 0 | 115.4 | | |
| 164 | G | 42.7 | Very low | 44.4 | Very low | 87 Ų | 87 | 109.3 Ų | 109.3 | 90% | 0.897 | 84% | 0.839 | S | S | * | * | | | trans | 83.5 | 143.2 | 152.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | | |
| 165 | G | 44.9 | Very low | 43.9 | Very low | 76 Ų | 76 | 108.2 Ų | 108.2 | 78% | 0.784 | 84% | 0.842 | S | S | * | * | | | cis | 176.1 | 144.9 | -6.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 166 | A | 42.7 | Very low | 43.9 | Very low | 114 Ų | 114 | 108.5 Ų | 108.5 | 94% | 0.942 | 84% | 0.844 | S | S | * | * | | | trans | 21.4 | 138 | 158.4 | 0 | 0 | 0 | 0 | 0 | 122.9 | | |
| 167 | G | 41.6 | Very low | 43.6 | Very low | 77 Ų | 77 | 107.1 Ų | 107.1 | 79% | 0.794 | 84% | 0.84 | S | S | * | * | | | trans | 144.8 | 94.8 | 140 | 0 | 0 | 0 | 0 | 0 | 117.7 | | |
| 168 | V | 44.4 | Very low | 43.6 | Very low | 144 Ų | 144 | 112.2 Ų | 112.2 | 87% | 0.873 | 84% | 0.843 | S | S | * | * | | | trans | -103 | 144.3 | 151.7 | -76 | 0 | 0 | 0 | 0 | 108.9 | | |
| 169 | P | 46 | Very low | 44.2 | Very low | 130 Ų | 130 | 114 Ų | 114 | 84% | 0.844 | 84% | 0.839 | S | S | * | * | | | | -151.3 | 164 | 113.9 | 38.1 | -22.3 | 0 | 0 | 0 | 115.5 | | |
| 170 | G | 41 | Very low | 44.3 | Very low | 80 Ų | 80 | 114.3 Ų | 114.3 | 83% | 0.825 | 84% | 0.842 | S | S | * | * | | | trans | 114.9 | 102.7 | 146.4 | 0 | 0 | 0 | 0 | 0 | 118 | | |
| 171 | V | 44.2 | Very low | 44.2 | Very low | 140 Ų | 140 | 110.3 Ų | 110.3 | 85% | 0.848 | 84% | 0.842 | S | S | * | * | | | trans | -87.9 | 156.2 | 151.5 | -135.8 | 0 | 0 | 0 | 0 | 107.8 | | |
| 172 | P | 44.2 | Very low | 44.3 | Very low | 127 Ų | 127 | 109.8 Ų | 109.8 | 83% | 0.825 | 84% | 0.837 | S | S | * | * | | | | -156.4 | 159.9 | 84.5 | 39.3 | -19.8 | 0 | 0 | 0 | 118.1 | | |
| 173 | G | 37.7 | Very low | 44.2 | Very low | 76 Ų | 76 | 110.3 Ų | 110.3 | 78% | 0.784 | 84% | 0.84 | S | S | * | * | | | trans | 98.8 | 120.6 | 132.5 | 0 | 0 | 0 | 0 | 0 | 119.9 | | |
| 174 | A | 42.7 | Very low | 44 | Very low | 110 Ų | 110 | 108 Ų | 108 | 91% | 0.909 | 84% | 0.835 | S | S | * | * | | | trans | -165.2 | 132.7 | 135.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 175 | A | 36.5 | Very low | 44.2 | Very low | 112 Ų | 112 | 108.6 Ų | 108.6 | 93% | 0.926 | 83% | 0.833 | S | S | * | * | | | trans | -126.2 | 153.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 176 | G | 42.3 | Very low | 43.9 | Very low | 81 Ų | 81 | 108.2 Ų | 108.2 | 84% | 0.835 | 83% | 0.828 | S | S | * | * | | | trans | 127.9 | 119.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 177 | G | 39.3 | Very low | 44 | Very low | 70 Ų | 70 | 113.5 Ų | 113.5 | 72% | 0.722 | 83% | 0.825 | S | S | * | * | | | cis | 105.6 | 103.3 | 3.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 178 | F | 43.6 | Very low | 44.1 | Very low | 214 Ų | 214 | 116.6 Ų | 116.6 | 94% | 0.939 | 83% | 0.829 | S | S | * | * | | | trans | -159.1 | 148.7 | 147.5 | -101.6 | -74.8 | 0 | 0 | 0 | 109.4 | | |
| 179 | P | 51.6 | Low | 44 | Very low | 123 Ų | 123 | 113.8 Ų | 113.8 | 80% | 0.799 | 83% | 0.829 | S | S | * | * | | | trans | -116.6 | 175.3 | -168.6 | 41.4 | -29.6 | 0 | 0 | 0 | 114 | | |
| 180 | G | 46.5 | Very low | 43.6 | Very low | 67 Ų | 67 | 111 Ų | 111 | 69% | 0.691 | 83% | 0.825 | S | S | * | * | | | trans | 160.5 | 130 | 153.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | | |
| 181 | V | 47.3 | Very low | 44 | Very low | 161 Ų | 161 | 112.9 Ų | 112.9 | 98% | 0.976 | 82% | 0.822 | S | S | * | * | | | trans | 69.2 | 130.5 | 160.2 | -162.3 | 0 | 0 | 0 | 0 | 116.2 | | |
| 182 | G | 46.1 | Very low | 43.7 | Very low | 65 Ų | 65 | 114 Ų | 114 | 67% | 0.67 | 82% | 0.822 | S | S | * | * | | | cis | 175.6 | 155.3 | -3.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 183 | P | 52.9 | Low | 43.6 | Very low | 139 Ų | 139 | 111.7 Ų | 111.7 | 90% | 0.903 | 82% | 0.821 | S | S | * | * | | | trans | -109.1 | 167.6 | -159.4 | 40.3 | -34.8 | 0 | 0 | 0 | 115.8 | | |
| 184 | G | 45.5 | Very low | 43.7 | Very low | 74 Ų | 74 | 114.1 Ų | 114.1 | 76% | 0.763 | 82% | 0.82 | S | S | * | * | | | trans | 173.7 | 118.5 | 161.6 | 0 | 0 | 0 | 0 | 0 | 117.8 | | |
| 185 | A | 46.3 | Very low | 43.4 | Very low | 101 Ų | 101 | 118.1 Ų | 118.1 | 84% | 0.835 | 82% | 0.818 | S | S | * | * | | | trans | 57.7 | 128.9 | 160.6 | 0 | 0 | 0 | 0 | 0 | 119.8 | | |
| 186 | G | 40.3 | Very low | 43.8 | Very low | 67 Ų | 67 | 118.7 Ų | 118.7 | 69% | 0.691 | 81% | 0.812 | S | S | * | * | | | cis | 114.8 | 94.6 | -6.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 187 | Y | 43.8 | Very low | 43.7 | Very low | 225 Ų | 225 | 118.7 Ų | 118.7 | 88% | 0.882 | 81% | 0.812 | S | S | * | * | | | trans | -144.1 | 146.1 | 158.3 | 5.6 | -86.5 | 0 | 0 | 0 | 109.7 | | |
| 188 | T | 44.7 | Very low | 43.9 | Very low | 142 Ų | 142 | 119.5 Ų | 119.5 | 87% | 0.871 | 82% | 0.82 | S | S | * | * | | | trans | -136.2 | 153.7 | -158.4 | 47.3 | 0 | 0 | 0 | 0 | 113.4 | | |
| 189 | G | 41.4 | Very low | 43.6 | Very low | 85 Ų | 85 | 118.1 Ų | 118.1 | 88% | 0.876 | 81% | 0.814 | S | S | * | * | | | trans | 83 | 150 | 165 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 190 | G | 38 | Very low | 43.1 | Very low | 73 Ų | 73 | 121.7 Ų | 121.7 | 75% | 0.753 | 82% | 0.82 | S | S | * | * | | | cis | -162.9 | -170.6 | 9 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 191 | P | 48 | Very low | 42.9 | Very low | 118 Ų | 118 | 122.9 Ų | 122.9 | 77% | 0.766 | 82% | 0.823 | S | S | * | * | | | trans | -111.9 | 160.7 | -140.2 | 39.9 | -36.2 | 0 | 0 | 0 | 118.1 | | |
| 192 | I | 38.1 | Very low | 42.6 | Very low | 165 Ų | 165 | 118.3 Ų | 118.3 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | | | trans | 23.9 | 120.2 | 140.9 | -46.3 | 173.4 | 0 | 0 | 0 | 117.9 | | |
| 193 | G | 42.4 | Very low | 42.8 | Very low | 78 Ų | 78 | 122.2 Ų | 122.2 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | | | trans | -143.6 | 139.3 | 166.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 194 | T | 40.3 | Very low | 42.8 | Very low | 126 Ų | 126 | 121 Ų | 121 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | | | trans | -96.4 | 156.5 | -163.4 | -53.1 | 0 | 0 | 0 | 0 | 113.9 | | |
| 195 | F | 37 | Very low | 42.7 | Very low | 195 Ų | 195 | 124.8 Ų | 124.8 | 86% | 0.855 | 82% | 0.82 | S | S | * | * | | | trans | -22.4 | 162.5 | 161.5 | -67.8 | -75.5 | 0 | 0 | 0 | 118.4 | | |
| 196 | P | 45.3 | Very low | 42.6 | Very low | 124 Ų | 124 | 123.4 Ų | 123.4 | 81% | 0.805 | 82% | 0.816 | S | S | * | * | | | cis | -152.1 | 171.7 | 34.7 | 42.9 | -22.2 | 0 | 0 | 0 | 120.6 | | |
| 197 | G | 39.1 | Very low | 42.7 | Very low | 80 Ų | 80 | 123.7 Ų | 123.7 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | | | trans | 86.7 | 123.9 | 132.3 | 0 | 0 | 0 | 0 | 0 | 119.7 | | |
| 198 | G | 44.3 | Very low | 42.7 | Very low | 87 Ų | 87 | 124.2 Ų | 124.2 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | | | trans | 174.1 | 80.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 199 | F | 35.7 | Very low | 42.6 | Very low | 185 Ų | 185 | 120.8 Ų | 120.8 | 81% | 0.811 | 81% | 0.814 | S | S | * | * | | | trans | -110.8 | 125.8 | 178.5 | 177.1 | -77.2 | 0 | 0 | 0 | 109.2 | A201 | F199-A201 HydrophobicContact CE1-CB 4.26Š|
| 200 | E | 42.8 | Very low | 42.8 | Very low | 199 Ų | 199 | 123.7 Ų | 123.7 | 93% | 0.93 | 82% | 0.815 | S | S | * | * | | | trans | -145.7 | 151.5 | 153.4 | -77.2 | -149.9 | 115 | 0 | 0 | 110.6 | | |
| 201 | A | 40.8 | Very low | 42.9 | Very low | 92 Ų | 92 | 126.7 Ų | 126.7 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | | | trans | -112 | 164.5 | -162.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | F199 | F199-A201 HydrophobicContact CE1-CB 4.26Š|
| 202 | G | 42.3 | Very low | 42.6 | Very low | 65 Ų | 65 | 128.1 Ų | 128.1 | 67% | 0.67 | 83% | 0.825 | S | S | * | * | | | trans | -149.3 | 15.3 | -167.4 | 0 | 0 | 0 | 0 | 0 | 120.4 | | |
| 203 | T | 49.4 | Very low | 42.8 | Very low | 147 Ų | 147 | 123.9 Ų | 123.9 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | | | trans | 61.2 | 161.7 | 158.2 | 38.4 | 0 | 0 | 0 | 0 | 121 | | |
| 204 | P | 54 | Low | 42.5 | Very low | 112 Ų | 112 | 123.4 Ų | 123.4 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | | | trans | -132.6 | 178.5 | -150.4 | 44.5 | -29.3 | 0 | 0 | 0 | 116.7 | | |
| 205 | T | 42.8 | Very low | 42.7 | Very low | 154 Ų | 154 | 128.1 Ų | 128.1 | 95% | 0.945 | 83% | 0.827 | S | S | * | * | | | trans | -172.9 | 138.2 | 154.6 | 7.2 | 0 | 0 | 0 | 0 | 109.5 | | |
| 206 | G | 43.2 | Very low | 42.6 | Very low | 72 Ų | 72 | 122.3 Ų | 122.3 | 74% | 0.742 | 82% | 0.822 | S | S | * | * | | | cis | 174.1 | 147 | -12.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 207 | G | 42.5 | Very low | 42.8 | Very low | 73 Ų | 73 | 123.5 Ų | 123.5 | 75% | 0.753 | 83% | 0.826 | S | S | * | * | | | trans | 67.2 | 146.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 208 | Y | 45.1 | Very low | 43.1 | Very low | 237 Ų | 237 | 125.8 Ų | 125.8 | 93% | 0.929 | 83% | 0.827 | S | S | * | * | | | cis | -167.9 | 166.2 | 10.5 | 42.8 | -96.9 | 0 | 0 | 0 | 109.1 | | |
| 209 | G | 41.9 | Very low | 42.8 | Very low | 70 Ų | 70 | 125.3 Ų | 125.3 | 72% | 0.722 | 82% | 0.822 | S | S | * | * | | | cis | 169.2 | 16.8 | -4.8 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 210 | T | 46.1 | Very low | 43 | Very low | 145 Ų | 145 | 119.5 Ų | 119.5 | 89% | 0.89 | 81% | 0.814 | S | S | * | * | | | trans | -126.6 | 141.5 | -179.9 | 52.3 | 0 | 0 | 0 | 0 | 115 | | |
| 211 | T | 39.1 | Very low | 43 | Very low | 136 Ų | 136 | 118.9 Ų | 118.9 | 83% | 0.834 | 81% | 0.811 | S | S | * | * | | | trans | -137.6 | 134.8 | -166.4 | 50.6 | 0 | 0 | 0 | 0 | 113.8 | | |
| 212 | V | 43.2 | Very low | 43 | Very low | 149 Ų | 149 | 123.1 Ų | 123.1 | 90% | 0.903 | 82% | 0.815 | S | S | * | * | | | trans | -150.3 | 114 | 145.5 | -166.2 | 0 | 0 | 0 | 0 | 104.3 | | |
| 213 | G | 40.5 | Very low | 42.7 | Very low | 76 Ų | 76 | 131 Ų | 131 | 78% | 0.784 | 83% | 0.826 | S | S | * | * | | | | 79.7 | 108 | 71.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 214 | G | 37.5 | Very low | 42.4 | Very low | 67 Ų | 67 | 131.3 Ų | 131.3 | 69% | 0.691 | 82% | 0.822 | S | S | * | * | | | cis | 125.2 | 87.8 | 5 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 215 | F | 43.2 | Very low | 42 | Very low | 226 Ų | 226 | 134.6 Ų | 134.6 | 99% | 0.991 | 83% | 0.827 | S | S | * | * | | | trans | -149.3 | 132.4 | 160.8 | -90.6 | -74.7 | 0 | 0 | 0 | 108.9 | | |
| 216 | G | 36.3 | Very low | 42.2 | Very low | 72 Ų | 72 | 137.7 Ų | 137.7 | 74% | 0.742 | 82% | 0.823 | S | S | * | * | | | trans | -127.1 | 159.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 217 | V | 48.3 | Very low | 42.9 | Very low | 149 Ų | 149 | 140.1 Ų | 140.1 | 90% | 0.903 | 83% | 0.826 | S | S | * | * | | | trans | -144.6 | 143.5 | 161.5 | -110.1 | 0 | 0 | 0 | 0 | 108.1 | | |
| 218 | P | 45.8 | Very low | 43.1 | Very low | 128 Ų | 128 | 145.6 Ų | 145.6 | 83% | 0.831 | 83% | 0.832 | S | S | * | * | | | trans | -106 | 166.1 | -167.9 | 40.1 | -34.6 | 0 | 0 | 0 | 113.8 | | |
| 219 | G | 37.3 | Very low | 42.8 | Very low | 78 Ų | 78 | 138.8 Ų | 138.8 | 80% | 0.804 | 83% | 0.825 | S | S | * | * | | | trans | 120.5 | 123.8 | 148.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | | |
| 220 | G | 41.3 | Very low | 43.3 | Very low | 62 Ų | 62 | 143.3 Ų | 143.3 | 64% | 0.639 | 83% | 0.831 | S | S | * | * | | | trans | 73 | 148.8 | 162.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | | |
| 221 | E | 42.6 | Very low | 43.6 | Very low | 187 Ų | 187 | 142.1 Ų | 142.1 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | | | cis | -168.9 | -179.5 | -25.4 | 34.5 | -150.8 | 78.2 | 0 | 0 | 107.5 | | |
| 222 | E | 40.4 | Very low | 43.8 | Very low | 180 Ų | 180 | 139.2 Ų | 139.2 | 84% | 0.841 | 82% | 0.823 | S | S | * | * | | | trans | 77.8 | 99.6 | 172.9 | -143.8 | 165.1 | 151.8 | 0 | 0 | 117.3 | | |
| 223 | Y | 35.5 | Very low | 44 | Very low | 230 Ų | 230 | 138.8 Ų | 138.8 | 90% | 0.902 | 82% | 0.82 | S | S | * | * | | | trans | -75.2 | 123.5 | 160.4 | -99.1 | -105.4 | 0 | 0 | 0 | 108.7 | E225 | Y223-E225 PolarHBondContact O-N 3Š|
| 224 | L | 43.2 | Very low | 44.5 | Very low | 154 Ų | 154 | 141 Ų | 141 | 81% | 0.806 | 82% | 0.821 | S | S | * | * | | | trans | -76.5 | 108.3 | 174.3 | -112.1 | 163.4 | 0 | 0 | 0 | 110.6 | | |
| 225 | E | 45.3 | Very low | 44.6 | Very low | 182 Ų | 182 | 141.2 Ų | 141.2 | 85% | 0.85 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 121.8 | 175.7 | -157.5 | 160.5 | 108.2 | 0 | 0 | 110 | Y223 | Y223-E225 PolarHBondContact O-N 3Š|
| 226 | Y | 47.7 | Very low | 44.7 | Very low | 219 Ų | 219 | 134.3 Ų | 134.3 | 86% | 0.859 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -80.4 | 127.2 | 174.6 | -91.1 | -96.8 | 0 | 0 | 0 | 109.8 | | |
| 227 | P | 58.5 | Low | 45.6 | Very low | 123 Ų | 123 | 137 Ų | 137 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -70 | 154.4 | -177.4 | 28.1 | -34.6 | 0 | 0 | 0 | 113.1 | | |
| 228 | E | 47.3 | Very low | 45.7 | Very low | 188 Ų | 188 | 135.3 Ų | 135.3 | 88% | 0.879 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 151.1 | -162.4 | -59.8 | 171.5 | 103.4 | 0 | 0 | 115.8 | | |
| 229 | X | 37.6 | Very low | 45.9 | Very low | 94 Ų | 94 | 133 Ų | 133 | 78% | 0.777 | 81% | 0.808 | S | S | * | * | | | trans | 30.1 | 97.8 | 144.5 | 0 | 0 | 0 | 0 | 0 | 119.4 | | |
| 230 | I | 52.5 | Low | 46.4 | Very low | 165 Ų | 165 | 137 Ų | 137 | 85% | 0.846 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -70 | 133.9 | 155.1 | -59.1 | 176.2 | 0 | 0 | 0 | 108.8 | | |
| 231 | P | 52.4 | Low | 46.9 | Very low | 119 Ų | 119 | 136.7 Ų | 136.7 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 141.1 | 179.5 | -26.5 | 35.5 | 0 | 0 | 0 | 113.8 | | |
| 232 | G | 43 | Very low | 47.6 | Very low | 76 Ų | 76 | 134.3 Ų | 134.3 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 136.8 | -167.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 233 | V | 48 | Very low | 48 | Very low | 140 Ų | 140 | 129.1 Ų | 129.1 | 85% | 0.848 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 130.2 | 164.9 | -169.8 | 0 | 0 | 0 | 0 | 108.7 | G235 | V233-G235 PolarHBondContact O-N 3.3Š|
| 234 | P | 51.8 | Low | 48.6 | Very low | 122 Ų | 122 | 121.6 Ų | 121.6 | 79% | 0.792 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 119 | -177.8 | 27.1 | -33.6 | 0 | 0 | 0 | 112.3 | | |
| 235 | G | 38.3 | Very low | 49 | Very low | 71 Ų | 71 | 122.2 Ų | 122.2 | 73% | 0.732 | 80% | 0.798 | S | S | * | * | | | trans | 57.8 | 66.2 | 146 | 0 | 0 | 0 | 0 | 0 | 117.9 | V233 V237 | V233-G235 PolarHBondContact O-N 3.3Å; G235-V237 PolarHBondContact O-N 3.01Å |
| 236 | G | 44.8 | Very low | 49.2 | Very low | 81 Ų | 81 | 119.2 Ų | 119.2 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -61 | 116 | 155.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 237 | V | 56 | Low | 49.2 | Very low | 128 Ų | 128 | 112.1 Ų | 112.1 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 148.4 | -176.1 | -70.3 | 0 | 0 | 0 | 0 | 112.7 | G235 G239 | G235-V237 PolarHBondContact O-N 3.01Å; V237-G239 PolarHBondContact O-N 2.98Å |
| 238 | P | 51 | Low | 49 | Very low | 115 Ų | 115 | 112.8 Ų | 112.8 | 75% | 0.747 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 124.4 | 170.2 | -19.1 | 31.1 | 0 | 0 | 0 | 109.2 | L240 | P238-L240 PolarHBondContact O-N 3.18Š|
| 239 | G | 48.7 | Very low | 49.2 | Very low | 78 Ų | 78 | 109.4 Ų | 109.4 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | | | trans | -60.5 | 107.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | V237 G241 | V237-G239 PolarHBondContact O-N 2.98Å; G239-G241 PolarHBondContact O-N 3.2Å; G239-G241 VanDerWaalsContact O-N 3.1Å |
| 240 | L | 47.4 | Very low | 49.4 | Very low | 164 Ų | 164 | 108.5 Ų | 108.5 | 86% | 0.859 | 78% | 0.784 | S | S | * | * | | | trans | -57 | 117.6 | 169.4 | -94.3 | 67 | 0 | 0 | 0 | 107.7 | P238 | P238-L240 PolarHBondContact O-N 3.18Š|
| 241 | G | 52.5 | Low | 49.1 | Very low | 54 Ų | 54 | 103.8 Ų | 103.8 | 56% | 0.557 | 78% | 0.775 | S | S | * | * | | | trans | -56.9 | 162.2 | 162.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | G239 G243 | G239-G241 PolarHBondContact O-N 3.2Å; G239-G241 VanDerWaalsContact O-N 3.1Å; G241-G243 PolarHBondContact O-N 3.31Å |
| 242 | P | 58.3 | Low | 48.6 | Very low | 138 Ų | 138 | 103.5 Ų | 103.5 | 90% | 0.896 | 77% | 0.774 | S | S | * | * | | | trans | -53.6 | 110.5 | -177 | 22.5 | -33.4 | 0 | 0 | 0 | 110 | G244 | P242-G244 PolarHBondContact O-N 3.44Š|
| 243 | G | 47.1 | Very low | 48.7 | Very low | 70 Ų | 70 | 109.4 Ų | 109.4 | 72% | 0.722 | 78% | 0.778 | S | S | * | * | | | trans | -59.5 | 126.9 | -175.5 | 0 | 0 | 0 | 0 | 0 | 110 | G241 L245 | G241-G243 PolarHBondContact O-N 3.31Å; G243-L245 PolarHBondContact O-N 3.43Å |
| 244 | G | 49 | Very low | 48.2 | Very low | 73 Ų | 73 | 106 Ų | 106 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | | | trans | -53.3 | 138.4 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | P242 | P242-G244 PolarHBondContact O-N 3.44Š|
| 245 | L | 51 | Low | 47.9 | Very low | 167 Ų | 167 | 108.8 Ų | 108.8 | 87% | 0.874 | 77% | 0.774 | S | S | * | * | | | trans | -43.2 | 127.1 | -179.3 | -72 | 161.7 | 0 | 0 | 0 | 110.6 | G243 G247 | G243-L245 PolarHBondContact O-N 3.43Å; L245-G247 PolarHBondContact O-N 3.24Å; L245-G247 VanDerWaalsContact O-N 3.13Å |
| 246 | P | 50.9 | Low | 47.9 | Very low | 119 Ų | 119 | 112.4 Ų | 112.4 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 123.8 | 177.5 | 23.1 | -31.9 | 0 | 0 | 0 | 109 | V248 | P246-V248 PolarHBondContact O-N 3.45Š|
| 247 | G | 47.8 | Very low | 47.7 | Very low | 70 Ų | 70 | 110.9 Ų | 110.9 | 72% | 0.722 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -55 | 130.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | L245 | L245-G247 PolarHBondContact O-N 3.24Å; L245-G247 VanDerWaalsContact O-N 3.13Å |
| 248 | V | 53.7 | Low | 47.2 | Very low | 136 Ų | 136 | 116.4 Ų | 116.4 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -54 | 124.9 | -179.5 | -170.2 | 0 | 0 | 0 | 0 | 108.7 | P246 G250 | P246-V248 PolarHBondContact O-N 3.45Å; V248-G250 PolarHBondContact O-N 3.36Å |
| 249 | P | 51 | Low | 46.6 | Very low | 118 Ų | 118 | 114.8 Ų | 114.8 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 127.7 | -178.5 | 21 | -29.7 | 0 | 0 | 0 | 110.2 | G251 | P249-G251 PolarHBondContact O-N 3.4Š|
| 250 | G | 41.8 | Very low | 46.2 | Very low | 75 Ų | 75 | 114.6 Ų | 114.6 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 120.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | V248 | V248-G250 PolarHBondContact O-N 3.36Š|
| 251 | G | 46.9 | Very low | 46.1 | Very low | 65 Ų | 65 | 113 Ų | 113 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -67 | 131.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | P249 F253 | P249-G251 PolarHBondContact O-N 3.4Å; G251-F253 VanDerWaalsContact C-N 3.33Å; G251-F253 PolarHBondContact O-N 3.49Å |
| 252 | P | 42.5 | Very low | 45.6 | Very low | 114 Ų | 114 | 114.4 Ų | 114.4 | 74% | 0.74 | 79% | 0.792 | S | S | * | * | | | trans | -91.8 | 47.1 | -173 | 37.2 | -37.3 | 0 | 0 | 0 | 113.8 | | |
| 253 | F | 43.9 | Very low | 44.5 | Very low | 199 Ų | 199 | 111.2 Ų | 111.2 | 87% | 0.873 | 78% | 0.784 | S | S | * | * | | | trans | -153.4 | 140.3 | 171.1 | -58.6 | -84 | 0 | 0 | 0 | 107.6 | G251 | G251-F253 VanDerWaalsContact C-N 3.33Å; G251-F253 PolarHBondContact O-N 3.49Å |
| 254 | G | 37.7 | Very low | 44.3 | Very low | 70 Ų | 70 | 116.4 Ų | 116.4 | 72% | 0.722 | 80% | 0.795 | S | S | * | * | | | cis | -179 | 179.4 | -1.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 255 | E | 45.8 | Very low | 43.9 | Very low | 179 Ų | 179 | 122.6 Ų | 122.6 | 84% | 0.836 | 80% | 0.804 | S | S | * | * | | | trans | 70.9 | 92.1 | 174.4 | -57.6 | -168.7 | 83.1 | 0 | 0 | 119.4 | G257 | E255-G257 PolarHBondContact O-N 3.32Š|
| 256 | P | 37.9 | Very low | 43.2 | Very low | 147 Ų | 147 | 118.1 Ų | 118.1 | 96% | 0.955 | 80% | 0.798 | S | S | * | * | | | trans | -71.3 | 80.4 | 141.8 | 31.5 | -31.2 | 0 | 0 | 0 | 109.2 | | |
| 257 | G | 40.7 | Very low | 42.6 | Very low | 50 Ų | 50 | 120.6 Ų | 120.6 | 52% | 0.515 | 80% | 0.804 | S | S | . | * | | | trans | -113.7 | 97.2 | -165.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | E255 | E255-G257 PolarHBondContact O-N 3.32Š|
| 258 | R | 46 | Very low | 42.4 | Very low | 243 Ų | 243 | 125.3 Ų | 125.3 | 92% | 0.917 | 81% | 0.812 | S | S | * | * | | | trans | 52.1 | 105.8 | 158.2 | -64.4 | -176.8 | 176 | -156.6 | -2.5 | 118.5 | G260 | R258-G260 PolarHBondContact O-N 3.2Š|
| 259 | G | 38.8 | Very low | 41.7 | Very low | 81 Ų | 81 | 128.5 Ų | 128.5 | 84% | 0.835 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 125.2 | 143.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | P261 | G259-P261 WeakPolarHBondContact O-CD 3.39Š|
| 260 | G | 38.6 | Very low | 41.5 | Very low | 74 Ų | 74 | 126.3 Ų | 126.3 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 117 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | R258 | R258-G260 PolarHBondContact O-N 3.2Š|
| 261 | P | 46.6 | Very low | 41.6 | Very low | 131 Ų | 131 | 129.3 Ų | 129.3 | 85% | 0.851 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 123.7 | 158.7 | 32.3 | -28.2 | 0 | 0 | 0 | 108.5 | G259 | G259-P261 WeakPolarHBondContact O-CD 3.39Š|
| 262 | G | 40.6 | Very low | 41.3 | Very low | 83 Ų | 83 | 129.8 Ų | 129.8 | 86% | 0.856 | 83% | 0.827 | S | S | * | * | | | trans | 174.7 | 122.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 263 | G | 36.2 | Very low | 41.4 | Very low | 71 Ų | 71 | 128.1 Ų | 128.1 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | | | trans | 112.5 | 44.6 | 132.4 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 264 | L | 43.9 | Very low | 41.3 | Very low | 180 Ų | 180 | 126.2 Ų | 126.2 | 94% | 0.942 | 82% | 0.82 | S | S | * | * | | | trans | -140.3 | 32.1 | 162.7 | -67.2 | 177.4 | 0 | 0 | 0 | 113.5 | | |
| 265 | E | 38.9 | Very low | 41.6 | Very low | 203 Ų | 203 | 132 Ų | 132 | 95% | 0.949 | 83% | 0.826 | S | S | * | * | | | trans | -120.6 | 125.4 | 169 | -70.6 | -165.7 | 121.9 | 0 | 0 | 110.3 | | |
| 266 | G | 36 | Very low | 41.4 | Very low | 73 Ų | 73 | 129.2 Ų | 129.2 | 75% | 0.753 | 82% | 0.823 | S | S | * | * | | | trans | 134.1 | 69.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 267 | L | 39.4 | Very low | 41.4 | Very low | 171 Ų | 171 | 126 Ų | 126 | 90% | 0.895 | 82% | 0.818 | S | S | * | * | | | trans | 178.5 | 71.5 | 154.5 | -102.1 | 157.3 | 0 | 0 | 0 | 111.8 | | |
| 268 | L | 43 | Very low | 41.7 | Very low | 169 Ų | 169 | 128.7 Ų | 128.7 | 89% | 0.885 | 83% | 0.834 | S | S | * | * | | | trans | -171.7 | 106.2 | 130.1 | -134.2 | 64.2 | 0 | 0 | 0 | 111 | | |
| 269 | E | 39.4 | Very low | 41.5 | Very low | 202 Ų | 202 | 129.7 Ų | 129.7 | 94% | 0.944 | 84% | 0.838 | S | S | * | * | | | trans | -74.8 | 138.6 | 161.8 | -67.7 | 172.2 | 105.7 | 0 | 0 | 109.4 | | |
| 270 | G | 47.8 | Very low | 41.8 | Very low | 73 Ų | 73 | 129.4 Ų | 129.4 | 75% | 0.753 | 84% | 0.835 | S | S | * | * | | | trans | -173.2 | 94.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 271 | P | 43.7 | Very low | 42 | Very low | 138 Ų | 138 | 138.4 Ų | 138.4 | 90% | 0.896 | 85% | 0.846 | S | S | * | * | | | trans | -90.7 | 142.3 | -178.9 | 34.3 | -32.7 | 0 | 0 | 0 | 112.4 | | |
| 272 | G | 40.2 | Very low | 41.8 | Very low | 74 Ų | 74 | 135.5 Ų | 135.5 | 76% | 0.763 | 84% | 0.84 | S | S | * | * | | | trans | 147.7 | 151 | 160.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 273 | A | 44.8 | Very low | 42.4 | Very low | 79 Ų | 79 | 134.6 Ų | 134.6 | 65% | 0.653 | 83% | 0.831 | S | S | * | * | | | trans | 58.5 | 93.5 | 178 | 0 | 0 | 0 | 0 | 0 | 114.6 | F275 | A273-F275 HydrophobicContact CB-CE2 4.43Š|
| 274 | I | 41.1 | Very low | 43.2 | Very low | 159 Ų | 159 | 137.4 Ų | 137.4 | 82% | 0.815 | 84% | 0.836 | S | S | * | * | | | | 46.9 | 88 | 53.5 | -44.9 | 179 | 0 | 0 | 0 | 112.5 | | |
| 275 | F | 44.5 | Very low | 43.6 | Very low | 193 Ų | 193 | 136 Ų | 136 | 85% | 0.846 | 83% | 0.828 | S | S | * | * | | | trans | -138 | 125.3 | 148 | -86.4 | -75.7 | 0 | 0 | 0 | 109.9 | A273 | A273-F275 HydrophobicContact CB-CE2 4.43Š|
| 276 | P | 42.1 | Very low | 44.1 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | | | trans | -96.1 | 147.3 | -174.2 | 35.7 | -33.6 | 0 | 0 | 0 | 113.2 | | |
| 277 | G | 36.2 | Very low | 45 | Very low | 81 Ų | 81 | 137.2 Ų | 137.2 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | | | trans | 104.6 | 96.8 | 146 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 278 | A | 47.2 | Very low | 45.8 | Very low | 105 Ų | 105 | 133.6 Ų | 133.6 | 87% | 0.868 | 81% | 0.81 | S | S | * | * | | | trans | -145 | 105 | 144.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | G280 | A278-G280 PolarHBondContact O-N 3.32Š|
| 279 | R | 42.2 | Very low | 46.6 | Very low | 264 Ų | 264 | 131 Ų | 131 | 100% | 0.996 | 80% | 0.797 | S | S | * | * | | | trans | -86.6 | 104.9 | 178.9 | -63.4 | -178.2 | -169.8 | 169.7 | 4 | 109.9 | | |
| 280 | G | 45.5 | Very low | 47.5 | Very low | 75 Ų | 75 | 127.1 Ų | 127.1 | 77% | 0.773 | 79% | 0.787 | S | S | * | * | | | trans | -106.9 | 128.9 | 167 | 0 | 0 | 0 | 0 | 0 | 111.3 | A278 | A278-G280 PolarHBondContact O-N 3.32Š|
| 281 | R | 43.5 | Very low | 48 | Very low | 263 Ų | 263 | 130.2 Ų | 130.2 | 99% | 0.992 | 78% | 0.782 | S | S | * | * | | | trans | -73.9 | 138.4 | 173.8 | -63.5 | -176.7 | -177.8 | -153.2 | 3.5 | 110 | | |
| 282 | G | 41.3 | Very low | 48.7 | Very low | 70 Ų | 70 | 132.4 Ų | 132.4 | 72% | 0.722 | 77% | 0.772 | S | S | * | * | | | trans | -176.1 | 59 | 177.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 283 | G | 52.7 | Low | 49.5 | Very low | 64 Ų | 64 | 131.1 Ų | 131.1 | 66% | 0.66 | 76% | 0.755 | S | S | * | * | | | trans | 76.2 | 160.4 | 161.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | I285 | G283-I285 PolarHBondContact O-N 3.02Å; G283-I285 VanDerWaalsContact O-N 3.14Å |
| 284 | P | 54.3 | Low | 50.2 | Low | 131 Ų | 131 | 131.9 Ų | 131.9 | 85% | 0.851 | 76% | 0.755 | S | S | * | * | | | trans | -74.7 | 100.7 | 172 | 30.8 | -31.7 | 0 | 0 | 0 | 109.3 | C286 | P284-C286 PolarHBondContact O-N 2.7Š|
| 285 | I | 51.2 | Low | 51.3 | Low | 149 Ų | 149 | 132.7 Ų | 132.7 | 76% | 0.764 | 75% | 0.748 | S | S | * | * | | | trans | -58 | 121.6 | 171.6 | -62.6 | 167.1 | 0 | 0 | 0 | 108.2 | G283 K287 | G283-I285 PolarHBondContact O-N 3.02Å; G283-I285 VanDerWaalsContact O-N 3.14Å; I285-K287 PolarHBondContact O-N 3.5Å |
| 286 | C | 50.4 | Low | 51.9 | Low | 107 Ų | 107 | 125.9 Ų | 125.9 | 72% | 0.723 | 72% | 0.724 | S | S | * | * | | | trans | -60.3 | 108 | 171.4 | -71.2 | 0 | 0 | 0 | 0 | 109 | P284 C288 | P284-C286 PolarHBondContact O-N 2.7Å; C286-C288 PolarHBondContact O-N 3.46Å |
| 287 | K | 54.9 | Low | 52.7 | Low | 195 Ų | 195 | 125.8 Ų | 125.8 | 85% | 0.848 | 72% | 0.723 | S | S | * | * | | | trans | -72.8 | 73.9 | 164 | -69.2 | -173.4 | 177 | -173.8 | 0 | 108.9 | I285 D289 | I285-K287 PolarHBondContact O-N 3.5Å; K287-D289 PolarHBondContact O-N 3.48Å |
| 288 | C | 55.6 | Low | 53.6 | Low | 96 Ų | 96 | 126.2 Ų | 126.2 | 65% | 0.649 | 72% | 0.719 | S | S | * | * | | | trans | -72.6 | 103.3 | 159.5 | -65.9 | 0 | 0 | 0 | 0 | 106.3 | C286 T290 | C286-C288 PolarHBondContact O-N 3.46Å; C288-T290 PolarHBondContact O-N 3.3Å |
| 289 | D | 60.2 | Low | 54 | Low | 115 Ų | 115 | 122.7 Ų | 122.7 | 62% | 0.615 | 69% | 0.693 | S | S | * | * | | | trans | -54.4 | 127.2 | 170.3 | -73 | -51.6 | 0 | 0 | 0 | 108.8 | K287 E291 R292 A293 | K287-D289 PolarHBondContact O-N 3.48Å; D289-E291 PolarHBondContact O-N 3.44Å; D289-E291 VanDerWaalsContact O-N 3.13Å; D289-R292 PolarHBondContact O-N 3.34Å; D289-A293 PolarHBondContact O-N 2.9Å |
| 290 | T | 58.6 | Low | 54.6 | Low | 120 Ų | 120 | 114.8 Ų | 114.8 | 74% | 0.736 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -57.4 | -28.3 | 179.7 | 39.3 | 0 | 0 | 0 | 0 | 111.7 | C288 R292 A293 S294 | C288-T290 PolarHBondContact O-N 3.3Å; T290-R292 PolarHBondContact O-N 3.03Å; T290-A293 PolarHBondContact O-N 3.41Å; T290-S294 WeakPolarHBondContact O-CB 3.26Å; T290-S294 PolarHBondContact O-N 2.9Å; T290-S294 PolarHBondContact O-OG 3.28Å |
| 291 | E | 56.9 | Low | 54.9 | Low | 137 Ų | 137 | 116.7 Ų | 116.7 | 64% | 0.64 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -64.9 | -14.4 | 172.2 | -60.1 | -162.7 | 158.4 | 0 | 0 | 115.5 | D289 S294 R295 | D289-E291 PolarHBondContact O-N 3.44Å; D289-E291 VanDerWaalsContact O-N 3.13Å; E291-S294 WeakPolarHBondContact CA-OG 3.43Å; E291-S294 PolarHBondContact O-OG 3.06Å; E291-R295 VanDerWaalsContact O-CZ 3.31Å; E291-R295 PolarHBondContact O-NE 3.01Å; E291-R295 PolarHBondContact O-NH2 3.16Å |
| 292 | R | 59.4 | Low | 55.3 | Low | 184 Ų | 184 | 106.9 Ų | 106.9 | 69% | 0.694 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -102.8 | -30 | 177.3 | -149 | 172.5 | -170.8 | 177.5 | 2.6 | 111.7 | D289 T290 R295 | D289-R292 PolarHBondContact O-N 3.34Å; T290-R292 PolarHBondContact O-N 3.03Å; R292-R295 PolarHBondContact O-N 3.02Å |
| 293 | A | 56 | Low | 55.9 | Low | 48 Ų | 48 | 109.9 Ų | 109.9 | 40% | 0.397 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -64.2 | -41.1 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | D289 T290 R295 C296 | D289-A293 PolarHBondContact O-N 2.9Å; T290-A293 PolarHBondContact O-N 3.41Å; A293-R295 PolarHBondContact O-N 3.04Å; A293-C296 PolarHBondContact O-N 2.88Å |
| 294 | S | 59.8 | Low | 55.5 | Low | 94 Ų | 94 | 114.8 Ų | 114.8 | 66% | 0.657 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | 3.4 | 176.3 | 69.2 | 0 | 0 | 0 | 0 | 115.4 | T290 E291 | T290-S294 WeakPolarHBondContact O-CB 3.26Å; T290-S294 PolarHBondContact O-N 2.9Å; T290-S294 PolarHBondContact O-OG 3.28Å; E291-S294 WeakPolarHBondContact CA-OG 3.43Å; E291-S294 PolarHBondContact O-OG 3.06Å |
| 295 | R | 65.7 | Low | 55.2 | Low | 177 Ų | 177 | 111.4 Ų | 111.4 | 67% | 0.668 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.4 | -2.6 | 178.8 | -93.9 | -179.9 | -77.4 | -165.4 | -9.1 | 114.2 | E291 R292 A293 | E291-R295 VanDerWaalsContact O-CZ 3.31Å; E291-R295 PolarHBondContact O-NE 3.01Å; E291-R295 PolarHBondContact O-NH2 3.16Å; R292-R295 PolarHBondContact O-N 3.02Å; A293-R295 PolarHBondContact O-N 3.04Å |
| 296 | C | 56 | Low | 55.3 | Low | 50 Ų | 50 | 112.5 Ų | 112.5 | 34% | 0.338 | 66% | 0.656 | S | S | . | * | S | Bend | trans | -73.7 | 131.5 | 168.1 | -71 | 0 | 0 | 0 | 0 | 108.7 | A293 C474 | A293-C296 PolarHBondContact O-N 2.88Å; C296-C474 WeakPolarHBondContact CB-SG 3.21Å; C296-C474 WeakPolarHBondContact SG-CB 3.31Å; C296-C474 CovalentContact SG-SG 2.05Å; C296-C474 PolarHBondContact SG-SG 3.34Å |
| 297 | P | 60.2 | Low | 55.3 | Low | 117 Ų | 117 | 113 Ų | 113 | 76% | 0.76 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 148.2 | 174.8 | 28.3 | -34.4 | 0 | 0 | 0 | 109.7 | G299 | P297-G299 PolarHBondContact O-N 3.45Š|
| 298 | A | 54.6 | Low | 54.9 | Low | 90 Ų | 90 | 107 Ų | 107 | 74% | 0.744 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 137.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 299 | G | 54.6 | Low | 54.8 | Low | 31 Ų | 31 | 108.9 Ų | 108.9 | 32% | 0.32 | 66% | 0.66 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 156.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | P297 | P297-G299 PolarHBondContact O-N 3.45Š|
| 300 | P | 54.8 | Low | 54.4 | Low | 97 Ų | 97 | 109.3 Ų | 109.3 | 63% | 0.63 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 140.2 | 176.2 | 25.8 | -34.1 | 0 | 0 | 0 | 110 | G302 | P300-G302 PolarHBondContact O-N 3.4Š|
| 301 | P | 53.2 | Low | 54.1 | Low | 115 Ų | 115 | 107 Ų | 107 | 75% | 0.747 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 138 | 171.8 | -27 | 35.1 | 0 | 0 | 0 | 110.9 | | |
| 302 | G | 50.3 | Low | 54.2 | Low | 58 Ų | 58 | 109.9 Ų | 109.9 | 60% | 0.598 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 156.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P300 R304 | P300-G302 PolarHBondContact O-N 3.4Å; G302-R304 PolarHBondContact O-N 3.34Å |
| 303 | P | 54.3 | Low | 53.7 | Low | 132 Ų | 132 | 106.7 Ų | 106.7 | 86% | 0.857 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -58 | 137.8 | 175.9 | 26.3 | -34.3 | 0 | 0 | 0 | 110.2 | G305 | P303-G305 PolarHBondContact O-N 3.24Š|
| 304 | R | 45.2 | Very low | 53.3 | Low | 167 Ų | 167 | 108.4 Ų | 108.4 | 63% | 0.63 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 133.2 | 173.9 | -174 | -175.4 | 179.9 | 142 | 3.1 | 109.3 | G302 E461 | G302-R304 PolarHBondContact O-N 3.34Å; R304-E461 VanDerWaalsContact CD-OE1 3.22Å; R304-E461 WeakPolarHBondContact CD-OE1 3.39Å; R304-E461 IonicContact CZ-OE1 3.81Å; R304-E461 IonicContact CZ-OE2 3.31Å; R304-E461 IonicContact NE-OE1 3.01Å; R304-E461 PolarHBondContact NE-OE1 3.5Å; R304-E461 IonicContact NH1-OE1 2.61Å; R304-E461 PolarHBondContact NH1-OE1 2.96Å; R304-E461 IonicContact NH1-OE2 3.97Å; R304-E461 PolarHBondContact NH1-OE2 2.93Å; R304-E461 IonicContact NH2-OE1 3.02Å; R304-E461 IonicContact NH2-OE2 3.16Å; R304-E461 PolarHBondContact NH2-OE2 3.28Å |
| 305 | G | 47.8 | Very low | 52.9 | Low | 60 Ų | 60 | 108.5 Ų | 108.5 | 62% | 0.619 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 149.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | P303 | P303-G305 PolarHBondContact O-N 3.24Š|
| 306 | L | 52 | Low | 52.1 | Low | 173 Ų | 173 | 106.7 Ų | 106.7 | 91% | 0.906 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 138.2 | 173.7 | -74.6 | 163.8 | 0 | 0 | 0 | 109.8 | G308 | L306-G308 PolarHBondContact O-N 3.29Š|
| 307 | P | 50.9 | Low | 51.8 | Low | 117 Ų | 117 | 107.7 Ų | 107.7 | 76% | 0.76 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 134.8 | 171.8 | -25.7 | 34.7 | 0 | 0 | 0 | 110.7 | | |
| 308 | G | 46.5 | Very low | 51.5 | Low | 70 Ų | 70 | 108.3 Ų | 108.3 | 72% | 0.722 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 144.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111 | L306 | L306-G308 PolarHBondContact O-N 3.29Š|
| 309 | T | 53.9 | Low | 51.8 | Low | 135 Ų | 135 | 109.7 Ų | 109.7 | 83% | 0.828 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 134.7 | 170.9 | 46.3 | 0 | 0 | 0 | 0 | 109.7 | G311 | T309-G311 PolarHBondContact O-N 3.1Š|
| 310 | P | 52.9 | Low | 51.6 | Low | 124 Ų | 124 | 111.7 Ų | 111.7 | 81% | 0.805 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 138 | 168.6 | -26 | 34.9 | 0 | 0 | 0 | 110.3 | | |
| 311 | G | 50.3 | Low | 51.6 | Low | 72 Ų | 72 | 117 Ų | 117 | 74% | 0.742 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 146.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111 | T309 D313 | T309-G311 PolarHBondContact O-N 3.1Å; G311-D313 PolarHBondContact O-N 2.97Å |
| 312 | E | 59.2 | Low | 51.8 | Low | 196 Ų | 196 | 119.4 Ų | 119.4 | 92% | 0.916 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 135.9 | 174 | -63.1 | -177.5 | 128.7 | 0 | 0 | 110.1 | A314 | E312-A314 PolarHBondContact O-N 3.13Å; E312-A314 VanDerWaalsContact O-N 3.14Å |
| 313 | D | 48.8 | Very low | 51.5 | Low | 118 Ų | 118 | 120.1 Ų | 120.1 | 63% | 0.631 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 118.3 | 175.8 | -102.2 | 1.6 | 0 | 0 | 0 | 109.7 | G311 A315 R452 | G311-D313 PolarHBondContact O-N 2.97Å; D313-A315 PolarHBondContact O-N 3.47Å; D313-R452 IonicContact OD1-CZ 3.29Å; D313-R452 IonicContact OD1-NH1 2.7Å; D313-R452 PolarHBondContact OD1-NH1 2.99Å; D313-R452 IonicContact OD2-CZ 2.68Å; D313-R452 VanDerWaalsContact OD2-CZ 3.29Å; D313-R452 IonicContact OD2-NH1 2.86Å; D313-R452 PolarHBondContact OD2-NH1 3.41Å; D313-R452 IonicContact OD2-NH2 3.19Å; D313-R452 PolarHBondContact OD2-NH2 2.96Å |
| 314 | A | 48.8 | Very low | 51.5 | Low | 83 Ų | 83 | 117.2 Ų | 117.2 | 69% | 0.686 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 124.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | E312 N316 | E312-A314 PolarHBondContact O-N 3.13Å; E312-A314 VanDerWaalsContact O-N 3.14Å; A314-N316 PolarHBondContact O-N 3.5Å |
| 315 | A | 51.4 | Low | 51.6 | Low | 96 Ų | 96 | 118.6 Ų | 118.6 | 79% | 0.793 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 131.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | D313 G317 | D313-A315 PolarHBondContact O-N 3.47Å; A315-G317 PolarHBondContact O-N 3.48Å |
| 316 | N | 48.8 | Very low | 51.5 | Low | 140 Ų | 140 | 119.3 Ų | 119.3 | 75% | 0.749 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 126.3 | -178.7 | -80.3 | 3.5 | 0 | 0 | 0 | 110.5 | A314 T318 | A314-N316 PolarHBondContact O-N 3.5Å; N316-T318 PolarHBondContact O-N 3.1Å |
| 317 | G | 49.1 | Very low | 51.6 | Low | 71 Ų | 71 | 119.3 Ų | 119.3 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 135.3 | 175 | 0 | 0 | 0 | 0 | 0 | 110.8 | A315 | A315-G317 PolarHBondContact O-N 3.48Š|
| 318 | T | 54.9 | Low | 51.3 | Low | 129 Ų | 129 | 121.9 Ų | 121.9 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61 | 136.9 | 170 | 50.2 | 0 | 0 | 0 | 0 | 109.4 | N316 G320 | N316-T318 PolarHBondContact O-N 3.1Å; T318-G320 PolarHBondContact O-N 3.21Å |
| 319 | P | 59.1 | Low | 51.4 | Low | 119 Ų | 119 | 122.9 Ų | 122.9 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 136.2 | 176.8 | -29.5 | 35.7 | 0 | 0 | 0 | 112.4 | | |
| 320 | G | 50.8 | Low | 51 | Low | 74 Ų | 74 | 126.5 Ų | 126.5 | 76% | 0.763 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 144.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | T318 | T318-G320 PolarHBondContact O-N 3.21Š|
| 321 | K | 55 | Low | 50.9 | Low | 207 Ų | 207 | 126.4 Ų | 126.4 | 90% | 0.9 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 141 | 168.9 | -63.6 | 178 | -178.5 | 176.9 | 0 | 108.9 | G323 | K321-G323 PolarHBondContact O-N 3.38Š|
| 322 | D | 57.5 | Low | 51 | Low | 166 Ų | 166 | 131.5 Ų | 131.5 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 127.8 | -179.9 | -51.3 | -33.3 | 0 | 0 | 0 | 111.9 | G324 | D322-G324 PolarHBondContact O-N 3.47Š|
| 323 | G | 44.9 | Very low | 50.5 | Low | 74 Ų | 74 | 130.8 Ų | 130.8 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | | | trans | -75.4 | 110.4 | -171.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | K321 | K321-G323 PolarHBondContact O-N 3.38Š|
| 324 | G | 52.8 | Low | 50.6 | Low | 71 Ų | 71 | 131.4 Ų | 131.4 | 73% | 0.732 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 143.1 | 163.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | D322 G326 | D322-G324 PolarHBondContact O-N 3.47Å; G324-G326 PolarHBondContact O-N 3.5Å |
| 325 | H | 47.9 | Very low | 50.4 | Low | 195 Ų | 195 | 137 Ų | 137 | 90% | 0.903 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 116.5 | -176.4 | -50.1 | -55.8 | 0 | 0 | 0 | 112.3 | | |
| 326 | G | 46.3 | Very low | 50.6 | Low | 75 Ų | 75 | 139.5 Ų | 139.5 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -81 | 138.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | G324 | G324-G326 PolarHBondContact O-N 3.5Š|
| 327 | L | 54.1 | Low | 50.8 | Low | 174 Ų | 174 | 138.6 Ų | 138.6 | 91% | 0.911 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 138.1 | 171 | -73.2 | 162.9 | 0 | 0 | 0 | 110.3 | A329 | L327-A329 PolarHBondContact O-N 3.48Š|
| 328 | D | 44 | Very low | 50.6 | Low | 171 Ų | 171 | 141.4 Ų | 141.4 | 91% | 0.914 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 117.5 | -178.3 | -60.2 | -61.6 | 0 | 0 | 0 | 112.6 | | |
| 329 | A | 48.3 | Very low | 50.2 | Low | 91 Ų | 91 | 144.5 Ų | 144.5 | 75% | 0.752 | 83% | 0.829 | S | S | * | * | | | trans | -105.2 | 121.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | L327 | L327-A329 PolarHBondContact O-N 3.48Š|
| 330 | K | 46.5 | Very low | 49.5 | Very low | 210 Ų | 210 | 150.8 Ų | 150.8 | 91% | 0.913 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 138.3 | 176.9 | -75.4 | 178.4 | 172.8 | -179.7 | 0 | 111.8 | | |
| 331 | V | 51.3 | Low | 49 | Very low | 123 Ų | 123 | 152.9 Ų | 152.9 | 75% | 0.745 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -103.1 | 120.7 | 165.5 | -179.3 | 0 | 0 | 0 | 0 | 108.9 | | |
| 332 | E | 50.7 | Low | 48.8 | Very low | 178 Ų | 178 | 149 Ų | 149 | 83% | 0.832 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 135.7 | 168.3 | -71.7 | -166.2 | 142.8 | 0 | 0 | 110.7 | | |
| 333 | H | 50.2 | Low | 48.3 | Very low | 182 Ų | 182 | 146.7 Ų | 146.7 | 84% | 0.843 | 83% | 0.832 | S | S | * | * | | | trans | -91.7 | 109.7 | 175.4 | -71.9 | -66.3 | 0 | 0 | 0 | 111.2 | | |
| 334 | V | 49.5 | Very low | 48.7 | Very low | 130 Ų | 130 | 148.3 Ų | 148.3 | 79% | 0.788 | 83% | 0.829 | S | S | * | * | | | trans | -88.7 | 129 | 168.2 | -178.2 | 0 | 0 | 0 | 0 | 109.8 | L336 | V334-L336 HydrophobicContact CG1-CD1 4.28Š|
| 335 | K | 45.8 | Very low | 48.3 | Very low | 201 Ų | 201 | 151.1 Ų | 151.1 | 87% | 0.874 | 83% | 0.834 | S | S | * | * | | | trans | -114.7 | 115.1 | -172.5 | -176.5 | -178.4 | -176.5 | 179.7 | 0 | 110.1 | | |
| 336 | L | 55.6 | Low | 47.9 | Very low | 148 Ų | 148 | 145.7 Ų | 145.7 | 78% | 0.775 | 83% | 0.832 | S | S | * | * | | | trans | -115.4 | 141.4 | 174.8 | -112.1 | 71.6 | 0 | 0 | 0 | 111.5 | V334 | V334-L336 HydrophobicContact CG1-CD1 4.28Š|
| 337 | P | 52.5 | Low | 48.2 | Very low | 122 Ų | 122 | 145 Ų | 145 | 79% | 0.792 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 151 | -176.1 | 35.6 | -34.9 | 0 | 0 | 0 | 114 | | |
| 338 | C | 44.3 | Very low | 47.9 | Very low | 129 Ų | 129 | 143 Ų | 143 | 87% | 0.872 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 138.5 | -175.7 | -47.2 | 0 | 0 | 0 | 0 | 113.4 | | |
| 339 | Q | 48 | Very low | 47.8 | Very low | 195 Ų | 195 | 138.6 Ų | 138.6 | 91% | 0.911 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -97.1 | 152.1 | 165 | -76.3 | -177.5 | -20.9 | 0 | 0 | 111.3 | | |
| 340 | R | 43.2 | Very low | 47.8 | Very low | 250 Ų | 250 | 137.6 Ų | 137.6 | 94% | 0.943 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 139.4 | -179.1 | -69.7 | 176.6 | 173.3 | 170.9 | -3.9 | 111.4 | | |
| 341 | C | 41.7 | Very low | 47.8 | Very low | 118 Ų | 118 | 136.2 Ų | 136.2 | 80% | 0.797 | 82% | 0.817 | S | S | * | * | | | trans | -120.9 | 147.5 | 167.1 | -68 | 0 | 0 | 0 | 0 | 110.5 | | |
| 342 | P | 50.9 | Low | 47.4 | Very low | 127 Ų | 127 | 133.5 Ų | 133.5 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 149.5 | 179.9 | 30.7 | -34.9 | 0 | 0 | 0 | 113 | | |
| 343 | S | 46.1 | Very low | 47.6 | Very low | 116 Ų | 116 | 129.6 Ų | 129.6 | 81% | 0.811 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 133.2 | -167.6 | -49.8 | 0 | 0 | 0 | 0 | 114.5 | | |
| 344 | P | 53.2 | Low | 47.9 | Very low | 109 Ų | 109 | 126.9 Ų | 126.9 | 71% | 0.708 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 165.3 | 164 | 33.4 | -34.2 | 0 | 0 | 0 | 111.9 | | |
| 345 | P | 44.2 | Very low | 47.9 | Very low | 129 Ų | 129 | 123.5 Ų | 123.5 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 139.1 | 175.7 | -25.5 | 35.3 | 0 | 0 | 0 | 112.9 | G347 | P345-G347 PolarHBondContact O-N 3.19Š|
| 346 | G | 40.2 | Very low | 48.6 | Very low | 82 Ų | 82 | 120.2 Ų | 120.2 | 85% | 0.845 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 122.5 | -174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 347 | G | 51.6 | Low | 48.2 | Very low | 60 Ų | 60 | 121.8 Ų | 121.8 | 62% | 0.619 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -70 | 172.7 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | P345 G349 | P345-G347 PolarHBondContact O-N 3.19Å; G347-G349 PolarHBondContact O-N 3.41Å |
| 348 | P | 47.1 | Very low | 48 | Very low | 133 Ų | 133 | 118.9 Ų | 118.9 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -50.1 | 140 | 171.4 | -24.8 | 34.4 | 0 | 0 | 0 | 110.9 | G350 | P348-G350 PolarHBondContact O-N 3.44Š|
| 349 | G | 43.3 | Very low | 48.5 | Very low | 77 Ų | 77 | 121 Ų | 121 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 127.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | G347 | G347-G349 PolarHBondContact O-N 3.41Š|
| 350 | G | 48.9 | Very low | 48.6 | Very low | 71 Ų | 71 | 119 Ų | 119 | 73% | 0.732 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 143.5 | -177 | 0 | 0 | 0 | 0 | 0 | 110.8 | P348 G352 | P348-G350 PolarHBondContact O-N 3.44Å; G350-G352 PolarHBondContact O-N 3.44Å |
| 351 | L | 44.6 | Very low | 48.8 | Very low | 180 Ų | 180 | 110 Ų | 110 | 94% | 0.942 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -46.8 | 127.4 | 165.2 | -82.8 | 157.3 | 0 | 0 | 0 | 108.1 | A353 | L351-A353 PolarHBondContact O-N 3.16Š|
| 352 | G | 44.3 | Very low | 49.7 | Very low | 67 Ų | 67 | 112 Ų | 112 | 69% | 0.691 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 139.7 | -177.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | G350 | G350-G352 PolarHBondContact O-N 3.44Š|
| 353 | A | 53.5 | Low | 50.1 | Low | 95 Ų | 95 | 113.4 Ų | 113.4 | 79% | 0.785 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 130.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | L351 G355 | L351-A353 PolarHBondContact O-N 3.16Å; A353-G355 PolarHBondContact O-N 3.05Å |
| 354 | P | 57.5 | Low | 50.2 | Low | 125 Ų | 125 | 111 Ų | 111 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 135.9 | 174.5 | -28.4 | 35.3 | 0 | 0 | 0 | 109.8 | | |
| 355 | G | 50.1 | Low | 50.5 | Low | 60 Ų | 60 | 110.2 Ų | 110.2 | 62% | 0.619 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 147.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | A353 Q357 | A353-G355 PolarHBondContact O-N 3.05Å; G355-Q357 PolarHBondContact O-N 3.47Å; G355-Q357 VanDerWaalsContact O-N 3.15Å |
| 356 | P | 59.3 | Low | 51.5 | Low | 132 Ų | 132 | 110 Ų | 110 | 86% | 0.857 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -53 | 128 | 179.9 | 23.8 | -33.8 | 0 | 0 | 0 | 109 | G358 | P356-G358 PolarHBondContact O-N 3.05Š|
| 357 | Q | 48.8 | Very low | 51.9 | Low | 181 Ų | 181 | 109.6 Ų | 109.6 | 85% | 0.846 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 132.9 | 177.4 | -174.1 | 173.9 | 10.5 | 0 | 0 | 108.6 | G355 L359 | G355-Q357 PolarHBondContact O-N 3.47Å; G355-Q357 VanDerWaalsContact O-N 3.15Å; Q357-L359 PolarHBondContact O-N 2.94Å |
| 358 | G | 47.5 | Very low | 52 | Low | 60 Ų | 60 | 113.6 Ų | 113.6 | 62% | 0.619 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 140.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | P356 I360 | P356-G358 PolarHBondContact O-N 3.05Å; G358-I360 PolarHBondContact O-N 3.44Å |
| 359 | L | 55.3 | Low | 52.4 | Low | 175 Ų | 175 | 112.3 Ų | 112.3 | 92% | 0.916 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 125.4 | 175.1 | -73.9 | 156.9 | 0 | 0 | 0 | 108.8 | Q357 G361 | Q357-L359 PolarHBondContact O-N 2.94Å; L359-G361 PolarHBondContact O-N 2.94Å |
| 360 | I | 49.4 | Very low | 52.6 | Low | 153 Ų | 153 | 111.8 Ų | 111.8 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 126.4 | 168.5 | -72.3 | 173.5 | 0 | 0 | 0 | 106.8 | G358 N362 | G358-I360 PolarHBondContact O-N 3.44Å; I360-N362 PolarHBondContact O-N 3.48Å |
| 361 | G | 47.6 | Very low | 53 | Low | 59 Ų | 59 | 119.1 Ų | 119.1 | 61% | 0.608 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 135.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | L359 D363 | L359-G361 PolarHBondContact O-N 2.94Å; G361-D363 PolarHBondContact O-N 2.76Å |
| 362 | N | 61.4 | Low | 53.3 | Low | 161 Ų | 161 | 118.7 Ų | 118.7 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 139.7 | 179 | -60.9 | -46.4 | 0 | 0 | 0 | 109.9 | I360 G364 | I360-N362 PolarHBondContact O-N 3.48Å; N362-G364 PolarHBondContact O-N 3.43Å |
| 363 | D | 58.4 | Low | 53.3 | Low | 156 Ų | 156 | 119 Ų | 119 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -52 | 140.2 | 172.5 | -66.2 | -47.3 | 0 | 0 | 0 | 110.3 | G361 A365 | G361-D363 PolarHBondContact O-N 2.76Å; D363-A365 PolarHBondContact O-N 3.34Å |
| 364 | G | 48.8 | Very low | 53.7 | Low | 67 Ų | 67 | 120.7 Ų | 120.7 | 69% | 0.691 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 136.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | N362 | N362-G364 PolarHBondContact O-N 3.43Š|
| 365 | A | 58.5 | Low | 54.2 | Low | 91 Ų | 91 | 120.6 Ų | 120.6 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 136.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | D363 G367 | D363-A365 PolarHBondContact O-N 3.34Å; A365-G367 PolarHBondContact O-N 2.99Å |
| 366 | P | 65.2 | Low | 54.5 | Low | 126 Ų | 126 | 121.2 Ų | 121.2 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 134.4 | 176.8 | -27.6 | 34.9 | 0 | 0 | 0 | 111.4 | V368 | P366-V368 PolarHBondContact O-N 2.96Š|
| 367 | G | 48.9 | Very low | 54.6 | Low | 73 Ų | 73 | 120.2 Ų | 120.2 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 134.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | A365 S369 | A365-G367 PolarHBondContact O-N 2.99Å; G367-S369 PolarHBondContact O-N 2.98Å |
| 368 | V | 54.5 | Low | 55.6 | Low | 143 Ų | 143 | 117.5 Ų | 117.5 | 87% | 0.867 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 122 | -179.5 | -152.5 | 0 | 0 | 0 | 0 | 108.7 | P366 G370 | P366-V368 PolarHBondContact O-N 2.96Å; V368-G370 PolarHBondContact O-N 2.72Å |
| 369 | S | 54.4 | Low | 56 | Low | 106 Ų | 106 | 118.1 Ų | 118.1 | 74% | 0.741 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 126.5 | 176.3 | 52.1 | 0 | 0 | 0 | 0 | 110 | G367 R371 | G367-S369 PolarHBondContact O-N 2.98Å; S369-R371 PolarHBondContact O-N 3.42Å |
| 370 | G | 47.9 | Very low | 56.7 | Low | 67 Ų | 67 | 119.2 Ų | 119.2 | 69% | 0.691 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -52 | 129.3 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | V368 H372 | V368-G370 PolarHBondContact O-N 2.72Å; G370-H372 PolarHBondContact O-N 3.21Å |
| 371 | R | 56.7 | Low | 57 | Low | 225 Ų | 225 | 120.5 Ų | 120.5 | 85% | 0.849 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 124.7 | 178.8 | -169.9 | 178.4 | -178.9 | -176 | 0.5 | 108.7 | S369 G373 | S369-R371 PolarHBondContact O-N 3.42Å; R371-G373 PolarHBondContact O-N 3.43Å |
| 372 | H | 51.4 | Low | 57.7 | Low | 171 Ų | 171 | 120.2 Ų | 120.2 | 79% | 0.792 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 134.6 | 173.3 | -58.8 | -57.8 | 0 | 0 | 0 | 109.7 | G370 N374 | G370-H372 PolarHBondContact O-N 3.21Å; H372-N374 PolarHBondContact O-N 3.49Å |
| 373 | G | 44.9 | Very low | 58.1 | Low | 73 Ų | 73 | 118.4 Ų | 118.4 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 136.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | R371 | R371-G373 PolarHBondContact O-N 3.43Š|
| 374 | N | 60.8 | Low | 58.6 | Low | 131 Ų | 131 | 116.9 Ų | 116.9 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 140 | 173.9 | -66.6 | -25.5 | 0 | 0 | 0 | 109 | H372 | H372-N374 PolarHBondContact O-N 3.49Š|
| 375 | P | 69.1 | Low | 59.3 | Low | 122 Ų | 122 | 116.8 Ų | 116.8 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 143.2 | 169 | -25.2 | 34.5 | 0 | 0 | 0 | 110.7 | | |
| 376 | G | 55.5 | Low | 59.9 | Low | 73 Ų | 73 | 120.2 Ų | 120.2 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 145.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 377 | S | 61.9 | Low | 60.3 | Low | 111 Ų | 111 | 120 Ų | 120 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 140 | 175.1 | 49.2 | 0 | 0 | 0 | 0 | 110.4 | | |
| 378 | P | 69.8 | Low | 61.2 | Low | 124 Ų | 124 | 119.2 Ų | 119.2 | 81% | 0.805 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 143.7 | 169.8 | -25.7 | 34.9 | 0 | 0 | 0 | 110.9 | | |
| 379 | G | 55.1 | Low | 62.3 | Low | 74 Ų | 74 | 118.7 Ų | 118.7 | 76% | 0.763 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 149.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | M381 | G379-M381 PolarHBondContact O-N 3.25Š|
| 380 | E | 70.4 | Confident | 63 | Low | 197 Ų | 197 | 122 Ų | 122 | 92% | 0.921 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 138.5 | 176.4 | -64.4 | -174.6 | 140.3 | 0 | 0 | 110.9 | G382 | E380-G382 PolarHBondContact O-N 3.17Š|
| 381 | M | 55.6 | Low | 64 | Low | 180 Ų | 180 | 121.3 Ų | 121.3 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 131.4 | 173.8 | -177.3 | 170.8 | 63.9 | 0 | 0 | 109.2 | G379 | G379-M381 PolarHBondContact O-N 3.25Š|
| 382 | G | 62.4 | Low | 65 | Low | 53 Ų | 53 | 116.9 Ų | 116.9 | 55% | 0.546 | 77% | 0.77 | S | S | . | * | P | Polyproline II helix | trans | -56.7 | 152.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | E380 | E380-G382 PolarHBondContact O-N 3.17Š|
| 383 | P | 69.8 | Low | 66.2 | Low | 123 Ų | 123 | 120.6 Ų | 120.6 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 147.2 | -179.2 | 25.2 | -34.7 | 0 | 0 | 0 | 111.1 | | |
| 384 | P | 69.7 | Low | 67.5 | Low | 125 Ų | 125 | 119.6 Ų | 119.6 | 81% | 0.812 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -52 | 143.3 | 173.8 | -26.5 | 34.7 | 0 | 0 | 0 | 111.9 | | |
| 385 | G | 63.5 | Low | 68.4 | Low | 65 Ų | 65 | 119.5 Ų | 119.5 | 67% | 0.67 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 146.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 386 | L | 71 | Confident | 68.7 | Low | 163 Ų | 163 | 123.6 Ų | 123.6 | 85% | 0.853 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 139.7 | 174.8 | -69 | 170.4 | 0 | 0 | 0 | 110.1 | G388 | L386-G388 PolarHBondContact O-N 3.4Š|
| 387 | P | 72.3 | Confident | 69.4 | Low | 121 Ų | 121 | 123.1 Ų | 123.1 | 79% | 0.786 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 138.5 | 174 | -27 | 34.9 | 0 | 0 | 0 | 111.6 | | |
| 388 | G | 68.4 | Low | 69.9 | Low | 57 Ų | 57 | 127.3 Ų | 127.3 | 59% | 0.588 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 155.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L386 L390 | L386-G388 PolarHBondContact O-N 3.4Å; G388-L390 PolarHBondContact O-N 3.3Å |
| 389 | P | 76.9 | Confident | 70.1 | Confident | 132 Ų | 132 | 127.1 Ų | 127.1 | 86% | 0.857 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 137.8 | 177.7 | 25.5 | -34.4 | 0 | 0 | 0 | 110.6 | G391 | P389-G391 PolarHBondContact O-N 2.82Š|
| 390 | L | 70.4 | Confident | 70.3 | Confident | 174 Ų | 174 | 126.6 Ų | 126.6 | 91% | 0.911 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 125.9 | 179.1 | -174.2 | 70.6 | 0 | 0 | 0 | 110 | G388 | G388-L390 PolarHBondContact O-N 3.3Š|
| 391 | G | 68.3 | Low | 69.7 | Low | 54 Ų | 54 | 126.9 Ų | 126.9 | 56% | 0.557 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 149.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | P389 R393 | P389-G391 PolarHBondContact O-N 2.82Å; G391-R393 PolarHBondContact O-N 2.96Å |
| 392 | P | 78.7 | Confident | 69.4 | Low | 132 Ų | 132 | 125.8 Ų | 125.8 | 86% | 0.857 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 137.8 | -179.2 | 24.8 | -34.3 | 0 | 0 | 0 | 110.5 | G394 | P392-G394 PolarHBondContact O-N 3.5Š|
| 393 | R | 76.3 | Confident | 68.9 | Low | 248 Ų | 248 | 131.9 Ų | 131.9 | 94% | 0.936 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 125 | 177.6 | -179.4 | 179.2 | 178.9 | 171.4 | 2 | 109.5 | G391 | G391-R393 PolarHBondContact O-N 2.96Š|
| 394 | G | 71.7 | Confident | 68.2 | Low | 52 Ų | 52 | 133.6 Ų | 133.6 | 54% | 0.536 | 78% | 0.777 | S | S | . | * | P | Polyproline II helix | trans | -52.7 | 150.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | P392 K396 | P392-G394 PolarHBondContact O-N 3.5Å; G394-K396 PolarHBondContact O-N 3.33Å |
| 395 | P | 79.3 | Confident | 67.1 | Low | 130 Ų | 130 | 137 Ų | 137 | 84% | 0.844 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 141.2 | -175.8 | 23.8 | -34.2 | 0 | 0 | 0 | 111 | G397 | P395-G397 PolarHBondContact O-N 3.06Š|
| 396 | K | 76.8 | Confident | 66.6 | Low | 207 Ų | 207 | 140.4 Ų | 140.4 | 90% | 0.9 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 128 | 175.6 | -165.2 | 178.9 | -176.4 | -176.1 | 0 | 108.3 | G394 | G394-K396 PolarHBondContact O-N 3.33Š|
| 397 | G | 69.8 | Low | 65.5 | Low | 64 Ų | 64 | 143 Ų | 143 | 66% | 0.66 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 142 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | P395 | P395-G397 PolarHBondContact O-N 3.06Š|
| 398 | K | 72.7 | Confident | 64.6 | Low | 199 Ų | 199 | 140.3 Ų | 140.3 | 87% | 0.865 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 138.1 | 176.8 | -64.9 | -179.9 | -179.7 | 178.9 | 0 | 109 | G400 | K398-G400 PolarHBondContact O-N 2.94Š|
| 399 | P | 74 | Confident | 64.1 | Low | 120 Ų | 120 | 142.3 Ų | 142.3 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 138.1 | 170.6 | -26 | 34.8 | 0 | 0 | 0 | 110.4 | F401 | P399-F401 PolarHBondContact O-N 3.22Š|
| 400 | G | 57.8 | Low | 63.4 | Low | 62 Ų | 62 | 145.7 Ų | 145.7 | 64% | 0.639 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 137.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | K398 D402 | K398-G400 PolarHBondContact O-N 2.94Å; G400-D402 PolarHBondContact O-N 3.5Å |
| 401 | F | 58.4 | Low | 62.8 | Low | 203 Ų | 203 | 140.6 Ų | 140.6 | 89% | 0.89 | 79% | 0.787 | S | S | * | * | | | trans | -68.3 | 114.8 | 175.7 | -108.5 | -94.9 | 0 | 0 | 0 | 109.2 | P399 K403 | P399-F401 PolarHBondContact O-N 3.22Å; F401-K403 PolarHBondContact O-N 2.98Å; F401-K403 VanDerWaalsContact O-N 3.16Å |
| 402 | D | 49.1 | Very low | 62.8 | Low | 158 Ų | 158 | 147.2 Ų | 147.2 | 85% | 0.845 | 80% | 0.804 | S | S | * | * | | | trans | -67.3 | 110.5 | 177.5 | -54.1 | -63.8 | 0 | 0 | 0 | 110.2 | G400 | G400-D402 PolarHBondContact O-N 3.5Š|
| 403 | K | 52.2 | Low | 62.1 | Low | 180 Ų | 180 | 150.7 Ų | 150.7 | 78% | 0.783 | 81% | 0.806 | S | S | * | * | | | trans | -139.2 | 132.9 | 159.2 | -69.9 | -163.3 | 177.5 | -170.6 | 0 | 109.8 | F401 | F401-K403 PolarHBondContact O-N 2.98Å; F401-K403 VanDerWaalsContact O-N 3.16Å |
| 404 | E | 56.3 | Low | 61.2 | Low | 159 Ų | 159 | 142 Ų | 142 | 74% | 0.743 | 79% | 0.793 | S | S | * | * | S | Bend | trans | 6.8 | 117.6 | 178 | -96 | 80.9 | 175.1 | 0 | 0 | 120.2 | | |
| 405 | F | 45.7 | Very low | 60.7 | Low | 196 Ų | 196 | 145.1 Ų | 145.1 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | S | Bend | trans | 42.3 | 74.8 | 145.6 | -58.4 | -75.5 | 0 | 0 | 0 | 119.2 | | |
| 406 | T | 53.9 | Low | 59.8 | Low | 137 Ų | 137 | 143.5 Ų | 143.5 | 84% | 0.84 | 80% | 0.804 | S | S | * | * | | | | -146.6 | 150.8 | 128.9 | 28.3 | 0 | 0 | 0 | 0 | 109.6 | G408 | T406-G408 PolarHBondContact O-N 3.45Š|
| 407 | K | 47.6 | Very low | 59 | Low | 218 Ų | 218 | 136.6 Ų | 136.6 | 95% | 0.948 | 79% | 0.791 | S | S | * | * | | | trans | -73.1 | 76.4 | 176.3 | -172.7 | 177.8 | -178.8 | 177.5 | 0 | 109.5 | | |
| 408 | G | 53 | Low | 59.1 | Low | 64 Ų | 64 | 139.8 Ų | 139.8 | 66% | 0.66 | 80% | 0.8 | S | S | * | * | | | trans | -56.6 | 138.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | T406 | T406-G408 PolarHBondContact O-N 3.45Š|
| 409 | A | 58.5 | Low | 58.6 | Low | 99 Ų | 99 | 139.4 Ų | 139.4 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | | | trans | -57.6 | 144.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111 | G411 | A409-G411 PolarHBondContact O-N 3.05Š|
| 410 | K | 61.8 | Low | 57.8 | Low | 203 Ų | 203 | 136.2 Ų | 136.2 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | | | trans | -54.1 | 115.8 | 172.5 | 177 | -179.4 | 178.2 | -179.7 | 0 | 108.4 | E412 | K410-E412 PolarHBondContact O-N 3.41Š|
| 411 | G | 56.7 | Low | 58.3 | Low | 67 Ų | 67 | 139.3 Ų | 139.3 | 69% | 0.691 | 80% | 0.8 | S | S | * | * | | | trans | -49.5 | 138.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112 | A409 | A409-G411 PolarHBondContact O-N 3.05Š|
| 412 | E | 68.5 | Low | 58.4 | Low | 193 Ų | 193 | 136.3 Ų | 136.3 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | | | trans | -55.4 | 144 | -174.1 | -63.7 | -174.7 | 137.3 | 0 | 0 | 111.2 | K410 G414 | K410-E412 PolarHBondContact O-N 3.41Å; E412-G414 PolarHBondContact O-N 3.39Å |
| 413 | K | 64.3 | Low | 58.5 | Low | 206 Ų | 206 | 131.3 Ų | 131.3 | 90% | 0.896 | 78% | 0.784 | S | S | * | * | | | trans | -62.1 | 115.4 | 175.3 | -174.7 | -176 | -177.5 | -173.3 | 0 | 106.9 | S415 | K413-S415 PolarHBondContact O-N 3.15Š|
| 414 | G | 58.1 | Low | 59.3 | Low | 65 Ų | 65 | 131.9 Ų | 131.9 | 67% | 0.67 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -47 | 139.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111 | E412 | E412-G414 PolarHBondContact O-N 3.39Š|
| 415 | S | 60.8 | Low | 59.1 | Low | 118 Ų | 118 | 130.8 Ų | 130.8 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 150.4 | -178.4 | 45 | 0 | 0 | 0 | 0 | 111.5 | K413 G417 | K413-S415 PolarHBondContact O-N 3.15Å; S415-G417 PolarHBondContact O-N 2.91Å |
| 416 | A | 60.5 | Low | 59.4 | Low | 96 Ų | 96 | 124.5 Ų | 124.5 | 79% | 0.793 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 142.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | | |
| 417 | G | 60.5 | Low | 59.8 | Low | 61 Ų | 61 | 123.1 Ų | 123.1 | 63% | 0.629 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -58 | 156.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | S415 E419 | S415-G417 PolarHBondContact O-N 2.91Å; G417-E419 PolarHBondContact O-N 3.01Å |
| 418 | P | 70.9 | Confident | 60.5 | Low | 131 Ų | 131 | 118.6 Ų | 118.6 | 85% | 0.851 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 145.2 | 171.7 | 26 | -34.6 | 0 | 0 | 0 | 109.6 | G420 | P418-G420 PolarHBondContact O-N 3.37Š|
| 419 | E | 61.7 | Low | 60.4 | Low | 191 Ų | 191 | 118.8 Ų | 118.8 | 89% | 0.893 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 141.2 | 171.9 | -167.6 | 169.7 | -178.5 | 0 | 0 | 109.3 | G417 | G417-E419 PolarHBondContact O-N 3.01Š|
| 420 | G | 57.2 | Low | 60.3 | Low | 54 Ų | 54 | 123.9 Ų | 123.9 | 56% | 0.557 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 150.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | P418 T422 | P418-G420 PolarHBondContact O-N 3.37Å; G420-T422 PolarHBondContact O-N 3.15Å |
| 421 | P | 68.7 | Low | 60 | Low | 126 Ų | 126 | 121.9 Ų | 121.9 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 136.6 | 173.8 | 25.4 | -34.1 | 0 | 0 | 0 | 109.3 | G423 | P421-G423 PolarHBondContact O-N 2.99Š|
| 422 | T | 59.9 | Low | 59.7 | Low | 140 Ų | 140 | 123.1 Ų | 123.1 | 86% | 0.859 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 127.6 | 172 | -49.8 | 0 | 0 | 0 | 0 | 108.4 | G420 E424 | G420-T422 PolarHBondContact O-N 3.15Å; T422-E424 PolarHBondContact O-N 2.97Å |
| 423 | G | 52.3 | Low | 59.1 | Low | 53 Ų | 53 | 119.2 Ų | 119.2 | 55% | 0.546 | 78% | 0.775 | S | S | . | * | P | Polyproline II helix | trans | -54.5 | 141.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | P421 T425 | P421-G423 PolarHBondContact O-N 2.99Å; G423-T425 PolarHBondContact O-N 2.96Å |
| 424 | E | 67.9 | Low | 58.7 | Low | 192 Ų | 192 | 116.3 Ų | 116.3 | 90% | 0.897 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 129.5 | 179.3 | -64.1 | -173.8 | 134.1 | 0 | 0 | 109.6 | T422 G426 | T422-E424 PolarHBondContact O-N 2.97Å; E424-G426 PolarHBondContact O-N 3.47Å; E424-G426 VanDerWaalsContact O-N 3.1Å |
| 425 | T | 53.8 | Low | 58.6 | Low | 137 Ų | 137 | 115.6 Ų | 115.6 | 84% | 0.84 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 121.6 | 176 | -52.8 | 0 | 0 | 0 | 0 | 108.1 | G423 S427 | G423-T425 PolarHBondContact O-N 2.96Å; T425-S427 PolarHBondContact O-N 2.95Å |
| 426 | G | 51.3 | Low | 58.9 | Low | 63 Ų | 63 | 116.1 Ų | 116.1 | 65% | 0.649 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -51 | 130.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110 | E424 | E424-G426 PolarHBondContact O-N 3.47Å; E424-G426 VanDerWaalsContact O-N 3.1Å |
| 427 | S | 62.6 | Low | 58.9 | Low | 108 Ų | 108 | 119.6 Ų | 119.6 | 76% | 0.755 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 132.3 | 177.8 | 53 | 0 | 0 | 0 | 0 | 109.5 | T425 G429 | T425-S427 PolarHBondContact O-N 2.95Å; S427-G429 PolarHBondContact O-N 3.43Å |
| 428 | P | 62.6 | Low | 58.7 | Low | 124 Ų | 124 | 119.6 Ų | 119.6 | 81% | 0.805 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 135.7 | 179.8 | -30 | 35.1 | 0 | 0 | 0 | 111.1 | K430 | P428-K430 PolarHBondContact O-N 3.4Š|
| 429 | G | 50.4 | Low | 58.6 | Low | 68 Ų | 68 | 121.1 Ų | 121.1 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 133.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | S427 D431 | S427-G429 PolarHBondContact O-N 3.43Å; G429-D431 PolarHBondContact O-N 2.89Å; G429-D431 VanDerWaalsContact O-N 3.1Å |
| 430 | K | 56.5 | Low | 58.9 | Low | 205 Ų | 205 | 116.8 Ų | 116.8 | 89% | 0.891 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 124.2 | 176.1 | -67.5 | -178 | 179.4 | 178.1 | 0 | 107.6 | P428 A432 | P428-K430 PolarHBondContact O-N 3.4Å; K430-A432 PolarHBondContact O-N 3.17Å |
| 431 | D | 55.5 | Low | 59 | Low | 162 Ų | 162 | 117.1 Ų | 117.1 | 87% | 0.866 | 77% | 0.773 | S | S | * | * | | | trans | -45.8 | 115.8 | 178.7 | -67.5 | -50 | 0 | 0 | 0 | 108.6 | G429 S433 | G429-D431 PolarHBondContact O-N 2.89Å; G429-D431 VanDerWaalsContact O-N 3.1Å; D431-S433 PolarHBondContact O-N 3.42Å |
| 432 | A | 49.8 | Very low | 59.1 | Low | 92 Ų | 92 | 117.2 Ų | 117.2 | 76% | 0.76 | 77% | 0.774 | S | S | * | * | | | trans | -58.6 | 121.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 106.2 | K430 V434 | K430-A432 PolarHBondContact O-N 3.17Å; A432-V434 PolarHBondContact O-N 3.31Å |
| 433 | S | 55 | Low | 59.5 | Low | 111 Ų | 111 | 115.2 Ų | 115.2 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | | | trans | -48.4 | 120.3 | -180 | 51.8 | 0 | 0 | 0 | 0 | 108.1 | D431 G435 | D431-S433 PolarHBondContact O-N 3.42Å; S433-G435 PolarHBondContact O-N 3.07Å |
| 434 | V | 57.4 | Low | 59.7 | Low | 145 Ų | 145 | 116 Ų | 116 | 88% | 0.879 | 78% | 0.781 | S | S | * | * | | | trans | -42.7 | 119 | -177.7 | 178.6 | 0 | 0 | 0 | 0 | 107.7 | A432 | A432-V434 PolarHBondContact O-N 3.31Š|
| 435 | G | 55.1 | Low | 59.5 | Low | 50 Ų | 50 | 114.6 Ų | 114.6 | 52% | 0.515 | 78% | 0.778 | S | S | . | * | P | Polyproline II helix | trans | -52.6 | 151.6 | -175.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | S433 L437 | S433-G435 PolarHBondContact O-N 3.07Å; G435-L437 PolarHBondContact O-N 2.94Å; G435-L437 VanDerWaalsContact O-N 3.16Å |
| 436 | P | 66.9 | Low | 60 | Low | 130 Ų | 130 | 113.8 Ų | 113.8 | 84% | 0.844 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 131.1 | 176.5 | 23.4 | -33.7 | 0 | 0 | 0 | 108.7 | G438 | P436-G438 PolarHBondContact O-N 3.34Š|
| 437 | L | 60.3 | Low | 60.1 | Low | 168 Ų | 168 | 113.9 Ų | 113.9 | 88% | 0.88 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 117.8 | 176.8 | 176.4 | 65.9 | 0 | 0 | 0 | 107.1 | G435 D439 | G435-L437 PolarHBondContact O-N 2.94Å; G435-L437 VanDerWaalsContact O-N 3.16Å; L437-D439 PolarHBondContact O-N 3.25Å |
| 438 | G | 56.9 | Low | 60.1 | Low | 62 Ų | 62 | 116.6 Ų | 116.6 | 64% | 0.639 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 140.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | P436 A440 | P436-G438 PolarHBondContact O-N 3.34Å; G438-A440 PolarHBondContact O-N 2.96Å |
| 439 | D | 68.4 | Low | 60 | Low | 162 Ų | 162 | 116.3 Ų | 116.3 | 87% | 0.866 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 138.3 | -179.1 | -70.7 | -50.1 | 0 | 0 | 0 | 110.3 | L437 G441 | L437-D439 PolarHBondContact O-N 3.25Å; D439-G441 PolarHBondContact O-N 3.45Å; D439-G441 VanDerWaalsContact O-N 3.13Å |
| 440 | A | 67.9 | Low | 60.1 | Low | 101 Ų | 101 | 116.4 Ų | 116.4 | 84% | 0.835 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 125.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | G438 | G438-A440 PolarHBondContact O-N 2.96Š|
| 441 | G | 60.7 | Low | 60.4 | Low | 60 Ų | 60 | 115.9 Ų | 115.9 | 62% | 0.619 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 150.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111 | D439 A443 | D439-G441 PolarHBondContact O-N 3.45Å; D439-G441 VanDerWaalsContact O-N 3.13Å; G441-A443 PolarHBondContact O-N 3.3Å |
| 442 | P | 70.9 | Confident | 60.3 | Low | 128 Ų | 128 | 115.8 Ų | 115.8 | 83% | 0.831 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 144.1 | 179.5 | 24.4 | -34.4 | 0 | 0 | 0 | 110.1 | G444 | P442-G444 PolarHBondContact O-N 2.93Š|
| 443 | A | 66.8 | Low | 60.3 | Low | 99 Ų | 99 | 114.2 Ų | 114.2 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 134.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | G441 L445 | G441-A443 PolarHBondContact O-N 3.3Å; A443-L445 PolarHBondContact O-N 2.96Å |
| 444 | G | 56.1 | Low | 60.5 | Low | 70 Ų | 70 | 116.8 Ų | 116.8 | 72% | 0.722 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 142.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | P442 | P442-G444 PolarHBondContact O-N 2.93Š|
| 445 | L | 65.5 | Low | 60.5 | Low | 162 Ų | 162 | 115.8 Ų | 115.8 | 85% | 0.848 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 140 | 173.6 | -67.3 | 172.9 | 0 | 0 | 0 | 109.2 | A443 G447 | A443-L445 PolarHBondContact O-N 2.96Å; L445-G447 PolarHBondContact O-N 3.23Å |
| 446 | P | 64 | Low | 60.3 | Low | 120 Ų | 120 | 116.2 Ų | 116.2 | 78% | 0.779 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 138.5 | 171.3 | -26.5 | 34.8 | 0 | 0 | 0 | 110.2 | L448 | P446-L448 PolarHBondContact O-N 3.5Š|
| 447 | G | 53.6 | Low | 59.9 | Low | 65 Ų | 65 | 116.2 Ų | 116.2 | 67% | 0.67 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 142 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L445 | L445-G447 PolarHBondContact O-N 3.23Š|
| 448 | L | 61.8 | Low | 59.5 | Low | 165 Ų | 165 | 116.3 Ų | 116.3 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 138.4 | 172.1 | -67.7 | 173.4 | 0 | 0 | 0 | 108.9 | P446 G450 | P446-L448 PolarHBondContact O-N 3.5Å; L448-G450 PolarHBondContact O-N 2.94Å |
| 449 | P | 61.5 | Low | 59.2 | Low | 118 Ų | 118 | 116.2 Ų | 116.2 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -51 | 133.8 | 171.9 | -26.2 | 34.8 | 0 | 0 | 0 | 110.1 | | |
| 450 | G | 51.8 | Low | 58.6 | Low | 70 Ų | 70 | 114 Ų | 114 | 72% | 0.722 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 146.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L448 R452 | L448-G450 PolarHBondContact O-N 2.94Å; G450-R452 PolarHBondContact O-N 3.47Å |
| 451 | E | 62.2 | Low | 57.9 | Low | 193 Ų | 193 | 114.6 Ų | 114.6 | 90% | 0.902 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 139.2 | 175.7 | -64.1 | -170.4 | 128.3 | 0 | 0 | 110.2 | G453 | E451-G453 PolarHBondContact O-N 3.33Å; E451-G453 VanDerWaalsContact O-N 3.16Å |
| 452 | R | 52.7 | Low | 57.5 | Low | 161 Ų | 161 | 114.8 Ų | 114.8 | 61% | 0.608 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 124.3 | 174.2 | -176.8 | -169.9 | -75.8 | -166.3 | -7.1 | 107.8 | D313 G450 L454 | D313-R452 IonicContact OD1-CZ 3.29Å; D313-R452 IonicContact OD1-NH1 2.7Å; D313-R452 PolarHBondContact OD1-NH1 2.99Å; D313-R452 IonicContact OD2-CZ 2.68Å; D313-R452 VanDerWaalsContact OD2-CZ 3.29Å; D313-R452 IonicContact OD2-NH1 2.86Å; D313-R452 PolarHBondContact OD2-NH1 3.41Å; D313-R452 IonicContact OD2-NH2 3.19Å; D313-R452 PolarHBondContact OD2-NH2 2.96Å; G450-R452 PolarHBondContact O-N 3.47Å; R452-L454 PolarHBondContact O-N 3.34Å |
| 453 | G | 51.6 | Low | 56.8 | Low | 59 Ų | 59 | 118 Ų | 118 | 61% | 0.608 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 141.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | E451 | E451-G453 PolarHBondContact O-N 3.33Å; E451-G453 VanDerWaalsContact O-N 3.16Å |
| 454 | L | 58.9 | Low | 55.9 | Low | 165 Ų | 165 | 117.4 Ų | 117.4 | 86% | 0.864 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 141.9 | 176.4 | -68.1 | 173 | 0 | 0 | 0 | 110 | R452 G456 | R452-L454 PolarHBondContact O-N 3.34Å; L454-G456 PolarHBondContact O-N 3.01Å |
| 455 | P | 56.7 | Low | 55.6 | Low | 124 Ų | 124 | 117.1 Ų | 117.1 | 81% | 0.805 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 135.5 | 171.9 | -27.3 | 35.2 | 0 | 0 | 0 | 110.6 | | |
| 456 | G | 51.5 | Low | 55.1 | Low | 59 Ų | 59 | 117.2 Ų | 117.2 | 61% | 0.608 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 151.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | L454 I458 | L454-G456 PolarHBondContact O-N 3.01Å; G456-I458 PolarHBondContact O-N 2.95Å |
| 457 | P | 58.4 | Low | 54.6 | Low | 130 Ų | 130 | 116.2 Ų | 116.2 | 84% | 0.844 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 139 | 175.6 | 25.5 | -34.3 | 0 | 0 | 0 | 109.4 | G459 | P457-G459 PolarHBondContact O-N 3.37Å; P457-G459 VanDerWaalsContact O-N 3.14Å |
| 458 | I | 52 | Low | 54.6 | Low | 169 Ų | 169 | 116.1 Ų | 116.1 | 87% | 0.867 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 125.5 | 173.5 | -64 | 171.5 | 0 | 0 | 0 | 107.2 | G456 S460 | G456-I458 PolarHBondContact O-N 2.95Å; I458-S460 PolarHBondContact O-N 2.96Å |
| 459 | G | 49.8 | Very low | 54.6 | Low | 61 Ų | 61 | 114.6 Ų | 114.6 | 63% | 0.629 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 139.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | P457 E461 | P457-G459 PolarHBondContact O-N 3.37Å; P457-G459 VanDerWaalsContact O-N 3.14Å; G459-E461 PolarHBondContact O-N 3.39Å |
| 460 | S | 56.5 | Low | 54.1 | Low | 115 Ų | 115 | 113.7 Ų | 113.7 | 80% | 0.804 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 142.9 | 176.7 | 51.4 | 0 | 0 | 0 | 0 | 110.2 | I458 G462 | I458-S460 PolarHBondContact O-N 2.96Å; S460-G462 PolarHBondContact O-N 3.49Å |
| 461 | E | 53.6 | Low | 54 | Low | 114 Ų | 114 | 114.8 Ų | 114.8 | 53% | 0.533 | 73% | 0.727 | S | S | . | * | P | Polyproline II helix | trans | -49 | 126.4 | 170.4 | -176 | 158.1 | -163.8 | 0 | 0 | 109.7 | R304 G459 | R304-E461 VanDerWaalsContact CD-OE1 3.22Å; R304-E461 WeakPolarHBondContact CD-OE1 3.39Å; R304-E461 IonicContact CZ-OE1 3.81Å; R304-E461 IonicContact CZ-OE2 3.31Å; R304-E461 IonicContact NE-OE1 3.01Å; R304-E461 PolarHBondContact NE-OE1 3.5Å; R304-E461 IonicContact NH1-OE1 2.61Å; R304-E461 PolarHBondContact NH1-OE1 2.96Å; R304-E461 IonicContact NH1-OE2 3.97Å; R304-E461 PolarHBondContact NH1-OE2 2.93Å; R304-E461 IonicContact NH2-OE1 3.02Å; R304-E461 IonicContact NH2-OE2 3.16Å; R304-E461 PolarHBondContact NH2-OE2 3.28Å; G459-E461 PolarHBondContact O-N 3.39Å |
| 462 | G | 50.6 | Low | 53.7 | Low | 64 Ų | 64 | 113.2 Ų | 113.2 | 66% | 0.66 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 145.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | S460 A464 | S460-G462 PolarHBondContact O-N 3.49Å; G462-A464 PolarHBondContact O-N 3.46Å |
| 463 | E | 57.4 | Low | 53.8 | Low | 194 Ų | 194 | 112.6 Ų | 112.6 | 91% | 0.907 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 141.2 | 178.1 | -64.6 | -172.8 | 124.8 | 0 | 0 | 110.7 | G465 | E463-G465 PolarHBondContact O-N 3.01Å; E463-G465 VanDerWaalsContact O-N 3.16Å |
| 464 | A | 47.8 | Very low | 53.9 | Low | 88 Ų | 88 | 111.8 Ų | 111.8 | 73% | 0.727 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -55 | 125 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | G462 I466 | G462-A464 PolarHBondContact O-N 3.46Å; A464-I466 PolarHBondContact O-N 3.4Å |
| 465 | G | 49.9 | Very low | 53.9 | Low | 64 Ų | 64 | 109.8 Ų | 109.8 | 66% | 0.66 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 137.3 | -176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | E463 | E463-G465 PolarHBondContact O-N 3.01Å; E463-G465 VanDerWaalsContact O-N 3.16Å |
| 466 | I | 55.4 | Low | 53.6 | Low | 163 Ų | 163 | 109.1 Ų | 109.1 | 84% | 0.836 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 129 | 177.3 | -53.7 | 172.3 | 0 | 0 | 0 | 108.4 | A464 G468 | A464-I466 PolarHBondContact O-N 3.4Å; I466-G468 PolarHBondContact O-N 3.5Å |
| 467 | P | 52.9 | Low | 53.9 | Low | 100 Ų | 100 | 111.2 Ų | 111.2 | 65% | 0.649 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 125.4 | 178.5 | -29.6 | 36 | 0 | 0 | 0 | 111.3 | | |
| 468 | G | 54.3 | Low | 53.4 | Low | 63 Ų | 63 | 109.6 Ų | 109.6 | 65% | 0.649 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 143.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | I466 D470 | I466-G468 PolarHBondContact O-N 3.5Å; G468-D470 PolarHBondContact O-N 3.31Å; G468-D470 VanDerWaalsContact O-N 3.16Å |
| 469 | T | 60.5 | Low | 53.2 | Low | 132 Ų | 132 | 113.3 Ų | 113.3 | 81% | 0.81 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 120.5 | -175.3 | 53.7 | 0 | 0 | 0 | 0 | 111.9 | A471 | T469-A471 PolarHBondContact O-N 3.07Š|
| 470 | D | 51.8 | Low | 52.8 | Low | 100 Ų | 100 | 114.4 Ų | 114.4 | 54% | 0.535 | 72% | 0.717 | S | S | . | * | S | Bend | trans | -70.6 | 15.1 | -159.9 | 29.8 | -68.1 | 0 | 0 | 0 | 116.2 | G468 N472 Y473 | G468-D470 PolarHBondContact O-N 3.31Å; G468-D470 VanDerWaalsContact O-N 3.16Å; D470-N472 PolarHBondContact O-N 3.5Å; D470-Y473 PolarHBondContact O-N 2.9Å; D470-Y473 VanDerWaalsContact O-N 3.07Å |
| 471 | A | 49.5 | Very low | 52.2 | Low | 93 Ų | 93 | 112.1 Ų | 112.1 | 77% | 0.769 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | -14.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | T469 | T469-A471 PolarHBondContact O-N 3.07Š|
| 472 | N | 55.9 | Low | 51.6 | Low | 159 Ų | 159 | 110.2 Ų | 110.2 | 85% | 0.85 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.3 | -2.3 | 179.1 | -73.2 | -28.1 | 0 | 0 | 0 | 114.4 | D470 | D470-N472 PolarHBondContact O-N 3.5Š|
| 473 | Y | 55.9 | Low | 51.2 | Low | 148 Ų | 148 | 115 Ų | 115 | 58% | 0.58 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.9 | -23.2 | -168.4 | -98.2 | -82.5 | 0 | 0 | 0 | 115.8 | D470 P475 | D470-Y473 PolarHBondContact O-N 2.9Å; D470-Y473 VanDerWaalsContact O-N 3.07Å; Y473-P475 WeakPolarHBondContact O-CD 3.48Å |
| 474 | C | 53 | Low | 50.6 | Low | 43 Ų | 43 | 110.5 Ų | 110.5 | 29% | 0.291 | 72% | 0.722 | S | S | . | * | S | Bend | trans | -90.2 | 115.9 | 173.5 | -55.1 | 0 | 0 | 0 | 0 | 109.1 | C296 C476 | C296-C474 WeakPolarHBondContact CB-SG 3.21Å; C296-C474 WeakPolarHBondContact SG-CB 3.31Å; C296-C474 CovalentContact SG-SG 2.05Å; C296-C474 PolarHBondContact SG-SG 3.34Å; C474-C476 PolarHBondContact O-N 3.32Å |
| 475 | P | 59.5 | Low | 50.6 | Low | 122 Ų | 122 | 112.4 Ų | 112.4 | 79% | 0.792 | 73% | 0.726 | S | S | * | * | | | trans | -64.4 | 102.9 | 171 | 26.4 | -32.5 | 0 | 0 | 0 | 108.3 | Y473 | Y473-P475 WeakPolarHBondContact O-CD 3.48Š|
| 476 | C | 48.8 | Very low | 50.3 | Low | 111 Ų | 111 | 112.6 Ų | 112.6 | 75% | 0.75 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 127.6 | 173.4 | -77.1 | 0 | 0 | 0 | 0 | 108.1 | C474 A478 | C474-C476 PolarHBondContact O-N 3.32Å; C476-A478 PolarHBondContact O-N 3.13Å |
| 477 | P | 58.2 | Low | 49.6 | Very low | 102 Ų | 102 | 110.3 Ų | 110.3 | 66% | 0.662 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 129.5 | 174.9 | 23.2 | -32.2 | 0 | 0 | 0 | 108.1 | R479 | P477-R479 PolarHBondContact O-N 2.99Š|
| 478 | A | 49.3 | Very low | 49.2 | Very low | 96 Ų | 96 | 109.3 Ų | 109.3 | 79% | 0.793 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -49 | 140.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | C476 G480 | C476-A478 PolarHBondContact O-N 3.13Å; A478-G480 VanDerWaalsContact C-N 3.28Å; A478-G480 PolarHBondContact O-N 3.31Å |
| 479 | R | 47.3 | Very low | 48.6 | Very low | 248 Ų | 248 | 110.3 Ų | 110.3 | 94% | 0.936 | 75% | 0.752 | S | S | * | * | | | trans | -59.4 | 85.6 | -173.1 | -67 | -176.6 | -179 | -174.6 | 1.4 | 111.5 | P477 G481 | P477-R479 PolarHBondContact O-N 2.99Å; R479-G481 PolarHBondContact O-N 3.14Å |
| 480 | G | 41.7 | Very low | 48 | Very low | 83 Ų | 83 | 107.7 Ų | 107.7 | 86% | 0.856 | 75% | 0.751 | S | S | * | * | | | trans | -80 | 112.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | A478 | A478-G480 VanDerWaalsContact C-N 3.28Å; A478-G480 PolarHBondContact O-N 3.31Å |
| 481 | G | 42.2 | Very low | 48.1 | Very low | 67 Ų | 67 | 109.1 Ų | 109.1 | 69% | 0.691 | 77% | 0.766 | S | S | * | * | | | trans | 121.1 | 78 | -161.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | R479 | R479-G481 PolarHBondContact O-N 3.14Š|
| 482 | G | 41.4 | Very low | 48 | Very low | 75 Ų | 75 | 109.2 Ų | 109.2 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | | | cis | 84 | 33.7 | 48.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | S484 | G482-S484 PolarHBondContact O-N 3.11Š|
| 483 | I | 41.8 | Very low | 47.7 | Very low | 163 Ų | 163 | 109.5 Ų | 109.5 | 84% | 0.836 | 77% | 0.767 | S | S | * | * | | | trans | -74.6 | 99.8 | 152.7 | -53.4 | 177 | 0 | 0 | 0 | 105.4 | P485 | I483-P485 WeakPolarHBondContact O-CD 3.42Š|
| 484 | S | 45.7 | Very low | 47.9 | Very low | 101 Ų | 101 | 107.6 Ų | 107.6 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | | | trans | -55.6 | 126.6 | 172.6 | -59.3 | 0 | 0 | 0 | 0 | 109.8 | G482 G486 | G482-S484 PolarHBondContact O-N 3.11Å; S484-G486 PolarHBondContact O-N 3.26Å |
| 485 | P | 47.6 | Very low | 47.9 | Very low | 127 Ų | 127 | 114.9 Ų | 114.9 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | | | trans | -64.1 | 107.2 | 152.8 | -7.6 | 24.4 | 0 | 0 | 0 | 105.8 | I483 A487 | I483-P485 WeakPolarHBondContact O-CD 3.42Å; P485-A487 PolarHBondContact O-N 3.45Å |
| 486 | G | 42.8 | Very low | 47.3 | Very low | 68 Ų | 68 | 112.6 Ų | 112.6 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | | | trans | -55 | 139.2 | 170.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | S484 G488 | S484-G486 PolarHBondContact O-N 3.26Å; G486-G488 PolarHBondContact O-N 3.27Å |
| 487 | A | 41 | Very low | 47.2 | Very low | 116 Ų | 116 | 110.7 Ų | 110.7 | 96% | 0.959 | 80% | 0.801 | S | S | * | * | | | trans | -45 | 128.2 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | P485 | P485-A487 PolarHBondContact O-N 3.45Š|
| 488 | G | 44.2 | Very low | 46.7 | Very low | 78 Ų | 78 | 116.2 Ų | 116.2 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | | | trans | -157.9 | 25.3 | -167.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | G486 | G486-G488 PolarHBondContact O-N 3.27Š|
| 489 | G | 43.3 | Very low | 46.6 | Very low | 84 Ų | 84 | 115 Ų | 115 | 87% | 0.866 | 81% | 0.812 | S | S | * | * | | | trans | 71.7 | 144 | 157.1 | 0 | 0 | 0 | 0 | 0 | 120.2 | | |
| 490 | G | 47.8 | Very low | 47.2 | Very low | 78 Ų | 78 | 109.8 Ų | 109.8 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | | | trans | 120.2 | 106.2 | 163.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 491 | P | 53.9 | Low | 47.5 | Very low | 129 Ų | 129 | 109.7 Ų | 109.7 | 84% | 0.838 | 81% | 0.809 | S | S | * | * | | | trans | -105.3 | 177.9 | -177.7 | 39.9 | -34.7 | 0 | 0 | 0 | 115 | | |
| 492 | A | 46.6 | Very low | 47.5 | Very low | 95 Ų | 95 | 112 Ų | 112 | 79% | 0.785 | 82% | 0.822 | S | S | * | * | | | trans | 85 | 141.5 | 167.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | | |
| 493 | L | 50.8 | Low | 47.8 | Very low | 166 Ų | 166 | 111.9 Ų | 111.9 | 87% | 0.869 | 82% | 0.821 | S | S | * | * | | | cis | -135.1 | 168.3 | 12.5 | -80.6 | 167.7 | 0 | 0 | 0 | 113.2 | | |
| 494 | P | 59.9 | Low | 48.2 | Very low | 107 Ų | 107 | 111.4 Ų | 111.4 | 70% | 0.695 | 83% | 0.825 | S | S | * | * | | | trans | -111.4 | -155.5 | -173.3 | 43 | -32.2 | 0 | 0 | 0 | 114.5 | | |
| 495 | E | 52.4 | Low | 48.3 | Very low | 196 Ų | 196 | 109.7 Ų | 109.7 | 92% | 0.916 | 82% | 0.823 | S | S | * | * | | | trans | 87.5 | 132.5 | 175.8 | -49.9 | -168.2 | 119.3 | 0 | 0 | 116 | | |
| 496 | G | 45.7 | Very low | 48.1 | Very low | 75 Ų | 75 | 109.7 Ų | 109.7 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | | | cis | -150.4 | 160.1 | -7.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 497 | G | 46.7 | Very low | 48.1 | Very low | 71 Ų | 71 | 109.9 Ų | 109.9 | 73% | 0.732 | 83% | 0.825 | S | S | * | * | | | | 73.3 | 115.3 | 78.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 498 | F | 48.3 | Very low | 48 | Very low | 217 Ų | 217 | 115.1 Ų | 115.1 | 95% | 0.952 | 82% | 0.822 | S | S | * | * | | | cis | -155.4 | 147.9 | 44.6 | -88.2 | -99.4 | 0 | 0 | 0 | 114.4 | | |
| 499 | G | 48.6 | Very low | 47.9 | Very low | 71 Ų | 71 | 114.8 Ų | 114.8 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | | | | 97 | 117.8 | 116.7 | 0 | 0 | 0 | 0 | 0 | 119.8 | | |
| 500 | P | 58.2 | Low | 47.7 | Very low | 139 Ų | 139 | 116.1 Ų | 116.1 | 90% | 0.903 | 82% | 0.822 | S | S | * | * | | | trans | -111.1 | 170 | -179.8 | 40.1 | -31.1 | 0 | 0 | 0 | 114.4 | | |
| 501 | G | 48.2 | Very low | 47.4 | Very low | 81 Ų | 81 | 116.2 Ų | 116.2 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | | | trans | -163.2 | 121.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 502 | A | 42 | Very low | 46.5 | Very low | 115 Ų | 115 | 113.6 Ų | 113.6 | 95% | 0.95 | 82% | 0.819 | S | S | * | * | | | trans | -88.2 | 152.1 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 503 | G | 49 | Very low | 46.2 | Very low | 73 Ų | 73 | 113 Ų | 113 | 75% | 0.753 | 82% | 0.822 | S | S | * | * | | | trans | -168.3 | 67.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 504 | V | 50.1 | Low | 46 | Very low | 152 Ų | 152 | 116.8 Ų | 116.8 | 92% | 0.921 | 83% | 0.825 | S | S | * | * | | | trans | 30.4 | 119.1 | 146.2 | -161.6 | 0 | 0 | 0 | 0 | 120.8 | | |
| 505 | G | 46.5 | Very low | 45.2 | Very low | 65 Ų | 65 | 121.1 Ų | 121.1 | 67% | 0.67 | 84% | 0.836 | S | S | * | * | | | | 88.6 | 140.2 | 129.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 506 | P | 44.4 | Very low | 44.8 | Very low | 127 Ų | 127 | 115.3 Ų | 115.3 | 83% | 0.825 | 83% | 0.828 | S | S | * | * | | | trans | -88.7 | 132 | -175.2 | 34.4 | -33.3 | 0 | 0 | 0 | 113.5 | | |
| 507 | G | 42.1 | Very low | 45.1 | Very low | 73 Ų | 73 | 118.2 Ų | 118.2 | 75% | 0.753 | 83% | 0.831 | S | S | * | * | | | trans | -122.5 | 111.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G509 | G507-G509 PolarHBondContact O-N 2.99Š|
| 508 | Y | 40.2 | Very low | 45.3 | Very low | 225 Ų | 225 | 120.6 Ų | 120.6 | 88% | 0.882 | 83% | 0.833 | S | S | * | * | | | trans | -66.6 | 117.7 | 173 | 24.6 | -90.4 | 0 | 0 | 0 | 110.2 | | |
| 509 | G | 41.4 | Very low | 45.5 | Very low | 71 Ų | 71 | 113.8 Ų | 113.8 | 73% | 0.732 | 82% | 0.824 | S | S | * | * | | | trans | -142.8 | 120.9 | 178 | 0 | 0 | 0 | 0 | 0 | 110.8 | G507 G511 | G507-G509 PolarHBondContact O-N 2.99Å; G509-G511 PolarHBondContact O-N 2.92Å |
| 510 | A | 38.8 | Very low | 45.3 | Very low | 113 Ų | 113 | 117.1 Ų | 117.1 | 93% | 0.934 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 118.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 511 | G | 40.9 | Very low | 44.6 | Very low | 79 Ų | 79 | 114 Ų | 114 | 81% | 0.814 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 122.7 | 174 | 0 | 0 | 0 | 0 | 0 | 111.4 | G509 | G509-G511 PolarHBondContact O-N 2.92Š|
| 512 | G | 35.5 | Very low | 44.7 | Very low | 75 Ų | 75 | 119.2 Ų | 119.2 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -69 | 136.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 513 | G | 40.7 | Very low | 44.9 | Very low | 83 Ų | 83 | 125.3 Ų | 125.3 | 86% | 0.856 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 123.1 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 514 | R | 46.8 | Very low | 44.7 | Very low | 245 Ų | 245 | 129.9 Ų | 129.9 | 93% | 0.925 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 144.3 | 172.1 | -68.6 | 177 | 173.7 | 178.8 | -3.4 | 110.2 | | |
| 515 | E | 42 | Very low | 44.9 | Very low | 198 Ų | 198 | 125.7 Ų | 125.7 | 93% | 0.925 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 134.1 | 176.3 | -65.4 | 170.5 | 123.3 | 0 | 0 | 111.5 | | |
| 516 | G | 45.8 | Very low | 45.1 | Very low | 73 Ų | 73 | 129.1 Ų | 129.1 | 75% | 0.753 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -89.9 | 134.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 517 | V | 50.3 | Low | 45.5 | Very low | 137 Ų | 137 | 126.7 Ų | 126.7 | 83% | 0.83 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 136.6 | -176.6 | -177.1 | 0 | 0 | 0 | 0 | 112.4 | G519 | V517-G519 PolarHBondContact O-N 3.25Š|
| 518 | P | 52.5 | Low | 45.8 | Very low | 121 Ų | 121 | 127.2 Ų | 127.2 | 79% | 0.786 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 128.9 | 171.7 | -20.5 | 32.8 | 0 | 0 | 0 | 112.6 | | |
| 519 | G | 50.7 | Low | 46.2 | Very low | 74 Ų | 74 | 123.4 Ų | 123.4 | 76% | 0.763 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 150.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114 | V517 G521 | V517-G519 PolarHBondContact O-N 3.25Å; G519-G521 PolarHBondContact O-N 2.92Å |
| 520 | V | 46.4 | Very low | 46.1 | Very low | 141 Ų | 141 | 129 Ų | 129 | 86% | 0.855 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 126.2 | -174.8 | -179.1 | 0 | 0 | 0 | 0 | 112.2 | | |
| 521 | G | 42.5 | Very low | 46.4 | Very low | 73 Ų | 73 | 126.7 Ų | 126.7 | 75% | 0.753 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 134.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G519 | G519-G521 PolarHBondContact O-N 2.92Š|
| 522 | Q | 50.9 | Low | 46.7 | Very low | 190 Ų | 190 | 132.3 Ų | 132.3 | 89% | 0.888 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -89 | 149.6 | 176.7 | -62.4 | -169.8 | 42.9 | 0 | 0 | 111.7 | | |
| 523 | R | 45.2 | Very low | 47.4 | Very low | 244 Ų | 244 | 139.9 Ų | 139.9 | 92% | 0.921 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -65 | 137.1 | -174.4 | -74 | 171.9 | 158 | -129.5 | -0.7 | 112.8 | | |
| 524 | L | 45.1 | Very low | 48.1 | Very low | 169 Ų | 169 | 138.8 Ų | 138.8 | 89% | 0.885 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 141.9 | 158.9 | -92.5 | 69.4 | 0 | 0 | 0 | 110.6 | | |
| 525 | G | 54 | Low | 48.6 | Very low | 63 Ų | 63 | 133.5 Ų | 133.5 | 65% | 0.649 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 167.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 526 | P | 51.4 | Low | 49.1 | Very low | 137 Ų | 137 | 130.7 Ų | 130.7 | 89% | 0.89 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 138.6 | -177.8 | 30.2 | -34.4 | 0 | 0 | 0 | 112.2 | | |
| 527 | G | 52 | Low | 49.2 | Very low | 77 Ų | 77 | 130.7 Ų | 130.7 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 143.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 528 | G | 48.2 | Very low | 49.1 | Very low | 83 Ų | 83 | 131 Ų | 131 | 86% | 0.856 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 153.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 529 | T | 48.6 | Very low | 48.5 | Very low | 145 Ų | 145 | 128.7 Ų | 128.7 | 89% | 0.89 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 160 | -174.4 | 44.9 | 0 | 0 | 0 | 0 | 114.4 | | |
| 530 | F | 39.1 | Very low | 48.4 | Very low | 190 Ų | 190 | 133.4 Ų | 133.4 | 83% | 0.833 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 148.4 | -173.2 | -148.3 | -99.9 | 0 | 0 | 0 | 116 | | |
| 531 | G | 45.6 | Very low | 48.3 | Very low | 64 Ų | 64 | 132.1 Ų | 132.1 | 66% | 0.66 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -102 | 131.6 | 166.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 532 | E | 48.6 | Very low | 48.3 | Very low | 196 Ų | 196 | 132.1 Ų | 132.1 | 92% | 0.916 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 153.3 | -172.3 | -66.7 | -178.7 | 102.7 | 0 | 0 | 114.6 | | |
| 533 | R | 49.2 | Very low | 47.9 | Very low | 235 Ų | 235 | 134.1 Ų | 134.1 | 89% | 0.887 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -88 | 118.4 | -177.5 | -168.5 | -177.2 | -62.1 | -170.4 | 1 | 110.5 | | |
| 534 | G | 56.3 | Low | 47.8 | Very low | 59 Ų | 59 | 126.5 Ų | 126.5 | 61% | 0.608 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 156.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 535 | P | 56.7 | Low | 47.9 | Very low | 135 Ų | 135 | 128.9 Ų | 128.9 | 88% | 0.877 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 150.5 | -168.7 | 28.9 | -35.9 | 0 | 0 | 0 | 114.5 | | |
| 536 | V | 53.1 | Low | 47.4 | Very low | 139 Ų | 139 | 132.9 Ų | 132.9 | 84% | 0.842 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 123.8 | 177.7 | 178.3 | 0 | 0 | 0 | 0 | 110.6 | T538 | V536-T538 PolarHBondContact O-N 3.38Š|
| 537 | G | 46.1 | Very low | 47 | Very low | 72 Ų | 72 | 135.3 Ų | 135.3 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -70 | 122.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 538 | T | 49.1 | Very low | 46.7 | Very low | 144 Ų | 144 | 141.6 Ų | 141.6 | 88% | 0.883 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 138.3 | 177.9 | -15 | 0 | 0 | 0 | 0 | 110.9 | V536 | V536-T538 PolarHBondContact O-N 3.38Š|
| 539 | G | 40.8 | Very low | 46.8 | Very low | 72 Ų | 72 | 143.2 Ų | 143.2 | 74% | 0.742 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 158.9 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 540 | I | 47.1 | Very low | 46.9 | Very low | 174 Ų | 174 | 142.3 Ų | 142.3 | 89% | 0.892 | 81% | 0.813 | S | S | * | * | | | trans | -124.7 | 128.9 | 165.2 | 50.8 | 172.5 | 0 | 0 | 0 | 110.2 | | |
| 541 | S | 44.4 | Very low | 47.8 | Very low | 113 Ų | 113 | 142.8 Ų | 142.8 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | | | trans | -85.5 | 138.9 | 177.8 | 177.8 | 0 | 0 | 0 | 0 | 110.7 | | |
| 542 | G | 43 | Very low | 48.3 | Very low | 74 Ų | 74 | 146 Ų | 146 | 76% | 0.763 | 82% | 0.821 | S | S | * | * | | | trans | -145.2 | 112 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 543 | Y | 43.5 | Very low | 48.6 | Very low | 232 Ų | 232 | 151.6 Ų | 151.6 | 91% | 0.91 | 83% | 0.834 | S | S | * | * | | | trans | -74.3 | 143.5 | -175.4 | -72.9 | -103.6 | 0 | 0 | 0 | 113.4 | | |
| 544 | G | 42.4 | Very low | 48.6 | Very low | 83 Ų | 83 | 147.4 Ų | 147.4 | 86% | 0.856 | 83% | 0.832 | S | S | * | * | | | trans | -141.1 | 131.8 | 167.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 545 | R | 47.4 | Very low | 48.2 | Very low | 220 Ų | 220 | 152.1 Ų | 152.1 | 83% | 0.83 | 84% | 0.843 | S | S | * | * | | | trans | -124.1 | 152.1 | -161.2 | -163.1 | -161.5 | -78.5 | -177.6 | -4.2 | 112.3 | | |
| 546 | M | 42.7 | Very low | 47.7 | Very low | 146 Ų | 146 | 153 Ų | 153 | 72% | 0.719 | 84% | 0.842 | S | S | * | * | | | trans | 76.9 | 157.6 | 165.8 | -34.6 | -173.5 | -162.4 | 0 | 0 | 115.8 | | |
| 547 | K | 43.3 | Very low | 47.4 | Very low | 189 Ų | 189 | 153.8 Ų | 153.8 | 82% | 0.822 | 84% | 0.841 | S | S | * | * | | | cis | -137.5 | 151.7 | 11.8 | -71.2 | 175.8 | 178.6 | 175.8 | 0 | 112.3 | | |
| 548 | K | 45.5 | Very low | 47.4 | Very low | 208 Ų | 208 | 158.9 Ų | 158.9 | 90% | 0.904 | 85% | 0.848 | S | S | * | * | | | trans | -68 | 147.4 | 160.2 | -72.8 | 179.2 | 174.1 | -179.8 | 0 | 110.3 | | |
| 549 | S | 50 | Low | 47.3 | Very low | 117 Ų | 117 | 159.9 Ų | 159.9 | 82% | 0.818 | 85% | 0.845 | S | S | * | * | | | trans | -131.4 | 93.7 | 163.3 | 178.5 | 0 | 0 | 0 | 0 | 109.9 | | |
| 550 | T | 52.2 | Low | 47.8 | Very low | 127 Ų | 127 | 166.2 Ų | 166.2 | 78% | 0.779 | 85% | 0.853 | S | S | * | * | | | trans | -65.5 | 133.7 | 166.7 | -55.4 | 0 | 0 | 0 | 0 | 109.2 | | |
| 551 | K | 57.6 | Low | 47.9 | Very low | 199 Ų | 199 | 165.6 Ų | 165.6 | 87% | 0.865 | 85% | 0.85 | S | S | * | * | | | trans | -122 | 117.7 | 166.1 | -163.3 | 173.7 | -174.3 | 179.3 | 0 | 110.1 | | |
| 552 | T | 54.6 | Low | 48.1 | Very low | 131 Ų | 131 | 170 Ų | 170 | 80% | 0.804 | 86% | 0.855 | S | S | * | * | | | trans | -74.9 | 131.4 | -177.5 | -33.9 | 0 | 0 | 0 | 0 | 111.3 | | |
| 553 | R | 55.5 | Low | 48.6 | Very low | 314 Ų | 314 | 178.7 Ų | 178.7 | 100% | 1.185 | 86% | 0.863 | S | S | * | * | | | trans | -154.7 | 0 | 131.6 | -148.4 | 179.7 | -167.5 | -159.8 | 2.1 | 110.3 | | |