| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42.2 | Very low | 43.3 | Very low | 223 Ų | 223 | 174.9 Ų | 174.9 | 100% | 1.099 | 86% | 0.855 | S | S | * | * | 0 | 76.4 | 0 | -95.2 | 155.8 | 165.7 | 0 | 0 | 105.8 | |||||
| 2 | E | 45.1 | Very low | 44.4 | Very low | 180 Ų | 180 | 168.3 Ų | 168.3 | 84% | 0.841 | 84% | 0.835 | S | S | * | * | 60 | 108.9 | 81.4 | -61.3 | 170.9 | 153.4 | 0 | 0 | 107.7 | |||||
| 3 | G | 42.8 | Very low | 43.5 | Very low | 70 Ų | 70 | 167.5 Ų | 167.5 | 72% | 0.722 | 84% | 0.836 | S | S | * | * | cis | 99.9 | 88.5 | 25.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 4 | E | 52.6 | Low | 43.1 | Very low | 191 Ų | 191 | 161.8 Ų | 161.8 | 89% | 0.893 | 82% | 0.82 | S | S | * | * | trans | -146.7 | 89.1 | 162.8 | -71.6 | -175.5 | 128.7 | 0 | 0 | 105 | ||||
| 5 | E | 53.4 | Low | 43 | Very low | 184 Ų | 184 | 160.5 Ų | 160.5 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | 54.5 | 94.5 | 88.4 | -65.3 | -161.2 | 142.9 | 0 | 0 | 113.6 | |||||
| 6 | K | 40.2 | Very low | 42.9 | Very low | 216 Ų | 216 | 155.8 Ų | 155.8 | 94% | 0.939 | 82% | 0.815 | S | S | * | * | trans | -151.1 | 77.1 | 138.2 | -78.6 | -157.8 | 177.7 | 166.5 | 0 | 108.9 | ||||
| 7 | D | 42.3 | Very low | 42.9 | Very low | 132 Ų | 132 | 157.4 Ų | 157.4 | 71% | 0.706 | 82% | 0.818 | S | S | * | * | trans | -92.7 | 120.4 | 153.4 | -174.1 | 43.2 | 0 | 0 | 0 | 106.9 | ||||
| 8 | F | 41.3 | Very low | 43.2 | Very low | 207 Ų | 207 | 156.4 Ų | 156.4 | 91% | 0.908 | 82% | 0.82 | S | S | * | * | trans | -152.8 | 71.9 | 158.7 | -142.1 | -92 | 0 | 0 | 0 | 107.4 | ||||
| 9 | Q | 43.3 | Very low | 43 | Very low | 161 Ų | 161 | 152.2 Ų | 152.2 | 75% | 0.752 | 82% | 0.817 | S | S | * | * | trans | -89.6 | 116.7 | 157.3 | -159.3 | 167.3 | 2.1 | 0 | 0 | 105.7 | ||||
| 10 | E | 37.8 | Very low | 43.2 | Very low | 181 Ų | 181 | 154.4 Ų | 154.4 | 85% | 0.846 | 82% | 0.822 | S | S | * | * | 176.8 | 131.7 | 121.6 | -92.2 | -172.8 | 123.8 | 0 | 0 | 111.2 | |||||
| 11 | Q | 35.1 | Very low | 43.3 | Very low | 179 Ų | 179 | 154.8 Ų | 154.8 | 84% | 0.836 | 82% | 0.824 | S | S | * | * | trans | -91.8 | -162.4 | 173.2 | -158 | -170.4 | 7.1 | 0 | 0 | 107.1 | ||||
| 12 | P | 56.6 | Low | 43.7 | Very low | 96 Ų | 96 | 148 Ų | 148 | 62% | 0.623 | 80% | 0.804 | S | S | * | * | -93.8 | 160.4 | -112.7 | 38.8 | -22.9 | 0 | 0 | 0 | 115.5 | |||||
| 13 | D | 32.9 | Very low | 43.6 | Very low | 157 Ų | 157 | 146.1 Ų | 146.1 | 84% | 0.84 | 80% | 0.804 | S | S | * | * | trans | 177.6 | 144 | 152.3 | -96.3 | -33.1 | 0 | 0 | 0 | 109.2 | ||||
| 14 | S | 38 | Very low | 43.8 | Very low | 88 Ų | 88 | 149.6 Ų | 149.6 | 62% | 0.615 | 81% | 0.812 | S | S | * | * | cis | 179.2 | 136.5 | -9.8 | -113.4 | 0 | 0 | 0 | 0 | 107 | ||||
| 15 | V | 41.3 | Very low | 43.4 | Very low | 142 Ų | 142 | 145.5 Ų | 145.5 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | trans | 49.3 | 148.1 | 148.5 | -104.5 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 16 | A | 41.7 | Very low | 43.3 | Very low | 85 Ų | 85 | 143.3 Ų | 143.3 | 70% | 0.702 | 80% | 0.803 | S | S | * | * | cis | -170.6 | 150.9 | 11.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 17 | E | 42.7 | Very low | 43.7 | Very low | 183 Ų | 183 | 136.7 Ų | 136.7 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | trans | -171.4 | 89.9 | 140.8 | -153.3 | 177.5 | 156.3 | 0 | 0 | 109.3 | ||||
| 18 | V | 48.9 | Very low | 43.6 | Very low | 141 Ų | 141 | 135.2 Ų | 135.2 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | 54.2 | 114.2 | 102.4 | -174.2 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 19 | G | 39.1 | Very low | 43.9 | Very low | 75 Ų | 75 | 129.4 Ų | 129.4 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | cis | -171.9 | 142.8 | 0.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 20 | E | 46.1 | Very low | 44.2 | Very low | 197 Ų | 197 | 128 Ų | 128 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | trans | -121.9 | 96.8 | 167.8 | 58.3 | -163.7 | 145.4 | 0 | 0 | 107 | A22 | E20-A22 PolarHBondContact O-N 3.02Š| ||
| 21 | D | 45.3 | Very low | 45 | Very low | 162 Ų | 162 | 126.4 Ų | 126.4 | 87% | 0.866 | 79% | 0.794 | S | S | * | * | trans | -77.5 | 107.8 | -172.3 | -142.3 | -17.3 | 0 | 0 | 0 | 109.8 | ||||
| 22 | A | 51.4 | Low | 46.3 | Very low | 82 Ų | 82 | 122.8 Ų | 122.8 | 68% | 0.678 | 79% | 0.786 | S | S | * | * | trans | 41.4 | 87.4 | 153.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | E20 | E20-A22 PolarHBondContact O-N 3.02Š| ||
| 23 | V | 42.6 | Very low | 46.4 | Very low | 139 Ų | 139 | 124.1 Ų | 124.1 | 84% | 0.842 | 79% | 0.794 | S | S | * | * | trans | -140.8 | 106.7 | 139.6 | -150.8 | 0 | 0 | 0 | 0 | 110.7 | S25 | V23-S25 PolarHBondContact O-N 3.15Š| ||
| 24 | T | 48.3 | Very low | 47.7 | Very low | 144 Ų | 144 | 122.4 Ų | 122.4 | 88% | 0.883 | 79% | 0.79 | S | S | * | * | trans | -64.6 | 111.3 | 168 | -43.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 25 | S | 43.9 | Very low | 48.8 | Very low | 104 Ų | 104 | 123.5 Ų | 123.5 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | trans | -156.5 | 98.2 | 155.8 | -176 | 0 | 0 | 0 | 0 | 111 | V23 | V23-S25 PolarHBondContact O-N 3.15Š| ||
| 26 | V | 49.7 | Very low | 50.7 | Low | 139 Ų | 139 | 120.3 Ų | 120.3 | 84% | 0.842 | 77% | 0.767 | S | S | * | * | trans | 26.1 | 110 | 143.1 | -174.6 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 27 | G | 49.4 | Very low | 52.5 | Low | 77 Ų | 77 | 121.1 Ų | 121.1 | 79% | 0.794 | 76% | 0.756 | S | S | * | * | 73.9 | 102.5 | 128.4 | 0 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 28 | A | 39.8 | Very low | 54.4 | Low | 100 Ų | 100 | 118 Ų | 118 | 83% | 0.826 | 74% | 0.742 | S | S | * | * | trans | -161.7 | 109.6 | 137.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 29 | A | 48.2 | Very low | 56.3 | Low | 85 Ų | 85 | 115.3 Ų | 115.3 | 70% | 0.702 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 154.5 | 159.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | L31 | A29-L31 PolarHBondContact O-N 3.14Š|
| 30 | P | 49.6 | Very low | 58.6 | Low | 132 Ų | 132 | 118.7 Ų | 118.7 | 86% | 0.857 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 122.7 | 177.8 | -17.5 | 30 | 0 | 0 | 0 | 110.2 | ||
| 31 | L | 54.2 | Low | 60.6 | Low | 148 Ų | 148 | 114 Ų | 114 | 78% | 0.775 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 139.1 | 177.7 | -67.2 | 157.6 | 0 | 0 | 0 | 110 | A29 | A29-L31 PolarHBondContact O-N 3.14Š|
| 32 | P | 62.2 | Low | 62.8 | Low | 102 Ų | 102 | 112.5 Ų | 112.5 | 66% | 0.662 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 157.6 | 167.5 | 29 | -32.5 | 0 | 0 | 0 | 109.3 | V34 | P32-V34 PolarHBondContact O-N 2.99Š|
| 33 | P | 58.9 | Low | 64.8 | Low | 124 Ų | 124 | 112.7 Ų | 112.7 | 81% | 0.805 | 67% | 0.665 | S | S | * | * | trans | -55.4 | 112.2 | -178.4 | 23.1 | -32.1 | 0 | 0 | 0 | 109 | M35 | P33-M35 VanDerWaalsContact C-N 3.32Å; P33-M35 PolarHBondContact O-N 3.43Å | ||
| 34 | V | 61.2 | Low | 67.3 | Low | 122 Ų | 122 | 111.3 Ų | 111.3 | 74% | 0.739 | 65% | 0.649 | S | S | * | * | trans | -70.9 | 96.4 | 172.4 | 177.8 | 0 | 0 | 0 | 0 | 104.8 | P32 T36 | P32-V34 PolarHBondContact O-N 2.99Å; V34-T36 PolarHBondContact O-N 3.25Å | ||
| 35 | M | 61.2 | Low | 69.6 | Low | 111 Ų | 111 | 111.4 Ų | 111.4 | 55% | 0.547 | 64% | 0.639 | S | S | . | * | trans | -53.6 | 136.4 | 162.1 | -63.8 | -160.9 | 86.2 | 0 | 0 | 107.2 | P33 L43 | P33-M35 VanDerWaalsContact C-N 3.32Å; P33-M35 PolarHBondContact O-N 3.43Å; M35-L43 HydrophobicContact CE-CD1 3.94Å; M35-L43 HydrophobicContact SD-CD1 4.14Å | ||
| 36 | T | 79.8 | Confident | 72.1 | Confident | 74 Ų | 74 | 112.2 Ų | 112.2 | 45% | 0.454 | 63% | 0.631 | S | S | . | * | trans | -61.6 | 144 | -179.2 | -8.8 | 0 | 0 | 0 | 0 | 108.9 | V34 E38 E39 R40 | V34-T36 PolarHBondContact O-N 3.25Å; T36-E38 WeakPolarHBondContact CG2-OE2 3.41Å; T36-E38 PolarHBondContact O-N 3.16Å; T36-E38 VanDerWaalsContact O-N 3.15Å; T36-E39 PolarHBondContact N-OE2 3.5Å; T36-E39 PolarHBondContact O-N 3Å; T36-E39 VanDerWaalsContact OG1-CD 3.25Å; T36-E39 PolarHBondContact OG1-OE2 3.09Å; T36-R40 PolarHBondContact O-N 3.04Å; T36-R40 VanDerWaalsContact O-N 3.09Å | ||
| 37 | E | 79.8 | Confident | 74.4 | Confident | 102 Ų | 102 | 110.3 Ų | 110.3 | 48% | 0.477 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -58.6 | -32.1 | -174.6 | 176.6 | 59.3 | -155.5 | 0 | 0 | 111.3 | R40 Q41 | E37-R40 PolarHBondContact O-N 3.15Å; E37-Q41 WeakPolarHBondContact O-CG 3.46Å; E37-Q41 PolarHBondContact O-N 3.4Å; E37-Q41 VanDerWaalsContact O-N 3.14Å; E37-Q41 PolarHBondContact OE1-NE2 3.08Å |
| 38 | E | 82.9 | Confident | 76.7 | Confident | 117 Ų | 117 | 108.8 Ų | 108.8 | 55% | 0.547 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -63.8 | -47.8 | 174.7 | -60.1 | 75.9 | -165 | 0 | 0 | 111.9 | T36 R40 Q41 E42 | T36-E38 WeakPolarHBondContact CG2-OE2 3.41Å; T36-E38 PolarHBondContact O-N 3.16Å; T36-E38 VanDerWaalsContact O-N 3.15Å; E38-R40 VanDerWaalsContact C-N 3.27Å; E38-R40 PolarHBondContact O-N 3.02Å; E38-Q41 PolarHBondContact O-N 3.44Å; E38-Q41 VanDerWaalsContact O-N 3.16Å; E38-E42 WeakPolarHBondContact O-CG 3.37Å; E38-E42 PolarHBondContact O-N 3.35Å |
| 39 | E | 88.2 | Confident | 79.4 | Confident | 86 Ų | 86 | 110.2 Ų | 110.2 | 40% | 0.402 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63.9 | -34.8 | 178.2 | -63.2 | 175.7 | 129.1 | 0 | 0 | 111.6 | T36 Q41 E42 L43 | T36-E39 PolarHBondContact N-OE2 3.5Å; T36-E39 PolarHBondContact O-N 3Å; T36-E39 VanDerWaalsContact OG1-CD 3.25Å; T36-E39 PolarHBondContact OG1-OE2 3.09Å; E39-Q41 VanDerWaalsContact C-N 3.34Å; E39-E42 PolarHBondContact O-N 3.36Å; E39-L43 WeakPolarHBondContact O-CB 3.41Å; E39-L43 WeakPolarHBondContact O-CG 3.49Å; E39-L43 PolarHBondContact O-N 3.28Å |
| 40 | R | 87.1 | Confident | 81.8 | Confident | 146 Ų | 146 | 109 Ų | 109 | 55% | 0.551 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.8 | -40.4 | 175.9 | -174.5 | -176.5 | 179.3 | 175.4 | 1.2 | 111.5 | T36 E37 E38 Q44 | T36-R40 PolarHBondContact O-N 3.04Å; T36-R40 VanDerWaalsContact O-N 3.09Å; E37-R40 PolarHBondContact O-N 3.15Å; E38-R40 VanDerWaalsContact C-N 3.27Å; E38-R40 PolarHBondContact O-N 3.02Å; R40-Q44 WeakPolarHBondContact O-CG 3.44Å; R40-Q44 PolarHBondContact O-N 3.34Å; R40-Q44 VanDerWaalsContact O-N 3.15Å |
| 41 | Q | 88.2 | Confident | 84.2 | Confident | 97 Ų | 97 | 108 Ų | 108 | 45% | 0.453 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -67.9 | -43.8 | 177 | -72 | 175 | 11.5 | 0 | 0 | 111 | E37 E38 E39 L43 Q44 E45 | E37-Q41 WeakPolarHBondContact O-CG 3.46Å; E37-Q41 PolarHBondContact O-N 3.4Å; E37-Q41 VanDerWaalsContact O-N 3.14Å; E37-Q41 PolarHBondContact OE1-NE2 3.08Å; E38-Q41 PolarHBondContact O-N 3.44Å; E38-Q41 VanDerWaalsContact O-N 3.16Å; E39-Q41 VanDerWaalsContact C-N 3.34Å; Q41-L43 VanDerWaalsContact C-N 3.33Å; Q41-L43 PolarHBondContact O-N 2.96Å; Q41-Q44 WeakPolarHBondContact O-CB 3.45Å; Q41-Q44 PolarHBondContact O-N 3.37Å; Q41-Q44 VanDerWaalsContact O-N 3.08Å; Q41-E45 PolarHBondContact O-N 3.01Å |
| 42 | E | 91.6 | Very high | 86.3 | Confident | 131 Ų | 131 | 105.7 Ų | 105.7 | 61% | 0.612 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -58.2 | -43.8 | 175.4 | -71.6 | 179.7 | -179.4 | 0 | 0 | 112.1 | E38 E39 Q44 E45 E46 | E38-E42 WeakPolarHBondContact O-CG 3.37Å; E38-E42 PolarHBondContact O-N 3.35Å; E39-E42 PolarHBondContact O-N 3.36Å; E42-Q44 VanDerWaalsContact C-N 3.3Å; E42-Q44 PolarHBondContact O-N 3.5Å; E42-E45 PolarHBondContact O-N 2.91Å; E42-E46 PolarHBondContact O-N 3.39Å |
| 43 | L | 94.8 | Very high | 88 | Confident | 87 Ų | 87 | 105.4 Ų | 105.4 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.5 | -33.2 | 175.9 | -74.4 | 172.4 | 0 | 0 | 0 | 113 | M35 E39 Q41 L47 | M35-L43 HydrophobicContact CE-CD1 3.94Å; M35-L43 HydrophobicContact SD-CD1 4.14Å; E39-L43 WeakPolarHBondContact O-CB 3.41Å; E39-L43 WeakPolarHBondContact O-CG 3.49Å; E39-L43 PolarHBondContact O-N 3.28Å; Q41-L43 VanDerWaalsContact C-N 3.33Å; Q41-L43 PolarHBondContact O-N 2.96Å; L43-L47 WeakPolarHBondContact O-CB 3.33Å; L43-L47 PolarHBondContact O-N 3.01Å |
| 44 | Q | 94.2 | Very high | 89.9 | Confident | 110 Ų | 110 | 104.2 Ų | 104.2 | 51% | 0.514 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69.1 | -39.6 | 175.1 | -76 | -179.2 | -8.7 | 0 | 0 | 111.8 | R40 Q41 E42 L47 A48 | R40-Q44 WeakPolarHBondContact O-CG 3.44Å; R40-Q44 PolarHBondContact O-N 3.34Å; R40-Q44 VanDerWaalsContact O-N 3.15Å; Q41-Q44 WeakPolarHBondContact O-CB 3.45Å; Q41-Q44 PolarHBondContact O-N 3.37Å; Q41-Q44 VanDerWaalsContact O-N 3.08Å; E42-Q44 VanDerWaalsContact C-N 3.3Å; E42-Q44 PolarHBondContact O-N 3.5Å; Q44-L47 PolarHBondContact O-N 2.91Å; Q44-A48 WeakPolarHBondContact O-CB 3.5Å; Q44-A48 PolarHBondContact O-N 3.25Å |
| 45 | E | 96.5 | Very high | 91.7 | Very high | 145 Ų | 145 | 103.7 Ų | 103.7 | 68% | 0.678 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.4 | -43.8 | 175.1 | -69.5 | -175.3 | 178.2 | 0 | 0 | 111.8 | Q41 E42 L47 A48 K49 | Q41-E45 PolarHBondContact O-N 3.01Å; E42-E45 PolarHBondContact O-N 2.91Å; E45-L47 VanDerWaalsContact C-N 3.35Å; E45-A48 PolarHBondContact O-N 3.01Å; E45-K49 WeakPolarHBondContact O-CB 3.27Å; E45-K49 PolarHBondContact O-N 3.19Å |
| 46 | E | 96.8 | Very high | 93.4 | Very high | 121 Ų | 121 | 102.2 Ų | 102.2 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.5 | -42.2 | 175.9 | -173.7 | 174.1 | -171.5 | 0 | 0 | 111.3 | E42 A48 K49 V50 | E42-E46 PolarHBondContact O-N 3.39Å; E46-A48 PolarHBondContact O-N 3.47Å; E46-K49 PolarHBondContact O-N 3.27Å; E46-V50 HydrophobicContact CG-CG2 4.42Å; E46-V50 WeakPolarHBondContact O-CG2 3.48Å; E46-V50 PolarHBondContact O-N 2.9Å |
| 47 | L | 97.5 | Very high | 94.3 | Very high | 100 Ų | 100 | 104.2 Ų | 104.2 | 52% | 0.524 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.5 | -51.1 | 175 | -177.6 | 71.3 | 0 | 0 | 0 | 110.9 | L43 Q44 E45 K49 V50 E51 | L43-L47 WeakPolarHBondContact O-CB 3.33Å; L43-L47 PolarHBondContact O-N 3.01Å; Q44-L47 PolarHBondContact O-N 2.91Å; E45-L47 VanDerWaalsContact C-N 3.35Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 2.99Å; L47-V50 PolarHBondContact O-N 3.3Å; L47-V50 VanDerWaalsContact O-N 3.16Å; L47-E51 WeakPolarHBondContact O-CG 3.47Å; L47-E51 PolarHBondContact O-N 2.86Å |
| 48 | A | 97.4 | Very high | 95.2 | Very high | 45 Ų | 45 | 102.6 Ų | 102.6 | 37% | 0.372 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.9 | -42.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q44 E45 E46 E51 D52 | Q44-A48 WeakPolarHBondContact O-CB 3.5Å; Q44-A48 PolarHBondContact O-N 3.25Å; E45-A48 PolarHBondContact O-N 3.01Å; E46-A48 PolarHBondContact O-N 3.47Å; A48-E51 PolarHBondContact O-N 2.65Å; A48-D52 PolarHBondContact O-N 3.18Å |
| 49 | K | 98.2 | Very high | 96 | Very high | 129 Ų | 129 | 103 Ų | 103 | 56% | 0.561 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.9 | -44 | 175.9 | -176.8 | -174.6 | 172.4 | -162.2 | 0 | 112.3 | E45 E46 L47 E51 D52 E53 | E45-K49 WeakPolarHBondContact O-CB 3.27Å; E45-K49 PolarHBondContact O-N 3.19Å; E46-K49 PolarHBondContact O-N 3.27Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 2.99Å; K49-E51 VanDerWaalsContact C-N 3.33Å; K49-D52 PolarHBondContact O-N 3.02Å; K49-E53 VanDerWaalsContact CE-OE1 3.27Å; K49-E53 WeakPolarHBondContact CE-OE1 3.2Å; K49-E53 WeakPolarHBondContact O-CG 3.34Å; K49-E53 PolarHBondContact O-N 3.36Å |
| 50 | V | 98.5 | Very high | 96.5 | Very high | 60 Ų | 60 | 102.5 Ų | 102.5 | 36% | 0.364 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.7 | -39.1 | 177.5 | 169.2 | 0 | 0 | 0 | 0 | 110.8 | E46 L47 E53 I54 | E46-V50 HydrophobicContact CG-CG2 4.42Å; E46-V50 WeakPolarHBondContact O-CG2 3.48Å; E46-V50 PolarHBondContact O-N 2.9Å; L47-V50 PolarHBondContact O-N 3.3Å; L47-V50 VanDerWaalsContact O-N 3.16Å; V50-E53 PolarHBondContact O-N 2.89Å; V50-I54 HydrophobicContact CG1-CD1 3.88Å; V50-I54 HydrophobicContact CG1-CG1 4.4Å; V50-I54 VanDerWaalsContact O-CG1 3.26Å; V50-I54 WeakPolarHBondContact O-CG1 3.49Å; V50-I54 PolarHBondContact O-N 3.42Å |
| 51 | E | 98.3 | Very high | 97 | Very high | 111 Ų | 111 | 100.4 Ų | 100.4 | 52% | 0.519 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.7 | -44.3 | 174.4 | -72.3 | 176.9 | 156.1 | 0 | 0 | 111.8 | L47 A48 K49 I54 Q55 | L47-E51 WeakPolarHBondContact O-CG 3.47Å; L47-E51 PolarHBondContact O-N 2.86Å; A48-E51 PolarHBondContact O-N 2.65Å; K49-E51 VanDerWaalsContact C-N 3.33Å; E51-I54 PolarHBondContact O-N 3.31Å; E51-Q55 WeakPolarHBondContact O-CB 3.34Å; E51-Q55 PolarHBondContact O-N 3.32Å |
| 52 | D | 98.4 | Very high | 97.5 | Very high | 99 Ų | 99 | 98.3 Ų | 98.3 | 53% | 0.529 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.5 | -40.8 | 175.2 | -77.6 | -16.6 | 0 | 0 | 0 | 112.4 | A48 K49 Q55 T56 | A48-D52 PolarHBondContact O-N 3.18Å; K49-D52 PolarHBondContact O-N 3.02Å; D52-Q55 PolarHBondContact O-N 2.95Å; D52-T56 WeakPolarHBondContact O-CB 3.33Å; D52-T56 PolarHBondContact O-N 3.16Å; D52-T56 PolarHBondContact O-OG1 3.33Å |
| 53 | E | 98.5 | Very high | 97.8 | Very high | 97 Ų | 97 | 94.6 Ų | 94.6 | 45% | 0.453 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 174.4 | -75.3 | -179.2 | -162.7 | 0 | 0 | 111.2 | K49 V50 Q55 T56 L57 | K49-E53 VanDerWaalsContact CE-OE1 3.27Å; K49-E53 WeakPolarHBondContact CE-OE1 3.2Å; K49-E53 WeakPolarHBondContact O-CG 3.34Å; K49-E53 PolarHBondContact O-N 3.36Å; V50-E53 PolarHBondContact O-N 2.89Å; E53-Q55 VanDerWaalsContact C-N 3.31Å; E53-Q55 PolarHBondContact O-N 2.81Å; E53-T56 PolarHBondContact O-N 2.87Å; E53-L57 VanDerWaalsContact O-CB 3.31Å; E53-L57 WeakPolarHBondContact O-CB 3.26Å; E53-L57 WeakPolarHBondContact O-CG 3.45Å; E53-L57 PolarHBondContact O-N 2.93Å |
| 54 | I | 98.5 | Very high | 98 | Very high | 99 Ų | 99 | 96.1 Ų | 96.1 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -58.8 | -45 | 174.8 | -71.7 | 165.9 | 0 | 0 | 0 | 110.3 | V50 E51 L57 S58 | V50-I54 HydrophobicContact CG1-CD1 3.88Å; V50-I54 HydrophobicContact CG1-CG1 4.4Å; V50-I54 VanDerWaalsContact O-CG1 3.26Å; V50-I54 WeakPolarHBondContact O-CG1 3.49Å; V50-I54 PolarHBondContact O-N 3.42Å; E51-I54 PolarHBondContact O-N 3.31Å; I54-L57 PolarHBondContact O-N 2.86Å; I54-S58 VanDerWaalsContact O-CB 3.31Å; I54-S58 WeakPolarHBondContact O-CB 3.31Å; I54-S58 PolarHBondContact O-N 3.36Å; I54-S58 PolarHBondContact O-OG 2.99Å |
| 55 | Q | 98.6 | Very high | 98.1 | Very high | 111 Ų | 111 | 96.4 Ų | 96.4 | 52% | 0.519 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 180 | -169.3 | -179 | 15.4 | 0 | 0 | 111.1 | E51 D52 E53 S58 Q59 | E51-Q55 WeakPolarHBondContact O-CB 3.34Å; E51-Q55 PolarHBondContact O-N 3.32Å; D52-Q55 PolarHBondContact O-N 2.95Å; E53-Q55 VanDerWaalsContact C-N 3.31Å; E53-Q55 PolarHBondContact O-N 2.81Å; Q55-S58 WeakPolarHBondContact O-CB 3.4Å; Q55-S58 PolarHBondContact O-N 3.33Å; Q55-Q59 PolarHBondContact O-N 2.89Å |
| 56 | T | 98.5 | Very high | 98.2 | Very high | 80 Ų | 80 | 96.5 Ų | 96.5 | 49% | 0.491 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -48 | 177.7 | -60.1 | 0 | 0 | 0 | 0 | 111.2 | D52 E53 S58 Q59 V60 | D52-T56 WeakPolarHBondContact O-CB 3.33Å; D52-T56 PolarHBondContact O-N 3.16Å; D52-T56 PolarHBondContact O-OG1 3.33Å; E53-T56 PolarHBondContact O-N 2.87Å; T56-S58 VanDerWaalsContact C-N 3.29Å; T56-S58 PolarHBondContact O-N 3.27Å; T56-Q59 WeakPolarHBondContact O-CB 3.31Å; T56-Q59 PolarHBondContact O-N 3.46Å; T56-Q59 VanDerWaalsContact O-N 3.17Å; T56-V60 WeakPolarHBondContact O-CG2 3.36Å; T56-V60 PolarHBondContact O-N 2.81Å |
| 57 | L | 98.7 | Very high | 98.2 | Very high | 116 Ų | 116 | 95.6 Ų | 95.6 | 61% | 0.607 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.4 | -39.6 | 177.3 | -72.3 | 173.9 | 0 | 0 | 0 | 111.5 | E53 I54 Q59 V60 L61 | E53-L57 VanDerWaalsContact O-CB 3.31Å; E53-L57 WeakPolarHBondContact O-CB 3.26Å; E53-L57 WeakPolarHBondContact O-CG 3.45Å; E53-L57 PolarHBondContact O-N 2.93Å; I54-L57 PolarHBondContact O-N 2.86Å; L57-Q59 VanDerWaalsContact C-N 3.34Å; L57-Q59 PolarHBondContact O-N 3.17Å; L57-V60 PolarHBondContact O-N 2.72Å; L57-L61 WeakPolarHBondContact O-CB 3.21Å; L57-L61 PolarHBondContact O-N 3.42Å |
| 58 | S | 98.6 | Very high | 98.1 | Very high | 67 Ų | 67 | 95.3 Ų | 95.3 | 47% | 0.469 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -41.7 | 175.1 | -60 | 0 | 0 | 0 | 0 | 112 | I54 Q55 T56 L61 A62 | I54-S58 VanDerWaalsContact O-CB 3.31Å; I54-S58 WeakPolarHBondContact O-CB 3.31Å; I54-S58 PolarHBondContact O-N 3.36Å; I54-S58 PolarHBondContact O-OG 2.99Å; Q55-S58 WeakPolarHBondContact O-CB 3.4Å; Q55-S58 PolarHBondContact O-N 3.33Å; T56-S58 VanDerWaalsContact C-N 3.29Å; T56-S58 PolarHBondContact O-N 3.27Å; S58-L61 PolarHBondContact O-N 3.35Å; S58-A62 PolarHBondContact O-N 2.88Å |
| 59 | Q | 98.6 | Very high | 98 | Very high | 126 Ų | 126 | 95.8 Ų | 95.8 | 59% | 0.589 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.8 | -43.3 | 174.8 | -73.4 | 178.3 | 22.2 | 0 | 0 | 112.2 | Q55 T56 L57 L61 A62 A63 | Q55-Q59 PolarHBondContact O-N 2.89Å; T56-Q59 WeakPolarHBondContact O-CB 3.31Å; T56-Q59 PolarHBondContact O-N 3.46Å; T56-Q59 VanDerWaalsContact O-N 3.17Å; L57-Q59 VanDerWaalsContact C-N 3.34Å; L57-Q59 PolarHBondContact O-N 3.17Å; Q59-L61 VanDerWaalsContact C-N 3.3Å; Q59-L61 PolarHBondContact O-N 3.4Å; Q59-A62 PolarHBondContact O-N 3.48Å; Q59-A63 WeakPolarHBondContact O-CB 3.47Å; Q59-A63 PolarHBondContact O-N 3.45Å |
| 60 | V | 98.7 | Very high | 97.9 | Very high | 75 Ų | 75 | 92.2 Ų | 92.2 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.6 | -42 | 176.5 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | T56 L57 A63 K64 | T56-V60 WeakPolarHBondContact O-CG2 3.36Å; T56-V60 PolarHBondContact O-N 2.81Å; L57-V60 PolarHBondContact O-N 2.72Å; V60-A63 WeakPolarHBondContact O-CB 3.46Å; V60-A63 PolarHBondContact O-N 2.89Å; V60-K64 HydrophobicContact CG1-CG 4.43Å; V60-K64 VanDerWaalsContact O-CG 3.3Å; V60-K64 WeakPolarHBondContact O-CG 3.48Å; V60-K64 PolarHBondContact O-N 2.93Å |
| 61 | L | 98.6 | Very high | 97.7 | Very high | 103 Ų | 103 | 93.9 Ų | 93.9 | 54% | 0.539 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.2 | -50.1 | 176.5 | -176.4 | 64.1 | 0 | 0 | 0 | 111 | L57 S58 Q59 A63 K64 E65 | L57-L61 WeakPolarHBondContact O-CB 3.21Å; L57-L61 PolarHBondContact O-N 3.42Å; S58-L61 PolarHBondContact O-N 3.35Å; Q59-L61 VanDerWaalsContact C-N 3.3Å; Q59-L61 PolarHBondContact O-N 3.4Å; L61-A63 VanDerWaalsContact C-N 3.25Å; L61-A63 PolarHBondContact O-N 2.97Å; L61-K64 CarbonylContact O-C 3.56Å; L61-K64 WeakPolarHBondContact O-CA 3.38Å; L61-K64 WeakPolarHBondContact O-CB 3.39Å; L61-K64 PolarHBondContact O-N 3.28Å; L61-E65 WeakPolarHBondContact O-CG 3.45Å; L61-E65 PolarHBondContact O-N 2.83Å |
| 62 | A | 98.4 | Very high | 97.5 | Very high | 53 Ų | 53 | 93.1 Ų | 93.1 | 44% | 0.438 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -57.6 | -39.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | S58 Q59 E65 K66 | S58-A62 PolarHBondContact O-N 2.88Å; Q59-A62 PolarHBondContact O-N 3.48Å; A62-E65 PolarHBondContact O-N 2.97Å; A62-K66 WeakPolarHBondContact O-CB 3.43Å; A62-K66 PolarHBondContact O-N 3.02Å |
| 63 | A | 98.3 | Very high | 97.2 | Very high | 52 Ų | 52 | 96 Ų | 96 | 43% | 0.43 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64 | -39.4 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q59 V60 L61 Q67 | Q59-A63 WeakPolarHBondContact O-CB 3.47Å; Q59-A63 PolarHBondContact O-N 3.45Å; V60-A63 WeakPolarHBondContact O-CB 3.46Å; V60-A63 PolarHBondContact O-N 2.89Å; L61-A63 VanDerWaalsContact C-N 3.25Å; L61-A63 PolarHBondContact O-N 2.97Å; A63-Q67 WeakPolarHBondContact O-CG 3.3Å; A63-Q67 PolarHBondContact O-N 3.28Å |
| 64 | K | 98.1 | Very high | 96.9 | Very high | 120 Ų | 120 | 99.8 Ų | 99.8 | 52% | 0.522 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.9 | -39.5 | 176 | -70.8 | -69.9 | 177.5 | -168.7 | 0 | 112.6 | V60 L61 K66 Q67 L68 | V60-K64 HydrophobicContact CG1-CG 4.43Å; V60-K64 VanDerWaalsContact O-CG 3.3Å; V60-K64 WeakPolarHBondContact O-CG 3.48Å; V60-K64 PolarHBondContact O-N 2.93Å; L61-K64 CarbonylContact O-C 3.56Å; L61-K64 WeakPolarHBondContact O-CA 3.38Å; L61-K64 WeakPolarHBondContact O-CB 3.39Å; L61-K64 PolarHBondContact O-N 3.28Å; K64-K66 VanDerWaalsContact C-N 3.33Å; K64-Q67 WeakPolarHBondContact O-CB 3.5Å; K64-Q67 PolarHBondContact O-N 2.89Å; K64-L68 WeakPolarHBondContact O-CB 3.48Å; K64-L68 PolarHBondContact O-N 3.46Å |
| 65 | E | 97.1 | Very high | 96.5 | Very high | 116 Ų | 116 | 100.8 Ų | 100.8 | 54% | 0.542 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.6 | -42 | 174.6 | -70.8 | 177.9 | 153.3 | 0 | 0 | 111.4 | L61 A62 L68 A69 | L61-E65 WeakPolarHBondContact O-CG 3.45Å; L61-E65 PolarHBondContact O-N 2.83Å; A62-E65 PolarHBondContact O-N 2.97Å; E65-L68 WeakPolarHBondContact O-CB 3.42Å; E65-L68 PolarHBondContact O-N 3.28Å; E65-A69 WeakPolarHBondContact O-CB 3.42Å; E65-A69 PolarHBondContact O-N 3.46Å |
| 66 | K | 97.2 | Very high | 96 | Very high | 147 Ų | 147 | 96.9 Ų | 96.9 | 64% | 0.639 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.1 | -46.5 | 171.8 | -176.2 | -179.1 | 176.9 | 177.4 | 0 | 111.8 | A62 K64 L68 A69 D70 | A62-K66 WeakPolarHBondContact O-CB 3.43Å; A62-K66 PolarHBondContact O-N 3.02Å; K64-K66 VanDerWaalsContact C-N 3.33Å; K66-L68 VanDerWaalsContact C-N 3.31Å; K66-L68 PolarHBondContact O-N 2.75Å; K66-A69 PolarHBondContact O-N 3.31Å; K66-D70 PolarHBondContact O-N 3.21Å |
| 67 | Q | 97.7 | Very high | 95.3 | Very high | 101 Ų | 101 | 96.6 Ų | 96.6 | 47% | 0.472 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.1 | -42.3 | 175.6 | -76.4 | -177.9 | -13.7 | 0 | 0 | 111.9 | A63 K64 D70 I71 | A63-Q67 WeakPolarHBondContact O-CG 3.3Å; A63-Q67 PolarHBondContact O-N 3.28Å; K64-Q67 WeakPolarHBondContact O-CB 3.5Å; K64-Q67 PolarHBondContact O-N 2.89Å; Q67-D70 PolarHBondContact O-N 2.91Å; Q67-I71 VanDerWaalsContact O-CG1 3.26Å; Q67-I71 WeakPolarHBondContact O-CG1 3.26Å; Q67-I71 PolarHBondContact O-N 3.31Å |
| 68 | L | 96.2 | Very high | 94.7 | Very high | 94 Ų | 94 | 93.7 Ų | 93.7 | 49% | 0.492 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.4 | -47 | 175.3 | 177.2 | 68.3 | 0 | 0 | 0 | 111 | K64 E65 K66 D70 I71 K72 | K64-L68 WeakPolarHBondContact O-CB 3.48Å; K64-L68 PolarHBondContact O-N 3.46Å; E65-L68 WeakPolarHBondContact O-CB 3.42Å; E65-L68 PolarHBondContact O-N 3.28Å; K66-L68 VanDerWaalsContact C-N 3.31Å; K66-L68 PolarHBondContact O-N 2.75Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.42Å; L68-I71 PolarHBondContact O-N 2.83Å; L68-K72 HydrophobicContact CG-CD 4.45Å; L68-K72 VanDerWaalsContact O-CB 3.32Å; L68-K72 WeakPolarHBondContact O-CB 3.39Å; L68-K72 WeakPolarHBondContact O-CG 3.49Å; L68-K72 PolarHBondContact O-N 2.82Å |
| 69 | A | 94.3 | Very high | 94 | Very high | 56 Ų | 56 | 95.5 Ų | 95.5 | 46% | 0.463 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.9 | -40.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | E65 K66 K72 R73 | E65-A69 WeakPolarHBondContact O-CB 3.42Å; E65-A69 PolarHBondContact O-N 3.46Å; K66-A69 PolarHBondContact O-N 3.31Å; A69-K72 PolarHBondContact O-N 3.44Å; A69-R73 WeakPolarHBondContact O-CB 3.44Å; A69-R73 PolarHBondContact O-N 2.91Å |
| 70 | D | 95.4 | Very high | 93.3 | Very high | 54 Ų | 54 | 95.5 Ų | 95.5 | 29% | 0.289 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.3 | -42.9 | 176.2 | -82.5 | -36.2 | 0 | 0 | 0 | 112.7 | K66 Q67 L68 R73 K74 | K66-D70 PolarHBondContact O-N 3.21Å; Q67-D70 PolarHBondContact O-N 2.91Å; L68-D70 VanDerWaalsContact C-N 3.32Å; L68-D70 PolarHBondContact O-N 3.42Å; D70-R73 PolarHBondContact O-N 2.89Å; D70-R73 IonicContact OD1-CZ 3.55Å; D70-R73 IonicContact OD1-NE 3.73Å; D70-R73 IonicContact OD1-NH2 2.75Å; D70-R73 PolarHBondContact OD1-NH2 3.43Å; D70-K74 WeakPolarHBondContact O-CG 3.47Å; D70-K74 PolarHBondContact O-N 3.23Å |
| 71 | I | 95.5 | Very high | 92.7 | Very high | 95 Ų | 95 | 94.7 Ų | 94.7 | 49% | 0.487 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.6 | -47.1 | 175 | -68.8 | 164.2 | 0 | 0 | 0 | 110.1 | Q67 L68 R73 K74 L75 | Q67-I71 VanDerWaalsContact O-CG1 3.26Å; Q67-I71 WeakPolarHBondContact O-CG1 3.26Å; Q67-I71 PolarHBondContact O-N 3.31Å; L68-I71 PolarHBondContact O-N 2.83Å; I71-R73 VanDerWaalsContact C-N 3.32Å; I71-R73 PolarHBondContact O-N 3.33Å; I71-K74 PolarHBondContact O-N 3.38Å; I71-K74 VanDerWaalsContact O-N 3.12Å; I71-L75 HydrophobicContact CG2-CD1 3.83Å; I71-L75 HydrophobicContact CG2-CG 4.31Å; I71-L75 WeakPolarHBondContact O-CB 3.37Å; I71-L75 WeakPolarHBondContact O-CG 3.37Å; I71-L75 PolarHBondContact O-N 3.02Å |
| 72 | K | 94 | Very high | 92.2 | Very high | 94 Ų | 94 | 93.9 Ų | 93.9 | 41% | 0.409 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -54.7 | -46.6 | 175.5 | -85.8 | -173.4 | 178.3 | -172 | 0 | 111.7 | L68 A69 L75 G76 I77 | L68-K72 HydrophobicContact CG-CD 4.45Å; L68-K72 VanDerWaalsContact O-CB 3.32Å; L68-K72 WeakPolarHBondContact O-CB 3.39Å; L68-K72 WeakPolarHBondContact O-CG 3.49Å; L68-K72 PolarHBondContact O-N 2.82Å; A69-K72 PolarHBondContact O-N 3.44Å; K72-L75 CarbonylContact O-C 3.56Å; K72-L75 PolarHBondContact O-N 3.08Å; K72-G76 PolarHBondContact O-N 3.32Å; K72-G76 VanDerWaalsContact O-N 3.08Å; K72-I77 HydrophobicContact CB-CB 4.46Å; K72-I77 WeakPolarHBondContact CB-O 3.35Å; K72-I77 HydrophobicContact CG-CB 4.46Å; K72-I77 CarbonylContact O-C 3.52Å; K72-I77 WeakPolarHBondContact O-CA 3.32Å; K72-I77 PolarHBondContact O-N 2.94Å |
| 73 | R | 91.4 | Very high | 91.7 | Very high | 160 Ų | 160 | 95.9 Ų | 95.9 | 60% | 0.604 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.5 | -46.6 | 174.3 | -179.7 | 178.3 | 59.9 | 151.6 | -4.9 | 112.2 | A69 D70 I71 L75 G76 | A69-R73 WeakPolarHBondContact O-CB 3.44Å; A69-R73 PolarHBondContact O-N 2.91Å; D70-R73 PolarHBondContact O-N 2.89Å; D70-R73 IonicContact OD1-CZ 3.55Å; D70-R73 IonicContact OD1-NE 3.73Å; D70-R73 IonicContact OD1-NH2 2.75Å; D70-R73 PolarHBondContact OD1-NH2 3.43Å; I71-R73 VanDerWaalsContact C-N 3.32Å; I71-R73 PolarHBondContact O-N 3.33Å; R73-L75 VanDerWaalsContact C-N 3.29Å; R73-L75 PolarHBondContact O-N 3.4Å; R73-G76 PolarHBondContact O-N 2.87Å |
| 74 | K | 92 | Very high | 91.2 | Very high | 176 Ų | 176 | 100.2 Ų | 100.2 | 77% | 0.765 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62 | -35 | 177.3 | -76.1 | 179.5 | 177.7 | -173.3 | 0 | 112.9 | D70 I71 G76 | D70-K74 WeakPolarHBondContact O-CG 3.47Å; D70-K74 PolarHBondContact O-N 3.23Å; I71-K74 PolarHBondContact O-N 3.38Å; I71-K74 VanDerWaalsContact O-N 3.12Å; K74-G76 VanDerWaalsContact C-N 3.26Å |
| 75 | L | 91 | Very high | 90.7 | Very high | 121 Ų | 121 | 100 Ų | 100 | 63% | 0.634 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.4 | -2.7 | 175 | -65.5 | 176.8 | 0 | 0 | 0 | 113.2 | I71 K72 R73 I77 | I71-L75 HydrophobicContact CG2-CD1 3.83Å; I71-L75 HydrophobicContact CG2-CG 4.31Å; I71-L75 WeakPolarHBondContact O-CB 3.37Å; I71-L75 WeakPolarHBondContact O-CG 3.37Å; I71-L75 PolarHBondContact O-N 3.02Å; K72-L75 CarbonylContact O-C 3.56Å; K72-L75 PolarHBondContact O-N 3.08Å; R73-L75 VanDerWaalsContact C-N 3.29Å; R73-L75 PolarHBondContact O-N 3.4Å; L75-I77 HydrophobicContact CB-CD1 4.02Å; L75-I77 HydrophobicContact CB-CG1 4.04Å; L75-I77 HydrophobicContact CD1-CD1 4.24Å; L75-I77 PolarHBondContact O-N 3.12Å |
| 76 | G | 86.8 | Confident | 90.4 | Very high | 29 Ų | 29 | 99 Ų | 99 | 30% | 0.299 | 50% | 0.499 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.2 | 7.5 | -176 | 0 | 0 | 0 | 0 | 0 | 114.3 | K72 R73 K74 T78 N81 | K72-G76 PolarHBondContact O-N 3.32Å; K72-G76 VanDerWaalsContact O-N 3.08Å; R73-G76 PolarHBondContact O-N 2.87Å; K74-G76 VanDerWaalsContact C-N 3.26Å; G76-T78 PolarHBondContact O-N 2.8Å; G76-N81 VanDerWaalsContact O-CB 3.32Å; G76-N81 WeakPolarHBondContact O-CB 3.32Å; G76-N81 PolarHBondContact O-ND2 2.8Å |
| 77 | I | 85.6 | Confident | 90.1 | Very high | 74 Ų | 74 | 96.7 Ų | 96.7 | 38% | 0.379 | 49% | 0.493 | S | S | . | . | trans | -82.9 | 63.9 | 175.2 | -51.4 | 171.6 | 0 | 0 | 0 | 108.1 | K72 L75 E82 | K72-I77 HydrophobicContact CB-CB 4.46Å; K72-I77 WeakPolarHBondContact CB-O 3.35Å; K72-I77 HydrophobicContact CG-CB 4.46Å; K72-I77 CarbonylContact O-C 3.52Å; K72-I77 WeakPolarHBondContact O-CA 3.32Å; K72-I77 PolarHBondContact O-N 2.94Å; L75-I77 HydrophobicContact CB-CD1 4.02Å; L75-I77 HydrophobicContact CB-CG1 4.04Å; L75-I77 HydrophobicContact CD1-CD1 4.24Å; L75-I77 PolarHBondContact O-N 3.12Å; I77-E82 HydrophobicContact CG2-CG 4.44Å; I77-E82 WeakPolarHBondContact CG2-OE1 3.09Å | ||
| 78 | T | 85.9 | Confident | 89.5 | Confident | 55 Ų | 55 | 94.5 Ų | 94.5 | 34% | 0.337 | 49% | 0.486 | S | S | . | . | trans | -97.9 | 142.9 | 176.6 | -51.8 | 0 | 0 | 0 | 0 | 108.2 | G76 L80 N81 E82 | G76-T78 PolarHBondContact O-N 2.8Å; T78-L80 PolarHBondContact O-N 3.02Å; T78-N81 WeakPolarHBondContact O-CA 3.44Å; T78-N81 WeakPolarHBondContact O-CB 3.42Å; T78-N81 PolarHBondContact O-N 2.99Å; T78-E82 PolarHBondContact O-N 2.86Å | ||
| 79 | P | 83.6 | Confident | 89.2 | Confident | 104 Ų | 104 | 96.5 Ų | 96.5 | 68% | 0.675 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -49.6 | -35.9 | 179.8 | -30.2 | 35.1 | 0 | 0 | 0 | 113.9 | L83 | P79-L83 WeakPolarHBondContact O-CB 3.39Å; P79-L83 PolarHBondContact O-N 2.79Å |
| 80 | L | 84.6 | Confident | 88.9 | Confident | 127 Ų | 127 | 97.5 Ų | 97.5 | 67% | 0.665 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.6 | -37.8 | 175 | -176.9 | 60.9 | 0 | 0 | 0 | 113.3 | T78 K84 | T78-L80 PolarHBondContact O-N 3.02Å; L80-K84 WeakPolarHBondContact O-CB 3.36Å; L80-K84 PolarHBondContact O-N 3.39Å |
| 81 | N | 85.4 | Confident | 88.5 | Confident | 57 Ų | 57 | 103 Ų | 103 | 31% | 0.305 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -71.4 | -40 | 177.6 | -172 | 54.6 | 0 | 0 | 0 | 111.2 | G76 T78 K84 Q85 | G76-N81 VanDerWaalsContact O-CB 3.32Å; G76-N81 WeakPolarHBondContact O-CB 3.32Å; G76-N81 PolarHBondContact O-ND2 2.8Å; T78-N81 WeakPolarHBondContact O-CA 3.44Å; T78-N81 WeakPolarHBondContact O-CB 3.42Å; T78-N81 PolarHBondContact O-N 2.99Å; N81-K84 PolarHBondContact O-N 3.44Å; N81-Q85 PolarHBondContact ND2-NE2 3.42Å; N81-Q85 WeakPolarHBondContact O-CB 3.26Å; N81-Q85 VanDerWaalsContact O-CG 3.26Å; N81-Q85 WeakPolarHBondContact O-CG 3.34Å; N81-Q85 PolarHBondContact O-N 2.89Å |
| 82 | E | 87.2 | Confident | 88 | Confident | 86 Ų | 86 | 103.3 Ų | 103.3 | 40% | 0.402 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62 | -42.5 | 172.7 | -69.9 | -178.4 | -142.9 | 0 | 0 | 111.8 | I77 T78 Q85 N86 | I77-E82 HydrophobicContact CG2-CG 4.44Å; I77-E82 WeakPolarHBondContact CG2-OE1 3.09Å; T78-E82 PolarHBondContact O-N 2.86Å; E82-Q85 PolarHBondContact O-N 2.87Å; E82-N86 WeakPolarHBondContact O-CB 3.42Å; E82-N86 PolarHBondContact O-N 3.01Å; E82-N86 PolarHBondContact O-ND2 2.96Å |
| 83 | L | 87.9 | Confident | 87.6 | Confident | 96 Ų | 96 | 104.6 Ų | 104.6 | 50% | 0.503 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.4 | -49.3 | 175.3 | 179.7 | 63.9 | 0 | 0 | 0 | 111.4 | P79 Q85 N86 I87 | P79-L83 WeakPolarHBondContact O-CB 3.39Å; P79-L83 PolarHBondContact O-N 2.79Å; L83-Q85 VanDerWaalsContact C-N 3.3Å; L83-Q85 PolarHBondContact O-N 3.32Å; L83-N86 PolarHBondContact O-N 2.94Å; L83-I87 HydrophobicContact CD1-CD1 3.71Å; L83-I87 HydrophobicContact CD1-CG1 4.07Å; L83-I87 HydrophobicContact CD2-CD1 4.45Å; L83-I87 HydrophobicContact CG-CD1 3.77Å; L83-I87 HydrophobicContact CG-CG1 4.44Å; L83-I87 WeakPolarHBondContact O-CG1 3.22Å; L83-I87 PolarHBondContact O-N 3.44Å |
| 84 | K | 87.8 | Confident | 87 | Confident | 142 Ų | 142 | 100.8 Ų | 100.8 | 62% | 0.617 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.8 | -45.3 | 177.9 | -177.5 | -178.1 | 175.6 | -176.2 | 0 | 110.9 | L80 N81 T88 | L80-K84 WeakPolarHBondContact O-CB 3.36Å; L80-K84 PolarHBondContact O-N 3.39Å; N81-K84 PolarHBondContact O-N 3.44Å; K84-T88 WeakPolarHBondContact O-CB 3.22Å; K84-T88 PolarHBondContact O-N 2.82Å; K84-T88 PolarHBondContact O-OG1 3.39Å |
| 85 | Q | 89 | Confident | 86.1 | Confident | 115 Ų | 115 | 94 Ų | 94 | 54% | 0.537 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.5 | -43.6 | 178.2 | -74.1 | -177.9 | -8.5 | 0 | 0 | 112.1 | N81 E82 L83 T88 K89 | N81-Q85 PolarHBondContact ND2-NE2 3.42Å; N81-Q85 WeakPolarHBondContact O-CB 3.26Å; N81-Q85 VanDerWaalsContact O-CG 3.26Å; N81-Q85 WeakPolarHBondContact O-CG 3.34Å; N81-Q85 PolarHBondContact O-N 2.89Å; E82-Q85 PolarHBondContact O-N 2.87Å; L83-Q85 VanDerWaalsContact C-N 3.3Å; L83-Q85 PolarHBondContact O-N 3.32Å; Q85-T88 PolarHBondContact O-N 3.27Å; Q85-K89 WeakPolarHBondContact O-CB 3.35Å; Q85-K89 PolarHBondContact O-N 2.86Å |
| 86 | N | 90.2 | Very high | 85.3 | Confident | 95 Ų | 95 | 92.8 Ų | 92.8 | 51% | 0.508 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62 | -48.8 | 176.4 | -87.7 | -81 | 0 | 0 | 0 | 111.7 | E82 L83 T88 K89 T90 | E82-N86 WeakPolarHBondContact O-CB 3.42Å; E82-N86 PolarHBondContact O-N 3.01Å; E82-N86 PolarHBondContact O-ND2 2.96Å; L83-N86 PolarHBondContact O-N 2.94Å; N86-T88 VanDerWaalsContact C-N 3.34Å; N86-T88 PolarHBondContact O-N 3.26Å; N86-K89 PolarHBondContact O-N 3.13Å; N86-T90 WeakPolarHBondContact O-CB 3.38Å; N86-T90 PolarHBondContact O-N 3.41Å; N86-T90 PolarHBondContact O-OG1 2.9Å |
| 87 | I | 89.8 | Confident | 84.9 | Confident | 100 Ų | 100 | 93.9 Ų | 93.9 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.9 | -44.4 | 177.8 | -66.2 | 171.3 | 0 | 0 | 0 | 110.6 | L83 K89 T90 W91 | L83-I87 HydrophobicContact CD1-CD1 3.71Å; L83-I87 HydrophobicContact CD1-CG1 4.07Å; L83-I87 HydrophobicContact CD2-CD1 4.45Å; L83-I87 HydrophobicContact CG-CD1 3.77Å; L83-I87 HydrophobicContact CG-CG1 4.44Å; L83-I87 WeakPolarHBondContact O-CG1 3.22Å; L83-I87 PolarHBondContact O-N 3.44Å; I87-K89 VanDerWaalsContact C-N 3.32Å; I87-K89 PolarHBondContact O-N 2.88Å; I87-T90 PolarHBondContact O-N 3.01Å; I87-W91 WeakPolarHBondContact O-CB 3.19Å; I87-W91 PolarHBondContact O-N 2.82Å |
| 88 | T | 86.9 | Confident | 83.9 | Confident | 54 Ų | 54 | 93.6 Ų | 93.6 | 33% | 0.331 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 178.6 | -58.8 | 0 | 0 | 0 | 0 | 110.6 | K84 Q85 N86 W91 Q92 | K84-T88 WeakPolarHBondContact O-CB 3.22Å; K84-T88 PolarHBondContact O-N 2.82Å; K84-T88 PolarHBondContact O-OG1 3.39Å; Q85-T88 PolarHBondContact O-N 3.27Å; N86-T88 VanDerWaalsContact C-N 3.34Å; N86-T88 PolarHBondContact O-N 3.26Å; T88-W91 PolarHBondContact O-N 3.43Å; T88-Q92 HydrophobicContact CG2-CG 4.42Å; T88-Q92 VanDerWaalsContact O-CB 3.26Å; T88-Q92 WeakPolarHBondContact O-CB 3.41Å; T88-Q92 WeakPolarHBondContact O-CG 3.16Å; T88-Q92 PolarHBondContact O-N 2.86Å |
| 89 | K | 88.4 | Confident | 83.2 | Confident | 137 Ų | 137 | 94 Ų | 94 | 60% | 0.596 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.4 | -49.9 | 177.8 | -174.8 | -178.6 | 177.8 | -174.5 | 0 | 111.4 | Q85 N86 I87 W91 Q92 E93 | Q85-K89 WeakPolarHBondContact O-CB 3.35Å; Q85-K89 PolarHBondContact O-N 2.86Å; N86-K89 PolarHBondContact O-N 3.13Å; I87-K89 VanDerWaalsContact C-N 3.32Å; I87-K89 PolarHBondContact O-N 2.88Å; K89-W91 VanDerWaalsContact C-N 3.32Å; K89-W91 PolarHBondContact O-N 3.5Å; K89-Q92 PolarHBondContact O-N 2.76Å; K89-E93 WeakPolarHBondContact O-CB 3.17Å; K89-E93 PolarHBondContact O-N 2.66Å |
| 90 | T | 88.8 | Confident | 82.5 | Confident | 76 Ų | 76 | 94.9 Ų | 94.9 | 47% | 0.466 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.8 | -39.1 | 178.2 | -57.9 | 0 | 0 | 0 | 0 | 111.6 | N86 I87 E93 V94 | N86-T90 WeakPolarHBondContact O-CB 3.38Å; N86-T90 PolarHBondContact O-N 3.41Å; N86-T90 PolarHBondContact O-OG1 2.9Å; I87-T90 PolarHBondContact O-N 3.01Å; T90-E93 PolarHBondContact O-N 2.85Å; T90-V94 VanDerWaalsContact O-CG2 3.28Å; T90-V94 WeakPolarHBondContact O-CG2 3.28Å; T90-V94 PolarHBondContact O-N 3.2Å |
| 91 | W | 86.3 | Confident | 82 | Confident | 170 Ų | 170 | 94.5 Ų | 94.5 | 64% | 0.644 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -68.4 | -43.6 | 176.5 | -178.4 | 71.5 | 0 | 0 | 0 | 112.3 | I87 T88 K89 E93 V94 T95 | I87-W91 WeakPolarHBondContact O-CB 3.19Å; I87-W91 PolarHBondContact O-N 2.82Å; T88-W91 PolarHBondContact O-N 3.43Å; K89-W91 VanDerWaalsContact C-N 3.32Å; K89-W91 PolarHBondContact O-N 3.5Å; W91-E93 VanDerWaalsContact C-N 3.31Å; W91-E93 PolarHBondContact O-N 3.45Å; W91-V94 PolarHBondContact O-N 3.43Å; W91-T95 HydrophobicContact CD2-CG2 4.47Å; W91-T95 HydrophobicContact CZ2-CG2 4.34Å; W91-T95 WeakPolarHBondContact O-CG2 3.07Å; W91-T95 PolarHBondContact O-N 3.39Å; W91-T95 PolarHBondContact O-OG1 3.33Å |
| 92 | Q | 86.1 | Confident | 81.4 | Confident | 102 Ų | 102 | 99.3 Ų | 99.3 | 48% | 0.477 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.8 | -42.8 | 171.8 | -76.9 | 176.4 | -2.2 | 0 | 0 | 111.1 | T88 K89 V94 T95 T96 | T88-Q92 HydrophobicContact CG2-CG 4.42Å; T88-Q92 VanDerWaalsContact O-CB 3.26Å; T88-Q92 WeakPolarHBondContact O-CB 3.41Å; T88-Q92 WeakPolarHBondContact O-CG 3.16Å; T88-Q92 PolarHBondContact O-N 2.86Å; K89-Q92 PolarHBondContact O-N 2.76Å; Q92-V94 PolarHBondContact O-N 3.32Å; Q92-T95 WeakPolarHBondContact CA-OG1 3.26Å; Q92-T95 PolarHBondContact O-N 3.49Å; Q92-T95 PolarHBondContact O-OG1 2.88Å; Q92-T95 VanDerWaalsContact O-OG1 3.09Å; Q92-T96 VanDerWaalsContact O-CB 3.28Å; Q92-T96 WeakPolarHBondContact O-CB 3.4Å; Q92-T96 WeakPolarHBondContact O-CG2 3.27Å; Q92-T96 PolarHBondContact O-N 2.9Å; Q92-T96 PolarHBondContact O-OG1 3.39Å |
| 93 | E | 85.3 | Confident | 80.6 | Confident | 120 Ų | 120 | 99.7 Ų | 99.7 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.8 | -42.4 | 178.7 | -176.1 | 171.1 | -173.2 | 0 | 0 | 111.4 | K89 T90 W91 S97 | K89-E93 WeakPolarHBondContact O-CB 3.17Å; K89-E93 PolarHBondContact O-N 2.66Å; T90-E93 PolarHBondContact O-N 2.85Å; W91-E93 VanDerWaalsContact C-N 3.31Å; W91-E93 PolarHBondContact O-N 3.45Å; E93-S97 WeakPolarHBondContact O-CA 3.38Å; E93-S97 WeakPolarHBondContact O-CB 3.28Å; E93-S97 PolarHBondContact O-N 2.96Å |
| 94 | V | 78.4 | Confident | 79.6 | Confident | 80 Ų | 80 | 97.2 Ų | 97.2 | 49% | 0.485 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.3 | -43.3 | 175.5 | 170.6 | 0 | 0 | 0 | 0 | 111.4 | T90 W91 Q92 S97 Y100 | T90-V94 VanDerWaalsContact O-CG2 3.28Å; T90-V94 WeakPolarHBondContact O-CG2 3.28Å; T90-V94 PolarHBondContact O-N 3.2Å; W91-V94 PolarHBondContact O-N 3.43Å; Q92-V94 PolarHBondContact O-N 3.32Å; V94-S97 WeakPolarHBondContact O-CB 3.33Å; V94-Y100 WeakPolarHBondContact O-CB 3.46Å |
| 95 | T | 74.3 | Confident | 78.9 | Confident | 35 Ų | 35 | 94.5 Ų | 94.5 | 22% | 0.215 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -75.4 | -31.9 | -177.6 | 52.2 | 0 | 0 | 0 | 0 | 113.5 | W91 Q92 Y100 | W91-T95 HydrophobicContact CD2-CG2 4.47Å; W91-T95 HydrophobicContact CZ2-CG2 4.34Å; W91-T95 WeakPolarHBondContact O-CG2 3.07Å; W91-T95 PolarHBondContact O-N 3.39Å; W91-T95 PolarHBondContact O-OG1 3.33Å; Q92-T95 WeakPolarHBondContact CA-OG1 3.26Å; Q92-T95 PolarHBondContact O-N 3.49Å; Q92-T95 PolarHBondContact O-OG1 2.88Å; Q92-T95 VanDerWaalsContact O-OG1 3.09Å; T95-Y100 HydrophobicContact CG2-CE1 4.22Å; T95-Y100 VanDerWaalsContact O-CD1 3.27Å; T95-Y100 WeakPolarHBondContact O-CD1 3.41Å |
| 96 | T | 72.8 | Confident | 78.1 | Confident | 95 Ų | 95 | 93.4 Ų | 93.4 | 58% | 0.583 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -85.9 | -17.4 | 175.5 | 58.4 | 0 | 0 | 0 | 0 | 112.6 | Q92 T98 | Q92-T96 VanDerWaalsContact O-CB 3.28Å; Q92-T96 WeakPolarHBondContact O-CB 3.4Å; Q92-T96 WeakPolarHBondContact O-CG2 3.27Å; Q92-T96 PolarHBondContact O-N 2.9Å; Q92-T96 PolarHBondContact O-OG1 3.39Å; T96-T98 PolarHBondContact O-N 3.48Å |
| 97 | S | 78.3 | Confident | 77.6 | Confident | 51 Ų | 51 | 94.7 Ų | 94.7 | 36% | 0.357 | 48% | 0.484 | S | S | . | . | S | Bend | trans | -55.1 | 135.4 | 176.8 | 174.8 | 0 | 0 | 0 | 0 | 111 | E93 V94 A99 Y100 R101 | E93-S97 WeakPolarHBondContact O-CA 3.38Å; E93-S97 WeakPolarHBondContact O-CB 3.28Å; E93-S97 PolarHBondContact O-N 2.96Å; V94-S97 WeakPolarHBondContact O-CB 3.33Å; S97-A99 PolarHBondContact O-N 2.8Å; S97-A99 VanDerWaalsContact O-N 3.07Å; S97-A99 PolarHBondContact OG-N 2.61Å; S97-Y100 PolarHBondContact O-N 2.86Å; S97-R101 PolarHBondContact O-N 3.09Å |
| 98 | T | 65.9 | Low | 77.1 | Confident | 69 Ų | 69 | 92.9 Ų | 92.9 | 42% | 0.423 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -56 | -26.8 | 178.7 | -28 | 0 | 0 | 0 | 0 | 112.1 | T96 R102 | T96-T98 PolarHBondContact O-N 3.48Å; T98-R102 HydrophobicContact CG2-CG 4.5Å; T98-R102 VanDerWaalsContact CG2-CZ 3.48Å; T98-R102 WeakPolarHBondContact O-CB 2.92Å; T98-R102 WeakPolarHBondContact O-CG 3.48Å; T98-R102 PolarHBondContact O-N 3.28Å |
| 99 | A | 71.1 | Confident | 76.7 | Confident | 63 Ų | 63 | 95.4 Ų | 95.4 | 52% | 0.521 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -70.6 | -46.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S97 T103 | S97-A99 PolarHBondContact O-N 2.8Å; S97-A99 VanDerWaalsContact O-N 3.07Å; S97-A99 PolarHBondContact OG-N 2.61Å; A99-T103 WeakPolarHBondContact O-CB 3.15Å; A99-T103 PolarHBondContact O-N 3.36Å; A99-T103 PolarHBondContact O-OG1 3.21Å |
| 100 | Y | 68.9 | Low | 76 | Confident | 123 Ų | 123 | 91.2 Ų | 91.2 | 48% | 0.482 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.4 | -42.6 | 175.4 | -177.4 | -93.5 | 0 | 0 | 0 | 111.6 | V94 T95 S97 R102 T103 S104 | V94-Y100 WeakPolarHBondContact O-CB 3.46Å; T95-Y100 HydrophobicContact CG2-CE1 4.22Å; T95-Y100 VanDerWaalsContact O-CD1 3.27Å; T95-Y100 WeakPolarHBondContact O-CD1 3.41Å; S97-Y100 PolarHBondContact O-N 2.86Å; Y100-R102 PolarHBondContact O-N 3.38Å; Y100-T103 PolarHBondContact O-N 3.4Å; Y100-S104 WeakPolarHBondContact O-CB 3.12Å; Y100-S104 PolarHBondContact O-N 3.14Å; Y100-S104 PolarHBondContact O-OG 3.48Å |
| 101 | R | 73.8 | Confident | 75.4 | Confident | 118 Ų | 118 | 90.2 Ų | 90.2 | 45% | 0.445 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.1 | -48.3 | 173.2 | -84 | -169.9 | 58.1 | -121.5 | -11.2 | 111.8 | S97 T103 S104 E105 | S97-R101 PolarHBondContact O-N 3.09Å; R101-T103 PolarHBondContact O-N 3.39Å; R101-S104 WeakPolarHBondContact CA-OG 3.22Å; R101-S104 PolarHBondContact O-N 3.27Å; R101-S104 PolarHBondContact O-OG 3.33Å; R101-E105 IonicContact CZ-OE1 3.54Å; R101-E105 IonicContact NE-OE1 3.6Å; R101-E105 IonicContact NH2-OE1 2.75Å; R101-E105 PolarHBondContact NH2-OE1 3.27Å; R101-E105 WeakPolarHBondContact O-CB 3.41Å; R101-E105 WeakPolarHBondContact O-CG 3.36Å; R101-E105 PolarHBondContact O-N 3.29Å |
| 102 | R | 72.3 | Confident | 75.1 | Confident | 159 Ų | 159 | 87.5 Ų | 87.5 | 60% | 0.6 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -64.3 | -38.3 | 176.8 | -76.6 | -176.5 | -176.8 | 125.8 | -0.2 | 112.9 | T98 Y100 T106 | T98-R102 HydrophobicContact CG2-CG 4.5Å; T98-R102 VanDerWaalsContact CG2-CZ 3.48Å; T98-R102 WeakPolarHBondContact O-CB 2.92Å; T98-R102 WeakPolarHBondContact O-CG 3.48Å; T98-R102 PolarHBondContact O-N 3.28Å; Y100-R102 PolarHBondContact O-N 3.38Å; R102-T106 WeakPolarHBondContact O-CB 3.2Å; R102-T106 PolarHBondContact O-N 3.23Å; R102-T106 PolarHBondContact O-OG1 2.91Å |
| 103 | T | 71.1 | Confident | 74.8 | Confident | 94 Ų | 94 | 89.2 Ų | 89.2 | 58% | 0.577 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -71.6 | -38.9 | 176.8 | -60.3 | 0 | 0 | 0 | 0 | 111.9 | A99 Y100 R101 T106 L107 | A99-T103 WeakPolarHBondContact O-CB 3.15Å; A99-T103 PolarHBondContact O-N 3.36Å; A99-T103 PolarHBondContact O-OG1 3.21Å; Y100-T103 PolarHBondContact O-N 3.4Å; R101-T103 PolarHBondContact O-N 3.39Å; T103-T106 PolarHBondContact O-N 3.07Å; T103-L107 WeakPolarHBondContact O-CB 3.21Å; T103-L107 PolarHBondContact O-N 2.85Å |
| 104 | S | 66.9 | Low | 74.3 | Confident | 43 Ų | 43 | 86.3 Ų | 86.3 | 30% | 0.301 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -69.5 | -39.2 | 175.5 | 67.8 | 0 | 0 | 0 | 0 | 111.9 | Y100 R101 S108 | Y100-S104 WeakPolarHBondContact O-CB 3.12Å; Y100-S104 PolarHBondContact O-N 3.14Å; Y100-S104 PolarHBondContact O-OG 3.48Å; R101-S104 WeakPolarHBondContact CA-OG 3.22Å; R101-S104 PolarHBondContact O-N 3.27Å; R101-S104 PolarHBondContact O-OG 3.33Å; S104-S108 WeakPolarHBondContact O-CB 3.14Å; S104-S108 PolarHBondContact O-N 3.23Å |
| 105 | E | 72.6 | Confident | 73.9 | Confident | 86 Ų | 86 | 87 Ų | 87 | 40% | 0.402 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.8 | -38.9 | 171.8 | -74.2 | 169.7 | -173.9 | 0 | 0 | 110.9 | R101 Q109 | R101-E105 IonicContact CZ-OE1 3.54Å; R101-E105 IonicContact NE-OE1 3.6Å; R101-E105 IonicContact NH2-OE1 2.75Å; R101-E105 PolarHBondContact NH2-OE1 3.27Å; R101-E105 WeakPolarHBondContact O-CB 3.41Å; R101-E105 WeakPolarHBondContact O-CG 3.36Å; R101-E105 PolarHBondContact O-N 3.29Å; E105-Q109 VanDerWaalsContact O-CB 3.29Å; E105-Q109 WeakPolarHBondContact O-CB 3.14Å; E105-Q109 WeakPolarHBondContact O-CG 3.04Å; E105-Q109 PolarHBondContact O-N 2.81Å |
| 106 | T | 72.4 | Confident | 73.9 | Confident | 91 Ų | 91 | 88 Ų | 88 | 56% | 0.558 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -70.2 | -41.5 | 175.7 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | R102 T103 Q109 A110 | R102-T106 WeakPolarHBondContact O-CB 3.2Å; R102-T106 PolarHBondContact O-N 3.23Å; R102-T106 PolarHBondContact O-OG1 2.91Å; T103-T106 PolarHBondContact O-N 3.07Å; T106-Q109 PolarHBondContact O-N 2.79Å; T106-A110 WeakPolarHBondContact O-CA 3.19Å; T106-A110 WeakPolarHBondContact O-CB 3.37Å; T106-A110 PolarHBondContact O-N 2.97Å |
| 107 | L | 80.1 | Confident | 73.6 | Confident | 122 Ų | 122 | 85.8 Ų | 85.8 | 64% | 0.639 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.6 | -40.9 | 175.4 | 179.4 | 63.8 | 0 | 0 | 0 | 110.7 | T103 A110 S111 | T103-L107 WeakPolarHBondContact O-CB 3.21Å; T103-L107 PolarHBondContact O-N 2.85Å; L107-A110 PolarHBondContact O-N 2.92Å; L107-S111 VanDerWaalsContact O-CB 3.23Å; L107-S111 WeakPolarHBondContact O-CB 3.48Å; L107-S111 PolarHBondContact O-N 2.74Å; L107-S111 PolarHBondContact O-OG 3.29Å |
| 108 | S | 79.4 | Confident | 73.1 | Confident | 63 Ų | 63 | 91.2 Ų | 91.2 | 44% | 0.441 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.2 | -42 | 175.7 | -168.1 | 0 | 0 | 0 | 0 | 111.5 | S104 S111 L112 | S104-S108 WeakPolarHBondContact O-CB 3.14Å; S104-S108 PolarHBondContact O-N 3.23Å; S108-S111 WeakPolarHBondContact CA-OG 3.09Å; S108-S111 PolarHBondContact O-N 3.39Å; S108-S111 PolarHBondContact O-OG 3.44Å; S108-L112 WeakPolarHBondContact O-CB 3.48Å; S108-L112 WeakPolarHBondContact O-CG 3.34Å; S108-L112 PolarHBondContact O-N 2.94Å |
| 109 | Q | 76.7 | Confident | 73.4 | Confident | 106 Ų | 106 | 91.7 Ų | 91.7 | 50% | 0.495 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.4 | -39.9 | 172.2 | -79.9 | -171 | 29.2 | 0 | 0 | 112.1 | E105 T106 K113 | E105-Q109 VanDerWaalsContact O-CB 3.29Å; E105-Q109 WeakPolarHBondContact O-CB 3.14Å; E105-Q109 WeakPolarHBondContact O-CG 3.04Å; E105-Q109 PolarHBondContact O-N 2.81Å; T106-Q109 PolarHBondContact O-N 2.79Å; Q109-K113 WeakPolarHBondContact O-CB 3.48Å; Q109-K113 WeakPolarHBondContact O-CD 3.34Å; Q109-K113 WeakPolarHBondContact O-CG 3.46Å; Q109-K113 PolarHBondContact O-N 2.94Å |
| 110 | A | 75.1 | Confident | 73.3 | Confident | 50 Ų | 50 | 94.7 Ų | 94.7 | 41% | 0.413 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -68.6 | -38 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111 | T106 L107 K113 A114 | T106-A110 WeakPolarHBondContact O-CA 3.19Å; T106-A110 WeakPolarHBondContact O-CB 3.37Å; T106-A110 PolarHBondContact O-N 2.97Å; L107-A110 PolarHBondContact O-N 2.92Å; A110-K113 PolarHBondContact O-N 2.72Å; A110-A114 WeakPolarHBondContact O-CA 3.23Å; A110-A114 WeakPolarHBondContact O-CB 3.13Å; A110-A114 PolarHBondContact O-N 3.36Å |
| 111 | S | 76.4 | Confident | 72.8 | Confident | 54 Ų | 54 | 95 Ų | 95 | 38% | 0.378 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -69 | -41.2 | 176.1 | 71 | 0 | 0 | 0 | 0 | 111 | L107 S108 T115 | L107-S111 VanDerWaalsContact O-CB 3.23Å; L107-S111 WeakPolarHBondContact O-CB 3.48Å; L107-S111 PolarHBondContact O-N 2.74Å; L107-S111 PolarHBondContact O-OG 3.29Å; S108-S111 WeakPolarHBondContact CA-OG 3.09Å; S108-S111 PolarHBondContact O-N 3.39Å; S108-S111 PolarHBondContact O-OG 3.44Å; S111-T115 WeakPolarHBondContact O-CB 3.32Å; S111-T115 PolarHBondContact O-N 2.75Å; S111-T115 PolarHBondContact O-OG1 3.39Å |
| 112 | L | 80 | Confident | 72.4 | Confident | 113 Ų | 113 | 91.3 Ų | 91.3 | 59% | 0.592 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65 | -45.1 | 173.4 | -70.4 | 170.8 | 0 | 0 | 0 | 111.6 | S108 T115 A116 | S108-L112 WeakPolarHBondContact O-CB 3.48Å; S108-L112 WeakPolarHBondContact O-CG 3.34Å; S108-L112 PolarHBondContact O-N 2.94Å; L112-T115 PolarHBondContact O-N 2.9Å; L112-A116 WeakPolarHBondContact O-CB 3.19Å; L112-A116 PolarHBondContact O-N 3.48Å |
| 113 | K | 78.2 | Confident | 72 | Confident | 139 Ų | 139 | 87.5 Ų | 87.5 | 60% | 0.604 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -67.3 | -38.7 | 177.9 | -73.4 | 170.9 | -178 | 173.2 | 0 | 112.1 | Q109 A110 A116 A117 | Q109-K113 WeakPolarHBondContact O-CB 3.48Å; Q109-K113 WeakPolarHBondContact O-CD 3.34Å; Q109-K113 WeakPolarHBondContact O-CG 3.46Å; Q109-K113 PolarHBondContact O-N 2.94Å; A110-K113 PolarHBondContact O-N 2.72Å; K113-A116 PolarHBondContact O-N 3.31Å; K113-A117 WeakPolarHBondContact O-CB 3.29Å; K113-A117 PolarHBondContact O-N 3.34Å |
| 114 | A | 74.9 | Confident | 71.5 | Confident | 58 Ų | 58 | 85.7 Ų | 85.7 | 48% | 0.479 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68 | -40.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | A110 A116 A117 F118 | A110-A114 WeakPolarHBondContact O-CA 3.23Å; A110-A114 WeakPolarHBondContact O-CB 3.13Å; A110-A114 PolarHBondContact O-N 3.36Å; A114-A116 VanDerWaalsContact C-N 3.35Å; A114-A117 PolarHBondContact O-N 3.01Å; A114-F118 VanDerWaalsContact O-CB 3.23Å; A114-F118 WeakPolarHBondContact O-CB 3.23Å; A114-F118 PolarHBondContact O-N 3.44Å |
| 115 | T | 69.9 | Low | 71.3 | Confident | 94 Ų | 94 | 89.4 Ų | 89.4 | 58% | 0.577 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.6 | -42.8 | 174.4 | -58.8 | 0 | 0 | 0 | 0 | 110.8 | S111 L112 F118 S119 | S111-T115 WeakPolarHBondContact O-CB 3.32Å; S111-T115 PolarHBondContact O-N 2.75Å; S111-T115 PolarHBondContact O-OG1 3.39Å; L112-T115 PolarHBondContact O-N 2.9Å; T115-F118 PolarHBondContact O-N 3.4Å; T115-S119 WeakPolarHBondContact O-CB 3.45Å; T115-S119 PolarHBondContact O-N 3.38Å |
| 116 | A | 75.4 | Confident | 70.8 | Confident | 58 Ų | 58 | 88.8 Ų | 88.8 | 48% | 0.479 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.5 | -43.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L112 K113 A114 S119 N120 | L112-A116 WeakPolarHBondContact O-CB 3.19Å; L112-A116 PolarHBondContact O-N 3.48Å; K113-A116 PolarHBondContact O-N 3.31Å; A114-A116 VanDerWaalsContact C-N 3.35Å; A116-S119 PolarHBondContact O-N 2.81Å; A116-N120 PolarHBondContact O-N 2.89Å |
| 117 | A | 67.3 | Low | 70.4 | Confident | 47 Ų | 47 | 91.8 Ų | 91.8 | 39% | 0.388 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | K113 A114 N120 M121 | K113-A117 WeakPolarHBondContact O-CB 3.29Å; K113-A117 PolarHBondContact O-N 3.34Å; A114-A117 PolarHBondContact O-N 3.01Å; A117-N120 PolarHBondContact O-N 3.41Å; A117-M121 WeakPolarHBondContact O-CG 3.18Å; A117-M121 PolarHBondContact O-N 3.31Å |
| 118 | F | 67.4 | Low | 69.5 | Low | 166 Ų | 166 | 92.9 Ų | 92.9 | 73% | 0.728 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.4 | -43.5 | 175.4 | -174.4 | -97.7 | 0 | 0 | 0 | 111.4 | A114 T115 N120 M121 G122 | A114-F118 VanDerWaalsContact O-CB 3.23Å; A114-F118 WeakPolarHBondContact O-CB 3.23Å; A114-F118 PolarHBondContact O-N 3.44Å; T115-F118 PolarHBondContact O-N 3.4Å; F118-N120 VanDerWaalsContact C-N 3.32Å; F118-N120 PolarHBondContact O-N 2.73Å; F118-M121 PolarHBondContact O-N 2.64Å; F118-G122 PolarHBondContact O-N 3.48Å |
| 119 | S | 71.7 | Confident | 68.6 | Low | 79 Ų | 79 | 96.9 Ų | 96.9 | 55% | 0.552 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -59.4 | -42.5 | 173.1 | -170.7 | 0 | 0 | 0 | 0 | 111.8 | T115 A116 G122 S123 | T115-S119 WeakPolarHBondContact O-CB 3.45Å; T115-S119 PolarHBondContact O-N 3.38Å; A116-S119 PolarHBondContact O-N 2.81Å; S119-G122 PolarHBondContact O-N 3.41Å; S119-S123 PolarHBondContact O-N 2.87Å |
| 120 | N | 68.9 | Low | 67.9 | Low | 125 Ų | 125 | 97.6 Ų | 97.6 | 67% | 0.668 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.9 | -39.3 | 176.9 | -111.1 | 53.1 | 0 | 0 | 0 | 113.3 | A116 A117 F118 S123 A124 | A116-N120 PolarHBondContact O-N 2.89Å; A117-N120 PolarHBondContact O-N 3.41Å; F118-N120 VanDerWaalsContact C-N 3.32Å; F118-N120 PolarHBondContact O-N 2.73Å; N120-S123 PolarHBondContact O-N 2.73Å; N120-A124 PolarHBondContact O-N 3.43Å; N120-A124 VanDerWaalsContact O-N 3.08Å |
| 121 | M | 57.8 | Low | 67.2 | Low | 130 Ų | 130 | 99.6 Ų | 99.6 | 64% | 0.64 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -72 | -34.1 | 176.2 | -66.2 | -159.3 | -148.9 | 0 | 0 | 112.5 | A117 F118 S123 A124 I125 | A117-M121 WeakPolarHBondContact O-CG 3.18Å; A117-M121 PolarHBondContact O-N 3.31Å; F118-M121 PolarHBondContact O-N 2.64Å; M121-S123 VanDerWaalsContact C-N 3.34Å; M121-A124 PolarHBondContact O-N 2.75Å; M121-I125 WeakPolarHBondContact O-CG1 3.35Å; M121-I125 PolarHBondContact O-N 2.8Å; M121-I125 VanDerWaalsContact O-N 3.15Å |
| 122 | G | 65.2 | Low | 66.3 | Low | 41 Ų | 41 | 101.2 Ų | 101.2 | 42% | 0.423 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.2 | -40.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | F118 S119 I125 S126 | F118-G122 PolarHBondContact O-N 3.48Å; S119-G122 PolarHBondContact O-N 3.41Å; G122-I125 PolarHBondContact O-N 2.83Å; G122-S126 WeakPolarHBondContact O-CB 3.19Å; G122-S126 PolarHBondContact O-N 3.44Å |
| 123 | S | 65.4 | Low | 65.1 | Low | 78 Ų | 78 | 98.5 Ų | 98.5 | 55% | 0.545 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -68.6 | -36.8 | 177.3 | -148.6 | 0 | 0 | 0 | 0 | 112.6 | S119 N120 M121 S126 K127 | S119-S123 PolarHBondContact O-N 2.87Å; N120-S123 PolarHBondContact O-N 2.73Å; M121-S123 VanDerWaalsContact C-N 3.34Å; S123-S126 PolarHBondContact O-N 3.06Å; S123-K127 WeakPolarHBondContact O-CB 3.33Å; S123-K127 PolarHBondContact O-N 2.95Å |
| 124 | A | 60.7 | Low | 64 | Low | 56 Ų | 56 | 97.3 Ų | 97.3 | 46% | 0.463 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67.5 | -37.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | N120 M121 K128 | N120-A124 PolarHBondContact O-N 3.43Å; N120-A124 VanDerWaalsContact O-N 3.08Å; M121-A124 PolarHBondContact O-N 2.75Å; A124-K128 WeakPolarHBondContact O-CB 3.42Å; A124-K128 WeakPolarHBondContact O-CG 3.38Å; A124-K128 PolarHBondContact O-N 2.95Å |
| 125 | I | 61.3 | Low | 63 | Low | 122 Ų | 122 | 100.3 Ų | 100.3 | 63% | 0.626 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -71.5 | -42.7 | 174.7 | -64.3 | 166.1 | 0 | 0 | 0 | 110.4 | M121 G122 K127 K128 F129 | M121-I125 WeakPolarHBondContact O-CG1 3.35Å; M121-I125 PolarHBondContact O-N 2.8Å; M121-I125 VanDerWaalsContact O-N 3.15Å; G122-I125 PolarHBondContact O-N 2.83Å; I125-K127 VanDerWaalsContact C-N 3.29Å; I125-K127 PolarHBondContact O-N 3.36Å; I125-K128 PolarHBondContact O-N 2.66Å; I125-F129 WeakPolarHBondContact O-CB 3.06Å; I125-F129 PolarHBondContact O-N 3.44Å |
| 126 | S | 61.8 | Low | 61.9 | Low | 72 Ų | 72 | 99.9 Ų | 99.9 | 50% | 0.503 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -61.9 | -39 | 175.6 | -163 | 0 | 0 | 0 | 0 | 111.5 | G122 S123 F129 E130 | G122-S126 WeakPolarHBondContact O-CB 3.19Å; G122-S126 PolarHBondContact O-N 3.44Å; S123-S126 PolarHBondContact O-N 3.06Å; S126-F129 PolarHBondContact O-N 2.97Å; S126-E130 WeakPolarHBondContact O-CB 3.39Å; S126-E130 PolarHBondContact O-N 2.99Å |
| 127 | K | 64.6 | Low | 60.8 | Low | 155 Ų | 155 | 103 Ų | 103 | 67% | 0.674 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -69.3 | -35.4 | 176 | -165.2 | 168.6 | -173.9 | 166.6 | 0 | 112.5 | S123 I125 D131 | S123-K127 WeakPolarHBondContact O-CB 3.33Å; S123-K127 PolarHBondContact O-N 2.95Å; I125-K127 VanDerWaalsContact C-N 3.29Å; I125-K127 PolarHBondContact O-N 3.36Å; K127-D131 WeakPolarHBondContact O-CB 3.33Å; K127-D131 PolarHBondContact O-N 3.41Å |
| 128 | K | 62.1 | Low | 60.2 | Low | 145 Ų | 145 | 107.9 Ų | 107.9 | 63% | 0.63 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -70.6 | -34.3 | 172 | -72.1 | -101.9 | 175.8 | -86.4 | 0 | 112 | A124 I125 V132 | A124-K128 WeakPolarHBondContact O-CB 3.42Å; A124-K128 WeakPolarHBondContact O-CG 3.38Å; A124-K128 PolarHBondContact O-N 2.95Å; I125-K128 PolarHBondContact O-N 2.66Å; K128-V132 VanDerWaalsContact O-CB 3.32Å; K128-V132 WeakPolarHBondContact O-CB 3.36Å; K128-V132 WeakPolarHBondContact O-CG2 3.19Å; K128-V132 PolarHBondContact O-N 2.92Å |
| 129 | F | 59.8 | Low | 59 | Low | 147 Ų | 147 | 106.7 Ų | 106.7 | 65% | 0.645 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -72.2 | -38.5 | 174.6 | -177.3 | -98.7 | 0 | 0 | 0 | 111.8 | I125 S126 S133 | I125-F129 WeakPolarHBondContact O-CB 3.06Å; I125-F129 PolarHBondContact O-N 3.44Å; S126-F129 PolarHBondContact O-N 2.97Å; F129-S133 WeakPolarHBondContact O-CA 3.47Å; F129-S133 WeakPolarHBondContact O-CB 3Å; F129-S133 PolarHBondContact O-N 3.25Å |
| 130 | E | 63 | Low | 57.5 | Low | 120 Ų | 120 | 108.5 Ų | 108.5 | 56% | 0.561 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -64.4 | -44.4 | 172.5 | -172 | 166.2 | -155.4 | 0 | 0 | 111 | S126 S133 L134 | S126-E130 WeakPolarHBondContact O-CB 3.39Å; S126-E130 PolarHBondContact O-N 2.99Å; E130-S133 PolarHBondContact O-N 3.3Å; E130-L134 HydrophobicContact CG-CD1 4.19Å; E130-L134 WeakPolarHBondContact O-CB 3.43Å; E130-L134 WeakPolarHBondContact O-CG 3.43Å; E130-L134 PolarHBondContact O-N 2.78Å |
| 131 | D | 60 | Low | 56.8 | Low | 92 Ų | 92 | 107.7 Ų | 107.7 | 49% | 0.492 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -63.2 | -44.4 | 176.2 | -160.8 | 25.6 | 0 | 0 | 0 | 112 | K127 L134 Q135 | K127-D131 WeakPolarHBondContact O-CB 3.33Å; K127-D131 PolarHBondContact O-N 3.41Å; D131-L134 PolarHBondContact O-N 3.46Å; D131-Q135 WeakPolarHBondContact O-CB 3.36Å; D131-Q135 PolarHBondContact O-N 2.96Å |
| 132 | V | 57.3 | Low | 56.6 | Low | 88 Ų | 88 | 107 Ų | 107 | 53% | 0.533 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -71.6 | -34.8 | 175.9 | 173.1 | 0 | 0 | 0 | 0 | 112.2 | K128 Q135 S136 | K128-V132 VanDerWaalsContact O-CB 3.32Å; K128-V132 WeakPolarHBondContact O-CB 3.36Å; K128-V132 WeakPolarHBondContact O-CG2 3.19Å; K128-V132 PolarHBondContact O-N 2.92Å; V132-Q135 PolarHBondContact O-N 3.32Å; V132-S136 WeakPolarHBondContact O-CA 3.36Å; V132-S136 WeakPolarHBondContact O-CB 3.16Å; V132-S136 PolarHBondContact O-N 2.88Å |
| 133 | S | 55.2 | Low | 56.1 | Low | 56 Ų | 56 | 113.6 Ų | 113.6 | 39% | 0.392 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -69.7 | -34.8 | 176.1 | -174 | 0 | 0 | 0 | 0 | 111.6 | F129 E130 I137 | F129-S133 WeakPolarHBondContact O-CA 3.47Å; F129-S133 WeakPolarHBondContact O-CB 3Å; F129-S133 PolarHBondContact O-N 3.25Å; E130-S133 PolarHBondContact O-N 3.3Å; S133-I137 WeakPolarHBondContact O-CD1 3.21Å; S133-I137 WeakPolarHBondContact O-CG1 3.32Å |
| 134 | L | 54.7 | Low | 55.9 | Low | 115 Ų | 115 | 115 Ų | 115 | 60% | 0.602 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -73.7 | -37.2 | 173.4 | -69.7 | 173.4 | 0 | 0 | 0 | 111.4 | E130 D131 | E130-L134 HydrophobicContact CG-CD1 4.19Å; E130-L134 WeakPolarHBondContact O-CB 3.43Å; E130-L134 WeakPolarHBondContact O-CG 3.43Å; E130-L134 PolarHBondContact O-N 2.78Å; D131-L134 PolarHBondContact O-N 3.46Å |
| 135 | Q | 53.5 | Low | 55.8 | Low | 121 Ų | 121 | 116.3 Ų | 116.3 | 57% | 0.565 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -77.8 | -28.6 | 178.1 | -158.5 | 168.3 | 13.2 | 0 | 0 | 113.3 | D131 V132 I137 Q138 | D131-Q135 WeakPolarHBondContact O-CB 3.36Å; D131-Q135 PolarHBondContact O-N 2.96Å; V132-Q135 PolarHBondContact O-N 3.32Å; Q135-I137 PolarHBondContact O-N 3.46Å; Q135-Q138 PolarHBondContact O-N 2.84Å |
| 136 | S | 46.8 | Very low | 55.8 | Low | 85 Ų | 85 | 116.9 Ų | 116.9 | 59% | 0.594 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -15.1 | 176.1 | -177.5 | 0 | 0 | 0 | 0 | 113.2 | V132 Q138 | V132-S136 WeakPolarHBondContact O-CA 3.36Å; V132-S136 WeakPolarHBondContact O-CB 3.16Å; V132-S136 PolarHBondContact O-N 2.88Å; S136-Q138 VanDerWaalsContact C-N 3.26Å |
| 137 | I | 52.5 | Low | 55.6 | Low | 124 Ų | 124 | 125 Ų | 125 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -11.6 | 174.5 | -67.2 | 167.7 | 0 | 0 | 0 | 111.4 | S133 Q135 | S133-I137 WeakPolarHBondContact O-CD1 3.21Å; S133-I137 WeakPolarHBondContact O-CG1 3.32Å; Q135-I137 PolarHBondContact O-N 3.46Å |
| 138 | Q | 54.7 | Low | 55.2 | Low | 149 Ų | 149 | 124.3 Ų | 124.3 | 70% | 0.696 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.9 | -11 | -174.6 | -69.2 | -76.9 | -53.5 | 0 | 0 | 115.3 | Q135 S136 | Q135-Q138 PolarHBondContact O-N 2.84Å; S136-Q138 VanDerWaalsContact C-N 3.26Å |
| 139 | H | 42.7 | Very low | 55 | Low | 141 Ų | 141 | 119.1 Ų | 119.1 | 65% | 0.653 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -131.5 | 86.2 | 179.3 | -63.7 | -72.6 | 0 | 0 | 0 | 112.1 | ||
| 140 | S | 40 | Very low | 54.9 | Low | 116 Ų | 116 | 117.5 Ų | 117.5 | 81% | 0.811 | 66% | 0.662 | S | S | * | * | trans | 19.7 | 111.3 | 141.3 | -46.4 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 141 | A | 52.8 | Low | 54.6 | Low | 108 Ų | 108 | 117.4 Ų | 117.4 | 89% | 0.893 | 67% | 0.67 | S | S | * | * | trans | 45.6 | 83.6 | 143.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 142 | S | 54.1 | Low | 54.7 | Low | 116 Ų | 116 | 121.2 Ų | 121.2 | 81% | 0.811 | 68% | 0.682 | S | S | * | * | trans | -154.6 | 109.2 | 146.8 | -173.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 143 | M | 55.1 | Low | 55 | Low | 180 Ų | 180 | 124.7 Ų | 124.7 | 89% | 0.887 | 69% | 0.69 | S | S | * | * | trans | -65.2 | 132.3 | -179.6 | -65.1 | 175 | 76.5 | 0 | 0 | 111.2 | A145 | M143-A145 PolarHBondContact O-N 3.21Š| ||
| 144 | P | 60.5 | Low | 55.3 | Low | 106 Ų | 106 | 124.6 Ų | 124.6 | 69% | 0.688 | 69% | 0.689 | S | S | * | * | trans | -74.8 | 108.7 | 167.8 | -14.4 | 30 | 0 | 0 | 0 | 109.5 | I146 | P144-I146 HydrophobicContact CB-CD1 4.03Å; P144-I146 HydrophobicContact CB-CG1 3.72Å; P144-I146 WeakPolarHBondContact O-CG1 3.22Å; P144-I146 PolarHBondContact O-N 2.85Å | ||
| 145 | A | 60.3 | Low | 55.6 | Low | 84 Ų | 84 | 124.4 Ų | 124.4 | 69% | 0.694 | 69% | 0.688 | S | S | * | * | trans | -72.4 | 70.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | M143 R147 | M143-A145 PolarHBondContact O-N 3.21Å; A145-R147 PolarHBondContact O-N 2.75Å | ||
| 146 | I | 59.4 | Low | 56.3 | Low | 135 Ų | 135 | 124.9 Ų | 124.9 | 69% | 0.692 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -84.1 | 1.8 | 178.7 | -20.7 | -176.5 | 0 | 0 | 0 | 112.4 | P144 | P144-I146 HydrophobicContact CB-CD1 4.03Å; P144-I146 HydrophobicContact CB-CG1 3.72Å; P144-I146 WeakPolarHBondContact O-CG1 3.22Å; P144-I146 PolarHBondContact O-N 2.85Å |
| 147 | R | 57.7 | Low | 57 | Low | 243 Ų | 243 | 127.3 Ų | 127.3 | 92% | 0.917 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -90.3 | -7.1 | -177 | -75.6 | -172.2 | 165.8 | 135.8 | -2 | 115 | A145 | A145-R147 PolarHBondContact O-N 2.75Š|
| 148 | N | 56.8 | Low | 57.6 | Low | 140 Ų | 140 | 128.1 Ų | 128.1 | 75% | 0.749 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -111.7 | 17.1 | 177.9 | -63.1 | -41.8 | 0 | 0 | 0 | 113.2 | P150 | N148-P150 WeakPolarHBondContact O-CD 3.36Š|
| 149 | A | 58.6 | Low | 58 | Low | 36 Ų | 36 | 125.5 Ų | 125.5 | 30% | 0.298 | 69% | 0.685 | S | S | . | * | trans | -62.7 | 124.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | T151 F152 | A149-T151 PolarHBondContact O-N 3.32Å; A149-F152 PolarHBondContact O-N 2.8Å | ||
| 150 | P | 57.7 | Low | 58.8 | Low | 113 Ų | 113 | 125.5 Ų | 125.5 | 73% | 0.734 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -53.3 | -23.8 | -179.2 | -26.1 | 32.8 | 0 | 0 | 0 | 114 | N148 S154 | N148-P150 WeakPolarHBondContact O-CD 3.36Å; P150-S154 PolarHBondContact O-N 2.9Å |
| 151 | T | 57.2 | Low | 59.7 | Low | 118 Ų | 118 | 124.5 Ų | 124.5 | 72% | 0.724 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -66.4 | -29.6 | 178.7 | 21.3 | 0 | 0 | 0 | 0 | 114.5 | A149 | A149-T151 PolarHBondContact O-N 3.32Å |
| 152 | F | 61.8 | Low | 60 | Low | 171 Ų | 171 | 125.8 Ų | 125.8 | 75% | 0.75 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -81.5 | -34.6 | 179.5 | -140.8 | -95.5 | 0 | 0 | 0 | 111.9 | A149 S154 L155 | A149-F152 PolarHBondContact O-N 2.8Å; F152-S154 VanDerWaalsContact C-N 3.33Å; F152-S154 PolarHBondContact O-N 3.46Å; F152-L155 PolarHBondContact O-N 3.21Å |
| 153 | K | 62.6 | Low | 60 | Low | 161 Ų | 161 | 129.7 Ų | 129.7 | 70% | 0.7 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -64.1 | -36.5 | 176.5 | -125.2 | -172.4 | -179.7 | -161.8 | 0 | 112.7 | L155 E156 E157 | K153-L155 PolarHBondContact O-N 2.81Å; K153-E156 PolarHBondContact O-N 3.41Å; K153-E157 PolarHBondContact O-N 2.86Å |
| 154 | S | 61.2 | Low | 59.9 | Low | 55 Ų | 55 | 126.7 Ų | 126.7 | 39% | 0.385 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -68.5 | -21.7 | -179.5 | -168.9 | 0 | 0 | 0 | 0 | 113.5 | P150 F152 K158 | P150-S154 PolarHBondContact O-N 2.9Å; F152-S154 VanDerWaalsContact C-N 3.33Å; F152-S154 PolarHBondContact O-N 3.46Å; S154-K158 WeakPolarHBondContact O-CD 3.15Å; S154-K158 WeakPolarHBondContact O-CG 3.22Å; S154-K158 PolarHBondContact O-N 3.45Å |
| 155 | L | 62.2 | Low | 59.5 | Low | 111 Ų | 111 | 130.7 Ų | 130.7 | 58% | 0.581 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -80.2 | -39.1 | 177.2 | -172.5 | 142.1 | 0 | 0 | 0 | 112 | F152 K153 K158 V159 | F152-L155 PolarHBondContact O-N 3.21Å; K153-L155 PolarHBondContact O-N 2.81Å; L155-K158 PolarHBondContact O-N 3.35Å; L155-V159 HydrophobicContact CD2-CG2 4.43Å; L155-V159 WeakPolarHBondContact O-CG2 3.43Å; L155-V159 PolarHBondContact O-N 2.73Å |
| 156 | E | 68.1 | Low | 59.1 | Low | 130 Ų | 130 | 134 Ų | 134 | 61% | 0.607 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -59.5 | -48.6 | 175.3 | -175 | 173.3 | -150.4 | 0 | 0 | 111.2 | K153 K158 V159 E160 | K153-E156 PolarHBondContact O-N 3.41Å; E156-K158 VanDerWaalsContact C-N 3.28Å; E156-K158 PolarHBondContact O-N 3.46Å; E156-V159 PolarHBondContact O-N 3.15Å; E156-E160 PolarHBondContact O-N 3.43Å; E156-E160 VanDerWaalsContact O-N 3.14Å |
| 157 | E | 61.6 | Low | 58.2 | Low | 136 Ų | 136 | 133.2 Ų | 133.2 | 64% | 0.636 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -61.6 | -33.7 | 179.3 | -169.4 | -180 | -179.6 | 0 | 0 | 112.9 | K153 T161 | K153-E157 PolarHBondContact O-N 2.86Å; E157-T161 PolarHBondContact O-OG1 3.08Å |
| 158 | K | 64.6 | Low | 57.5 | Low | 142 Ų | 142 | 127 Ų | 127 | 62% | 0.617 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -78.1 | -24.2 | 180 | -78.4 | 174.3 | 174.5 | -76.7 | 0 | 113.9 | S154 L155 E156 T161 | S154-K158 WeakPolarHBondContact O-CD 3.15Å; S154-K158 WeakPolarHBondContact O-CG 3.22Å; S154-K158 PolarHBondContact O-N 3.45Å; L155-K158 PolarHBondContact O-N 3.35Å; E156-K158 VanDerWaalsContact C-N 3.28Å; E156-K158 PolarHBondContact O-N 3.46Å; K158-T161 PolarHBondContact O-OG1 2.88Å |
| 159 | V | 63.8 | Low | 56.6 | Low | 93 Ų | 93 | 126.6 Ų | 126.6 | 56% | 0.564 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -88.5 | -29.9 | 177.8 | 177.6 | 0 | 0 | 0 | 0 | 111.3 | L155 E156 L162 | L155-V159 HydrophobicContact CD2-CG2 4.43Å; L155-V159 WeakPolarHBondContact O-CG2 3.43Å; L155-V159 PolarHBondContact O-N 2.73Å; E156-V159 PolarHBondContact O-N 3.15Å; V159-L162 PolarHBondContact O-N 3.43Å |
| 160 | E | 58.9 | Low | 56.1 | Low | 141 Ų | 141 | 130.7 Ų | 130.7 | 66% | 0.659 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -67.3 | -36.1 | 177.4 | -167 | 166.3 | -165 | 0 | 0 | 112.7 | E156 L162 K163 | E156-E160 PolarHBondContact O-N 3.43Å; E156-E160 VanDerWaalsContact O-N 3.14Å; E160-L162 PolarHBondContact O-N 2.92Å; E160-K163 PolarHBondContact O-N 3.48Å |
| 161 | T | 59.6 | Low | 55.4 | Low | 95 Ų | 95 | 130.5 Ų | 130.5 | 58% | 0.583 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | -13.2 | 177.8 | 49.9 | 0 | 0 | 0 | 0 | 114.7 | E157 K158 | E157-T161 PolarHBondContact O-OG1 3.08Å; K158-T161 PolarHBondContact O-OG1 2.88Å |
| 162 | L | 57.4 | Low | 54.7 | Low | 136 Ų | 136 | 130.7 Ų | 130.7 | 71% | 0.712 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | -17.5 | 177.6 | -90.1 | 154.6 | 0 | 0 | 0 | 113.4 | V159 E160 | V159-L162 PolarHBondContact O-N 3.43Å; E160-L162 PolarHBondContact O-N 2.92Å |
| 163 | K | 54.9 | Low | 53.5 | Low | 197 Ų | 197 | 127.2 Ų | 127.2 | 86% | 0.857 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -89.9 | -12.7 | -176.3 | -149.8 | -178.9 | 171.8 | -171.4 | 0 | 113.8 | E160 | E160-K163 PolarHBondContact O-N 3.48Š|
| 164 | T | 52.7 | Low | 52.3 | Low | 118 Ų | 118 | 127.5 Ų | 127.5 | 72% | 0.724 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -98.7 | 2.3 | -173 | 12.1 | 0 | 0 | 0 | 0 | 115.4 | ||
| 165 | K | 52.9 | Low | 51.6 | Low | 190 Ų | 190 | 132.9 Ų | 132.9 | 83% | 0.826 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -127.2 | 45.7 | -177.7 | -154.7 | -179.5 | 179.5 | -175.6 | 0 | 114 | ||
| 166 | I | 50.4 | Low | 50.4 | Low | 153 Ų | 153 | 135.6 Ų | 135.6 | 79% | 0.785 | 73% | 0.731 | S | S | * | * | trans | -139.2 | 78.1 | 159 | -52.3 | 177 | 0 | 0 | 0 | 108 | ||||
| 167 | T | 40.9 | Very low | 48.8 | Very low | 119 Ų | 119 | 133.1 Ų | 133.1 | 73% | 0.73 | 74% | 0.74 | S | S | * | * | trans | -138.7 | 104 | 160.4 | -44.4 | 0 | 0 | 0 | 0 | 106.3 | T169 | T167-T169 PolarHBondContact O-N 3.36Š| ||
| 168 | P | 44.3 | Very low | 47.5 | Very low | 111 Ų | 111 | 133.9 Ų | 133.9 | 72% | 0.721 | 75% | 0.748 | S | S | * | * | trans | -77 | 102.1 | 170 | 25 | -17.7 | 0 | 0 | 0 | 107.6 | T170 | P168-T170 PolarHBondContact O-N 2.93Å; P168-T170 VanDerWaalsContact O-N 3.13Å | ||
| 169 | T | 37.6 | Very low | 46.4 | Very low | 132 Ų | 132 | 133 Ų | 133 | 81% | 0.81 | 75% | 0.754 | S | S | * | * | trans | -63.6 | 107.3 | 168.3 | -61.3 | 0 | 0 | 0 | 0 | 109 | T167 | T167-T169 PolarHBondContact O-N 3.36Š| ||
| 170 | T | 47.5 | Very low | 45.8 | Very low | 122 Ų | 122 | 133.7 Ų | 133.7 | 75% | 0.748 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 133.4 | 168.2 | -24.4 | 0 | 0 | 0 | 0 | 108.8 | P168 | P168-T170 PolarHBondContact O-N 2.93Å; P168-T170 VanDerWaalsContact O-N 3.13Å |
| 171 | P | 42.5 | Very low | 44.6 | Very low | 109 Ų | 109 | 135.6 Ų | 135.6 | 71% | 0.708 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 158.5 | 171.7 | 31 | -31.6 | 0 | 0 | 0 | 111.3 | ||
| 172 | P | 44 | Very low | 43.5 | Very low | 123 Ų | 123 | 136.5 Ų | 136.5 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 150.3 | -162.4 | 30.9 | -34.9 | 0 | 0 | 0 | 114.5 | ||
| 173 | S | 36.5 | Very low | 42.5 | Very low | 97 Ų | 97 | 135.7 Ų | 135.7 | 68% | 0.678 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 134.8 | 170.1 | 174.9 | 0 | 0 | 0 | 0 | 112.9 | ||
| 174 | N | 37.3 | Very low | 41.8 | Very low | 167 Ų | 167 | 134.7 Ų | 134.7 | 89% | 0.893 | 78% | 0.775 | S | S | * | * | trans | -112.8 | 124.7 | 149.7 | -78.6 | -44.7 | 0 | 0 | 0 | 107.9 | ||||
| 175 | Q | 46.2 | Very low | 41.1 | Very low | 169 Ų | 169 | 133.8 Ų | 133.8 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | trans | -82.3 | 139.3 | 170.6 | -67.9 | 172.8 | 36.5 | 0 | 0 | 109.5 | ||||
| 176 | D | 36.7 | Very low | 40.4 | Very low | 168 Ų | 168 | 131.9 Ų | 131.9 | 90% | 0.898 | 77% | 0.771 | S | S | * | * | trans | 164.1 | 113.7 | 148.1 | -89.8 | -21.4 | 0 | 0 | 0 | 104.4 | ||||
| 177 | G | 34.4 | Very low | 40 | Very low | 77 Ų | 77 | 131.9 Ų | 131.9 | 79% | 0.794 | 77% | 0.771 | S | S | * | * | cis | 118.9 | 84.7 | 34.2 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 178 | N | 33.3 | Very low | 39.8 | Very low | 153 Ų | 153 | 131.7 Ų | 131.7 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -172.4 | 102.7 | 145.7 | -152.4 | 9.1 | 0 | 0 | 0 | 112.4 | ||||
| 179 | V | 42.7 | Very low | 39.8 | Very low | 123 Ų | 123 | 134.1 Ų | 134.1 | 75% | 0.745 | 78% | 0.776 | S | S | * | * | trans | -0.2 | 170.8 | 143.1 | -132.1 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 180 | P | 51.5 | Low | 40 | Very low | 108 Ų | 108 | 133.8 Ų | 133.8 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | -124.1 | 178.7 | -87.8 | 41.2 | -25.1 | 0 | 0 | 0 | 112.8 | |||||
| 181 | E | 32.7 | Very low | 39.5 | Very low | 180 Ų | 180 | 136.1 Ų | 136.1 | 84% | 0.841 | 78% | 0.779 | S | S | * | * | trans | -169.9 | 123.7 | 130.3 | -111.3 | 179.4 | 144.8 | 0 | 0 | 111.9 | ||||
| 182 | T | 36.3 | Very low | 39.3 | Very low | 114 Ų | 114 | 138.8 Ų | 138.8 | 70% | 0.699 | 79% | 0.787 | S | S | * | * | trans | 28.1 | 121.7 | 142.1 | 35.8 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 183 | T | 37.8 | Very low | 39.4 | Very low | 120 Ų | 120 | 136.8 Ų | 136.8 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | -167.2 | 138.2 | 100.4 | 36.4 | 0 | 0 | 0 | 0 | 112 | |||||
| 184 | E | 39.4 | Very low | 39.7 | Very low | 176 Ų | 176 | 138.2 Ų | 138.2 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | trans | 64.5 | 105.9 | 141.1 | -64.3 | -175.2 | 117.3 | 0 | 0 | 118.8 | ||||
| 185 | S | 39 | Very low | 40.2 | Very low | 98 Ų | 98 | 136.1 Ų | 136.1 | 69% | 0.685 | 78% | 0.781 | S | S | * | * | 103.6 | 91.7 | 82.2 | -163.8 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 186 | L | 36.4 | Very low | 40 | Very low | 151 Ų | 151 | 137 Ų | 137 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | 63.9 | 97.4 | 114 | -63.6 | 177.5 | 0 | 0 | 0 | 112.5 | |||||
| 187 | I | 42.2 | Very low | 40.4 | Very low | 152 Ų | 152 | 136.5 Ų | 136.5 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | 81.2 | 101.5 | 101.2 | -153.8 | 73.1 | 0 | 0 | 0 | 111.6 | Q189 | I187-Q189 PolarHBondContact O-N 2.97Š| |||
| 188 | S | 38.3 | Very low | 41.6 | Very low | 116 Ų | 116 | 136.7 Ų | 136.7 | 81% | 0.811 | 78% | 0.777 | S | S | * | * | trans | -73.1 | 110.5 | 163.7 | -54 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 189 | Q | 42.8 | Very low | 42.9 | Very low | 162 Ų | 162 | 135.1 Ų | 135.1 | 76% | 0.757 | 78% | 0.775 | S | S | * | * | trans | -173 | 142.9 | 145.7 | -111.1 | 168.2 | 69.3 | 0 | 0 | 109.3 | I187 | I187-Q189 PolarHBondContact O-N 2.97Š| ||
| 190 | P | 43.3 | Very low | 43.1 | Very low | 124 Ų | 124 | 137.8 Ų | 137.8 | 81% | 0.805 | 78% | 0.782 | S | S | * | * | -134.2 | 132.3 | 90.2 | 33.4 | -19.8 | 0 | 0 | 0 | 112.9 | |||||
| 191 | E | 36.7 | Very low | 42.9 | Very low | 171 Ų | 171 | 145.4 Ų | 145.4 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | trans | -89.5 | 121 | 144.2 | -74.7 | -114.7 | 132 | 0 | 0 | 106.4 | ||||
| 192 | D | 37.7 | Very low | 43.4 | Very low | 165 Ų | 165 | 143.7 Ų | 143.7 | 88% | 0.882 | 81% | 0.806 | S | S | * | * | trans | -152.5 | 141.3 | 151.8 | -119.1 | -36.6 | 0 | 0 | 0 | 110 | ||||
| 193 | A | 46.1 | Very low | 43.7 | Very low | 81 Ų | 81 | 145.2 Ų | 145.2 | 67% | 0.669 | 81% | 0.812 | S | S | * | * | trans | -65.2 | 154.4 | -156.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 194 | P | 42.4 | Very low | 44.1 | Very low | 128 Ų | 128 | 146.6 Ų | 146.6 | 83% | 0.831 | 82% | 0.816 | S | S | * | * | trans | -86.2 | 115 | 145.4 | 30.9 | -23.7 | 0 | 0 | 0 | 109.2 | Q196 | P194-Q196 PolarHBondContact O-N 3Š| ||
| 195 | T | 48.9 | Very low | 44.3 | Very low | 122 Ų | 122 | 144.9 Ų | 144.9 | 75% | 0.748 | 82% | 0.815 | S | S | * | * | trans | -44.2 | 123.3 | 165.6 | -58 | 0 | 0 | 0 | 0 | 110.8 | D197 | T195-D197 PolarHBondContact O-N 3.23Š| ||
| 196 | Q | 42.2 | Very low | 44.7 | Very low | 189 Ų | 189 | 147.8 Ų | 147.8 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | trans | -69 | 107.7 | 163.4 | -158.2 | -175.4 | 17 | 0 | 0 | 107 | P194 | P194-Q196 PolarHBondContact O-N 3Š| ||
| 197 | D | 44.5 | Very low | 45.2 | Very low | 156 Ų | 156 | 147.6 Ų | 147.6 | 83% | 0.834 | 83% | 0.826 | S | S | * | * | trans | -117.8 | 124.8 | 162.7 | -134.9 | -18.8 | 0 | 0 | 0 | 108.3 | T195 | T195-D197 PolarHBondContact O-N 3.23Š| ||
| 198 | A | 59.3 | Low | 45.4 | Very low | 82 Ų | 82 | 147.3 Ų | 147.3 | 68% | 0.678 | 83% | 0.829 | S | S | * | * | trans | -90.2 | 173.5 | -173.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 199 | P | 60.1 | Low | 46 | Very low | 119 Ų | 119 | 149.7 Ų | 149.7 | 77% | 0.773 | 83% | 0.83 | S | S | * | * | trans | -85.7 | 161.3 | -153.2 | 36.6 | -35.2 | 0 | 0 | 0 | 113 | ||||
| 200 | M | 48.1 | Very low | 46.3 | Very low | 180 Ų | 180 | 148.7 Ų | 148.7 | 89% | 0.887 | 84% | 0.836 | S | S | * | * | trans | -172.4 | 102.1 | 142.2 | -86.4 | -124.3 | -77.4 | 0 | 0 | 111 | ||||
| 201 | Q | 45.8 | Very low | 46.5 | Very low | 267 Ų | 267 | 150.9 Ų | 150.9 | 100% | 1.248 | 84% | 0.839 | S | S | * | * | 162.8 | 0 | 121.5 | -84.9 | -168.7 | 36.7 | 0 | 0 | 110.9 |
Retrieved 201 of 201 residues in 310.7 ms
(Link to these results)