| 1 | M | 40.7 | Very low | 39 | Very low | 244 Ų | 244 | 164.5 Ų | 164.5 | 100% | 1.202 | 84% | 0.844 | S | S | * | * | | | | 0 | 98.6 | 0 | -74 | 177.5 | 165.5 | 0 | 0 | 108 | | |
| 2 | A | 40.3 | Very low | 39.4 | Very low | 95 Ų | 95 | 159.9 Ų | 159.9 | 79% | 0.785 | 83% | 0.834 | S | S | * | * | | | trans | -87.8 | 132.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 3 | K | 38.3 | Very low | 40 | Very low | 196 Ų | 196 | 157.5 Ų | 157.5 | 85% | 0.852 | 83% | 0.834 | S | S | * | * | | | trans | -72.1 | 125.9 | -172.4 | -61.8 | 173 | 179.3 | 178.7 | 0 | 109.3 | E5 | K3-E5 PolarHBondContact O-N 2.96Š|
| 4 | Y | 36.2 | Very low | 40.5 | Very low | 231 Ų | 231 | 151.1 Ų | 151.1 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | | | trans | -73.7 | 104.2 | 167 | -79.5 | -97.3 | 0 | 0 | 0 | 107.8 | A6 | Y4-A6 PolarHBondContact O-N 3.3Š|
| 5 | E | 36.2 | Very low | 40.8 | Very low | 185 Ų | 185 | 154.7 Ų | 154.7 | 86% | 0.864 | 83% | 0.829 | S | S | * | * | | | trans | -68.8 | 115.3 | 167.7 | -71.8 | -111.6 | 132.1 | 0 | 0 | 107.8 | K3 E7 | K3-E5 PolarHBondContact O-N 2.96Å; E5-E7 PolarHBondContact O-N 2.75Å |
| 6 | A | 40.5 | Very low | 41.2 | Very low | 93 Ų | 93 | 150.9 Ų | 150.9 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | | | trans | -63 | 107.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | Y4 S8 | Y4-A6 PolarHBondContact O-N 3.3Å; A6-S8 PolarHBondContact O-N 3.47Å |
| 7 | E | 31.7 | Very low | 41.4 | Very low | 165 Ų | 165 | 144.2 Ų | 144.2 | 77% | 0.771 | 79% | 0.793 | S | S | * | * | | | trans | -54.6 | 104.6 | 174.1 | -160.6 | -176.8 | 175.1 | 0 | 0 | 108.2 | E5 | E5-E7 PolarHBondContact O-N 2.75Š|
| 8 | S | 39.8 | Very low | 41.6 | Very low | 103 Ų | 103 | 140.8 Ų | 140.8 | 72% | 0.72 | 77% | 0.772 | S | S | * | * | | | trans | -61.5 | 126.7 | -179.9 | -75.6 | 0 | 0 | 0 | 0 | 108.5 | A6 K10 | A6-S8 PolarHBondContact O-N 3.47Å; S8-K10 PolarHBondContact O-N 3.27Å; S8-K10 VanDerWaalsContact O-N 3.08Å |
| 9 | P | 40.9 | Very low | 41.7 | Very low | 120 Ų | 120 | 138.2 Ų | 138.2 | 78% | 0.779 | 76% | 0.755 | S | S | * | * | | | trans | -56.4 | 121.5 | -175.6 | 19.8 | -30.6 | 0 | 0 | 0 | 109.3 | K11 | P9-K11 PolarHBondContact O-N 2.69Š|
| 10 | K | 42.4 | Very low | 41.8 | Very low | 183 Ų | 183 | 133.8 Ų | 133.8 | 80% | 0.796 | 73% | 0.73 | S | S | * | * | | | trans | -46.5 | 104.1 | 173.8 | -72.4 | 171.9 | -179.8 | 165.6 | 0 | 107.6 | S8 P12 | S8-K10 PolarHBondContact O-N 3.27Å; S8-K10 VanDerWaalsContact O-N 3.08Å; K10-P12 VanDerWaalsContact O-N 3.12Å |
| 11 | K | 42 | Very low | 42.1 | Very low | 194 Ų | 194 | 129.3 Ų | 129.3 | 84% | 0.843 | 71% | 0.707 | S | S | * | * | | | trans | -51.9 | 124 | 174.2 | -79.2 | 177.9 | 178.8 | 176.1 | 0 | 106.2 | P9 | P9-K11 PolarHBondContact O-N 2.69Š|
| 12 | P | 44.1 | Very low | 42.2 | Very low | 110 Ų | 110 | 120.5 Ų | 120.5 | 71% | 0.714 | 67% | 0.667 | S | S | * | * | | | trans | -55 | 137.5 | 177.3 | 23 | -31.7 | 0 | 0 | 0 | 107.1 | K10 G14 | K10-P12 VanDerWaalsContact O-N 3.12Å; P12-G14 PolarHBondContact O-N 3.1Å |
| 13 | P | 46.9 | Very low | 42 | Very low | 129 Ų | 129 | 125.1 Ų | 125.1 | 84% | 0.838 | 66% | 0.664 | S | S | * | * | | | trans | -49 | 111.5 | -175.2 | 18.5 | -30.6 | 0 | 0 | 0 | 108 | K15 | P13-K15 PolarHBondContact O-N 2.88Å; P13-K15 VanDerWaalsContact O-N 3.17Å |
| 14 | G | 46.5 | Very low | 42.1 | Very low | 68 Ų | 68 | 119.6 Ų | 119.6 | 70% | 0.701 | 65% | 0.646 | S | S | * | * | | | trans | -55 | 125.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | P12 S16 | P12-G14 PolarHBondContact O-N 3.1Å; G14-S16 PolarHBondContact O-N 2.79Å |
| 15 | K | 45.6 | Very low | 42.5 | Very low | 205 Ų | 205 | 115.1 Ų | 115.1 | 89% | 0.891 | 63% | 0.634 | S | S | * | * | | | trans | -35.8 | 99.5 | -178.8 | -62.9 | 170.6 | 179.5 | 178.3 | 0 | 110.4 | P13 G17 | P13-K15 PolarHBondContact O-N 2.88Å; P13-K15 VanDerWaalsContact O-N 3.17Å; K15-G17 PolarHBondContact O-N 2.88Å; K15-G17 VanDerWaalsContact O-N 3.16Å |
| 16 | S | 46.7 | Very low | 42.8 | Very low | 93 Ų | 93 | 114.3 Ų | 114.3 | 65% | 0.65 | 64% | 0.635 | S | S | * | * | | | trans | -80.7 | 97.7 | 176.4 | 48.6 | 0 | 0 | 0 | 0 | 107.4 | G14 I18 | G14-S16 PolarHBondContact O-N 2.79Å; S16-I18 PolarHBondContact O-N 2.8Å |
| 17 | G | 44.4 | Very low | 42.8 | Very low | 38 Ų | 38 | 112.6 Ų | 112.6 | 39% | 0.392 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -65.5 | 126.8 | 172.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | K15 M19 | K15-G17 PolarHBondContact O-N 2.88Å; K15-G17 VanDerWaalsContact O-N 3.16Å; G17-M19 PolarHBondContact O-N 2.87Å |
| 18 | I | 44.9 | Very low | 43.3 | Very low | 82 Ų | 82 | 108.3 Ų | 108.3 | 42% | 0.421 | 61% | 0.606 | S | S | . | * | P | Polyproline II helix | trans | -78.5 | 118 | 168.3 | -48.2 | -176.3 | 0 | 0 | 0 | 106.7 | S16 V60 H62 | S16-I18 PolarHBondContact O-N 2.8Å; I18-V60 HydrophobicContact CG2-CG1 3.97Å; I18-H62 VanDerWaalsContact CD1-CE1 3.41Å; I18-H62 WeakPolarHBondContact CD1-CE1 3.33Å |
| 19 | M | 43.3 | Very low | 43.4 | Very low | 92 Ų | 92 | 111.5 Ų | 111.5 | 45% | 0.453 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -98.6 | 125.9 | 172 | -62.6 | -164 | -43.8 | 0 | 0 | 108.9 | G17 A63 L66 | G17-M19 PolarHBondContact O-N 2.87Å; M19-A63 HydrophobicContact CE-CB 3.97Å; M19-A63 HydrophobicContact CG-CB 4.23Å; M19-L66 HydrophobicContact CE-CD1 4.27Å |
| 20 | I | 45.5 | Very low | 43.5 | Very low | 49 Ų | 49 | 110 Ų | 110 | 25% | 0.251 | 59% | 0.592 | S | S | . | * | B | Isolated β-bridge | trans | -101.8 | 115.8 | 173.4 | -54.7 | -179.3 | 0 | 0 | 0 | 107.7 | V22 L33 V58 V60 | I20-V22 HydrophobicContact CG2-CG2 4.12Å; I20-L33 HydrophobicContact CD1-CD1 4.4Å; I20-V58 HydrophobicContact CG2-CG1 4.2Å; I20-V60 HydrophobicContact CD1-CG1 4.41Å; I20-V60 HydrophobicContact CD1-CG2 4.04Å; I20-V60 HydrophobicContact CG1-CG1 3.99Å; I20-V60 HydrophobicContact CG1-CG2 4.13Å; I20-V60 HydrophobicContact CG2-CG2 4.04Å |
| 21 | V | 47.3 | Very low | 43.5 | Very low | 41 Ų | 41 | 103.8 Ų | 103.8 | 25% | 0.248 | 57% | 0.574 | C | S | . | * | | | trans | -90.5 | 104.4 | 174.5 | -178.6 | 0 | 0 | 0 | 0 | 108.1 | R23 L30 | V21-R23 HydrophobicContact CG1-CG 4.28Å; V21-L30 HydrophobicContact CG1-CD2 4.42Å; V21-L30 HydrophobicContact CG2-CD2 4.42Å |
| 22 | V | 42.5 | Very low | 43.4 | Very low | 58 Ų | 58 | 100.6 Ų | 100.6 | 35% | 0.352 | 57% | 0.571 | S | S | . | * | | | trans | -87.7 | 113.5 | 173.4 | -175.6 | 0 | 0 | 0 | 0 | 108.4 | I20 T24 | I20-V22 HydrophobicContact CG2-CG2 4.12Å; V22-T24 HydrophobicContact CG1-CG2 4.28Å |
| 23 | R | 37.3 | Very low | 43.2 | Very low | 193 Ų | 193 | 99.7 Ų | 99.7 | 73% | 0.728 | 56% | 0.56 | S | S | * | * | | | trans | -94.9 | 119.6 | 174.7 | -71.8 | -178.3 | 172.9 | -178.7 | -3.5 | 109.1 | V21 | V21-R23 HydrophobicContact CG1-CG 4.28Š|
| 24 | T | 39.6 | Very low | 42.7 | Very low | 79 Ų | 79 | 98.3 Ų | 98.3 | 49% | 0.485 | 55% | 0.553 | S | S | . | * | B | Isolated β-bridge | trans | -112.3 | 147.4 | 169.2 | 70.9 | 0 | 0 | 0 | 0 | 109.9 | V22 N26 S27 | V22-T24 HydrophobicContact CG1-CG2 4.28Å; T24-N26 PolarHBondContact O-N 2.92Å; T24-S27 PolarHBondContact O-N 2.78Å; T24-S27 VanDerWaalsContact O-N 3.12Å; T24-S27 PolarHBondContact OG1-O 3.05Å |
| 25 | H | 44.2 | Very low | 42.3 | Very low | 138 Ų | 138 | 98.2 Ų | 98.2 | 64% | 0.639 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | -10.7 | -159.5 | -77.6 | -68.8 | 0 | 0 | 0 | 117.6 | K56 | H25-K56 WeakPolarHBondContact NE2-CD 3.41Š|
| 26 | N | 43.5 | Very low | 41.8 | Very low | 168 Ų | 168 | 92 Ų | 92 | 90% | 0.898 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -141.1 | 12.3 | 173.6 | -73.7 | -44.2 | 0 | 0 | 0 | 113.4 | T24 | T24-N26 PolarHBondContact O-N 2.92Š|
| 27 | S | 40.8 | Very low | 41.2 | Very low | 57 Ų | 57 | 96 Ų | 96 | 40% | 0.399 | 53% | 0.529 | S | S | . | . | B | Isolated β-bridge | trans | -160.1 | 126.7 | 169.6 | 70.1 | 0 | 0 | 0 | 0 | 111.5 | T24 K29 | T24-S27 PolarHBondContact O-N 2.78Å; T24-S27 VanDerWaalsContact O-N 3.12Å; T24-S27 PolarHBondContact OG1-O 3.05Å; S27-K29 VanDerWaalsContact C-N 3.33Å; S27-K29 PolarHBondContact O-N 3.12Å |
| 28 | S | 41.4 | Very low | 40.7 | Very low | 74 Ų | 74 | 103.1 Ų | 103.1 | 52% | 0.517 | 55% | 0.546 | S | S | . | . | | | trans | -82.2 | 77.9 | 166.8 | 24.9 | 0 | 0 | 0 | 0 | 108.7 | L30 | S28-L30 PolarHBondContact O-N 3.22Š|
| 29 | K | 40.9 | Very low | 40.1 | Very low | 171 Ų | 171 | 104.6 Ų | 104.6 | 74% | 0.743 | 56% | 0.56 | S | S | * | * | | | trans | -81.9 | 106 | 166.8 | -81.9 | -172.9 | 177.3 | 178.7 | 0 | 109 | S27 A31 | S27-K29 VanDerWaalsContact C-N 3.33Å; S27-K29 PolarHBondContact O-N 3.12Å; K29-A31 PolarHBondContact O-N 3.38Å |
| 30 | L | 43.4 | Very low | 39.7 | Very low | 89 Ų | 89 | 105.5 Ų | 105.5 | 47% | 0.466 | 58% | 0.583 | S | S | . | * | | | trans | -67.7 | 109.2 | 170.3 | -71.7 | 166.9 | 0 | 0 | 0 | 109 | V21 S28 T32 I73 | V21-L30 HydrophobicContact CG1-CD2 4.42Å; V21-L30 HydrophobicContact CG2-CD2 4.42Å; S28-L30 PolarHBondContact O-N 3.22Å; L30-T32 PolarHBondContact O-N 3.02Å; L30-I73 HydrophobicContact CD1-CG1 4.25Å; L30-I73 HydrophobicContact CD1-CG2 3.95Å |
| 31 | A | 43.7 | Very low | 39.1 | Very low | 51 Ų | 51 | 107.9 Ų | 107.9 | 42% | 0.421 | 60% | 0.604 | S | S | . | * | | | trans | -81.1 | 101.2 | 156.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | K29 L33 | K29-A31 PolarHBondContact O-N 3.38Å; A31-L33 HydrophobicContact CB-CG 4.47Å; A31-L33 PolarHBondContact O-N 2.98Å |
| 32 | T | 39 | Very low | 38.4 | Very low | 128 Ų | 128 | 112.3 Ų | 112.3 | 79% | 0.785 | 64% | 0.635 | S | S | * | * | | | trans | -66.2 | 86.9 | 159.8 | -54.7 | 0 | 0 | 0 | 0 | 106.2 | L30 S34 | L30-T32 PolarHBondContact O-N 3.02Å; T32-S34 PolarHBondContact O-N 3.4Å |
| 33 | L | 40.3 | Very low | 37.8 | Very low | 90 Ų | 90 | 118.4 Ų | 118.4 | 47% | 0.471 | 66% | 0.657 | S | S | . | * | | | trans | -66 | 96.4 | 163.5 | -66.8 | -179.8 | 0 | 0 | 0 | 105.2 | I20 A31 S35 | I20-L33 HydrophobicContact CD1-CD1 4.4Å; A31-L33 HydrophobicContact CB-CG 4.47Å; A31-L33 PolarHBondContact O-N 2.98Å; L33-S35 PolarHBondContact O-N 3.17Å |
| 34 | S | 36.7 | Very low | 37.6 | Very low | 100 Ų | 100 | 116.2 Ų | 116.2 | 70% | 0.699 | 66% | 0.659 | S | S | * | * | | | trans | -49.1 | 93.6 | 167.8 | 152.4 | 0 | 0 | 0 | 0 | 107.4 | T32 C36 | T32-S34 PolarHBondContact O-N 3.4Å; S34-C36 PolarHBondContact O-N 2.84Å |
| 35 | S | 36.8 | Very low | 37.6 | Very low | 66 Ų | 66 | 121.8 Ų | 121.8 | 46% | 0.462 | 68% | 0.68 | S | S | . | * | | | trans | 29.7 | 60.5 | 160 | 173.9 | 0 | 0 | 0 | 0 | 112.6 | L33 F37 | L33-S35 PolarHBondContact O-N 3.17Å; S35-F37 PolarHBondContact O-N 3.39Å; S35-F37 WeakPolarHBondContact OG-CD2 3.4Å; S35-F37 VanDerWaalsContact OG-CE2 3.27Å; S35-F37 WeakPolarHBondContact OG-CE2 2.96Å |
| 36 | C | 35.5 | Very low | 37.3 | Very low | 76 Ų | 76 | 121 Ų | 121 | 51% | 0.514 | 69% | 0.685 | S | S | . | * | | | trans | -68.3 | 93.3 | 164.6 | -62.2 | 0 | 0 | 0 | 0 | 104.6 | S34 Y38 | S34-C36 PolarHBondContact O-N 2.84Å; C36-Y38 HydrophobicContact CB-CD2 4Å; C36-Y38 HydrophobicContact CB-CE2 3.78Å; C36-Y38 WeakPolarHBondContact O-CD2 3.36Å; C36-Y38 PolarHBondContact O-N 3.06Å |
| 37 | F | 34.2 | Very low | 36.8 | Very low | 176 Ų | 176 | 122.2 Ų | 122.2 | 77% | 0.772 | 68% | 0.682 | S | S | * | * | | | trans | -55.6 | 92.1 | 158.7 | -82.4 | -93.3 | 0 | 0 | 0 | 105.4 | S35 P39 | S35-F37 PolarHBondContact O-N 3.39Å; S35-F37 WeakPolarHBondContact OG-CD2 3.4Å; S35-F37 VanDerWaalsContact OG-CE2 3.27Å; S35-F37 WeakPolarHBondContact OG-CE2 2.96Å; F37-P39 WeakPolarHBondContact O-CD 3.37Å |
| 38 | Y | 34.2 | Very low | 36.7 | Very low | 188 Ų | 188 | 125.4 Ų | 125.4 | 74% | 0.737 | 71% | 0.705 | S | S | * | * | | | trans | -69.6 | 108.9 | 163.7 | -81.9 | -87.3 | 0 | 0 | 0 | 105.1 | C36 A40 | C36-Y38 HydrophobicContact CB-CD2 4Å; C36-Y38 HydrophobicContact CB-CE2 3.78Å; C36-Y38 WeakPolarHBondContact O-CD2 3.36Å; C36-Y38 PolarHBondContact O-N 3.06Å; Y38-A40 PolarHBondContact O-N 3.19Å; Y38-A40 VanDerWaalsContact O-N 3.12Å |
| 39 | P | 32.2 | Very low | 36.7 | Very low | 112 Ų | 112 | 127.1 Ų | 127.1 | 73% | 0.727 | 72% | 0.717 | S | S | * | * | | | trans | -59.1 | 123.7 | 165.9 | 26.7 | -30.9 | 0 | 0 | 0 | 105.9 | F37 S41 | F37-P39 WeakPolarHBondContact O-CD 3.37Å; P39-S41 VanDerWaalsContact C-N 3.26Å; P39-S41 PolarHBondContact O-N 3.18Å |
| 40 | A | 35.6 | Very low | 36.3 | Very low | 112 Ų | 112 | 126.9 Ų | 126.9 | 93% | 0.926 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -58.4 | 91.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | Y38 | Y38-A40 PolarHBondContact O-N 3.19Å; Y38-A40 VanDerWaalsContact O-N 3.12Å |
| 41 | S | 31.5 | Very low | 36.1 | Very low | 99 Ų | 99 | 128.2 Ų | 128.2 | 69% | 0.692 | 74% | 0.735 | S | S | * | * | | | trans | -156.2 | 54.1 | 173 | -176.8 | 0 | 0 | 0 | 0 | 109.3 | P39 K43 | P39-S41 VanDerWaalsContact C-N 3.26Å; P39-S41 PolarHBondContact O-N 3.18Å; S41-K43 PolarHBondContact O-N 2.89Å |
| 42 | C | 31.9 | Very low | 35.7 | Very low | 133 Ų | 133 | 133 Ų | 133 | 90% | 0.899 | 75% | 0.748 | S | S | * | * | | | trans | -86.3 | 75.5 | 160.9 | -68.3 | 0 | 0 | 0 | 0 | 107.9 | | |
| 43 | K | 30.3 | Very low | 35.4 | Very low | 186 Ų | 186 | 130.5 Ų | 130.5 | 81% | 0.809 | 75% | 0.748 | S | S | * | * | | | trans | -113.5 | 102.3 | 148.1 | -70.4 | -156.9 | 178 | -169 | 0 | 105 | S41 | S41-K43 PolarHBondContact O-N 2.89Š|
| 44 | D | 33.4 | Very low | 35.4 | Very low | 147 Ų | 147 | 137.4 Ų | 137.4 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | | | | -172.1 | 129.5 | 120.4 | -105 | -36.9 | 0 | 0 | 0 | 110.8 | T46 | D44-T46 PolarHBondContact O-N 2.73Š|
| 45 | E | 40.2 | Very low | 35.5 | Very low | 196 Ų | 196 | 143.8 Ų | 143.8 | 92% | 0.916 | 78% | 0.779 | S | S | * | * | | | trans | -64.9 | 99.5 | 177.2 | -58.5 | -175.7 | 124.9 | 0 | 0 | 108.5 | | |
| 46 | T | 37.3 | Very low | 35.8 | Very low | 121 Ų | 121 | 147.1 Ų | 147.1 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | | | trans | -129.9 | 86.8 | 173.2 | -34.7 | 0 | 0 | 0 | 0 | 110.4 | D44 | D44-T46 PolarHBondContact O-N 2.73Š|
| 47 | K | 34.4 | Very low | 36.3 | Very low | 195 Ų | 195 | 150.9 Ų | 150.9 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | | | trans | 36.5 | 99.2 | 142.6 | -58.6 | -171 | -179.8 | -179.1 | 0 | 116.3 | S49 | K47-S49 PolarHBondContact O-N 3.12Š|
| 48 | S | 37.8 | Very low | 36.9 | Very low | 124 Ų | 124 | 147.3 Ų | 147.3 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | | | trans | -41.9 | 98.9 | 157.7 | 162 | 0 | 0 | 0 | 0 | 112.5 | | |
| 49 | S | 40.6 | Very low | 37.5 | Very low | 110 Ų | 110 | 145.6 Ų | 145.6 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | | | trans | -89.2 | 91.5 | 153.4 | 49.8 | 0 | 0 | 0 | 0 | 108.8 | K47 S51 | K47-S49 PolarHBondContact O-N 3.12Å; S49-S51 PolarHBondContact O-N 2.83Å |
| 50 | E | 33.5 | Very low | 38.6 | Very low | 165 Ų | 165 | 143.8 Ų | 143.8 | 77% | 0.771 | 78% | 0.778 | S | S | * | * | | | trans | 33.5 | 54.9 | 139.8 | -146.5 | 165.4 | -179.5 | 0 | 0 | 117.9 | H52 | E50-H52 PolarHBondContact O-N 3.31Å; E50-H52 VanDerWaalsContact O-N 3.15Å; E50-H52 PolarHBondContact O-ND1 3.36Å |
| 51 | S | 39 | Very low | 39.6 | Very low | 117 Ų | 117 | 140.4 Ų | 140.4 | 82% | 0.818 | 75% | 0.746 | S | S | * | * | | | trans | -76.3 | 105.5 | 172.8 | 66.7 | 0 | 0 | 0 | 0 | 110.1 | S49 | S49-S51 PolarHBondContact O-N 2.83Š|
| 52 | H | 35.1 | Very low | 40.6 | Very low | 151 Ų | 151 | 139.2 Ų | 139.2 | 70% | 0.699 | 73% | 0.729 | S | S | * | * | | | trans | -55.7 | 130.4 | 171.5 | -71.4 | 29.4 | 0 | 0 | 0 | 111.8 | E50 Y54 | E50-H52 PolarHBondContact O-N 3.31Å; E50-H52 VanDerWaalsContact O-N 3.15Å; E50-H52 PolarHBondContact O-ND1 3.36Å; H52-Y54 PolarHBondContact O-N 3.21Å |
| 53 | G | 33.1 | Very low | 41.9 | Very low | 77 Ų | 77 | 134.8 Ų | 134.8 | 79% | 0.794 | 70% | 0.702 | S | S | * | * | S | Bend | trans | 84.1 | -14.6 | 137.6 | 0 | 0 | 0 | 0 | 0 | 121.7 | R55 | G53-R55 PolarHBondContact O-N 2.78Š|
| 54 | Y | 40.3 | Very low | 43.3 | Very low | 234 Ų | 234 | 132 Ų | 132 | 92% | 0.918 | 70% | 0.696 | S | S | * | * | | | trans | -101.4 | 65.6 | 179.3 | -62.1 | -78.8 | 0 | 0 | 0 | 112.6 | H52 K56 | H52-Y54 PolarHBondContact O-N 3.21Å; Y54-K56 PolarHBondContact O-N 3.44Å |
| 55 | R | 38.3 | Very low | 44.2 | Very low | 235 Ų | 235 | 133.6 Ų | 133.6 | 89% | 0.887 | 69% | 0.691 | S | S | * | * | | | trans | -77.6 | 116.9 | 161.5 | -75.8 | -170.3 | 177 | -175.8 | 0.6 | 107.9 | G53 | G53-R55 PolarHBondContact O-N 2.78Š|
| 56 | K | 42.9 | Very low | 45 | Very low | 135 Ų | 135 | 127 Ų | 127 | 59% | 0.587 | 66% | 0.662 | S | S | * | * | | | trans | 177.3 | 101.6 | 140 | -89.9 | 153.7 | -156.1 | -175.4 | 0 | 110.3 | H25 Y54 V58 | H25-K56 WeakPolarHBondContact NE2-CD 3.41Å; Y54-K56 PolarHBondContact O-N 3.44Å; K56-V58 PolarHBondContact O-N 3.23Å |
| 57 | D | 47.1 | Very low | 46.2 | Very low | 156 Ų | 156 | 131.3 Ų | 131.3 | 83% | 0.834 | 67% | 0.67 | S | S | * | * | | | trans | 45.3 | 66.1 | 136.1 | -45.8 | -29 | 0 | 0 | 0 | 117 | Q59 | D57-Q59 PolarHBondContact O-N 2.87Å; D57-Q59 VanDerWaalsContact O-N 3.17Å |
| 58 | V | 46.4 | Very low | 47.2 | Very low | 101 Ų | 101 | 126.2 Ų | 126.2 | 61% | 0.612 | 66% | 0.659 | S | S | * | * | | | trans | -72 | 104.1 | 161.3 | -176.7 | 0 | 0 | 0 | 0 | 108 | I20 K56 | I20-V58 HydrophobicContact CG2-CG1 4.2Å; K56-V58 PolarHBondContact O-N 3.23Å |
| 59 | Q | 47.5 | Very low | 47.8 | Very low | 151 Ų | 151 | 124.6 Ų | 124.6 | 71% | 0.706 | 65% | 0.646 | S | S | * | * | | | trans | -96.1 | 111.4 | 172.6 | -160.1 | 174.4 | 51.4 | 0 | 0 | 109.9 | D57 V61 | D57-Q59 PolarHBondContact O-N 2.87Å; D57-Q59 VanDerWaalsContact O-N 3.17Å; Q59-V61 HydrophobicContact CG-CG2 3.98Å |
| 60 | V | 53.5 | Low | 48.5 | Very low | 75 Ų | 75 | 120.9 Ų | 120.9 | 46% | 0.455 | 62% | 0.62 | S | S | . | * | B | Isolated β-bridge | trans | -81.3 | 117 | 172.3 | 177.9 | 0 | 0 | 0 | 0 | 108.3 | I18 I20 | I18-V60 HydrophobicContact CG2-CG1 3.97Å; I20-V60 HydrophobicContact CD1-CG1 4.41Å; I20-V60 HydrophobicContact CD1-CG2 4.04Å; I20-V60 HydrophobicContact CG1-CG1 3.99Å; I20-V60 HydrophobicContact CG1-CG2 4.13Å; I20-V60 HydrophobicContact CG2-CG2 4.04Å |
| 61 | V | 56.5 | Low | 49.3 | Very low | 41 Ų | 41 | 116.6 Ų | 116.6 | 25% | 0.248 | 62% | 0.62 | C | S | . | * | | | trans | -124.3 | 123.2 | 178 | -173.8 | 0 | 0 | 0 | 0 | 108.6 | Q59 R65 L66 | Q59-V61 HydrophobicContact CG-CG2 3.98Å; V61-R65 HydrophobicContact CG1-CB 4.14Å; V61-L66 HydrophobicContact CB-CD2 4.32Å; V61-L66 HydrophobicContact CG1-CD2 3.79Å; V61-L66 HydrophobicContact CG1-CG 4.27Å |
| 62 | H | 54 | Low | 49.8 | Very low | 73 Ų | 73 | 117.2 Ų | 117.2 | 34% | 0.338 | 61% | 0.614 | S | S | . | * | | | trans | -62.5 | 143.8 | 174.2 | -70.2 | -100.6 | 0 | 0 | 0 | 111 | I18 D64 R65 | I18-H62 VanDerWaalsContact CD1-CE1 3.41Å; I18-H62 WeakPolarHBondContact CD1-CE1 3.33Å; H62-D64 VanDerWaalsContact C-N 3.25Å; H62-D64 WeakPolarHBondContact CB-OD1 2.97Å; H62-D64 PolarHBondContact O-N 2.74Å; H62-R65 HydrophobicContact CB-CG 4.37Å; H62-R65 PolarHBondContact O-N 3.17Å |
| 63 | A | 58.6 | Low | 50.5 | Low | 41 Ų | 41 | 111.7 Ų | 111.7 | 34% | 0.339 | 59% | 0.589 | S | S | . | * | G | 310 helix | trans | -61.2 | -33.1 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | M19 R65 L66 | M19-A63 HydrophobicContact CE-CB 3.97Å; M19-A63 HydrophobicContact CG-CB 4.23Å; A63-R65 VanDerWaalsContact C-N 3.27Å; A63-R65 PolarHBondContact O-N 2.82Å; A63-L66 PolarHBondContact O-N 2.86Å |
| 64 | D | 60.8 | Low | 50.9 | Low | 128 Ų | 128 | 118.8 Ų | 118.8 | 68% | 0.684 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -68.9 | -21 | 176.3 | 63.3 | -27.5 | 0 | 0 | 0 | 113.7 | H62 | H62-D64 VanDerWaalsContact C-N 3.25Å; H62-D64 WeakPolarHBondContact CB-OD1 2.97Å; H62-D64 PolarHBondContact O-N 2.74Å |
| 65 | R | 50.5 | Low | 51.3 | Low | 180 Ų | 180 | 115.7 Ų | 115.7 | 68% | 0.679 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -88 | -10.7 | 177 | -63 | -176.8 | 67.7 | -169.1 | 0.5 | 113.2 | V61 H62 A63 K67 | V61-R65 HydrophobicContact CG1-CB 4.14Å; H62-R65 HydrophobicContact CB-CG 4.37Å; H62-R65 PolarHBondContact O-N 3.17Å; A63-R65 VanDerWaalsContact C-N 3.27Å; A63-R65 PolarHBondContact O-N 2.82Å; R65-K67 PolarHBondContact O-N 3.48Å |
| 66 | L | 58.4 | Low | 51.5 | Low | 57 Ų | 57 | 112.8 Ų | 112.8 | 30% | 0.298 | 58% | 0.58 | S | S | . | * | | | trans | -72.7 | 108.9 | 175.5 | -64.6 | 174.9 | 0 | 0 | 0 | 109.1 | M19 V61 A63 S68 | M19-L66 HydrophobicContact CE-CD1 4.27Å; V61-L66 HydrophobicContact CB-CD2 4.32Å; V61-L66 HydrophobicContact CG1-CD2 3.79Å; V61-L66 HydrophobicContact CG1-CG 4.27Å; A63-L66 PolarHBondContact O-N 2.86Å; L66-S68 PolarHBondContact O-N 3.16Å |
| 67 | K | 62.9 | Low | 51.4 | Low | 212 Ų | 212 | 115.1 Ų | 115.1 | 92% | 0.922 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -65.2 | -23.4 | 175.9 | -66.9 | -58.9 | -173.4 | -177.1 | 0 | 112.9 | R65 | R65-K67 PolarHBondContact O-N 3.48Š|
| 68 | S | 55.3 | Low | 51 | Low | 88 Ų | 88 | 115.2 Ų | 115.2 | 62% | 0.615 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -147.3 | 149.3 | 177.1 | 50.8 | 0 | 0 | 0 | 0 | 109.6 | L66 P70 | L66-S68 PolarHBondContact O-N 3.16Å; S68-P70 WeakPolarHBondContact O-CD 3.47Å |
| 69 | C | 50 | Low | 50.7 | Low | 89 Ų | 89 | 120.1 Ų | 120.1 | 60% | 0.601 | 60% | 0.601 | S | S | * | * | | | trans | -63.5 | 123.1 | 169.1 | -166.1 | 0 | 0 | 0 | 0 | 107.8 | G71 | C69-G71 PolarHBondContact O-N 2.82Å; C69-G71 VanDerWaalsContact O-N 3.17Å |
| 70 | P | 54.3 | Low | 50.6 | Low | 33 Ų | 33 | 120 Ų | 120 | 21% | 0.214 | 61% | 0.605 | C | S | . | * | | | trans | -53.7 | 124.2 | 175 | -21.4 | 27.6 | 0 | 0 | 0 | 109.9 | S68 D72 I73 | S68-P70 WeakPolarHBondContact O-CD 3.47Å; P70-D72 PolarHBondContact O-N 2.83Å; P70-I73 HydrophobicContact CB-CD1 4.03Å; P70-I73 HydrophobicContact CB-CG1 4.19Å; P70-I73 HydrophobicContact CG-CD1 3.83Å; P70-I73 WeakPolarHBondContact O-CG1 3.27Å; P70-I73 PolarHBondContact O-N 2.84Å |
| 71 | G | 51.2 | Low | 49.6 | Very low | 74 Ų | 74 | 128.5 Ų | 128.5 | 76% | 0.763 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | -17.1 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | C69 I73 | C69-G71 PolarHBondContact O-N 2.82Å; C69-G71 VanDerWaalsContact O-N 3.17Å; G71-I73 VanDerWaalsContact C-N 3.25Å; G71-I73 PolarHBondContact O-N 3.08Å |
| 72 | D | 48.8 | Very low | 48.8 | Very low | 130 Ų | 130 | 129.8 Ų | 129.8 | 70% | 0.695 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | -0.9 | 177.7 | -64.7 | -28.2 | 0 | 0 | 0 | 113.8 | P70 R74 | P70-D72 PolarHBondContact O-N 2.83Å; D72-R74 VanDerWaalsContact C-N 3.31Å; D72-R74 PolarHBondContact O-N 2.92Å; D72-R74 VanDerWaalsContact O-N 3.12Å |
| 73 | I | 51 | Low | 48.5 | Very low | 35 Ų | 35 | 131.8 Ų | 131.8 | 18% | 0.179 | 66% | 0.659 | C | S | . | * | | | trans | -87.5 | 73.9 | 176 | -50.2 | 175.3 | 0 | 0 | 0 | 108.7 | L30 P70 G71 F75 | L30-I73 HydrophobicContact CD1-CG1 4.25Å; L30-I73 HydrophobicContact CD1-CG2 3.95Å; P70-I73 HydrophobicContact CB-CD1 4.03Å; P70-I73 HydrophobicContact CB-CG1 4.19Å; P70-I73 HydrophobicContact CG-CD1 3.83Å; P70-I73 WeakPolarHBondContact O-CG1 3.27Å; P70-I73 PolarHBondContact O-N 2.84Å; G71-I73 VanDerWaalsContact C-N 3.25Å; G71-I73 PolarHBondContact O-N 3.08Å; I73-F75 HydrophobicContact CG2-CD2 4.14Å; I73-F75 HydrophobicContact CG2-CE2 3.81Å; I73-F75 HydrophobicContact CG2-CZ 4.13Å; I73-F75 PolarHBondContact O-N 3.04Å |
| 74 | R | 41.2 | Very low | 47.9 | Very low | 226 Ų | 226 | 137.4 Ų | 137.4 | 85% | 0.853 | 68% | 0.683 | S | S | * | * | | | trans | -76.4 | 102.5 | 163.1 | -62.9 | -175.8 | 78.5 | 177.6 | 3.1 | 107 | D72 Q76 | D72-R74 VanDerWaalsContact C-N 3.31Å; D72-R74 PolarHBondContact O-N 2.92Å; D72-R74 VanDerWaalsContact O-N 3.12Å; R74-Q76 PolarHBondContact O-N 3.3Å |
| 75 | F | 48 | Very low | 47 | Very low | 170 Ų | 170 | 136.4 Ų | 136.4 | 75% | 0.746 | 68% | 0.681 | S | S | * | * | | | trans | -57.1 | 114.1 | 162.1 | -71.6 | -86.8 | 0 | 0 | 0 | 106.4 | I73 E77 | I73-F75 HydrophobicContact CG2-CD2 4.14Å; I73-F75 HydrophobicContact CG2-CE2 3.81Å; I73-F75 HydrophobicContact CG2-CZ 4.13Å; I73-F75 PolarHBondContact O-N 3.04Å; F75-E77 PolarHBondContact O-N 3.25Å |
| 76 | Q | 42.1 | Very low | 46.7 | Very low | 174 Ų | 174 | 134.7 Ų | 134.7 | 81% | 0.813 | 69% | 0.686 | S | S | * | * | | | trans | -67.8 | 82.8 | 165.8 | -76.4 | -166.1 | 14.5 | 0 | 0 | 107 | R74 E78 | R74-Q76 PolarHBondContact O-N 3.3Å; Q76-E78 PolarHBondContact O-N 3.34Å |
| 77 | E | 42.4 | Very low | 46 | Very low | 183 Ų | 183 | 139.5 Ų | 139.5 | 86% | 0.855 | 71% | 0.707 | S | S | * | * | | | trans | -73.5 | 42.2 | 164.9 | -158 | 178.3 | 180 | 0 | 0 | 109.7 | F75 | F75-E77 PolarHBondContact O-N 3.25Š|
| 78 | E | 37.8 | Very low | 45.2 | Very low | 159 Ų | 159 | 140.7 Ų | 140.7 | 74% | 0.743 | 71% | 0.705 | S | S | * | * | | | trans | -120.4 | 69.5 | 176.9 | -73.9 | -167.4 | 163.1 | 0 | 0 | 108.5 | Q76 | Q76-E78 PolarHBondContact O-N 3.34Š|
| 79 | K | 40.9 | Very low | 44.7 | Very low | 203 Ų | 203 | 141 Ų | 141 | 88% | 0.883 | 70% | 0.703 | S | S | * | * | S | Bend | trans | 177.9 | 41.4 | 147 | -98.7 | 166.2 | -172.4 | -173.8 | 0 | 112.9 | | |
| 80 | L | 44.3 | Very low | 44.4 | Very low | 149 Ų | 149 | 148.8 Ų | 148.8 | 78% | 0.78 | 72% | 0.72 | S | S | * | * | | | trans | -133.2 | 61.6 | 157.4 | -104.1 | 132.2 | 0 | 0 | 0 | 108.3 | S82 | L80-S82 PolarHBondContact O-N 3.41Š|
| 81 | R | 33.8 | Very low | 43.9 | Very low | 254 Ų | 254 | 157.6 Ų | 157.6 | 96% | 0.958 | 75% | 0.749 | S | S | * | * | | | trans | -73 | 53 | 165.3 | -151.6 | -172.8 | -160.9 | -174.7 | 6.6 | 109.3 | | |
| 82 | S | 39.5 | Very low | 43.6 | Very low | 68 Ų | 68 | 158 Ų | 158 | 48% | 0.476 | 75% | 0.746 | S | S | . | * | | | trans | -101.6 | 113.4 | 159.7 | 45.9 | 0 | 0 | 0 | 0 | 106.1 | L80 L84 | L80-S82 PolarHBondContact O-N 3.41Å; S82-L84 VanDerWaalsContact C-N 3.27Å; S82-L84 PolarHBondContact O-N 3.23Å |
| 83 | P | 47.8 | Very low | 43.5 | Very low | 114 Ų | 114 | 163 Ų | 163 | 74% | 0.74 | 76% | 0.755 | S | S | * | * | | | trans | -66 | 95.8 | 174.4 | 27.1 | -30.5 | 0 | 0 | 0 | 106.9 | T85 | P83-T85 PolarHBondContact O-N 3.19Š|
| 84 | L | 44.9 | Very low | 43.1 | Very low | 160 Ų | 160 | 171.7 Ų | 171.7 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | | | trans | -76.6 | 75.1 | 166.3 | -152.7 | 82.6 | 0 | 0 | 0 | 106.1 | S82 D86 | S82-L84 VanDerWaalsContact C-N 3.27Å; S82-L84 PolarHBondContact O-N 3.23Å; L84-D86 VanDerWaalsContact C-N 3.25Å; L84-D86 PolarHBondContact O-N 3.01Å |
| 85 | T | 42.3 | Very low | 43.3 | Very low | 106 Ų | 106 | 167.8 Ų | 167.8 | 65% | 0.65 | 78% | 0.781 | S | S | * | * | | | trans | -53.4 | 100 | 156.9 | 40.1 | 0 | 0 | 0 | 0 | 106.5 | P83 Q87 | P83-T85 PolarHBondContact O-N 3.19Å; T85-Q87 PolarHBondContact O-N 3.47Å |
| 86 | D | 44.4 | Very low | 43.3 | Very low | 145 Ų | 145 | 167.8 Ų | 167.8 | 78% | 0.775 | 78% | 0.783 | S | S | * | * | | | trans | -70.9 | 61.3 | 165.4 | -165.2 | 18.2 | 0 | 0 | 0 | 108.7 | L84 | L84-D86 VanDerWaalsContact C-N 3.25Å; L84-D86 PolarHBondContact O-N 3.01Å |
| 87 | Q | 42.5 | Very low | 43.2 | Very low | 158 Ų | 158 | 163.1 Ų | 163.1 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | | | trans | -107.1 | 46.5 | 167.9 | -73.7 | -159.1 | 27.1 | 0 | 0 | 109.1 | T85 T89 | T85-Q87 PolarHBondContact O-N 3.47Å; Q87-T89 PolarHBondContact O-N 3.39Å; Q87-T89 PolarHBondContact O-OG1 3.4Å |
| 88 | R | 47.6 | Very low | 43.3 | Very low | 236 Ų | 236 | 160.1 Ų | 160.1 | 89% | 0.891 | 78% | 0.778 | S | S | * | * | | | trans | -72.3 | 69.6 | 159.6 | -82.5 | -175 | 174.1 | 174.3 | -0.2 | 109.2 | R90 | R88-R90 PolarHBondContact O-N 3.32Š|
| 89 | T | 44.9 | Very low | 43.8 | Very low | 94 Ų | 94 | 159.9 Ų | 159.9 | 58% | 0.577 | 78% | 0.781 | S | S | * | * | | | | 28.5 | 101.2 | 126 | -49.5 | 0 | 0 | 0 | 0 | 111.9 | Q87 R91 | Q87-T89 PolarHBondContact O-N 3.39Å; Q87-T89 PolarHBondContact O-OG1 3.4Å; T89-R91 HydrophobicContact CG2-CG 3.49Å; T89-R91 VanDerWaalsContact CG2-CG 3.49Å; T89-R91 PolarHBondContact O-N 3.31Å |
| 90 | R | 43.7 | Very low | 44 | Very low | 253 Ų | 253 | 159.6 Ų | 159.6 | 96% | 0.955 | 78% | 0.783 | S | S | * | * | | | trans | -54.8 | 79.7 | 160.1 | -69.3 | -176.2 | 172.9 | -166.1 | -1.2 | 108.8 | R88 A92 | R88-R90 PolarHBondContact O-N 3.32Å; R90-A92 PolarHBondContact O-N 3.17Å |
| 91 | R | 43.8 | Very low | 43.8 | Very low | 218 Ų | 218 | 156.1 Ų | 156.1 | 82% | 0.823 | 78% | 0.783 | S | S | * | * | | | trans | -77.8 | 112.4 | 172.7 | -71.4 | -165.5 | 176.6 | -165.3 | -1 | 106.6 | T89 | T89-R91 HydrophobicContact CG2-CG 3.49Å; T89-R91 VanDerWaalsContact CG2-CG 3.49Å; T89-R91 PolarHBondContact O-N 3.31Å |
| 92 | A | 44 | Very low | 44.2 | Very low | 84 Ų | 84 | 152.3 Ų | 152.3 | 69% | 0.694 | 78% | 0.78 | S | S | * | * | | | trans | -47.3 | 139 | 178 | 0 | 0 | 0 | 0 | 0 | 111.3 | R90 R94 | R90-A92 PolarHBondContact O-N 3.17Å; A92-R94 PolarHBondContact O-N 3.45Å; A92-R94 VanDerWaalsContact O-N 3.1Å |
| 93 | R | 46.2 | Very low | 44.2 | Very low | 233 Ų | 233 | 151.7 Ų | 151.7 | 88% | 0.879 | 78% | 0.784 | S | S | * | * | | | trans | -40.7 | 115.7 | 168.5 | -70 | 177.8 | 170.5 | 167.1 | -4.6 | 109.3 | | |
| 94 | R | 42.2 | Very low | 44.3 | Very low | 218 Ų | 218 | 152 Ų | 152 | 82% | 0.823 | 79% | 0.786 | S | S | * | * | | | trans | -117.1 | 108.1 | 162.9 | -74.5 | -165.9 | 175.7 | -173.6 | -1.1 | 107 | A92 H96 | A92-R94 PolarHBondContact O-N 3.45Å; A92-R94 VanDerWaalsContact O-N 3.1Å; R94-H96 PolarHBondContact O-N 2.83Å |
| 95 | D | 45.4 | Very low | 44.6 | Very low | 144 Ų | 144 | 148.7 Ų | 148.7 | 77% | 0.77 | 78% | 0.777 | S | S | * | * | | | trans | -70.9 | 100 | 174.1 | -60.3 | -58.5 | 0 | 0 | 0 | 109.8 | | |
| 96 | H | 48.7 | Very low | 45.1 | Very low | 171 Ų | 171 | 151.8 Ų | 151.8 | 79% | 0.792 | 78% | 0.783 | S | S | * | * | | | trans | -151.2 | 97.3 | 163.1 | -58.3 | -63.8 | 0 | 0 | 0 | 106 | R94 | R94-H96 PolarHBondContact O-N 2.83Š|
| 97 | G | 40.5 | Very low | 45.6 | Very low | 75 Ų | 75 | 153 Ų | 153 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | | | | 119.1 | 143.6 | 80 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 98 | P | 44.8 | Very low | 46.3 | Very low | 120 Ų | 120 | 153.2 Ų | 153.2 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | | | trans | -97.6 | 145.8 | -161.5 | 18.7 | -1.9 | 0 | 0 | 0 | 115.2 | | |
| 99 | L | 47.3 | Very low | 46.8 | Very low | 154 Ų | 154 | 149.3 Ų | 149.3 | 81% | 0.806 | 78% | 0.782 | S | S | * | * | | | trans | 57.5 | 108.3 | 144.1 | -59.3 | 171 | 0 | 0 | 0 | 118.9 | | |
| 100 | Q | 45.8 | Very low | 47.5 | Very low | 197 Ų | 197 | 149.4 Ų | 149.4 | 92% | 0.921 | 79% | 0.792 | S | S | * | * | | | | 179.8 | 113.3 | 123.3 | -97.5 | 155 | 66 | 0 | 0 | 110.5 | | |
| 101 | G | 40.6 | Very low | 48.7 | Very low | 77 Ų | 77 | 145.9 Ų | 145.9 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | | | trans | -159.2 | 57.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | G103 | G101-G103 PolarHBondContact O-N 2.8Š|
| 102 | I | 40.9 | Very low | 49.9 | Very low | 174 Ų | 174 | 142.5 Ų | 142.5 | 89% | 0.892 | 77% | 0.774 | S | S | * | * | | | trans | -77 | 83.4 | 169.2 | -56.4 | 165.9 | 0 | 0 | 0 | 105.8 | | |
| 103 | G | 40.3 | Very low | 50.8 | Low | 54 Ų | 54 | 142.9 Ų | 142.9 | 56% | 0.557 | 77% | 0.769 | S | S | * | * | | | trans | -110.9 | 127.2 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | G101 S105 | G101-G103 PolarHBondContact O-N 2.8Å; G103-S105 VanDerWaalsContact C-N 3.3Å; G103-S105 PolarHBondContact O-N 2.84Å |
| 104 | P | 49.4 | Very low | 51.6 | Low | 121 Ų | 121 | 136.9 Ų | 136.9 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | | | trans | -66.5 | 96.8 | 171.8 | 27.9 | -30.5 | 0 | 0 | 0 | 107.4 | H106 | P104-H106 PolarHBondContact O-N 3.4Š|
| 105 | S | 50.9 | Low | 52.7 | Low | 91 Ų | 91 | 136.4 Ų | 136.4 | 64% | 0.636 | 76% | 0.758 | S | S | * | * | | | trans | -72 | 69.9 | 173.1 | 177.3 | 0 | 0 | 0 | 0 | 108.8 | G103 Q107 | G103-S105 VanDerWaalsContact C-N 3.3Å; G103-S105 PolarHBondContact O-N 2.84Å; S105-Q107 PolarHBondContact O-N 3.35Å; S105-Q107 WeakPolarHBondContact OG-CG 3.37Å |
| 106 | H | 52.5 | Low | 53.6 | Low | 170 Ų | 170 | 138 Ų | 138 | 79% | 0.787 | 76% | 0.764 | S | S | * | * | | | trans | -67.3 | 73.8 | 156.8 | -106.1 | 62.5 | 0 | 0 | 0 | 106.7 | P104 H108 | P104-H106 PolarHBondContact O-N 3.4Å; H106-H108 PolarHBondContact O-CD2 2.87Å; H106-H108 PolarHBondContact O-N 3.4Å |
| 107 | Q | 56.7 | Low | 54.4 | Low | 171 Ų | 171 | 136.7 Ų | 136.7 | 80% | 0.799 | 76% | 0.761 | S | S | * | * | | | trans | -71.5 | 87.5 | 169.2 | -87.3 | -176.3 | -11.1 | 0 | 0 | 107.8 | S105 N109 | S105-Q107 PolarHBondContact O-N 3.35Å; S105-Q107 WeakPolarHBondContact OG-CG 3.37Å; Q107-N109 PolarHBondContact O-N 3.12Å |
| 108 | H | 55.5 | Low | 55.3 | Low | 162 Ų | 162 | 139.6 Ų | 139.6 | 75% | 0.75 | 76% | 0.758 | S | S | * | * | | | trans | -1.5 | 114.1 | 147.2 | -77.2 | -92.8 | 0 | 0 | 0 | 113.9 | H106 A110 | H106-H108 PolarHBondContact O-CD2 2.87Å; H106-H108 PolarHBondContact O-N 3.4Å; H108-A110 PolarHBondContact O-N 3.17Å |
| 109 | N | 58.2 | Low | 56.5 | Low | 154 Ų | 154 | 137.4 Ų | 137.4 | 82% | 0.824 | 74% | 0.742 | S | S | * | * | | | trans | 42 | 69.6 | 142.1 | -55.6 | -34.7 | 0 | 0 | 0 | 114.3 | Q107 Y111 | Q107-N109 PolarHBondContact O-N 3.12Å; N109-Y111 PolarHBondContact O-N 3.19Å |
| 110 | A | 60.7 | Low | 57.4 | Low | 96 Ų | 96 | 136.8 Ų | 136.8 | 79% | 0.793 | 74% | 0.74 | S | S | * | * | | | trans | -57.1 | 122.5 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | H108 | H108-A110 PolarHBondContact O-N 3.17Š|
| 111 | Y | 68.9 | Low | 57.7 | Low | 180 Ų | 180 | 136.3 Ų | 136.3 | 71% | 0.706 | 73% | 0.731 | S | S | * | * | | | trans | 18.5 | 106.2 | 164.3 | -169.6 | -100.9 | 0 | 0 | 0 | 117.2 | N109 P114 | N109-Y111 PolarHBondContact O-N 3.19Å; Y111-P114 WeakPolarHBondContact OH-CD 3.04Å; Y111-P114 WeakPolarHBondContact OH-CG 3.41Å |
| 112 | Q | 68.2 | Low | 57.8 | Low | 147 Ų | 147 | 139.6 Ų | 139.6 | 69% | 0.687 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 128.1 | 165.5 | -164.4 | 176.6 | 13 | 0 | 0 | 109.4 | | |
| 113 | P | 63.1 | Low | 58.1 | Low | 92 Ų | 92 | 138.6 Ų | 138.6 | 60% | 0.597 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 146.5 | -177.7 | 25.4 | -33.8 | 0 | 0 | 0 | 111.8 | R115 | P113-R115 PolarHBondContact O-N 3.49Š|
| 114 | P | 62.7 | Low | 58.7 | Low | 107 Ų | 107 | 142.6 Ų | 142.6 | 70% | 0.695 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 131.9 | 178.3 | -21.2 | 32.2 | 0 | 0 | 0 | 111.3 | Y111 | Y111-P114 WeakPolarHBondContact OH-CD 3.04Å; Y111-P114 WeakPolarHBondContact OH-CG 3.41Å |
| 115 | R | 65.9 | Low | 58.5 | Low | 207 Ų | 207 | 141.4 Ų | 141.4 | 78% | 0.781 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 123.1 | 173.4 | -68.3 | 179.9 | 170.1 | -177.2 | -4.3 | 109 | P113 I117 | P113-R115 PolarHBondContact O-N 3.49Å; R115-I117 PolarHBondContact O-N 3.01Å |
| 116 | M | 65.1 | Low | 57.9 | Low | 179 Ų | 179 | 140.3 Ų | 140.3 | 88% | 0.882 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -74 | 116.2 | 172.8 | -174 | 174.2 | 67.9 | 0 | 0 | 108.7 | | |
| 117 | I | 65.6 | Low | 57.2 | Low | 143 Ų | 143 | 137.5 Ų | 137.5 | 73% | 0.733 | 73% | 0.728 | S | S | * | * | | | trans | -97.8 | 106.5 | 173 | -52.2 | 179.1 | 0 | 0 | 0 | 106.8 | R115 V119 | R115-I117 PolarHBondContact O-N 3.01Å; I117-V119 HydrophobicContact CG2-CG2 3.54Å; I117-V119 PolarHBondContact O-N 2.75Å |
| 118 | L | 58.6 | Low | 56.5 | Low | 136 Ų | 136 | 136.8 Ų | 136.8 | 71% | 0.712 | 73% | 0.729 | S | S | * | * | | | trans | -77.6 | 111.7 | 171.1 | -176.5 | 68.7 | 0 | 0 | 0 | 107.3 | | |
| 119 | V | 70.4 | Confident | 55.7 | Low | 74 Ų | 74 | 135.9 Ų | 135.9 | 45% | 0.448 | 73% | 0.729 | S | S | . | * | | | trans | -124.2 | 98.5 | 170.7 | -152.4 | 0 | 0 | 0 | 0 | 110.1 | I117 Y121 | I117-V119 HydrophobicContact CG2-CG2 3.54Å; I117-V119 PolarHBondContact O-N 2.75Å; V119-Y121 HydrophobicContact CB-CD2 3.73Å; V119-Y121 HydrophobicContact CB-CE2 3.46Å; V119-Y121 VanDerWaalsContact CB-CE2 3.46Å; V119-Y121 HydrophobicContact CG1-CD1 4.29Å; V119-Y121 HydrophobicContact CG1-CD2 3.38Å; V119-Y121 HydrophobicContact CG1-CE1 3.96Å; V119-Y121 HydrophobicContact CG1-CE2 2.99Å; V119-Y121 HydrophobicContact CG1-CG 4.02Å; V119-Y121 HydrophobicContact CG2-CE2 4.16Å; V119-Y121 PolarHBondContact O-N 3.23Å; V119-Y121 VanDerWaalsContact O-N 3.17Å |
| 120 | D | 65.7 | Low | 54.9 | Low | 141 Ų | 141 | 136.6 Ų | 136.6 | 75% | 0.754 | 73% | 0.727 | S | S | * | * | | | trans | -80.3 | 86.5 | 171 | -67.4 | -37.6 | 0 | 0 | 0 | 108.3 | Q122 | D120-Q122 PolarHBondContact O-N 3.15Š|
| 121 | Y | 52.9 | Low | 53.8 | Low | 187 Ų | 187 | 142.9 Ų | 142.9 | 73% | 0.733 | 73% | 0.731 | S | S | * | * | | | trans | -80.2 | 105.5 | 175.9 | -78.3 | -75.1 | 0 | 0 | 0 | 110.8 | V119 | V119-Y121 HydrophobicContact CB-CD2 3.73Å; V119-Y121 HydrophobicContact CB-CE2 3.46Å; V119-Y121 VanDerWaalsContact CB-CE2 3.46Å; V119-Y121 HydrophobicContact CG1-CD1 4.29Å; V119-Y121 HydrophobicContact CG1-CD2 3.38Å; V119-Y121 HydrophobicContact CG1-CE1 3.96Å; V119-Y121 HydrophobicContact CG1-CE2 2.99Å; V119-Y121 HydrophobicContact CG1-CG 4.02Å; V119-Y121 HydrophobicContact CG2-CE2 4.16Å; V119-Y121 PolarHBondContact O-N 3.23Å; V119-Y121 VanDerWaalsContact O-N 3.17Å |
| 122 | Q | 42.8 | Very low | 52.5 | Low | 145 Ų | 145 | 142 Ų | 142 | 68% | 0.678 | 73% | 0.733 | S | S | * | * | | | trans | 40.9 | 100.2 | 150.4 | -58.8 | -165.9 | 64.3 | 0 | 0 | 117.1 | D120 D124 | D120-Q122 PolarHBondContact O-N 3.15Å; Q122-D124 PolarHBondContact O-N 2.88Å; Q122-D124 PolarHBondContact OE1-OD1 3.13Å |
| 123 | N | 45.4 | Very low | 51 | Low | 153 Ų | 153 | 143.3 Ų | 143.3 | 82% | 0.818 | 74% | 0.739 | S | S | * | * | | | trans | -77.1 | 96.9 | 144.2 | -90.5 | -74.5 | 0 | 0 | 0 | 107.6 | S125 | N123-S125 PolarHBondContact O-N 3.24Š|
| 124 | D | 53.2 | Low | 49.9 | Very low | 139 Ų | 139 | 145.5 Ų | 145.5 | 74% | 0.743 | 75% | 0.745 | S | S | * | * | | | trans | -70.4 | 53.2 | 163.1 | -75.8 | -52.5 | 0 | 0 | 0 | 110.8 | Q122 | Q122-D124 PolarHBondContact O-N 2.88Å; Q122-D124 PolarHBondContact OE1-OD1 3.13Å |
| 125 | S | 46.8 | Very low | 48.6 | Very low | 95 Ų | 95 | 145.1 Ų | 145.1 | 66% | 0.664 | 75% | 0.745 | S | S | * | * | | | trans | -124.8 | 88.3 | -176.7 | -55.3 | 0 | 0 | 0 | 0 | 109.6 | N123 | N123-S125 PolarHBondContact O-N 3.24Š|
| 126 | G | 38.3 | Very low | 47.5 | Very low | 68 Ų | 68 | 141.1 Ų | 141.1 | 70% | 0.701 | 75% | 0.746 | S | S | * | * | | | trans | 98.7 | 87.6 | 153.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | L128 | G126-L128 PolarHBondContact O-N 3.03Š|
| 127 | S | 37.2 | Very low | 46.2 | Very low | 112 Ų | 112 | 137.6 Ų | 137.6 | 78% | 0.783 | 74% | 0.739 | S | S | * | * | | | trans | -21.2 | 102.3 | 136.2 | 161.4 | 0 | 0 | 0 | 0 | 112.6 | | |
| 128 | L | 41.1 | Very low | 44.9 | Very low | 156 Ų | 156 | 137.3 Ų | 137.3 | 82% | 0.817 | 74% | 0.744 | S | S | * | * | | | trans | -121.8 | 65.6 | 155.7 | -138.3 | 162.9 | 0 | 0 | 0 | 106.5 | G126 E130 | G126-L128 PolarHBondContact O-N 3.03Å; L128-E130 VanDerWaalsContact C-N 3.28Å; L128-E130 PolarHBondContact O-N 3.24Å |
| 129 | D | 39.8 | Very low | 44.1 | Very low | 142 Ų | 142 | 135.6 Ų | 135.6 | 76% | 0.759 | 74% | 0.743 | S | S | * | * | | | trans | -47.9 | 105 | 143.6 | -101.4 | -81.1 | 0 | 0 | 0 | 106.3 | | |
| 130 | E | 41.6 | Very low | 42.8 | Very low | 169 Ų | 169 | 141 Ų | 141 | 79% | 0.79 | 76% | 0.764 | S | S | * | * | | | | -174.1 | 122.3 | 120.4 | -94 | -175 | 110.9 | 0 | 0 | 109.8 | L128 Q132 | L128-E130 VanDerWaalsContact C-N 3.28Å; L128-E130 PolarHBondContact O-N 3.24Å; E130-Q132 PolarHBondContact O-N 3.01Å; E130-Q132 VanDerWaalsContact O-N 3.11Å |
| 131 | R | 37.2 | Very low | 41.9 | Very low | 229 Ų | 229 | 142 Ų | 142 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | | | trans | -52 | 111.1 | 174.7 | -64.4 | 166.9 | 73.9 | -157.8 | 5.7 | 110.4 | | |
| 132 | Q | 40.6 | Very low | 41.6 | Very low | 162 Ų | 162 | 138.7 Ų | 138.7 | 76% | 0.757 | 77% | 0.769 | S | S | * | * | | | trans | -127.1 | 79.7 | 149.6 | -74.9 | -172.2 | 5.9 | 0 | 0 | 109.1 | E130 L134 | E130-Q132 PolarHBondContact O-N 3.01Å; E130-Q132 VanDerWaalsContact O-N 3.11Å; Q132-L134 HydrophobicContact CB-CD1 4.36Å; Q132-L134 HydrophobicContact CB-CG 4.25Å; Q132-L134 PolarHBondContact O-N 3.29Å |
| 133 | Q | 37.6 | Very low | 41.9 | Very low | 173 Ų | 173 | 136.1 Ų | 136.1 | 81% | 0.808 | 77% | 0.773 | S | S | * | * | | | trans | -62.5 | 85.2 | 149.9 | -75.3 | 179.8 | -10.3 | 0 | 0 | 107.3 | | |
| 134 | L | 39.9 | Very low | 42.2 | Very low | 138 Ų | 138 | 134.7 Ų | 134.7 | 72% | 0.723 | 77% | 0.772 | S | S | * | * | | | trans | -104.8 | 102.6 | 163.7 | -69.1 | 174.6 | 0 | 0 | 0 | 106.6 | Q132 | Q132-L134 HydrophobicContact CB-CD1 4.36Å; Q132-L134 HydrophobicContact CB-CG 4.25Å; Q132-L134 PolarHBondContact O-N 3.29Å |
| 135 | S | 35.3 | Very low | 41.8 | Very low | 100 Ų | 100 | 136.4 Ų | 136.4 | 70% | 0.699 | 78% | 0.776 | S | S | * | * | | | trans | -44.3 | 141.3 | -179.5 | -56.7 | 0 | 0 | 0 | 0 | 112.5 | S137 | S135-S137 PolarHBondContact O-N 3.11Š|
| 136 | P | 42.4 | Very low | 41.9 | Very low | 123 Ų | 123 | 142.8 Ų | 142.8 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | | | trans | -69.3 | 93.9 | 177.3 | 27.9 | -32 | 0 | 0 | 0 | 109.7 | T138 | P136-T138 VanDerWaalsContact C-N 3.33Å; P136-T138 PolarHBondContact O-N 3.39Å; P136-T138 VanDerWaalsContact O-N 3.07Å |
| 137 | S | 38.1 | Very low | 42.4 | Very low | 105 Ų | 105 | 145.4 Ų | 145.4 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | | | trans | -72.8 | 94.7 | 160.1 | -74.4 | 0 | 0 | 0 | 0 | 108 | S135 S139 | S135-S137 PolarHBondContact O-N 3.11Å; S137-S139 VanDerWaalsContact C-N 3.29Å; S137-S139 PolarHBondContact O-N 3.05Å |
| 138 | T | 37.9 | Very low | 43.1 | Very low | 136 Ų | 136 | 149 Ų | 149 | 83% | 0.834 | 79% | 0.792 | S | S | * | * | | | trans | -57.2 | 88.8 | 164.4 | 28.8 | 0 | 0 | 0 | 0 | 110.2 | P136 | P136-T138 VanDerWaalsContact C-N 3.33Å; P136-T138 PolarHBondContact O-N 3.39Å; P136-T138 VanDerWaalsContact O-N 3.07Å |
| 139 | S | 43 | Very low | 43.3 | Very low | 100 Ų | 100 | 153.3 Ų | 153.3 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | | | trans | -87.6 | 109 | 167 | -51.9 | 0 | 0 | 0 | 0 | 108.1 | S137 L141 | S137-S139 VanDerWaalsContact C-N 3.29Å; S137-S139 PolarHBondContact O-N 3.05Å; S139-L141 PolarHBondContact O-N 3.21Å |
| 140 | Q | 41 | Very low | 43.8 | Very low | 189 Ų | 189 | 151.7 Ų | 151.7 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | | | trans | -55.8 | 123 | 177 | -60.4 | 168.9 | 16.9 | 0 | 0 | 110.3 | | |
| 141 | L | 47.8 | Very low | 44 | Very low | 161 Ų | 161 | 148 Ų | 148 | 84% | 0.843 | 79% | 0.79 | S | S | * | * | | | trans | -135.1 | 147.3 | 167.3 | -78.8 | 178.4 | 0 | 0 | 0 | 110.5 | S139 | S139-L141 PolarHBondContact O-N 3.21Š|
| 142 | P | 46.3 | Very low | 44.5 | Very low | 117 Ų | 117 | 143 Ų | 143 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 158 | -143.6 | 30 | -35 | 0 | 0 | 0 | 114.6 | | |
| 143 | A | 48.6 | Very low | 44.5 | Very low | 91 Ų | 91 | 142.6 Ų | 142.6 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 139.4 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | E145 | A143-E145 PolarHBondContact O-N 2.92Š|
| 144 | P | 52.2 | Low | 44.4 | Very low | 124 Ų | 124 | 140.1 Ų | 140.1 | 81% | 0.805 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 119.5 | 179.5 | 24.6 | -31.6 | 0 | 0 | 0 | 110.6 | R146 | P144-R146 PolarHBondContact O-N 3.16Š|
| 145 | E | 44.6 | Very low | 44.5 | Very low | 175 Ų | 175 | 143.6 Ų | 143.6 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 122.9 | 175.8 | -151.6 | -175.7 | 158.8 | 0 | 0 | 109.3 | A143 | A143-E145 PolarHBondContact O-N 2.92Š|
| 146 | R | 49.2 | Very low | 44.8 | Very low | 229 Ų | 229 | 147.3 Ų | 147.3 | 86% | 0.864 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 132.6 | -174.9 | -71.7 | 179.7 | 179.3 | 155.9 | 0.1 | 110 | P144 K148 | P144-R146 PolarHBondContact O-N 3.16Å; R146-K148 PolarHBondContact O-N 3Å; R146-K148 VanDerWaalsContact O-N 3.16Å |
| 147 | P | 49.3 | Very low | 44.8 | Very low | 122 Ų | 122 | 151.3 Ų | 151.3 | 79% | 0.792 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 122.5 | 177.3 | -23.9 | 32.7 | 0 | 0 | 0 | 111 | R149 | P147-R149 PolarHBondContact O-N 2.88Š|
| 148 | K | 51.8 | Low | 44.8 | Very low | 189 Ų | 189 | 149.5 Ų | 149.5 | 82% | 0.822 | 81% | 0.81 | S | S | * | * | | | trans | -59 | 107.5 | 169.5 | -74.5 | 171.3 | -178.6 | 167.3 | 0 | 107.4 | R146 S150 | R146-K148 PolarHBondContact O-N 3Å; R146-K148 VanDerWaalsContact O-N 3.16Å; K148-S150 PolarHBondContact O-N 3.01Å |
| 149 | R | 46 | Very low | 44.9 | Very low | 245 Ų | 245 | 151.7 Ų | 151.7 | 93% | 0.925 | 81% | 0.813 | S | S | * | * | | | trans | -62.7 | 105.7 | 172.4 | -73.1 | -178.5 | 170.1 | -175.4 | -3.7 | 107.4 | P147 S151 | P147-R149 PolarHBondContact O-N 2.88Å; R149-S151 PolarHBondContact O-N 3.07Å |
| 150 | S | 48.6 | Very low | 44.7 | Very low | 108 Ų | 108 | 151.8 Ų | 151.8 | 76% | 0.755 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -60 | 126.9 | 162.1 | 49.4 | 0 | 0 | 0 | 0 | 107.7 | K148 | K148-S150 PolarHBondContact O-N 3.01Š|
| 151 | S | 46.3 | Very low | 44.8 | Very low | 92 Ų | 92 | 154.2 Ų | 154.2 | 64% | 0.643 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -55 | 127.1 | 173.8 | 44.1 | 0 | 0 | 0 | 0 | 109.6 | R149 D153 | R149-S151 PolarHBondContact O-N 3.07Å; S151-D153 PolarHBondContact O-N 2.89Å |
| 152 | P | 47.6 | Very low | 44.6 | Very low | 125 Ų | 125 | 153.9 Ų | 153.9 | 81% | 0.812 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 117.1 | 168.1 | 26.1 | -29.4 | 0 | 0 | 0 | 108.3 | | |
| 153 | D | 40.8 | Very low | 44.6 | Very low | 152 Ų | 152 | 155.8 Ų | 155.8 | 81% | 0.813 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 147.4 | 171.9 | -71.3 | -49.5 | 0 | 0 | 0 | 111.4 | S151 | S151-D153 PolarHBondContact O-N 2.89Š|
| 154 | C | 36.5 | Very low | 44.3 | Very low | 122 Ų | 122 | 159.4 Ų | 159.4 | 82% | 0.824 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 132 | -162.7 | -60.7 | 0 | 0 | 0 | 0 | 115.2 | E156 | C154-E156 PolarHBondContact O-N 3.36Š|
| 155 | F | 40.3 | Very low | 43.9 | Very low | 210 Ų | 210 | 161.5 Ų | 161.5 | 92% | 0.921 | 85% | 0.847 | S | S | * | * | | | trans | -58.5 | 114 | 153.9 | -88.6 | -102.5 | 0 | 0 | 0 | 109.5 | | |
| 156 | E | 41.6 | Very low | 43.8 | Very low | 179 Ų | 179 | 160.7 Ų | 160.7 | 84% | 0.836 | 85% | 0.849 | S | S | * | * | | | trans | -146.7 | 67.4 | 158.9 | -153 | 178.4 | -169.5 | 0 | 0 | 109.5 | C154 G158 | C154-E156 PolarHBondContact O-N 3.36Å; E156-G158 VanDerWaalsContact C-N 3.29Å; E156-G158 PolarHBondContact O-N 3.22Å; E156-G158 VanDerWaalsContact O-N 3.13Å |
| 157 | F | 44.1 | Very low | 43.5 | Very low | 207 Ų | 207 | 156.1 Ų | 156.1 | 91% | 0.908 | 85% | 0.847 | S | S | * | * | | | trans | -77.6 | 92.1 | 159.2 | -101.2 | -85.7 | 0 | 0 | 0 | 107.4 | M159 | F157-M159 PolarHBondContact O-N 3.3Š|
| 158 | G | 36.6 | Very low | 43 | Very low | 67 Ų | 67 | 158.6 Ų | 158.6 | 69% | 0.691 | 85% | 0.851 | S | S | * | * | | | trans | -57.5 | 116.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | E156 | E156-G158 VanDerWaalsContact C-N 3.29Å; E156-G158 PolarHBondContact O-N 3.22Å; E156-G158 VanDerWaalsContact O-N 3.13Å |
| 159 | M | 40.4 | Very low | 42.4 | Very low | 182 Ų | 182 | 156.2 Ų | 156.2 | 90% | 0.897 | 85% | 0.854 | S | S | * | * | | | trans | -122.1 | 79.2 | 158.1 | -67.6 | -118.8 | -56.3 | 0 | 0 | 106.2 | F157 | F157-M159 PolarHBondContact O-N 3.3Š|
| 160 | A | 38.2 | Very low | 42.1 | Very low | 102 Ų | 102 | 148.8 Ų | 148.8 | 84% | 0.843 | 85% | 0.848 | S | S | * | * | | | trans | -81.6 | 128.7 | 163.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | | |
| 161 | I | 43.9 | Very low | 41.5 | Very low | 240 Ų | 240 | 152.5 Ų | 152.5 | 100% | 1.231 | 86% | 0.856 | S | S | * | * | | | trans | -62.7 | 0 | -176.3 | -61.6 | 158.3 | 0 | 0 | 0 | 111.2 | | |