| 1 | M | 54.5 | Low | 68.5 | Low | 237 Ų | 237 | 143.8 Ų | 143.8 | 100% | 1.167 | 70% | 0.696 | S | S | * | * | | | | 0 | 75.9 | 0 | -173.7 | 163.9 | 109.2 | 0 | 0 | 109.2 | | |
| 2 | L | 65.5 | Low | 68.1 | Low | 164 Ų | 164 | 136.4 Ų | 136.4 | 86% | 0.859 | 69% | 0.685 | S | S | * | * | | | trans | -141.3 | 46.3 | 174.4 | -68.8 | 175 | 0 | 0 | 0 | 108.9 | I4 | L2-I4 PolarHBondContact O-N 3.45Š|
| 3 | R | 72.8 | Confident | 67.7 | Low | 246 Ų | 246 | 136.4 Ų | 136.4 | 93% | 0.928 | 69% | 0.687 | S | S | * | * | | | trans | -95.2 | 79.7 | 170.2 | -66.9 | -178.9 | -177.6 | 170 | 0.2 | 106.5 | P5 | R3-P5 VanDerWaalsContact O-CD 3.23Å; R3-P5 WeakPolarHBondContact O-CD 3.23Å |
| 4 | I | 74.3 | Confident | 67.5 | Low | 122 Ų | 122 | 133.4 Ų | 133.4 | 63% | 0.626 | 69% | 0.685 | S | S | * | * | | | trans | -70 | 115.9 | 173.7 | -59.7 | 167 | 0 | 0 | 0 | 105.7 | L2 I6 | L2-I4 PolarHBondContact O-N 3.45Å; I4-I6 PolarHBondContact O-N 3.25Å |
| 5 | P | 71.2 | Confident | 67.1 | Low | 76 Ų | 76 | 132.5 Ų | 132.5 | 49% | 0.494 | 68% | 0.682 | S | S | . | * | | | trans | -63.5 | 128.2 | 175.9 | 22.7 | -26.7 | 0 | 0 | 0 | 107.8 | R3 K7 R8 | R3-P5 VanDerWaalsContact O-CD 3.23Å; R3-P5 WeakPolarHBondContact O-CD 3.23Å; P5-K7 PolarHBondContact O-N 3.07Å; P5-R8 HydrophobicContact CG-CB 4.07Å; P5-R8 WeakPolarHBondContact O-CA 3.48Å; P5-R8 WeakPolarHBondContact O-CB 3.42Å; P5-R8 PolarHBondContact O-N 3.03Å |
| 6 | I | 72.6 | Confident | 66.8 | Low | 132 Ų | 132 | 129.7 Ų | 129.7 | 68% | 0.677 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -52.5 | -32.5 | -178.8 | -62.7 | 167.1 | 0 | 0 | 0 | 110.7 | I4 R8 A9 L10 | I4-I6 PolarHBondContact O-N 3.25Å; I6-R8 PolarHBondContact O-N 2.9Å; I6-A9 PolarHBondContact O-N 3.37Å; I6-L10 HydrophobicContact CG2-CG 4.02Å; I6-L10 PolarHBondContact O-N 2.77Å; I6-L10 WeakPolarHBondContact O-CG 3.35Å; I6-L10 HydrophobicContact CG2-CD1 3.83Å |
| 7 | K | 69.7 | Low | 66.5 | Low | 161 Ų | 161 | 128.9 Ų | 128.9 | 70% | 0.7 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -50.2 | -42.7 | 171.3 | -162.6 | -178 | -173.8 | -171.1 | 0 | 112.7 | P5 L10 I11 | P5-K7 PolarHBondContact O-N 3.07Å; K7-L10 PolarHBondContact O-N 3.16Å; K7-I11 HydrophobicContact CG-CD1 4.03Å; K7-I11 VanDerWaalsContact O-CD1 3.27Å; K7-I11 WeakPolarHBondContact O-CD1 3.14Å; K7-I11 WeakPolarHBondContact O-CG1 3.27Å; K7-I11 PolarHBondContact O-N 3.38Å |
| 8 | R | 66.8 | Low | 66.6 | Low | 196 Ų | 196 | 133.3 Ų | 133.3 | 74% | 0.74 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -72.7 | -31.5 | -179.5 | -153 | 177.5 | -170.3 | 176.2 | 2.1 | 112.5 | P5 I6 | P5-R8 HydrophobicContact CG-CB 4.07Å; P5-R8 WeakPolarHBondContact O-CA 3.48Å; P5-R8 WeakPolarHBondContact O-CB 3.42Å; P5-R8 PolarHBondContact O-N 3.03Å; I6-R8 PolarHBondContact O-N 2.9Å |
| 9 | A | 67.4 | Low | 65.9 | Low | 59 Ų | 59 | 133.8 Ų | 133.8 | 49% | 0.488 | 74% | 0.736 | S | S | . | * | H | α-helix | trans | -72 | -41 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | I6 G12 L13 | I6-A9 PolarHBondContact O-N 3.37Å; A9-G12 PolarHBondContact O-N 3.47Å; A9-L13 VanDerWaalsContact O-N 3.16Å; A9-L13 PolarHBondContact O-N 3.32Å |
| 10 | L | 69.6 | Low | 65.9 | Low | 100 Ų | 100 | 133.8 Ų | 133.8 | 52% | 0.524 | 74% | 0.736 | S | S | . | * | H | α-helix | trans | -68.4 | -36.9 | 178.8 | -69.4 | 174.6 | 0 | 0 | 0 | 112.9 | I6 K7 G12 L13 S14 | I6-L10 HydrophobicContact CG2-CG 4.02Å; I6-L10 PolarHBondContact O-N 2.77Å; I6-L10 WeakPolarHBondContact O-CG 3.35Å; I6-L10 HydrophobicContact CG2-CD1 3.83Å; K7-L10 PolarHBondContact O-N 3.16Å; L10-G12 VanDerWaalsContact C-N 3.26Å; L10-G12 PolarHBondContact O-N 3.24Å; L10-L13 PolarHBondContact O-N 2.91Å; L10-L13 VanDerWaalsContact O-N 3.1Å; L10-S14 PolarHBondContact O-N 3.1Å; L10-S14 PolarHBondContact O-OG 2.8Å |
| 11 | I | 68.9 | Low | 65.9 | Low | 89 Ų | 89 | 133.8 Ų | 133.8 | 46% | 0.456 | 74% | 0.736 | S | S | . | * | H | α-helix | trans | -61.4 | -35.6 | 175.4 | -70 | 159.8 | 0 | 0 | 0 | 111.2 | K7 S14 N15 | K7-I11 HydrophobicContact CG-CD1 4.03Å; K7-I11 VanDerWaalsContact O-CD1 3.27Å; K7-I11 WeakPolarHBondContact O-CD1 3.14Å; K7-I11 WeakPolarHBondContact O-CG1 3.27Å; K7-I11 PolarHBondContact O-N 3.38Å; I11-S14 PolarHBondContact O-OG 3.03Å; I11-N15 PolarHBondContact O-ND2 3.23Å |
| 12 | G | 64.2 | Low | 66.6 | Low | 55 Ų | 55 | 128.1 Ų | 128.1 | 57% | 0.567 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -71.7 | -34.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113 | A9 L10 | A9-G12 PolarHBondContact O-N 3.47Å; L10-G12 VanDerWaalsContact C-N 3.26Å; L10-G12 PolarHBondContact O-N 3.24Å |
| 13 | L | 62.9 | Low | 66.6 | Low | 136 Ų | 136 | 125.9 Ų | 125.9 | 71% | 0.712 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -73 | -38.5 | 179.8 | -147.2 | 86.1 | 0 | 0 | 0 | 112.6 | A9 L10 N15 S16 | A9-L13 VanDerWaalsContact O-N 3.16Å; A9-L13 PolarHBondContact O-N 3.32Å; L10-L13 PolarHBondContact O-N 2.91Å; L10-L13 VanDerWaalsContact O-N 3.1Å; L13-N15 VanDerWaalsContact C-N 3.25Å; L13-N15 PolarHBondContact O-N 3.36Å; L13-S16 WeakPolarHBondContact O-CB 3.23Å; L13-S16 PolarHBondContact O-N 3.36Å |
| 14 | S | 64.4 | Low | 66.2 | Low | 94 Ų | 94 | 118.4 Ų | 118.4 | 66% | 0.657 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -11.4 | -179.3 | 67.3 | 0 | 0 | 0 | 0 | 114.2 | L10 I11 | L10-S14 PolarHBondContact O-N 3.1Å; L10-S14 PolarHBondContact O-OG 2.8Å; I11-S14 PolarHBondContact O-OG 3.03Å |
| 15 | N | 62 | Low | 65.7 | Low | 120 Ų | 120 | 118.2 Ų | 118.2 | 64% | 0.642 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | 9.2 | 172.5 | -77.5 | -69.7 | 0 | 0 | 0 | 112.6 | I11 L13 P17 | I11-N15 PolarHBondContact O-ND2 3.23Å; L13-N15 VanDerWaalsContact C-N 3.25Å; L13-N15 PolarHBondContact O-N 3.36Å; N15-P17 VanDerWaalsContact O-CD 3.23Å; N15-P17 WeakPolarHBondContact O-CD 3.48Å; N15-P17 VanDerWaalsContact O-N 3.15Å |
| 16 | S | 62.7 | Low | 65.3 | Low | 88 Ų | 88 | 121.2 Ų | 121.2 | 62% | 0.615 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -65.5 | 112.6 | 163.5 | -159.5 | 0 | 0 | 0 | 0 | 106.7 | L13 K18 | L13-S16 WeakPolarHBondContact O-CB 3.23Å; L13-S16 PolarHBondContact O-N 3.36Å; S16-K18 PolarHBondContact O-N 2.87Å |
| 17 | P | 61.6 | Low | 64.8 | Low | 117 Ų | 117 | 120.4 Ų | 120.4 | 76% | 0.76 | 71% | 0.71 | S | S | * | * | | | trans | -60.7 | 115.9 | 178 | 26.8 | -30.5 | 0 | 0 | 0 | 105.4 | N15 G19 | N15-P17 VanDerWaalsContact O-CD 3.23Å; N15-P17 WeakPolarHBondContact O-CD 3.48Å; N15-P17 VanDerWaalsContact O-N 3.15Å; P17-G19 VanDerWaalsContact C-N 3.32Å; P17-G19 PolarHBondContact O-N 2.95Å |
| 18 | K | 67.6 | Low | 64.4 | Low | 207 Ų | 207 | 117 Ų | 117 | 90% | 0.9 | 71% | 0.711 | S | S | * | * | | | trans | -56.3 | 105.3 | 169 | -130.6 | 174.8 | 177.2 | 179.4 | 0 | 105.2 | S16 | S16-K18 PolarHBondContact O-N 2.87Š|
| 19 | G | 54.2 | Low | 64.1 | Low | 143 Ų | 143 | 109.8 Ų | 109.8 | 100% | 1.474 | 71% | 0.709 | S | S | * | * | | | trans | -56 | 0 | 154.3 | 0 | 0 | 0 | 0 | 0 | 109 | P17 | P17-G19 VanDerWaalsContact C-N 3.32Å; P17-G19 PolarHBondContact O-N 2.95Å |