| 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 | 46.8 | Very low | 55.8 | Low | 249 Ų | 249 | 116.5 Ų | 116.5 | 100% | 1.227 | 65% | 0.652 | S | S | * | * | 0 | 96.2 | 0 | -69 | 170.8 | 173.4 | 0 | 0 | 108.3 | |||||
| 2 | Q | 50.5 | Low | 56.4 | Low | 157 Ų | 157 | 115 Ų | 115 | 73% | 0.734 | 64% | 0.641 | S | S | * | * | trans | -135.3 | 69.7 | -174.4 | -155.9 | 171.7 | 32.2 | 0 | 0 | 109.4 | ||||
| 3 | A | 53.5 | Low | 57 | Low | 79 Ų | 79 | 113.2 Ų | 113.2 | 65% | 0.653 | 64% | 0.635 | S | S | * | * | trans | -121.3 | 9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 4 | P | 56.3 | Low | 57.5 | Low | 88 Ų | 88 | 112.7 Ų | 112.7 | 57% | 0.571 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -79.6 | -29.3 | 179.7 | 30.2 | -31.7 | 0 | 0 | 0 | 112.8 | L8 | P4-L8 VanDerWaalsContact O-CB 3.31Å; P4-L8 WeakPolarHBondContact O-CB 3.5Å; P4-L8 PolarHBondContact O-N 3.23Å |
| 5 | R | 51.8 | Low | 57.6 | Low | 191 Ų | 191 | 110.4 Ų | 110.4 | 72% | 0.721 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -75.4 | -41.1 | -170.1 | -69 | -176.4 | 166.5 | 170.8 | -4.3 | 113.7 | L8 V9 | R5-L8 PolarHBondContact O-N 3.01Å; R5-V9 WeakPolarHBondContact O-CG2 3.1Å; R5-V9 PolarHBondContact O-N 3Å |
| 6 | A | 52.4 | Low | 57.5 | Low | 76 Ų | 76 | 111.3 Ų | 111.3 | 63% | 0.628 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -67.7 | -39.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | L8 V9 F10 | A6-L8 VanDerWaalsContact C-N 3.34Å; A6-V9 PolarHBondContact O-N 3.46Å; A6-F10 PolarHBondContact O-N 3.34Å |
| 7 | A | 57.4 | Low | 57.1 | Low | 62 Ų | 62 | 109.7 Ų | 109.7 | 51% | 0.512 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -64.7 | -38.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F10 A11 | A7-F10 PolarHBondContact O-N 3.13Å; A7-A11 WeakPolarHBondContact O-CB 3.09Å; A7-A11 PolarHBondContact O-N 2.95Å |
| 8 | L | 59.2 | Low | 56.6 | Low | 115 Ų | 115 | 110.4 Ų | 110.4 | 60% | 0.602 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -68.6 | -40 | 178.6 | -153.9 | 158.3 | 0 | 0 | 0 | 111.7 | P4 R5 A6 F10 A11 L12 | P4-L8 VanDerWaalsContact O-CB 3.31Å; P4-L8 WeakPolarHBondContact O-CB 3.5Å; P4-L8 PolarHBondContact O-N 3.23Å; R5-L8 PolarHBondContact O-N 3.01Å; A6-L8 VanDerWaalsContact C-N 3.34Å; L8-F10 VanDerWaalsContact C-N 3.33Å; L8-F10 PolarHBondContact O-N 2.93Å; L8-A11 PolarHBondContact O-N 2.96Å; L8-L12 VanDerWaalsContact O-CB 3.3Å; L8-L12 WeakPolarHBondContact O-CB 3.3Å; L8-L12 PolarHBondContact O-N 3.05Å |
| 9 | V | 61.7 | Low | 56 | Low | 89 Ų | 89 | 110.2 Ų | 110.2 | 54% | 0.539 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -64 | -40.6 | 173.2 | 175.4 | 0 | 0 | 0 | 0 | 110.8 | R5 A6 L12 V13 | R5-V9 WeakPolarHBondContact O-CG2 3.1Å; R5-V9 PolarHBondContact O-N 3Å; A6-V9 PolarHBondContact O-N 3.46Å; V9-L12 PolarHBondContact O-N 3.09Å; V9-V13 VanDerWaalsContact O-CG2 3.31Å; V9-V13 WeakPolarHBondContact O-CG2 3.35Å; V9-V13 PolarHBondContact O-N 2.83Å |
| 10 | F | 59.4 | Low | 55.5 | Low | 118 Ų | 118 | 108.9 Ų | 108.9 | 52% | 0.518 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -64.9 | -40.5 | 176.4 | -138.9 | -89.5 | 0 | 0 | 0 | 112 | A6 A7 L8 V13 I14 L92 | A6-F10 PolarHBondContact O-N 3.34Å; A7-F10 PolarHBondContact O-N 3.13Å; L8-F10 VanDerWaalsContact C-N 3.33Å; L8-F10 PolarHBondContact O-N 2.93Å; F10-V13 PolarHBondContact O-N 3.28Å; F10-I14 HydrophobicContact CD1-CD1 3.84Å; F10-I14 HydrophobicContact CE1-CD1 4.19Å; F10-I14 VanDerWaalsContact O-CG1 3.32Å; F10-I14 WeakPolarHBondContact O-CG1 3.46Å; F10-I14 PolarHBondContact O-N 3.34Å; F10-I14 VanDerWaalsContact O-N 3.1Å; F10-L92 HydrophobicContact CZ-CD1 4.42Å |
| 11 | A | 64.3 | Low | 54.7 | Low | 57 Ų | 57 | 113.4 Ų | 113.4 | 47% | 0.471 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -66.8 | -38.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A7 L8 I14 A15 | A7-A11 WeakPolarHBondContact O-CB 3.09Å; A7-A11 PolarHBondContact O-N 2.95Å; L8-A11 PolarHBondContact O-N 2.96Å; A11-I14 PolarHBondContact O-N 3.5Å; A11-A15 VanDerWaalsContact O-CB 3.29Å; A11-A15 WeakPolarHBondContact O-CB 3.46Å; A11-A15 PolarHBondContact O-N 3.05Å |
| 12 | L | 64.1 | Low | 54.3 | Low | 99 Ų | 99 | 104.6 Ų | 104.6 | 52% | 0.518 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -65.2 | -41.9 | 177.3 | -171.8 | 68.6 | 0 | 0 | 0 | 110.9 | L8 V9 A15 L16 | L8-L12 VanDerWaalsContact O-CB 3.3Å; L8-L12 WeakPolarHBondContact O-CB 3.3Å; L8-L12 PolarHBondContact O-N 3.05Å; V9-L12 PolarHBondContact O-N 3.09Å; L12-A15 PolarHBondContact O-N 3.46Å; L12-L16 HydrophobicContact CD1-CD1 3.69Å; L12-L16 HydrophobicContact CG-CD1 3.78Å; L12-L16 WeakPolarHBondContact O-CD1 3.28Å; L12-L16 PolarHBondContact O-N 3.05Å |
| 13 | V | 63.8 | Low | 53.3 | Low | 92 Ų | 92 | 104.1 Ų | 104.1 | 56% | 0.558 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -65.9 | -40.4 | 176.5 | 173.5 | 0 | 0 | 0 | 0 | 111.3 | V9 F10 A15 L16 V17 | V9-V13 VanDerWaalsContact O-CG2 3.31Å; V9-V13 WeakPolarHBondContact O-CG2 3.35Å; V9-V13 PolarHBondContact O-N 2.83Å; F10-V13 PolarHBondContact O-N 3.28Å; V13-A15 VanDerWaalsContact C-N 3.32Å; V13-A15 PolarHBondContact O-N 3.36Å; V13-L16 PolarHBondContact O-N 3.47Å; V13-V17 WeakPolarHBondContact O-CG2 3.31Å; V13-V17 PolarHBondContact O-N 2.93Å; V13-V17 VanDerWaalsContact O-N 3.17Å |
| 14 | I | 63.3 | Low | 52.4 | Low | 106 Ų | 106 | 109.1 Ų | 109.1 | 54% | 0.544 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -66.7 | -33.9 | 174.4 | -66.4 | 169.2 | 0 | 0 | 0 | 111.5 | F10 A11 | F10-I14 HydrophobicContact CD1-CD1 3.84Å; F10-I14 HydrophobicContact CE1-CD1 4.19Å; F10-I14 VanDerWaalsContact O-CG1 3.32Å; F10-I14 WeakPolarHBondContact O-CG1 3.46Å; F10-I14 PolarHBondContact O-N 3.34Å; F10-I14 VanDerWaalsContact O-N 3.1Å; A11-I14 PolarHBondContact O-N 3.5Å |
| 15 | A | 59.7 | Low | 51.6 | Low | 78 Ų | 78 | 112.9 Ų | 112.9 | 65% | 0.645 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -75.5 | -27.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A11 L12 V13 | A11-A15 VanDerWaalsContact O-CB 3.29Å; A11-A15 WeakPolarHBondContact O-CB 3.46Å; A11-A15 PolarHBondContact O-N 3.05Å; L12-A15 PolarHBondContact O-N 3.46Å; V13-A15 VanDerWaalsContact C-N 3.32Å; V13-A15 PolarHBondContact O-N 3.36Å |
| 16 | L | 56.4 | Low | 50.8 | Low | 124 Ų | 124 | 113.2 Ų | 113.2 | 65% | 0.649 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -83.5 | -16.5 | 174.8 | -91.7 | 84.7 | 0 | 0 | 0 | 113.3 | L12 V13 P18 | L12-L16 HydrophobicContact CD1-CD1 3.69Å; L12-L16 HydrophobicContact CG-CD1 3.78Å; L12-L16 WeakPolarHBondContact O-CD1 3.28Å; L12-L16 PolarHBondContact O-N 3.05Å; V13-L16 PolarHBondContact O-N 3.47Å; L16-P18 VanDerWaalsContact O-CD 3.24Å; L16-P18 WeakPolarHBondContact O-CD 3.24Å |
| 17 | V | 50.1 | Low | 50.2 | Low | 85 Ų | 85 | 117.4 Ų | 117.4 | 52% | 0.515 | 67% | 0.666 | S | S | . | * | S | Bend | trans | -65.2 | 117.2 | 165.5 | 172.3 | 0 | 0 | 0 | 0 | 106.3 | V13 V19 | V13-V17 WeakPolarHBondContact O-CG2 3.31Å; V13-V17 PolarHBondContact O-N 2.93Å; V13-V17 VanDerWaalsContact O-N 3.17Å; V17-V19 PolarHBondContact O-N 3.37Å |
| 18 | P | 48.7 | Very low | 49 | Very low | 122 Ų | 122 | 122.8 Ų | 122.8 | 79% | 0.792 | 68% | 0.68 | S | S | * | * | trans | -66.8 | 91.9 | 177.2 | -10.8 | 26.3 | 0 | 0 | 0 | 107.2 | L16 G20 | L16-P18 VanDerWaalsContact O-CD 3.24Å; L16-P18 WeakPolarHBondContact O-CD 3.24Å; P18-G20 VanDerWaalsContact C-N 3.26Å; P18-G20 PolarHBondContact O-N 3.47Å | ||
| 19 | V | 45.3 | Very low | 47.6 | Very low | 106 Ų | 106 | 125.2 Ų | 125.2 | 64% | 0.642 | 69% | 0.688 | S | S | * | * | trans | -60.1 | 102.4 | 159 | 161.1 | 0 | 0 | 0 | 0 | 104 | V17 R21 | V17-V19 PolarHBondContact O-N 3.37Å; V19-R21 HydrophobicContact CG1-CB 3.78Å; V19-R21 PolarHBondContact O-N 3.35Å | ||
| 20 | G | 45.8 | Very low | 46.4 | Very low | 85 Ų | 85 | 127 Ų | 127 | 88% | 0.876 | 71% | 0.705 | S | S | * | * | trans | -58.7 | 80.9 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | P18 | P18-G20 VanDerWaalsContact C-N 3.26Å; P18-G20 PolarHBondContact O-N 3.47Å | ||
| 21 | R | 37.6 | Very low | 44.9 | Very low | 203 Ų | 203 | 124.2 Ų | 124.2 | 77% | 0.766 | 71% | 0.709 | S | S | * | * | trans | -117.9 | 96.7 | 172.7 | 179.8 | 169.9 | -177.1 | 147.5 | 0.1 | 104.4 | V19 N23 | V19-R21 HydrophobicContact CG1-CB 3.78Å; V19-R21 PolarHBondContact O-N 3.35Å; R21-N23 PolarHBondContact O-N 3.17Å | ||
| 22 | G | 39.5 | Very low | 43.2 | Very low | 65 Ų | 65 | 128.8 Ų | 128.8 | 67% | 0.67 | 73% | 0.725 | S | S | * | * | trans | -48.4 | 127.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 23 | N | 30 | Very low | 41.4 | Very low | 147 Ų | 147 | 129.5 Ų | 129.5 | 79% | 0.786 | 73% | 0.734 | S | S | * | * | trans | -154.1 | 91.9 | 156.1 | -82.3 | -29.7 | 0 | 0 | 0 | 103.5 | R21 E25 | R21-N23 PolarHBondContact O-N 3.17Å; N23-E25 PolarHBondContact O-N 3.49Å | ||
| 24 | F | 34.8 | Very low | 39.7 | Very low | 183 Ų | 183 | 130.5 Ų | 130.5 | 80% | 0.803 | 74% | 0.741 | S | S | * | * | trans | -61.4 | 122.9 | 165.4 | -89.5 | -101.2 | 0 | 0 | 0 | 107.7 | ||||
| 25 | E | 37.9 | Very low | 38.2 | Very low | 167 Ų | 167 | 134.2 Ų | 134.2 | 78% | 0.78 | 76% | 0.756 | S | S | * | * | trans | 55.6 | 89.5 | 135 | -53.1 | -177.7 | 156.7 | 0 | 0 | 117.2 | N23 | N23-E25 PolarHBondContact O-N 3.49Š| ||
| 26 | E | 35.7 | Very low | 36.9 | Very low | 199 Ų | 199 | 139.8 Ų | 139.8 | 93% | 0.93 | 77% | 0.768 | S | S | * | * | trans | -128.3 | 74.5 | 143.6 | -162.9 | 178.2 | 132.6 | 0 | 0 | 107.6 | ||||
| 27 | L | 39.9 | Very low | 35.7 | Very low | 164 Ų | 164 | 138.4 Ų | 138.4 | 86% | 0.859 | 77% | 0.769 | S | S | * | * | trans | -132.2 | 74.6 | 170.2 | -179.4 | 85.8 | 0 | 0 | 0 | 107.8 | ||||
| 28 | E | 31.8 | Very low | 34.8 | Very low | 174 Ų | 174 | 143 Ų | 143 | 81% | 0.813 | 79% | 0.785 | S | S | * | * | trans | -163 | 131.9 | 149.5 | -66.7 | -154.4 | 99.6 | 0 | 0 | 103.6 | ||||
| 29 | H | 30.2 | Very low | 34.2 | Very low | 167 Ų | 167 | 148.2 Ų | 148.2 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | cis | -173.3 | 125.4 | 43.5 | -158.3 | 85.6 | 0 | 0 | 0 | 106.5 | ||||
| 30 | S | 35.3 | Very low | 34 | Very low | 127 Ų | 127 | 148.5 Ų | 148.5 | 89% | 0.888 | 79% | 0.793 | S | S | * | * | trans | -136 | 130.7 | 174.7 | -179.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 31 | G | 29.9 | Very low | 33.4 | Very low | 59 Ų | 59 | 151.3 Ų | 151.3 | 61% | 0.608 | 79% | 0.788 | S | S | * | * | trans | 94.8 | 139.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 32 | D | 26.7 | Very low | 33.3 | Very low | 152 Ų | 152 | 150 Ų | 150 | 81% | 0.813 | 79% | 0.79 | S | S | * | * | cis | -163.7 | 152.8 | 0.8 | -177.8 | 12.5 | 0 | 0 | 0 | 106.1 | ||||
| 33 | T | 26.6 | Very low | 33.2 | Very low | 115 Ų | 115 | 153.2 Ų | 153.2 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | -67 | 150.8 | 177 | 42.2 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 34 | T | 27.7 | Very low | 33.4 | Very low | 113 Ų | 113 | 151.7 Ų | 151.7 | 69% | 0.693 | 79% | 0.793 | S | S | * | * | trans | 129.6 | 108.2 | 134.3 | -52.8 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 35 | E | 33.3 | Very low | 33.7 | Very low | 184 Ų | 184 | 149.1 Ų | 149.1 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | 58.2 | 113.1 | 143.4 | -59.9 | -178.6 | 167.5 | 0 | 0 | 121.8 | ||||
| 36 | E | 31.4 | Very low | 33.9 | Very low | 194 Ų | 194 | 145.2 Ų | 145.2 | 91% | 0.907 | 78% | 0.782 | S | S | * | * | -147.7 | 131.2 | 125.4 | -157.2 | 175.4 | 136.2 | 0 | 0 | 111.2 | |||||
| 37 | S | 30.6 | Very low | 34.3 | Very low | 95 Ų | 95 | 141.1 Ų | 141.1 | 66% | 0.664 | 78% | 0.775 | S | S | * | * | trans | -62.5 | 138.3 | 170.2 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 38 | E | 31.3 | Very low | 34.8 | Very low | 183 Ų | 183 | 138.6 Ų | 138.6 | 86% | 0.855 | 76% | 0.761 | S | S | * | * | 177.8 | 148.3 | 86.7 | -166.6 | 167.6 | 130.4 | 0 | 0 | 109.3 | |||||
| 39 | R | 37.8 | Very low | 35.5 | Very low | 231 Ų | 231 | 139 Ų | 139 | 87% | 0.872 | 76% | 0.76 | S | S | * | * | trans | -89.5 | -178.1 | -174.9 | -79.5 | -165.5 | -89.8 | 168.9 | -10.7 | 112.6 | ||||
| 40 | P | 40.1 | Very low | 36.3 | Very low | 112 Ų | 112 | 134.8 Ų | 134.8 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | cis | -135 | 154.1 | -48.5 | 36.5 | -20.4 | 0 | 0 | 0 | 112.9 | ||||
| 41 | N | 33 | Very low | 36.8 | Very low | 144 Ų | 144 | 132.4 Ų | 132.4 | 77% | 0.77 | 74% | 0.742 | S | S | * | * | trans | -145.9 | 100.9 | 150.8 | 61.2 | -15 | 0 | 0 | 0 | 113.1 | ||||
| 42 | E | 36.1 | Very low | 37.6 | Very low | 174 Ų | 174 | 133.8 Ų | 133.8 | 81% | 0.813 | 74% | 0.739 | S | S | * | * | trans | 37.4 | 103.3 | 136.3 | 47.2 | -150.7 | 145.6 | 0 | 0 | 122.2 | ||||
| 43 | V | 36.5 | Very low | 38.4 | Very low | 134 Ų | 134 | 131.7 Ų | 131.7 | 81% | 0.812 | 73% | 0.732 | S | S | * | * | 73.2 | 102.9 | 119.5 | 173 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 44 | T | 34.8 | Very low | 39.5 | Very low | 115 Ų | 115 | 129.5 Ų | 129.5 | 71% | 0.706 | 73% | 0.725 | S | S | * | * | 143.9 | 95.4 | 124.2 | -55.2 | 0 | 0 | 0 | 0 | 113 | |||||
| 45 | T | 40.6 | Very low | 40.2 | Very low | 129 Ų | 129 | 129.2 Ų | 129.2 | 79% | 0.791 | 72% | 0.723 | S | S | * | * | trans | 38.4 | 146.2 | 137 | 19.6 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 46 | P | 42.9 | Very low | 40.9 | Very low | 85 Ų | 85 | 128.1 Ų | 128.1 | 55% | 0.552 | 72% | 0.719 | S | S | * | * | trans | -90.3 | 150.1 | -145.3 | 36.3 | -39.3 | 0 | 0 | 0 | 115.8 | I48 | P46-I48 HydrophobicContact CB-CD1 4.21Å; P46-I48 HydrophobicContact CB-CG1 4.04Å; P46-I48 HydrophobicContact CG-CD1 3.43Å; P46-I48 VanDerWaalsContact CG-CD1 3.43Å; P46-I48 HydrophobicContact CG-CG1 3.74Å; P46-I48 PolarHBondContact O-N 3.22Å | ||
| 47 | S | 44.8 | Very low | 41.5 | Very low | 113 Ų | 113 | 124.4 Ų | 124.4 | 79% | 0.79 | 71% | 0.709 | S | S | * | * | trans | -60.7 | 73.4 | 161.3 | 176.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 48 | I | 48.8 | Very low | 42.3 | Very low | 110 Ų | 110 | 127.1 Ų | 127.1 | 56% | 0.564 | 72% | 0.715 | S | S | * | * | trans | -97.6 | -3.4 | 174 | -73.2 | 176.3 | 0 | 0 | 0 | 112.1 | P46 | P46-I48 HydrophobicContact CB-CD1 4.21Å; P46-I48 HydrophobicContact CB-CG1 4.04Å; P46-I48 HydrophobicContact CG-CD1 3.43Å; P46-I48 VanDerWaalsContact CG-CD1 3.43Å; P46-I48 HydrophobicContact CG-CG1 3.74Å; P46-I48 PolarHBondContact O-N 3.22Å | ||
| 49 | F | 48 | Very low | 43.1 | Very low | 183 Ų | 183 | 124 Ų | 124 | 80% | 0.803 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -90.8 | -5.9 | -178.3 | -82.2 | -86.6 | 0 | 0 | 0 | 115.4 | ||
| 50 | A | 46.4 | Very low | 43.3 | Very low | 79 Ų | 79 | 117 Ų | 117 | 65% | 0.653 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -88.5 | -12.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 51 | A | 45.5 | Very low | 43.5 | Very low | 76 Ų | 76 | 117.5 Ų | 117.5 | 63% | 0.628 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -95.1 | -12.5 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 52 | V | 47.8 | Very low | 44.5 | Very low | 88 Ų | 88 | 118.2 Ų | 118.2 | 53% | 0.533 | 70% | 0.699 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.3 | -12.5 | -174.2 | -178.4 | 0 | 0 | 0 | 0 | 112.8 | ||
| 53 | T | 42.8 | Very low | 45.1 | Very low | 108 Ų | 108 | 114.8 Ų | 114.8 | 66% | 0.663 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | 1.5 | 179.3 | -23.7 | 0 | 0 | 0 | 0 | 114.2 | ||
| 54 | A | 49.4 | Very low | 45.8 | Very low | 70 Ų | 70 | 114.4 Ų | 114.4 | 58% | 0.579 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -98.8 | -10 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 55 | T | 42.3 | Very low | 46.2 | Very low | 106 Ų | 106 | 112.9 Ų | 112.9 | 65% | 0.65 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -99.8 | -20.9 | -175.5 | -49.5 | 0 | 0 | 0 | 0 | 113 | T57 | T55-T57 VanDerWaalsContact C-N 3.34Å; T55-T57 PolarHBondContact O-N 3.39Å |
| 56 | E | 48.4 | Very low | 46.8 | Very low | 162 Ų | 162 | 114 Ų | 114 | 76% | 0.757 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | 2.7 | -177.9 | -64.7 | -172.5 | 105.2 | 0 | 0 | 114.5 | ||
| 57 | T | 43.4 | Very low | 47.5 | Very low | 116 Ų | 116 | 115.3 Ų | 115.3 | 71% | 0.712 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.2 | 3.2 | 177.2 | 56.7 | 0 | 0 | 0 | 0 | 114.7 | T55 | T55-T57 VanDerWaalsContact C-N 3.34Å; T55-T57 PolarHBondContact O-N 3.39Å |
| 58 | L | 48.9 | Very low | 48.6 | Very low | 152 Ų | 152 | 113.6 Ų | 113.6 | 80% | 0.796 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -107.8 | -1 | -175.6 | -142.2 | 121.1 | 0 | 0 | 0 | 114.8 | ||
| 59 | T | 47.5 | Very low | 49.3 | Very low | 117 Ų | 117 | 111.4 Ų | 111.4 | 72% | 0.718 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -130.5 | 25.7 | -173.9 | -37.7 | 0 | 0 | 0 | 0 | 113.6 | ||
| 60 | A | 40.8 | Very low | 50.8 | Low | 85 Ų | 85 | 106.8 Ų | 106.8 | 70% | 0.702 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -112.2 | 0.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 61 | N | 44.9 | Very low | 52.4 | Low | 121 Ų | 121 | 110 Ų | 110 | 65% | 0.647 | 65% | 0.653 | S | S | * | * | trans | -116.8 | 52.5 | -179.3 | -162.5 | 50 | 0 | 0 | 0 | 112.9 | N63 | N61-N63 VanDerWaalsContact C-N 3.32Å; N61-N63 PolarHBondContact OD1-ND2 3.47Å; N61-N63 PolarHBondContact OD1-OD1 3.36Å | ||
| 62 | I | 53.8 | Low | 54.2 | Low | 159 Ų | 159 | 111.3 Ų | 111.3 | 82% | 0.815 | 65% | 0.65 | S | S | * | * | trans | -105.2 | 35.2 | 157.4 | 33.6 | 168.5 | 0 | 0 | 0 | 109.1 | ||||
| 63 | N | 49.2 | Very low | 56 | Low | 103 Ų | 103 | 112 Ų | 112 | 55% | 0.551 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -71.4 | 135 | 162.3 | 68.1 | 28 | 0 | 0 | 0 | 107.4 | N61 T65 | N61-N63 VanDerWaalsContact C-N 3.32Å; N61-N63 PolarHBondContact OD1-ND2 3.47Å; N61-N63 PolarHBondContact OD1-OD1 3.36Å; N63-T65 VanDerWaalsContact C-N 3.32Å; N63-T65 PolarHBondContact O-N 2.9Å |
| 64 | S | 50.7 | Low | 58.1 | Low | 125 Ų | 125 | 110.5 Ų | 110.5 | 87% | 0.874 | 64% | 0.635 | S | S | * | * | trans | -49.9 | 93.2 | 176.9 | -58.7 | 0 | 0 | 0 | 0 | 110.6 | D66 | S64-D66 PolarHBondContact O-N 3.4Š| ||
| 65 | T | 43.6 | Very low | 59.9 | Low | 84 Ų | 84 | 113.1 Ų | 113.1 | 52% | 0.515 | 64% | 0.635 | S | S | . | * | trans | -83.5 | 105.1 | 160.9 | -49.3 | 0 | 0 | 0 | 0 | 105 | N63 I67 | N63-T65 VanDerWaalsContact C-N 3.32Å; N63-T65 PolarHBondContact O-N 2.9Å; T65-I67 HydrophobicContact CG2-CD1 3.22Å; T65-I67 HydrophobicContact CG2-CG1 3.58Å; T65-I67 PolarHBondContact O-N 3.24Å | ||
| 66 | D | 53 | Low | 62.1 | Low | 152 Ų | 152 | 114.3 Ų | 114.3 | 81% | 0.813 | 63% | 0.632 | S | S | * | * | trans | -55.6 | 75.6 | 154.9 | -175.9 | 33.9 | 0 | 0 | 0 | 107.3 | S64 A68 | S64-D66 PolarHBondContact O-N 3.4Å; D66-A68 PolarHBondContact O-N 3.48Å | ||
| 67 | I | 58.5 | Low | 64.1 | Low | 113 Ų | 113 | 110.3 Ų | 110.3 | 58% | 0.579 | 61% | 0.614 | S | S | * | * | trans | -77.1 | 82.1 | 171.9 | -57.4 | -79.3 | 0 | 0 | 0 | 103.5 | T65 P69 | T65-I67 HydrophobicContact CG2-CD1 3.22Å; T65-I67 HydrophobicContact CG2-CG1 3.58Å; T65-I67 PolarHBondContact O-N 3.24Å; I67-P69 WeakPolarHBondContact O-CD 3.43Å | ||
| 68 | A | 66.4 | Low | 66.4 | Low | 76 Ų | 76 | 109 Ų | 109 | 63% | 0.628 | 60% | 0.603 | S | S | * | * | trans | -53.6 | 109.6 | 155 | 0 | 0 | 0 | 0 | 0 | 105 | D66 D70 | D66-A68 PolarHBondContact O-N 3.48Å; A68-D70 PolarHBondContact O-N 2.88Å; A68-D70 VanDerWaalsContact O-N 3.14Å | ||
| 69 | P | 63.6 | Low | 68.4 | Low | 64 Ų | 64 | 107.9 Ų | 107.9 | 42% | 0.416 | 60% | 0.595 | S | S | . | * | trans | -65.8 | 122.7 | -173.3 | 29.8 | -36.1 | 0 | 0 | 0 | 107.4 | I67 E71 L74 | I67-P69 WeakPolarHBondContact O-CD 3.43Å; P69-E71 PolarHBondContact O-N 3.33Å; P69-L74 HydrophobicContact CB-CD1 4.11Å; P69-L74 HydrophobicContact CB-CD2 3.79Å; P69-L74 HydrophobicContact CB-CG 3.77Å; P69-L74 HydrophobicContact CG-CD1 3.72Å; P69-L74 HydrophobicContact CG-CD2 3.99Å; P69-L74 HydrophobicContact CG-CG 3.95Å | ||
| 70 | D | 79.4 | Confident | 70.6 | Confident | 86 Ų | 86 | 106 Ų | 106 | 46% | 0.46 | 58% | 0.583 | S | S | . | * | trans | -54.4 | 137.4 | 175.7 | 170.9 | 41.3 | 0 | 0 | 0 | 109 | A68 N72 Q73 L74 | A68-D70 PolarHBondContact O-N 2.88Å; A68-D70 VanDerWaalsContact O-N 3.14Å; D70-N72 PolarHBondContact O-N 2.86Å; D70-N72 VanDerWaalsContact O-N 3.16Å; D70-N72 PolarHBondContact OD1-ND2 3.38Å; D70-N72 VanDerWaalsContact OD2-CB 3.31Å; D70-N72 WeakPolarHBondContact OD2-CB 3.48Å; D70-N72 PolarHBondContact OD2-ND2 3.1Å; D70-Q73 HydrophobicContact CB-CB 4.28Å; D70-Q73 WeakPolarHBondContact O-CA 3.32Å; D70-Q73 WeakPolarHBondContact O-CB 3.24Å; D70-Q73 PolarHBondContact O-N 3.32Å; D70-L74 PolarHBondContact O-N 3.17Å | ||
| 71 | E | 81.3 | Confident | 73.2 | Confident | 147 Ų | 147 | 105.5 Ų | 105.5 | 69% | 0.687 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62.2 | -31 | -172.2 | -49.8 | -153.9 | -161 | 0 | 0 | 110.9 | P69 Q75 | P69-E71 PolarHBondContact O-N 3.33Å; E71-Q75 WeakPolarHBondContact O-CB 3.29Å; E71-Q75 VanDerWaalsContact O-CG 3.25Å; E71-Q75 WeakPolarHBondContact O-CG 3.39Å; E71-Q75 PolarHBondContact O-N 2.98Å |
| 72 | N | 81.8 | Confident | 75.5 | Confident | 104 Ų | 104 | 104 Ų | 104 | 56% | 0.556 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -70.4 | -35.2 | 175.4 | -45.6 | -69.9 | 0 | 0 | 0 | 112 | D70 Q75 F76 | D70-N72 PolarHBondContact O-N 2.86Å; D70-N72 VanDerWaalsContact O-N 3.16Å; D70-N72 PolarHBondContact OD1-ND2 3.38Å; D70-N72 VanDerWaalsContact OD2-CB 3.31Å; D70-N72 WeakPolarHBondContact OD2-CB 3.48Å; D70-N72 PolarHBondContact OD2-ND2 3.1Å; N72-Q75 PolarHBondContact O-N 3.5Å; N72-F76 PolarHBondContact O-N 3.04Å |
| 73 | Q | 85.8 | Confident | 77.5 | Confident | 102 Ų | 102 | 99.7 Ų | 99.7 | 48% | 0.477 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -68.6 | -42.9 | 176.3 | -169.9 | 179.9 | 21.3 | 0 | 0 | 111.1 | D70 Q75 F76 I77 | D70-Q73 HydrophobicContact CB-CB 4.28Å; D70-Q73 WeakPolarHBondContact O-CA 3.32Å; D70-Q73 WeakPolarHBondContact O-CB 3.24Å; D70-Q73 PolarHBondContact O-N 3.32Å; Q73-Q75 VanDerWaalsContact C-N 3.35Å; Q73-F76 PolarHBondContact O-N 2.74Å; Q73-I77 HydrophobicContact CG-CD1 4.07Å; Q73-I77 WeakPolarHBondContact O-CB 3.43Å; Q73-I77 WeakPolarHBondContact O-CD1 3.38Å; Q73-I77 VanDerWaalsContact O-CG1 3.23Å; Q73-I77 WeakPolarHBondContact O-CG1 3.49Å; Q73-I77 PolarHBondContact O-N 3.48Å |
| 74 | L | 86.6 | Confident | 79.7 | Confident | 76 Ų | 76 | 99.5 Ų | 99.5 | 40% | 0.398 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.3 | -42.4 | 173.2 | -71.4 | -178.9 | 0 | 0 | 0 | 111.7 | P69 D70 F76 I77 L78 | P69-L74 HydrophobicContact CB-CD1 4.11Å; P69-L74 HydrophobicContact CB-CD2 3.79Å; P69-L74 HydrophobicContact CB-CG 3.77Å; P69-L74 HydrophobicContact CG-CD1 3.72Å; P69-L74 HydrophobicContact CG-CD2 3.99Å; P69-L74 HydrophobicContact CG-CG 3.95Å; D70-L74 PolarHBondContact O-N 3.17Å; L74-F76 VanDerWaalsContact C-N 3.34Å; L74-F76 PolarHBondContact O-N 3.49Å; L74-I77 PolarHBondContact O-N 2.75Å; L74-L78 WeakPolarHBondContact O-CB 3.31Å; L74-L78 VanDerWaalsContact O-CG 3.26Å; L74-L78 WeakPolarHBondContact O-CG 3.33Å; L74-L78 PolarHBondContact O-N 3.31Å |
| 75 | Q | 89.1 | Confident | 81.8 | Confident | 125 Ų | 125 | 98.2 Ų | 98.2 | 58% | 0.584 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.3 | -43.4 | 175.9 | -76.7 | 176 | 27.4 | 0 | 0 | 111.8 | E71 N72 Q73 L78 M79 | E71-Q75 WeakPolarHBondContact O-CB 3.29Å; E71-Q75 VanDerWaalsContact O-CG 3.25Å; E71-Q75 WeakPolarHBondContact O-CG 3.39Å; E71-Q75 PolarHBondContact O-N 2.98Å; N72-Q75 PolarHBondContact O-N 3.5Å; Q73-Q75 VanDerWaalsContact C-N 3.35Å; Q75-L78 PolarHBondContact O-N 3.41Å; Q75-M79 VanDerWaalsContact O-CB 3.23Å; Q75-M79 WeakPolarHBondContact O-CB 3.08Å; Q75-M79 PolarHBondContact O-N 2.99Å |
| 76 | F | 88 | Confident | 84.3 | Confident | 132 Ų | 132 | 99.2 Ų | 99.2 | 58% | 0.579 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.1 | -44.9 | 175.5 | -178.4 | -99.3 | 0 | 0 | 0 | 112 | N72 Q73 L74 L78 M79 V80 | N72-F76 PolarHBondContact O-N 3.04Å; Q73-F76 PolarHBondContact O-N 2.74Å; L74-F76 VanDerWaalsContact C-N 3.34Å; L74-F76 PolarHBondContact O-N 3.49Å; F76-L78 PolarHBondContact O-N 3.41Å; F76-M79 HydrophobicContact CD2-CE 4.02Å; F76-M79 HydrophobicContact CE2-CE 4.38Å; F76-M79 PolarHBondContact O-N 2.87Å; F76-V80 HydrophobicContact CE1-CG2 4.48Å; F76-V80 HydrophobicContact CE2-CG2 4.5Å; F76-V80 HydrophobicContact CZ-CG2 4.29Å; F76-V80 PolarHBondContact O-N 3.46Å |
| 77 | I | 89.8 | Confident | 86.3 | Confident | 77 Ų | 77 | 96.5 Ų | 96.5 | 40% | 0.395 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.9 | -48.3 | 176.4 | -69.6 | 163.9 | 0 | 0 | 0 | 110 | Q73 L74 M79 V80 L81 | Q73-I77 HydrophobicContact CG-CD1 4.07Å; Q73-I77 WeakPolarHBondContact O-CB 3.43Å; Q73-I77 WeakPolarHBondContact O-CD1 3.38Å; Q73-I77 VanDerWaalsContact O-CG1 3.23Å; Q73-I77 WeakPolarHBondContact O-CG1 3.49Å; Q73-I77 PolarHBondContact O-N 3.48Å; L74-I77 PolarHBondContact O-N 2.75Å; I77-M79 PolarHBondContact O-N 2.91Å; I77-V80 PolarHBondContact O-N 2.84Å; I77-L81 HydrophobicContact CG2-CB 4.44Å; I77-L81 HydrophobicContact CG2-CD2 4.3Å; I77-L81 WeakPolarHBondContact O-CA 3.3Å; I77-L81 WeakPolarHBondContact O-CB 3.05Å; I77-L81 PolarHBondContact O-N 3.41Å |
| 78 | L | 91.3 | Very high | 88.1 | Confident | 89 Ų | 89 | 95.4 Ų | 95.4 | 47% | 0.466 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65 | -40.1 | 179.2 | -70.7 | 174.9 | 0 | 0 | 0 | 111.9 | L74 Q75 F76 V80 L81 I82 | L74-L78 WeakPolarHBondContact O-CB 3.31Å; L74-L78 VanDerWaalsContact O-CG 3.26Å; L74-L78 WeakPolarHBondContact O-CG 3.33Å; L74-L78 PolarHBondContact O-N 3.31Å; Q75-L78 PolarHBondContact O-N 3.41Å; F76-L78 PolarHBondContact O-N 3.41Å; L78-V80 PolarHBondContact O-N 3.44Å; L78-L81 PolarHBondContact O-N 3.31Å; L78-I82 HydrophobicContact CB-CD1 3.95Å; L78-I82 HydrophobicContact CB-CG1 4.46Å; L78-I82 HydrophobicContact CD2-CD1 4.49Å; L78-I82 WeakPolarHBondContact O-CB 3.45Å; L78-I82 WeakPolarHBondContact O-CD1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.3Å; L78-I82 PolarHBondContact O-N 2.8Å |
| 79 | M | 92.1 | Very high | 89.5 | Confident | 128 Ų | 128 | 97 Ų | 97 | 63% | 0.631 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.7 | -30.3 | 177.9 | -174 | 175.2 | 68.5 | 0 | 0 | 112.6 | Q75 F76 I77 P83 | Q75-M79 VanDerWaalsContact O-CB 3.23Å; Q75-M79 WeakPolarHBondContact O-CB 3.08Å; Q75-M79 PolarHBondContact O-N 2.99Å; F76-M79 HydrophobicContact CD2-CE 4.02Å; F76-M79 HydrophobicContact CE2-CE 4.38Å; F76-M79 PolarHBondContact O-N 2.87Å; I77-M79 PolarHBondContact O-N 2.91Å; M79-P83 WeakPolarHBondContact O-CD 3.38Å; M79-P83 WeakPolarHBondContact O-CG 3.44Å |
| 80 | V | 93.2 | Very high | 91.1 | Very high | 77 Ų | 77 | 99.1 Ų | 99.1 | 47% | 0.467 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -93.9 | -38.4 | 176.7 | 178.9 | 0 | 0 | 0 | 0 | 112 | F76 I77 L78 P83 L84 | F76-V80 HydrophobicContact CE1-CG2 4.48Å; F76-V80 HydrophobicContact CE2-CG2 4.5Å; F76-V80 HydrophobicContact CZ-CG2 4.29Å; F76-V80 PolarHBondContact O-N 3.46Å; I77-V80 PolarHBondContact O-N 2.84Å; L78-V80 PolarHBondContact O-N 3.44Å; V80-P83 WeakPolarHBondContact O-CD 3.36Å; V80-P83 VanDerWaalsContact O-CG 3.27Å; V80-P83 WeakPolarHBondContact O-CG 3.34Å; V80-L84 WeakPolarHBondContact O-CB 3.41Å; V80-L84 PolarHBondContact O-N 3.21Å |
| 81 | L | 94.2 | Very high | 91.8 | Very high | 76 Ų | 76 | 100 Ų | 100 | 40% | 0.398 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -73.6 | -39.9 | -175 | -173.5 | 63.4 | 0 | 0 | 0 | 111.8 | I77 L78 L84 I85 | I77-L81 HydrophobicContact CG2-CB 4.44Å; I77-L81 HydrophobicContact CG2-CD2 4.3Å; I77-L81 WeakPolarHBondContact O-CA 3.3Å; I77-L81 WeakPolarHBondContact O-CB 3.05Å; I77-L81 PolarHBondContact O-N 3.41Å; L78-L81 PolarHBondContact O-N 3.31Å; L81-L84 PolarHBondContact O-N 3.34Å; L81-I85 HydrophobicContact CD1-CD1 4.04Å; L81-I85 HydrophobicContact CD1-CG1 4.21Å; L81-I85 HydrophobicContact CD2-CD1 4.29Å; L81-I85 HydrophobicContact CG-CD1 3.7Å; L81-I85 HydrophobicContact CG-CG1 4.28Å; L81-I85 VanDerWaalsContact O-CG1 3.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.37Å; L81-I85 PolarHBondContact O-N 3.03Å |
| 82 | I | 94.1 | Very high | 92.5 | Very high | 89 Ų | 89 | 97.3 Ų | 97.3 | 46% | 0.456 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.3 | -55.1 | 177 | -67 | 166.5 | 0 | 0 | 0 | 111.4 | L78 L84 I85 L86 | L78-I82 HydrophobicContact CB-CD1 3.95Å; L78-I82 HydrophobicContact CB-CG1 4.46Å; L78-I82 HydrophobicContact CD2-CD1 4.49Å; L78-I82 WeakPolarHBondContact O-CB 3.45Å; L78-I82 WeakPolarHBondContact O-CD1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.3Å; L78-I82 PolarHBondContact O-N 2.8Å; I82-L84 PolarHBondContact O-N 2.87Å; I82-I85 PolarHBondContact O-N 3.44Å; I82-L86 HydrophobicContact CG2-CD1 3.81Å; I82-L86 HydrophobicContact CG2-CG 4.28Å; I82-L86 WeakPolarHBondContact O-CB 3.3Å; I82-L86 VanDerWaalsContact O-CG 3.26Å; I82-L86 WeakPolarHBondContact O-CG 3.29Å; I82-L86 PolarHBondContact O-N 2.71Å |
| 83 | P | 95.4 | Very high | 93.1 | Very high | 68 Ų | 68 | 95.5 Ų | 95.5 | 44% | 0.442 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.6 | -31.5 | 179.5 | 24.2 | -33.2 | 0 | 0 | 0 | 112.3 | M79 V80 L87 | M79-P83 WeakPolarHBondContact O-CD 3.38Å; M79-P83 WeakPolarHBondContact O-CG 3.44Å; V80-P83 WeakPolarHBondContact O-CD 3.36Å; V80-P83 VanDerWaalsContact O-CG 3.27Å; V80-P83 WeakPolarHBondContact O-CG 3.34Å; P83-L87 VanDerWaalsContact O-CB 3.32Å; P83-L87 WeakPolarHBondContact O-CB 3.31Å; P83-L87 PolarHBondContact O-N 3.14Å |
| 84 | L | 95.3 | Very high | 93.5 | Very high | 99 Ų | 99 | 94.9 Ų | 94.9 | 52% | 0.518 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.1 | -47.6 | 176.5 | -169.4 | 66.9 | 0 | 0 | 0 | 112 | V80 L81 I82 L86 L87 V88 | V80-L84 WeakPolarHBondContact O-CB 3.41Å; V80-L84 PolarHBondContact O-N 3.21Å; L81-L84 PolarHBondContact O-N 3.34Å; I82-L84 PolarHBondContact O-N 2.87Å; L84-L86 VanDerWaalsContact C-N 3.34Å; L84-L87 PolarHBondContact O-N 3.1Å; L84-V88 WeakPolarHBondContact O-CG2 3.49Å; L84-V88 PolarHBondContact O-N 3.46Å |
| 85 | I | 95.5 | Very high | 93.9 | Very high | 98 Ų | 98 | 94.9 Ų | 94.9 | 50% | 0.503 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.3 | -43.4 | 176.9 | -67 | 169.1 | 0 | 0 | 0 | 110.2 | L81 I82 L87 V88 L89 | L81-I85 HydrophobicContact CD1-CD1 4.04Å; L81-I85 HydrophobicContact CD1-CG1 4.21Å; L81-I85 HydrophobicContact CD2-CD1 4.29Å; L81-I85 HydrophobicContact CG-CD1 3.7Å; L81-I85 HydrophobicContact CG-CG1 4.28Å; L81-I85 VanDerWaalsContact O-CG1 3.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.37Å; L81-I85 PolarHBondContact O-N 3.03Å; I82-I85 PolarHBondContact O-N 3.44Å; I85-L87 VanDerWaalsContact C-N 3.31Å; I85-L87 PolarHBondContact O-N 3.13Å; I85-V88 PolarHBondContact O-N 2.69Å; I85-L89 WeakPolarHBondContact O-CB 3.42Å; I85-L89 PolarHBondContact O-N 2.8Å |
| 86 | L | 96.1 | Very high | 94.1 | Very high | 106 Ų | 106 | 95.7 Ų | 95.7 | 56% | 0.555 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.4 | -41.2 | 176.8 | -72.5 | 176.5 | 0 | 0 | 0 | 111.6 | I82 L84 L89 L90 | I82-L86 HydrophobicContact CG2-CD1 3.81Å; I82-L86 HydrophobicContact CG2-CG 4.28Å; I82-L86 WeakPolarHBondContact O-CB 3.3Å; I82-L86 VanDerWaalsContact O-CG 3.26Å; I82-L86 WeakPolarHBondContact O-CG 3.29Å; I82-L86 PolarHBondContact O-N 2.71Å; L84-L86 VanDerWaalsContact C-N 3.34Å; L86-L89 PolarHBondContact O-N 3.19Å; L86-L90 WeakPolarHBondContact O-CB 3.32Å; L86-L90 PolarHBondContact O-N 2.91Å |
| 87 | L | 95.3 | Very high | 94.3 | Very high | 95 Ų | 95 | 92.9 Ų | 92.9 | 50% | 0.497 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.4 | -47 | 176.7 | -177.5 | 62.5 | 0 | 0 | 0 | 111.5 | P83 L84 I85 L90 L91 | P83-L87 VanDerWaalsContact O-CB 3.32Å; P83-L87 WeakPolarHBondContact O-CB 3.31Å; P83-L87 PolarHBondContact O-N 3.14Å; L84-L87 PolarHBondContact O-N 3.1Å; I85-L87 VanDerWaalsContact C-N 3.31Å; I85-L87 PolarHBondContact O-N 3.13Å; L87-L90 PolarHBondContact O-N 3.41Å; L87-L91 HydrophobicContact CG-CD1 4.41Å; L87-L91 VanDerWaalsContact O-CG 3.3Å; L87-L91 WeakPolarHBondContact O-CG 3.17Å; L87-L91 PolarHBondContact O-N 3.3Å |
| 88 | V | 95.6 | Very high | 94.3 | Very high | 90 Ų | 90 | 91.8 Ų | 91.8 | 55% | 0.545 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 177.8 | 174.3 | 0 | 0 | 0 | 0 | 111 | L84 I85 L90 L91 L92 | L84-V88 WeakPolarHBondContact O-CG2 3.49Å; L84-V88 PolarHBondContact O-N 3.46Å; I85-V88 PolarHBondContact O-N 2.69Å; V88-L90 VanDerWaalsContact C-N 3.33Å; V88-L90 PolarHBondContact O-N 3.08Å; V88-L91 PolarHBondContact O-N 3.47Å; V88-L92 WeakPolarHBondContact O-CB 3.16Å; V88-L92 PolarHBondContact O-N 3.47Å |
| 89 | L | 96.3 | Very high | 94.1 | Very high | 109 Ų | 109 | 91.3 Ų | 91.3 | 57% | 0.571 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65 | -38.6 | 178.9 | -166.5 | 72.4 | 0 | 0 | 0 | 111.5 | I85 L86 L92 S93 | I85-L89 WeakPolarHBondContact O-CB 3.42Å; I85-L89 PolarHBondContact O-N 2.8Å; L86-L89 PolarHBondContact O-N 3.19Å; L89-L92 PolarHBondContact O-N 3.29Å; L89-S93 WeakPolarHBondContact O-CB 3.32Å; L89-S93 PolarHBondContact O-N 2.72Å |
| 90 | L | 96.3 | Very high | 93.9 | Very high | 108 Ų | 108 | 90 Ų | 90 | 57% | 0.565 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.2 | -48.1 | 176.2 | -177 | 68 | 0 | 0 | 0 | 110.9 | L86 L87 V88 L92 S93 V94 | L86-L90 WeakPolarHBondContact O-CB 3.32Å; L86-L90 PolarHBondContact O-N 2.91Å; L87-L90 PolarHBondContact O-N 3.41Å; V88-L90 VanDerWaalsContact C-N 3.33Å; V88-L90 PolarHBondContact O-N 3.08Å; L90-L92 PolarHBondContact O-N 2.83Å; L90-S93 WeakPolarHBondContact O-CB 3.02Å; L90-S93 PolarHBondContact O-N 3.38Å; L90-V94 VanDerWaalsContact O-CG2 3.31Å; L90-V94 WeakPolarHBondContact O-CG2 3.15Å; L90-V94 PolarHBondContact O-N 2.87Å |
| 91 | L | 94.9 | Very high | 93.5 | Very high | 105 Ų | 105 | 93.1 Ų | 93.1 | 55% | 0.55 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61 | -45.2 | 176.8 | -68.3 | 174.8 | 0 | 0 | 0 | 111.3 | L87 V88 S93 V94 V95 | L87-L91 HydrophobicContact CG-CD1 4.41Å; L87-L91 VanDerWaalsContact O-CG 3.3Å; L87-L91 WeakPolarHBondContact O-CG 3.17Å; L87-L91 PolarHBondContact O-N 3.3Å; V88-L91 PolarHBondContact O-N 3.47Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 2.93Å; L91-V94 PolarHBondContact O-N 3.48Å; L91-V95 WeakPolarHBondContact O-CG2 3.26Å; L91-V95 PolarHBondContact O-N 3.38Å |
| 92 | L | 95.8 | Very high | 92.6 | Very high | 91 Ų | 91 | 97.3 Ų | 97.3 | 48% | 0.476 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.6 | -40.7 | 177.6 | -167.1 | 64.5 | 0 | 0 | 0 | 111.6 | F10 V88 L89 L90 V95 F96 | F10-L92 HydrophobicContact CZ-CD1 4.42Å; V88-L92 WeakPolarHBondContact O-CB 3.16Å; V88-L92 PolarHBondContact O-N 3.47Å; L89-L92 PolarHBondContact O-N 3.29Å; L90-L92 PolarHBondContact O-N 2.83Å; L92-V95 PolarHBondContact O-N 2.96Å; L92-F96 WeakPolarHBondContact O-CB 3.41Å; L92-F96 PolarHBondContact O-N 3.26Å |
| 93 | S | 94.2 | Very high | 91.4 | Very high | 65 Ų | 65 | 100.7 Ų | 100.7 | 46% | 0.455 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -47.9 | 175.9 | -177.5 | 0 | 0 | 0 | 0 | 110.9 | L89 L90 L91 V95 F96 L97 | L89-S93 WeakPolarHBondContact O-CB 3.32Å; L89-S93 PolarHBondContact O-N 2.72Å; L90-S93 WeakPolarHBondContact O-CB 3.02Å; L90-S93 PolarHBondContact O-N 3.38Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 2.93Å; S93-V95 VanDerWaalsContact C-N 3.35Å; S93-V95 PolarHBondContact O-N 2.87Å; S93-F96 PolarHBondContact O-N 3.29Å; S93-L97 WeakPolarHBondContact O-CB 3.27Å; S93-L97 PolarHBondContact O-N 3.06Å |
| 94 | V | 95.5 | Very high | 89.8 | Confident | 89 Ų | 89 | 102.6 Ų | 102.6 | 54% | 0.539 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -58.7 | -46.3 | 176.8 | 171.3 | 0 | 0 | 0 | 0 | 111.1 | L90 L91 L97 A98 | L90-V94 VanDerWaalsContact O-CG2 3.31Å; L90-V94 WeakPolarHBondContact O-CG2 3.15Å; L90-V94 PolarHBondContact O-N 2.87Å; L91-V94 PolarHBondContact O-N 3.48Å; V94-L97 PolarHBondContact O-N 2.92Å; V94-A98 VanDerWaalsContact O-CB 3.25Å; V94-A98 WeakPolarHBondContact O-CB 3.35Å; V94-A98 PolarHBondContact O-N 3.44Å |
| 95 | V | 93.9 | Very high | 87.9 | Confident | 76 Ų | 76 | 107.6 Ų | 107.6 | 46% | 0.461 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.4 | -45.2 | 178.4 | 173 | 0 | 0 | 0 | 0 | 111.4 | L91 L92 S93 L97 A98 T99 | L91-V95 WeakPolarHBondContact O-CG2 3.26Å; L91-V95 PolarHBondContact O-N 3.38Å; L92-V95 PolarHBondContact O-N 2.96Å; S93-V95 VanDerWaalsContact C-N 3.35Å; S93-V95 PolarHBondContact O-N 2.87Å; V95-L97 VanDerWaalsContact C-N 3.33Å; V95-L97 PolarHBondContact O-N 3.28Å; V95-A98 PolarHBondContact O-N 3.47Å; V95-T99 VanDerWaalsContact O-CB 3.3Å; V95-T99 WeakPolarHBondContact O-CB 2.99Å; V95-T99 PolarHBondContact O-N 3.33Å; V95-T99 PolarHBondContact O-OG1 2.78Å |
| 96 | F | 94.4 | Very high | 85.9 | Confident | 142 Ų | 142 | 107.5 Ų | 107.5 | 62% | 0.623 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.2 | -42.7 | 178.5 | -177 | -97.2 | 0 | 0 | 0 | 110.9 | L92 S93 T99 Y100 | L92-F96 WeakPolarHBondContact O-CB 3.41Å; L92-F96 PolarHBondContact O-N 3.26Å; S93-F96 PolarHBondContact O-N 3.29Å; F96-T99 CarbonylContact O-C 3.54Å; F96-T99 PolarHBondContact O-N 2.75Å; F96-Y100 WeakPolarHBondContact O-CB 3.4Å; F96-Y100 PolarHBondContact O-N 2.79Å |
| 97 | L | 92.1 | Very high | 83.8 | Confident | 73 Ų | 73 | 110 Ų | 110 | 38% | 0.382 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.6 | -44.1 | -179.7 | -168.4 | 65.7 | 0 | 0 | 0 | 110.8 | S93 V94 V95 T99 Y100 Y101 | S93-L97 WeakPolarHBondContact O-CB 3.27Å; S93-L97 PolarHBondContact O-N 3.06Å; V94-L97 PolarHBondContact O-N 2.92Å; V95-L97 VanDerWaalsContact C-N 3.33Å; V95-L97 PolarHBondContact O-N 3.28Å; L97-T99 VanDerWaalsContact C-N 3.32Å; L97-T99 PolarHBondContact O-N 3.3Å; L97-Y100 PolarHBondContact O-N 2.82Å; L97-Y101 HydrophobicContact CD1-CD2 4Å; L97-Y101 HydrophobicContact CD1-CE2 3.42Å; L97-Y101 VanDerWaalsContact CD1-CE2 3.42Å; L97-Y101 HydrophobicContact CD2-CE2 3.79Å; L97-Y101 HydrophobicContact CG-CD2 3.67Å; L97-Y101 HydrophobicContact CG-CE2 3.29Å; L97-Y101 WeakPolarHBondContact O-CB 3.17Å; L97-Y101 WeakPolarHBondContact O-CD2 3.06Å; L97-Y101 PolarHBondContact O-N 3.34Å |
| 98 | A | 89.7 | Confident | 81.6 | Confident | 54 Ų | 54 | 113.3 Ų | 113.3 | 45% | 0.446 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -58.8 | -44.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | V94 V95 Y100 K102 | V94-A98 VanDerWaalsContact O-CB 3.25Å; V94-A98 WeakPolarHBondContact O-CB 3.35Å; V94-A98 PolarHBondContact O-N 3.44Å; V95-A98 PolarHBondContact O-N 3.47Å; A98-Y100 VanDerWaalsContact C-N 3.35Å; A98-K102 VanDerWaalsContact O-CB 3.28Å; A98-K102 WeakPolarHBondContact O-CB 3.09Å; A98-K102 VanDerWaalsContact O-CG 3.24Å; A98-K102 WeakPolarHBondContact O-CG 3.17Å; A98-K102 PolarHBondContact O-N 3.22Å |
| 99 | T | 87.6 | Confident | 79 | Confident | 79 Ų | 79 | 116.5 Ų | 116.5 | 49% | 0.485 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.9 | -37.7 | 176.6 | -55.6 | 0 | 0 | 0 | 0 | 111.5 | V95 F96 L97 R103 | V95-T99 VanDerWaalsContact O-CB 3.3Å; V95-T99 WeakPolarHBondContact O-CB 2.99Å; V95-T99 PolarHBondContact O-N 3.33Å; V95-T99 PolarHBondContact O-OG1 2.78Å; F96-T99 CarbonylContact O-C 3.54Å; F96-T99 PolarHBondContact O-N 2.75Å; L97-T99 VanDerWaalsContact C-N 3.32Å; L97-T99 PolarHBondContact O-N 3.3Å; T99-R103 WeakPolarHBondContact O-CA 3.06Å; T99-R103 WeakPolarHBondContact O-CB 3.23Å; T99-R103 PolarHBondContact O-N 3.46Å |
| 100 | Y | 87.4 | Confident | 76.9 | Confident | 101 Ų | 101 | 117.6 Ų | 117.6 | 40% | 0.396 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70.4 | -44.4 | 179 | -179.7 | -109.3 | 0 | 0 | 0 | 111.6 | F96 L97 A98 R103 K104 | F96-Y100 WeakPolarHBondContact O-CB 3.4Å; F96-Y100 PolarHBondContact O-N 2.79Å; L97-Y100 PolarHBondContact O-N 2.82Å; A98-Y100 VanDerWaalsContact C-N 3.35Å; Y100-R103 PolarHBondContact O-N 3.47Å; Y100-K104 HydrophobicContact CD1-CD 4.13Å; Y100-K104 HydrophobicContact CE1-CD 3.7Å; Y100-K104 VanDerWaalsContact CE1-CE 3.45Å; Y100-K104 HydrophobicContact CE2-CD 4.35Å; Y100-K104 HydrophobicContact CE2-CG 4.49Å; Y100-K104 VanDerWaalsContact CZ-NZ 3.33Å; Y100-K104 WeakPolarHBondContact O-CB 3.29Å; Y100-K104 WeakPolarHBondContact O-CG 2.99Å; Y100-K104 PolarHBondContact O-N 3.16Å; Y100-K104 WeakPolarHBondContact OH-CE 3.47Å; Y100-K104 PolarHBondContact OH-NZ 2.82Å |
| 101 | Y | 83.6 | Confident | 74.7 | Confident | 142 Ų | 142 | 116.5 Ų | 116.5 | 56% | 0.557 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64.5 | -43 | 173.1 | -75.3 | -60.4 | 0 | 0 | 0 | 111.5 | L97 K104 R105 | L97-Y101 HydrophobicContact CD1-CD2 4Å; L97-Y101 HydrophobicContact CD1-CE2 3.42Å; L97-Y101 VanDerWaalsContact CD1-CE2 3.42Å; L97-Y101 HydrophobicContact CD2-CE2 3.79Å; L97-Y101 HydrophobicContact CG-CD2 3.67Å; L97-Y101 HydrophobicContact CG-CE2 3.29Å; L97-Y101 WeakPolarHBondContact O-CB 3.17Å; L97-Y101 WeakPolarHBondContact O-CD2 3.06Å; L97-Y101 PolarHBondContact O-N 3.34Å; Y101-K104 PolarHBondContact O-N 3.46Å; Y101-R105 WeakPolarHBondContact O-CG 3.35Å; Y101-R105 PolarHBondContact O-N 3.47Å |
| 102 | K | 75.4 | Confident | 72.4 | Confident | 164 Ų | 164 | 117 Ų | 117 | 71% | 0.713 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61.4 | -45 | 172.5 | -74.5 | -125.7 | 174.5 | -173.6 | 0 | 111.6 | A98 K104 R105 T106 | A98-K102 VanDerWaalsContact O-CB 3.28Å; A98-K102 WeakPolarHBondContact O-CB 3.09Å; A98-K102 VanDerWaalsContact O-CG 3.24Å; A98-K102 WeakPolarHBondContact O-CG 3.17Å; A98-K102 PolarHBondContact O-N 3.22Å; K102-K104 PolarHBondContact O-N 3.23Å; K102-R105 CarbonylContact O-C 3.51Å; K102-R105 WeakPolarHBondContact O-CA 3.23Å; K102-R105 WeakPolarHBondContact O-CB 3.5Å; K102-R105 PolarHBondContact O-N 2.7Å; K102-R105 VanDerWaalsContact O-N 3.14Å; K102-T106 WeakPolarHBondContact O-CG2 3.36Å; K102-T106 PolarHBondContact O-N 3.32Å |
| 103 | R | 70 | Confident | 69.9 | Low | 161 Ų | 161 | 120.9 Ų | 120.9 | 61% | 0.608 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68 | -32.4 | 180 | -174.3 | 176.2 | -174.7 | -170.9 | 1.1 | 112.9 | T99 Y100 T106 K107 | T99-R103 WeakPolarHBondContact O-CA 3.06Å; T99-R103 WeakPolarHBondContact O-CB 3.23Å; T99-R103 PolarHBondContact O-N 3.46Å; Y100-R103 PolarHBondContact O-N 3.47Å; R103-T106 WeakPolarHBondContact CA-OG1 3.47Å; R103-T106 PolarHBondContact O-N 3.45Å; R103-T106 PolarHBondContact O-OG1 3.29Å; R103-K107 WeakPolarHBondContact O-CG 3.48Å; R103-K107 PolarHBondContact O-N 3.45Å |
| 104 | K | 61.5 | Low | 67.4 | Low | 107 Ų | 107 | 120.7 Ų | 120.7 | 47% | 0.465 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -67.6 | -39.1 | 170.9 | -79.9 | -171.4 | 158 | -176.1 | 0 | 111.2 | Y100 Y101 K102 T106 K107 Q108 | Y100-K104 HydrophobicContact CD1-CD 4.13Å; Y100-K104 HydrophobicContact CE1-CD 3.7Å; Y100-K104 VanDerWaalsContact CE1-CE 3.45Å; Y100-K104 HydrophobicContact CE2-CD 4.35Å; Y100-K104 HydrophobicContact CE2-CG 4.49Å; Y100-K104 VanDerWaalsContact CZ-NZ 3.33Å; Y100-K104 WeakPolarHBondContact O-CB 3.29Å; Y100-K104 WeakPolarHBondContact O-CG 2.99Å; Y100-K104 PolarHBondContact O-N 3.16Å; Y100-K104 WeakPolarHBondContact OH-CE 3.47Å; Y100-K104 PolarHBondContact OH-NZ 2.82Å; Y101-K104 PolarHBondContact O-N 3.46Å; K102-K104 PolarHBondContact O-N 3.23Å; K104-T106 VanDerWaalsContact C-N 3.31Å; K104-T106 PolarHBondContact O-N 3.3Å; K104-K107 PolarHBondContact O-N 3.04Å; K104-K107 VanDerWaalsContact O-N 3.13Å; K104-Q108 PolarHBondContact O-N 3.43Å; K104-Q108 VanDerWaalsContact O-N 3.1Å |
| 105 | R | 54.5 | Low | 65.1 | Low | 205 Ų | 205 | 121.1 Ų | 121.1 | 77% | 0.774 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -68.9 | -23 | 172.6 | -72.4 | -173.4 | 148.3 | -174 | -7.4 | 114.4 | Y101 K102 K107 | Y101-R105 WeakPolarHBondContact O-CG 3.35Å; Y101-R105 PolarHBondContact O-N 3.47Å; K102-R105 CarbonylContact O-C 3.51Å; K102-R105 WeakPolarHBondContact O-CA 3.23Å; K102-R105 WeakPolarHBondContact O-CB 3.5Å; K102-R105 PolarHBondContact O-N 2.7Å; K102-R105 VanDerWaalsContact O-N 3.14Å; R105-K107 VanDerWaalsContact C-N 3.32Å |
| 106 | T | 53.9 | Low | 62.8 | Low | 95 Ų | 95 | 127.2 Ų | 127.2 | 58% | 0.583 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -3.7 | 170.4 | 62.1 | 0 | 0 | 0 | 0 | 113.5 | K102 R103 K104 | K102-T106 WeakPolarHBondContact O-CG2 3.36Å; K102-T106 PolarHBondContact O-N 3.32Å; R103-T106 WeakPolarHBondContact CA-OG1 3.47Å; R103-T106 PolarHBondContact O-N 3.45Å; R103-T106 PolarHBondContact O-OG1 3.29Å; K104-T106 VanDerWaalsContact C-N 3.31Å; K104-T106 PolarHBondContact O-N 3.3Å |
| 107 | K | 52.1 | Low | 60.6 | Low | 159 Ų | 159 | 125.3 Ų | 125.3 | 69% | 0.691 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.4 | -23.6 | 174.4 | -74.1 | -169.3 | 175.6 | -156.9 | 0 | 112.6 | R103 K104 R105 E109 | R103-K107 WeakPolarHBondContact O-CG 3.48Å; R103-K107 PolarHBondContact O-N 3.45Å; K104-K107 PolarHBondContact O-N 3.04Å; K104-K107 VanDerWaalsContact O-N 3.13Å; R105-K107 VanDerWaalsContact C-N 3.32Å; K107-E109 PolarHBondContact O-N 3.43Å |
| 108 | Q | 48.1 | Very low | 58.3 | Low | 165 Ų | 165 | 126.1 Ų | 126.1 | 77% | 0.771 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -86.9 | 98 | 160.3 | -76.6 | -175.8 | 3.4 | 0 | 0 | 107.3 | K104 | K104-Q108 PolarHBondContact O-N 3.43Å; K104-Q108 VanDerWaalsContact O-N 3.1Å |
| 109 | E | 41.9 | Very low | 56.3 | Low | 157 Ų | 157 | 132.2 Ų | 132.2 | 73% | 0.734 | 69% | 0.691 | S | S | * | * | trans | 81 | 109.7 | 171.7 | -130.9 | 173.7 | 135.6 | 0 | 0 | 117.3 | K107 S111 | K107-E109 PolarHBondContact O-N 3.43Å; E109-S111 PolarHBondContact O-N 3.28Å | ||
| 110 | P | 51.8 | Low | 54.1 | Low | 132 Ų | 132 | 137.2 Ų | 137.2 | 86% | 0.857 | 71% | 0.709 | S | S | * | * | trans | -85.9 | 81.3 | 164.6 | 35.2 | -27.6 | 0 | 0 | 0 | 108.2 | ||||
| 111 | S | 50.8 | Low | 51.9 | Low | 84 Ų | 84 | 138.9 Ų | 138.9 | 59% | 0.587 | 73% | 0.73 | S | S | * | * | trans | -148.3 | 126 | 167.5 | -165.8 | 0 | 0 | 0 | 0 | 110.6 | E109 | E109-S111 PolarHBondContact O-N 3.28Š| ||
| 112 | S | 46.6 | Very low | 50 | Low | 116 Ų | 116 | 143.4 Ų | 143.4 | 81% | 0.811 | 75% | 0.748 | S | S | * | * | trans | 68.3 | 64.7 | 169.6 | -65.1 | 0 | 0 | 0 | 0 | 117.7 | G114 | S112-G114 VanDerWaalsContact C-N 3.33Š| ||
| 113 | Q | 42 | Very low | 48.6 | Very low | 173 Ų | 173 | 144.2 Ų | 144.2 | 81% | 0.808 | 75% | 0.754 | S | S | * | * | trans | -100.2 | 66.2 | 140.2 | -161.7 | 179.1 | -53.1 | 0 | 0 | 109 | S115 | Q113-S115 PolarHBondContact O-N 2.93Š| ||
| 114 | G | 42.1 | Very low | 47.3 | Very low | 60 Ų | 60 | 144.4 Ų | 144.4 | 62% | 0.619 | 77% | 0.766 | S | S | * | * | trans | -69.3 | 118.9 | 164 | 0 | 0 | 0 | 0 | 0 | 109.9 | S112 | S112-G114 VanDerWaalsContact C-N 3.33Š| ||
| 115 | S | 47 | Very low | 46.4 | Very low | 99 Ų | 99 | 143.1 Ų | 143.1 | 69% | 0.692 | 78% | 0.783 | S | S | * | * | trans | 45 | 77.8 | 138.9 | -54.1 | 0 | 0 | 0 | 0 | 118.1 | Q113 S117 | Q113-S115 PolarHBondContact O-N 2.93Å; S115-S117 PolarHBondContact O-N 2.92Å | ||
| 116 | Q | 46.8 | Very low | 45.7 | Very low | 204 Ų | 204 | 140.5 Ų | 140.5 | 95% | 0.953 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | 62 | 154.5 | -71.8 | -168.1 | -6.1 | 0 | 0 | 111.3 | ||
| 117 | S | 47.2 | Very low | 45.7 | Very low | 101 Ų | 101 | 143.4 Ų | 143.4 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.4 | 10.1 | 173.7 | 67.3 | 0 | 0 | 0 | 0 | 114.7 | S115 | S115-S117 PolarHBondContact O-N 2.92Š|
| 118 | A | 43.2 | Very low | 45.7 | Very low | 91 Ų | 91 | 142.5 Ų | 142.5 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -100.4 | 0.8 | -172.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 119 | L | 48.2 | Very low | 45.9 | Very low | 182 Ų | 182 | 141.3 Ų | 141.3 | 95% | 0.953 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -110.7 | 47.1 | -179.2 | -100.7 | -174.7 | 0 | 0 | 0 | 113.7 | ||
| 120 | Q | 40.8 | Very low | 46.3 | Very low | 183 Ų | 183 | 142.4 Ų | 142.4 | 86% | 0.855 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -142 | 46.4 | 171.5 | -148.5 | 176 | 51.4 | 0 | 0 | 112.6 | ||
| 121 | T | 41.3 | Very low | 46.7 | Very low | 137 Ų | 137 | 142.1 Ų | 142.1 | 84% | 0.84 | 80% | 0.796 | S | S | * | * | trans | -158.2 | 73.9 | 163.5 | -29.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 122 | Y | 44.1 | Very low | 47.4 | Very low | 236 Ų | 236 | 143 Ų | 143 | 93% | 0.925 | 80% | 0.8 | S | S | * | * | trans | -151.6 | 70.5 | 161.6 | -150.4 | -94.9 | 0 | 0 | 0 | 112.2 | ||||
| 123 | E | 45.7 | Very low | 48 | Very low | 182 Ų | 182 | 144 Ų | 144 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | -157.1 | 91.5 | 150 | -105.8 | -142.5 | 134.4 | 0 | 0 | 107.1 | ||||
| 124 | L | 42.8 | Very low | 48.7 | Very low | 164 Ų | 164 | 145.7 Ų | 145.7 | 86% | 0.859 | 80% | 0.8 | S | S | * | * | S | Bend | 168.8 | 111.8 | 122 | -129.7 | 72.9 | 0 | 0 | 0 | 109.8 | |||
| 125 | G | 43.5 | Very low | 49.5 | Very low | 80 Ų | 80 | 151 Ų | 151 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | 65.9 | 101.8 | 145.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 126 | N | 38.8 | Very low | 50.1 | Low | 151 Ų | 151 | 154.5 Ų | 154.5 | 81% | 0.807 | 81% | 0.814 | S | S | * | * | -162.6 | 122.8 | 114.1 | -156.2 | 17.5 | 0 | 0 | 0 | 110.2 | |||||
| 127 | E | 55.3 | Low | 50.7 | Low | 155 Ų | 155 | 151.7 Ų | 151.7 | 72% | 0.724 | 81% | 0.805 | S | S | * | * | trans | -61.5 | 150.5 | 165.1 | 47.6 | -176.1 | -177 | 0 | 0 | 111.1 | ||||
| 128 | N | 50.8 | Low | 51.4 | Low | 140 Ų | 140 | 152.9 Ų | 152.9 | 75% | 0.749 | 81% | 0.808 | S | S | * | * | trans | 90.2 | 103.6 | 174.7 | -53.7 | -83.1 | 0 | 0 | 0 | 116.5 | ||||
| 129 | V | 52.3 | Low | 52.3 | Low | 140 Ų | 140 | 152.9 Ų | 152.9 | 85% | 0.848 | 80% | 0.801 | S | S | * | * | 170.7 | 110 | 117.5 | 163.1 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 130 | K | 51.5 | Low | 53 | Low | 180 Ų | 180 | 149.4 Ų | 149.4 | 78% | 0.783 | 79% | 0.791 | S | S | * | * | trans | 53.2 | 94.4 | 132.5 | -161.4 | 163.1 | 178.6 | -179.1 | 0 | 121.5 | ||||
| 131 | V | 59.6 | Low | 54.1 | Low | 127 Ų | 127 | 146.6 Ų | 146.6 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | trans | 51.4 | 172 | 144.4 | -49 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 132 | P | 65.6 | Low | 55.5 | Low | 103 Ų | 103 | 147.9 Ų | 147.9 | 67% | 0.669 | 79% | 0.785 | S | S | * | * | -110.1 | 131.2 | -107.5 | 29.7 | -9.1 | 0 | 0 | 0 | 113.4 | F134 | P132-F134 VanDerWaalsContact C-N 3.34Å; P132-F134 PolarHBondContact O-N 2.88Å | |||
| 133 | I | 58.5 | Low | 56.6 | Low | 135 Ų | 135 | 145 Ų | 145 | 69% | 0.692 | 78% | 0.78 | S | S | * | * | trans | -96.7 | 54.9 | -178.7 | -40.4 | 175.8 | 0 | 0 | 0 | 111.4 | E135 E136 | I133-E135 PolarHBondContact O-N 3.31Å; I133-E135 VanDerWaalsContact O-N 3.13Å; I133-E136 HydrophobicContact CG2-CB 4.39Å | ||
| 134 | F | 58.1 | Low | 58 | Low | 210 Ų | 210 | 141.9 Ų | 141.9 | 92% | 0.921 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.1 | 49.8 | 154.4 | -81.4 | -76.9 | 0 | 0 | 0 | 109.7 | P132 | P132-F134 VanDerWaalsContact C-N 3.34Å; P132-F134 PolarHBondContact O-N 2.88Å |
| 135 | E | 58.6 | Low | 59.3 | Low | 172 Ų | 172 | 140.3 Ų | 140.3 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.5 | -4 | 172 | -93.9 | -172.4 | 159.7 | 0 | 0 | 112.8 | I133 | I133-E135 PolarHBondContact O-N 3.31Å; I133-E135 VanDerWaalsContact O-N 3.13Å |
| 136 | E | 58.8 | Low | 61 | Low | 172 Ų | 172 | 144.5 Ų | 144.5 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -115.5 | 22 | -174.7 | -150.7 | 171.4 | 172.9 | 0 | 0 | 113.9 | I133 | I133-E136 HydrophobicContact CG2-CB 4.39Š|
| 137 | D | 60.4 | Low | 62.6 | Low | 145 Ų | 145 | 143.6 Ų | 143.6 | 78% | 0.775 | 75% | 0.747 | S | S | * | * | trans | -135.2 | 56.5 | 163.2 | -147.8 | 12 | 0 | 0 | 0 | 109.2 | P139 | D137-P139 VanDerWaalsContact C-CD 3.45Å; D137-P139 WeakPolarHBondContact O-CD 3.26Å | ||
| 138 | T | 62.1 | Low | 63.8 | Low | 125 Ų | 125 | 142 Ų | 142 | 77% | 0.767 | 74% | 0.74 | S | S | * | * | trans | -85.2 | 95 | 150 | -55.5 | 0 | 0 | 0 | 0 | 105.1 | S140 | T138-S140 PolarHBondContact O-N 2.88Š| ||
| 139 | P | 62 | Low | 65.4 | Low | 92 Ų | 92 | 140.7 Ų | 140.7 | 60% | 0.597 | 73% | 0.732 | S | S | * | * | trans | -56.8 | 118.6 | 174.6 | 23.7 | -33 | 0 | 0 | 0 | 107 | D137 V141 | D137-P139 VanDerWaalsContact C-CD 3.45Å; D137-P139 WeakPolarHBondContact O-CD 3.26Å; P139-V141 PolarHBondContact O-N 3.43Å | ||
| 140 | S | 62.3 | Low | 66.9 | Low | 108 Ų | 108 | 138.5 Ų | 138.5 | 76% | 0.755 | 72% | 0.716 | S | S | * | * | trans | -56.3 | 111.6 | 172.7 | 60 | 0 | 0 | 0 | 0 | 107.1 | T138 M142 | T138-S140 PolarHBondContact O-N 2.88Å; S140-M142 PolarHBondContact O-N 2.86Å | ||
| 141 | V | 63.6 | Low | 68.7 | Low | 124 Ų | 124 | 137.6 Ų | 137.6 | 75% | 0.752 | 71% | 0.712 | S | S | * | * | trans | -62.3 | 108 | 171.4 | 175.5 | 0 | 0 | 0 | 0 | 105.7 | P139 E143 | P139-V141 PolarHBondContact O-N 3.43Å; V141-E143 PolarHBondContact O-N 3.01Å | ||
| 142 | M | 70.8 | Confident | 69.9 | Low | 164 Ų | 164 | 139.5 Ų | 139.5 | 81% | 0.808 | 71% | 0.705 | S | S | * | * | trans | -68.4 | 104.8 | 173.4 | -169.9 | 91.4 | 78.4 | 0 | 0 | 106.9 | S140 I144 | S140-M142 PolarHBondContact O-N 2.86Å; M142-I144 PolarHBondContact O-N 3.43Å | ||
| 143 | E | 68.8 | Low | 70.7 | Confident | 176 Ų | 176 | 140.2 Ų | 140.2 | 82% | 0.822 | 70% | 0.701 | S | S | * | * | trans | -73.4 | 114.9 | 175.2 | -64.9 | 179.3 | -174.9 | 0 | 0 | 108.4 | V141 | V141-E143 PolarHBondContact O-N 3.01Š| ||
| 144 | I | 75.1 | Confident | 71.7 | Confident | 117 Ų | 117 | 137.2 Ų | 137.2 | 60% | 0.6 | 69% | 0.687 | S | S | * | * | trans | -84.6 | 130.4 | 171.7 | -59.4 | 167.9 | 0 | 0 | 0 | 107.5 | M142 E148 | M142-I144 PolarHBondContact O-N 3.43Å; I144-E148 HydrophobicContact CG2-CB 4.22Å | ||
| 145 | E | 69.6 | Low | 72.5 | Confident | 131 Ų | 131 | 129.2 Ų | 129.2 | 61% | 0.612 | 66% | 0.656 | S | S | * | * | trans | -69.5 | 136 | 174.9 | -70.6 | 179.6 | -163.4 | 0 | 0 | 110.2 | E147 E148 | E145-E147 WeakPolarHBondContact CB-OE2 3.37Å; E145-E147 PolarHBondContact O-N 3.29Å; E145-E147 VanDerWaalsContact O-N 3.09Å; E145-E148 HydrophobicContact CB-CG 4.38Å; E145-E148 WeakPolarHBondContact O-CB 3.31Å; E145-E148 PolarHBondContact O-N 3.18Å | ||
| 146 | M | 77.7 | Confident | 73.3 | Confident | 167 Ų | 167 | 126.2 Ų | 126.2 | 82% | 0.823 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -59.2 | -26.6 | -176.7 | -177.5 | 173.6 | 177.9 | 0 | 0 | 111.8 | L149 D150 | M146-L149 PolarHBondContact O-N 2.81Å; M146-D150 PolarHBondContact O-N 3.28Å |
| 147 | E | 74.1 | Confident | 73.7 | Confident | 132 Ų | 132 | 122.3 Ų | 122.3 | 62% | 0.617 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70.1 | -28 | 176.7 | -59.3 | 79.5 | -170.4 | 0 | 0 | 113.2 | E145 K151 | E145-E147 WeakPolarHBondContact CB-OE2 3.37Å; E145-E147 PolarHBondContact O-N 3.29Å; E145-E147 VanDerWaalsContact O-N 3.09Å; E147-K151 PolarHBondContact O-N 3.24Å |
| 148 | E | 79.5 | Confident | 73.9 | Confident | 123 Ų | 123 | 122.7 Ų | 122.7 | 58% | 0.575 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -74.2 | -34.4 | 176.3 | -70.8 | -165.8 | 141.3 | 0 | 0 | 111.8 | I144 E145 W152 | I144-E148 HydrophobicContact CG2-CB 4.22Å; E145-E148 HydrophobicContact CB-CG 4.38Å; E145-E148 WeakPolarHBondContact O-CB 3.31Å; E145-E148 PolarHBondContact O-N 3.18Å; E148-W152 PolarHBondContact O-N 3.49Å |
| 149 | L | 84.8 | Confident | 73.8 | Confident | 112 Ų | 112 | 121.7 Ų | 121.7 | 59% | 0.586 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -69.5 | -41.9 | 179.1 | -150.3 | 78.1 | 0 | 0 | 0 | 111.8 | M146 K151 W152 M153 | M146-L149 PolarHBondContact O-N 2.81Å; L149-K151 PolarHBondContact O-N 3.4Å; L149-W152 PolarHBondContact O-N 3.49Å; L149-M153 PolarHBondContact O-N 2.75Å; L149-M153 VanDerWaalsContact O-N 3.17Å |
| 150 | D | 84.6 | Confident | 73.8 | Confident | 93 Ų | 93 | 120.9 Ų | 120.9 | 50% | 0.497 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -63.2 | -42.2 | 177.3 | -174.6 | 64.3 | 0 | 0 | 0 | 111.7 | M146 W152 M153 N154 | M146-D150 PolarHBondContact O-N 3.28Å; D150-W152 VanDerWaalsContact C-N 3.32Å; D150-W152 PolarHBondContact O-N 2.88Å; D150-M153 PolarHBondContact O-N 2.92Å; D150-N154 VanDerWaalsContact O-CB 3.29Å; D150-N154 WeakPolarHBondContact O-CB 3.25Å; D150-N154 PolarHBondContact O-N 3.34Å |
| 151 | K | 87.3 | Confident | 73.6 | Confident | 162 Ų | 162 | 122 Ų | 122 | 70% | 0.704 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.3 | -36.5 | 178.7 | -169 | 176.1 | 178.2 | -173.4 | 0 | 112.6 | E147 L149 S155 | E147-K151 PolarHBondContact O-N 3.24Å; L149-K151 PolarHBondContact O-N 3.4Å; K151-S155 VanDerWaalsContact O-CB 3.3Å; K151-S155 WeakPolarHBondContact O-CB 3.47Å; K151-S155 PolarHBondContact O-N 2.88Å |
| 152 | W | 85.5 | Confident | 73.3 | Confident | 167 Ų | 167 | 125.5 Ų | 125.5 | 63% | 0.633 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -67.9 | -47 | 175.8 | 178.4 | 65.7 | 0 | 0 | 0 | 111.7 | E148 L149 D150 N154 S155 M156 | E148-W152 PolarHBondContact O-N 3.49Å; L149-W152 PolarHBondContact O-N 3.49Å; D150-W152 VanDerWaalsContact C-N 3.32Å; D150-W152 PolarHBondContact O-N 2.88Å; W152-N154 VanDerWaalsContact C-N 3.31Å; W152-N154 PolarHBondContact O-N 3.38Å; W152-S155 PolarHBondContact O-N 3.33Å; W152-S155 PolarHBondContact O-OG 3.04Å; W152-M156 HydrophobicContact CZ2-CE 3.84Å; W152-M156 PolarHBondContact O-N 2.83Å; W152-M156 VanDerWaalsContact O-N 3.08Å |
| 153 | M | 82.1 | Confident | 72.3 | Confident | 118 Ų | 118 | 125 Ų | 125 | 58% | 0.581 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -61.7 | -40.2 | 177.1 | -174.3 | 170 | 61 | 0 | 0 | 111.9 | L149 D150 M156 N157 | L149-M153 PolarHBondContact O-N 2.75Å; L149-M153 VanDerWaalsContact O-N 3.17Å; D150-M153 PolarHBondContact O-N 2.92Å; M153-M156 PolarHBondContact O-N 2.92Å; M153-N157 PolarHBondContact O-N 2.9Å |
| 154 | N | 80.3 | Confident | 71.7 | Confident | 72 Ų | 72 | 122.4 Ų | 122.4 | 39% | 0.385 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -68.9 | -37.1 | 176.4 | -160.1 | -35.2 | 0 | 0 | 0 | 112.2 | D150 W152 M156 N157 R158 | D150-N154 VanDerWaalsContact O-CB 3.29Å; D150-N154 WeakPolarHBondContact O-CB 3.25Å; D150-N154 PolarHBondContact O-N 3.34Å; W152-N154 VanDerWaalsContact C-N 3.31Å; W152-N154 PolarHBondContact O-N 3.38Å; N154-M156 PolarHBondContact O-N 3.44Å; N154-N157 WeakPolarHBondContact CA-ND2 3.13Å; N154-N157 VanDerWaalsContact O-CG 3.28Å; N154-N157 PolarHBondContact O-N 2.97Å; N154-N157 PolarHBondContact O-OD1 2.83Å; N154-N157 VanDerWaalsContact O-OD1 3.04Å; N154-R158 PolarHBondContact O-N 3.31Å |
| 155 | S | 75.1 | Confident | 70.8 | Confident | 41 Ų | 41 | 123.3 Ų | 123.3 | 29% | 0.287 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -62.1 | -43.9 | 175.4 | 77.6 | 0 | 0 | 0 | 0 | 111.8 | K151 W152 N157 R158 N159 | K151-S155 VanDerWaalsContact O-CB 3.3Å; K151-S155 WeakPolarHBondContact O-CB 3.47Å; K151-S155 PolarHBondContact O-N 2.88Å; W152-S155 PolarHBondContact O-N 3.33Å; W152-S155 PolarHBondContact O-OG 3.04Å; S155-N157 PolarHBondContact O-N 2.98Å; S155-R158 PolarHBondContact O-N 3.46Å; S155-N159 PolarHBondContact O-N 2.84Å; S155-N159 PolarHBondContact O-ND2 3.4Å; S155-N159 PolarHBondContact O-OD1 3.14Å |
| 156 | M | 74.6 | Confident | 69.7 | Low | 110 Ų | 110 | 122.5 Ų | 122.5 | 54% | 0.542 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -64.9 | -39.7 | -179.2 | -164.8 | 81.2 | 75.4 | 0 | 0 | 112.1 | W152 M153 N154 N159 | W152-M156 HydrophobicContact CZ2-CE 3.84Å; W152-M156 PolarHBondContact O-N 2.83Å; W152-M156 VanDerWaalsContact O-N 3.08Å; M153-M156 PolarHBondContact O-N 2.92Å; N154-M156 PolarHBondContact O-N 3.44Å; M156-N159 PolarHBondContact O-N 3.25Å |
| 157 | N | 68.6 | Low | 68.3 | Low | 90 Ų | 90 | 120.4 Ų | 120.4 | 48% | 0.481 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68.3 | -37.9 | -178.5 | 79 | 40.1 | 0 | 0 | 0 | 112.4 | M153 N154 S155 N159 A160 | M153-N157 PolarHBondContact O-N 2.9Å; N154-N157 WeakPolarHBondContact CA-ND2 3.13Å; N154-N157 VanDerWaalsContact O-CG 3.28Å; N154-N157 PolarHBondContact O-N 2.97Å; N154-N157 PolarHBondContact O-OD1 2.83Å; N154-N157 VanDerWaalsContact O-OD1 3.04Å; S155-N157 PolarHBondContact O-N 2.98Å; N157-N159 VanDerWaalsContact C-N 3.32Å; N157-N159 PolarHBondContact O-N 3.27Å; N157-A160 PolarHBondContact O-N 2.94Å |
| 158 | R | 63.9 | Low | 66.9 | Low | 152 Ų | 152 | 120.7 Ų | 120.7 | 57% | 0.574 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -77.2 | -22.1 | -178.5 | -164.8 | 175 | 71.4 | -145.4 | 2.7 | 112.7 | N154 S155 A160 | N154-R158 PolarHBondContact O-N 3.31Å; S155-R158 PolarHBondContact O-N 3.46Å; R158-A160 VanDerWaalsContact C-N 3.35Å |
| 159 | N | 60.3 | Low | 65.7 | Low | 105 Ų | 105 | 124 Ų | 124 | 56% | 0.561 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -78.3 | -20.1 | 178.3 | -61.3 | -22.9 | 0 | 0 | 0 | 112.6 | S155 M156 N157 D161 | S155-N159 PolarHBondContact O-N 2.84Å; S155-N159 PolarHBondContact O-ND2 3.4Å; S155-N159 PolarHBondContact O-OD1 3.14Å; M156-N159 PolarHBondContact O-N 3.25Å; N157-N159 VanDerWaalsContact C-N 3.32Å; N157-N159 PolarHBondContact O-N 3.27Å; N159-D161 VanDerWaalsContact C-N 3.33Å |
| 160 | A | 61.3 | Low | 64.2 | Low | 75 Ų | 75 | 126.7 Ų | 126.7 | 62% | 0.62 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -76.2 | -22.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | N157 R158 | N157-A160 PolarHBondContact O-N 2.94Å; R158-A160 VanDerWaalsContact C-N 3.35Å |
| 161 | D | 58.1 | Low | 62.6 | Low | 132 Ų | 132 | 130.9 Ų | 130.9 | 71% | 0.706 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -91.6 | -3.6 | -175.2 | -67.4 | -27.6 | 0 | 0 | 0 | 114.1 | N159 | N159-D161 VanDerWaalsContact C-N 3.33Š|
| 162 | Y | 57.1 | Low | 60.9 | Low | 196 Ų | 196 | 132.5 Ų | 132.5 | 77% | 0.769 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -117.9 | 3.1 | -173.4 | -87.7 | -79.9 | 0 | 0 | 0 | 117.1 | ||
| 163 | E | 50.9 | Low | 59 | Low | 153 Ų | 153 | 132.7 Ų | 132.7 | 72% | 0.715 | 67% | 0.672 | S | S | * | * | trans | -130.9 | 79.5 | 160.7 | -76.1 | -168.4 | 168.2 | 0 | 0 | 109.4 | L165 | E163-L165 VanDerWaalsContact C-N 3.28Å; E163-L165 PolarHBondContact O-N 3Å | ||
| 164 | C | 55.4 | Low | 57.6 | Low | 123 Ų | 123 | 131.2 Ų | 131.2 | 83% | 0.831 | 67% | 0.673 | S | S | * | * | trans | -52.7 | 110.3 | 138.7 | -173.4 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 165 | L | 56.5 | Low | 55.8 | Low | 135 Ų | 135 | 134.5 Ų | 134.5 | 71% | 0.707 | 69% | 0.69 | S | S | * | * | trans | -39.1 | 138.6 | -179 | -62.6 | 172.4 | 0 | 0 | 0 | 109.9 | E163 T167 | E163-L165 VanDerWaalsContact C-N 3.28Å; E163-L165 PolarHBondContact O-N 3Å; L165-T167 PolarHBondContact O-N 3.16Å | ||
| 166 | P | 45.8 | Very low | 54.6 | Low | 115 Ų | 115 | 140.2 Ų | 140.2 | 75% | 0.747 | 71% | 0.712 | S | S | * | * | trans | -52.4 | 115.3 | 173.3 | -16.9 | 27 | 0 | 0 | 0 | 107.6 | L168 | P166-L168 PolarHBondContact O-N 3.4Š| ||
| 167 | T | 48.7 | Very low | 53.5 | Low | 123 Ų | 123 | 142.3 Ų | 142.3 | 76% | 0.755 | 73% | 0.725 | S | S | * | * | trans | -51.5 | 106 | 178.6 | 34 | 0 | 0 | 0 | 0 | 108.7 | L165 K169 | L165-T167 PolarHBondContact O-N 3.16Å; T167-K169 PolarHBondContact O-N 3.33Å | ||
| 168 | L | 43.8 | Very low | 52.9 | Low | 138 Ų | 138 | 142.9 Ų | 142.9 | 72% | 0.723 | 73% | 0.734 | S | S | * | * | trans | -65.5 | 94.7 | 165 | -153.6 | 176.3 | 0 | 0 | 0 | 105.4 | P166 E170 | P166-L168 PolarHBondContact O-N 3.4Å; L168-E170 HydrophobicContact CD2-CG 3.67Å; L168-E170 PolarHBondContact O-N 3.38Å | ||
| 169 | K | 54.9 | Low | 52.5 | Low | 193 Ų | 193 | 140.1 Ų | 140.1 | 84% | 0.839 | 74% | 0.738 | S | S | * | * | trans | -53.6 | 82.5 | 162 | 42.7 | 179.8 | 176.4 | -179.4 | 0 | 109 | T167 E171 | T167-K169 PolarHBondContact O-N 3.33Å; K169-E171 PolarHBondContact O-N 3.44Å | ||
| 170 | E | 53.4 | Low | 52.2 | Low | 167 Ų | 167 | 141.7 Ų | 141.7 | 78% | 0.78 | 75% | 0.747 | S | S | * | * | trans | -71.8 | 113 | 164.3 | -67 | -168.7 | 167.5 | 0 | 0 | 108.3 | L168 K172 | L168-E170 HydrophobicContact CD2-CG 3.67Å; L168-E170 PolarHBondContact O-N 3.38Å; E170-K172 PolarHBondContact O-N 2.76Å | ||
| 171 | E | 50.9 | Low | 51.7 | Low | 182 Ų | 182 | 144.7 Ų | 144.7 | 85% | 0.85 | 75% | 0.752 | S | S | * | * | trans | -62.7 | 112.9 | 167.6 | 60.5 | -154.2 | 154.1 | 0 | 0 | 110.6 | K169 | K169-E171 PolarHBondContact O-N 3.44Š| ||
| 172 | K | 52.3 | Low | 51.2 | Low | 196 Ų | 196 | 147.3 Ų | 147.3 | 85% | 0.852 | 76% | 0.76 | S | S | * | * | trans | 34.7 | 98.3 | 134.2 | -168.5 | 156.7 | 178.3 | 156.9 | 0 | 117.6 | E170 | E170-K172 PolarHBondContact O-N 2.76Š| ||
| 173 | E | 45.3 | Very low | 50.7 | Low | 171 Ų | 171 | 147.5 Ų | 147.5 | 80% | 0.799 | 79% | 0.791 | S | S | * | * | trans | -115.4 | 120 | 135.1 | -175.6 | 176.4 | 131.1 | 0 | 0 | 109.3 | N175 | E173-N175 PolarHBondContact OE1-ND2 2.73Š| ||
| 174 | S | 52.9 | Low | 50.7 | Low | 87 Ų | 87 | 147.3 Ų | 147.3 | 61% | 0.608 | 79% | 0.794 | S | S | * | * | trans | -70.2 | 127.5 | 171.7 | 52.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 175 | N | 41.2 | Very low | 50.5 | Low | 141 Ų | 141 | 148.5 Ų | 148.5 | 75% | 0.754 | 79% | 0.792 | S | S | * | * | trans | -136.5 | 93.1 | 144.8 | -78.6 | -62.8 | 0 | 0 | 0 | 108.7 | E173 N177 | E173-N175 PolarHBondContact OE1-ND2 2.73Å; N175-N177 PolarHBondContact O-N 3.33Å | ||
| 176 | H | 51.2 | Low | 50.1 | Low | 160 Ų | 160 | 149.3 Ų | 149.3 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | trans | -65.3 | 117.5 | 164.4 | 176 | -62.2 | 0 | 0 | 0 | 108.2 | P178 | H176-P178 WeakPolarHBondContact CE1-CD 3.22Å; H176-P178 VanDerWaalsContact ND1-CD 3.28Å; H176-P178 WeakPolarHBondContact ND1-CD 3.28Å | ||
| 177 | N | 50.3 | Low | 50.4 | Low | 154 Ų | 154 | 151.3 Ų | 151.3 | 82% | 0.824 | 80% | 0.8 | S | S | * | * | trans | -149 | 108.6 | 151.7 | -115.5 | 13.4 | 0 | 0 | 0 | 109.5 | N175 S179 | N175-N177 PolarHBondContact O-N 3.33Å; N177-S179 PolarHBondContact O-N 2.97Å | ||
| 178 | P | 56 | Low | 50.5 | Low | 103 Ų | 103 | 153.1 Ų | 153.1 | 67% | 0.669 | 80% | 0.803 | S | S | * | * | trans | -83.3 | 100.4 | 164.9 | 31.6 | -30.5 | 0 | 0 | 0 | 107.8 | H176 | H176-P178 WeakPolarHBondContact CE1-CD 3.22Å; H176-P178 VanDerWaalsContact ND1-CD 3.28Å; H176-P178 WeakPolarHBondContact ND1-CD 3.28Å | ||
| 179 | S | 56.9 | Low | 50.9 | Low | 94 Ų | 94 | 154.1 Ų | 154.1 | 66% | 0.657 | 81% | 0.808 | S | S | * | * | trans | -80.1 | 144.3 | 150.5 | 40.6 | 0 | 0 | 0 | 0 | 108.4 | N177 | N177-S179 PolarHBondContact O-N 2.97Š| ||
| 180 | D | 52.6 | Low | 50.6 | Low | 137 Ų | 137 | 151.3 Ų | 151.3 | 73% | 0.733 | 81% | 0.806 | S | S | * | * | trans | 100.9 | 99.9 | 168.8 | -45.4 | -22.1 | 0 | 0 | 0 | 114 | ||||
| 181 | N | 51.8 | Low | 50.4 | Low | 138 Ų | 138 | 150.1 Ų | 150.1 | 74% | 0.738 | 81% | 0.808 | S | S | * | * | cis | 79.5 | 45.8 | 42.3 | 98.4 | -27.3 | 0 | 0 | 0 | 117.5 | ||||
| 182 | E | 47.4 | Very low | 50.4 | Low | 187 Ų | 187 | 147.4 Ų | 147.4 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -132.8 | 98.1 | 160.9 | -70.3 | -169.6 | 131.6 | 0 | 0 | 113.1 | ||||
| 183 | S | 46.8 | Very low | 50.2 | Low | 201 Ų | 201 | 143 Ų | 143 | 100% | 1.406 | 80% | 0.8 | S | S | * | * | trans | -167.1 | 0 | 145.8 | -77 | 0 | 0 | 0 | 0 | 110.1 |
Retrieved 183 of 183 residues in 284.1 ms
(Link to these results)