| 1 | M | 36.6 | Very low | 47.8 | Very low | 247 Ų | 247 | 114.3 Ų | 114.3 | 100% | 1.217 | 69% | 0.692 | S | S | * | * | | | | 0 | 113 | 0 | -80 | 167 | 177.6 | 0 | 0 | 107.7 | | |
| 2 | G | 37.5 | Very low | 48.6 | Very low | 75 Ų | 75 | 108.6 Ų | 108.6 | 77% | 0.773 | 66% | 0.658 | S | S | * | * | | | trans | -71.4 | 136.7 | -174.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | E4 | G2-E4 PolarHBondContact O-N 3.46Š|
| 3 | A | 48.2 | Very low | 49.4 | Very low | 74 Ų | 74 | 107.2 Ų | 107.2 | 61% | 0.612 | 65% | 0.652 | S | S | * | * | | | trans | -65 | 102.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | S5 | A3-S5 PolarHBondContact O-N 3.41Å; A3-S5 VanDerWaalsContact O-N 3.12Å |
| 4 | E | 42 | Very low | 50.4 | Low | 188 Ų | 188 | 112 Ų | 112 | 88% | 0.879 | 65% | 0.653 | S | S | * | * | | | trans | -63.4 | 111.1 | 164.9 | -72.2 | -174.9 | 153.4 | 0 | 0 | 108.2 | G2 | G2-E4 PolarHBondContact O-N 3.46Š|
| 5 | S | 49.4 | Very low | 51.3 | Low | 72 Ų | 72 | 110.3 Ų | 110.3 | 50% | 0.503 | 64% | 0.638 | S | S | . | * | | | trans | -97.8 | 106.6 | 173.1 | -60.3 | 0 | 0 | 0 | 0 | 108 | A3 | A3-S5 PolarHBondContact O-N 3.41Å; A3-S5 VanDerWaalsContact O-N 3.12Å |
| 6 | S | 50.6 | Low | 52.2 | Low | 89 Ų | 89 | 114.4 Ų | 114.4 | 62% | 0.622 | 64% | 0.639 | S | S | * | * | | | trans | -84.8 | 125 | 170.5 | 54.8 | 0 | 0 | 0 | 0 | 109.6 | | |
| 7 | V | 50.1 | Low | 53 | Low | 58 Ų | 58 | 110.3 Ų | 110.3 | 35% | 0.352 | 62% | 0.615 | S | S | . | * | | | trans | -106.2 | 108.8 | 173.9 | -178.4 | 0 | 0 | 0 | 0 | 107.7 | F9 F32 F34 | V7-F9 HydrophobicContact CG1-CD2 4.48Å; V7-F9 HydrophobicContact CG1-CZ 4.2Å; V7-F9 HydrophobicContact CG1-CE2 4.13Å; V7-F32 HydrophobicContact CG1-CD1 3.55Å; V7-F32 HydrophobicContact CG1-CE1 4.17Å; V7-F34 HydrophobicContact CG2-CD1 4.25Å; V7-F34 HydrophobicContact CG2-CE1 3.59Å; V7-F34 HydrophobicContact CG2-CZ 4.35Å |
| 8 | Q | 51 | Low | 53.8 | Low | 145 Ų | 145 | 110.3 Ų | 110.3 | 68% | 0.678 | 63% | 0.632 | S | S | * | * | | | trans | -89.7 | 117.8 | 170 | -72.5 | -178.7 | -24.2 | 0 | 0 | 109.1 | A10 | Q8-A10 PolarHBondContact O-N 3.29Š|
| 9 | F | 52 | Low | 54.3 | Low | 148 Ų | 148 | 114.5 Ų | 114.5 | 65% | 0.649 | 64% | 0.642 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -80.4 | 110.4 | 170.2 | -64.1 | -92 | 0 | 0 | 0 | 108.4 | V7 F32 | V7-F9 HydrophobicContact CG1-CD2 4.48Å; V7-F9 HydrophobicContact CG1-CZ 4.2Å; V7-F9 HydrophobicContact CG1-CE2 4.13Å; F9-F32 HydrophobicContact CZ-CE1 4.49Å; F9-F32 HydrophobicContact CE1-CE1 3.72Å; F9-F32 AromaticContact CE1-CE1 3.72Å; F9-F32 HydrophobicContact CD1-CE1 4.06Å |
| 10 | A | 54.5 | Low | 54.6 | Low | 56 Ų | 56 | 111 Ų | 111 | 46% | 0.463 | 63% | 0.626 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -80.5 | 126.5 | 160.5 | 0 | 0 | 0 | 0 | 0 | 108 | Q8 V12 | Q8-A10 PolarHBondContact O-N 3.29Å; A10-V12 PolarHBondContact O-N 3.39Å |
| 11 | A | 54.2 | Low | 54.9 | Low | 105 Ų | 105 | 118.4 Ų | 118.4 | 87% | 0.868 | 64% | 0.644 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -65.2 | 105.4 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | | |
| 12 | V | 57 | Low | 56.1 | Low | 46 Ų | 46 | 111.9 Ų | 111.9 | 28% | 0.279 | 61% | 0.61 | S | S | . | * | P | Polyproline II helix | trans | -92.7 | 131 | 174 | -166.2 | 0 | 0 | 0 | 0 | 107.9 | A10 M15 F29 A31 | A10-V12 PolarHBondContact O-N 3.39Å; V12-M15 HydrophobicContact CG1-CE 4.24Å; V12-F29 HydrophobicContact CB-CB 3.98Å; V12-F29 WeakPolarHBondContact CB-O 3.44Å; V12-F29 HydrophobicContact CG1-CB 3.76Å; V12-F29 HydrophobicContact CG2-CB 4.42Å; V12-A31 HydrophobicContact CG2-CB 4.46Å |
| 13 | P | 59.1 | Low | 57.2 | Low | 90 Ų | 90 | 120 Ų | 120 | 58% | 0.584 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 146.6 | 176.4 | 20.2 | -30.6 | 0 | 0 | 0 | 111 | M15 | P13-M15 PolarHBondContact O-N 3.24Š|
| 14 | R | 63.9 | Low | 58 | Low | 175 Ų | 175 | 119.3 Ų | 119.3 | 66% | 0.66 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 121.7 | 170.5 | -63.9 | 178.3 | 69 | 94.9 | -1.2 | 107.5 | V26 S28 | R14-V26 HydrophobicContact CB-CG1 4.34Å; R14-S28 VanDerWaalsContact NH1-OG 3.16Å; R14-S28 PolarHBondContact NH1-OG 3.21Å |
| 15 | M | 64.2 | Low | 59.1 | Low | 87 Ų | 87 | 117.8 Ų | 117.8 | 43% | 0.429 | 59% | 0.594 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -117.4 | 150.1 | -178.6 | -66.1 | -174.8 | -68.3 | 0 | 0 | 111.1 | V12 P13 A27 F29 | V12-M15 HydrophobicContact CG1-CE 4.24Å; P13-M15 PolarHBondContact O-N 3.24Å; M15-A27 PolarHBondContact N-O 2.68Å; M15-A27 VanDerWaalsContact N-O 3.08Å; M15-A27 PolarHBondContact O-N 3.05Å; M15-F29 HydrophobicContact CB-CD2 4.15Å; M15-F29 HydrophobicContact CB-CE2 3.8Å; M15-F29 HydrophobicContact CE-CD2 3.62Å; M15-F29 HydrophobicContact CE-CE2 3.89Å; M15-F29 HydrophobicContact CE-CG 4.05Å; M15-F29 HydrophobicContact CE-CZ 4.49Å |
| 16 | R | 65 | Low | 59.9 | Low | 175 Ų | 175 | 117.6 Ų | 117.6 | 66% | 0.66 | 59% | 0.59 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -76.7 | 132.2 | 171.5 | -163.8 | 178.8 | 174.6 | -174.1 | -4.6 | 108.8 | A18 R25 | R16-A18 PolarHBondContact O-N 3.44Å; R16-R25 VanDerWaalsContact CA-O 3.26Å; R16-R25 WeakPolarHBondContact CG-O 3.16Å; R16-R25 HydrophobicContact CG-CB 4.35Å; R16-R25 WeakPolarHBondContact CA-O 3.26Å; R16-R25 CarbonylContact C-O 3.51Å |
| 17 | L | 65.5 | Low | 60.5 | Low | 45 Ų | 45 | 113.8 Ų | 113.8 | 24% | 0.236 | 56% | 0.564 | C | S | . | * | | | trans | -65.9 | 127.7 | 177 | -65.9 | 176.3 | 0 | 0 | 0 | 109.7 | K19 R25 A27 F29 | L17-K19 VanDerWaalsContact C-N 3.27Å; L17-K19 PolarHBondContact O-N 2.86Å; L17-R25 PolarHBondContact N-O 2.98Å; L17-A27 HydrophobicContact CD1-CB 4.39Å; L17-A27 HydrophobicContact CD2-CB 3.74Å; L17-A27 HydrophobicContact CG-CB 4.04Å; L17-F29 HydrophobicContact CD2-CZ 3.81Å |
| 18 | A | 66.9 | Low | 61.2 | Low | 110 Ų | 110 | 113.7 Ų | 113.7 | 91% | 0.909 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -64 | -34.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | R16 | R16-A18 PolarHBondContact O-N 3.44Š|
| 19 | K | 63.8 | Low | 61.8 | Low | 191 Ų | 191 | 110.6 Ų | 110.6 | 83% | 0.83 | 55% | 0.55 | S | S | * | * | S | Bend | trans | -140.1 | 121.6 | 167.3 | -68.5 | -175.2 | 179.8 | 179.7 | 0 | 107.5 | L17 | L17-K19 VanDerWaalsContact C-N 3.27Å; L17-K19 PolarHBondContact O-N 2.86Å |
| 20 | S | 59.9 | Low | 62.5 | Low | 44 Ų | 44 | 109.8 Ų | 109.8 | 31% | 0.308 | 55% | 0.547 | S | S | . | . | | | trans | -112.4 | 122.3 | 174.2 | 62.2 | 0 | 0 | 0 | 0 | 109.3 | H22 | S20-H22 PolarHBondContact OG-O 2.98Å; S20-H22 PolarHBondContact O-N 3.42Å |
| 21 | W | 61.5 | Low | 62.7 | Low | 267 Ų | 267 | 109.5 Ų | 109.5 | 100% | 1.011 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -79.3 | 4.7 | 161.9 | -75.5 | 52.4 | 0 | 0 | 0 | 111.5 | | |
| 22 | H | 62 | Low | 63.1 | Low | 110 Ų | 110 | 108.2 Ų | 108.2 | 51% | 0.509 | 52% | 0.519 | S | S | . | . | S | Bend | trans | -121.3 | 155.5 | -173.1 | -160.8 | 51.7 | 0 | 0 | 0 | 112 | S20 S24 Q55 | S20-H22 PolarHBondContact OG-O 2.98Å; S20-H22 PolarHBondContact O-N 3.42Å; H22-S24 PolarHBondContact O-N 3.08Å; H22-Q55 PolarHBondContact CD2-OE1 3.4Å |
| 23 | R | 60 | Low | 63.1 | Low | 244 Ų | 244 | 111.9 Ų | 111.9 | 92% | 0.921 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -61.2 | -32.6 | -178.8 | -71.6 | -173 | 177.5 | -176.3 | -0.2 | 112.2 | R25 | R23-R25 PolarHBondContact O-N 3.16Š|
| 24 | S | 64.9 | Low | 63.1 | Low | 61 Ų | 61 | 110.6 Ų | 110.6 | 43% | 0.427 | 52% | 0.523 | S | S | . | . | | | trans | -81.5 | 110.4 | 178.1 | -61.8 | 0 | 0 | 0 | 0 | 110.9 | H22 V26 | H22-S24 PolarHBondContact O-N 3.08Å; S24-V26 PolarHBondContact O-N 3.24Å |
| 25 | R | 64.9 | Low | 62.6 | Low | 155 Ų | 155 | 113.4 Ų | 113.4 | 59% | 0.585 | 53% | 0.534 | S | S | * | . | | | trans | -78.6 | -5.5 | 175.6 | -65.1 | -177.2 | 176.7 | 175 | -2.1 | 113.5 | R16 L17 R23 | R16-R25 VanDerWaalsContact CA-O 3.26Å; R16-R25 WeakPolarHBondContact CG-O 3.16Å; R16-R25 HydrophobicContact CG-CB 4.35Å; R16-R25 WeakPolarHBondContact CA-O 3.26Å; R16-R25 CarbonylContact C-O 3.51Å; L17-R25 PolarHBondContact N-O 2.98Å; R23-R25 PolarHBondContact O-N 3.16Å |
| 26 | V | 66.2 | Low | 62.2 | Low | 69 Ų | 69 | 111.8 Ų | 111.8 | 42% | 0.418 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 131.1 | -177 | -179.4 | 0 | 0 | 0 | 0 | 109.2 | R14 S24 | R14-V26 HydrophobicContact CB-CG1 4.34Å; S24-V26 PolarHBondContact O-N 3.24Å |
| 27 | A | 64.7 | Low | 61.4 | Low | 8 Ų | 8 | 108.2 Ų | 108.2 | 7% | 0.066 | 54% | 0.537 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.9 | 142.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111 | M15 L17 F29 | M15-A27 PolarHBondContact N-O 2.68Å; M15-A27 VanDerWaalsContact N-O 3.08Å; M15-A27 PolarHBondContact O-N 3.05Å; L17-A27 HydrophobicContact CD1-CB 4.39Å; L17-A27 HydrophobicContact CD2-CB 3.74Å; L17-A27 HydrophobicContact CG-CB 4.04Å; A27-F29 HydrophobicContact CB-CD2 4.46Å; A27-F29 HydrophobicContact CB-CE2 3.82Å; A27-F29 HydrophobicContact CB-CZ 4.06Å |
| 28 | S | 64.6 | Low | 60.9 | Low | 56 Ų | 56 | 108.7 Ų | 108.7 | 39% | 0.392 | 55% | 0.552 | S | S | . | * | | | trans | -86.8 | 129.3 | 163.3 | -74.1 | 0 | 0 | 0 | 0 | 108.2 | R14 | R14-S28 VanDerWaalsContact NH1-OG 3.16Å; R14-S28 PolarHBondContact NH1-OG 3.21Å |
| 29 | F | 63.8 | Low | 60 | Low | 80 Ų | 80 | 115.3 Ų | 115.3 | 35% | 0.351 | 55% | 0.554 | S | S | . | * | | | trans | -102.5 | 147.4 | 176.4 | -66.5 | -92.7 | 0 | 0 | 0 | 109.2 | V12 M15 L17 A27 | V12-F29 HydrophobicContact CB-CB 3.98Å; V12-F29 WeakPolarHBondContact CB-O 3.44Å; V12-F29 HydrophobicContact CG1-CB 3.76Å; V12-F29 HydrophobicContact CG2-CB 4.42Å; M15-F29 HydrophobicContact CB-CD2 4.15Å; M15-F29 HydrophobicContact CB-CE2 3.8Å; M15-F29 HydrophobicContact CE-CD2 3.62Å; M15-F29 HydrophobicContact CE-CE2 3.89Å; M15-F29 HydrophobicContact CE-CG 4.05Å; M15-F29 HydrophobicContact CE-CZ 4.49Å; L17-F29 HydrophobicContact CD2-CZ 3.81Å; A27-F29 HydrophobicContact CB-CD2 4.46Å; A27-F29 HydrophobicContact CB-CE2 3.82Å; A27-F29 HydrophobicContact CB-CZ 4.06Å |
| 30 | F | 65 | Low | 59.2 | Low | 132 Ų | 132 | 108.4 Ų | 108.4 | 58% | 0.579 | 54% | 0.536 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -134.4 | 126.4 | 171.8 | -62.3 | -85.4 | 0 | 0 | 0 | 107.1 | F32 | F30-F32 HydrophobicContact CB-CE1 4.4Å; F30-F32 HydrophobicContact CB-CE2 3.84Å; F30-F32 HydrophobicContact CB-CZ 3.7Å |
| 31 | A | 58.9 | Low | 58.5 | Low | 50 Ų | 50 | 111 Ų | 111 | 41% | 0.413 | 55% | 0.551 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.4 | 131.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | V12 | V12-A31 HydrophobicContact CG2-CB 4.46Å |
| 32 | F | 63.8 | Low | 57.9 | Low | 77 Ų | 77 | 103.1 Ų | 103.1 | 34% | 0.338 | 53% | 0.527 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 121.8 | 178.2 | -53.4 | -80.1 | 0 | 0 | 0 | 108.5 | V7 F9 F30 F34 | V7-F32 HydrophobicContact CG1-CD1 3.55Å; V7-F32 HydrophobicContact CG1-CE1 4.17Å; F9-F32 HydrophobicContact CZ-CE1 4.49Å; F9-F32 HydrophobicContact CE1-CE1 3.72Å; F9-F32 AromaticContact CE1-CE1 3.72Å; F9-F32 HydrophobicContact CD1-CE1 4.06Å; F30-F32 HydrophobicContact CB-CE1 4.4Å; F30-F32 HydrophobicContact CB-CE2 3.84Å; F30-F32 HydrophobicContact CB-CZ 3.7Å; F32-F34 HydrophobicContact CB-CD2 3.96Å; F32-F34 HydrophobicContact CG-CZ 4.22Å; F32-F34 HydrophobicContact CG-CE2 4.09Å; F32-F34 HydrophobicContact CB-CZ 3.76Å; F32-F34 HydrophobicContact CB-CE2 3.31Å |
| 33 | N | 56.4 | Low | 57.3 | Low | 124 Ų | 124 | 101.3 Ų | 101.3 | 66% | 0.663 | 52% | 0.524 | S | S | * | . | | | trans | -95.8 | 107.8 | 169.5 | -70.9 | -44.7 | 0 | 0 | 0 | 108.2 | | |
| 34 | F | 58.6 | Low | 56.8 | Low | 63 Ų | 63 | 94.3 Ų | 94.3 | 28% | 0.276 | 51% | 0.509 | S | S | . | . | | | trans | -98.2 | 122.3 | 172 | -62.1 | -82.1 | 0 | 0 | 0 | 109 | V7 F32 T36 V43 | V7-F34 HydrophobicContact CG2-CD1 4.25Å; V7-F34 HydrophobicContact CG2-CE1 3.59Å; V7-F34 HydrophobicContact CG2-CZ 4.35Å; F32-F34 HydrophobicContact CB-CD2 3.96Å; F32-F34 HydrophobicContact CG-CZ 4.22Å; F32-F34 HydrophobicContact CG-CE2 4.09Å; F32-F34 HydrophobicContact CB-CZ 3.76Å; F32-F34 HydrophobicContact CB-CE2 3.31Å; F34-T36 HydrophobicContact CB-CG2 4.43Å; F34-V43 HydrophobicContact CZ-CG2 3.89Å; F34-V43 HydrophobicContact CZ-CG1 3.97Å; F34-V43 HydrophobicContact CZ-CB 3.65Å; F34-V43 HydrophobicContact CG-CG2 4.32Å; F34-V43 HydrophobicContact CE2-CG2 4.37Å; F34-V43 HydrophobicContact CE1-CG2 3.58Å; F34-V43 HydrophobicContact CE1-CG1 4.14Å; F34-V43 HydrophobicContact CE1-CB 3.87Å; F34-V43 HydrophobicContact CD1-CG2 3.81Å; F34-V43 HydrophobicContact CD1-CB 4.49Å; F34-V43 HydrophobicContact CE2-CB 4.09Å |
| 35 | R | 54.1 | Low | 56.2 | Low | 234 Ų | 234 | 99.3 Ų | 99.3 | 88% | 0.883 | 53% | 0.525 | S | S | * | . | | | trans | -97.1 | 102.1 | 160.2 | -79.5 | -173.3 | -178.3 | -166.5 | 1 | 107.8 | | |
| 36 | T | 54.6 | Low | 55.4 | Low | 52 Ų | 52 | 102.7 Ų | 102.7 | 32% | 0.319 | 54% | 0.538 | S | S | . | . | | | trans | -95.6 | 119.5 | 173.4 | 57.8 | 0 | 0 | 0 | 0 | 109.4 | F34 G38 | F34-T36 HydrophobicContact CB-CG2 4.43Å; T36-G38 PolarHBondContact O-N 2.76Å |
| 37 | A | 48.2 | Very low | 54.6 | Low | 101 Ų | 101 | 108.4 Ų | 108.4 | 84% | 0.835 | 56% | 0.56 | S | S | * | * | S | Bend | trans | -75 | 79.1 | 163.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |
| 38 | G | 56.2 | Low | 54.1 | Low | 54 Ų | 54 | 112.2 Ų | 112.2 | 56% | 0.557 | 58% | 0.579 | S | S | * | * | S | Bend | trans | 159.7 | 169 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | T36 G40 | T36-G38 PolarHBondContact O-N 2.76Å; G38-G40 VanDerWaalsContact C-N 3.34Å; G38-G40 PolarHBondContact O-N 2.95Å |
| 39 | R | 47.8 | Very low | 53.3 | Low | 250 Ų | 250 | 119.8 Ų | 119.8 | 94% | 0.943 | 60% | 0.599 | S | S | * | * | S | Bend | trans | -63.3 | 92.9 | 174.9 | -87.6 | -174.6 | 172.5 | -179.5 | -2.1 | 109.9 | | |
| 40 | G | 46.7 | Very low | 52.3 | Low | 45 Ų | 45 | 122.7 Ų | 122.7 | 46% | 0.464 | 63% | 0.626 | S | S | . | * | | | trans | 39.5 | 81.5 | 152.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | G38 L42 | G38-G40 VanDerWaalsContact C-N 3.34Å; G38-G40 PolarHBondContact O-N 2.95Å; G40-L42 PolarHBondContact O-N 3.02Å |
| 41 | T | 45.9 | Very low | 51.7 | Low | 100 Ų | 100 | 120.6 Ų | 120.6 | 61% | 0.613 | 64% | 0.641 | S | S | * | * | | | trans | -94.6 | 97.1 | 165.2 | -11.1 | 0 | 0 | 0 | 0 | 108.2 | V43 | T41-V43 PolarHBondContact O-N 3.48Š|
| 42 | L | 48.2 | Very low | 51.3 | Low | 100 Ų | 100 | 120.9 Ų | 120.9 | 52% | 0.524 | 64% | 0.643 | S | S | . | * | | | trans | -44 | 106.3 | 153 | -81.8 | 133.4 | 0 | 0 | 0 | 107.3 | G40 T44 Y57 A59 | G40-L42 PolarHBondContact O-N 3.02Å; L42-T44 HydrophobicContact CB-CG2 4.2Å; L42-T44 PolarHBondContact O-N 3.42Å; L42-Y57 WeakPolarHBondContact CD2-OH 3.44Å; L42-Y57 HydrophobicContact CD2-CE1 3.51Å; L42-A59 HydrophobicContact CD2-CB 3.9Å |
| 43 | V | 49.7 | Very low | 50.8 | Low | 73 Ų | 73 | 122 Ų | 122 | 44% | 0.442 | 66% | 0.66 | S | S | . | * | | | trans | -72.3 | 81.5 | 169.6 | 179.9 | 0 | 0 | 0 | 0 | 106.5 | F34 T41 Q45 | F34-V43 HydrophobicContact CZ-CG2 3.89Å; F34-V43 HydrophobicContact CZ-CG1 3.97Å; F34-V43 HydrophobicContact CZ-CB 3.65Å; F34-V43 HydrophobicContact CG-CG2 4.32Å; F34-V43 HydrophobicContact CE2-CG2 4.37Å; F34-V43 HydrophobicContact CE1-CG2 3.58Å; F34-V43 HydrophobicContact CE1-CG1 4.14Å; F34-V43 HydrophobicContact CE1-CB 3.87Å; F34-V43 HydrophobicContact CD1-CG2 3.81Å; F34-V43 HydrophobicContact CD1-CB 4.49Å; F34-V43 HydrophobicContact CE2-CB 4.09Å; T41-V43 PolarHBondContact O-N 3.48Å; V43-Q45 PolarHBondContact O-N 2.99Å |
| 44 | T | 49 | Very low | 50.9 | Low | 97 Ų | 97 | 119.5 Ų | 119.5 | 60% | 0.595 | 65% | 0.65 | S | S | * | * | | | trans | -62.7 | 106.7 | 173.6 | 41.9 | 0 | 0 | 0 | 0 | 108.9 | L42 R46 | L42-T44 HydrophobicContact CB-CG2 4.2Å; L42-T44 PolarHBondContact O-N 3.42Å; T44-R46 WeakPolarHBondContact O-CB 3.33Å; T44-R46 PolarHBondContact O-N 2.82Å |
| 45 | Q | 52.1 | Low | 50.9 | Low | 166 Ų | 166 | 121 Ų | 121 | 78% | 0.776 | 66% | 0.657 | S | S | * | * | S | Bend | trans | 53.9 | -4 | 130.5 | -136.9 | 174.4 | -38.9 | 0 | 0 | 120.7 | V43 | V43-Q45 PolarHBondContact O-N 2.99Š|
| 46 | R | 48.1 | Very low | 51 | Low | 226 Ų | 226 | 115.9 Ų | 115.9 | 85% | 0.853 | 65% | 0.653 | S | S | * | * | | | trans | -99 | -1.1 | -159 | -141.8 | 175.3 | -178.1 | -179.5 | -0.1 | 116.2 | T44 | T44-R46 WeakPolarHBondContact O-CB 3.33Å; T44-R46 PolarHBondContact O-N 2.82Å |
| 47 | H | 50.6 | Low | 51.3 | Low | 188 Ų | 188 | 118.6 Ų | 118.6 | 87% | 0.87 | 66% | 0.658 | S | S | * | * | | | trans | -133.6 | 37.7 | -177.2 | -81.1 | 117.7 | 0 | 0 | 0 | 114.5 | | |
| 48 | L | 53.1 | Low | 51.9 | Low | 89 Ų | 89 | 120.5 Ų | 120.5 | 47% | 0.466 | 65% | 0.653 | S | S | . | * | P | Polyproline II helix | trans | -93.6 | 132.4 | 167 | -68.4 | 172.6 | 0 | 0 | 0 | 109.1 | A52 V54 | L48-A52 HydrophobicContact CB-CB 4.07Å; L48-V54 HydrophobicContact CD1-CB 4.35Å; L48-V54 HydrophobicContact CD1-CG2 3.06Å |
| 49 | R | 48.3 | Very low | 52 | Low | 215 Ų | 215 | 120.2 Ų | 120.2 | 81% | 0.811 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 144.9 | -177.5 | -67.2 | -177.8 | 178.6 | -166.5 | -0.9 | 110.2 | G51 A52 | R49-G51 PolarHBondContact O-N 3Å; R49-A52 PolarHBondContact O-N 3.12Å |
| 50 | P | 42.1 | Very low | 52.1 | Low | 141 Ų | 141 | 118.8 Ų | 118.8 | 92% | 0.916 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.6 | 121 | 168 | -23 | 32 | 0 | 0 | 0 | 109.3 | | |
| 51 | G | 52.3 | Low | 52.2 | Low | 88 Ų | 88 | 125.2 Ų | 125.2 | 91% | 0.907 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.6 | -11.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | R49 | R49-G51 PolarHBondContact O-N 3Š|
| 52 | A | 51.7 | Low | 52.6 | Low | 55 Ų | 55 | 131.1 Ų | 131.1 | 46% | 0.455 | 68% | 0.683 | S | S | . | * | | | trans | -96 | 104.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L48 R49 | L48-A52 HydrophobicContact CB-CB 4.07Å; R49-A52 PolarHBondContact O-N 3.12Å |
| 53 | S | 53.2 | Low | 52.8 | Low | 100 Ų | 100 | 132.7 Ų | 132.7 | 70% | 0.699 | 69% | 0.691 | S | S | * | * | | | trans | -88.7 | 116.9 | 173 | 60.8 | 0 | 0 | 0 | 0 | 111.1 | | |
| 54 | V | 58.5 | Low | 53 | Low | 72 Ų | 72 | 135.8 Ų | 135.8 | 44% | 0.436 | 70% | 0.704 | S | S | . | * | | | trans | -81.3 | 119.2 | 166.1 | 172.5 | 0 | 0 | 0 | 0 | 108.5 | L48 T56 | L48-V54 HydrophobicContact CD1-CB 4.35Å; L48-V54 HydrophobicContact CD1-CG2 3.06Å; V54-T56 WeakPolarHBondContact CG1-O 3.43Å |
| 55 | Q | 58.9 | Low | 53.2 | Low | 94 Ų | 94 | 138 Ų | 138 | 44% | 0.439 | 71% | 0.71 | S | S | . | * | | | trans | -83.9 | -31 | -179.6 | -69.1 | 176.9 | 80.9 | 0 | 0 | 112.1 | H22 | H22-Q55 PolarHBondContact CD2-OE1 3.4Š|
| 56 | T | 56.6 | Low | 53.2 | Low | 128 Ų | 128 | 136.4 Ų | 136.4 | 79% | 0.785 | 71% | 0.706 | S | S | * | * | | | trans | -157.5 | 145.6 | 179.5 | -51.4 | 0 | 0 | 0 | 0 | 109.9 | V54 | V54-T56 WeakPolarHBondContact CG1-O 3.43Š|
| 57 | Y | 59.8 | Low | 53.6 | Low | 109 Ų | 109 | 130.8 Ų | 130.8 | 43% | 0.427 | 70% | 0.697 | S | S | . | * | | | trans | -129.9 | 138.5 | 175.4 | 161.4 | -95.5 | 0 | 0 | 0 | 109.4 | L42 A59 | L42-Y57 WeakPolarHBondContact CD2-OH 3.44Å; L42-Y57 HydrophobicContact CD2-CE1 3.51Å; Y57-A59 HydrophobicContact CE1-CB 3.59Å; Y57-A59 HydrophobicContact CE2-CB 4.38Å; Y57-A59 WeakPolarHBondContact OH-CB 2.94Å |
| 58 | L | 61.5 | Low | 53.8 | Low | 141 Ų | 141 | 126.9 Ų | 126.9 | 74% | 0.738 | 69% | 0.686 | S | S | * | * | | | trans | -128.1 | 109.3 | 173.3 | -176.8 | 70.7 | 0 | 0 | 0 | 108.6 | | |
| 59 | A | 57.4 | Low | 53.8 | Low | 47 Ų | 47 | 129.6 Ų | 129.6 | 39% | 0.388 | 70% | 0.701 | S | S | . | * | | | trans | -89.5 | 136.4 | 164.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | L42 Y57 | L42-A59 HydrophobicContact CD2-CB 3.9Å; Y57-A59 HydrophobicContact CE1-CB 3.59Å; Y57-A59 HydrophobicContact CE2-CB 4.38Å; Y57-A59 WeakPolarHBondContact OH-CB 2.94Å |
| 60 | R | 51 | Low | 54.2 | Low | 221 Ų | 221 | 123.1 Ų | 123.1 | 83% | 0.834 | 69% | 0.693 | S | S | * | * | | | trans | -112.7 | 133.7 | 156.7 | -73.4 | -167.3 | 174.8 | -153.6 | -0.1 | 108.7 | | |
| 61 | K | 49.1 | Very low | 55.2 | Low | 180 Ų | 180 | 121.6 Ų | 121.6 | 78% | 0.783 | 67% | 0.674 | S | S | * | * | | | trans | -89.9 | 121.7 | 169.2 | -176 | 179.8 | 176.5 | -171.2 | 0 | 106.9 | | |
| 62 | N | 52.8 | Low | 55.5 | Low | 224 Ų | 224 | 124.6 Ų | 124.6 | 100% | 1.198 | 65% | 0.653 | S | S | * | * | | | trans | -78.8 | 0 | 161.8 | -75.3 | -20.7 | 0 | 0 | 0 | 109.5 | | |