| 1 | M | 59.5 | Low | 69.8 | Low | 246 Ų | 246 | 157.5 Ų | 157.5 | 100% | 1.212 | 82% | 0.819 | S | S | * | * | | | | 0 | 127.3 | 0 | -66.9 | 179.3 | 95.3 | 0 | 0 | 107.8 | | |
| 2 | Y | 53.7 | Low | 69.7 | Low | 230 Ų | 230 | 151.9 Ų | 151.9 | 90% | 0.902 | 80% | 0.803 | S | S | * | * | | | trans | -87.7 | 131.3 | 177.2 | -107.1 | -97.3 | 0 | 0 | 0 | 109.9 | C4 | Y2-C4 PolarHBondContact O-N 3.21Š|
| 3 | A | 67.8 | Low | 70 | Confident | 94 Ų | 94 | 149.5 Ų | 149.5 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | | | trans | -82 | 113.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | S5 | A3-S5 PolarHBondContact O-N 2.99Š|
| 4 | C | 68.7 | Low | 70.6 | Confident | 123 Ų | 123 | 148.6 Ų | 148.6 | 83% | 0.831 | 78% | 0.784 | S | S | * | * | | | trans | -78.2 | 110.6 | 174.9 | -63.6 | 0 | 0 | 0 | 0 | 110.1 | Y2 | Y2-C4 PolarHBondContact O-N 3.21Š|
| 5 | S | 73.8 | Confident | 71 | Confident | 118 Ų | 118 | 153.5 Ų | 153.5 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | | | trans | -71.2 | 131.4 | 168.1 | -46.9 | 0 | 0 | 0 | 0 | 109.5 | A3 | A3-S5 PolarHBondContact O-N 2.99Š|
| 6 | K | 77.3 | Confident | 71.3 | Confident | 188 Ų | 188 | 150.8 Ų | 150.8 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | | | trans | -65.3 | 136.1 | 176.7 | -67.1 | -74.6 | -176 | 175.7 | 0 | 109.6 | V8 | K6-V8 HydrophobicContact CB-CG2 4.27Å; K6-V8 PolarHBondContact O-N 3Å |
| 7 | F | 73.8 | Confident | 71.6 | Confident | 210 Ų | 210 | 147.6 Ų | 147.6 | 92% | 0.921 | 78% | 0.775 | S | S | * | * | | | trans | -68.8 | 103.2 | 171.8 | -175.2 | -101.5 | 0 | 0 | 0 | 108.7 | | |
| 8 | V | 71.2 | Confident | 71.9 | Confident | 75 Ų | 75 | 146.1 Ų | 146.1 | 46% | 0.455 | 78% | 0.779 | S | S | . | * | | | trans | -108 | 120.1 | -178.1 | 176.6 | 0 | 0 | 0 | 0 | 108.4 | K6 T10 L13 | K6-V8 HydrophobicContact CB-CG2 4.27Å; K6-V8 PolarHBondContact O-N 3Å; V8-T10 PolarHBondContact O-N 3.47Å; V8-T10 VanDerWaalsContact O-N 3.15Å; V8-L13 HydrophobicContact CB-CD1 4.34Å; V8-L13 HydrophobicContact CG1-CD1 3.7Å; V8-L13 HydrophobicContact CG1-CD2 3.72Å; V8-L13 HydrophobicContact CG1-CG 4.06Å |
| 9 | S | 71.5 | Confident | 72.1 | Confident | 91 Ų | 91 | 146.8 Ų | 146.8 | 64% | 0.636 | 78% | 0.782 | S | S | * | * | | | trans | -59.2 | 117.3 | 171.9 | -175.6 | 0 | 0 | 0 | 0 | 108.6 | R11 | S9-R11 PolarHBondContact O-N 3.17Š|
| 10 | T | 72.3 | Confident | 72.4 | Confident | 120 Ų | 120 | 147.4 Ų | 147.4 | 74% | 0.736 | 77% | 0.772 | S | S | * | * | G | 310 helix | trans | -69.8 | 10.2 | -170.8 | 51.3 | 0 | 0 | 0 | 0 | 114 | V8 S12 | V8-T10 PolarHBondContact O-N 3.47Å; V8-T10 VanDerWaalsContact O-N 3.15Å; T10-S12 PolarHBondContact O-N 3.04Å |
| 11 | R | 78.3 | Confident | 72.5 | Confident | 238 Ų | 238 | 143.2 Ų | 143.2 | 90% | 0.898 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -59.5 | -23.5 | -168.2 | -157 | 173.6 | -154.1 | -119.9 | 1.8 | 113.8 | S9 | S9-R11 PolarHBondContact O-N 3.17Š|
| 12 | S | 68.7 | Low | 73 | Confident | 90 Ų | 90 | 136.3 Ų | 136.3 | 63% | 0.629 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -166.8 | 94.6 | 158.6 | -153.9 | 0 | 0 | 0 | 0 | 111 | T10 | T10-S12 PolarHBondContact O-N 3.04Š|
| 13 | L | 73.9 | Confident | 73.6 | Confident | 120 Ų | 120 | 128.4 Ų | 128.4 | 63% | 0.628 | 71% | 0.706 | S | S | * | * | | | trans | -106.3 | 63.9 | 169.6 | -66 | 179.1 | 0 | 0 | 0 | 110.1 | V8 R15 | V8-L13 HydrophobicContact CB-CD1 4.34Å; V8-L13 HydrophobicContact CG1-CD1 3.7Å; V8-L13 HydrophobicContact CG1-CD2 3.72Å; V8-L13 HydrophobicContact CG1-CG 4.06Å; L13-R15 PolarHBondContact O-N 2.97Å |
| 14 | I | 77.7 | Confident | 73.5 | Confident | 138 Ų | 138 | 129 Ų | 129 | 71% | 0.708 | 69% | 0.693 | S | S | * | * | | | trans | -83.6 | 95.1 | 170 | -55.9 | 175.9 | 0 | 0 | 0 | 106.9 | S16 | I14-S16 PolarHBondContact O-N 3.42Š|
| 15 | R | 76.8 | Confident | 73.4 | Confident | 222 Ų | 222 | 128.1 Ų | 128.1 | 84% | 0.838 | 68% | 0.679 | S | S | * | * | | | trans | -78.8 | 97.9 | 170.4 | -174.9 | -180 | 179.2 | -171.3 | -0.1 | 108.1 | L13 T17 | L13-R15 PolarHBondContact O-N 2.97Å; R15-T17 PolarHBondContact O-N 3.32Å |
| 16 | S | 75.4 | Confident | 73.1 | Confident | 110 Ų | 110 | 129.8 Ų | 129.8 | 77% | 0.769 | 68% | 0.678 | S | S | * | * | | | trans | -63.8 | 103.2 | 171.2 | -59.9 | 0 | 0 | 0 | 0 | 109.6 | I14 | I14-S16 PolarHBondContact O-N 3.42Š|
| 17 | T | 76.9 | Confident | 72.4 | Confident | 97 Ų | 97 | 125.2 Ų | 125.2 | 60% | 0.595 | 67% | 0.67 | S | S | * | * | | | trans | -85.4 | 114.2 | 163.4 | 53.5 | 0 | 0 | 0 | 0 | 106.9 | R15 L19 | R15-T17 PolarHBondContact O-N 3.32Å; T17-L19 PolarHBondContact O-N 3.33Å |
| 18 | S | 76.9 | Confident | 72.2 | Confident | 120 Ų | 120 | 123.6 Ų | 123.6 | 84% | 0.839 | 66% | 0.657 | S | S | * | * | | | trans | -64.7 | 105.3 | 175.7 | 50.3 | 0 | 0 | 0 | 0 | 109.3 | R20 | S18-R20 PolarHBondContact O-N 2.86Š|
| 19 | L | 75.5 | Confident | 71.7 | Confident | 159 Ų | 159 | 125.7 Ų | 125.7 | 83% | 0.832 | 67% | 0.673 | S | S | * | * | | | trans | -74.5 | 113.9 | 164.3 | -65.5 | 178.7 | 0 | 0 | 0 | 106.6 | T17 S21 | T17-L19 PolarHBondContact O-N 3.33Å; L19-S21 PolarHBondContact O-N 3.31Å; L19-S21 VanDerWaalsContact O-N 3.12Å |
| 20 | R | 78 | Confident | 71.3 | Confident | 159 Ų | 159 | 130 Ų | 130 | 60% | 0.6 | 69% | 0.688 | S | S | * | * | | | trans | -61.6 | 116.5 | 178.2 | -166.7 | 172.6 | -141.2 | 169.5 | 9.5 | 108.4 | S18 T22 Q24 | S18-R20 PolarHBondContact O-N 2.86Å; R20-T22 PolarHBondContact O-N 2.81Å; R20-Q24 HydrophobicContact CG-CB 4.48Å; R20-Q24 VanDerWaalsContact CG-OE1 3.25Å |
| 21 | S | 74.4 | Confident | 70.4 | Confident | 60 Ų | 60 | 133.1 Ų | 133.1 | 42% | 0.42 | 71% | 0.714 | S | S | . | * | | | trans | -57.1 | 129.5 | 179.2 | -175.1 | 0 | 0 | 0 | 0 | 109.9 | L19 S23 Q24 | L19-S21 PolarHBondContact O-N 3.31Å; L19-S21 VanDerWaalsContact O-N 3.12Å; S21-S23 PolarHBondContact O-N 2.97Å; S21-S23 PolarHBondContact OG-OG 2.75Å; S21-S23 VanDerWaalsContact O-N 3.17Å; S21-Q24 VanDerWaalsContact O-CB 3.28Å; S21-Q24 WeakPolarHBondContact O-CB 3.39Å; S21-Q24 PolarHBondContact O-N 3.2Å |
| 22 | T | 70.8 | Confident | 70 | Confident | 100 Ų | 100 | 127.9 Ų | 127.9 | 61% | 0.613 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.6 | -24.7 | 179.5 | 51.5 | 0 | 0 | 0 | 0 | 112.4 | R20 Q24 L25 L26 | R20-T22 PolarHBondContact O-N 2.81Å; T22-Q24 PolarHBondContact O-N 3.12Å; T22-L25 WeakPolarHBondContact O-CB 3.2Å; T22-L25 PolarHBondContact O-N 3.32Å; T22-L26 PolarHBondContact O-N 2.96Å |
| 23 | S | 66.6 | Low | 70.1 | Confident | 65 Ų | 65 | 129.9 Ų | 129.9 | 46% | 0.455 | 71% | 0.709 | S | S | . | * | H | α-helix | trans | -56.7 | -36.4 | 169.1 | 58.1 | 0 | 0 | 0 | 0 | 112 | S21 L25 L26 S27 | S21-S23 PolarHBondContact O-N 2.97Å; S21-S23 PolarHBondContact OG-OG 2.75Å; S21-S23 VanDerWaalsContact O-N 3.17Å; S23-L25 VanDerWaalsContact C-N 3.25Å; S23-L25 PolarHBondContact O-N 3.2Å; S23-L26 PolarHBondContact O-N 3.48Å; S23-S27 WeakPolarHBondContact O-CB 3.35Å; S23-S27 PolarHBondContact O-N 3.35Å; S23-S27 PolarHBondContact O-OG 3.07Å |
| 24 | Q | 64.4 | Low | 69.9 | Low | 107 Ų | 107 | 130.4 Ų | 130.4 | 50% | 0.5 | 71% | 0.714 | S | S | . | * | H | α-helix | trans | -69.1 | -22.1 | 175.1 | -62.5 | -174.7 | -22.5 | 0 | 0 | 113.5 | R20 S21 T22 | R20-Q24 HydrophobicContact CG-CB 4.48Å; R20-Q24 VanDerWaalsContact CG-OE1 3.25Å; S21-Q24 VanDerWaalsContact O-CB 3.28Å; S21-Q24 WeakPolarHBondContact O-CB 3.39Å; S21-Q24 PolarHBondContact O-N 3.2Å; T22-Q24 PolarHBondContact O-N 3.12Å |
| 25 | L | 66.6 | Low | 69.4 | Low | 103 Ų | 103 | 130 Ų | 130 | 54% | 0.539 | 71% | 0.714 | S | S | . | * | H | α-helix | trans | -81.8 | -42.5 | 176.2 | -63.4 | 174.6 | 0 | 0 | 0 | 110.8 | T22 S23 S27 R28 | T22-L25 WeakPolarHBondContact O-CB 3.2Å; T22-L25 PolarHBondContact O-N 3.32Å; S23-L25 VanDerWaalsContact C-N 3.25Å; S23-L25 PolarHBondContact O-N 3.2Å; L25-S27 VanDerWaalsContact C-N 3.33Å; L25-R28 PolarHBondContact O-N 3.01Å |
| 26 | L | 67.5 | Low | 69 | Low | 153 Ų | 153 | 124.3 Ų | 124.3 | 80% | 0.801 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -75.5 | -21 | -180 | -65.3 | 171.8 | 0 | 0 | 0 | 113.2 | T22 S23 R28 | T22-L26 PolarHBondContact O-N 2.96Å; S23-L26 PolarHBondContact O-N 3.48Å; L26-R28 VanDerWaalsContact C-N 3.33Å |
| 27 | S | 64.3 | Low | 68.6 | Low | 93 Ų | 93 | 125.2 Ų | 125.2 | 65% | 0.65 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | 5.5 | 175.6 | -53.9 | 0 | 0 | 0 | 0 | 114.3 | S23 L25 P29 | S23-S27 WeakPolarHBondContact O-CB 3.35Å; S23-S27 PolarHBondContact O-N 3.35Å; S23-S27 PolarHBondContact O-OG 3.07Å; L25-S27 VanDerWaalsContact C-N 3.33Å; S27-P29 WeakPolarHBondContact O-CD 3.28Å |
| 28 | R | 68.1 | Low | 68 | Low | 176 Ų | 176 | 127.2 Ų | 127.2 | 66% | 0.664 | 71% | 0.71 | S | S | * | * | | | trans | -80.3 | 113.6 | 174 | -69.9 | -150.7 | 135 | 169.8 | -5.3 | 109.6 | L25 L26 L30 | L25-R28 PolarHBondContact O-N 3.01Å; L26-R28 VanDerWaalsContact C-N 3.33Å; R28-L30 PolarHBondContact O-N 3.15Å |
| 29 | P | 61.3 | Low | 67.3 | Low | 119 Ų | 119 | 127.8 Ų | 127.8 | 77% | 0.773 | 70% | 0.7 | S | S | * | * | | | trans | -60.2 | 124.9 | 167.9 | 26 | -31.5 | 0 | 0 | 0 | 107.6 | S27 S31 | S27-P29 WeakPolarHBondContact O-CD 3.28Å; P29-S31 VanDerWaalsContact C-N 3.3Å; P29-S31 PolarHBondContact O-N 2.89Å |
| 30 | L | 63.7 | Low | 66.6 | Low | 182 Ų | 182 | 125.2 Ų | 125.2 | 95% | 0.953 | 69% | 0.688 | S | S | * | * | | | trans | -66.7 | 95.4 | 166 | -77.2 | 155.8 | 0 | 0 | 0 | 106.3 | R28 | R28-L30 PolarHBondContact O-N 3.15Š|
| 31 | S | 53.5 | Low | 65.6 | Low | 185 Ų | 185 | 122.1 Ų | 122.1 | 100% | 1.294 | 70% | 0.697 | S | S | * | * | | | trans | -73.5 | 0 | 161.5 | 69.8 | 0 | 0 | 0 | 0 | 109.6 | P29 | P29-S31 VanDerWaalsContact C-N 3.3Å; P29-S31 PolarHBondContact O-N 2.89Å |