| 1 | X | 50.3 | Low | 69.6 | Low | 110 Ų | 110 | 141.7 Ų | 141.7 | 100% | 1.134 | 71% | 0.714 | S | S | * | * | | | | 0 | 114.9 | 0 | 0 | 0 | 0 | 0 | 0 | 110.6 | R3 | G1-R3 PolarHBondContact O-N 2.84Š|
| 2 | Y | 66.9 | Low | 70.4 | Confident | 231 Ų | 231 | 135.3 Ų | 135.3 | 91% | 0.906 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | 14.7 | -169.6 | -60.8 | -91.8 | 0 | 0 | 0 | 116.9 | | |
| 3 | R | 67.2 | Low | 70.8 | Confident | 233 Ų | 233 | 132.2 Ų | 132.2 | 88% | 0.879 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -79.4 | -28.7 | -177.8 | -88.2 | -178.5 | 136.9 | -148 | -2.6 | 114.3 | X1 N5 | G1-R3 PolarHBondContact O-N 2.84Å; R3-N5 VanDerWaalsContact C-N 3.34Å; R3-N5 PolarHBondContact O-N 2.95Å |
| 4 | V | 66 | Low | 71.2 | Confident | 111 Ų | 111 | 127.9 Ų | 127.9 | 67% | 0.673 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -67.7 | -36.4 | -175.5 | -177.1 | 0 | 0 | 0 | 0 | 111.5 | | |
| 5 | N | 72.3 | Confident | 71.7 | Confident | 112 Ų | 112 | 133.6 Ų | 133.6 | 60% | 0.599 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -72.4 | -36 | -174.3 | -139.5 | -9.7 | 0 | 0 | 0 | 112.4 | R3 K7 L8 T9 | R3-N5 VanDerWaalsContact C-N 3.34Å; R3-N5 PolarHBondContact O-N 2.95Å; N5-K7 VanDerWaalsContact C-N 3.32Å; N5-K7 PolarHBondContact O-N 2.94Å; N5-L8 PolarHBondContact O-N 3.17Å; N5-L8 VanDerWaalsContact O-N 3.17Å; N5-T9 PolarHBondContact O-N 3.46Å; N5-T9 PolarHBondContact O-OG1 3.09Å |
| 6 | R | 70.8 | Confident | 71.7 | Confident | 207 Ų | 207 | 128.4 Ų | 128.4 | 78% | 0.781 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -64.4 | -32.9 | -177.8 | -168.5 | 174.2 | -83 | -129.7 | 0.1 | 113.1 | F10 | R6-F10 WeakPolarHBondContact O-CB 3.42Å; R6-F10 PolarHBondContact O-N 3.01Å |
| 7 | K | 75.5 | Confident | 71.7 | Confident | 179 Ų | 179 | 128.1 Ų | 128.1 | 78% | 0.778 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69.4 | -40 | 175.5 | -170.6 | 176.8 | -178.4 | -175.7 | 0 | 111.8 | N5 G11 | N5-K7 VanDerWaalsContact C-N 3.32Å; N5-K7 PolarHBondContact O-N 2.94Å; K7-G11 PolarHBondContact O-N 3.06Å |
| 8 | L | 73.2 | Confident | 71.9 | Confident | 116 Ų | 116 | 129.9 Ų | 129.9 | 61% | 0.607 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -67.2 | -42.3 | 176.5 | -64.7 | 172.8 | 0 | 0 | 0 | 111.2 | N5 A12 | N5-L8 PolarHBondContact O-N 3.17Å; N5-L8 VanDerWaalsContact O-N 3.17Å; L8-A12 PolarHBondContact O-N 3.3Å; L8-A12 VanDerWaalsContact O-N 3.11Å; L8-A12 WeakPolarHBondContact O-CB 3.49Å |
| 9 | T | 71.8 | Confident | 71.6 | Confident | 71 Ų | 71 | 133.2 Ų | 133.2 | 44% | 0.436 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -63.4 | -44.1 | 175.9 | -49.8 | 0 | 0 | 0 | 0 | 112.4 | N5 A12 N13 | N5-T9 PolarHBondContact O-N 3.46Å; N5-T9 PolarHBondContact O-OG1 3.09Å; T9-A12 PolarHBondContact O-N 3.11Å; T9-N13 PolarHBondContact O-N 3.1Å; T9-N13 VanDerWaalsContact O-N 3.1Å; T9-N13 PolarHBondContact O-ND2 3.11Å; T9-N13 VanDerWaalsContact O-ND2 3.09Å |
| 10 | F | 74.7 | Confident | 71.1 | Confident | 150 Ų | 150 | 137.2 Ų | 137.2 | 66% | 0.658 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -62.8 | -45 | 179.1 | -169.1 | -99.5 | 0 | 0 | 0 | 111.8 | R6 A12 N13 T14 | R6-F10 WeakPolarHBondContact O-CB 3.42Å; R6-F10 PolarHBondContact O-N 3.01Å; F10-A12 PolarHBondContact O-N 3.46Å; F10-N13 PolarHBondContact O-N 3.44Å; F10-T14 VanDerWaalsContact O-OG1 3.11Å; F10-T14 VanDerWaalsContact O-N 3.11Å; F10-T14 PolarHBondContact O-N 3.18Å; F10-T14 PolarHBondContact O-OG1 3.11Å |
| 11 | G | 76.4 | Confident | 71.1 | Confident | 39 Ų | 39 | 137.2 Ų | 137.2 | 40% | 0.402 | 70% | 0.702 | S | S | . | * | H | α-helix | trans | -63.3 | -37.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | K7 R15 | K7-G11 PolarHBondContact O-N 3.06Å; G11-R15 VanDerWaalsContact O-CB 3.32Å; G11-R15 WeakPolarHBondContact O-CB 3.31Å; G11-R15 PolarHBondContact O-N 3.5Å; G11-R15 VanDerWaalsContact O-N 3.11Å |
| 12 | A | 79.5 | Confident | 72.2 | Confident | 65 Ų | 65 | 138.6 Ų | 138.6 | 54% | 0.537 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -68.5 | -43.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L8 T9 F10 R15 G16 | L8-A12 PolarHBondContact O-N 3.3Å; L8-A12 VanDerWaalsContact O-N 3.11Å; L8-A12 WeakPolarHBondContact O-CB 3.49Å; T9-A12 PolarHBondContact O-N 3.11Å; F10-A12 PolarHBondContact O-N 3.46Å; A12-R15 PolarHBondContact O-N 3.48Å; A12-G16 PolarHBondContact O-N 3.46Å |
| 13 | N | 76.1 | Confident | 72.5 | Confident | 95 Ų | 95 | 133.5 Ų | 133.5 | 51% | 0.508 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -65.4 | -42.2 | 178.7 | -69.4 | -35.2 | 0 | 0 | 0 | 111.6 | T9 F10 I17 | T9-N13 PolarHBondContact O-N 3.1Å; T9-N13 VanDerWaalsContact O-N 3.1Å; T9-N13 PolarHBondContact O-ND2 3.11Å; T9-N13 VanDerWaalsContact O-ND2 3.09Å; F10-N13 PolarHBondContact O-N 3.44Å; N13-I17 PolarHBondContact O-N 3.39Å; N13-I17 WeakPolarHBondContact O-CG1 3.36Å; N13-I17 WeakPolarHBondContact O-CD1 3.19Å; N13-I17 WeakPolarHBondContact O-CB 3.45Å |
| 14 | T | 76.4 | Confident | 72.8 | Confident | 72 Ų | 72 | 127.6 Ų | 127.6 | 44% | 0.442 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -66.4 | -42.1 | 177.3 | -56.8 | 0 | 0 | 0 | 0 | 112.2 | F10 G16 I17 M18 | F10-T14 VanDerWaalsContact O-OG1 3.11Å; F10-T14 VanDerWaalsContact O-N 3.11Å; F10-T14 PolarHBondContact O-N 3.18Å; F10-T14 PolarHBondContact O-OG1 3.11Å; T14-G16 VanDerWaalsContact C-N 3.33Å; T14-G16 PolarHBondContact O-N 3.05Å; T14-I17 PolarHBondContact O-N 3.11Å; T14-M18 VanDerWaalsContact O-CB 3.31Å; T14-M18 WeakPolarHBondContact O-CB 3.32Å; T14-M18 PolarHBondContact O-N 3.33Å |
| 15 | R | 77.8 | Confident | 73.3 | Confident | 213 Ų | 213 | 128.7 Ų | 128.7 | 80% | 0.804 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -70.3 | -29.9 | -178.3 | -161.3 | -178.7 | -78.1 | -169.6 | -4 | 112.4 | G11 A12 | G11-R15 VanDerWaalsContact O-CB 3.32Å; G11-R15 WeakPolarHBondContact O-CB 3.31Å; G11-R15 PolarHBondContact O-N 3.5Å; G11-R15 VanDerWaalsContact O-N 3.11Å; A12-R15 PolarHBondContact O-N 3.48Å |
| 16 | G | 71.7 | Confident | 73.3 | Confident | 50 Ų | 50 | 129.8 Ų | 129.8 | 52% | 0.515 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -76.2 | -40.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | A12 T14 K19 | A12-G16 PolarHBondContact O-N 3.46Å; T14-G16 VanDerWaalsContact C-N 3.33Å; T14-G16 PolarHBondContact O-N 3.05Å; G16-K19 PolarHBondContact O-N 3.45Å |
| 17 | I | 71.8 | Confident | 73.5 | Confident | 123 Ų | 123 | 124.3 Ų | 124.3 | 63% | 0.631 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -72.2 | -35.3 | 179.3 | -65.6 | 165.5 | 0 | 0 | 0 | 111.6 | N13 T14 K19 L20 | N13-I17 PolarHBondContact O-N 3.39Å; N13-I17 WeakPolarHBondContact O-CG1 3.36Å; N13-I17 WeakPolarHBondContact O-CD1 3.19Å; N13-I17 WeakPolarHBondContact O-CB 3.45Å; T14-I17 PolarHBondContact O-N 3.11Å; I17-K19 PolarHBondContact O-N 3.13Å; I17-K19 VanDerWaalsContact O-N 3.13Å; I17-L20 PolarHBondContact O-N 3.06Å |
| 18 | M | 75.1 | Confident | 73.4 | Confident | 162 Ų | 162 | 120.1 Ų | 120.1 | 80% | 0.798 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -8.9 | 178.7 | -170.7 | 176.1 | -179.7 | 0 | 0 | 113.9 | T14 | T14-M18 VanDerWaalsContact O-CB 3.31Å; T14-M18 WeakPolarHBondContact O-CB 3.32Å; T14-M18 PolarHBondContact O-N 3.33Å |
| 19 | K | 67.2 | Low | 73.4 | Confident | 191 Ų | 191 | 120.4 Ų | 120.4 | 83% | 0.83 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | 5.4 | -180 | -154.2 | 174.3 | -179.9 | -178.8 | 0 | 113.5 | G16 I17 | G16-K19 PolarHBondContact O-N 3.45Å; I17-K19 PolarHBondContact O-N 3.13Å; I17-K19 VanDerWaalsContact O-N 3.13Å |
| 20 | L | 61.9 | Low | 73.5 | Confident | 214 Ų | 214 | 124.9 Ų | 124.9 | 100% | 1.12 | 66% | 0.659 | S | S | * | * | | | trans | -98.5 | 0 | 164.5 | -78.2 | 154 | 0 | 0 | 0 | 109 | I17 | I17-L20 PolarHBondContact O-N 3.06Š|