| 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 | 46.6 | Very low | 62.4 | Low | 244 Ų | 244 | 153.2 Ų | 153.2 | 100% | 1.202 | 79% | 0.79 | S | S | * | * | 0 | 98.8 | 0 | -166.9 | 175.3 | 170.2 | 0 | 0 | 106.3 | |||||
| 2 | I | 51.3 | Low | 63.1 | Low | 174 Ų | 174 | 157.3 Ų | 157.3 | 89% | 0.892 | 79% | 0.788 | S | S | * | * | trans | -121.5 | 125.6 | 172.3 | -63.2 | 174.2 | 0 | 0 | 0 | 104.2 | ||||
| 3 | A | 60.6 | Low | 63.2 | Low | 89 Ų | 89 | 154.2 Ų | 154.2 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | -67.7 | 135.1 | -158.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E5 | A3-E5 VanDerWaalsContact C-N 3.29Å; A3-E5 PolarHBondContact O-N 3.21Å | ||
| 4 | D | 61.1 | Low | 63.7 | Low | 129 Ų | 129 | 154.8 Ų | 154.8 | 69% | 0.69 | 79% | 0.791 | S | S | * | * | trans | -71.5 | 83.1 | 166.2 | 179.7 | 61.6 | 0 | 0 | 0 | 107.8 | K6 | D4-K6 PolarHBondContact O-N 3.12Å; D4-K6 VanDerWaalsContact O-N 3.16Å; D4-K6 WeakPolarHBondContact OD2-CE 3.45Å; D4-K6 IonicContact OD2-NZ 3.75Å | ||
| 5 | E | 65.1 | Low | 63.8 | Low | 183 Ų | 183 | 150.3 Ų | 150.3 | 86% | 0.855 | 78% | 0.78 | S | S | * | * | trans | -81.5 | 92.1 | 172.1 | -158.6 | 169.2 | 155.3 | 0 | 0 | 107.5 | A3 D7 | A3-E5 VanDerWaalsContact C-N 3.29Å; A3-E5 PolarHBondContact O-N 3.21Å; E5-D7 PolarHBondContact O-N 3.06Å; E5-D7 VanDerWaalsContact O-N 3.07Å | ||
| 6 | K | 62.2 | Low | 63.7 | Low | 152 Ų | 152 | 148.1 Ų | 148.1 | 66% | 0.661 | 78% | 0.778 | S | S | * | * | trans | -54.3 | 108.3 | 175.3 | -66.5 | -95.1 | 164.9 | 159.9 | 0 | 108.9 | D4 H8 | D4-K6 PolarHBondContact O-N 3.12Å; D4-K6 VanDerWaalsContact O-N 3.16Å; D4-K6 WeakPolarHBondContact OD2-CE 3.45Å; D4-K6 IonicContact OD2-NZ 3.75Å; K6-H8 VanDerWaalsContact C-N 3.32Å; K6-H8 PolarHBondContact O-N 2.82Å | ||
| 7 | D | 67 | Low | 64 | Low | 144 Ų | 144 | 146.8 Ų | 146.8 | 77% | 0.77 | 78% | 0.777 | S | S | * | * | trans | -55.8 | 95.6 | 167 | -174.6 | 28.8 | 0 | 0 | 0 | 108.8 | E5 V9 | E5-D7 PolarHBondContact O-N 3.06Å; E5-D7 VanDerWaalsContact O-N 3.07Å; D7-V9 VanDerWaalsContact C-N 3.25Å; D7-V9 PolarHBondContact O-N 3.34Å | ||
| 8 | H | 67.8 | Low | 63.9 | Low | 166 Ų | 166 | 145.1 Ų | 145.1 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -80.4 | 80.1 | -178.1 | -138.4 | -76.1 | 0 | 0 | 0 | 106.8 | K6 E10 | K6-H8 VanDerWaalsContact C-N 3.32Å; K6-H8 PolarHBondContact O-N 2.82Å; H8-E10 VanDerWaalsContact C-N 3.34Å; H8-E10 PolarHBondContact O-N 2.74Å | ||
| 9 | V | 69.4 | Low | 64.2 | Low | 97 Ų | 97 | 147.2 Ų | 147.2 | 59% | 0.588 | 78% | 0.78 | S | S | * | * | trans | -67 | 96.9 | 175.1 | -168.9 | 0 | 0 | 0 | 0 | 107.5 | D7 L11 | D7-V9 VanDerWaalsContact C-N 3.25Å; D7-V9 PolarHBondContact O-N 3.34Å; V9-L11 PolarHBondContact O-N 3.38Å | ||
| 10 | E | 68.4 | Low | 64.6 | Low | 145 Ų | 145 | 145.6 Ų | 145.6 | 68% | 0.678 | 78% | 0.777 | S | S | * | * | trans | -62.7 | 102.4 | 168 | -76.7 | -172.4 | 172.8 | 0 | 0 | 108 | H8 R12 | H8-E10 VanDerWaalsContact C-N 3.34Å; H8-E10 PolarHBondContact O-N 2.74Å; E10-R12 PolarHBondContact O-N 2.74Å | ||
| 11 | L | 66.7 | Low | 64.7 | Low | 162 Ų | 162 | 147.6 Ų | 147.6 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | -67.3 | 83.3 | 169.6 | -64.8 | 176 | 0 | 0 | 0 | 108.3 | V9 | V9-L11 PolarHBondContact O-N 3.38Š| ||
| 12 | R | 71.1 | Confident | 65.8 | Low | 203 Ų | 203 | 142.2 Ų | 142.2 | 77% | 0.766 | 76% | 0.756 | S | S | * | * | trans | -67.3 | 125.4 | 163.4 | -71.9 | -174.3 | 168.2 | -170.7 | -4.9 | 107 | E10 D14 | E10-R12 PolarHBondContact O-N 2.74Å; R12-D14 PolarHBondContact O-N 2.93Å; R12-D14 VanDerWaalsContact O-N 3.14Å | ||
| 13 | P | 63.9 | Low | 66.9 | Low | 116 Ų | 116 | 142.6 Ų | 142.6 | 75% | 0.753 | 75% | 0.754 | S | S | * | * | trans | -59.6 | 123.2 | 175 | 23.7 | -30.9 | 0 | 0 | 0 | 108.2 | S15 | P13-S15 PolarHBondContact O-N 2.68Š| ||
| 14 | D | 70.2 | Confident | 67.4 | Low | 163 Ų | 163 | 141.6 Ų | 141.6 | 87% | 0.872 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -72.6 | 84.1 | -178.4 | -151.2 | 8.9 | 0 | 0 | 0 | 107.4 | R12 | R12-D14 PolarHBondContact O-N 2.93Å; R12-D14 VanDerWaalsContact O-N 3.14Å |
| 15 | S | 65.3 | Low | 68 | Low | 88 Ų | 88 | 140.5 Ų | 140.5 | 62% | 0.615 | 75% | 0.75 | S | S | * | * | S | Bend | trans | 69.7 | 145.4 | -171 | 75.7 | 0 | 0 | 0 | 0 | 115.8 | P13 T17 | P13-S15 PolarHBondContact O-N 2.68Å; S15-T17 PolarHBondContact O-N 3.18Å; S15-T17 VanDerWaalsContact O-N 3.09Å |
| 16 | P | 62.1 | Low | 68.6 | Low | 115 Ų | 115 | 134.7 Ų | 134.7 | 75% | 0.747 | 73% | 0.725 | S | S | * | * | trans | -62.4 | 117.4 | 172.9 | 24.8 | -30 | 0 | 0 | 0 | 107.5 | ||||
| 17 | T | 70 | Confident | 69.4 | Low | 125 Ų | 125 | 135.4 Ų | 135.4 | 77% | 0.767 | 73% | 0.728 | S | S | * | * | trans | -42.3 | 121.3 | 160.3 | 18.1 | 0 | 0 | 0 | 0 | 106.7 | S15 E19 | S15-T17 PolarHBondContact O-N 3.18Å; S15-T17 VanDerWaalsContact O-N 3.09Å; T17-E19 PolarHBondContact O-N 3.39Å | ||
| 18 | P | 62.2 | Low | 70 | Confident | 117 Ų | 117 | 134.7 Ų | 134.7 | 76% | 0.76 | 72% | 0.72 | S | S | * | * | trans | -53.4 | 126.4 | 175.4 | 21.8 | -30.5 | 0 | 0 | 0 | 106 | V20 | P18-V20 PolarHBondContact O-N 3.43Š| ||
| 19 | E | 68.3 | Low | 70.5 | Confident | 184 Ų | 184 | 131.3 Ų | 131.3 | 86% | 0.86 | 71% | 0.708 | S | S | * | * | trans | -58.1 | 100.2 | 168.1 | -62.7 | -163.2 | 169.5 | 0 | 0 | 104.6 | T17 E21 | T17-E19 PolarHBondContact O-N 3.39Å; E19-E21 PolarHBondContact O-N 2.96Å | ||
| 20 | V | 72.5 | Confident | 70.8 | Confident | 116 Ų | 116 | 133.3 Ų | 133.3 | 70% | 0.703 | 71% | 0.709 | S | S | * | * | trans | -63.4 | 114 | 168 | 77 | 0 | 0 | 0 | 0 | 102.6 | P18 I22 | P18-V20 PolarHBondContact O-N 3.43Å; V20-I22 HydrophobicContact CG1-CG1 3.85Å; V20-I22 PolarHBondContact O-N 3.45Å | ||
| 21 | E | 67.2 | Low | 71.1 | Confident | 187 Ų | 187 | 131 Ų | 131 | 87% | 0.874 | 71% | 0.705 | S | S | * | * | trans | -62.1 | 92.6 | 169 | -68 | -178.4 | 156.5 | 0 | 0 | 104.8 | E19 E23 | E19-E21 PolarHBondContact O-N 2.96Å; E21-E23 PolarHBondContact O-N 2.7Å | ||
| 22 | I | 69.1 | Low | 71.5 | Confident | 131 Ų | 131 | 126.3 Ų | 126.3 | 67% | 0.672 | 69% | 0.685 | S | S | * | * | trans | -64.1 | 112.3 | 167.5 | -45.6 | 173.2 | 0 | 0 | 0 | 102.5 | V20 G24 V25 | V20-I22 HydrophobicContact CG1-CG1 3.85Å; V20-I22 PolarHBondContact O-N 3.45Å; I22-G24 PolarHBondContact O-N 2.99Å; I22-V25 HydrophobicContact CG2-CG2 4.45Å | ||
| 23 | E | 75.2 | Confident | 71.5 | Confident | 182 Ų | 182 | 122.2 Ų | 122.2 | 85% | 0.85 | 68% | 0.676 | S | S | * | * | trans | -46.2 | 114.6 | 168.4 | -177.9 | 168.2 | -161.1 | 0 | 0 | 106.1 | E21 V25 | E21-E23 PolarHBondContact O-N 2.7Å; E23-V25 PolarHBondContact O-N 2.86Å | ||
| 24 | G | 71 | Confident | 71.7 | Confident | 68 Ų | 68 | 122 Ų | 122 | 70% | 0.701 | 67% | 0.669 | S | S | * | * | trans | -53.7 | 111.6 | -163.5 | 0 | 0 | 0 | 0 | 0 | 109 | I22 N26 | I22-G24 PolarHBondContact O-N 2.99Å; G24-N26 PolarHBondContact O-N 2.93Å | ||
| 25 | V | 72.8 | Confident | 71.7 | Confident | 106 Ų | 106 | 119.6 Ų | 119.6 | 64% | 0.642 | 66% | 0.656 | S | S | * | * | trans | -61.6 | 113.6 | 174.2 | -171.5 | 0 | 0 | 0 | 0 | 105.3 | I22 E23 F27 | I22-V25 HydrophobicContact CG2-CG2 4.45Å; E23-V25 PolarHBondContact O-N 2.86Å; V25-F27 PolarHBondContact O-N 3.42Å | ||
| 26 | N | 79.2 | Confident | 71.7 | Confident | 61 Ų | 61 | 122.4 Ų | 122.4 | 33% | 0.326 | 66% | 0.66 | S | S | . | * | trans | -65.3 | 126.5 | 177.9 | 179.3 | 8.1 | 0 | 0 | 0 | 108.4 | G24 E28 D29 F30 | G24-N26 PolarHBondContact O-N 2.93Å; N26-E28 PolarHBondContact O-N 2.89Å; N26-E28 PolarHBondContact OD1-N 2.79Å; N26-E28 PolarHBondContact OD1-OE2 3.37Å; N26-D29 HydrophobicContact CB-CB 4.08Å; N26-D29 PolarHBondContact ND2-OD1 2.91Å; N26-D29 VanDerWaalsContact ND2-OD1 3.1Å; N26-D29 WeakPolarHBondContact O-CB 3.45Å; N26-D29 PolarHBondContact O-N 3.36Å; N26-D29 VanDerWaalsContact O-N 3.07Å; N26-F30 PolarHBondContact O-N 2.89Å; N26-F30 VanDerWaalsContact O-N 3.15Å | ||
| 27 | F | 78.4 | Confident | 71.9 | Confident | 167 Ų | 167 | 122.4 Ų | 122.4 | 73% | 0.732 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -60.6 | -33 | 176.7 | -77.8 | -78.2 | 0 | 0 | 0 | 111.6 | V25 D29 F30 V31 | V25-F27 PolarHBondContact O-N 3.42Å; F27-D29 VanDerWaalsContact C-N 3.32Å; F27-D29 PolarHBondContact O-N 3.45Å; F27-F30 PolarHBondContact O-N 2.75Å; F27-V31 WeakPolarHBondContact O-CG2 3.24Å; F27-V31 PolarHBondContact O-N 2.9Å |
| 28 | E | 79.7 | Confident | 71.8 | Confident | 130 Ų | 130 | 120.4 Ų | 120.4 | 61% | 0.607 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -66.1 | -34.9 | 175.2 | -71.3 | 78.1 | -130.9 | 0 | 0 | 112.2 | N26 V31 S32 | N26-E28 PolarHBondContact O-N 2.89Å; N26-E28 PolarHBondContact OD1-N 2.79Å; N26-E28 PolarHBondContact OD1-OE2 3.37Å; E28-V31 PolarHBondContact O-N 3.02Å; E28-S32 WeakPolarHBondContact O-CB 3.49Å; E28-S32 PolarHBondContact O-N 3.37Å; E28-S32 PolarHBondContact O-OG 3.12Å |
| 29 | D | 77.9 | Confident | 72 | Confident | 95 Ų | 95 | 120.4 Ų | 120.4 | 51% | 0.508 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.6 | -39.4 | 175.9 | -63.3 | -0.2 | 0 | 0 | 0 | 110.3 | N26 F27 S32 M33 | N26-D29 HydrophobicContact CB-CB 4.08Å; N26-D29 PolarHBondContact ND2-OD1 2.91Å; N26-D29 VanDerWaalsContact ND2-OD1 3.1Å; N26-D29 WeakPolarHBondContact O-CB 3.45Å; N26-D29 PolarHBondContact O-N 3.36Å; N26-D29 VanDerWaalsContact O-N 3.07Å; F27-D29 VanDerWaalsContact C-N 3.32Å; F27-D29 PolarHBondContact O-N 3.45Å; D29-S32 PolarHBondContact O-N 3.27Å; D29-M33 WeakPolarHBondContact O-CG 3.42Å; D29-M33 PolarHBondContact O-N 3.41Å |
| 30 | F | 75.4 | Confident | 72 | Confident | 139 Ų | 139 | 115.5 Ų | 115.5 | 61% | 0.61 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -65.5 | -42.2 | 176.5 | -174.9 | -94.2 | 0 | 0 | 0 | 112.6 | N26 F27 S32 M33 | N26-F30 PolarHBondContact O-N 2.89Å; N26-F30 VanDerWaalsContact O-N 3.15Å; F27-F30 PolarHBondContact O-N 2.75Å; F30-S32 VanDerWaalsContact C-N 3.31Å; F30-M33 PolarHBondContact O-N 3.22Å |
| 31 | V | 75.5 | Confident | 72.2 | Confident | 96 Ų | 96 | 116 Ų | 116 | 58% | 0.582 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -65.5 | -38 | 175.4 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | F27 E28 M33 D34 | F27-V31 WeakPolarHBondContact O-CG2 3.24Å; F27-V31 PolarHBondContact O-N 2.9Å; E28-V31 PolarHBondContact O-N 3.02Å; V31-M33 VanDerWaalsContact C-N 3.32Å; V31-M33 PolarHBondContact O-N 3.46Å; V31-D34 PolarHBondContact O-N 3.44Å |
| 32 | S | 75.3 | Confident | 72.8 | Confident | 64 Ų | 64 | 114.9 Ų | 114.9 | 45% | 0.448 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -69.1 | -28.8 | 178.3 | -54.4 | 0 | 0 | 0 | 0 | 112.9 | E28 D29 F30 D34 D35 E36 | E28-S32 WeakPolarHBondContact O-CB 3.49Å; E28-S32 PolarHBondContact O-N 3.37Å; E28-S32 PolarHBondContact O-OG 3.12Å; D29-S32 PolarHBondContact O-N 3.27Å; F30-S32 VanDerWaalsContact C-N 3.31Å; S32-D34 VanDerWaalsContact C-N 3.25Å; S32-D34 PolarHBondContact O-N 2.94Å; S32-D35 PolarHBondContact O-N 3.32Å; S32-E36 PolarHBondContact O-N 3.21Å |
| 33 | M | 70.7 | Confident | 73.4 | Confident | 116 Ų | 116 | 112.3 Ų | 112.3 | 57% | 0.571 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -63.1 | -31.2 | 174.5 | -78.1 | 176.7 | 69.8 | 0 | 0 | 112.6 | D29 F30 V31 D35 E36 L37 | D29-M33 WeakPolarHBondContact O-CG 3.42Å; D29-M33 PolarHBondContact O-N 3.41Å; F30-M33 PolarHBondContact O-N 3.22Å; V31-M33 VanDerWaalsContact C-N 3.32Å; V31-M33 PolarHBondContact O-N 3.46Å; M33-D35 VanDerWaalsContact C-N 3.33Å; M33-E36 PolarHBondContact O-N 3.37Å; M33-L37 WeakPolarHBondContact O-CG 3.36Å; M33-L37 PolarHBondContact O-N 2.94Å |
| 34 | D | 68.6 | Low | 74.1 | Confident | 113 Ų | 113 | 107.7 Ų | 107.7 | 60% | 0.604 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.8 | -37 | 177.2 | -162.7 | 48.8 | 0 | 0 | 0 | 111.4 | V31 S32 E36 L37 A38 | V31-D34 PolarHBondContact O-N 3.44Å; S32-D34 VanDerWaalsContact C-N 3.25Å; S32-D34 PolarHBondContact O-N 2.94Å; D34-E36 PolarHBondContact O-N 2.89Å; D34-L37 PolarHBondContact O-N 3.41Å; D34-A38 WeakPolarHBondContact O-CB 3.39Å; D34-A38 PolarHBondContact O-N 3.43Å |
| 35 | D | 69.2 | Low | 74.9 | Confident | 112 Ų | 112 | 108.7 Ų | 108.7 | 60% | 0.599 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.7 | -38.1 | 176.8 | -76.9 | -20.3 | 0 | 0 | 0 | 112.1 | S32 M33 A38 | S32-D35 PolarHBondContact O-N 3.32Å; M33-D35 VanDerWaalsContact C-N 3.33Å; D35-A38 PolarHBondContact O-N 3.33Å |
| 36 | E | 66.6 | Low | 75.7 | Confident | 147 Ų | 147 | 110.6 Ų | 110.6 | 69% | 0.687 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.7 | -41.5 | 174.8 | -67.6 | -168.7 | 172.8 | 0 | 0 | 111.4 | S32 M33 D34 A38 T39 | S32-E36 PolarHBondContact O-N 3.21Å; M33-E36 PolarHBondContact O-N 3.37Å; D34-E36 PolarHBondContact O-N 2.89Å; E36-A38 VanDerWaalsContact C-N 3.32Å; E36-A38 PolarHBondContact O-N 3.07Å; E36-T39 PolarHBondContact O-N 3.21Å; E36-T39 PolarHBondContact O-OG1 3.48Å |
| 37 | L | 64.8 | Low | 76.2 | Confident | 115 Ų | 115 | 110.2 Ų | 110.2 | 60% | 0.602 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -67.7 | -30.9 | 176.7 | -67.2 | 179.1 | 0 | 0 | 0 | 112.7 | M33 D34 T39 S40 | M33-L37 WeakPolarHBondContact O-CG 3.36Å; M33-L37 PolarHBondContact O-N 2.94Å; D34-L37 PolarHBondContact O-N 3.41Å; L37-T39 PolarHBondContact O-N 3.25Å; L37-S40 VanDerWaalsContact O-CB 3.24Å; L37-S40 WeakPolarHBondContact O-CB 3.41Å; L37-S40 PolarHBondContact O-N 3.26Å |
| 38 | A | 67.5 | Low | 76.8 | Confident | 83 Ų | 83 | 106 Ų | 106 | 69% | 0.686 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -63 | -21.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | D34 D35 E36 | D34-A38 WeakPolarHBondContact O-CB 3.39Å; D34-A38 PolarHBondContact O-N 3.43Å; D35-A38 PolarHBondContact O-N 3.33Å; E36-A38 VanDerWaalsContact C-N 3.32Å; E36-A38 PolarHBondContact O-N 3.07Å |
| 39 | T | 68.4 | Low | 77.2 | Confident | 116 Ų | 116 | 105.5 Ų | 105.5 | 71% | 0.712 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | -8.4 | 173.9 | 71.8 | 0 | 0 | 0 | 0 | 113.7 | E36 L37 T41 | E36-T39 PolarHBondContact O-N 3.21Å; E36-T39 PolarHBondContact O-OG1 3.48Å; L37-T39 PolarHBondContact O-N 3.25Å; T39-T41 PolarHBondContact O-N 3.32Å |
| 40 | S | 67.3 | Low | 77.8 | Confident | 82 Ų | 82 | 103.7 Ų | 103.7 | 57% | 0.573 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -69.2 | 107.7 | 175.1 | -159.2 | 0 | 0 | 0 | 0 | 108.1 | L37 E42 | L37-S40 VanDerWaalsContact O-CB 3.24Å; L37-S40 WeakPolarHBondContact O-CB 3.41Å; L37-S40 PolarHBondContact O-N 3.26Å; S40-E42 PolarHBondContact O-N 2.98Å; S40-E42 VanDerWaalsContact O-N 3.08Å |
| 41 | T | 76.9 | Confident | 78.5 | Confident | 126 Ų | 126 | 100.6 Ų | 100.6 | 77% | 0.773 | 57% | 0.57 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 119.3 | 168.4 | -58.9 | 0 | 0 | 0 | 0 | 107.2 | T39 P43 | T39-T41 PolarHBondContact O-N 3.32Å; T41-P43 WeakPolarHBondContact O-CD 3.31Å |
| 42 | E | 79.7 | Confident | 79.3 | Confident | 164 Ų | 164 | 100.6 Ų | 100.6 | 77% | 0.766 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 120.4 | 173.2 | -174.5 | 178.2 | 179 | 0 | 0 | 107.9 | S40 D44 | S40-E42 PolarHBondContact O-N 2.98Å; S40-E42 VanDerWaalsContact O-N 3.08Å; E42-D44 PolarHBondContact O-N 3.45Å |
| 43 | P | 82.2 | Confident | 80 | Confident | 77 Ų | 77 | 99 Ų | 99 | 50% | 0.5 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -61 | 137.1 | -176.3 | 23.6 | -33.2 | 0 | 0 | 0 | 109.2 | T41 P45 I48 | T41-P43 WeakPolarHBondContact O-CD 3.31Å; P43-P45 VanDerWaalsContact O-CD 3.28Å; P43-P45 WeakPolarHBondContact O-CD 3.3Å; P43-P45 VanDerWaalsContact O-N 3.12Å; P43-I48 HydrophobicContact CB-CD1 3.79Å; P43-I48 HydrophobicContact CB-CG1 4.05Å; P43-I48 HydrophobicContact CG-CD1 3.62Å; P43-I48 HydrophobicContact CG-CG1 4.37Å |
| 44 | D | 88.3 | Confident | 81 | Confident | 84 Ų | 84 | 96.8 Ų | 96.8 | 45% | 0.449 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -54.9 | 119.4 | 175.5 | 169.4 | 19.5 | 0 | 0 | 0 | 109.5 | E42 Q46 A47 I48 | E42-D44 PolarHBondContact O-N 3.45Å; D44-Q46 PolarHBondContact O-N 3Å; D44-Q46 VanDerWaalsContact O-N 3.15Å; D44-Q46 WeakPolarHBondContact OD1-CB 3.47Å; D44-Q46 PolarHBondContact OD1-N 3.37Å; D44-A47 HydrophobicContact CB-CB 3.93Å; D44-A47 WeakPolarHBondContact O-CB 3.06Å; D44-A47 PolarHBondContact O-N 2.97Å; D44-A47 PolarHBondContact OD2-N 3.47Å; D44-I48 PolarHBondContact O-N 3.05Å |
| 45 | P | 88.7 | Confident | 82.1 | Confident | 89 Ų | 89 | 99.4 Ų | 99.4 | 58% | 0.578 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -55 | -33.5 | 178.9 | -26.4 | 34.8 | 0 | 0 | 0 | 113 | P43 I48 F49 | P43-P45 VanDerWaalsContact O-CD 3.28Å; P43-P45 WeakPolarHBondContact O-CD 3.3Å; P43-P45 VanDerWaalsContact O-N 3.12Å; P45-I48 PolarHBondContact O-N 3.07Å; P45-F49 PolarHBondContact O-N 3.41Å |
| 46 | Q | 90.1 | Very high | 83.1 | Confident | 146 Ų | 146 | 97.2 Ų | 97.2 | 68% | 0.682 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -68 | -43.9 | 177.1 | -64 | -178 | -42.4 | 0 | 0 | 110.9 | D44 I48 F49 Q50 | D44-Q46 PolarHBondContact O-N 3Å; D44-Q46 VanDerWaalsContact O-N 3.15Å; D44-Q46 WeakPolarHBondContact OD1-CB 3.47Å; D44-Q46 PolarHBondContact OD1-N 3.37Å; Q46-I48 VanDerWaalsContact C-N 3.31Å; Q46-I48 PolarHBondContact O-N 3.18Å; Q46-F49 PolarHBondContact O-N 3.08Å; Q46-Q50 VanDerWaalsContact O-CG 3.23Å; Q46-Q50 WeakPolarHBondContact O-CG 3.39Å; Q46-Q50 PolarHBondContact O-N 3.27Å |
| 47 | A | 88.9 | Confident | 84.1 | Confident | 54 Ų | 54 | 93.2 Ų | 93.2 | 45% | 0.446 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -60.2 | -40.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | D44 Q50 S51 | D44-A47 HydrophobicContact CB-CB 3.93Å; D44-A47 WeakPolarHBondContact O-CB 3.06Å; D44-A47 PolarHBondContact O-N 2.97Å; D44-A47 PolarHBondContact OD2-N 3.47Å; A47-Q50 PolarHBondContact O-N 3.24Å; A47-S51 WeakPolarHBondContact O-CB 3.44Å; A47-S51 PolarHBondContact O-N 3.06Å |
| 48 | I | 90.5 | Very high | 85.1 | Confident | 77 Ų | 77 | 92.6 Ų | 92.6 | 40% | 0.395 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60 | -48.5 | 174.5 | -65.1 | 165.2 | 0 | 0 | 0 | 110.4 | P43 D44 P45 Q46 Q50 S51 I52 | P43-I48 HydrophobicContact CB-CD1 3.79Å; P43-I48 HydrophobicContact CB-CG1 4.05Å; P43-I48 HydrophobicContact CG-CD1 3.62Å; P43-I48 HydrophobicContact CG-CG1 4.37Å; D44-I48 PolarHBondContact O-N 3.05Å; P45-I48 PolarHBondContact O-N 3.07Å; Q46-I48 VanDerWaalsContact C-N 3.31Å; Q46-I48 PolarHBondContact O-N 3.18Å; I48-Q50 PolarHBondContact O-N 3.11Å; I48-S51 WeakPolarHBondContact O-CB 3.42Å; I48-S51 PolarHBondContact O-N 3.32Å; I48-I52 HydrophobicContact CG2-CD1 3.92Å; I48-I52 WeakPolarHBondContact O-CG1 3.23Å; I48-I52 PolarHBondContact O-N 3.05Å |
| 49 | F | 89.5 | Confident | 85.4 | Confident | 120 Ų | 120 | 92.8 Ų | 92.8 | 53% | 0.526 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60 | -46.9 | 179.9 | -175.6 | -109.4 | 0 | 0 | 0 | 111.9 | P45 Q46 S51 I52 L53 | P45-F49 PolarHBondContact O-N 3.41Å; Q46-F49 PolarHBondContact O-N 3.08Å; F49-S51 VanDerWaalsContact C-N 3.29Å; F49-S51 PolarHBondContact O-N 3.41Å; F49-I52 PolarHBondContact O-N 3.02Å; F49-L53 HydrophobicContact CD1-CD1 3.87Å; F49-L53 HydrophobicContact CD1-CG 4.32Å; F49-L53 HydrophobicContact CE1-CD1 3.39Å; F49-L53 HydrophobicContact CE1-CG 4.02Å; F49-L53 HydrophobicContact CE2-CG 4.49Å; F49-L53 HydrophobicContact CZ-CD1 3.85Å; F49-L53 HydrophobicContact CZ-CD2 4.15Å; F49-L53 HydrophobicContact CZ-CG 4.11Å; F49-L53 WeakPolarHBondContact O-CG 3.48Å; F49-L53 PolarHBondContact O-N 3.15Å |
| 50 | Q | 90.4 | Very high | 85.2 | Confident | 58 Ų | 58 | 89.1 Ų | 89.1 | 27% | 0.271 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.9 | -36.4 | 177.8 | -63.8 | -67.9 | 84.7 | 0 | 0 | 112.1 | Q46 A47 I48 L53 A54 Y62 | Q46-Q50 VanDerWaalsContact O-CG 3.23Å; Q46-Q50 WeakPolarHBondContact O-CG 3.39Å; Q46-Q50 PolarHBondContact O-N 3.27Å; A47-Q50 PolarHBondContact O-N 3.24Å; I48-Q50 PolarHBondContact O-N 3.11Å; Q50-L53 PolarHBondContact O-N 2.94Å; Q50-A54 VanDerWaalsContact O-CB 3.3Å; Q50-A54 WeakPolarHBondContact O-CB 3.46Å; Q50-A54 PolarHBondContact O-N 3.35Å; Q50-Y62 PolarHBondContact NE2-OH 3.21Å |
| 51 | S | 90.5 | Very high | 84.8 | Confident | 73 Ų | 73 | 93 Ų | 93 | 51% | 0.51 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.7 | -44.5 | 175.2 | -171.2 | 0 | 0 | 0 | 0 | 111.6 | A47 I48 F49 A54 E55 | A47-S51 WeakPolarHBondContact O-CB 3.44Å; A47-S51 PolarHBondContact O-N 3.06Å; I48-S51 WeakPolarHBondContact O-CB 3.42Å; I48-S51 PolarHBondContact O-N 3.32Å; F49-S51 VanDerWaalsContact C-N 3.29Å; F49-S51 PolarHBondContact O-N 3.41Å; S51-A54 PolarHBondContact O-N 3.45Å; S51-E55 WeakPolarHBondContact O-CB 3.45Å; S51-E55 PolarHBondContact O-N 3.31Å |
| 52 | I | 91.7 | Very high | 83.9 | Confident | 97 Ų | 97 | 95.2 Ų | 95.2 | 50% | 0.497 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.7 | -43.6 | 177.7 | -66.5 | 166 | 0 | 0 | 0 | 110.4 | I48 F49 E55 A56 | I48-I52 HydrophobicContact CG2-CD1 3.92Å; I48-I52 WeakPolarHBondContact O-CG1 3.23Å; I48-I52 PolarHBondContact O-N 3.05Å; F49-I52 PolarHBondContact O-N 3.02Å; I52-E55 PolarHBondContact O-N 3.37Å; I52-A56 WeakPolarHBondContact O-CB 3.48Å; I52-A56 PolarHBondContact O-N 3.14Å |
| 53 | L | 90.6 | Very high | 82.6 | Confident | 30 Ų | 30 | 93.2 Ų | 93.2 | 16% | 0.157 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -60.7 | -47.7 | 176 | -70.8 | -174.1 | 0 | 0 | 0 | 111.2 | F49 Q50 E55 A56 G57 L58 P60 | F49-L53 HydrophobicContact CD1-CD1 3.87Å; F49-L53 HydrophobicContact CD1-CG 4.32Å; F49-L53 HydrophobicContact CE1-CD1 3.39Å; F49-L53 HydrophobicContact CE1-CG 4.02Å; F49-L53 HydrophobicContact CE2-CG 4.49Å; F49-L53 HydrophobicContact CZ-CD1 3.85Å; F49-L53 HydrophobicContact CZ-CD2 4.15Å; F49-L53 HydrophobicContact CZ-CG 4.11Å; F49-L53 WeakPolarHBondContact O-CG 3.48Å; F49-L53 PolarHBondContact O-N 3.15Å; Q50-L53 PolarHBondContact O-N 2.94Å; L53-E55 PolarHBondContact O-N 3.16Å; L53-A56 CarbonylContact O-C 3.52Å; L53-A56 PolarHBondContact O-N 3.09Å; L53-G57 PolarHBondContact O-N 3.38Å; L53-G57 VanDerWaalsContact O-N 3.12Å; L53-L58 CarbonylContact C-O 3.18Å; L53-L58 HydrophobicContact CB-CB 4.23Å; L53-L58 WeakPolarHBondContact CB-O 3.48Å; L53-L58 HydrophobicContact CD2-CB 4.01Å; L53-L58 HydrophobicContact CD2-CD1 3.85Å; L53-L58 CarbonylContact O-C 3.55Å; L53-L58 WeakPolarHBondContact O-CA 3.5Å; L53-L58 PolarHBondContact O-N 2.89Å; L53-P60 HydrophobicContact CD1-CB 4.07Å |
| 54 | A | 90.3 | Very high | 81.4 | Confident | 69 Ų | 69 | 94.1 Ų | 94.1 | 57% | 0.57 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.1 | -41.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q50 S51 A56 G57 | Q50-A54 VanDerWaalsContact O-CB 3.3Å; Q50-A54 WeakPolarHBondContact O-CB 3.46Å; Q50-A54 PolarHBondContact O-N 3.35Å; S51-A54 PolarHBondContact O-N 3.45Å; A54-A56 VanDerWaalsContact C-N 3.34Å; A54-G57 PolarHBondContact O-N 3.07Å |
| 55 | E | 91.5 | Very high | 79.7 | Confident | 169 Ų | 169 | 96.8 Ų | 96.8 | 79% | 0.79 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.4 | -38.9 | 175.3 | -177.2 | 171 | -173.3 | 0 | 0 | 112 | S51 I52 L53 G57 | S51-E55 WeakPolarHBondContact O-CB 3.45Å; S51-E55 PolarHBondContact O-N 3.31Å; I52-E55 PolarHBondContact O-N 3.37Å; L53-E55 PolarHBondContact O-N 3.16Å; E55-G57 PolarHBondContact O-N 2.85Å |
| 56 | A | 91 | Very high | 78 | Confident | 65 Ų | 65 | 98.9 Ų | 98.9 | 54% | 0.537 | 54% | 0.542 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -4.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | I52 L53 A54 L58 | I52-A56 WeakPolarHBondContact O-CB 3.48Å; I52-A56 PolarHBondContact O-N 3.14Å; L53-A56 CarbonylContact O-C 3.52Å; L53-A56 PolarHBondContact O-N 3.09Å; A54-A56 VanDerWaalsContact C-N 3.34Å; A56-L58 HydrophobicContact CB-CD1 4.08Å; A56-L58 HydrophobicContact CB-CG 3.98Å; A56-L58 PolarHBondContact O-N 2.76Å |
| 57 | G | 88.3 | Confident | 76.3 | Confident | 64 Ų | 64 | 100.7 Ų | 100.7 | 66% | 0.66 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 70 | 13.3 | -173.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L53 A54 E55 S59 | L53-G57 PolarHBondContact O-N 3.38Å; L53-G57 VanDerWaalsContact O-N 3.12Å; A54-G57 PolarHBondContact O-N 3.07Å; E55-G57 PolarHBondContact O-N 2.85Å; G57-S59 PolarHBondContact O-N 2.99Å |
| 58 | L | 85.9 | Confident | 74.6 | Confident | 101 Ų | 101 | 101.6 Ų | 101.6 | 53% | 0.529 | 55% | 0.554 | S | S | . | * | trans | -84.2 | 102 | 172.3 | -58.9 | 176.6 | 0 | 0 | 0 | 106.7 | L53 A56 | L53-L58 CarbonylContact C-O 3.18Å; L53-L58 HydrophobicContact CB-CB 4.23Å; L53-L58 WeakPolarHBondContact CB-O 3.48Å; L53-L58 HydrophobicContact CD2-CB 4.01Å; L53-L58 HydrophobicContact CD2-CD1 3.85Å; L53-L58 CarbonylContact O-C 3.55Å; L53-L58 WeakPolarHBondContact O-CA 3.5Å; L53-L58 PolarHBondContact O-N 2.89Å; A56-L58 HydrophobicContact CB-CD1 4.08Å; A56-L58 HydrophobicContact CB-CG 3.98Å; A56-L58 PolarHBondContact O-N 2.76Å | ||
| 59 | S | 72.4 | Confident | 73.2 | Confident | 88 Ų | 88 | 106 Ų | 106 | 62% | 0.615 | 57% | 0.572 | S | S | * | * | trans | -65.3 | 132.3 | 164.7 | -165.6 | 0 | 0 | 0 | 0 | 106.7 | G57 E61 | G57-S59 PolarHBondContact O-N 2.99Å; S59-E61 PolarHBondContact O-N 2.97Å | ||
| 60 | P | 63.6 | Low | 71.8 | Confident | 38 Ų | 38 | 105.3 Ų | 105.3 | 25% | 0.247 | 58% | 0.575 | C | S | . | * | trans | -71.1 | 71.3 | 164.2 | 29.7 | -26.9 | 0 | 0 | 0 | 105.8 | L53 Y62 | L53-P60 HydrophobicContact CD1-CB 4.07Å; P60-Y62 HydrophobicContact CB-CE2 4.28Å; P60-Y62 HydrophobicContact CG-CE2 4.43Å; P60-Y62 WeakPolarHBondContact O-CD2 3.4Å; P60-Y62 VanDerWaalsContact O-CE2 3.31Å; P60-Y62 WeakPolarHBondContact O-CE2 3.15Å; P60-Y62 PolarHBondContact O-N 2.81Å | ||
| 61 | E | 60.7 | Low | 70.5 | Confident | 164 Ų | 164 | 110.1 Ų | 110.1 | 77% | 0.766 | 60% | 0.597 | S | S | * | * | trans | -60.5 | 98.9 | 151.2 | -72.5 | 180 | -176.8 | 0 | 0 | 103.1 | S59 D63 | S59-E61 PolarHBondContact O-N 2.97Å; E61-D63 PolarHBondContact O-N 2.85Å | ||
| 62 | Y | 56.6 | Low | 69.2 | Low | 172 Ų | 172 | 110.8 Ų | 110.8 | 68% | 0.675 | 60% | 0.598 | S | S | * | * | trans | -62.3 | 66.2 | 166.4 | -54.6 | -90.6 | 0 | 0 | 0 | 107.3 | Q50 P60 V64 | Q50-Y62 PolarHBondContact NE2-OH 3.21Å; P60-Y62 HydrophobicContact CB-CE2 4.28Å; P60-Y62 HydrophobicContact CG-CE2 4.43Å; P60-Y62 WeakPolarHBondContact O-CD2 3.4Å; P60-Y62 VanDerWaalsContact O-CE2 3.31Å; P60-Y62 WeakPolarHBondContact O-CE2 3.15Å; P60-Y62 PolarHBondContact O-N 2.81Å; Y62-V64 PolarHBondContact O-N 3.07Å | ||
| 63 | D | 53.5 | Low | 68.1 | Low | 122 Ų | 122 | 110.8 Ų | 110.8 | 65% | 0.652 | 60% | 0.596 | S | S | * | * | trans | -76.5 | 70.1 | 155.6 | -141.7 | 27.7 | 0 | 0 | 0 | 104.6 | E61 E65 | E61-D63 PolarHBondContact O-N 2.85Å; D63-E65 HydrophobicContact CB-CG 4.47Å; D63-E65 VanDerWaalsContact CG-CG 3.49Å; D63-E65 PolarHBondContact O-N 3.04Å; D63-E65 WeakPolarHBondContact OD1-CG 3.43Å; D63-E65 WeakPolarHBondContact OD2-CG 3.48Å | ||
| 64 | V | 56.4 | Low | 66.9 | Low | 96 Ų | 96 | 115.1 Ų | 115.1 | 58% | 0.582 | 62% | 0.617 | S | S | * | * | trans | -69.3 | 60 | 154.7 | -172.8 | 0 | 0 | 0 | 0 | 105.2 | Y62 E66 | Y62-V64 PolarHBondContact O-N 3.07Å; V64-E66 HydrophobicContact CG1-CG 4.1Å; V64-E66 PolarHBondContact O-N 3.03Å | ||
| 65 | E | 53.4 | Low | 65.9 | Low | 140 Ų | 140 | 116.6 Ų | 116.6 | 65% | 0.654 | 62% | 0.618 | S | S | * | * | trans | -66.2 | 95.2 | 149.1 | -67.1 | -70.4 | 124.4 | 0 | 0 | 102.1 | D63 E67 | D63-E65 HydrophobicContact CB-CG 4.47Å; D63-E65 VanDerWaalsContact CG-CG 3.49Å; D63-E65 PolarHBondContact O-N 3.04Å; D63-E65 WeakPolarHBondContact OD1-CG 3.43Å; D63-E65 WeakPolarHBondContact OD2-CG 3.48Å; E65-E67 PolarHBondContact O-N 2.75Å | ||
| 66 | E | 52.8 | Low | 64.6 | Low | 133 Ų | 133 | 115.1 Ų | 115.1 | 62% | 0.621 | 61% | 0.612 | S | S | * | * | trans | -48.5 | 85.7 | 165.3 | -73.8 | -80.8 | 155.7 | 0 | 0 | 108.3 | V64 S68 | V64-E66 HydrophobicContact CG1-CG 4.1Å; V64-E66 PolarHBondContact O-N 3.03Å; E66-S68 PolarHBondContact O-N 2.91Å; E66-S68 WeakPolarHBondContact OE2-CB 3.28Å; E66-S68 PolarHBondContact OE2-OG 2.88Å | ||
| 67 | E | 52.7 | Low | 63.6 | Low | 185 Ų | 185 | 117.8 Ų | 117.8 | 86% | 0.864 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | 21.2 | 161.3 | -74.2 | -160.8 | 140.2 | 0 | 0 | 110.7 | E65 | E65-E67 PolarHBondContact O-N 2.75Š|
| 68 | S | 54.9 | Low | 62.7 | Low | 73 Ų | 73 | 120.5 Ų | 120.5 | 51% | 0.51 | 61% | 0.61 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.4 | -9.4 | 176.3 | 78.7 | 0 | 0 | 0 | 0 | 113.2 | E66 | E66-S68 PolarHBondContact O-N 2.91Å; E66-S68 WeakPolarHBondContact OE2-CB 3.28Å; E66-S68 PolarHBondContact OE2-OG 2.88Å |
| 69 | E | 60.3 | Low | 62.1 | Low | 168 Ų | 168 | 123.1 Ų | 123.1 | 79% | 0.785 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -78.1 | -20.5 | 179.4 | -142.6 | 160.1 | -141.2 | 0 | 0 | 113.2 | ||
| 70 | N | 59.7 | Low | 61.9 | Low | 107 Ų | 107 | 126.5 Ų | 126.5 | 57% | 0.572 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -78.7 | -20 | -177.7 | -177.7 | 59.1 | 0 | 0 | 0 | 114.6 | T72 | N70-T72 VanDerWaalsContact C-N 3.28Å; N70-T72 PolarHBondContact O-N 3.41Å |
| 71 | E | 63.7 | Low | 62.2 | Low | 159 Ų | 159 | 130 Ų | 130 | 74% | 0.743 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -67.9 | -31.7 | -179.2 | -165.6 | 175.2 | 155.1 | 0 | 0 | 111.6 | ||
| 72 | T | 64.1 | Low | 62.5 | Low | 86 Ų | 86 | 123.8 Ų | 123.8 | 53% | 0.528 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -86.8 | -23.1 | -176.5 | 69.7 | 0 | 0 | 0 | 0 | 114.7 | N70 M74 V75 Q76 | N70-T72 VanDerWaalsContact C-N 3.28Å; N70-T72 PolarHBondContact O-N 3.41Å; T72-M74 VanDerWaalsContact C-N 3.33Å; T72-M74 PolarHBondContact O-N 2.98Å; T72-V75 PolarHBondContact O-N 2.76Å; T72-Q76 PolarHBondContact O-N 3.18Å |
| 73 | E | 67.7 | Low | 63.1 | Low | 97 Ų | 97 | 119.2 Ų | 119.2 | 45% | 0.453 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.4 | -39.8 | 178.3 | -165.5 | -172.5 | 154.7 | 0 | 0 | 111.2 | V75 Q76 K77 | E73-V75 VanDerWaalsContact C-N 3.32Å; E73-V75 PolarHBondContact O-N 3.26Å; E73-Q76 PolarHBondContact O-N 3.08Å; E73-K77 PolarHBondContact O-N 3.05Å; E73-K77 VanDerWaalsContact O-N 3.12Å; E73-K77 VanDerWaalsContact OE1-CE 3.24Å; E73-K77 WeakPolarHBondContact OE1-CE 3.5Å; E73-K77 IonicContact OE1-NZ 2.74Å; E73-K77 PolarHBondContact OE1-NZ 2.99Å |
| 74 | M | 66 | Low | 63.8 | Low | 122 Ų | 122 | 115.4 Ų | 115.4 | 60% | 0.601 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.5 | -36.7 | 177.3 | -69.7 | -75.6 | -76 | 0 | 0 | 112.3 | T72 L78 | T72-M74 VanDerWaalsContact C-N 3.33Å; T72-M74 PolarHBondContact O-N 2.98Å; M74-L78 WeakPolarHBondContact O-CG 3.42Å; M74-L78 PolarHBondContact O-N 3.21Å |
| 75 | V | 67.7 | Low | 64.5 | Low | 99 Ų | 99 | 118.5 Ų | 118.5 | 60% | 0.6 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -68 | -36.5 | 178.5 | -178 | 0 | 0 | 0 | 0 | 111.2 | T72 E73 K79 | T72-V75 PolarHBondContact O-N 2.76Å; E73-V75 VanDerWaalsContact C-N 3.32Å; E73-V75 PolarHBondContact O-N 3.26Å; V75-K79 PolarHBondContact O-N 3.1Å |
| 76 | Q | 66 | Low | 65.5 | Low | 139 Ų | 139 | 116.5 Ų | 116.5 | 65% | 0.65 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -70.1 | -43.2 | 176.7 | -65.5 | -170.5 | 18.2 | 0 | 0 | 112.3 | T72 E73 L78 K79 E80 | T72-Q76 PolarHBondContact O-N 3.18Å; E73-Q76 PolarHBondContact O-N 3.08Å; Q76-L78 VanDerWaalsContact C-N 3.33Å; Q76-L78 PolarHBondContact O-N 3.31Å; Q76-K79 WeakPolarHBondContact O-CB 3.41Å; Q76-K79 PolarHBondContact O-N 3.31Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; Q76-E80 PolarHBondContact O-N 3.18Å; Q76-E80 VanDerWaalsContact O-N 3.08Å |
| 77 | K | 69.9 | Low | 66.3 | Low | 120 Ų | 120 | 115.5 Ų | 115.5 | 52% | 0.522 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -61.5 | -39.4 | 177.5 | -73.6 | -172.4 | -176.8 | 160.1 | 0 | 112.7 | E73 K79 E80 E81 | E73-K77 PolarHBondContact O-N 3.05Å; E73-K77 VanDerWaalsContact O-N 3.12Å; E73-K77 VanDerWaalsContact OE1-CE 3.24Å; E73-K77 WeakPolarHBondContact OE1-CE 3.5Å; E73-K77 IonicContact OE1-NZ 2.74Å; E73-K77 PolarHBondContact OE1-NZ 2.99Å; K77-K79 VanDerWaalsContact C-N 3.3Å; K77-K79 PolarHBondContact O-N 3.07Å; K77-E80 PolarHBondContact O-N 3.16Å; K77-E81 PolarHBondContact O-N 3.15Å; K77-E81 VanDerWaalsContact O-N 3.07Å |
| 78 | L | 67.6 | Low | 67.2 | Low | 122 Ų | 122 | 110.1 Ų | 110.1 | 64% | 0.639 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -63.7 | -35.1 | 175.2 | -76.9 | 169.3 | 0 | 0 | 0 | 112.5 | M74 Q76 G82 | M74-L78 WeakPolarHBondContact O-CG 3.42Å; M74-L78 PolarHBondContact O-N 3.21Å; Q76-L78 VanDerWaalsContact C-N 3.33Å; Q76-L78 PolarHBondContact O-N 3.31Å; L78-G82 PolarHBondContact O-N 3.47Å |
| 79 | K | 73.3 | Confident | 68.1 | Low | 156 Ų | 156 | 114.5 Ų | 114.5 | 68% | 0.678 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.9 | -42.1 | 176.9 | -167.5 | 176.6 | 178.3 | 179.5 | 0 | 111.6 | V75 Q76 K77 V83 | V75-K79 PolarHBondContact O-N 3.1Å; Q76-K79 WeakPolarHBondContact O-CB 3.41Å; Q76-K79 PolarHBondContact O-N 3.31Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; K77-K79 VanDerWaalsContact C-N 3.3Å; K77-K79 PolarHBondContact O-N 3.07Å; K79-V83 HydrophobicContact CG-CG2 4.43Å; K79-V83 WeakPolarHBondContact O-CB 3.47Å; K79-V83 WeakPolarHBondContact O-CG2 3.24Å; K79-V83 PolarHBondContact O-N 3.32Å |
| 80 | E | 69.3 | Low | 68.7 | Low | 158 Ų | 158 | 113.7 Ų | 113.7 | 74% | 0.738 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -64.1 | -45.1 | 176.4 | -99.8 | -173.7 | 160.4 | 0 | 0 | 112.6 | Q76 K77 G82 V83 G84 | Q76-E80 PolarHBondContact O-N 3.18Å; Q76-E80 VanDerWaalsContact O-N 3.08Å; K77-E80 PolarHBondContact O-N 3.16Å; E80-G82 PolarHBondContact O-N 3Å; E80-V83 PolarHBondContact O-N 2.99Å; E80-G84 PolarHBondContact O-N 3.31Å |
| 81 | E | 69.2 | Low | 68.7 | Low | 111 Ų | 111 | 120.6 Ų | 120.6 | 52% | 0.519 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -66.4 | -38.6 | 179 | -159.6 | -170.6 | 157.7 | 0 | 0 | 111.7 | K77 G84 R85 | K77-E81 PolarHBondContact O-N 3.15Å; K77-E81 VanDerWaalsContact O-N 3.07Å; E81-G84 PolarHBondContact O-N 3.5Å; E81-R85 WeakPolarHBondContact O-CG 3.37Å; E81-R85 PolarHBondContact O-N 2.69Å; E81-R85 IonicContact OE1-CZ 3.63Å; E81-R85 IonicContact OE1-NE 3.61Å; E81-R85 IonicContact OE1-NH2 2.79Å; E81-R85 PolarHBondContact OE1-NH2 3.07Å |
| 82 | G | 67.8 | Low | 68.9 | Low | 34 Ų | 34 | 118.7 Ų | 118.7 | 35% | 0.351 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.9 | -43.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113 | L78 E80 R85 V86 | L78-G82 PolarHBondContact O-N 3.47Å; E80-G82 PolarHBondContact O-N 3Å; G82-R85 PolarHBondContact O-N 2.96Å; G82-V86 WeakPolarHBondContact O-CG2 2.75Å; G82-V86 PolarHBondContact O-N 3.38Å; G82-V86 VanDerWaalsContact O-N 3.16Å |
| 83 | V | 68.8 | Low | 69.2 | Low | 77 Ų | 77 | 120.4 Ų | 120.4 | 47% | 0.467 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -66.1 | -38.9 | 177.9 | 172 | 0 | 0 | 0 | 0 | 111.1 | K79 E80 R85 V86 L87 | K79-V83 HydrophobicContact CG-CG2 4.43Å; K79-V83 WeakPolarHBondContact O-CB 3.47Å; K79-V83 WeakPolarHBondContact O-CG2 3.24Å; K79-V83 PolarHBondContact O-N 3.32Å; E80-V83 PolarHBondContact O-N 2.99Å; V83-R85 VanDerWaalsContact C-N 3.32Å; V83-R85 PolarHBondContact O-N 3.29Å; V83-V86 PolarHBondContact O-N 3.46Å; V83-L87 HydrophobicContact CG1-CD1 3.93Å; V83-L87 WeakPolarHBondContact O-CB 3.46Å; V83-L87 PolarHBondContact O-N 3.37Å |
| 84 | G | 68.8 | Low | 69.2 | Low | 41 Ų | 41 | 121.7 Ų | 121.7 | 42% | 0.423 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -59.3 | -40.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | E80 E81 A88 | E80-G84 PolarHBondContact O-N 3.31Å; E81-G84 PolarHBondContact O-N 3.5Å; G84-A88 WeakPolarHBondContact O-CB 3.37Å; G84-A88 PolarHBondContact O-N 3.44Å; G84-A88 VanDerWaalsContact O-N 3.07Å |
| 85 | R | 71 | Confident | 69.4 | Low | 162 Ų | 162 | 121.7 Ų | 121.7 | 61% | 0.611 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -68.7 | -42.1 | 177.1 | -68.9 | -179 | -171.6 | -141.4 | 5.5 | 112.8 | E81 G82 V83 A88 Q89 | E81-R85 WeakPolarHBondContact O-CG 3.37Å; E81-R85 PolarHBondContact O-N 2.69Å; E81-R85 IonicContact OE1-CZ 3.63Å; E81-R85 IonicContact OE1-NE 3.61Å; E81-R85 IonicContact OE1-NH2 2.79Å; E81-R85 PolarHBondContact OE1-NH2 3.07Å; G82-R85 PolarHBondContact O-N 2.96Å; V83-R85 VanDerWaalsContact C-N 3.32Å; V83-R85 PolarHBondContact O-N 3.29Å; R85-A88 PolarHBondContact O-N 3.47Å; R85-Q89 PolarHBondContact O-N 3.46Å |
| 86 | V | 73.5 | Confident | 69.5 | Low | 98 Ų | 98 | 123.1 Ų | 123.1 | 59% | 0.594 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.5 | -39.8 | 177.8 | 177.7 | 0 | 0 | 0 | 0 | 111.1 | G82 V83 A88 Q89 L90 | G82-V86 WeakPolarHBondContact O-CG2 2.75Å; G82-V86 PolarHBondContact O-N 3.38Å; G82-V86 VanDerWaalsContact O-N 3.16Å; V83-V86 PolarHBondContact O-N 3.46Å; V86-A88 VanDerWaalsContact C-N 3.35Å; V86-A88 PolarHBondContact O-N 3.26Å; V86-Q89 PolarHBondContact O-N 3.4Å; V86-L90 PolarHBondContact O-N 3.02Å |
| 87 | L | 69.3 | Low | 69.8 | Low | 111 Ų | 111 | 122.1 Ų | 122.1 | 58% | 0.581 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -63.7 | -37.7 | 174.5 | -96 | 156.8 | 0 | 0 | 0 | 112.7 | V83 Q89 L90 | V83-L87 HydrophobicContact CG1-CD1 3.93Å; V83-L87 WeakPolarHBondContact O-CB 3.46Å; V83-L87 PolarHBondContact O-N 3.37Å; L87-Q89 VanDerWaalsContact C-N 3.28Å; L87-Q89 PolarHBondContact O-N 2.73Å; L87-L90 PolarHBondContact O-N 2.87Å |
| 88 | A | 72.5 | Confident | 69.8 | Low | 73 Ų | 73 | 122.2 Ų | 122.2 | 60% | 0.603 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -66.3 | -28.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | G84 R85 V86 | G84-A88 WeakPolarHBondContact O-CB 3.37Å; G84-A88 PolarHBondContact O-N 3.44Å; G84-A88 VanDerWaalsContact O-N 3.07Å; R85-A88 PolarHBondContact O-N 3.47Å; V86-A88 VanDerWaalsContact C-N 3.35Å; V86-A88 PolarHBondContact O-N 3.26Å |
| 89 | Q | 74.1 | Confident | 69.9 | Low | 165 Ų | 165 | 122.2 Ų | 122.2 | 77% | 0.771 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -83.6 | -13.2 | 177.3 | -70 | -175.9 | -20.3 | 0 | 0 | 114.1 | R85 V86 L87 | R85-Q89 PolarHBondContact O-N 3.46Å; V86-Q89 PolarHBondContact O-N 3.4Å; L87-Q89 VanDerWaalsContact C-N 3.28Å; L87-Q89 PolarHBondContact O-N 2.73Å |
| 90 | L | 72.1 | Confident | 69.6 | Low | 150 Ų | 150 | 119.4 Ų | 119.4 | 79% | 0.785 | 63% | 0.629 | S | S | * | * | trans | -87 | -8.2 | -178.9 | -169.7 | 58.2 | 0 | 0 | 0 | 113.5 | V86 L87 | V86-L90 PolarHBondContact O-N 3.02Å; L87-L90 PolarHBondContact O-N 2.87Å | ||
| 91 | K | 59.4 | Low | 69.7 | Low | 253 Ų | 253 | 115.9 Ų | 115.9 | 100% | 1.1 | 62% | 0.619 | S | S | * | * | trans | -88.8 | 0 | 169.2 | -81.7 | -173.3 | 176.2 | 177.1 | 0 | 111.1 |
Retrieved 91 of 91 residues in 72.6 ms
(Link to these results)