| 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 | 36.4 | Very low | 42.6 | Very low | 243 Ų | 243 | 141.7 Ų | 141.7 | 100% | 1.197 | 82% | 0.821 | S | S | * | * | 0 | 131.7 | 0 | -95.1 | 140.2 | 81.2 | 0 | 0 | 108.7 | |||||
| 2 | K | 47.5 | Very low | 43.4 | Very low | 196 Ų | 196 | 139.7 Ų | 139.7 | 85% | 0.852 | 82% | 0.82 | S | S | * | * | trans | 39.9 | 136.5 | 140.2 | -98.5 | -142.3 | 165.8 | 177.7 | 0 | 118.2 | ||||
| 3 | V | 41.6 | Very low | 43.6 | Very low | 101 Ų | 101 | 142.9 Ų | 142.9 | 61% | 0.612 | 82% | 0.818 | S | S | * | * | cis | 178.8 | 162.9 | 16.1 | 82.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 4 | V | 41.2 | Very low | 43.3 | Very low | 137 Ų | 137 | 141.8 Ų | 141.8 | 83% | 0.83 | 82% | 0.815 | S | S | * | * | trans | 66.9 | 135.1 | 151.9 | 166.8 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 5 | G | 39.3 | Very low | 43.1 | Very low | 59 Ų | 59 | 136.5 Ų | 136.5 | 61% | 0.608 | 80% | 0.804 | S | S | * | * | cis | 148.4 | 152.7 | 9.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 6 | S | 44 | Very low | 43.6 | Very low | 106 Ų | 106 | 132.7 Ų | 132.7 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | trans | 58.7 | 112.7 | 146.4 | -61.4 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 7 | T | 45.6 | Very low | 44 | Very low | 122 Ų | 122 | 135.2 Ų | 135.2 | 75% | 0.748 | 80% | 0.803 | S | S | * | * | 87.4 | 126.5 | 92.8 | 75.7 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 8 | C | 40.1 | Very low | 43.9 | Very low | 123 Ų | 123 | 136.8 Ų | 136.8 | 83% | 0.831 | 81% | 0.805 | S | S | * | * | trans | 9.2 | 137.9 | 153.4 | 48.8 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 9 | A | 40.1 | Very low | 44 | Very low | 102 Ų | 102 | 133.8 Ų | 133.8 | 84% | 0.843 | 81% | 0.806 | S | S | * | * | trans | -162.1 | 119.4 | 132.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 10 | L | 50.9 | Low | 44 | Very low | 173 Ų | 173 | 135.7 Ų | 135.7 | 91% | 0.906 | 81% | 0.811 | S | S | * | * | trans | -59.2 | 143.9 | 166.4 | -57.1 | 149.8 | 0 | 0 | 0 | 109.9 | ||||
| 11 | K | 41.8 | Very low | 44.3 | Very low | 197 Ų | 197 | 133.7 Ų | 133.7 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | trans | -148.9 | 99.8 | 147.5 | -158 | 162 | 67.9 | -76.7 | 0 | 110.9 | ||||
| 12 | S | 52.3 | Low | 44.9 | Very low | 117 Ų | 117 | 129.4 Ų | 129.4 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -61.4 | 129.8 | 161.2 | -179.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 13 | K | 45.9 | Very low | 45.2 | Very low | 182 Ų | 182 | 128.8 Ų | 128.8 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | trans | -164 | 136.5 | 150 | -167.6 | 67.1 | -178.8 | -74.3 | 0 | 109.8 | ||||
| 14 | V | 39.8 | Very low | 45.6 | Very low | 127 Ų | 127 | 128.9 Ų | 128.9 | 77% | 0.77 | 79% | 0.791 | S | S | * | * | trans | 95.3 | 107 | 153.5 | 132.1 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 15 | G | 39.8 | Very low | 46.1 | Very low | 63 Ų | 63 | 130.2 Ų | 130.2 | 65% | 0.649 | 79% | 0.792 | S | S | * | * | 69.7 | 86.8 | 116 | 0 | 0 | 0 | 0 | 0 | 114.2 | E17 | G15-E17 PolarHBondContact O-N 2.76Š| |||
| 16 | G | 51.3 | Low | 46.5 | Very low | 75 Ų | 75 | 131.4 Ų | 131.4 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | trans | -74.5 | 117 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 17 | E | 50.8 | Low | 46.9 | Very low | 175 Ų | 175 | 133.6 Ų | 133.6 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -175.9 | 86.5 | 152.8 | 42.6 | -131.3 | 114.6 | 0 | 0 | 108.6 | G15 | G15-E17 PolarHBondContact O-N 2.76Š| ||
| 18 | I | 42.2 | Very low | 47.4 | Very low | 165 Ų | 165 | 132 Ų | 132 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -106.5 | 116.2 | 156.3 | 46.4 | 166.5 | 0 | 0 | 0 | 107 | L20 | I18-L20 PolarHBondContact O-N 3.17Š| ||
| 19 | G | 45.4 | Very low | 47.9 | Very low | 80 Ų | 80 | 135.2 Ų | 135.2 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | trans | -56.5 | 114.9 | -168.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | S21 | G19-S21 PolarHBondContact O-N 3.4Š| ||
| 20 | L | 44.8 | Very low | 48.1 | Very low | 171 Ų | 171 | 135.6 Ų | 135.6 | 90% | 0.895 | 79% | 0.787 | S | S | * | * | trans | -85.4 | 86.8 | 157.5 | -59.9 | -179.5 | 0 | 0 | 0 | 106.7 | I18 D22 | I18-L20 PolarHBondContact O-N 3.17Å; L20-D22 PolarHBondContact O-N 3.12Å; L20-D22 VanDerWaalsContact O-N 3.12Å | ||
| 21 | S | 48.8 | Very low | 48.4 | Very low | 94 Ų | 94 | 135.8 Ų | 135.8 | 66% | 0.657 | 78% | 0.781 | S | S | * | * | trans | -66.3 | 111.1 | 179.6 | -152.6 | 0 | 0 | 0 | 0 | 110 | G19 Q23 | G19-S21 PolarHBondContact O-N 3.4Å; S21-Q23 VanDerWaalsContact C-N 3.28Å; S21-Q23 PolarHBondContact O-N 2.88Å | ||
| 22 | D | 50.4 | Low | 49.2 | Very low | 153 Ų | 153 | 131.2 Ų | 131.2 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | S | Bend | trans | 56.3 | -2.1 | 141.8 | -59.9 | -78.2 | 0 | 0 | 0 | 121.6 | L20 | L20-D22 PolarHBondContact O-N 3.12Å; L20-D22 VanDerWaalsContact O-N 3.12Å |
| 23 | Q | 52.9 | Low | 49.3 | Very low | 183 Ų | 183 | 130 Ų | 130 | 86% | 0.855 | 75% | 0.754 | S | S | * | * | trans | -92.4 | -0.2 | 178.6 | -93 | -173.3 | 90.4 | 0 | 0 | 115.4 | S21 | S21-Q23 VanDerWaalsContact C-N 3.28Å; S21-Q23 PolarHBondContact O-N 2.88Å | ||
| 24 | S | 50.3 | Low | 49.8 | Very low | 103 Ų | 103 | 127.6 Ų | 127.6 | 72% | 0.72 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -102.6 | 7.8 | -168 | -164.3 | 0 | 0 | 0 | 0 | 116.3 | ||
| 25 | L | 51.1 | Low | 50.8 | Low | 164 Ų | 164 | 127.4 Ų | 127.4 | 86% | 0.859 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -113.1 | -1.5 | -178.1 | -64.6 | 173.6 | 0 | 0 | 0 | 114.7 | ||
| 26 | A | 48.1 | Very low | 52.1 | Low | 85 Ų | 85 | 129.1 Ų | 129.1 | 70% | 0.702 | 74% | 0.738 | S | S | * | * | trans | -103.9 | 5.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | S28 | A26-S28 PolarHBondContact O-N 3.42Š| ||
| 27 | I | 52.8 | Low | 53.1 | Low | 151 Ų | 151 | 132 Ų | 132 | 77% | 0.774 | 73% | 0.731 | S | S | * | * | trans | -79.9 | 32.6 | 163.3 | -38.1 | 176.8 | 0 | 0 | 0 | 109.5 | K29 | I27-K29 PolarHBondContact O-N 3.37Å; I27-K29 VanDerWaalsContact O-N 3.16Å | ||
| 28 | S | 56.5 | Low | 54.4 | Low | 90 Ų | 90 | 130.5 Ų | 130.5 | 63% | 0.629 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -75.3 | 98 | 160.9 | -77.7 | 0 | 0 | 0 | 0 | 107.2 | A26 | A26-S28 PolarHBondContact O-N 3.42Š|
| 29 | K | 50.5 | Low | 56.1 | Low | 189 Ų | 189 | 127.4 Ų | 127.4 | 82% | 0.822 | 71% | 0.707 | S | S | * | * | trans | 65.1 | 63.7 | 155.7 | -50.1 | 175 | 176.8 | -179.7 | 0 | 115.5 | I27 K31 | I27-K29 PolarHBondContact O-N 3.37Å; I27-K29 VanDerWaalsContact O-N 3.16Å; K29-K31 PolarHBondContact O-N 3.42Å | ||
| 30 | C | 44.3 | Very low | 57.6 | Low | 111 Ų | 111 | 127.3 Ų | 127.3 | 75% | 0.75 | 69% | 0.687 | S | S | * | * | trans | -74.3 | 68.8 | 151.3 | -73.2 | 0 | 0 | 0 | 0 | 109.4 | I32 | C30-I32 VanDerWaalsContact C-N 3.3Å; C30-I32 PolarHBondContact O-N 3.26Å; C30-I32 VanDerWaalsContact O-N 3.14Å | ||
| 31 | K | 56 | Low | 59.3 | Low | 176 Ų | 176 | 123.3 Ų | 123.3 | 77% | 0.765 | 67% | 0.67 | S | S | * | * | trans | -74.7 | 93.6 | 160.2 | -159.5 | 176.6 | -166.3 | -161.3 | 0 | 105 | K29 P33 | K29-K31 PolarHBondContact O-N 3.42Å; K31-P33 WeakPolarHBondContact O-CD 3.38Å | ||
| 32 | I | 58.3 | Low | 60.9 | Low | 101 Ų | 101 | 124.6 Ų | 124.6 | 52% | 0.518 | 66% | 0.664 | S | S | . | * | trans | -85.4 | 99 | 166.4 | -61.4 | 161.7 | 0 | 0 | 0 | 104.9 | C30 L34 L35 | C30-I32 VanDerWaalsContact C-N 3.3Å; C30-I32 PolarHBondContact O-N 3.26Å; C30-I32 VanDerWaalsContact O-N 3.14Å; I32-L34 HydrophobicContact CG2-CB 4.09Å; I32-L34 PolarHBondContact O-N 2.98Å; I32-L35 HydrophobicContact CG2-CB 4.5Å; I32-L35 PolarHBondContact O-N 3.47Å | ||
| 33 | P | 55.4 | Low | 62.4 | Low | 92 Ų | 92 | 120.8 Ų | 120.8 | 60% | 0.597 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -65.4 | -22.1 | -174.5 | -17.9 | 34.9 | 0 | 0 | 0 | 112.1 | K31 L35 D36 E37 | K31-P33 WeakPolarHBondContact O-CD 3.38Å; P33-L35 PolarHBondContact O-N 3.05Å; P33-D36 WeakPolarHBondContact O-CB 3.24Å; P33-D36 PolarHBondContact O-N 2.92Å; P33-E37 PolarHBondContact O-N 3.16Å |
| 34 | L | 56.2 | Low | 63.7 | Low | 131 Ų | 131 | 117.7 Ų | 117.7 | 69% | 0.686 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -67 | -34.9 | -178.7 | -163.2 | 93.9 | 0 | 0 | 0 | 113.3 | I32 Q38 | I32-L34 HydrophobicContact CG2-CB 4.09Å; I32-L34 PolarHBondContact O-N 2.98Å; L34-Q38 VanDerWaalsContact O-CG 3.32Å; L34-Q38 WeakPolarHBondContact O-CG 3.47Å; L34-Q38 PolarHBondContact O-N 3.49Å |
| 35 | L | 60.7 | Low | 65.5 | Low | 123 Ų | 123 | 117.5 Ų | 117.5 | 64% | 0.644 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -74.5 | -31.8 | 177.8 | -121.7 | 74.4 | 0 | 0 | 0 | 111.4 | I32 P33 M39 | I32-L35 HydrophobicContact CG2-CB 4.5Å; I32-L35 PolarHBondContact O-N 3.47Å; P33-L35 PolarHBondContact O-N 3.05Å; L35-M39 WeakPolarHBondContact O-CB 3.4Å; L35-M39 PolarHBondContact O-N 2.9Å |
| 36 | D | 67.3 | Low | 67.5 | Low | 100 Ų | 100 | 112.7 Ų | 112.7 | 54% | 0.535 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -67.2 | -42.1 | 178.6 | -157.4 | 65.3 | 0 | 0 | 0 | 111.1 | P33 M39 N40 | P33-D36 WeakPolarHBondContact O-CB 3.24Å; P33-D36 PolarHBondContact O-N 2.92Å; D36-M39 PolarHBondContact O-N 2.82Å; D36-N40 VanDerWaalsContact O-CB 3.28Å; D36-N40 WeakPolarHBondContact O-CB 3.45Å; D36-N40 PolarHBondContact O-N 2.68Å |
| 37 | E | 73.3 | Confident | 69.6 | Low | 135 Ų | 135 | 112.5 Ų | 112.5 | 63% | 0.631 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.5 | -49.4 | 175.6 | -169.5 | 109.3 | 76.9 | 0 | 0 | 111.9 | P33 M39 N40 V41 | P33-E37 PolarHBondContact O-N 3.16Å; E37-M39 VanDerWaalsContact C-N 3.33Å; E37-M39 PolarHBondContact O-N 3.2Å; E37-N40 PolarHBondContact O-N 3.01Å; E37-V41 WeakPolarHBondContact O-CG2 2.94Å; E37-V41 PolarHBondContact O-N 3.46Å |
| 38 | Q | 76.3 | Confident | 71.4 | Confident | 143 Ų | 143 | 108.7 Ų | 108.7 | 67% | 0.668 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -61.4 | -40.7 | 177.9 | -69.1 | -94.5 | 96.9 | 0 | 0 | 111.9 | L34 V41 F42 | L34-Q38 VanDerWaalsContact O-CG 3.32Å; L34-Q38 WeakPolarHBondContact O-CG 3.47Å; L34-Q38 PolarHBondContact O-N 3.49Å; Q38-V41 PolarHBondContact O-N 3.39Å; Q38-F42 PolarHBondContact O-N 3.44Å; Q38-F42 VanDerWaalsContact O-N 3.08Å |
| 39 | M | 78.4 | Confident | 73.2 | Confident | 101 Ų | 101 | 107.3 Ų | 107.3 | 50% | 0.498 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -66.9 | -40.5 | 176.4 | -177.8 | -179.7 | 64.1 | 0 | 0 | 111.5 | L35 D36 E37 F42 L43 | L35-M39 WeakPolarHBondContact O-CB 3.4Å; L35-M39 PolarHBondContact O-N 2.9Å; D36-M39 PolarHBondContact O-N 2.82Å; E37-M39 VanDerWaalsContact C-N 3.33Å; E37-M39 PolarHBondContact O-N 3.2Å; M39-F42 PolarHBondContact O-N 3.17Å; M39-L43 HydrophobicContact CG-CD1 4.12Å; M39-L43 HydrophobicContact CG-CG 4.44Å; M39-L43 WeakPolarHBondContact O-CB 3.19Å; M39-L43 VanDerWaalsContact O-CG 3.26Å; M39-L43 WeakPolarHBondContact O-CG 3.46Å; M39-L43 PolarHBondContact O-N 2.87Å |
| 40 | N | 77.3 | Confident | 75.3 | Confident | 77 Ų | 77 | 100.1 Ų | 100.1 | 41% | 0.412 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.3 | -41.6 | 177 | -173 | 34 | 0 | 0 | 0 | 111.6 | D36 E37 L43 Q44 | D36-N40 VanDerWaalsContact O-CB 3.28Å; D36-N40 WeakPolarHBondContact O-CB 3.45Å; D36-N40 PolarHBondContact O-N 2.68Å; E37-N40 PolarHBondContact O-N 3.01Å; N40-L43 PolarHBondContact O-N 3.46Å; N40-Q44 WeakPolarHBondContact O-CB 3.46Å; N40-Q44 WeakPolarHBondContact O-CG 3.11Å; N40-Q44 PolarHBondContact O-N 2.92Å |
| 41 | V | 79.8 | Confident | 77.6 | Confident | 87 Ų | 87 | 98.4 Ų | 98.4 | 53% | 0.527 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.9 | -47.1 | 174 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | E37 Q38 L43 Q44 D45 | E37-V41 WeakPolarHBondContact O-CG2 2.94Å; E37-V41 PolarHBondContact O-N 3.46Å; Q38-V41 PolarHBondContact O-N 3.39Å; V41-L43 PolarHBondContact O-N 3.16Å; V41-Q44 PolarHBondContact O-N 3.45Å; V41-D45 PolarHBondContact O-N 3.46Å |
| 42 | F | 82.8 | Confident | 79.3 | Confident | 121 Ų | 121 | 95.3 Ų | 95.3 | 53% | 0.531 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.8 | -41.7 | 176.5 | 176.7 | -100.9 | 0 | 0 | 0 | 112.6 | Q38 M39 Q44 D45 M46 | Q38-F42 PolarHBondContact O-N 3.44Å; Q38-F42 VanDerWaalsContact O-N 3.08Å; M39-F42 PolarHBondContact O-N 3.17Å; F42-Q44 VanDerWaalsContact C-N 3.34Å; F42-D45 PolarHBondContact O-N 3.44Å; F42-M46 HydrophobicContact CE1-CE 3.72Å; F42-M46 HydrophobicContact CE2-CE 4.02Å; F42-M46 HydrophobicContact CZ-CE 3.32Å; F42-M46 WeakPolarHBondContact O-CB 3.41Å; F42-M46 PolarHBondContact O-N 3.49Å |
| 43 | L | 81.9 | Confident | 81.1 | Confident | 73 Ų | 73 | 92.7 Ų | 92.7 | 38% | 0.382 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.9 | -34.1 | 176.9 | -70 | 176.1 | 0 | 0 | 0 | 112.2 | M39 N40 V41 M46 N47 | M39-L43 HydrophobicContact CG-CD1 4.12Å; M39-L43 HydrophobicContact CG-CG 4.44Å; M39-L43 WeakPolarHBondContact O-CB 3.19Å; M39-L43 VanDerWaalsContact O-CG 3.26Å; M39-L43 WeakPolarHBondContact O-CG 3.46Å; M39-L43 PolarHBondContact O-N 2.87Å; N40-L43 PolarHBondContact O-N 3.46Å; V41-L43 PolarHBondContact O-N 3.16Å; L43-M46 PolarHBondContact O-N 3.12Å; L43-N47 WeakPolarHBondContact O-CB 3.27Å; L43-N47 PolarHBondContact O-N 3.4Å; L43-N47 PolarHBondContact O-ND2 3.49Å |
| 44 | Q | 81.6 | Confident | 82.9 | Confident | 118 Ų | 118 | 90.3 Ų | 90.3 | 55% | 0.551 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -65.4 | -42.7 | 172.4 | -77 | -164.8 | 18.7 | 0 | 0 | 111.8 | N40 V41 F42 M46 N47 S48 | N40-Q44 WeakPolarHBondContact O-CB 3.46Å; N40-Q44 WeakPolarHBondContact O-CG 3.11Å; N40-Q44 PolarHBondContact O-N 2.92Å; V41-Q44 PolarHBondContact O-N 3.45Å; F42-Q44 VanDerWaalsContact C-N 3.34Å; Q44-M46 VanDerWaalsContact C-N 3.33Å; Q44-M46 PolarHBondContact O-N 3.14Å; Q44-N47 PolarHBondContact O-N 3.34Å; Q44-S48 WeakPolarHBondContact O-CB 3.45Å; Q44-S48 PolarHBondContact O-N 3.26Å; Q44-S48 PolarHBondContact O-OG 3Å |
| 45 | D | 88.3 | Confident | 84.6 | Confident | 100 Ų | 100 | 90.2 Ų | 90.2 | 54% | 0.535 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 174.6 | -172.5 | 46.7 | 0 | 0 | 0 | 111.1 | V41 F42 N47 S48 C49 | V41-D45 PolarHBondContact O-N 3.46Å; F42-D45 PolarHBondContact O-N 3.44Å; D45-N47 PolarHBondContact O-N 3.25Å; D45-S48 WeakPolarHBondContact O-CB 3.23Å; D45-S48 PolarHBondContact O-N 3.15Å; D45-S48 VanDerWaalsContact O-N 3.11Å; D45-C49 PolarHBondContact O-N 3.33Å; D45-C49 PolarHBondContact O-SG 3.49Å |
| 46 | M | 92.6 | Very high | 86.2 | Confident | 63 Ų | 63 | 89 Ų | 89 | 31% | 0.31 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.5 | -42.8 | 175.6 | -164.7 | 69 | 63.2 | 0 | 0 | 112.5 | F42 L43 Q44 S48 C49 Y50 | F42-M46 HydrophobicContact CE1-CE 3.72Å; F42-M46 HydrophobicContact CE2-CE 4.02Å; F42-M46 HydrophobicContact CZ-CE 3.32Å; F42-M46 WeakPolarHBondContact O-CB 3.41Å; F42-M46 PolarHBondContact O-N 3.49Å; L43-M46 PolarHBondContact O-N 3.12Å; Q44-M46 VanDerWaalsContact C-N 3.33Å; Q44-M46 PolarHBondContact O-N 3.14Å; M46-S48 VanDerWaalsContact C-N 3.28Å; M46-S48 PolarHBondContact O-N 3.4Å; M46-C49 WeakPolarHBondContact O-CB 3.4Å; M46-C49 PolarHBondContact O-N 3.06Å; M46-Y50 HydrophobicContact CG-CD2 4.43Å; M46-Y50 HydrophobicContact CG-CE2 3.89Å; M46-Y50 WeakPolarHBondContact O-CD2 3.29Å; M46-Y50 PolarHBondContact O-N 3.44Å |
| 47 | N | 91.1 | Very high | 87.5 | Confident | 80 Ų | 80 | 84.5 Ų | 84.5 | 43% | 0.428 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -66.1 | -33.1 | 176.3 | -69.7 | -33.8 | 0 | 0 | 0 | 111.8 | L43 Q44 D45 C49 Y50 S51 | L43-N47 WeakPolarHBondContact O-CB 3.27Å; L43-N47 PolarHBondContact O-N 3.4Å; L43-N47 PolarHBondContact O-ND2 3.49Å; Q44-N47 PolarHBondContact O-N 3.34Å; D45-N47 PolarHBondContact O-N 3.25Å; N47-C49 VanDerWaalsContact C-N 3.34Å; N47-Y50 PolarHBondContact O-N 2.99Å; N47-S51 PolarHBondContact O-N 3.38Å; N47-S51 PolarHBondContact O-OG 2.98Å |
| 48 | S | 92.2 | Very high | 88.4 | Confident | 71 Ų | 71 | 82.9 Ų | 82.9 | 50% | 0.497 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -66 | -38.1 | 174.4 | -56.9 | 0 | 0 | 0 | 0 | 111.3 | Q44 D45 M46 Y50 S51 K52 | Q44-S48 WeakPolarHBondContact O-CB 3.45Å; Q44-S48 PolarHBondContact O-N 3.26Å; Q44-S48 PolarHBondContact O-OG 3Å; D45-S48 WeakPolarHBondContact O-CB 3.23Å; D45-S48 PolarHBondContact O-N 3.15Å; D45-S48 VanDerWaalsContact O-N 3.11Å; M46-S48 VanDerWaalsContact C-N 3.28Å; M46-S48 PolarHBondContact O-N 3.4Å; S48-Y50 PolarHBondContact O-N 3.03Å; S48-S51 WeakPolarHBondContact O-CB 3.43Å; S48-S51 PolarHBondContact O-N 3.07Å; S48-K52 PolarHBondContact O-N 3.25Å |
| 49 | C | 93.8 | Very high | 88.9 | Confident | 61 Ų | 61 | 80.1 Ų | 80.1 | 41% | 0.412 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -58.4 | -47.5 | 171.6 | -64.2 | 0 | 0 | 0 | 0 | 111.4 | D45 M46 N47 S51 K52 L53 | D45-C49 PolarHBondContact O-N 3.33Å; D45-C49 PolarHBondContact O-SG 3.49Å; M46-C49 WeakPolarHBondContact O-CB 3.4Å; M46-C49 PolarHBondContact O-N 3.06Å; N47-C49 VanDerWaalsContact C-N 3.34Å; C49-S51 VanDerWaalsContact C-N 3.32Å; C49-S51 PolarHBondContact O-N 3.38Å; C49-K52 PolarHBondContact O-N 3.43Å; C49-K52 VanDerWaalsContact O-N 3.12Å; C49-L53 WeakPolarHBondContact O-CG 3.34Å; C49-L53 PolarHBondContact O-N 2.86Å |
| 50 | Y | 93.6 | Very high | 89.4 | Confident | 39 Ų | 39 | 75.7 Ų | 75.7 | 15% | 0.153 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -61.9 | -37 | 176.5 | -72.8 | -70.9 | 0 | 0 | 0 | 113.2 | M46 N47 S48 K52 L53 K54 K68 I71 L72 | M46-Y50 HydrophobicContact CG-CD2 4.43Å; M46-Y50 HydrophobicContact CG-CE2 3.89Å; M46-Y50 WeakPolarHBondContact O-CD2 3.29Å; M46-Y50 PolarHBondContact O-N 3.44Å; N47-Y50 PolarHBondContact O-N 2.99Å; S48-Y50 PolarHBondContact O-N 3.03Å; Y50-K52 VanDerWaalsContact C-N 3.34Å; Y50-L53 HydrophobicContact CD1-CD1 4.25Å; Y50-L53 PolarHBondContact O-N 2.93Å; Y50-K54 WeakPolarHBondContact O-CG 3.44Å; Y50-K54 PolarHBondContact O-N 3.13Å; Y50-K68 HydrophobicContact CD2-CD 4.48Å; Y50-K68 HydrophobicContact CD2-CG 4.38Å; Y50-K68 HydrophobicContact CE1-CB 3.96Å; Y50-K68 HydrophobicContact CE1-CG 4.08Å; Y50-K68 HydrophobicContact CE2-CD 3.78Å; Y50-K68 HydrophobicContact CE2-CG 3.95Å; Y50-I71 HydrophobicContact CD1-CB 4.13Å; Y50-I71 HydrophobicContact CD1-CD1 3.95Å; Y50-I71 HydrophobicContact CD1-CG2 3.76Å; Y50-I71 HydrophobicContact CE1-CG2 4.35Å; Y50-I71 HydrophobicContact CG-CD1 4.46Å; Y50-L72 HydrophobicContact CE1-CD2 4.23Å; Y50-L72 HydrophobicContact CE1-CG 4.23Å |
| 51 | S | 92.2 | Very high | 89.7 | Confident | 75 Ų | 75 | 74.3 Ų | 74.3 | 52% | 0.524 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63.3 | -42.2 | 173.5 | -62.9 | 0 | 0 | 0 | 0 | 111.3 | N47 S48 C49 L53 K54 E55 | N47-S51 PolarHBondContact O-N 3.38Å; N47-S51 PolarHBondContact O-OG 2.98Å; S48-S51 WeakPolarHBondContact O-CB 3.43Å; S48-S51 PolarHBondContact O-N 3.07Å; C49-S51 VanDerWaalsContact C-N 3.32Å; C49-S51 PolarHBondContact O-N 3.38Å; S51-L53 PolarHBondContact O-N 3.46Å; S51-K54 WeakPolarHBondContact O-CB 3.27Å; S51-K54 PolarHBondContact O-N 3.14Å; S51-E55 PolarHBondContact O-N 3.04Å |
| 52 | K | 93.4 | Very high | 89.7 | Confident | 110 Ų | 110 | 74.6 Ų | 74.6 | 48% | 0.478 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 177.3 | -167.3 | 66.9 | -170 | 165.8 | 0 | 112.4 | S48 C49 Y50 K54 E55 L56 | S48-K52 PolarHBondContact O-N 3.25Å; C49-K52 PolarHBondContact O-N 3.43Å; C49-K52 VanDerWaalsContact O-N 3.12Å; Y50-K52 VanDerWaalsContact C-N 3.34Å; K52-K54 VanDerWaalsContact C-N 3.27Å; K52-K54 PolarHBondContact O-N 3.03Å; K52-E55 WeakPolarHBondContact CD-OE2 3.49Å; K52-E55 IonicContact NZ-OE2 2.78Å; K52-E55 PolarHBondContact NZ-OE2 3.37Å; K52-E55 PolarHBondContact O-N 3.44Å; K52-E55 VanDerWaalsContact O-N 3.1Å; K52-L56 HydrophobicContact CG-CD1 4.09Å; K52-L56 WeakPolarHBondContact O-CG 3.29Å; K52-L56 PolarHBondContact O-N 3.04Å |
| 53 | L | 95.3 | Very high | 89.4 | Confident | 46 Ų | 46 | 76.6 Ų | 76.6 | 24% | 0.241 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -59.8 | -37.4 | 175.4 | -66.5 | 170.1 | 0 | 0 | 0 | 111.9 | C49 Y50 S51 E55 L56 V57 I71 V75 | C49-L53 WeakPolarHBondContact O-CG 3.34Å; C49-L53 PolarHBondContact O-N 2.86Å; Y50-L53 HydrophobicContact CD1-CD1 4.25Å; Y50-L53 PolarHBondContact O-N 2.93Å; S51-L53 PolarHBondContact O-N 3.46Å; L53-E55 VanDerWaalsContact C-N 3.27Å; L53-E55 PolarHBondContact O-N 3.22Å; L53-L56 PolarHBondContact O-N 3.39Å; L53-V57 WeakPolarHBondContact O-CB 3.43Å; L53-V57 WeakPolarHBondContact O-CG2 3.3Å; L53-V57 PolarHBondContact O-N 3.42Å; L53-I71 HydrophobicContact CB-CG2 4.01Å; L53-I71 HydrophobicContact CD1-CG2 4.02Å; L53-V75 HydrophobicContact CB-CG2 4.08Å; L53-V75 HydrophobicContact CD1-CG2 4.09Å; L53-V75 HydrophobicContact CD2-CG1 4.31Å; L53-V75 HydrophobicContact CD2-CG2 3.77Å; L53-V75 HydrophobicContact CG-CG2 4.17Å |
| 54 | K | 92.3 | Very high | 89.3 | Confident | 42 Ų | 42 | 80.4 Ų | 80.4 | 18% | 0.183 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -67.3 | -23.2 | 175.9 | -70.8 | -176 | 177 | -166.7 | 0 | 114.5 | Y50 S51 K52 L60 K64 | Y50-K54 WeakPolarHBondContact O-CG 3.44Å; Y50-K54 PolarHBondContact O-N 3.13Å; S51-K54 WeakPolarHBondContact O-CB 3.27Å; S51-K54 PolarHBondContact O-N 3.14Å; K52-K54 VanDerWaalsContact C-N 3.27Å; K52-K54 PolarHBondContact O-N 3.03Å; K54-L60 HydrophobicContact CG-CB 4.44Å; K54-L60 HydrophobicContact CG-CD1 4.29Å; K54-K64 PolarHBondContact NZ-O 3.39Å |
| 55 | E | 93.5 | Very high | 89.3 | Confident | 129 Ų | 129 | 85.1 Ų | 85.1 | 60% | 0.603 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -81.7 | -34.4 | 174.2 | -63.4 | -176.3 | 157.2 | 0 | 0 | 111.9 | S51 K52 L53 | S51-E55 PolarHBondContact O-N 3.04Å; K52-E55 WeakPolarHBondContact CD-OE2 3.49Å; K52-E55 IonicContact NZ-OE2 2.78Å; K52-E55 PolarHBondContact NZ-OE2 3.37Å; K52-E55 PolarHBondContact O-N 3.44Å; K52-E55 VanDerWaalsContact O-N 3.1Å; L53-E55 VanDerWaalsContact C-N 3.27Å; L53-E55 PolarHBondContact O-N 3.22Å |
| 56 | L | 94.6 | Very high | 89.2 | Confident | 98 Ų | 98 | 81.4 Ų | 81.4 | 51% | 0.513 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -86 | -32 | -173.9 | -65.6 | 175.4 | 0 | 0 | 0 | 113.2 | K52 L53 P58 Y78 | K52-L56 HydrophobicContact CG-CD1 4.09Å; K52-L56 WeakPolarHBondContact O-CG 3.29Å; K52-L56 PolarHBondContact O-N 3.04Å; L53-L56 PolarHBondContact O-N 3.39Å; L56-P58 WeakPolarHBondContact O-CD 3.39Å; L56-Y78 VanDerWaalsContact O-CE1 3.3Å; L56-Y78 WeakPolarHBondContact O-CE1 3.45Å |
| 57 | V | 94 | Very high | 89.3 | Confident | 5 Ų | 5 | 81 Ų | 81 | 3% | 0.03 | 44% | 0.439 | C | S | . | . | trans | -92.4 | 115.2 | -176.2 | 179.8 | 0 | 0 | 0 | 0 | 110.6 | L53 T59 L60 H74 V75 Y78 | L53-V57 WeakPolarHBondContact O-CB 3.43Å; L53-V57 WeakPolarHBondContact O-CG2 3.3Å; L53-V57 PolarHBondContact O-N 3.42Å; V57-T59 WeakPolarHBondContact CG1-OG1 3.19Å; V57-T59 PolarHBondContact O-N 3.07Å; V57-L60 HydrophobicContact CB-CB 4.3Å; V57-L60 HydrophobicContact CB-CD1 3.79Å; V57-L60 HydrophobicContact CB-CG 4Å; V57-L60 HydrophobicContact CG1-CB 4.41Å; V57-L60 HydrophobicContact CG1-CD1 4.1Å; V57-L60 HydrophobicContact CG1-CG 3.89Å; V57-L60 HydrophobicContact CG2-CD1 4.14Å; V57-L60 PolarHBondContact O-N 3.17Å; V57-H74 HydrophobicContact CG1-CB 4.08Å; V57-V75 HydrophobicContact CG2-CB 4.43Å; V57-V75 HydrophobicContact CG2-CG2 3.63Å; V57-Y78 HydrophobicContact CB-CD1 4.39Å; V57-Y78 HydrophobicContact CG1-CD1 4.48Å; V57-Y78 HydrophobicContact CG1-CG 4.29Å; V57-Y78 HydrophobicContact CG2-CD1 3.95Å; V57-Y78 HydrophobicContact CG2-CG 4.49Å | ||
| 58 | P | 90.9 | Very high | 89.4 | Confident | 101 Ų | 101 | 82.1 Ų | 82.1 | 66% | 0.656 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -26.7 | -173.9 | -22.8 | 32.9 | 0 | 0 | 0 | 114.6 | L56 L60 Y78 | L56-P58 WeakPolarHBondContact O-CD 3.39Å; P58-L60 VanDerWaalsContact C-N 3.34Å; P58-Y78 VanDerWaalsContact CD-CE2 3.43Å; P58-Y78 HydrophobicContact CG-CD2 4.27Å; P58-Y78 HydrophobicContact CG-CE2 3.74Å |
| 59 | T | 87 | Confident | 89.6 | Confident | 85 Ų | 85 | 83.2 Ų | 83.2 | 52% | 0.521 | 44% | 0.443 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | -9 | -176.7 | 56.8 | 0 | 0 | 0 | 0 | 113.1 | V57 H74 | V57-T59 WeakPolarHBondContact CG1-OG1 3.19Å; V57-T59 PolarHBondContact O-N 3.07Å; T59-H74 PolarHBondContact OG1-ND1 3.26Å; T59-H74 VanDerWaalsContact OG1-ND1 3.07Å |
| 60 | L | 90.4 | Very high | 89.6 | Confident | 8 Ų | 8 | 84.6 Ų | 84.6 | 4% | 0.042 | 44% | 0.444 | C | S | . | . | S | Bend | trans | -86.9 | 133.4 | -179.1 | -77.6 | 178.1 | 0 | 0 | 0 | 112.5 | K54 V57 P58 T62 I71 H74 | K54-L60 HydrophobicContact CG-CB 4.44Å; K54-L60 HydrophobicContact CG-CD1 4.29Å; V57-L60 HydrophobicContact CB-CB 4.3Å; V57-L60 HydrophobicContact CB-CD1 3.79Å; V57-L60 HydrophobicContact CB-CG 4Å; V57-L60 HydrophobicContact CG1-CB 4.41Å; V57-L60 HydrophobicContact CG1-CD1 4.1Å; V57-L60 HydrophobicContact CG1-CG 3.89Å; V57-L60 HydrophobicContact CG2-CD1 4.14Å; V57-L60 PolarHBondContact O-N 3.17Å; P58-L60 VanDerWaalsContact C-N 3.34Å; L60-T62 PolarHBondContact O-N 2.96Å; L60-I71 HydrophobicContact CD1-CB 4.3Å; L60-I71 HydrophobicContact CD1-CG1 4.31Å; L60-I71 HydrophobicContact CD1-CG2 3.77Å; L60-I71 HydrophobicContact CD2-CG1 4.18Å; L60-H74 HydrophobicContact CD1-CB 4.27Å; L60-H74 HydrophobicContact CD2-CB 3.65Å; L60-H74 WeakPolarHBondContact CD2-CD2 3.14Å; L60-H74 HydrophobicContact CG-CB 3.75Å |
| 61 | P | 83.5 | Confident | 89.7 | Confident | 49 Ų | 49 | 83 Ų | 83 | 32% | 0.318 | 44% | 0.438 | S | S | . | . | trans | -76.1 | 115.7 | 177.2 | 30.2 | -33.6 | 0 | 0 | 0 | 111 | N63 K64 | P61-N63 VanDerWaalsContact C-N 3.34Å; P61-N63 PolarHBondContact O-N 3.17Å; P61-K64 HydrophobicContact CB-CB 3.81Å; P61-K64 HydrophobicContact CB-CD 4.25Å; P61-K64 HydrophobicContact CB-CG 4.15Å; P61-K64 HydrophobicContact CG-CB 4Å | ||
| 62 | T | 79.1 | Confident | 89.9 | Confident | 92 Ų | 92 | 83.1 Ų | 83.1 | 56% | 0.564 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | -35.5 | -178.6 | -19.5 | 0 | 0 | 0 | 0 | 112.4 | L60 | L60-T62 PolarHBondContact O-N 2.96Š|
| 63 | N | 75.8 | Confident | 90 | Very high | 163 Ų | 163 | 83 Ų | 83 | 87% | 0.872 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.8 | 0.9 | -175.1 | -65.3 | -58.9 | 0 | 0 | 0 | 114.5 | P61 | P61-N63 VanDerWaalsContact C-N 3.34Å; P61-N63 PolarHBondContact O-N 3.17Å |
| 64 | K | 80 | Confident | 90.1 | Very high | 153 Ų | 153 | 83.8 Ų | 83.8 | 67% | 0.665 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -111.7 | 156 | 178.9 | -58.8 | -178.5 | 175.3 | 174.3 | 0 | 111.6 | K54 P61 A66 | K54-K64 PolarHBondContact NZ-O 3.39Å; P61-K64 HydrophobicContact CB-CB 3.81Å; P61-K64 HydrophobicContact CB-CD 4.25Å; P61-K64 HydrophobicContact CB-CG 4.15Å; P61-K64 HydrophobicContact CG-CB 4Å; K64-A66 PolarHBondContact O-N 3.17Å |
| 65 | K | 82.8 | Confident | 90.3 | Very high | 217 Ų | 217 | 82.9 Ų | 82.9 | 94% | 0.943 | 43% | 0.433 | S | S | * | . | trans | -76.9 | 119.7 | 172.3 | -60.2 | -143 | 176.9 | -170.5 | 0 | 108.4 | ||||
| 66 | A | 86.4 | Confident | 90.5 | Very high | 23 Ų | 23 | 81.5 Ų | 81.5 | 19% | 0.19 | 43% | 0.429 | C | S | . | . | trans | -117.4 | 142 | 169.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | K64 I71 | K64-A66 PolarHBondContact O-N 3.17Å; A66-I71 HydrophobicContact CB-CD1 4.43Å; A66-I71 HydrophobicContact CB-CG1 3.97Å | ||
| 67 | S | 93.8 | Very high | 90.5 | Very high | 55 Ų | 55 | 81.2 Ų | 81.2 | 39% | 0.385 | 43% | 0.428 | S | S | . | . | trans | -68.2 | 158.9 | 176.2 | 70.9 | 0 | 0 | 0 | 0 | 110.9 | V69 E70 I71 | S67-V69 PolarHBondContact O-N 3.46Å; S67-E70 WeakPolarHBondContact CB-OE2 3.44Å; S67-E70 PolarHBondContact N-OE2 3.2Å; S67-E70 PolarHBondContact O-N 2.63Å; S67-E70 WeakPolarHBondContact OG-CB 3.33Å; S67-E70 VanDerWaalsContact OG-CG 3.3Å; S67-E70 WeakPolarHBondContact OG-CG 3.42Å; S67-E70 PolarHBondContact OG-N 2.82Å; S67-E70 PolarHBondContact OG-OE2 3.35Å; S67-I71 WeakPolarHBondContact O-CG1 3.39Å; S67-I71 PolarHBondContact O-N 3.26Å | ||
| 68 | K | 93.4 | Very high | 90.6 | Very high | 102 Ų | 102 | 84.3 Ų | 84.3 | 44% | 0.443 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -56.6 | -38.3 | 176.7 | -69 | -177.1 | 175.9 | -176.3 | 0 | 111.6 | Y50 I71 L72 | Y50-K68 HydrophobicContact CD2-CD 4.48Å; Y50-K68 HydrophobicContact CD2-CG 4.38Å; Y50-K68 HydrophobicContact CE1-CB 3.96Å; Y50-K68 HydrophobicContact CE1-CG 4.08Å; Y50-K68 HydrophobicContact CE2-CD 3.78Å; Y50-K68 HydrophobicContact CE2-CG 3.95Å; K68-I71 PolarHBondContact O-N 3.19Å; K68-L72 VanDerWaalsContact O-CG 3.26Å; K68-L72 WeakPolarHBondContact O-CG 3.39Å; K68-L72 PolarHBondContact O-N 3.27Å; K68-L72 VanDerWaalsContact O-N 3.07Å |
| 69 | V | 95.6 | Very high | 90.9 | Very high | 94 Ų | 94 | 83.4 Ų | 83.4 | 57% | 0.57 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -68.6 | -45.9 | 179.6 | 177.1 | 0 | 0 | 0 | 0 | 111.2 | S67 I71 L72 Q73 | S67-V69 PolarHBondContact O-N 3.46Å; V69-I71 VanDerWaalsContact C-N 3.29Å; V69-I71 PolarHBondContact O-N 3.07Å; V69-L72 PolarHBondContact O-N 2.99Å; V69-L72 VanDerWaalsContact O-N 3.13Å; V69-Q73 HydrophobicContact CG1-CG 4.48Å; V69-Q73 WeakPolarHBondContact O-CG 3.26Å; V69-Q73 PolarHBondContact O-N 3.22Å |
| 70 | E | 94.7 | Very high | 91.2 | Very high | 90 Ų | 90 | 87.3 Ų | 87.3 | 42% | 0.421 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -58.6 | -43.5 | 175.4 | -74.8 | 164 | 114.3 | 0 | 0 | 111.1 | S67 L72 Q73 H74 | S67-E70 WeakPolarHBondContact CB-OE2 3.44Å; S67-E70 PolarHBondContact N-OE2 3.2Å; S67-E70 PolarHBondContact O-N 2.63Å; S67-E70 WeakPolarHBondContact OG-CB 3.33Å; S67-E70 VanDerWaalsContact OG-CG 3.3Å; S67-E70 WeakPolarHBondContact OG-CG 3.42Å; S67-E70 PolarHBondContact OG-N 2.82Å; S67-E70 PolarHBondContact OG-OE2 3.35Å; E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 3.38Å; E70-Q73 PolarHBondContact O-N 3.36Å; E70-H74 PolarHBondContact O-CD2 2.94Å; E70-H74 PolarHBondContact O-N 3.12Å |
| 71 | I | 94.7 | Very high | 91.4 | Very high | 5 Ų | 5 | 91.8 Ų | 91.8 | 3% | 0.026 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -57 | -47.2 | 175.5 | -66 | 166.2 | 0 | 0 | 0 | 110.9 | Y50 L53 L60 A66 S67 K68 V69 Q73 H74 V75 | Y50-I71 HydrophobicContact CD1-CB 4.13Å; Y50-I71 HydrophobicContact CD1-CD1 3.95Å; Y50-I71 HydrophobicContact CD1-CG2 3.76Å; Y50-I71 HydrophobicContact CE1-CG2 4.35Å; Y50-I71 HydrophobicContact CG-CD1 4.46Å; L53-I71 HydrophobicContact CB-CG2 4.01Å; L53-I71 HydrophobicContact CD1-CG2 4.02Å; L60-I71 HydrophobicContact CD1-CB 4.3Å; L60-I71 HydrophobicContact CD1-CG1 4.31Å; L60-I71 HydrophobicContact CD1-CG2 3.77Å; L60-I71 HydrophobicContact CD2-CG1 4.18Å; A66-I71 HydrophobicContact CB-CD1 4.43Å; A66-I71 HydrophobicContact CB-CG1 3.97Å; S67-I71 WeakPolarHBondContact O-CG1 3.39Å; S67-I71 PolarHBondContact O-N 3.26Å; K68-I71 PolarHBondContact O-N 3.19Å; V69-I71 VanDerWaalsContact C-N 3.29Å; V69-I71 PolarHBondContact O-N 3.07Å; I71-Q73 VanDerWaalsContact C-N 3.34Å; I71-Q73 PolarHBondContact O-N 3.28Å; I71-H74 PolarHBondContact O-N 3.48Å; I71-V75 HydrophobicContact CG2-CG2 4.38Å; I71-V75 WeakPolarHBondContact O-CG2 3.49Å; I71-V75 PolarHBondContact O-N 3.42Å |
| 72 | L | 96.8 | Very high | 91.9 | Very high | 78 Ų | 78 | 92 Ų | 92 | 41% | 0.408 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.7 | -36.9 | 179.7 | -67.3 | 173.4 | 0 | 0 | 0 | 112.7 | Y50 K68 V69 E70 V75 I76 | Y50-L72 HydrophobicContact CE1-CD2 4.23Å; Y50-L72 HydrophobicContact CE1-CG 4.23Å; K68-L72 VanDerWaalsContact O-CG 3.26Å; K68-L72 WeakPolarHBondContact O-CG 3.39Å; K68-L72 PolarHBondContact O-N 3.27Å; K68-L72 VanDerWaalsContact O-N 3.07Å; V69-L72 PolarHBondContact O-N 2.99Å; V69-L72 VanDerWaalsContact O-N 3.13Å; E70-L72 VanDerWaalsContact C-N 3.32Å; E70-L72 PolarHBondContact O-N 3.38Å; L72-V75 PolarHBondContact O-N 3.1Å; L72-I76 WeakPolarHBondContact O-CD1 3.5Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.34Å; L72-I76 PolarHBondContact O-N 3.41Å |
| 73 | Q | 96.5 | Very high | 92.4 | Very high | 109 Ų | 109 | 93.5 Ų | 93.5 | 51% | 0.509 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.5 | -51 | 175.9 | -71.5 | 174.5 | -49.6 | 0 | 0 | 111.2 | V69 E70 I71 V75 I76 D77 | V69-Q73 HydrophobicContact CG1-CG 4.48Å; V69-Q73 WeakPolarHBondContact O-CG 3.26Å; V69-Q73 PolarHBondContact O-N 3.22Å; E70-Q73 PolarHBondContact O-N 3.36Å; I71-Q73 VanDerWaalsContact C-N 3.34Å; I71-Q73 PolarHBondContact O-N 3.28Å; Q73-V75 PolarHBondContact O-N 3.42Å; Q73-I76 WeakPolarHBondContact O-CB 3.32Å; Q73-I76 PolarHBondContact O-N 2.78Å; Q73-D77 PolarHBondContact O-N 3.06Å |
| 74 | H | 96.1 | Very high | 93.1 | Very high | 62 Ų | 62 | 90.1 Ų | 90.1 | 29% | 0.287 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -60 | -33.7 | 177.2 | -77.4 | -73.8 | 0 | 0 | 0 | 113.1 | V57 T59 L60 E70 I71 Y78 | V57-H74 HydrophobicContact CG1-CB 4.08Å; T59-H74 PolarHBondContact OG1-ND1 3.26Å; T59-H74 VanDerWaalsContact OG1-ND1 3.07Å; L60-H74 HydrophobicContact CD1-CB 4.27Å; L60-H74 HydrophobicContact CD2-CB 3.65Å; L60-H74 WeakPolarHBondContact CD2-CD2 3.14Å; L60-H74 HydrophobicContact CG-CB 3.75Å; E70-H74 PolarHBondContact O-CD2 2.94Å; E70-H74 PolarHBondContact O-N 3.12Å; I71-H74 PolarHBondContact O-N 3.48Å; H74-Y78 VanDerWaalsContact O-CB 3.29Å; H74-Y78 WeakPolarHBondContact O-CB 3.36Å; H74-Y78 PolarHBondContact O-N 3.48Å |
| 75 | V | 97 | Very high | 93.7 | Very high | 22 Ų | 22 | 90 Ų | 90 | 13% | 0.133 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -67.7 | -41.8 | 175 | 170.4 | 0 | 0 | 0 | 0 | 111.5 | L53 V57 I71 L72 Q73 Y78 I79 | L53-V75 HydrophobicContact CB-CG2 4.08Å; L53-V75 HydrophobicContact CD1-CG2 4.09Å; L53-V75 HydrophobicContact CD2-CG1 4.31Å; L53-V75 HydrophobicContact CD2-CG2 3.77Å; L53-V75 HydrophobicContact CG-CG2 4.17Å; V57-V75 HydrophobicContact CG2-CB 4.43Å; V57-V75 HydrophobicContact CG2-CG2 3.63Å; I71-V75 HydrophobicContact CG2-CG2 4.38Å; I71-V75 WeakPolarHBondContact O-CG2 3.49Å; I71-V75 PolarHBondContact O-N 3.42Å; L72-V75 PolarHBondContact O-N 3.1Å; Q73-V75 PolarHBondContact O-N 3.42Å; V75-Y78 PolarHBondContact O-N 3.46Å; V75-I79 HydrophobicContact CG1-CD1 3.77Å; V75-I79 HydrophobicContact CG1-CG1 4.45Å; V75-I79 VanDerWaalsContact O-CG1 3.27Å; V75-I79 WeakPolarHBondContact O-CG1 3.3Å; V75-I79 PolarHBondContact O-N 2.94Å |
| 76 | I | 96.6 | Very high | 94 | Very high | 100 Ų | 100 | 85.1 Ų | 85.1 | 51% | 0.513 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.1 | -47.5 | 177.6 | -70 | 160 | 0 | 0 | 0 | 110.1 | L72 Q73 Y78 I79 W80 | L72-I76 WeakPolarHBondContact O-CD1 3.5Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.34Å; L72-I76 PolarHBondContact O-N 3.41Å; Q73-I76 WeakPolarHBondContact O-CB 3.32Å; Q73-I76 PolarHBondContact O-N 2.78Å; I76-Y78 PolarHBondContact O-N 3.2Å; I76-I79 PolarHBondContact O-N 3.44Å; I76-W80 PolarHBondContact O-N 3.49Å |
| 77 | D | 95.3 | Very high | 93.4 | Very high | 92 Ų | 92 | 89.1 Ų | 89.1 | 49% | 0.492 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 179.4 | -63.6 | -26.6 | 0 | 0 | 0 | 110.9 | Q73 I79 W80 D81 | Q73-D77 PolarHBondContact O-N 3.06Å; D77-I79 PolarHBondContact O-N 3.3Å; D77-W80 WeakPolarHBondContact O-CB 3.11Å; D77-W80 PolarHBondContact O-N 3.3Å; D77-D81 PolarHBondContact O-N 2.93Å |
| 78 | Y | 96.9 | Very high | 91.8 | Very high | 71 Ų | 71 | 95 Ų | 95 | 28% | 0.278 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.1 | -40.6 | 178.7 | -177.2 | -127.5 | 0 | 0 | 0 | 113.1 | L56 V57 P58 H74 V75 I76 W80 D81 L82 | L56-Y78 VanDerWaalsContact O-CE1 3.3Å; L56-Y78 WeakPolarHBondContact O-CE1 3.45Å; V57-Y78 HydrophobicContact CB-CD1 4.39Å; V57-Y78 HydrophobicContact CG1-CD1 4.48Å; V57-Y78 HydrophobicContact CG1-CG 4.29Å; V57-Y78 HydrophobicContact CG2-CD1 3.95Å; V57-Y78 HydrophobicContact CG2-CG 4.49Å; P58-Y78 VanDerWaalsContact CD-CE2 3.43Å; P58-Y78 HydrophobicContact CG-CD2 4.27Å; P58-Y78 HydrophobicContact CG-CE2 3.74Å; H74-Y78 VanDerWaalsContact O-CB 3.29Å; H74-Y78 WeakPolarHBondContact O-CB 3.36Å; H74-Y78 PolarHBondContact O-N 3.48Å; V75-Y78 PolarHBondContact O-N 3.46Å; I76-Y78 PolarHBondContact O-N 3.2Å; Y78-W80 VanDerWaalsContact C-N 3.31Å; Y78-D81 PolarHBondContact O-N 3.26Å; Y78-L82 HydrophobicContact CD1-CD1 4.08Å; Y78-L82 HydrophobicContact CD2-CD1 4.36Å; Y78-L82 HydrophobicContact CD2-CG 4.15Å; Y78-L82 HydrophobicContact CE1-CD1 3.62Å; Y78-L82 HydrophobicContact CE1-CG 4.39Å; Y78-L82 HydrophobicContact CE2-CD1 3.91Å; Y78-L82 HydrophobicContact CE2-CD2 3.93Å; Y78-L82 HydrophobicContact CE2-CG 3.77Å; Y78-L82 HydrophobicContact CG-CD1 4.44Å; Y78-L82 WeakPolarHBondContact O-CB 3.49Å; Y78-L82 VanDerWaalsContact O-CG 3.27Å; Y78-L82 WeakPolarHBondContact O-CG 3.47Å; Y78-L82 PolarHBondContact O-N 2.96Å |
| 79 | I | 96.1 | Very high | 89.9 | Confident | 82 Ų | 82 | 95 Ų | 95 | 42% | 0.421 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 174.8 | -69.3 | 166.8 | 0 | 0 | 0 | 110.3 | V75 I76 D77 Q83 | V75-I79 HydrophobicContact CG1-CD1 3.77Å; V75-I79 HydrophobicContact CG1-CG1 4.45Å; V75-I79 VanDerWaalsContact O-CG1 3.27Å; V75-I79 WeakPolarHBondContact O-CG1 3.3Å; V75-I79 PolarHBondContact O-N 2.94Å; I76-I79 PolarHBondContact O-N 3.44Å; D77-I79 PolarHBondContact O-N 3.3Å; I79-Q83 HydrophobicContact CG2-CG 4.37Å; I79-Q83 WeakPolarHBondContact O-CB 3.26Å; I79-Q83 VanDerWaalsContact O-CG 3.23Å; I79-Q83 WeakPolarHBondContact O-CG 3.46Å; I79-Q83 PolarHBondContact O-N 3.11Å |
| 80 | W | 94.4 | Very high | 87.9 | Confident | 167 Ų | 167 | 95.8 Ų | 95.8 | 63% | 0.633 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -62.5 | -48.3 | 177.6 | -169.2 | -58.8 | 0 | 0 | 0 | 111.2 | I76 D77 Y78 L82 Q83 V84 | I76-W80 PolarHBondContact O-N 3.49Å; D77-W80 WeakPolarHBondContact O-CB 3.11Å; D77-W80 PolarHBondContact O-N 3.3Å; Y78-W80 VanDerWaalsContact C-N 3.31Å; W80-L82 VanDerWaalsContact C-N 3.35Å; W80-L82 PolarHBondContact O-N 3.45Å; W80-Q83 WeakPolarHBondContact O-CB 3.45Å; W80-Q83 PolarHBondContact O-N 2.91Å; W80-Q83 VanDerWaalsContact O-N 3.16Å; W80-V84 WeakPolarHBondContact O-CG2 3.49Å; W80-V84 PolarHBondContact O-N 2.92Å |
| 81 | D | 93.1 | Very high | 85.8 | Confident | 101 Ų | 101 | 101.2 Ų | 101.2 | 54% | 0.54 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.1 | -45.8 | 180 | -71.5 | -20.3 | 0 | 0 | 0 | 111.1 | D77 Y78 Q83 V84 E85 | D77-D81 PolarHBondContact O-N 2.93Å; Y78-D81 PolarHBondContact O-N 3.26Å; D81-Q83 VanDerWaalsContact C-N 3.35Å; D81-Q83 PolarHBondContact O-N 3.41Å; D81-V84 PolarHBondContact O-N 3.26Å; D81-E85 WeakPolarHBondContact O-CB 3.34Å; D81-E85 PolarHBondContact O-N 3.3Å |
| 82 | L | 93.9 | Very high | 83.7 | Confident | 54 Ų | 54 | 105.8 Ų | 105.8 | 28% | 0.283 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.5 | -41.5 | 174.9 | -72.5 | 178.8 | 0 | 0 | 0 | 112.2 | Y78 W80 V84 E85 L86 | Y78-L82 HydrophobicContact CD1-CD1 4.08Å; Y78-L82 HydrophobicContact CD2-CD1 4.36Å; Y78-L82 HydrophobicContact CD2-CG 4.15Å; Y78-L82 HydrophobicContact CE1-CD1 3.62Å; Y78-L82 HydrophobicContact CE1-CG 4.39Å; Y78-L82 HydrophobicContact CE2-CD1 3.91Å; Y78-L82 HydrophobicContact CE2-CD2 3.93Å; Y78-L82 HydrophobicContact CE2-CG 3.77Å; Y78-L82 HydrophobicContact CG-CD1 4.44Å; Y78-L82 WeakPolarHBondContact O-CB 3.49Å; Y78-L82 VanDerWaalsContact O-CG 3.27Å; Y78-L82 WeakPolarHBondContact O-CG 3.47Å; Y78-L82 PolarHBondContact O-N 2.96Å; W80-L82 VanDerWaalsContact C-N 3.35Å; W80-L82 PolarHBondContact O-N 3.45Å; L82-V84 VanDerWaalsContact C-N 3.32Å; L82-V84 PolarHBondContact O-N 3.05Å; L82-E85 PolarHBondContact O-N 3.45Å; L82-L86 WeakPolarHBondContact O-CB 3.48Å; L82-L86 WeakPolarHBondContact O-CD1 3.47Å; L82-L86 WeakPolarHBondContact O-CG 3.28Å; L82-L86 PolarHBondContact O-N 3.04Å |
| 83 | Q | 90.6 | Very high | 81.4 | Confident | 123 Ų | 123 | 112.1 Ų | 112.1 | 58% | 0.575 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.1 | -42.1 | 177 | -78.5 | 173.9 | -15.9 | 0 | 0 | 111.3 | I79 W80 D81 D87 | I79-Q83 HydrophobicContact CG2-CG 4.37Å; I79-Q83 WeakPolarHBondContact O-CB 3.26Å; I79-Q83 VanDerWaalsContact O-CG 3.23Å; I79-Q83 WeakPolarHBondContact O-CG 3.46Å; I79-Q83 PolarHBondContact O-N 3.11Å; W80-Q83 WeakPolarHBondContact O-CB 3.45Å; W80-Q83 PolarHBondContact O-N 2.91Å; W80-Q83 VanDerWaalsContact O-N 3.16Å; D81-Q83 VanDerWaalsContact C-N 3.35Å; D81-Q83 PolarHBondContact O-N 3.41Å; Q83-D87 WeakPolarHBondContact O-CB 3.32Å; Q83-D87 PolarHBondContact O-N 3.27Å |
| 84 | V | 90.9 | Very high | 79 | Confident | 93 Ų | 93 | 114.6 Ų | 114.6 | 56% | 0.564 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68.1 | -44.5 | 177.1 | 174 | 0 | 0 | 0 | 0 | 111.7 | W80 D81 L82 L86 D87 | W80-V84 WeakPolarHBondContact O-CG2 3.49Å; W80-V84 PolarHBondContact O-N 2.92Å; D81-V84 PolarHBondContact O-N 3.26Å; L82-V84 VanDerWaalsContact C-N 3.32Å; L82-V84 PolarHBondContact O-N 3.05Å; V84-L86 VanDerWaalsContact C-N 3.28Å; V84-L86 PolarHBondContact O-N 3.23Å; V84-D87 PolarHBondContact O-N 2.89Å |
| 85 | E | 91.6 | Very high | 76.6 | Confident | 151 Ų | 151 | 119.7 Ų | 119.7 | 71% | 0.706 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.5 | -34.5 | 179.6 | -172.3 | 174.5 | -178.7 | 0 | 0 | 112 | D81 L82 | D81-E85 WeakPolarHBondContact O-CB 3.34Å; D81-E85 PolarHBondContact O-N 3.3Å; L82-E85 PolarHBondContact O-N 3.45Å |
| 86 | L | 89.8 | Confident | 74.3 | Confident | 113 Ų | 113 | 127 Ų | 127 | 59% | 0.592 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -89.3 | -8.8 | 179.9 | -63 | 172.5 | 0 | 0 | 0 | 114.2 | L82 V84 E88 P89 | L82-L86 WeakPolarHBondContact O-CB 3.48Å; L82-L86 WeakPolarHBondContact O-CD1 3.47Å; L82-L86 WeakPolarHBondContact O-CG 3.28Å; L82-L86 PolarHBondContact O-N 3.04Å; V84-L86 VanDerWaalsContact C-N 3.28Å; V84-L86 PolarHBondContact O-N 3.23Å; L86-E88 PolarHBondContact O-N 3.34Å; L86-E88 VanDerWaalsContact O-N 3.17Å; L86-P89 WeakPolarHBondContact O-CD 3.19Å |
| 87 | D | 74.3 | Confident | 71.9 | Confident | 107 Ų | 107 | 127.7 Ų | 127.7 | 57% | 0.572 | 63% | 0.629 | S | S | * | * | trans | -68.6 | -12.3 | -175.7 | -146.8 | -117.2 | 0 | 0 | 0 | 113.3 | Q83 V84 P89 E90 | Q83-D87 WeakPolarHBondContact O-CB 3.32Å; Q83-D87 PolarHBondContact O-N 3.27Å; V84-D87 PolarHBondContact O-N 2.89Å; D87-P89 VanDerWaalsContact C-N 3.31Å; D87-E90 PolarHBondContact O-N 2.95Å | ||
| 88 | E | 60.4 | Low | 69.8 | Low | 180 Ų | 180 | 128.8 Ų | 128.8 | 84% | 0.841 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 27.7 | 178.6 | -84 | -71.8 | 128.3 | 0 | 0 | 115.5 | L86 | L86-E88 PolarHBondContact O-N 3.34Å; L86-E88 VanDerWaalsContact O-N 3.17Å |
| 89 | P | 53.5 | Low | 67.6 | Low | 102 Ų | 102 | 130.2 Ų | 130.2 | 66% | 0.662 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -144.1 | 10.3 | 136.5 | 29.3 | -9.1 | 0 | 0 | 0 | 116.8 | L86 D87 | L86-P89 WeakPolarHBondContact O-CD 3.19Å; D87-P89 VanDerWaalsContact C-N 3.31Å |
| 90 | E | 52.3 | Low | 65.8 | Low | 109 Ų | 109 | 137.9 Ų | 137.9 | 51% | 0.509 | 68% | 0.681 | S | S | . | * | trans | -112.3 | 38.3 | -170.1 | -67.2 | -69.2 | 133.2 | 0 | 0 | 114.5 | D87 S92 | D87-E90 PolarHBondContact O-N 2.95Å; E90-S92 PolarHBondContact O-N 3.24Å | ||
| 91 | K | 50.8 | Low | 64 | Low | 204 Ų | 204 | 134.5 Ų | 134.5 | 89% | 0.887 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | 8.4 | 172.7 | -161.4 | 163.4 | -171.8 | 164.3 | 0 | 115.1 | ||
| 92 | S | 50.1 | Low | 62.4 | Low | 102 Ų | 102 | 133.7 Ų | 133.7 | 71% | 0.713 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.1 | 22.8 | -170.2 | -51.2 | 0 | 0 | 0 | 0 | 115.2 | E90 | E90-S92 PolarHBondContact O-N 3.24Š|
| 93 | R | 49.1 | Very low | 60.5 | Low | 211 Ų | 211 | 138.2 Ų | 138.2 | 80% | 0.796 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -122.6 | 61.1 | 167.2 | -57.7 | -167 | 83.1 | 162.9 | 3.4 | 111.6 | ||
| 94 | Q | 46.1 | Very low | 59.1 | Low | 161 Ų | 161 | 137.5 Ų | 137.5 | 75% | 0.752 | 71% | 0.707 | S | S | * | * | trans | 6 | 119.3 | 149 | -75.9 | 164.4 | -28.5 | 0 | 0 | 116.3 | ||||
| 95 | Q | 46.8 | Very low | 57.8 | Low | 168 Ų | 168 | 135.8 Ų | 135.8 | 79% | 0.785 | 70% | 0.697 | S | S | * | * | trans | 71 | 66.5 | 135.7 | -57.3 | 179.8 | -35.2 | 0 | 0 | 117.9 | ||||
| 96 | H | 47.3 | Very low | 56.7 | Low | 177 Ų | 177 | 133.4 Ų | 133.4 | 82% | 0.819 | 69% | 0.688 | S | S | * | * | trans | -132.7 | 43.1 | 151.5 | -84.7 | -93.7 | 0 | 0 | 0 | 112.1 | V98 | H96-V98 PolarHBondContact O-N 2.85Å; H96-V98 VanDerWaalsContact O-N 3.12Å | ||
| 97 | S | 47 | Very low | 55.4 | Low | 113 Ų | 113 | 133.1 Ų | 133.1 | 79% | 0.79 | 69% | 0.687 | S | S | * | * | trans | -79 | 78.3 | 155.7 | 62.6 | 0 | 0 | 0 | 0 | 108.2 | P99 | S97-P99 VanDerWaalsContact O-CD 3.24Å; S97-P99 WeakPolarHBondContact O-CD 3.37Å | ||
| 98 | V | 51.2 | Low | 55.1 | Low | 115 Ų | 115 | 131 Ų | 131 | 70% | 0.697 | 69% | 0.685 | S | S | * | * | trans | -71.5 | 112.5 | 166.7 | -141.1 | 0 | 0 | 0 | 0 | 105.9 | H96 R100 | H96-V98 PolarHBondContact O-N 2.85Å; H96-V98 VanDerWaalsContact O-N 3.12Å; V98-R100 PolarHBondContact O-N 3.08Å | ||
| 99 | P | 50.9 | Low | 55.4 | Low | 102 Ų | 102 | 127.8 Ų | 127.8 | 66% | 0.662 | 67% | 0.669 | S | S | * | * | trans | -66.3 | 123.6 | 173.9 | 26.5 | -24.8 | 0 | 0 | 0 | 106.1 | S97 T101 | S97-P99 VanDerWaalsContact O-CD 3.24Å; S97-P99 WeakPolarHBondContact O-CD 3.37Å; P99-T101 VanDerWaalsContact C-N 3.35Å; P99-T101 PolarHBondContact O-N 2.82Å | ||
| 100 | R | 57.6 | Low | 55.8 | Low | 242 Ų | 242 | 128.5 Ų | 128.5 | 91% | 0.913 | 67% | 0.667 | S | S | * | * | trans | -61.6 | 99.6 | 176.2 | -63.7 | -165.1 | -171.5 | 125.9 | 0.4 | 108 | V98 | V98-R100 PolarHBondContact O-N 3.08Š| ||
| 101 | T | 57.7 | Low | 56.2 | Low | 97 Ų | 97 | 126.9 Ų | 126.9 | 60% | 0.595 | 67% | 0.673 | S | S | * | * | trans | -62.5 | 126.8 | 174 | 36.5 | 0 | 0 | 0 | 0 | 108.5 | P99 | P99-T101 VanDerWaalsContact C-N 3.35Å; P99-T101 PolarHBondContact O-N 2.82Å | ||
| 102 | P | 58 | Low | 56.6 | Low | 84 Ų | 84 | 121.4 Ų | 121.4 | 55% | 0.545 | 66% | 0.66 | S | S | . | * | trans | -62.4 | 146.1 | -179 | 25.2 | -32.8 | 0 | 0 | 0 | 110.3 | T104 T105 | P102-T104 PolarHBondContact O-N 3.48Å; P102-T105 PolarHBondContact O-N 3.41Å; P102-T105 PolarHBondContact O-OG1 3.49Å | ||
| 103 | L | 54.7 | Low | 57.2 | Low | 149 Ų | 149 | 122.8 Ų | 122.8 | 78% | 0.78 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -49.2 | -24.1 | 179.2 | -107.7 | 104 | 0 | 0 | 0 | 114 | T105 N107 | L103-T105 VanDerWaalsContact C-N 3.28Å; L103-T105 PolarHBondContact O-N 2.88Å; L103-N107 PolarHBondContact O-N 3.36Å |
| 104 | T | 61.6 | Low | 57.5 | Low | 107 Ų | 107 | 117.6 Ų | 117.6 | 66% | 0.656 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -58.7 | -35.3 | 175.1 | -110.4 | 0 | 0 | 0 | 0 | 113.2 | P102 N107 A108 | P102-T104 PolarHBondContact O-N 3.48Å; T104-N107 PolarHBondContact O-N 2.97Å; T104-A108 PolarHBondContact O-N 2.97Å; T104-A108 VanDerWaalsContact O-N 3.15Å |
| 105 | T | 63.2 | Low | 57.8 | Low | 58 Ų | 58 | 116.4 Ų | 116.4 | 36% | 0.356 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -67.2 | -43.2 | -176.5 | -55.4 | 0 | 0 | 0 | 0 | 111.4 | P102 L103 N107 A108 E109 | P102-T105 PolarHBondContact O-N 3.41Å; P102-T105 PolarHBondContact O-OG1 3.49Å; L103-T105 VanDerWaalsContact C-N 3.28Å; L103-T105 PolarHBondContact O-N 2.88Å; T105-N107 VanDerWaalsContact C-N 3.35Å; T105-N107 PolarHBondContact O-N 3.22Å; T105-A108 PolarHBondContact O-N 3.14Å; T105-E109 PolarHBondContact O-N 3.35Å; T105-E109 VanDerWaalsContact O-N 3.16Å |
| 106 | L | 67.9 | Low | 57.6 | Low | 101 Ų | 101 | 121.1 Ų | 121.1 | 53% | 0.529 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -69.1 | -33 | 178.8 | -61.9 | -175.1 | 0 | 0 | 0 | 112.6 | A108 E109 L110 | L106-A108 VanDerWaalsContact C-N 3.32Å; L106-A108 PolarHBondContact O-N 3.36Å; L106-E109 PolarHBondContact O-N 3.5Å; L106-L110 PolarHBondContact O-N 3.17Å |
| 107 | N | 62.7 | Low | 58.1 | Low | 107 Ų | 107 | 118.4 Ų | 118.4 | 57% | 0.572 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -67.3 | -33.1 | 174.9 | -79.8 | 9.9 | 0 | 0 | 0 | 112.4 | L103 T104 T105 A111 | L103-N107 PolarHBondContact O-N 3.36Å; T104-N107 PolarHBondContact O-N 2.97Å; T105-N107 VanDerWaalsContact C-N 3.35Å; T105-N107 PolarHBondContact O-N 3.22Å; N107-A111 PolarHBondContact O-N 3.34Å |
| 108 | A | 68.4 | Low | 58.7 | Low | 62 Ų | 62 | 118.6 Ų | 118.6 | 51% | 0.512 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -70.5 | -39.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | T104 T105 L106 A111 S112 | T104-A108 PolarHBondContact O-N 2.97Å; T104-A108 VanDerWaalsContact O-N 3.15Å; T105-A108 PolarHBondContact O-N 3.14Å; L106-A108 VanDerWaalsContact C-N 3.32Å; L106-A108 PolarHBondContact O-N 3.36Å; A108-A111 PolarHBondContact O-N 3.44Å; A108-S112 PolarHBondContact O-N 3.36Å; A108-S112 VanDerWaalsContact O-N 3.14Å |
| 109 | E | 66 | Low | 59.1 | Low | 112 Ų | 112 | 118.8 Ų | 118.8 | 52% | 0.523 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -67.4 | -39.8 | 177 | -68.7 | -161.1 | 108.2 | 0 | 0 | 112.2 | T105 L106 A111 S112 I113 | T105-E109 PolarHBondContact O-N 3.35Å; T105-E109 VanDerWaalsContact O-N 3.16Å; L106-E109 PolarHBondContact O-N 3.5Å; E109-A111 VanDerWaalsContact C-N 3.31Å; E109-A111 PolarHBondContact O-N 3.22Å; E109-S112 WeakPolarHBondContact CA-OG 3.36Å; E109-S112 PolarHBondContact O-N 2.8Å; E109-S112 VanDerWaalsContact O-N 3.12Å; E109-S112 PolarHBondContact O-OG 3Å; E109-I113 WeakPolarHBondContact O-CD1 3.14Å; E109-I113 WeakPolarHBondContact O-CG1 3.47Å; E109-I113 PolarHBondContact O-N 3.16Å |
| 110 | L | 62.6 | Low | 59.6 | Low | 118 Ų | 118 | 119.8 Ų | 119.8 | 62% | 0.618 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -62.9 | -36.1 | 174 | -77.5 | 164.4 | 0 | 0 | 0 | 113 | L106 S112 I113 | L106-L110 PolarHBondContact O-N 3.17Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 3.12Å; L110-I113 PolarHBondContact O-N 3.23Å |
| 111 | A | 59.8 | Low | 59.8 | Low | 75 Ų | 75 | 112.2 Ų | 112.2 | 62% | 0.62 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -69.2 | -28.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | N107 A108 E109 | N107-A111 PolarHBondContact O-N 3.34Å; A108-A111 PolarHBondContact O-N 3.44Å; E109-A111 VanDerWaalsContact C-N 3.31Å; E109-A111 PolarHBondContact O-N 3.22Å |
| 112 | S | 59.4 | Low | 59.9 | Low | 88 Ų | 88 | 113.2 Ų | 113.2 | 62% | 0.615 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -77.3 | -16.4 | 177.8 | 68.9 | 0 | 0 | 0 | 0 | 114.5 | A108 E109 L110 | A108-S112 PolarHBondContact O-N 3.36Å; A108-S112 VanDerWaalsContact O-N 3.14Å; E109-S112 WeakPolarHBondContact CA-OG 3.36Å; E109-S112 PolarHBondContact O-N 2.8Å; E109-S112 VanDerWaalsContact O-N 3.12Å; E109-S112 PolarHBondContact O-OG 3Å; L110-S112 VanDerWaalsContact C-N 3.3Å; L110-S112 PolarHBondContact O-N 3.12Å |
| 113 | I | 62.3 | Low | 60 | Low | 131 Ų | 131 | 115.3 Ų | 115.3 | 67% | 0.672 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -8.6 | -178.4 | -64.2 | 160 | 0 | 0 | 0 | 112.2 | E109 L110 V115 | E109-I113 WeakPolarHBondContact O-CD1 3.14Å; E109-I113 WeakPolarHBondContact O-CG1 3.47Å; E109-I113 PolarHBondContact O-N 3.16Å; L110-I113 PolarHBondContact O-N 3.23Å; I113-V115 PolarHBondContact O-N 2.87Å |
| 114 | S | 56.3 | Low | 60.4 | Low | 102 Ų | 102 | 112.7 Ų | 112.7 | 71% | 0.713 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -94.9 | 25 | -175.1 | -164.2 | 0 | 0 | 0 | 0 | 115.4 | ||
| 115 | V | 53.1 | Low | 60.3 | Low | 136 Ų | 136 | 113.2 Ų | 113.2 | 82% | 0.824 | 65% | 0.651 | S | S | * | * | trans | -137.7 | 85.7 | 166.2 | 179.4 | 0 | 0 | 0 | 0 | 109.1 | I113 | I113-V115 PolarHBondContact O-N 2.87Š| ||
| 116 | E | 42.3 | Very low | 60.1 | Low | 268 Ų | 268 | 118.2 Ų | 118.2 | 100% | 1.252 | 68% | 0.677 | S | S | * | * | trans | -158.1 | 0 | 130.8 | -156.9 | 162.1 | 85.2 | 0 | 0 | 109.9 |
Retrieved 116 of 116 residues in 44.5 ms
(Link to these results)