| 1 | M | 42.1 | Very low | 54.1 | Low | 246 Ų | 246 | 137.7 Ų | 137.7 | 100% | 1.212 | 78% | 0.778 | S | S | * | * | | | | 0 | 110 | 0 | -68.6 | -158.4 | -73.1 | 0 | 0 | 107.7 | | |
| 2 | G | 52.1 | Low | 54.9 | Low | 79 Ų | 79 | 135 Ų | 135 | 81% | 0.814 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 131.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 3 | T | 48.9 | Very low | 55.6 | Low | 130 Ų | 130 | 136.3 Ų | 136.3 | 80% | 0.798 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 135.8 | 173.7 | 43.8 | 0 | 0 | 0 | 0 | 109.9 | R5 | T3-R5 PolarHBondContact O-N 3.43Š|
| 4 | P | 50.1 | Low | 56.4 | Low | 127 Ų | 127 | 132.9 Ų | 132.9 | 83% | 0.825 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 123.2 | 176.2 | 26.7 | -30.5 | 0 | 0 | 0 | 108.3 | A6 | P4-A6 PolarHBondContact O-N 3.13Å; P4-A6 VanDerWaalsContact O-N 3.15Å |
| 5 | R | 50 | Low | 57.2 | Low | 238 Ų | 238 | 129.6 Ų | 129.6 | 90% | 0.898 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 120.2 | 174.2 | -86.4 | -164.1 | 149.1 | 149.9 | -1.9 | 108.9 | T3 Q7 | T3-R5 PolarHBondContact O-N 3.43Å; R5-Q7 PolarHBondContact O-N 3.12Å |
| 6 | A | 57 | Low | 57.8 | Low | 95 Ų | 95 | 128.9 Ų | 128.9 | 79% | 0.785 | 71% | 0.71 | S | S | * | * | | | trans | -53.7 | 112.7 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | P4 H8 | P4-A6 PolarHBondContact O-N 3.13Å; P4-A6 VanDerWaalsContact O-N 3.15Å; A6-H8 PolarHBondContact O-N 3.17Å |
| 7 | Q | 56.8 | Low | 58.6 | Low | 186 Ų | 186 | 127.6 Ų | 127.6 | 87% | 0.869 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 120.1 | 172.3 | -65.9 | -179.3 | 6.5 | 0 | 0 | 106.6 | R5 | R5-Q7 PolarHBondContact O-N 3.12Š|
| 8 | H | 54.4 | Low | 59.3 | Low | 178 Ų | 178 | 125.4 Ų | 125.4 | 82% | 0.824 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 129.4 | 177.4 | -116.4 | -107.5 | 0 | 0 | 0 | 109 | A6 | A6-H8 PolarHBondContact O-N 3.17Š|
| 9 | P | 57.7 | Low | 59.8 | Low | 105 Ų | 105 | 121.7 Ų | 121.7 | 68% | 0.682 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 136.5 | 173.6 | 24.2 | -31 | 0 | 0 | 0 | 108.5 | | |
| 10 | P | 58.4 | Low | 60.2 | Low | 63 Ų | 63 | 121.1 Ų | 121.1 | 41% | 0.409 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -59.5 | 149 | 179.1 | 24.7 | -33.4 | 0 | 0 | 0 | 109.9 | L14 L15 | P10-L14 HydrophobicContact CB-CB 4.49Å; P10-L15 HydrophobicContact CG-CD1 4.38Å; P10-L15 HydrophobicContact CG-CD2 3.69Å; P10-L15 HydrophobicContact CG-CG 3.95Å |
| 11 | P | 67.5 | Low | 60.2 | Low | 68 Ų | 68 | 119.2 Ų | 119.2 | 44% | 0.442 | 66% | 0.658 | S | S | . | * | P | Polyproline II helix | trans | -50.6 | 139.4 | 175.3 | -23.3 | 30.3 | 0 | 0 | 0 | 110.5 | Q13 L14 L15 | P11-Q13 PolarHBondContact O-N 2.96Å; P11-L14 HydrophobicContact CB-CD1 4.46Å; P11-L14 HydrophobicContact CG-CD1 3.96Å; P11-L14 WeakPolarHBondContact O-CB 3.46Å; P11-L14 PolarHBondContact O-N 3.21Å; P11-L15 PolarHBondContact O-N 2.96Å |
| 12 | P | 64 | Low | 61.3 | Low | 105 Ų | 105 | 109.6 Ų | 109.6 | 68% | 0.682 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -57.6 | -26.1 | -177.4 | 21.7 | -32.8 | 0 | 0 | 0 | 112.9 | L15 F16 | P12-L15 PolarHBondContact O-N 3.06Å; P12-F16 PolarHBondContact O-N 3.26Å |
| 13 | Q | 64.1 | Low | 61.4 | Low | 152 Ų | 152 | 109.8 Ų | 109.8 | 71% | 0.71 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.6 | -37.1 | 174.3 | -63 | 168.5 | -3.1 | 0 | 0 | 112.7 | P11 F16 L17 | P11-Q13 PolarHBondContact O-N 2.96Å; Q13-F16 PolarHBondContact O-N 3.12Å; Q13-L17 WeakPolarHBondContact O-CG 3.48Å; Q13-L17 PolarHBondContact O-N 3.19Å; Q13-L17 VanDerWaalsContact O-N 3.09Å |
| 14 | L | 66.6 | Low | 61.5 | Low | 88 Ų | 88 | 110 Ų | 110 | 46% | 0.461 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -71.6 | -39 | 175.8 | -94.2 | 153.7 | 0 | 0 | 0 | 111 | P10 P11 F16 L17 I18 | P10-L14 HydrophobicContact CB-CB 4.49Å; P11-L14 HydrophobicContact CB-CD1 4.46Å; P11-L14 HydrophobicContact CG-CD1 3.96Å; P11-L14 WeakPolarHBondContact O-CB 3.46Å; P11-L14 PolarHBondContact O-N 3.21Å; L14-F16 VanDerWaalsContact C-N 3.31Å; L14-F16 PolarHBondContact O-N 3.37Å; L14-L17 PolarHBondContact O-N 3.49Å; L14-I18 WeakPolarHBondContact O-CB 3.43Å; L14-I18 WeakPolarHBondContact O-CD1 3.32Å; L14-I18 WeakPolarHBondContact O-CG1 3.3Å; L14-I18 PolarHBondContact O-N 3.31Å |
| 15 | L | 69.1 | Low | 61.8 | Low | 84 Ų | 84 | 105.9 Ų | 105.9 | 44% | 0.44 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.1 | -42.3 | 173.6 | -67.5 | 174.2 | 0 | 0 | 0 | 111.2 | P10 P11 P12 I18 L19 | P10-L15 HydrophobicContact CG-CD1 4.38Å; P10-L15 HydrophobicContact CG-CD2 3.69Å; P10-L15 HydrophobicContact CG-CG 3.95Å; P11-L15 PolarHBondContact O-N 2.96Å; P12-L15 PolarHBondContact O-N 3.06Å; L15-I18 PolarHBondContact O-N 3.18Å; L15-L19 WeakPolarHBondContact O-CB 3.4Å; L15-L19 WeakPolarHBondContact O-CG 3.35Å; L15-L19 PolarHBondContact O-N 3.19Å |
| 16 | F | 66.9 | Low | 61.9 | Low | 118 Ų | 118 | 102 Ų | 102 | 52% | 0.518 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.9 | -45.1 | 176 | -172.4 | -100.2 | 0 | 0 | 0 | 112.3 | P12 Q13 L14 L19 L20 | P12-F16 PolarHBondContact O-N 3.26Å; Q13-F16 PolarHBondContact O-N 3.12Å; L14-F16 VanDerWaalsContact C-N 3.31Å; L14-F16 PolarHBondContact O-N 3.37Å; F16-L19 PolarHBondContact O-N 2.89Å; F16-L20 HydrophobicContact CE1-CD1 4.09Å; F16-L20 HydrophobicContact CE1-CD2 4.24Å; F16-L20 HydrophobicContact CE2-CD1 4.48Å; F16-L20 HydrophobicContact CZ-CD1 3.93Å; F16-L20 WeakPolarHBondContact O-CB 3.41Å; F16-L20 PolarHBondContact O-N 3.3Å |
| 17 | L | 70.1 | Confident | 61.5 | Low | 108 Ų | 108 | 99.1 Ų | 99.1 | 57% | 0.565 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.6 | -38.2 | 176.8 | -70.9 | 168.2 | 0 | 0 | 0 | 112.5 | Q13 L14 L20 S21 | Q13-L17 WeakPolarHBondContact O-CG 3.48Å; Q13-L17 PolarHBondContact O-N 3.19Å; Q13-L17 VanDerWaalsContact O-N 3.09Å; L14-L17 PolarHBondContact O-N 3.49Å; L17-L20 PolarHBondContact O-N 3.12Å; L17-S21 VanDerWaalsContact O-CB 3.3Å; L17-S21 WeakPolarHBondContact O-CB 3.42Å; L17-S21 PolarHBondContact O-N 3.5Å; L17-S21 PolarHBondContact O-OG 3.13Å |
| 18 | I | 71.8 | Confident | 61 | Low | 87 Ų | 87 | 92.7 Ų | 92.7 | 45% | 0.446 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.7 | -45.7 | 174.8 | -69.2 | 162.5 | 0 | 0 | 0 | 109.9 | L14 L15 S21 C22 | L14-I18 WeakPolarHBondContact O-CB 3.43Å; L14-I18 WeakPolarHBondContact O-CD1 3.32Å; L14-I18 WeakPolarHBondContact O-CG1 3.3Å; L14-I18 PolarHBondContact O-N 3.31Å; L15-I18 PolarHBondContact O-N 3.18Å; I18-S21 WeakPolarHBondContact CA-OG 3.11Å; I18-S21 PolarHBondContact O-N 3Å; I18-S21 PolarHBondContact O-OG 3.01Å; I18-C22 PolarHBondContact O-N 3.01Å; I18-C22 VanDerWaalsContact O-N 3.11Å; I18-C22 PolarHBondContact O-SG 3.46Å; I18-C22 VanDerWaalsContact O-SG 3.4Å |
| 19 | L | 68.9 | Low | 60.5 | Low | 55 Ų | 55 | 89.4 Ų | 89.4 | 29% | 0.288 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.8 | -41.5 | 176.2 | -70.7 | 168.6 | 0 | 0 | 0 | 112 | L15 F16 S21 C22 I25 L55 | L15-L19 WeakPolarHBondContact O-CB 3.4Å; L15-L19 WeakPolarHBondContact O-CG 3.35Å; L15-L19 PolarHBondContact O-N 3.19Å; F16-L19 PolarHBondContact O-N 2.89Å; L19-S21 VanDerWaalsContact C-N 3.27Å; L19-S21 PolarHBondContact O-N 3.06Å; L19-C22 WeakPolarHBondContact O-CB 3.35Å; L19-C22 PolarHBondContact O-N 3.06Å; L19-I25 HydrophobicContact CB-CD1 4.19Å; L19-I25 HydrophobicContact CD2-CD1 4.13Å; L19-I25 WeakPolarHBondContact O-CD1 3.43Å; L19-L55 HydrophobicContact CD1-CD1 4.03Å |
| 20 | L | 67.3 | Low | 59.8 | Low | 110 Ų | 110 | 91.9 Ų | 91.9 | 58% | 0.576 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -67 | -29.8 | 175.9 | -128.8 | 72 | 0 | 0 | 0 | 112.5 | F16 L17 C22 | F16-L20 HydrophobicContact CE1-CD1 4.09Å; F16-L20 HydrophobicContact CE1-CD2 4.24Å; F16-L20 HydrophobicContact CE2-CD1 4.48Å; F16-L20 HydrophobicContact CZ-CD1 3.93Å; F16-L20 WeakPolarHBondContact O-CB 3.41Å; F16-L20 PolarHBondContact O-N 3.3Å; L17-L20 PolarHBondContact O-N 3.12Å; L20-C22 VanDerWaalsContact C-N 3.34Å |
| 21 | S | 59.8 | Low | 59.1 | Low | 82 Ų | 82 | 97.3 Ų | 97.3 | 57% | 0.573 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -81.5 | -10.7 | 177.2 | 74.8 | 0 | 0 | 0 | 0 | 113.9 | L17 I18 L19 P23 | L17-S21 VanDerWaalsContact O-CB 3.3Å; L17-S21 WeakPolarHBondContact O-CB 3.42Å; L17-S21 PolarHBondContact O-N 3.5Å; L17-S21 PolarHBondContact O-OG 3.13Å; I18-S21 WeakPolarHBondContact CA-OG 3.11Å; I18-S21 PolarHBondContact O-N 3Å; I18-S21 PolarHBondContact O-OG 3.01Å; L19-S21 VanDerWaalsContact C-N 3.27Å; L19-S21 PolarHBondContact O-N 3.06Å; S21-P23 VanDerWaalsContact O-CD 3.32Å; S21-P23 WeakPolarHBondContact O-CD 3.37Å |
| 22 | C | 65.1 | Low | 58 | Low | 43 Ų | 43 | 103 Ų | 103 | 29% | 0.291 | 54% | 0.54 | S | S | . | . | | | trans | -71.1 | 118.2 | 178.4 | -82.6 | 0 | 0 | 0 | 0 | 110.3 | I18 L19 L20 W24 I25 | I18-C22 PolarHBondContact O-N 3.01Å; I18-C22 VanDerWaalsContact O-N 3.11Å; I18-C22 PolarHBondContact O-SG 3.46Å; I18-C22 VanDerWaalsContact O-SG 3.4Å; L19-C22 WeakPolarHBondContact O-CB 3.35Å; L19-C22 PolarHBondContact O-N 3.06Å; L20-C22 VanDerWaalsContact C-N 3.34Å; C22-W24 PolarHBondContact O-N 2.8Å; C22-I25 HydrophobicContact CB-CD1 4.12Å; C22-I25 HydrophobicContact CB-CG1 4.5Å; C22-I25 PolarHBondContact O-N 3.41Å; C22-I25 VanDerWaalsContact O-N 3.08Å |
| 23 | P | 54.8 | Low | 57 | Low | 84 Ų | 84 | 105 Ų | 105 | 55% | 0.545 | 54% | 0.54 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.2 | -15.6 | -180 | 23.6 | -31.4 | 0 | 0 | 0 | 113.2 | S21 I25 Q26 | S21-P23 VanDerWaalsContact O-CD 3.32Å; S21-P23 WeakPolarHBondContact O-CD 3.37Å; P23-I25 VanDerWaalsContact C-N 3.33Å; P23-I25 PolarHBondContact O-N 3.39Å; P23-Q26 WeakPolarHBondContact O-CB 3.47Å; P23-Q26 PolarHBondContact O-N 3.28Å |
| 24 | W | 52 | Low | 55.9 | Low | 135 Ų | 135 | 106.6 Ų | 106.6 | 51% | 0.511 | 55% | 0.547 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | -22 | 177.7 | -65.6 | 73.6 | 0 | 0 | 0 | 113.7 | C22 R62 G63 P64 | C22-W24 PolarHBondContact O-N 2.8Å; W24-R62 HydrophobicContact CE3-CB 4.46Å; W24-R62 WeakPolarHBondContact CZ3-O 3.39Å; W24-G63 WeakPolarHBondContact CZ3-O 3.4Å; W24-P64 HydrophobicContact CH2-CB 4.43Å |
| 25 | I | 55.8 | Low | 54.8 | Low | 39 Ų | 39 | 108.5 Ų | 108.5 | 20% | 0.2 | 56% | 0.557 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -91.8 | -13.5 | 178.2 | -65.9 | 164.5 | 0 | 0 | 0 | 111.3 | L19 C22 P23 G27 L28 L55 | L19-I25 HydrophobicContact CB-CD1 4.19Å; L19-I25 HydrophobicContact CD2-CD1 4.13Å; L19-I25 WeakPolarHBondContact O-CD1 3.43Å; C22-I25 HydrophobicContact CB-CD1 4.12Å; C22-I25 HydrophobicContact CB-CG1 4.5Å; C22-I25 PolarHBondContact O-N 3.41Å; C22-I25 VanDerWaalsContact O-N 3.08Å; P23-I25 VanDerWaalsContact C-N 3.33Å; P23-I25 PolarHBondContact O-N 3.39Å; I25-G27 PolarHBondContact O-N 3.31Å; I25-L28 HydrophobicContact CG2-CD1 4.1Å; I25-L28 PolarHBondContact O-N 3.46Å; I25-L55 HydrophobicContact CD1-CD2 4.47Å |
| 26 | Q | 50.9 | Low | 53.4 | Low | 157 Ų | 157 | 110.8 Ų | 110.8 | 73% | 0.734 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | -6.2 | 177.2 | -67.8 | 178.6 | 2.9 | 0 | 0 | 114.3 | P23 | P23-Q26 WeakPolarHBondContact O-CB 3.47Å; P23-Q26 PolarHBondContact O-N 3.28Å |
| 27 | G | 50.4 | Low | 52.3 | Low | 34 Ų | 34 | 110.8 Ų | 110.8 | 35% | 0.351 | 58% | 0.58 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -123.2 | 16.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | I25 P29 R62 | I25-G27 PolarHBondContact O-N 3.31Å; G27-P29 VanDerWaalsContact O-CD 3.31Å; G27-P29 WeakPolarHBondContact O-CD 3.36Å; G27-R62 VanDerWaalsContact C-NH1 3.31Å; G27-R62 PolarHBondContact O-NH1 3.4Å; G27-R62 VanDerWaalsContact O-NH1 3.14Å; G27-R62 PolarHBondContact O-NH2 3.12Å |
| 28 | L | 44.4 | Very low | 51 | Low | 51 Ų | 51 | 113.1 Ų | 113.1 | 27% | 0.267 | 59% | 0.588 | S | S | . | * | S | Bend | trans | -74.6 | 116.9 | 161 | -73.1 | -178.3 | 0 | 0 | 0 | 106.5 | I25 L30 A58 | I25-L28 HydrophobicContact CG2-CD1 4.1Å; I25-L28 PolarHBondContact O-N 3.46Å; L28-L30 PolarHBondContact O-N 3.18Å; L28-A58 HydrophobicContact CD1-CB 4.18Å; L28-A58 HydrophobicContact CD2-CB 4.1Å |
| 29 | P | 44.2 | Very low | 49.6 | Very low | 110 Ų | 110 | 114.9 Ų | 114.9 | 71% | 0.714 | 61% | 0.606 | S | S | * | * | | | trans | -63.5 | 97.4 | 163.1 | 28.4 | -30.1 | 0 | 0 | 0 | 105.1 | G27 K31 | G27-P29 VanDerWaalsContact O-CD 3.31Å; G27-P29 WeakPolarHBondContact O-CD 3.36Å; P29-K31 PolarHBondContact O-N 3.42Å |
| 30 | L | 44.5 | Very low | 48.4 | Very low | 156 Ų | 156 | 115 Ų | 115 | 82% | 0.817 | 62% | 0.62 | S | S | * | * | | | trans | -61.2 | 82.2 | 151.9 | -90.3 | 148.9 | 0 | 0 | 0 | 103.8 | L28 E32 | L28-L30 PolarHBondContact O-N 3.18Å; L30-E32 PolarHBondContact O-N 3.22Å |
| 31 | K | 43.3 | Very low | 47.2 | Very low | 178 Ų | 178 | 114.7 Ų | 114.7 | 77% | 0.774 | 63% | 0.627 | S | S | * | * | | | trans | -54 | 107.9 | 159 | -115.6 | -174.9 | 164.4 | -179.5 | 0 | 102.8 | P29 E33 | P29-K31 PolarHBondContact O-N 3.42Å; K31-E33 PolarHBondContact O-N 3.45Å |
| 32 | E | 44 | Very low | 46.2 | Very low | 188 Ų | 188 | 118.2 Ų | 118.2 | 88% | 0.879 | 64% | 0.635 | S | S | * | * | | | trans | -59.2 | 77 | 162.1 | -59.5 | 150.8 | 166.5 | 0 | 0 | 104.5 | L30 E34 | L30-E32 PolarHBondContact O-N 3.22Å; E32-E34 PolarHBondContact O-N 3.21Å |
| 33 | E | 43.2 | Very low | 45.1 | Very low | 145 Ų | 145 | 121.1 Ų | 121.1 | 68% | 0.678 | 65% | 0.651 | S | S | * | * | | | trans | -71.8 | 93.3 | 167.4 | -151.2 | 173.2 | 111.1 | 0 | 0 | 103.6 | K31 I35 | K31-E33 PolarHBondContact O-N 3.45Å; E33-I35 HydrophobicContact CB-CG1 4.15Å; E33-I35 HydrophobicContact CG-CG1 4.14Å; E33-I35 VanDerWaalsContact O-CG1 3.3Å; E33-I35 WeakPolarHBondContact O-CG1 3.15Å; E33-I35 PolarHBondContact O-N 3.41Å |
| 34 | E | 41.8 | Very low | 44.6 | Very low | 186 Ų | 186 | 123 Ų | 123 | 87% | 0.869 | 66% | 0.663 | S | S | * | * | | | trans | -56.7 | 74.8 | 165 | -173.2 | -175.3 | 155.1 | 0 | 0 | 107.8 | E32 L36 | E32-E34 PolarHBondContact O-N 3.21Å; E34-L36 PolarHBondContact O-N 3.2Å |
| 35 | I | 42.7 | Very low | 44.3 | Very low | 128 Ų | 128 | 121.3 Ų | 121.3 | 66% | 0.656 | 67% | 0.668 | S | S | * | * | | | trans | -91.6 | 96.3 | 164 | -10.3 | 177.3 | 0 | 0 | 0 | 104.9 | E33 P37 | E33-I35 HydrophobicContact CB-CG1 4.15Å; E33-I35 HydrophobicContact CG-CG1 4.14Å; E33-I35 VanDerWaalsContact O-CG1 3.3Å; E33-I35 WeakPolarHBondContact O-CG1 3.15Å; E33-I35 PolarHBondContact O-N 3.41Å; I35-P37 WeakPolarHBondContact O-CD 3.41Å; I35-P37 VanDerWaalsContact O-N 3.09Å |
| 36 | L | 39.3 | Very low | 43.8 | Very low | 133 Ų | 133 | 124.8 Ų | 124.8 | 70% | 0.696 | 69% | 0.691 | S | S | * | * | | | trans | -38 | 114 | 162.4 | -169.9 | 98.2 | 0 | 0 | 0 | 108.4 | E34 E38 | E34-L36 PolarHBondContact O-N 3.2Å; L36-E38 PolarHBondContact O-N 3.34Å |
| 37 | P | 44.7 | Very low | 44 | Very low | 117 Ų | 117 | 120.4 Ų | 120.4 | 76% | 0.76 | 68% | 0.682 | S | S | * | * | | | trans | -72 | 109.1 | 179.5 | 27.1 | -29.8 | 0 | 0 | 0 | 107.6 | I35 | I35-P37 WeakPolarHBondContact O-CD 3.41Å; I35-P37 VanDerWaalsContact O-N 3.09Å |
| 38 | E | 41.3 | Very low | 44.2 | Very low | 157 Ų | 157 | 122.5 Ų | 122.5 | 73% | 0.734 | 69% | 0.691 | S | S | * | * | | | trans | -56.2 | 127.8 | 164 | -83.7 | -72.6 | 117.1 | 0 | 0 | 108.4 | L36 G40 | L36-E38 PolarHBondContact O-N 3.34Å; E38-G40 PolarHBondContact O-N 3.11Å; E38-G40 VanDerWaalsContact O-N 3.09Å |
| 39 | P | 42.2 | Very low | 44.7 | Very low | 125 Ų | 125 | 126.3 Ų | 126.3 | 81% | 0.812 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -85.7 | 89.6 | -170.1 | 33.8 | -32.1 | 0 | 0 | 0 | 109.7 | | |
| 40 | G | 45.3 | Very low | 45.5 | Very low | 57 Ų | 57 | 123.8 Ų | 123.8 | 59% | 0.588 | 70% | 0.696 | S | S | * | * | | | trans | 158.9 | 123.3 | 167.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | E38 | E38-G40 PolarHBondContact O-N 3.11Å; E38-G40 VanDerWaalsContact O-N 3.09Å |
| 41 | S | 41.3 | Very low | 46.1 | Very low | 104 Ų | 104 | 120.7 Ų | 120.7 | 73% | 0.727 | 68% | 0.68 | S | S | * | * | | | trans | 61.1 | 129.1 | 178.4 | 74.7 | 0 | 0 | 0 | 0 | 113.4 | | |
| 42 | E | 38.9 | Very low | 47.1 | Very low | 155 Ų | 155 | 114.8 Ų | 114.8 | 72% | 0.724 | 66% | 0.664 | S | S | * | * | | | cis | -164.7 | 156.4 | 26.1 | 32.2 | -121.1 | 101.7 | 0 | 0 | 106.9 | | |
| 43 | T | 41.2 | Very low | 48.1 | Very low | 104 Ų | 104 | 112.1 Ų | 112.1 | 64% | 0.638 | 65% | 0.652 | S | S | * | * | | | trans | -8.4 | 129.9 | 170.3 | 34.9 | 0 | 0 | 0 | 0 | 117.7 | T45 | T43-T45 PolarHBondContact O-N 3.33Š|
| 44 | P | 44.6 | Very low | 49.3 | Very low | 123 Ų | 123 | 110.6 Ų | 110.6 | 80% | 0.799 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | 52 | -178.1 | 35.3 | -37.6 | 0 | 0 | 0 | 112.7 | | |
| 45 | T | 46.9 | Very low | 50.6 | Low | 100 Ų | 100 | 103.3 Ų | 103.3 | 61% | 0.613 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | -31.7 | 174.4 | -50.8 | 0 | 0 | 0 | 0 | 110.7 | T43 A47 S48 | T43-T45 PolarHBondContact O-N 3.33Å; T45-A47 VanDerWaalsContact C-N 3.3Å; T45-A47 PolarHBondContact O-N 3.24Å; T45-S48 WeakPolarHBondContact O-CB 3.41Å; T45-S48 PolarHBondContact O-N 3.22Å |
| 46 | V | 44.1 | Very low | 51.8 | Low | 113 Ų | 113 | 103 Ų | 103 | 69% | 0.685 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -69.6 | -26.2 | -178.4 | -177.2 | 0 | 0 | 0 | 0 | 112.6 | S48 A50 | V46-S48 VanDerWaalsContact C-N 3.31Å; V46-S48 PolarHBondContact O-N 3.12Å; V46-A50 PolarHBondContact O-N 2.74Å |
| 47 | A | 55.7 | Low | 53.4 | Low | 65 Ų | 65 | 98 Ų | 98 | 54% | 0.537 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -70.7 | -26.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | T45 L51 | T45-A47 VanDerWaalsContact C-N 3.3Å; T45-A47 PolarHBondContact O-N 3.24Å; A47-L51 WeakPolarHBondContact O-CB 3.21Å; A47-L51 PolarHBondContact O-N 3.34Å; A47-L51 VanDerWaalsContact O-N 3.13Å |
| 48 | S | 53.9 | Low | 54.2 | Low | 78 Ų | 78 | 93.3 Ų | 93.3 | 55% | 0.545 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -72.6 | -42.5 | -179.6 | 159.5 | 0 | 0 | 0 | 0 | 111.9 | T45 V46 L51 A52 | T45-S48 WeakPolarHBondContact O-CB 3.41Å; T45-S48 PolarHBondContact O-N 3.22Å; V46-S48 VanDerWaalsContact C-N 3.31Å; V46-S48 PolarHBondContact O-N 3.12Å; S48-L51 PolarHBondContact O-N 3.44Å; S48-A52 WeakPolarHBondContact O-CB 3.14Å; S48-A52 PolarHBondContact O-N 3.28Å |
| 49 | E | 56 | Low | 55.3 | Low | 131 Ų | 131 | 90.3 Ų | 90.3 | 61% | 0.612 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -70.2 | -45.6 | -178.8 | -170.1 | 166.7 | -156.3 | 0 | 0 | 111.3 | L51 A52 E53 | E49-L51 VanDerWaalsContact C-N 3.28Å; E49-L51 PolarHBondContact O-N 3.11Å; E49-A52 WeakPolarHBondContact O-CB 2.92Å; E49-A52 PolarHBondContact O-N 3.41Å; E49-A52 VanDerWaalsContact O-N 3.1Å; E49-E53 WeakPolarHBondContact O-CG 3.31Å; E49-E53 PolarHBondContact O-N 3.19Å |
| 50 | A | 59.9 | Low | 56.3 | Low | 57 Ų | 57 | 90.4 Ų | 90.4 | 47% | 0.471 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.9 | -37.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V46 L54 | V46-A50 PolarHBondContact O-N 2.74Å; A50-L54 WeakPolarHBondContact O-CB 3.44Å; A50-L54 PolarHBondContact O-N 3.25Å |
| 51 | L | 57.1 | Low | 57.1 | Low | 91 Ų | 91 | 98.4 Ų | 98.4 | 48% | 0.476 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -70 | -37.2 | 175 | -174.7 | 133.6 | 0 | 0 | 0 | 111.7 | A47 S48 E49 L55 | A47-L51 WeakPolarHBondContact O-CB 3.21Å; A47-L51 PolarHBondContact O-N 3.34Å; A47-L51 VanDerWaalsContact O-N 3.13Å; S48-L51 PolarHBondContact O-N 3.44Å; E49-L51 VanDerWaalsContact C-N 3.28Å; E49-L51 PolarHBondContact O-N 3.11Å; L51-L55 HydrophobicContact CD2-CD1 3.5Å; L51-L55 HydrophobicContact CD2-CG 4.37Å; L51-L55 HydrophobicContact CG-CD1 4.15Å; L51-L55 VanDerWaalsContact O-CB 3.23Å; L51-L55 WeakPolarHBondContact O-CB 3.17Å; L51-L55 WeakPolarHBondContact O-CG 3.21Å; L51-L55 PolarHBondContact O-N 3.4Å |
| 52 | A | 65.8 | Low | 57.8 | Low | 54 Ų | 54 | 99.1 Ų | 99.1 | 45% | 0.446 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.2 | -42.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S48 E49 H56 | S48-A52 WeakPolarHBondContact O-CB 3.14Å; S48-A52 PolarHBondContact O-N 3.28Å; E49-A52 WeakPolarHBondContact O-CB 2.92Å; E49-A52 PolarHBondContact O-N 3.41Å; E49-A52 VanDerWaalsContact O-N 3.1Å; A52-H56 WeakPolarHBondContact O-CB 3.31Å; A52-H56 PolarHBondContact O-N 3.08Å |
| 53 | E | 63.6 | Low | 58.8 | Low | 132 Ų | 132 | 92.7 Ų | 92.7 | 62% | 0.617 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.5 | -42.1 | 175.6 | -72 | -175.1 | 172.2 | 0 | 0 | 112 | E49 H56 G57 | E49-E53 WeakPolarHBondContact O-CG 3.31Å; E49-E53 PolarHBondContact O-N 3.19Å; E53-H56 PolarHBondContact O-N 3.01Å; E53-G57 PolarHBondContact O-N 3.14Å |
| 54 | L | 69.6 | Low | 59.5 | Low | 112 Ų | 112 | 92.2 Ų | 92.2 | 59% | 0.586 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.1 | -41.9 | 177.3 | -171.6 | 125.4 | 0 | 0 | 0 | 111.4 | A50 A58 | A50-L54 WeakPolarHBondContact O-CB 3.44Å; A50-L54 PolarHBondContact O-N 3.25Å; L54-A58 WeakPolarHBondContact O-CB 3.21Å; L54-A58 PolarHBondContact O-N 2.75Å |
| 55 | L | 67.7 | Low | 60.2 | Low | 34 Ų | 34 | 95.1 Ų | 95.1 | 18% | 0.178 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -64.9 | -41.7 | 172.6 | -75.9 | 171.4 | 0 | 0 | 0 | 111.4 | L19 I25 L51 A58 L59 | L19-L55 HydrophobicContact CD1-CD1 4.03Å; I25-L55 HydrophobicContact CD1-CD2 4.47Å; L51-L55 HydrophobicContact CD2-CD1 3.5Å; L51-L55 HydrophobicContact CD2-CG 4.37Å; L51-L55 HydrophobicContact CG-CD1 4.15Å; L51-L55 VanDerWaalsContact O-CB 3.23Å; L51-L55 WeakPolarHBondContact O-CB 3.17Å; L51-L55 WeakPolarHBondContact O-CG 3.21Å; L51-L55 PolarHBondContact O-N 3.4Å; L55-A58 PolarHBondContact O-N 3.43Å; L55-L59 WeakPolarHBondContact O-CB 3.17Å; L55-L59 WeakPolarHBondContact O-CG 3.33Å; L55-L59 PolarHBondContact O-N 3.49Å |
| 56 | H | 68.6 | Low | 60.5 | Low | 122 Ų | 122 | 98.5 Ų | 98.5 | 57% | 0.565 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.3 | -46.4 | 177.4 | -172 | 46.7 | 0 | 0 | 0 | 111.1 | A52 E53 L60 | A52-H56 WeakPolarHBondContact O-CB 3.31Å; A52-H56 PolarHBondContact O-N 3.08Å; E53-H56 PolarHBondContact O-N 3.01Å; H56-L60 WeakPolarHBondContact O-CB 3.26Å; H56-L60 VanDerWaalsContact O-CG 3.26Å; H56-L60 WeakPolarHBondContact O-CG 3.41Å; H56-L60 PolarHBondContact O-N 3.44Å |
| 57 | G | 72.9 | Confident | 60.8 | Low | 27 Ų | 27 | 96 Ų | 96 | 28% | 0.278 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | E53 R61 | E53-G57 PolarHBondContact O-N 3.14Å; G57-R61 WeakPolarHBondContact O-CB 3.23Å; G57-R61 WeakPolarHBondContact O-CG 3.19Å; G57-R61 PolarHBondContact O-N 2.94Å |
| 58 | A | 62.5 | Low | 60.2 | Low | 19 Ų | 19 | 103.7 Ų | 103.7 | 16% | 0.157 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -68.8 | -40.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L28 L54 L55 R61 R62 | L28-A58 HydrophobicContact CD1-CB 4.18Å; L28-A58 HydrophobicContact CD2-CB 4.1Å; L54-A58 WeakPolarHBondContact O-CB 3.21Å; L54-A58 PolarHBondContact O-N 2.75Å; L55-A58 PolarHBondContact O-N 3.43Å; A58-R61 PolarHBondContact O-N 2.86Å; A58-R62 WeakPolarHBondContact O-CB 3.28Å; A58-R62 PolarHBondContact O-N 3Å |
| 59 | L | 62.9 | Low | 60 | Low | 94 Ų | 94 | 107 Ų | 107 | 49% | 0.492 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -73.3 | -26.1 | 177.8 | -69.8 | 171.6 | 0 | 0 | 0 | 112.9 | L55 G63 | L55-L59 WeakPolarHBondContact O-CB 3.17Å; L55-L59 WeakPolarHBondContact O-CG 3.33Å; L55-L59 PolarHBondContact O-N 3.49Å; L59-G63 WeakPolarHBondContact O-CA 3.47Å; L59-G63 PolarHBondContact O-N 3.38Å |
| 60 | L | 64 | Low | 59.8 | Low | 126 Ų | 126 | 106.8 Ų | 106.8 | 66% | 0.66 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -76.7 | -37.2 | 170.8 | -73.5 | 174.9 | 0 | 0 | 0 | 112 | H56 | H56-L60 WeakPolarHBondContact O-CB 3.26Å; H56-L60 VanDerWaalsContact O-CG 3.26Å; H56-L60 WeakPolarHBondContact O-CG 3.41Å; H56-L60 PolarHBondContact O-N 3.44Å |
| 61 | R | 61.1 | Low | 59.3 | Low | 226 Ų | 226 | 107.5 Ų | 107.5 | 85% | 0.853 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -80.3 | -29.6 | -179.2 | -71.1 | 176.6 | -179.5 | -158.6 | 1.7 | 114 | G57 A58 | G57-R61 WeakPolarHBondContact O-CB 3.23Å; G57-R61 WeakPolarHBondContact O-CG 3.19Å; G57-R61 PolarHBondContact O-N 2.94Å; A58-R61 PolarHBondContact O-N 2.86Å |
| 62 | R | 55.8 | Low | 58.8 | Low | 118 Ų | 118 | 108.1 Ų | 108.1 | 45% | 0.445 | 59% | 0.589 | S | S | . | * | S | Bend | trans | -125.8 | 27.6 | 178.3 | -64.1 | -167.5 | -175.5 | -177.3 | 5.3 | 111.5 | W24 G27 A58 | W24-R62 HydrophobicContact CE3-CB 4.46Å; W24-R62 WeakPolarHBondContact CZ3-O 3.39Å; G27-R62 VanDerWaalsContact C-NH1 3.31Å; G27-R62 PolarHBondContact O-NH1 3.4Å; G27-R62 VanDerWaalsContact O-NH1 3.14Å; G27-R62 PolarHBondContact O-NH2 3.12Å; A58-R62 WeakPolarHBondContact O-CB 3.28Å; A58-R62 PolarHBondContact O-N 3Å |
| 63 | G | 61.5 | Low | 57.7 | Low | 20 Ų | 20 | 112.2 Ų | 112.2 | 21% | 0.206 | 60% | 0.604 | C | S | . | * | S | Bend | trans | -59.1 | 161.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | W24 L59 E65 | W24-G63 WeakPolarHBondContact CZ3-O 3.4Å; L59-G63 WeakPolarHBondContact O-CA 3.47Å; L59-G63 PolarHBondContact O-N 3.38Å; G63-E65 PolarHBondContact O-N 3.1Å |
| 64 | P | 54.3 | Low | 57.2 | Low | 94 Ų | 94 | 111.3 Ų | 111.3 | 61% | 0.61 | 61% | 0.609 | S | S | * | * | | | trans | -48.9 | 116.4 | 171 | 20.6 | -30.2 | 0 | 0 | 0 | 108.2 | W24 M66 | W24-P64 HydrophobicContact CH2-CB 4.43Å; P64-M66 VanDerWaalsContact C-N 3.27Å; P64-M66 PolarHBondContact O-N 2.87Å |
| 65 | E | 61.1 | Low | 55.8 | Low | 184 Ų | 184 | 111 Ų | 111 | 86% | 0.86 | 61% | 0.608 | S | S | * | * | | | trans | -57.3 | 99.9 | 174.9 | -71.6 | -166.9 | 179.5 | 0 | 0 | 106.5 | G63 G67 | G63-E65 PolarHBondContact O-N 3.1Å; E65-G67 VanDerWaalsContact C-N 3.28Å; E65-G67 PolarHBondContact O-N 3.12Å |
| 66 | M | 51.8 | Low | 55 | Low | 172 Ų | 172 | 115.3 Ų | 115.3 | 85% | 0.847 | 64% | 0.638 | S | S | * | * | | | trans | -64.9 | 98.4 | 174.7 | -77.3 | -72.8 | -63 | 0 | 0 | 105.2 | P64 Y68 | P64-M66 VanDerWaalsContact C-N 3.27Å; P64-M66 PolarHBondContact O-N 2.87Å; M66-Y68 PolarHBondContact O-N 3.15Å |
| 67 | G | 51 | Low | 53.7 | Low | 61 Ų | 61 | 114.8 Ų | 114.8 | 63% | 0.629 | 64% | 0.644 | S | S | * | * | | | trans | -44.8 | 127.9 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111 | E65 L69 | E65-G67 VanDerWaalsContact C-N 3.28Å; E65-G67 PolarHBondContact O-N 3.12Å; G67-L69 PolarHBondContact O-N 3.49Å |
| 68 | Y | 43.7 | Very low | 52.4 | Low | 226 Ų | 226 | 121.3 Ų | 121.3 | 89% | 0.886 | 67% | 0.672 | S | S | * | * | | | trans | 21.8 | 92.3 | 162.2 | -68.1 | -89.7 | 0 | 0 | 0 | 115.9 | M66 | M66-Y68 PolarHBondContact O-N 3.15Š|
| 69 | L | 49.8 | Very low | 51.7 | Low | 147 Ų | 147 | 124.3 Ų | 124.3 | 77% | 0.77 | 70% | 0.696 | S | S | * | * | | | trans | -74.4 | 123.1 | 143.5 | -68.3 | -178.1 | 0 | 0 | 0 | 107 | G67 G71 | G67-L69 PolarHBondContact O-N 3.49Å; L69-G71 PolarHBondContact O-N 3.09Å; L69-G71 VanDerWaalsContact O-N 3.1Å |
| 70 | P | 51.2 | Low | 50.5 | Low | 127 Ų | 127 | 125.7 Ų | 125.7 | 83% | 0.825 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -67.9 | 114.8 | 173.1 | 28.2 | -29.5 | 0 | 0 | 0 | 107.8 | | |
| 71 | G | 49.7 | Very low | 49.3 | Very low | 71 Ų | 71 | 125.4 Ų | 125.4 | 73% | 0.732 | 71% | 0.714 | S | S | * | * | | | trans | 94.3 | 77.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | L69 | L69-G71 PolarHBondContact O-N 3.09Å; L69-G71 VanDerWaalsContact O-N 3.1Å |
| 72 | S | 45.3 | Very low | 48.3 | Very low | 105 Ų | 105 | 120.3 Ų | 120.3 | 73% | 0.734 | 71% | 0.711 | S | S | * | * | | | trans | -146.6 | 72.3 | 153.5 | -60.6 | 0 | 0 | 0 | 0 | 107.2 | P74 | S72-P74 VanDerWaalsContact O-CD 3.31Å; S72-P74 WeakPolarHBondContact O-CD 3.17Å |
| 73 | D | 44.6 | Very low | 48.2 | Very low | 139 Ų | 139 | 119.9 Ų | 119.9 | 74% | 0.743 | 73% | 0.732 | S | S | * | * | | | trans | -79.1 | 114 | 166.1 | -168.8 | 4.1 | 0 | 0 | 0 | 107.4 | D75 | D73-D75 VanDerWaalsContact C-N 3.28Å; D73-D75 PolarHBondContact O-N 3.19Å |
| 74 | P | 51.6 | Low | 47.7 | Very low | 114 Ų | 114 | 121.8 Ų | 121.8 | 74% | 0.74 | 75% | 0.751 | S | S | * | * | | | trans | -84 | 79.9 | 165.4 | 34.2 | -28.5 | 0 | 0 | 0 | 107.8 | S72 P76 | S72-P74 VanDerWaalsContact O-CD 3.31Å; S72-P74 WeakPolarHBondContact O-CD 3.17Å; P74-P76 VanDerWaalsContact O-CD 3.28Å; P74-P76 WeakPolarHBondContact O-CD 3.2Å |
| 75 | D | 40.8 | Very low | 47.2 | Very low | 106 Ų | 106 | 126.4 Ų | 126.4 | 57% | 0.567 | 77% | 0.765 | S | S | * | * | | | trans | -77.2 | 113 | 163.6 | -171.3 | -3.7 | 0 | 0 | 0 | 108 | D73 T77 | D73-D75 VanDerWaalsContact C-N 3.28Å; D73-D75 PolarHBondContact O-N 3.19Å; D75-T77 PolarHBondContact O-N 2.88Å; D75-T77 VanDerWaalsContact O-N 3.07Å; D75-T77 PolarHBondContact OD1-OG1 3.35Å |
| 76 | P | 51.3 | Low | 46.3 | Very low | 124 Ų | 124 | 124 Ų | 124 | 81% | 0.805 | 76% | 0.763 | S | S | * | * | | | trans | -87.4 | 61.7 | 178 | 37.6 | -29.6 | 0 | 0 | 0 | 108.7 | P74 | P74-P76 VanDerWaalsContact O-CD 3.28Å; P74-P76 WeakPolarHBondContact O-CD 3.2Å |
| 77 | T | 41 | Very low | 46.3 | Very low | 111 Ų | 111 | 124.1 Ų | 124.1 | 68% | 0.681 | 77% | 0.766 | S | S | * | * | | | trans | -110.2 | 103 | 174 | -58.5 | 0 | 0 | 0 | 0 | 110.7 | D75 | D75-T77 PolarHBondContact O-N 2.88Å; D75-T77 VanDerWaalsContact O-N 3.07Å; D75-T77 PolarHBondContact OD1-OG1 3.35Å |
| 78 | L | 45.3 | Very low | 45.8 | Very low | 164 Ų | 164 | 125.6 Ų | 125.6 | 86% | 0.859 | 77% | 0.772 | S | S | * | * | | | trans | -33.6 | 125.2 | 169 | -149.8 | 109.8 | 0 | 0 | 0 | 114.1 | | |
| 79 | A | 47 | Very low | 46 | Very low | 81 Ų | 81 | 120.5 Ų | 120.5 | 67% | 0.669 | 76% | 0.764 | S | S | * | * | | | trans | 51.3 | 109.4 | 143.9 | 0 | 0 | 0 | 0 | 0 | 119.8 | | |
| 80 | T | 38.8 | Very low | 45.5 | Very low | 123 Ų | 123 | 119.4 Ų | 119.4 | 76% | 0.755 | 77% | 0.766 | S | S | * | * | | | | 165.7 | 124.4 | 117.3 | -67.2 | 0 | 0 | 0 | 0 | 109.8 | P82 | T80-P82 WeakPolarHBondContact O-CD 3.47Š|
| 81 | P | 38.8 | Very low | 45.1 | Very low | 120 Ų | 120 | 118.8 Ų | 118.8 | 78% | 0.779 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 124.7 | 170.4 | 31.2 | -28.1 | 0 | 0 | 0 | 110.3 | A83 | P81-A83 PolarHBondContact O-N 2.93Š|
| 82 | P | 41 | Very low | 44.7 | Very low | 120 Ų | 120 | 122.7 Ų | 122.7 | 78% | 0.779 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 121.6 | 162.6 | 27.1 | -26 | 0 | 0 | 0 | 108.6 | T80 G84 | T80-P82 WeakPolarHBondContact O-CD 3.47Å; P82-G84 PolarHBondContact O-N 3.42Å |
| 83 | A | 53.1 | Low | 44.6 | Very low | 109 Ų | 109 | 123.7 Ų | 123.7 | 90% | 0.901 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 130.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | P81 | P81-A83 PolarHBondContact O-N 2.93Š|
| 84 | G | 50.5 | Low | 44.5 | Very low | 59 Ų | 59 | 127.5 Ų | 127.5 | 61% | 0.608 | 78% | 0.776 | S | S | * | * | | | trans | 122.9 | 98.2 | 165.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | P82 | P82-G84 PolarHBondContact O-N 3.42Š|
| 85 | Q | 44.5 | Very low | 44.3 | Very low | 192 Ų | 192 | 126.8 Ų | 126.8 | 90% | 0.897 | 78% | 0.78 | S | S | * | * | | | trans | -175.2 | 88 | 134.9 | -97 | 157.6 | 88 | 0 | 0 | 109.8 | | |
| 86 | T | 42.1 | Very low | 44.2 | Very low | 134 Ų | 134 | 127.5 Ų | 127.5 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | | | trans | 31 | 112 | 139.6 | -50.6 | 0 | 0 | 0 | 0 | 118.2 | A88 | T86-A88 PolarHBondContact O-N 3.33Å; T86-A88 VanDerWaalsContact O-N 3.14Å |
| 87 | L | 51.4 | Low | 43.8 | Very low | 174 Ų | 174 | 129.7 Ų | 129.7 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | | | trans | -43.1 | 112.2 | 159.9 | -69 | 163.5 | 0 | 0 | 0 | 111.6 | | |
| 88 | A | 40.7 | Very low | 43.8 | Very low | 91 Ų | 91 | 129.6 Ų | 129.6 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | | | trans | -120.7 | 99.6 | 159 | 0 | 0 | 0 | 0 | 0 | 108.1 | T86 | T86-A88 PolarHBondContact O-N 3.33Å; T86-A88 VanDerWaalsContact O-N 3.14Å |
| 89 | V | 47.2 | Very low | 43.4 | Very low | 119 Ų | 119 | 125.1 Ų | 125.1 | 72% | 0.721 | 78% | 0.782 | S | S | * | * | | | trans | -61.5 | 126.3 | 167.7 | 175.6 | 0 | 0 | 0 | 0 | 107.8 | S91 | V89-S91 PolarHBondContact O-N 2.87Å; V89-S91 VanDerWaalsContact O-N 3.12Å |
| 90 | P | 40.2 | Very low | 43 | Very low | 125 Ų | 125 | 128.1 Ų | 128.1 | 81% | 0.812 | 79% | 0.792 | S | S | * | * | | | trans | -70.7 | 111.1 | 170.5 | 22.9 | -22.8 | 0 | 0 | 0 | 108.7 | L92 | P90-L92 PolarHBondContact O-N 3.33Š|
| 91 | S | 42.2 | Very low | 43 | Very low | 114 Ų | 114 | 125.5 Ų | 125.5 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | | | trans | -62.5 | 123.4 | 177.5 | -58.4 | 0 | 0 | 0 | 0 | 111.5 | V89 | V89-S91 PolarHBondContact O-N 2.87Å; V89-S91 VanDerWaalsContact O-N 3.12Å |
| 92 | L | 41.8 | Very low | 43.3 | Very low | 153 Ų | 153 | 125.1 Ų | 125.1 | 80% | 0.801 | 79% | 0.787 | S | S | * | * | | | trans | -74.5 | 127.4 | 173.5 | -157.7 | 139.6 | 0 | 0 | 0 | 109.3 | P90 R94 | P90-L92 PolarHBondContact O-N 3.33Å; L92-R94 PolarHBondContact O-N 3.47Å |
| 93 | P | 42.1 | Very low | 43.3 | Very low | 125 Ų | 125 | 126.7 Ų | 126.7 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | | | trans | -70.2 | 106.6 | 173.1 | 25.5 | -28.7 | 0 | 0 | 0 | 109.3 | A95 | P93-A95 PolarHBondContact O-N 2.89Š|
| 94 | R | 44 | Very low | 42.8 | Very low | 219 Ų | 219 | 127 Ų | 127 | 83% | 0.826 | 78% | 0.779 | S | S | * | * | | | trans | -56.4 | 121.9 | 177.1 | -176.1 | 178 | -178 | 98.3 | -1.1 | 110.9 | L92 T96 | L92-R94 PolarHBondContact O-N 3.47Å; R94-T96 PolarHBondContact O-N 2.9Å |
| 95 | A | 45.9 | Very low | 42.5 | Very low | 99 Ų | 99 | 130.7 Ų | 130.7 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | | | trans | -53.5 | 126.4 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110 | P93 | P93-A95 PolarHBondContact O-N 2.89Š|
| 96 | T | 38.6 | Very low | 42.1 | Very low | 121 Ų | 121 | 126.2 Ų | 126.2 | 74% | 0.742 | 79% | 0.786 | S | S | * | * | | | trans | -139.6 | 99 | 170.6 | -47.8 | 0 | 0 | 0 | 0 | 108.9 | R94 | R94-T96 PolarHBondContact O-N 2.9Š|
| 97 | E | 43.1 | Very low | 41.9 | Very low | 171 Ų | 171 | 126 Ų | 126 | 80% | 0.799 | 78% | 0.784 | S | S | * | * | | | trans | -100 | 155.8 | 139.8 | -108.5 | -85.6 | 119.2 | 0 | 0 | 104.8 | | |
| 98 | P | 42.3 | Very low | 41.3 | Very low | 109 Ų | 109 | 123.2 Ų | 123.2 | 71% | 0.708 | 78% | 0.775 | S | S | * | * | | | cis | -133.4 | 155.5 | 14.3 | 33.8 | -13.7 | 0 | 0 | 0 | 114.7 | | |
| 99 | G | 36.4 | Very low | 41.2 | Very low | 69 Ų | 69 | 124.6 Ų | 124.6 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | | | trans | -134.6 | 87.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | G101 | G99-G101 PolarHBondContact O-N 3.02Š|
| 100 | T | 38.8 | Very low | 40.8 | Very low | 145 Ų | 145 | 126.8 Ų | 126.8 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | | | trans | -53.5 | 122.2 | 169.3 | -57.7 | 0 | 0 | 0 | 0 | 112.4 | | |
| 101 | G | 37.6 | Very low | 40.5 | Very low | 68 Ų | 68 | 124 Ų | 124 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | | | trans | -131.8 | 125 | 163.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | G99 | G99-G101 PolarHBondContact O-N 3.02Š|
| 102 | P | 46.7 | Very low | 40.3 | Very low | 112 Ų | 112 | 125.6 Ų | 125.6 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | | | trans | -93.6 | 169.7 | 179.5 | 36.7 | -31.4 | 0 | 0 | 0 | 112 | | |
| 103 | L | 39.9 | Very low | 40.6 | Very low | 152 Ų | 152 | 130.1 Ų | 130.1 | 80% | 0.796 | 79% | 0.789 | S | S | * | * | | | trans | 110.3 | 83.4 | 171.7 | -59.8 | 163.8 | 0 | 0 | 0 | 113.1 | | |
| 104 | T | 41.9 | Very low | 40.5 | Very low | 116 Ų | 116 | 127.4 Ų | 127.4 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | | | | 63.9 | 98.1 | 96.1 | 59.3 | 0 | 0 | 0 | 0 | 114.5 | | |
| 105 | T | 44.6 | Very low | 40.5 | Very low | 137 Ų | 137 | 121.9 Ų | 121.9 | 84% | 0.84 | 79% | 0.785 | S | S | * | * | | | | -164.4 | 93.5 | 122 | 3.8 | 0 | 0 | 0 | 0 | 109.4 | V107 | T105-V107 PolarHBondContact O-N 2.89Š|
| 106 | A | 36.1 | Very low | 40.4 | Very low | 97 Ų | 97 | 120.1 Ų | 120.1 | 80% | 0.802 | 78% | 0.776 | S | S | * | * | | | trans | -71.1 | 119.6 | 156.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | | |
| 107 | V | 38.7 | Very low | 40.6 | Very low | 131 Ų | 131 | 121 Ų | 121 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | | | trans | -112 | 99.4 | 159.4 | 177 | 0 | 0 | 0 | 0 | 107 | T105 | T105-V107 PolarHBondContact O-N 2.89Š|
| 108 | T | 37.8 | Very low | 40.6 | Very low | 115 Ų | 115 | 119 Ų | 119 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | | | trans | -71.2 | 133.1 | 166 | -5.5 | 0 | 0 | 0 | 0 | 109.5 | | |
| 109 | P | 39.6 | Very low | 40.6 | Very low | 120 Ų | 120 | 117.3 Ų | 117.3 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | | | trans | -92.2 | 111.5 | 145 | 0.6 | 17.5 | 0 | 0 | 0 | 108.3 | G111 | P109-G111 PolarHBondContact O-N 2.79Š|
| 110 | N | 38.3 | Very low | 41.1 | Very low | 164 Ų | 164 | 120.3 Ų | 120.3 | 88% | 0.877 | 79% | 0.786 | S | S | * | * | | | trans | -59.4 | 127.6 | 161.3 | -97.1 | -32.9 | 0 | 0 | 0 | 108.9 | | |
| 111 | G | 34.1 | Very low | 41.4 | Very low | 68 Ų | 68 | 122 Ų | 122 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | | | trans | 174.4 | 79.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | P109 | P109-G111 PolarHBondContact O-N 2.79Š|
| 112 | V | 38.5 | Very low | 41.5 | Very low | 146 Ų | 146 | 126.2 Ų | 126.2 | 89% | 0.885 | 79% | 0.79 | S | S | * | * | | | trans | 80.9 | 105.7 | 149.7 | -162.7 | 0 | 0 | 0 | 0 | 118.3 | | |
| 113 | R | 47 | Very low | 41.6 | Very low | 248 Ų | 248 | 129.2 Ų | 129.2 | 94% | 0.936 | 80% | 0.799 | S | S | * | * | | | trans | -33.9 | 122 | 157.1 | 178.7 | -175.3 | -68.6 | -157.6 | -2.3 | 114.1 | | |
| 114 | G | 40.7 | Very low | 42.2 | Very low | 69 Ų | 69 | 127.8 Ų | 127.8 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | | | trans | 179.5 | 98.6 | 164 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 115 | A | 42.8 | Very low | 42.4 | Very low | 103 Ų | 103 | 127.5 Ų | 127.5 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | | | trans | 36.3 | 109.7 | 151.9 | 0 | 0 | 0 | 0 | 0 | 120.8 | | |
| 116 | G | 44 | Very low | 42.6 | Very low | 61 Ų | 61 | 126.3 Ų | 126.3 | 63% | 0.629 | 79% | 0.791 | S | S | * | * | | | trans | 61.9 | 131.5 | 134.9 | 0 | 0 | 0 | 0 | 0 | 120.2 | T118 | G116-T118 PolarHBondContact O-N 2.84Š|
| 117 | P | 43.8 | Very low | 43.2 | Very low | 139 Ų | 139 | 128.2 Ų | 128.2 | 90% | 0.903 | 80% | 0.795 | S | S | * | * | | | trans | -69.2 | 105.2 | 167.8 | 29 | -30.2 | 0 | 0 | 0 | 109.4 | | |
| 118 | T | 42.7 | Very low | 43.9 | Very low | 129 Ų | 129 | 125.5 Ų | 125.5 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 130.8 | 169.4 | -60 | 0 | 0 | 0 | 0 | 108.3 | G116 | G116-T118 PolarHBondContact O-N 2.84Š|
| 119 | A | 43.6 | Very low | 44.3 | Very low | 75 Ų | 75 | 126.2 Ų | 126.2 | 62% | 0.62 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 152.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | E121 | A119-E121 PolarHBondContact O-N 2.82Š|
| 120 | P | 46.3 | Very low | 44.9 | Very low | 132 Ų | 132 | 127 Ų | 127 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 119.9 | 175.9 | 25 | -31.5 | 0 | 0 | 0 | 110.3 | | |
| 121 | E | 43.7 | Very low | 45.7 | Very low | 179 Ų | 179 | 122.6 Ų | 122.6 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 136.7 | 179.7 | -74.9 | -164.5 | 115.2 | 0 | 0 | 112.7 | A119 L123 | A119-E121 PolarHBondContact O-N 2.82Å; E121-L123 PolarHBondContact O-N 3.41Å |
| 122 | L | 41.7 | Very low | 46.8 | Very low | 158 Ų | 158 | 124.6 Ų | 124.6 | 83% | 0.827 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 116.7 | 160.2 | -87.9 | 124.2 | 0 | 0 | 0 | 110.2 | T124 | L122-T124 VanDerWaalsContact C-N 3.33Å; L122-T124 PolarHBondContact O-N 2.86Å |
| 123 | L | 46.8 | Very low | 47.9 | Very low | 175 Ų | 175 | 123 Ų | 123 | 92% | 0.916 | 78% | 0.781 | S | S | * | * | | | trans | -64.6 | 92.7 | 164.6 | -68.5 | 171.6 | 0 | 0 | 0 | 109.4 | E121 | E121-L123 PolarHBondContact O-N 3.41Š|
| 124 | T | 53.4 | Low | 48.3 | Very low | 121 Ų | 121 | 116.5 Ų | 116.5 | 74% | 0.742 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -90.2 | 118.4 | 166 | -38.1 | 0 | 0 | 0 | 0 | 107.4 | L122 | L122-T124 VanDerWaalsContact C-N 3.33Å; L122-T124 PolarHBondContact O-N 2.86Å |
| 125 | P | 46.5 | Very low | 48.9 | Very low | 111 Ų | 111 | 119.1 Ų | 119.1 | 72% | 0.721 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -71 | 150.9 | 176.3 | 27.4 | -31.7 | 0 | 0 | 0 | 111.2 | | |
| 126 | P | 48.1 | Very low | 49.3 | Very low | 111 Ų | 111 | 119.2 Ų | 119.2 | 72% | 0.721 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 152.9 | -173.6 | 28 | -34.3 | 0 | 0 | 0 | 112.3 | G128 | P126-G128 PolarHBondContact O-N 3.22Š|
| 127 | P | 48.3 | Very low | 49.6 | Very low | 138 Ų | 138 | 122.1 Ų | 122.1 | 90% | 0.896 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | 122 | -177.3 | 24.4 | -17.3 | 0 | 0 | 0 | 110 | | |
| 128 | G | 54.3 | Low | 49.8 | Very low | 74 Ų | 74 | 120.1 Ų | 120.1 | 76% | 0.763 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 135 | 4.4 | 165.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | P126 | P126-G128 PolarHBondContact O-N 3.22Š|
| 129 | T | 47.1 | Very low | 49.9 | Very low | 129 Ų | 129 | 119 Ų | 119 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | | | trans | -120 | 75.5 | 174.9 | -52.5 | 0 | 0 | 0 | 0 | 110.9 | A131 | T129-A131 VanDerWaalsContact C-N 3.32Å; T129-A131 PolarHBondContact O-N 3.14Å; T129-A131 VanDerWaalsContact O-N 3.13Å |
| 130 | T | 50.6 | Low | 50 | Low | 138 Ų | 138 | 121.2 Ų | 121.2 | 85% | 0.847 | 78% | 0.777 | S | S | * | * | | | trans | -78.5 | 90.1 | 161.4 | -50.9 | 0 | 0 | 0 | 0 | 107.2 | | |
| 131 | A | 56.4 | Low | 50 | Low | 71 Ų | 71 | 117.6 Ų | 117.6 | 59% | 0.587 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 134.3 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | T129 | T129-A131 VanDerWaalsContact C-N 3.32Å; T129-A131 PolarHBondContact O-N 3.14Å; T129-A131 VanDerWaalsContact O-N 3.13Å |
| 132 | P | 57.3 | Low | 50.5 | Low | 110 Ų | 110 | 114.7 Ų | 114.7 | 71% | 0.714 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 143.5 | 172.2 | 24.1 | -31.5 | 0 | 0 | 0 | 108.4 | | |
| 133 | P | 59.7 | Low | 50.7 | Low | 113 Ų | 113 | 113 Ų | 113 | 73% | 0.734 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 144 | 177.4 | 25 | -33.3 | 0 | 0 | 0 | 109.2 | | |
| 134 | P | 55.8 | Low | 50.7 | Low | 111 Ų | 111 | 113 Ų | 113 | 72% | 0.721 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 144.7 | 176 | 23.5 | -32.9 | 0 | 0 | 0 | 109.7 | S136 | P134-S136 PolarHBondContact O-N 3.27Å; P134-S136 VanDerWaalsContact O-N 3.17Å |
| 135 | P | 54.7 | Low | 50.4 | Low | 124 Ų | 124 | 110 Ų | 110 | 81% | 0.805 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 128.2 | 174.9 | 23.2 | -31.4 | 0 | 0 | 0 | 108 | | |
| 136 | S | 50.4 | Low | 50.3 | Low | 105 Ų | 105 | 111.3 Ų | 111.3 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 139.6 | 177.7 | -61.9 | 0 | 0 | 0 | 0 | 109.1 | P134 A138 | P134-S136 PolarHBondContact O-N 3.27Å; P134-S136 VanDerWaalsContact O-N 3.17Å; S136-A138 PolarHBondContact O-N 3.03Å; S136-A138 VanDerWaalsContact O-N 3.12Å |
| 137 | P | 49.7 | Very low | 50.2 | Low | 122 Ų | 122 | 115.4 Ų | 115.4 | 79% | 0.792 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 127.5 | 173.6 | 21.2 | -29.8 | 0 | 0 | 0 | 107.5 | S139 | P137-S139 PolarHBondContact O-N 3.15Š|
| 138 | A | 48.1 | Very low | 50.1 | Low | 96 Ų | 96 | 112.6 Ų | 112.6 | 79% | 0.793 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 122.1 | 178 | 0 | 0 | 0 | 0 | 0 | 107.8 | S136 | S136-A138 PolarHBondContact O-N 3.03Å; S136-A138 VanDerWaalsContact O-N 3.12Å |
| 139 | S | 44.3 | Very low | 49.5 | Very low | 107 Ų | 107 | 112.3 Ų | 112.3 | 75% | 0.748 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 128.1 | 177.7 | -152.4 | 0 | 0 | 0 | 0 | 107.4 | P137 G141 | P137-S139 PolarHBondContact O-N 3.15Å; S139-G141 PolarHBondContact O-N 3.25Å |
| 140 | P | 46.9 | Very low | 49.2 | Very low | 120 Ų | 120 | 115.3 Ų | 115.3 | 78% | 0.779 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -55 | 117.9 | 169.7 | -16.1 | 28.1 | 0 | 0 | 0 | 105.5 | | |
| 141 | G | 46.8 | Very low | 49.1 | Very low | 56 Ų | 56 | 118.1 Ų | 118.1 | 58% | 0.577 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 151.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | S139 | S139-G141 PolarHBondContact O-N 3.25Š|
| 142 | P | 52.6 | Low | 48.3 | Very low | 119 Ų | 119 | 122.8 Ų | 122.8 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 139.7 | 174.6 | 23.5 | -32.4 | 0 | 0 | 0 | 108.6 | L144 | P142-L144 PolarHBondContact O-N 3.02Š|
| 143 | P | 47.5 | Very low | 47.8 | Very low | 121 Ų | 121 | 123.3 Ų | 123.3 | 79% | 0.786 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 131.8 | -180 | 23.8 | -32 | 0 | 0 | 0 | 107.9 | G145 | P143-G145 PolarHBondContact O-N 2.87Å; P143-G145 VanDerWaalsContact O-N 3.12Å |
| 144 | L | 46.4 | Very low | 46.9 | Very low | 176 Ų | 176 | 122.7 Ų | 122.7 | 92% | 0.921 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 124.6 | 170.1 | -75 | 164.1 | 0 | 0 | 0 | 106.8 | P142 | P142-L144 PolarHBondContact O-N 3.02Š|
| 145 | G | 46.8 | Very low | 46.1 | Very low | 57 Ų | 57 | 122 Ų | 122 | 59% | 0.588 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 154 | -177 | 0 | 0 | 0 | 0 | 0 | 110.7 | P143 E147 | P143-G145 PolarHBondContact O-N 2.87Å; P143-G145 VanDerWaalsContact O-N 3.12Å; G145-E147 PolarHBondContact O-N 3.02Å |
| 146 | P | 44.9 | Very low | 45.2 | Very low | 139 Ų | 139 | 120.2 Ų | 120.2 | 90% | 0.903 | 76% | 0.759 | S | S | * | * | | | trans | -55.2 | 115.1 | 177.7 | 21.9 | -30 | 0 | 0 | 0 | 109 | G148 | P146-G148 PolarHBondContact O-N 3.32Š|
| 147 | E | 46.1 | Very low | 44.8 | Very low | 197 Ų | 197 | 123.3 Ų | 123.3 | 92% | 0.921 | 76% | 0.761 | S | S | * | * | | | trans | -66.2 | 111.2 | 171 | -175.3 | 176.5 | 103.9 | 0 | 0 | 107.4 | G145 | G145-E147 PolarHBondContact O-N 3.02Š|
| 148 | G | 46.1 | Very low | 44.3 | Very low | 79 Ų | 79 | 125.5 Ų | 125.5 | 81% | 0.814 | 76% | 0.76 | S | S | * | * | S | Bend | trans | 53 | 106 | 157.4 | 0 | 0 | 0 | 0 | 0 | 117.8 | P146 | P146-G148 PolarHBondContact O-N 3.32Š|
| 149 | G | 40.8 | Very low | 43.8 | Very low | 69 Ų | 69 | 129.1 Ų | 129.1 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | | | trans | 170.7 | 97.8 | 161.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 150 | E | 40.2 | Very low | 43.5 | Very low | 192 Ų | 192 | 130 Ų | 130 | 90% | 0.897 | 77% | 0.77 | S | S | * | * | | | trans | 42 | 131.7 | 160 | 63.7 | -160.4 | 146.7 | 0 | 0 | 121.1 | E152 | E150-E152 PolarHBondContact O-N 2.98Å; E150-E152 VanDerWaalsContact O-N 3.12Å |
| 151 | E | 49.5 | Very low | 43.2 | Very low | 196 Ų | 196 | 128.8 Ų | 128.8 | 92% | 0.916 | 77% | 0.77 | S | S | * | * | | | trans | -51.6 | 107.9 | -175.2 | -71.2 | 175.8 | 99.5 | 0 | 0 | 114.2 | | |
| 152 | E | 39.6 | Very low | 42.9 | Very low | 169 Ų | 169 | 133.9 Ų | 133.9 | 79% | 0.79 | 77% | 0.772 | S | S | * | * | | | trans | -107.7 | 107.2 | 158.6 | -165 | 173.5 | 132.4 | 0 | 0 | 109.1 | E150 T154 | E150-E152 PolarHBondContact O-N 2.98Å; E150-E152 VanDerWaalsContact O-N 3.12Å; E152-T154 VanDerWaalsContact C-N 3.25Å; E152-T154 PolarHBondContact O-N 3.35Å |
| 153 | T | 47.1 | Very low | 42.5 | Very low | 122 Ų | 122 | 133 Ų | 133 | 75% | 0.748 | 77% | 0.767 | S | S | * | * | | | trans | -69.2 | 85.3 | 175.9 | -61 | 0 | 0 | 0 | 0 | 109.3 | T155 | T153-T155 PolarHBondContact O-N 2.81Š|
| 154 | T | 41.1 | Very low | 42.1 | Very low | 99 Ų | 99 | 133.5 Ų | 133.5 | 61% | 0.607 | 77% | 0.77 | S | S | * | * | | | trans | -76.6 | 89.9 | 173.8 | -58.1 | 0 | 0 | 0 | 0 | 108.7 | E152 T156 | E152-T154 VanDerWaalsContact C-N 3.25Å; E152-T154 PolarHBondContact O-N 3.35Å; T154-T156 PolarHBondContact O-N 2.84Å |
| 155 | T | 38.1 | Very low | 42 | Very low | 97 Ų | 97 | 129.6 Ų | 129.6 | 60% | 0.595 | 75% | 0.749 | S | S | * | * | | | trans | -73.7 | 95.8 | 168.1 | -59.8 | 0 | 0 | 0 | 0 | 108.4 | T153 H157 | T153-T155 PolarHBondContact O-N 2.81Å; T155-H157 PolarHBondContact O-N 3.3Å |
| 156 | T | 36.4 | Very low | 41.7 | Very low | 87 Ų | 87 | 132.4 Ų | 132.4 | 53% | 0.534 | 76% | 0.757 | S | S | . | * | | | trans | -77.6 | 105.2 | 177.6 | -59.4 | 0 | 0 | 0 | 0 | 108.9 | T154 H158 | T154-T156 PolarHBondContact O-N 2.84Å; T156-H158 WeakPolarHBondContact CG2-NE2 3.3Å; T156-H158 PolarHBondContact O-N 3.4Å |
| 157 | H | 41.9 | Very low | 41.9 | Very low | 170 Ų | 170 | 132.7 Ų | 132.7 | 79% | 0.787 | 76% | 0.756 | S | S | * | * | | | trans | -87.1 | 102.3 | 169.9 | -76.5 | -62.9 | 0 | 0 | 0 | 110.4 | T155 L159 | T155-H157 PolarHBondContact O-N 3.3Å; H157-L159 PolarHBondContact O-N 2.87Å |
| 158 | H | 39.2 | Very low | 41.8 | Very low | 167 Ų | 167 | 130.8 Ų | 130.8 | 77% | 0.773 | 75% | 0.752 | S | S | * | * | | | trans | -76.8 | 109 | 172.1 | -74.3 | -79.2 | 0 | 0 | 0 | 110.4 | T156 | T156-H158 WeakPolarHBondContact CG2-NE2 3.3Å; T156-H158 PolarHBondContact O-N 3.4Å |
| 159 | L | 36.7 | Very low | 41.4 | Very low | 173 Ų | 173 | 135 Ų | 135 | 91% | 0.906 | 75% | 0.751 | S | S | * | * | | | trans | -93.9 | 97.4 | 166.4 | -166.3 | 72.9 | 0 | 0 | 0 | 109.6 | H157 A161 | H157-L159 PolarHBondContact O-N 2.87Å; L159-A161 PolarHBondContact O-N 2.71Å |
| 160 | C | 38.8 | Very low | 41.2 | Very low | 124 Ų | 124 | 137.6 Ų | 137.6 | 84% | 0.838 | 76% | 0.755 | S | S | * | * | | | trans | -77.7 | 105.2 | 168.4 | -99.5 | 0 | 0 | 0 | 0 | 109.6 | R162 | C160-R162 PolarHBondContact O-N 2.89Š|
| 161 | A | 39.7 | Very low | 40.9 | Very low | 96 Ų | 96 | 132.6 Ų | 132.6 | 79% | 0.793 | 75% | 0.746 | S | S | * | * | | | trans | -72.1 | 106.9 | 164.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | L159 | L159-A161 PolarHBondContact O-N 2.71Š|
| 162 | R | 42.5 | Very low | 40.3 | Very low | 163 Ų | 163 | 128 Ų | 128 | 62% | 0.615 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 131 | 175.5 | -162.9 | -179.9 | -170.4 | 174.2 | 6.4 | 108.9 | C160 | C160-R162 PolarHBondContact O-N 2.89Š|
| 163 | P | 42.4 | Very low | 40 | Very low | 101 Ų | 101 | 126.4 Ų | 126.4 | 66% | 0.656 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 151.7 | 168.2 | 25.3 | -30.6 | 0 | 0 | 0 | 109.7 | L165 | P163-L165 PolarHBondContact O-N 2.74Å; P163-L165 VanDerWaalsContact O-N 3.12Å |
| 164 | P | 39.9 | Very low | 39.3 | Very low | 131 Ų | 131 | 128.5 Ų | 128.5 | 85% | 0.851 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 120.9 | -179.5 | 25.1 | -32.1 | 0 | 0 | 0 | 108.9 | | |
| 165 | L | 44.3 | Very low | 38.7 | Very low | 94 Ų | 94 | 132.7 Ų | 132.7 | 49% | 0.492 | 75% | 0.754 | S | S | . | * | P | Polyproline II helix | trans | -70.5 | 144.8 | 173.8 | -69.8 | 177 | 0 | 0 | 0 | 109.7 | P163 | P163-L165 PolarHBondContact O-N 2.74Å; P163-L165 VanDerWaalsContact O-N 3.12Å |
| 166 | P | 40.4 | Very low | 38.2 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 75% | 0.753 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 139.1 | 165.1 | 24.7 | -29.7 | 0 | 0 | 0 | 109.9 | D168 | P166-D168 VanDerWaalsContact C-N 3.33Å; P166-D168 PolarHBondContact O-N 2.86Å |
| 167 | V | 48.8 | Very low | 37.8 | Very low | 144 Ų | 144 | 135.7 Ų | 135.7 | 87% | 0.873 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -65.3 | 84.2 | -177.5 | -178.5 | 0 | 0 | 0 | 0 | 109.6 | | |
| 168 | D | 45 | Very low | 37.8 | Very low | 157 Ų | 157 | 132.7 Ų | 132.7 | 84% | 0.84 | 77% | 0.767 | S | S | * | * | | | trans | -177.4 | 55.6 | 154.1 | -116 | -36.7 | 0 | 0 | 0 | 113.8 | P166 | P166-D168 VanDerWaalsContact C-N 3.33Å; P166-D168 PolarHBondContact O-N 2.86Å |
| 169 | Q | 36.7 | Very low | 37.4 | Very low | 169 Ų | 169 | 131.5 Ų | 131.5 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | | | trans | -140.7 | 138.5 | 161.6 | -79.1 | -158 | -4.7 | 0 | 0 | 112 | | |
| 170 | P | 36.3 | Very low | 37.5 | Very low | 123 Ų | 123 | 132.7 Ų | 132.7 | 80% | 0.799 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 141 | 176.6 | 28.2 | -32.2 | 0 | 0 | 0 | 110.4 | | |
| 171 | A | 35.3 | Very low | 37.2 | Very low | 87 Ų | 87 | 137.5 Ų | 137.5 | 72% | 0.719 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 136 | -172.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | T173 | A171-T173 PolarHBondContact O-N 3.03Š|
| 172 | P | 36.8 | Very low | 37.1 | Very low | 98 Ų | 98 | 138.6 Ų | 138.6 | 64% | 0.636 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 124.3 | 165.7 | 28.4 | -30.3 | 0 | 0 | 0 | 108.7 | L174 | P172-L174 PolarHBondContact O-N 2.83Š|
| 173 | T | 31.5 | Very low | 36.6 | Very low | 137 Ų | 137 | 137.8 Ų | 137.8 | 84% | 0.84 | 78% | 0.776 | S | S | * | * | | | trans | -65.8 | 113 | 173.5 | -28.3 | 0 | 0 | 0 | 0 | 108.3 | A171 Q175 | A171-T173 PolarHBondContact O-N 3.03Å; T173-Q175 PolarHBondContact O-N 3Å |
| 174 | L | 32.5 | Very low | 36.3 | Very low | 166 Ų | 166 | 139.8 Ų | 139.8 | 87% | 0.869 | 79% | 0.786 | S | S | * | * | | | trans | -75.6 | 102.2 | 167 | -81.5 | 168.9 | 0 | 0 | 0 | 107.5 | P172 S176 | P172-L174 PolarHBondContact O-N 2.83Å; L174-S176 PolarHBondContact O-N 3.07Å |
| 175 | Q | 28.5 | Very low | 35.8 | Very low | 187 Ų | 187 | 137.4 Ų | 137.4 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | | | trans | -81.3 | 106.5 | 168.8 | -168 | 166.4 | -0.2 | 0 | 0 | 107.7 | T173 D177 | T173-Q175 PolarHBondContact O-N 3Å; Q175-D177 PolarHBondContact O-N 2.85Å |
| 176 | S | 28.5 | Very low | 35.5 | Very low | 107 Ų | 107 | 138.1 Ų | 138.1 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | | | trans | -77 | 111.3 | 167.8 | -31.1 | 0 | 0 | 0 | 0 | 107.4 | L174 P178 | L174-S176 PolarHBondContact O-N 3.07Å; S176-P178 WeakPolarHBondContact O-CD 3.34Å |
| 177 | D | 28.7 | Very low | 35 | Very low | 139 Ų | 139 | 136 Ų | 136 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | | | trans | -85.4 | 115.5 | 165.5 | -163.8 | -6.7 | 0 | 0 | 0 | 107.7 | Q175 D179 | Q175-D177 PolarHBondContact O-N 2.85Å; D177-D179 PolarHBondContact O-N 3.39Å |
| 178 | P | 41.1 | Very low | 34.6 | Very low | 108 Ų | 108 | 140.6 Ų | 140.6 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | | | trans | -100.5 | 59.5 | -175.5 | 40 | -30.4 | 0 | 0 | 0 | 110.1 | S176 | S176-P178 WeakPolarHBondContact O-CD 3.34Š|
| 179 | D | 31.1 | Very low | 33.9 | Very low | 141 Ų | 141 | 136.7 Ų | 136.7 | 75% | 0.754 | 79% | 0.794 | S | S | * | * | | | trans | -146.2 | 111.4 | 167.9 | -86 | -48.8 | 0 | 0 | 0 | 111.6 | D177 R181 | D177-D179 PolarHBondContact O-N 3.39Å; D179-R181 PolarHBondContact O-N 3.45Å |
| 180 | H | 39.6 | Very low | 33.8 | Very low | 198 Ų | 198 | 136.5 Ų | 136.5 | 92% | 0.917 | 79% | 0.793 | S | S | * | * | | | trans | -59.4 | 103.5 | 164 | -87.7 | -88.2 | 0 | 0 | 0 | 109.5 | | |
| 181 | R | 31.1 | Very low | 33.9 | Very low | 225 Ų | 225 | 136.1 Ų | 136.1 | 85% | 0.849 | 79% | 0.791 | S | S | * | * | | | trans | -155.7 | 129.2 | 150.5 | -113.9 | 172.2 | -175.2 | -167.2 | 1.1 | 110.6 | D179 I183 | D179-R181 PolarHBondContact O-N 3.45Å; R181-I183 PolarHBondContact O-N 3.44Å |
| 182 | S | 38 | Very low | 33.6 | Very low | 120 Ų | 120 | 135.6 Ų | 135.6 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | | | trans | -44.4 | 125.2 | 164.8 | 40.5 | 0 | 0 | 0 | 0 | 111.3 | | |
| 183 | I | 32.2 | Very low | 33.8 | Very low | 146 Ų | 146 | 137.3 Ų | 137.3 | 75% | 0.749 | 81% | 0.805 | S | S | * | * | | | trans | -129.6 | 98.9 | 162.6 | -48.4 | -179.1 | 0 | 0 | 0 | 107.6 | R181 A185 | R181-I183 PolarHBondContact O-N 3.44Å; I183-A185 HydrophobicContact CG2-CB 4.11Å; I183-A185 PolarHBondContact O-N 3.46Å |
| 184 | T | 36.3 | Very low | 33.8 | Very low | 143 Ų | 143 | 134.1 Ų | 134.1 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | | | trans | -63 | 111.2 | 150.2 | -51.7 | 0 | 0 | 0 | 0 | 106.6 | | |
| 185 | A | 29.5 | Very low | 33.7 | Very low | 81 Ų | 81 | 135.5 Ų | 135.5 | 67% | 0.669 | 80% | 0.801 | S | S | * | * | | | trans | -118.9 | 99.4 | 168.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | I183 G187 | I183-A185 HydrophobicContact CG2-CB 4.11Å; I183-A185 PolarHBondContact O-N 3.46Å; A185-G187 PolarHBondContact O-N 3.22Å |
| 186 | A | 37.6 | Very low | 34.5 | Very low | 108 Ų | 108 | 131.9 Ų | 131.9 | 89% | 0.893 | 79% | 0.794 | S | S | * | * | | | trans | -57.3 | 114.2 | 153.3 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 187 | G | 29.6 | Very low | 34.4 | Very low | 71 Ų | 71 | 131.2 Ų | 131.2 | 73% | 0.732 | 80% | 0.795 | S | S | * | * | | | trans | -130.6 | 89.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | A185 G189 | A185-G187 PolarHBondContact O-N 3.22Å; G187-G189 PolarHBondContact O-N 3.06Å |
| 188 | R | 40.5 | Very low | 34.7 | Very low | 242 Ų | 242 | 129 Ų | 129 | 91% | 0.913 | 80% | 0.796 | S | S | * | * | | | trans | -59 | 119.3 | 172 | -166.9 | 178.8 | -165.4 | -131.8 | 2.3 | 109.3 | | |
| 189 | G | 30.5 | Very low | 34.3 | Very low | 74 Ų | 74 | 129 Ų | 129 | 76% | 0.763 | 80% | 0.798 | S | S | * | * | | | trans | -148.4 | 99.9 | 172 | 0 | 0 | 0 | 0 | 0 | 109.9 | G187 | G187-G189 PolarHBondContact O-N 3.06Š|
| 190 | E | 34.2 | Very low | 34.7 | Very low | 165 Ų | 165 | 134.6 Ų | 134.6 | 77% | 0.771 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 152.3 | 176.2 | -77.5 | -79 | 138.2 | 0 | 0 | 113.1 | | |
| 191 | P | 39.1 | Very low | 34.2 | Very low | 116 Ų | 116 | 132.9 Ų | 132.9 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 123.2 | -179.4 | 32 | -30.2 | 0 | 0 | 0 | 111.9 | | |
| 192 | G | 29.5 | Very low | 34 | Very low | 75 Ų | 75 | 125.5 Ų | 125.5 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -92.8 | 131.6 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 193 | P | 40.9 | Very low | 33.8 | Very low | 135 Ų | 135 | 127.6 Ų | 127.6 | 88% | 0.877 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 136.5 | -174.4 | 34.9 | -31.1 | 0 | 0 | 0 | 111.5 | | |
| 194 | G | 30.2 | Very low | 33.5 | Very low | 70 Ų | 70 | 127.1 Ų | 127.1 | 72% | 0.722 | 80% | 0.804 | S | S | * | * | | | trans | 159.3 | 86 | 169.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 195 | H | 30.2 | Very low | 33.7 | Very low | 194 Ų | 194 | 124.3 Ų | 124.3 | 90% | 0.898 | 79% | 0.788 | S | S | * | * | | | trans | 84.5 | 147.9 | 150.9 | -79.9 | -79 | 0 | 0 | 0 | 122.5 | | |
| 196 | P | 45.5 | Very low | 33.8 | Very low | 112 Ų | 112 | 130.6 Ų | 130.6 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | | | trans | -108.7 | 144.7 | -154.4 | 40 | -29.3 | 0 | 0 | 0 | 112.8 | | |
| 197 | A | 27.9 | Very low | 33.6 | Very low | 93 Ų | 93 | 133.7 Ų | 133.7 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | | | trans | -162 | 101.8 | 151.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | | |
| 198 | A | 33.8 | Very low | 33.4 | Very low | 92 Ų | 92 | 141 Ų | 141 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | | | | 54.8 | 92.7 | 105.8 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 199 | S | 32.4 | Very low | 32.9 | Very low | 108 Ų | 108 | 138.4 Ų | 138.4 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | | | trans | -158.2 | 86.8 | 139.8 | -84.5 | 0 | 0 | 0 | 0 | 109.1 | L201 | S199-L201 PolarHBondContact O-N 3.04Å; S199-L201 VanDerWaalsContact O-N 3.13Å |
| 200 | R | 39.5 | Very low | 32.7 | Very low | 258 Ų | 258 | 142.1 Ų | 142.1 | 97% | 0.974 | 79% | 0.788 | S | S | * | * | | | trans | -62.4 | 102.6 | 152.9 | -70.2 | -176.2 | -179.3 | -143.1 | 1.1 | 106.4 | | |
| 201 | L | 30.7 | Very low | 32.6 | Very low | 162 Ų | 162 | 141 Ų | 141 | 85% | 0.848 | 78% | 0.782 | S | S | * | * | | | trans | -96.1 | 122.6 | 156.2 | -109.1 | 94.6 | 0 | 0 | 0 | 108.5 | S199 | S199-L201 PolarHBondContact O-N 3.04Å; S199-L201 VanDerWaalsContact O-N 3.13Å |
| 202 | G | 26.5 | Very low | 32.3 | Very low | 70 Ų | 70 | 142.5 Ų | 142.5 | 72% | 0.722 | 78% | 0.783 | S | S | * | * | | | trans | -60.4 | 139.5 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | | |
| 203 | H | 34 | Very low | 32.2 | Very low | 164 Ų | 164 | 146.7 Ų | 146.7 | 76% | 0.759 | 79% | 0.787 | S | S | * | * | | | | 20.1 | 122 | 128.3 | -135 | 59 | 0 | 0 | 0 | 118.4 | P205 | H203-P205 WeakPolarHBondContact CD2-CD 3.48Å; H203-P205 WeakPolarHBondContact NE2-CD 3.39Å; H203-P205 WeakPolarHBondContact NE2-CG 3.12Å |
| 204 | C | 25.6 | Very low | 31.8 | Very low | 136 Ų | 136 | 148.5 Ų | 148.5 | 92% | 0.919 | 78% | 0.783 | S | S | * | * | | | trans | -150.2 | 100.5 | 140.1 | -102.4 | 0 | 0 | 0 | 0 | 109.8 | | |
| 205 | P | 40.8 | Very low | 31.7 | Very low | 84 Ų | 84 | 152.8 Ų | 152.8 | 55% | 0.545 | 79% | 0.785 | S | S | . | * | | | trans | -93.7 | 116.1 | 160.2 | 33.3 | -24.4 | 0 | 0 | 0 | 108 | H203 | H203-P205 WeakPolarHBondContact CD2-CD 3.48Å; H203-P205 WeakPolarHBondContact NE2-CD 3.39Å; H203-P205 WeakPolarHBondContact NE2-CG 3.12Å |
| 206 | R | 31.1 | Very low | 32.1 | Very low | 213 Ų | 213 | 147.5 Ų | 147.5 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | | | trans | 178.6 | 85.9 | 152 | -100 | 161.8 | -173.7 | -158.4 | 0.9 | 107.4 | W208 | R206-W208 PolarHBondContact O-N 3.07Š|
| 207 | Q | 33.7 | Very low | 31.4 | Very low | 174 Ų | 174 | 147.6 Ų | 147.6 | 81% | 0.813 | 78% | 0.778 | S | S | * | * | | | trans | -76.7 | 115.1 | 169.9 | -69.6 | -176 | 4.7 | 0 | 0 | 108.1 | | |
| 208 | W | 24.1 | Very low | 31.6 | Very low | 224 Ų | 224 | 146.4 Ų | 146.4 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | | | trans | -86.5 | 110.7 | 158.6 | -59.2 | 131.4 | 0 | 0 | 0 | 107.5 | R206 | R206-W208 PolarHBondContact O-N 3.07Š|
| 209 | R | 30.4 | Very low | 32.1 | Very low | 188 Ų | 188 | 151.9 Ų | 151.9 | 71% | 0.709 | 78% | 0.781 | S | S | * | * | | | trans | -93 | 96.9 | -179 | -159.1 | -176.6 | -130.8 | -124.3 | 14.2 | 107.6 | H211 | R209-H211 PolarHBondContact NH1-NE2 3.2Š|
| 210 | L | 26.7 | Very low | 32.1 | Very low | 151 Ų | 151 | 152 Ų | 152 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | | | trans | -90.2 | 102.9 | 172.3 | -164.1 | 72.2 | 0 | 0 | 0 | 108 | L212 | L210-L212 HydrophobicContact CD2-CD1 3.56Å; L210-L212 HydrophobicContact CD2-CG 4.48Å; L210-L212 HydrophobicContact CG-CD1 4.09Å; L210-L212 PolarHBondContact O-N 3.1Å |
| 211 | H | 32.1 | Very low | 32.1 | Very low | 142 Ų | 142 | 145.4 Ų | 145.4 | 66% | 0.657 | 77% | 0.767 | S | S | * | * | | | trans | -78.5 | 101.4 | 169.9 | -66.8 | 108.3 | 0 | 0 | 0 | 108.2 | R209 | R209-H211 PolarHBondContact NH1-NE2 3.2Š|
| 212 | L | 32.4 | Very low | 32.2 | Very low | 148 Ų | 148 | 146.2 Ų | 146.2 | 78% | 0.775 | 76% | 0.764 | S | S | * | * | | | trans | -90.9 | 104.8 | 165.7 | -92.8 | 131.5 | 0 | 0 | 0 | 108.3 | L210 H214 | L210-L212 HydrophobicContact CD2-CD1 3.56Å; L210-L212 HydrophobicContact CD2-CG 4.48Å; L210-L212 HydrophobicContact CG-CD1 4.09Å; L210-L212 PolarHBondContact O-N 3.1Å; L212-H214 PolarHBondContact O-N 3.34Å |
| 213 | L | 27.5 | Very low | 32.8 | Very low | 162 Ų | 162 | 153.8 Ų | 153.8 | 85% | 0.848 | 77% | 0.771 | S | S | * | * | | | trans | -73.8 | 98.5 | 171.5 | -150.8 | 88.2 | 0 | 0 | 0 | 107.9 | Q215 | L213-Q215 PolarHBondContact O-N 2.86Š|
| 214 | H | 31.8 | Very low | 32.9 | Very low | 174 Ų | 174 | 154 Ų | 154 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | | | trans | -84.2 | 91 | 172 | -164 | -107.7 | 0 | 0 | 0 | 108.7 | L212 A216 | L212-H214 PolarHBondContact O-N 3.34Å; H214-A216 PolarHBondContact O-N 2.92Å; H214-A216 VanDerWaalsContact O-N 3.12Å |
| 215 | Q | 28.3 | Very low | 33.4 | Very low | 160 Ų | 160 | 155.5 Ų | 155.5 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | | | trans | -66.4 | 105.6 | 164.7 | -111.4 | -88.5 | 47.8 | 0 | 0 | 107.4 | L213 S217 | L213-Q215 PolarHBondContact O-N 2.86Å; Q215-S217 PolarHBondContact O-N 2.76Å; Q215-S217 VanDerWaalsContact O-N 3.11Å |
| 216 | A | 38.8 | Very low | 33.2 | Very low | 82 Ų | 82 | 154.9 Ų | 154.9 | 68% | 0.678 | 78% | 0.784 | S | S | * | * | | | trans | -65.5 | 106.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | H214 | H214-A216 PolarHBondContact O-N 2.92Å; H214-A216 VanDerWaalsContact O-N 3.12Å |
| 217 | S | 30.2 | Very low | 33.2 | Very low | 115 Ų | 115 | 152.1 Ų | 152.1 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | | | trans | -145.9 | 101.4 | 160.2 | -173.7 | 0 | 0 | 0 | 0 | 110.8 | Q215 | Q215-S217 PolarHBondContact O-N 2.76Å; Q215-S217 VanDerWaalsContact O-N 3.11Å |
| 218 | G | 33.3 | Very low | 33.3 | Very low | 67 Ų | 67 | 149.8 Ų | 149.8 | 69% | 0.691 | 78% | 0.784 | S | S | * | * | | | trans | 75.7 | 100.9 | 142.9 | 0 | 0 | 0 | 0 | 0 | 118.5 | | |
| 219 | K | 43.6 | Very low | 33.8 | Very low | 207 Ų | 207 | 147 Ų | 147 | 90% | 0.9 | 79% | 0.785 | S | S | * | * | | | trans | 46.9 | 100.7 | 139.5 | -83.8 | 140.4 | 165.8 | 169.3 | 0 | 118.3 | | |
| 220 | V | 32.2 | Very low | 34 | Very low | 110 Ų | 110 | 146.1 Ų | 146.1 | 67% | 0.667 | 79% | 0.793 | S | S | * | * | | | trans | -148.1 | 127.7 | 137.6 | -170.3 | 0 | 0 | 0 | 0 | 110 | F222 | V220-F222 HydrophobicContact CB-CD2 4.25Å; V220-F222 HydrophobicContact CB-CE2 4.1Å; V220-F222 HydrophobicContact CG1-CD2 3.81Å; V220-F222 HydrophobicContact CG1-CE2 3.56Å; V220-F222 HydrophobicContact CG1-CZ 4.23Å; V220-F222 PolarHBondContact O-N 3.37Å |
| 221 | P | 40.6 | Very low | 34.4 | Very low | 121 Ų | 121 | 147.1 Ų | 147.1 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | | | trans | -86.7 | 100.1 | 171.2 | 32.9 | -28.1 | 0 | 0 | 0 | 109.9 | R223 | P221-R223 PolarHBondContact O-N 2.88Š|
| 222 | F | 33.1 | Very low | 34.6 | Very low | 179 Ų | 179 | 145.2 Ų | 145.2 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | | | trans | -82.4 | 95.5 | 166.6 | -82.9 | -81.9 | 0 | 0 | 0 | 109.7 | V220 L224 | V220-F222 HydrophobicContact CB-CD2 4.25Å; V220-F222 HydrophobicContact CB-CE2 4.1Å; V220-F222 HydrophobicContact CG1-CD2 3.81Å; V220-F222 HydrophobicContact CG1-CE2 3.56Å; V220-F222 HydrophobicContact CG1-CZ 4.23Å; V220-F222 PolarHBondContact O-N 3.37Å; F222-L224 PolarHBondContact O-N 3.46Å; F222-L224 VanDerWaalsContact O-N 3.15Å |
| 223 | R | 39.2 | Very low | 34.6 | Very low | 228 Ų | 228 | 147.4 Ų | 147.4 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | | | trans | -64.8 | 103.2 | 157 | -77.4 | -161.1 | 174.7 | -163.7 | 0.9 | 108 | P221 L225 | P221-R223 PolarHBondContact O-N 2.88Å; R223-L225 PolarHBondContact O-N 3.25Å |
| 224 | L | 36 | Very low | 35.2 | Very low | 169 Ų | 169 | 148.2 Ų | 148.2 | 89% | 0.885 | 80% | 0.8 | S | S | * | * | | | trans | -65.8 | 96.4 | 162.3 | -94.9 | 117.6 | 0 | 0 | 0 | 108.7 | F222 | F222-L224 PolarHBondContact O-N 3.46Å; F222-L224 VanDerWaalsContact O-N 3.15Å |
| 225 | L | 35.6 | Very low | 35.5 | Very low | 168 Ų | 168 | 151.4 Ų | 151.4 | 88% | 0.88 | 80% | 0.804 | S | S | * | * | | | trans | -83.9 | 114.8 | 166.6 | -148.3 | 82.7 | 0 | 0 | 0 | 108.3 | R223 | R223-L225 PolarHBondContact O-N 3.25Š|
| 226 | G | 35.9 | Very low | 36 | Very low | 71 Ų | 71 | 147.4 Ų | 147.4 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | | | trans | 92.5 | 81.2 | 149.2 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 227 | L | 31.5 | Very low | 35.9 | Very low | 155 Ų | 155 | 149.8 Ų | 149.8 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | | | trans | -109.1 | 136.2 | 140.2 | -76 | 169.1 | 0 | 0 | 0 | 107.3 | L229 | L227-L229 PolarHBondContact O-N 3.45Š|
| 228 | P | 35.1 | Very low | 36.6 | Very low | 125 Ų | 125 | 147.9 Ų | 147.9 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | | | trans | -67.5 | 119.9 | -174.4 | 27.7 | -31.8 | 0 | 0 | 0 | 109.6 | L230 | P228-L230 PolarHBondContact O-N 3.13Š|
| 229 | L | 34.4 | Very low | 36.9 | Very low | 165 Ų | 165 | 152.4 Ų | 152.4 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | | | trans | -59.6 | 109.4 | 168.9 | -83.7 | 160.1 | 0 | 0 | 0 | 108.7 | L227 Q231 | L227-L229 PolarHBondContact O-N 3.45Å; L229-Q231 PolarHBondContact O-N 3.02Å |
| 230 | L | 34.6 | Very low | 36.8 | Very low | 169 Ų | 169 | 151.8 Ų | 151.8 | 89% | 0.885 | 82% | 0.818 | S | S | * | * | | | trans | -60.8 | 104.7 | 161.7 | -160.8 | 75.6 | 0 | 0 | 0 | 107 | P228 P232 | P228-L230 PolarHBondContact O-N 3.13Å; L230-P232 WeakPolarHBondContact O-CD 3.46Å |
| 231 | Q | 37 | Very low | 37.3 | Very low | 173 Ų | 173 | 155.2 Ų | 155.2 | 81% | 0.808 | 83% | 0.827 | S | S | * | * | | | trans | -61.5 | 125.7 | 177 | -76 | -174.9 | -14.6 | 0 | 0 | 110.2 | L229 | L229-Q231 PolarHBondContact O-N 3.02Š|
| 232 | P | 35.7 | Very low | 37.4 | Very low | 102 Ų | 102 | 155.6 Ų | 155.6 | 66% | 0.662 | 83% | 0.829 | S | S | * | * | | | trans | -77.6 | 122.7 | 163.6 | 29 | -27.5 | 0 | 0 | 0 | 109.1 | L230 H234 | L230-P232 WeakPolarHBondContact O-CD 3.46Å; P232-H234 PolarHBondContact O-N 3.46Å |
| 233 | H | 32.9 | Very low | 38 | Very low | 193 Ų | 193 | 151.8 Ų | 151.8 | 89% | 0.894 | 83% | 0.831 | S | S | * | * | | | trans | -55.4 | 109.9 | 167.3 | -79.7 | -88.6 | 0 | 0 | 0 | 110.1 | R235 | H233-R235 PolarHBondContact O-N 3.44Š|
| 234 | H | 38.3 | Very low | 38.3 | Very low | 180 Ų | 180 | 151.3 Ų | 151.3 | 83% | 0.833 | 85% | 0.853 | S | S | * | * | | | trans | -72.1 | 108.5 | 167.9 | -83 | -83.7 | 0 | 0 | 0 | 109.6 | P232 G236 | P232-H234 PolarHBondContact O-N 3.46Å; H234-G236 PolarHBondContact O-N 3.09Å |
| 235 | R | 38.6 | Very low | 38.4 | Very low | 240 Ų | 240 | 150.5 Ų | 150.5 | 91% | 0.906 | 85% | 0.851 | S | S | * | * | | | trans | -73.8 | 115.9 | 162.2 | -159.3 | 176.1 | -172.5 | 168.4 | 1.3 | 107 | H233 V237 | H233-R235 PolarHBondContact O-N 3.44Å; R235-V237 PolarHBondContact O-N 2.75Å |
| 236 | G | 39.3 | Very low | 38.6 | Very low | 76 Ų | 76 | 149.5 Ų | 149.5 | 78% | 0.784 | 85% | 0.85 | S | S | * | * | | | trans | -58.4 | 129.8 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113 | H234 | H234-G236 PolarHBondContact O-N 3.09Š|
| 237 | V | 35.8 | Very low | 38.7 | Very low | 133 Ų | 133 | 153.9 Ų | 153.9 | 81% | 0.806 | 86% | 0.856 | S | S | * | * | | | trans | -119.4 | 107.8 | 158.6 | -178.9 | 0 | 0 | 0 | 0 | 105.2 | R235 | R235-V237 PolarHBondContact O-N 2.75Š|
| 238 | G | 46.1 | Very low | 39.1 | Very low | 74 Ų | 74 | 153.8 Ų | 153.8 | 76% | 0.763 | 86% | 0.859 | S | S | * | * | | | trans | -70.5 | 132.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 239 | L | 38.6 | Very low | 39.4 | Very low | 163 Ų | 163 | 155.6 Ų | 155.6 | 85% | 0.853 | 86% | 0.862 | S | S | * | * | | | trans | -110.9 | 117.8 | 161.1 | -69.4 | 175.6 | 0 | 0 | 0 | 107.6 | | |
| 240 | Q | 43 | Very low | 39.7 | Very low | 193 Ų | 193 | 155 Ų | 155 | 90% | 0.902 | 86% | 0.862 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 134.5 | 170.7 | -85.3 | 179.8 | 13.6 | 0 | 0 | 110.7 | | |
| 241 | Q | 41.3 | Very low | 40.1 | Very low | 183 Ų | 183 | 154 Ų | 154 | 86% | 0.855 | 86% | 0.86 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 137.2 | 161.2 | -69.2 | 179.1 | -12.2 | 0 | 0 | 109.3 | | |
| 242 | P | 44.1 | Very low | 40.3 | Very low | 129 Ų | 129 | 152.5 Ų | 152.5 | 84% | 0.838 | 86% | 0.864 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 123.3 | 159.8 | 29.4 | -26 | 0 | 0 | 0 | 108.9 | | |
| 243 | A | 45.2 | Very low | 40.7 | Very low | 99 Ų | 99 | 156.8 Ų | 156.8 | 82% | 0.818 | 88% | 0.881 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 133 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 244 | V | 45.2 | Very low | 41.4 | Very low | 218 Ų | 218 | 153.5 Ų | 153.5 | 100% | 1.321 | 88% | 0.88 | S | S | * | * | | | trans | -140.5 | 0 | 147.4 | -175.8 | 0 | 0 | 0 | 0 | 107.5 | | |