| 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 | 36.1 | Very low | 51.5 | Low | 241 Ų | 241 | 133.3 Ų | 133.3 | 100% | 1.187 | 70% | 0.7 | S | S | * | * | 0 | 121.2 | 0 | -74.3 | -62.7 | -171.3 | 0 | 0 | 106.7 | |||||
| 2 | S | 45 | Very low | 51.8 | Low | 107 Ų | 107 | 131.5 Ų | 131.5 | 75% | 0.748 | 69% | 0.691 | S | S | * | * | trans | -57.3 | 131.8 | -164.1 | -60.1 | 0 | 0 | 0 | 0 | 114.2 | K4 | S2-K4 PolarHBondContact O-N 2.76Š| ||
| 3 | E | 52.1 | Low | 52 | Low | 149 Ų | 149 | 127.7 Ų | 127.7 | 70% | 0.696 | 67% | 0.671 | S | S | * | * | trans | -57.4 | 123.9 | 155.8 | 179.4 | 139.7 | 30.5 | 0 | 0 | 109.7 | K5 | E3-K5 HydrophobicContact CG-CG 4.44Å; E3-K5 IonicContact OE2-NZ 2.71Å; E3-K5 PolarHBondContact OE2-NZ 3.13Å | ||
| 4 | K | 46.7 | Very low | 52.2 | Low | 174 Ų | 174 | 128.4 Ų | 128.4 | 76% | 0.757 | 67% | 0.669 | S | S | * | * | trans | -127.6 | 88.3 | 161.2 | -70.1 | -166.5 | 179.4 | 78.6 | 0 | 106.3 | S2 Q6 | S2-K4 PolarHBondContact O-N 2.76Å; K4-Q6 PolarHBondContact O-N 2.79Å | ||
| 5 | K | 55.1 | Low | 52.3 | Low | 166 Ų | 166 | 128.7 Ų | 128.7 | 72% | 0.722 | 67% | 0.665 | S | S | * | * | trans | -57 | 107.5 | 158.9 | -80.7 | -177.3 | 169.2 | 75.4 | 0 | 105.8 | E3 | E3-K5 HydrophobicContact CG-CG 4.44Å; E3-K5 IonicContact OE2-NZ 2.71Å; E3-K5 PolarHBondContact OE2-NZ 3.13Å | ||
| 6 | Q | 57.3 | Low | 52.5 | Low | 158 Ų | 158 | 128.3 Ų | 128.3 | 74% | 0.738 | 67% | 0.665 | S | S | * | * | trans | -51.6 | 134.2 | 164.8 | -63.1 | -96.3 | -56.8 | 0 | 0 | 105.9 | K4 V8 | K4-Q6 PolarHBondContact O-N 2.79Å; Q6-V8 VanDerWaalsContact C-N 3.31Å; Q6-V8 PolarHBondContact O-N 2.71Å | ||
| 7 | P | 52.3 | Low | 53 | Low | 123 Ų | 123 | 129.8 Ų | 129.8 | 80% | 0.799 | 67% | 0.674 | S | S | * | * | trans | -59.1 | 106.5 | 169.3 | 26.3 | -30.6 | 0 | 0 | 0 | 105.4 | D9 | P7-D9 PolarHBondContact O-N 3.05Š| ||
| 8 | V | 56.9 | Low | 53.7 | Low | 97 Ų | 97 | 131.7 Ų | 131.7 | 59% | 0.588 | 68% | 0.679 | S | S | * | * | trans | -57.2 | 124.4 | 173.2 | -170.4 | 0 | 0 | 0 | 0 | 104.7 | Q6 L10 L13 | Q6-V8 VanDerWaalsContact C-N 3.31Å; Q6-V8 PolarHBondContact O-N 2.71Å; V8-L10 PolarHBondContact O-N 2.7Å; V8-L13 HydrophobicContact CB-CD1 4.12Å; V8-L13 HydrophobicContact CG1-CD1 3.53Å; V8-L13 HydrophobicContact CG1-CD2 4.43Å; V8-L13 HydrophobicContact CG1-CG 4.02Å | ||
| 9 | D | 53.9 | Low | 54.1 | Low | 110 Ų | 110 | 132.7 Ų | 132.7 | 59% | 0.588 | 68% | 0.678 | S | S | * | * | trans | -63.1 | 100.4 | -175.7 | -165.6 | 8.7 | 0 | 0 | 0 | 107.6 | P7 G11 L12 | P7-D9 PolarHBondContact O-N 3.05Å; D9-G11 PolarHBondContact O-N 2.65Å; D9-G11 VanDerWaalsContact O-N 3.12Å; D9-L12 HydrophobicContact CB-CD1 4.18Å; D9-L12 WeakPolarHBondContact O-CB 3.5Å; D9-L12 PolarHBondContact O-N 3.16Å | ||
| 10 | L | 55.4 | Low | 54.6 | Low | 113 Ų | 113 | 133.6 Ų | 133.6 | 59% | 0.592 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -63.4 | -19.7 | -170.4 | -67.8 | 168 | 0 | 0 | 0 | 111.4 | V8 L13 E14 | V8-L10 PolarHBondContact O-N 2.7Å; L10-L13 HydrophobicContact CD2-CD1 4.11Å; L10-L13 PolarHBondContact O-N 2.87Å; L10-E14 WeakPolarHBondContact O-CB 3.25Å; L10-E14 VanDerWaalsContact O-CG 3.26Å; L10-E14 WeakPolarHBondContact O-CG 3.39Å; L10-E14 PolarHBondContact O-N 3.04Å |
| 11 | G | 55.8 | Low | 55.1 | Low | 28 Ų | 28 | 136.7 Ų | 136.7 | 29% | 0.289 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -64.9 | -39.5 | 171 | 0 | 0 | 0 | 0 | 0 | 113 | D9 L13 E14 E15 | D9-G11 PolarHBondContact O-N 2.65Å; D9-G11 VanDerWaalsContact O-N 3.12Å; G11-L13 PolarHBondContact O-N 3.26Å; G11-E14 PolarHBondContact O-N 3.21Å; G11-E15 WeakPolarHBondContact O-CB 3.26Å; G11-E15 WeakPolarHBondContact O-CG 3.39Å; G11-E15 PolarHBondContact O-N 3.46Å |
| 12 | L | 55.6 | Low | 56 | Low | 112 Ų | 112 | 131.8 Ų | 131.8 | 59% | 0.586 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69.9 | -20.9 | 174.5 | -79 | 167.7 | 0 | 0 | 0 | 113.1 | D9 | D9-L12 HydrophobicContact CB-CD1 4.18Å; D9-L12 WeakPolarHBondContact O-CB 3.5Å; D9-L12 PolarHBondContact O-N 3.16Å |
| 13 | L | 54.2 | Low | 56.9 | Low | 82 Ų | 82 | 132 Ų | 132 | 43% | 0.429 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -89.7 | -34 | 175.3 | -67.7 | 173.5 | 0 | 0 | 0 | 112 | V8 L10 G11 E15 D16 D17 | V8-L13 HydrophobicContact CB-CD1 4.12Å; V8-L13 HydrophobicContact CG1-CD1 3.53Å; V8-L13 HydrophobicContact CG1-CD2 4.43Å; V8-L13 HydrophobicContact CG1-CG 4.02Å; L10-L13 HydrophobicContact CD2-CD1 4.11Å; L10-L13 PolarHBondContact O-N 2.87Å; G11-L13 PolarHBondContact O-N 3.26Å; L13-E15 VanDerWaalsContact C-N 3.33Å; L13-D16 PolarHBondContact O-N 3.34Å; L13-D17 PolarHBondContact O-N 3.3Å |
| 14 | E | 53.9 | Low | 57.3 | Low | 138 Ų | 138 | 129.7 Ų | 129.7 | 65% | 0.645 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -68.3 | -33.9 | 172.4 | -74.6 | 172.8 | -163.7 | 0 | 0 | 111.1 | L10 G11 D16 D17 E18 | L10-E14 WeakPolarHBondContact O-CB 3.25Å; L10-E14 VanDerWaalsContact O-CG 3.26Å; L10-E14 WeakPolarHBondContact O-CG 3.39Å; L10-E14 PolarHBondContact O-N 3.04Å; G11-E14 PolarHBondContact O-N 3.21Å; E14-D16 VanDerWaalsContact C-N 3.31Å; E14-D16 PolarHBondContact O-N 2.83Å; E14-D17 PolarHBondContact O-N 3.37Å; E14-E18 PolarHBondContact O-N 3.27Å |
| 15 | E | 54.5 | Low | 57.8 | Low | 132 Ų | 132 | 127.9 Ų | 127.9 | 62% | 0.617 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -67.4 | -26.5 | 171.4 | -72.6 | 168.8 | -151.5 | 0 | 0 | 113.1 | G11 L13 E18 | G11-E15 WeakPolarHBondContact O-CB 3.26Å; G11-E15 WeakPolarHBondContact O-CG 3.39Å; G11-E15 PolarHBondContact O-N 3.46Å; L13-E15 VanDerWaalsContact C-N 3.33Å; E15-E18 PolarHBondContact O-N 3.44Å |
| 16 | D | 54.9 | Low | 57.8 | Low | 122 Ų | 122 | 126.9 Ų | 126.9 | 65% | 0.652 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -78.8 | -25.3 | 178.1 | -155.6 | 27.4 | 0 | 0 | 0 | 112 | L13 E14 | L13-D16 PolarHBondContact O-N 3.34Å; E14-D16 VanDerWaalsContact C-N 3.31Å; E14-D16 PolarHBondContact O-N 2.83Å |
| 17 | D | 60.6 | Low | 57.7 | Low | 155 Ų | 155 | 127 Ų | 127 | 83% | 0.829 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -83.5 | -13.8 | 171 | -92.2 | -17.1 | 0 | 0 | 0 | 112.8 | L13 E14 | L13-D17 PolarHBondContact O-N 3.3Å; E14-D17 PolarHBondContact O-N 3.37Å |
| 18 | E | 66.3 | Low | 57.7 | Low | 163 Ų | 163 | 125.3 Ų | 125.3 | 76% | 0.762 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -95.5 | 3.7 | 177.4 | -162.2 | 160.9 | -159.9 | 0 | 0 | 112.7 | E14 E15 E20 | E14-E18 PolarHBondContact O-N 3.27Å; E15-E18 PolarHBondContact O-N 3.44Å; E18-E20 PolarHBondContact O-N 3.38Å |
| 19 | F | 61.5 | Low | 57.6 | Low | 151 Ų | 151 | 123.7 Ų | 123.7 | 66% | 0.662 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -64.2 | 118.1 | 165.5 | -155.4 | -98.5 | 0 | 0 | 0 | 108.2 | E21 F22 | F19-E21 PolarHBondContact O-N 3.5Å; F19-E21 VanDerWaalsContact O-N 3.16Å; F19-F22 HydrophobicContact CD1-CD2 4.18Å; F19-F22 HydrophobicContact CD1-CE2 4.33Å; F19-F22 AromaticContact CE1-CD2 3.61Å; F19-F22 HydrophobicContact CE1-CD2 3.61Å; F19-F22 AromaticContact CE1-CE2 3.65Å; F19-F22 HydrophobicContact CE1-CE2 3.65Å; F19-F22 HydrophobicContact CZ-CD2 4.32Å; F19-F22 AromaticContact CZ-CE2 3.93Å; F19-F22 HydrophobicContact CZ-CE2 3.93Å |
| 20 | E | 64.4 | Low | 57.5 | Low | 151 Ų | 151 | 124.3 Ų | 124.3 | 71% | 0.706 | 66% | 0.661 | S | S | * | * | trans | -50.2 | 126.7 | 177.4 | -71.4 | -170.7 | 177.2 | 0 | 0 | 108.8 | E18 F22 | E18-E20 PolarHBondContact O-N 3.38Å; E20-F22 VanDerWaalsContact O-CD2 3.25Å; E20-F22 WeakPolarHBondContact O-CD2 3.17Å; E20-F22 PolarHBondContact O-N 3.31Å | ||
| 21 | E | 63.8 | Low | 57.4 | Low | 199 Ų | 199 | 123.6 Ų | 123.6 | 93% | 0.93 | 66% | 0.658 | S | S | * | * | trans | -57.7 | 85.9 | 165.7 | -95.9 | -174.6 | 163.2 | 0 | 0 | 106.8 | F19 | F19-E21 PolarHBondContact O-N 3.5Å; F19-E21 VanDerWaalsContact O-N 3.16Å | ||
| 22 | F | 55.8 | Low | 57.3 | Low | 137 Ų | 137 | 131 Ų | 131 | 60% | 0.601 | 69% | 0.685 | S | S | * | * | trans | -54.5 | 134 | 170 | -82.4 | -88.5 | 0 | 0 | 0 | 105.6 | F19 E20 A24 | F19-F22 HydrophobicContact CD1-CD2 4.18Å; F19-F22 HydrophobicContact CD1-CE2 4.33Å; F19-F22 AromaticContact CE1-CD2 3.61Å; F19-F22 HydrophobicContact CE1-CD2 3.61Å; F19-F22 AromaticContact CE1-CE2 3.65Å; F19-F22 HydrophobicContact CE1-CE2 3.65Å; F19-F22 HydrophobicContact CZ-CD2 4.32Å; F19-F22 AromaticContact CZ-CE2 3.93Å; F19-F22 HydrophobicContact CZ-CE2 3.93Å; E20-F22 VanDerWaalsContact O-CD2 3.25Å; E20-F22 WeakPolarHBondContact O-CD2 3.17Å; E20-F22 PolarHBondContact O-N 3.31Å; F22-A24 PolarHBondContact O-N 2.96Å | ||
| 23 | P | 65.1 | Low | 57.3 | Low | 111 Ų | 111 | 130.7 Ų | 130.7 | 72% | 0.721 | 69% | 0.685 | S | S | * | * | trans | -49 | 128.4 | 171.8 | 22.8 | -32 | 0 | 0 | 0 | 106.3 | E25 | P23-E25 VanDerWaalsContact C-N 3.26Å; P23-E25 PolarHBondContact O-N 3.41Å | ||
| 24 | A | 58.8 | Low | 57.3 | Low | 101 Ų | 101 | 133.6 Ų | 133.6 | 84% | 0.835 | 70% | 0.696 | S | S | * | * | trans | -52.2 | 103.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 106 | F22 D26 | F22-A24 PolarHBondContact O-N 2.96Å; A24-D26 PolarHBondContact O-N 2.83Å; A24-D26 VanDerWaalsContact O-N 3.13Å | ||
| 25 | E | 57.8 | Low | 57.3 | Low | 136 Ų | 136 | 131.2 Ų | 131.2 | 64% | 0.636 | 69% | 0.688 | S | S | * | * | trans | -60.9 | 125.1 | 179.8 | -166.5 | 139.9 | -156.2 | 0 | 0 | 104.2 | P23 W27 | P23-E25 VanDerWaalsContact C-N 3.26Å; P23-E25 PolarHBondContact O-N 3.41Å; E25-W27 PolarHBondContact O-N 3.06Å | ||
| 26 | D | 55.4 | Low | 57.3 | Low | 146 Ų | 146 | 127 Ų | 127 | 78% | 0.781 | 68% | 0.675 | S | S | * | * | trans | -70.1 | 78.2 | -179.5 | -137.7 | -33.1 | 0 | 0 | 0 | 105.2 | A24 A28 | A24-D26 PolarHBondContact O-N 2.83Å; A24-D26 VanDerWaalsContact O-N 3.13Å; D26-A28 PolarHBondContact O-N 3.22Å | ||
| 27 | W | 55.8 | Low | 57.4 | Low | 161 Ų | 161 | 125.9 Ų | 125.9 | 61% | 0.61 | 67% | 0.666 | S | S | * | * | trans | -66.1 | 29.3 | 175.7 | -69.3 | 100.3 | 0 | 0 | 0 | 111.2 | E25 G29 D35 | E25-W27 PolarHBondContact O-N 3.06Å; W27-G29 PolarHBondContact O-N 3.31Å; W27-D35 WeakPolarHBondContact CH2-OD2 3.42Å | ||
| 28 | A | 52.3 | Low | 57.4 | Low | 86 Ų | 86 | 122.2 Ų | 122.2 | 71% | 0.711 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -71.4 | 66.5 | 172 | 0 | 0 | 0 | 0 | 0 | 109.4 | D26 | D26-A28 PolarHBondContact O-N 3.22Š|
| 29 | G | 53.9 | Low | 57.1 | Low | 64 Ų | 64 | 124 Ų | 124 | 66% | 0.66 | 65% | 0.649 | S | S | * | * | S | Bend | trans | 87.3 | 40.2 | 163.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | W27 | W27-G29 PolarHBondContact O-N 3.31Š|
| 30 | L | 52.4 | Low | 56.9 | Low | 122 Ų | 122 | 123.1 Ų | 123.1 | 64% | 0.639 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -81.2 | 118.5 | 146.9 | -78.9 | 165.6 | 0 | 0 | 0 | 105.9 | E32 | L30-E32 PolarHBondContact O-N 3.42Š|
| 31 | D | 52.9 | Low | 56.7 | Low | 99 Ų | 99 | 121.2 Ų | 121.2 | 53% | 0.529 | 64% | 0.641 | S | S | . | * | trans | -38.3 | 117.6 | -165.3 | -62.4 | -81.5 | 0 | 0 | 0 | 113.1 | D33 E34 | D31-D33 HydrophobicContact CB-CB 4.4Å; D31-D33 PolarHBondContact O-N 2.79Å; D31-E34 PolarHBondContact O-N 2.93Å | ||
| 32 | E | 54.6 | Low | 56.4 | Low | 182 Ų | 182 | 117.1 Ų | 117.1 | 85% | 0.85 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -53.8 | -12.1 | 170.5 | -76.1 | 178.4 | 161.7 | 0 | 0 | 112.5 | L30 | L30-E32 PolarHBondContact O-N 3.42Å |
| 33 | D | 54.3 | Low | 56.9 | Low | 107 Ų | 107 | 120.4 Ų | 120.4 | 57% | 0.572 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -78.6 | -34.8 | 178.5 | -57.5 | -41.6 | 0 | 0 | 0 | 112.7 | D31 H37 | D31-D33 HydrophobicContact CB-CB 4.4Å; D31-D33 PolarHBondContact O-N 2.79Å; D33-H37 PolarHBondContact O-CD2 3.38Å; D33-H37 VanDerWaalsContact O-CG 3.27Å; D33-H37 PolarHBondContact O-N 2.87Å |
| 34 | E | 54.8 | Low | 56.6 | Low | 142 Ų | 142 | 122 Ų | 122 | 66% | 0.664 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -74.5 | -37.4 | -174.3 | -76.6 | -161.1 | 148.2 | 0 | 0 | 113.5 | D31 | D31-E34 PolarHBondContact O-N 2.93Å |
| 35 | D | 53.8 | Low | 56.5 | Low | 89 Ų | 89 | 121.5 Ų | 121.5 | 48% | 0.476 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -71.2 | -39.1 | 177.9 | -99.4 | -36.2 | 0 | 0 | 0 | 111.2 | W27 H37 V38 | W27-D35 WeakPolarHBondContact CH2-OD2 3.42Å; D35-H37 VanDerWaalsContact C-N 3.29Å; D35-H37 PolarHBondContact O-N 2.71Å; D35-V38 PolarHBondContact O-N 3.36Å |
| 36 | A | 54.9 | Low | 56.5 | Low | 43 Ų | 43 | 120.3 Ų | 120.3 | 36% | 0.355 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.4 | -35.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V38 W39 E40 | A36-V38 VanDerWaalsContact C-N 3.28Å; A36-V38 PolarHBondContact O-N 3.27Å; A36-W39 PolarHBondContact O-N 2.99Å; A36-E40 PolarHBondContact O-N 3.12Å |
| 37 | H | 57.2 | Low | 56.6 | Low | 99 Ų | 99 | 119.6 Ų | 119.6 | 46% | 0.458 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -59.8 | -34.9 | 177.7 | -75.9 | -45.6 | 0 | 0 | 0 | 113.2 | D33 D35 W39 D41 | D33-H37 PolarHBondContact O-CD2 3.38Å; D33-H37 VanDerWaalsContact O-CG 3.27Å; D33-H37 PolarHBondContact O-N 2.87Å; D35-H37 VanDerWaalsContact C-N 3.29Å; D35-H37 PolarHBondContact O-N 2.71Å; H37-W39 VanDerWaalsContact C-N 3.32Å; H37-W39 PolarHBondContact O-N 3.36Å; H37-D41 WeakPolarHBondContact O-CB 3.48Å; H37-D41 VanDerWaalsContact O-CG 3.25Å; H37-D41 PolarHBondContact O-N 3.01Å |
| 38 | V | 59.1 | Low | 56.6 | Low | 77 Ų | 77 | 116.3 Ų | 116.3 | 47% | 0.467 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -70.3 | -29.5 | -179.2 | -177.3 | 0 | 0 | 0 | 0 | 112.3 | D35 A36 N42 | D35-V38 PolarHBondContact O-N 3.36Å; A36-V38 VanDerWaalsContact C-N 3.28Å; A36-V38 PolarHBondContact O-N 3.27Å; V38-N42 WeakPolarHBondContact O-CB 3.17Å; V38-N42 PolarHBondContact O-ND2 3.41Å |
| 39 | W | 61.6 | Low | 56.8 | Low | 202 Ų | 202 | 118.7 Ų | 118.7 | 77% | 0.765 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -89.5 | -29.6 | -179.9 | -61.5 | 90.1 | 0 | 0 | 0 | 112.7 | A36 H37 W43 | A36-W39 PolarHBondContact O-N 2.99Å; H37-W39 VanDerWaalsContact C-N 3.32Å; H37-W39 PolarHBondContact O-N 3.36Å; W39-W43 WeakPolarHBondContact O-CB 3.48Å |
| 40 | E | 56.3 | Low | 57.2 | Low | 132 Ų | 132 | 119.7 Ų | 119.7 | 62% | 0.617 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -77.5 | -43.4 | 174.1 | -68.7 | -171.1 | 171.1 | 0 | 0 | 111.9 | A36 N42 W43 D44 | A36-E40 PolarHBondContact O-N 3.12Å; E40-N42 PolarHBondContact O-N 3.18Å; E40-W43 PolarHBondContact O-N 2.84Å; E40-D44 PolarHBondContact O-N 3.43Å |
| 41 | D | 60.4 | Low | 58.1 | Low | 111 Ų | 111 | 118.8 Ų | 118.8 | 59% | 0.594 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68 | -33.1 | -177.5 | -74.9 | -19.2 | 0 | 0 | 0 | 112.7 | H37 | H37-D41 WeakPolarHBondContact O-CB 3.48Å; H37-D41 VanDerWaalsContact O-CG 3.25Å; H37-D41 PolarHBondContact O-N 3.01Å |
| 42 | N | 57.2 | Low | 58.7 | Low | 113 Ų | 113 | 120.9 Ų | 120.9 | 60% | 0.604 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -7.9 | -178.2 | -69.7 | -37.4 | 0 | 0 | 0 | 114 | V38 E40 | V38-N42 WeakPolarHBondContact O-CB 3.17Å; V38-N42 PolarHBondContact O-ND2 3.41Å; E40-N42 PolarHBondContact O-N 3.18Å |
| 43 | W | 67.4 | Low | 59.6 | Low | 205 Ų | 205 | 114.5 Ų | 114.5 | 78% | 0.777 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.3 | -29.2 | 177.6 | -169.3 | 12.2 | 0 | 0 | 0 | 112.2 | W39 E40 D45 | W39-W43 WeakPolarHBondContact O-CB 3.48Å; E40-W43 PolarHBondContact O-N 2.84Å; W43-D45 VanDerWaalsContact C-N 3.31Å |
| 44 | D | 58.4 | Low | 60.5 | Low | 144 Ų | 144 | 112.7 Ų | 112.7 | 77% | 0.77 | 57% | 0.565 | S | S | * | * | G | 310 helix | trans | -80.6 | -9 | 168.7 | -99.2 | -33.7 | 0 | 0 | 0 | 113.3 | E40 D46 N47 | E40-D44 PolarHBondContact O-N 3.43Å; D44-D46 PolarHBondContact O-N 3Å; D44-N47 PolarHBondContact O-N 3.03Å |
| 45 | D | 57.1 | Low | 61.5 | Low | 91 Ų | 91 | 111.1 Ų | 111.1 | 49% | 0.487 | 56% | 0.557 | S | S | . | * | G | 310 helix | trans | -72.3 | -4.1 | 176.3 | -153.7 | 31.8 | 0 | 0 | 0 | 113.7 | W43 N47 V48 | W43-D45 VanDerWaalsContact C-N 3.31Å; D45-N47 PolarHBondContact O-N 3.38Å; D45-V48 PolarHBondContact O-N 3.44Å; D45-V48 WeakPolarHBondContact OD1-CG2 2.95Å |
| 46 | D | 56.7 | Low | 62.4 | Low | 112 Ų | 112 | 112.2 Ų | 112.2 | 60% | 0.599 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -58.5 | -13 | 166.9 | -92.1 | -26.8 | 0 | 0 | 0 | 112.5 | D44 V48 E49 | D44-D46 PolarHBondContact O-N 3Å; D46-V48 VanDerWaalsContact C-N 3.28Å; D46-V48 PolarHBondContact O-N 3.42Å; D46-E49 PolarHBondContact O-N 3.46Å |
| 47 | N | 57.6 | Low | 63.3 | Low | 130 Ų | 130 | 118.7 Ų | 118.7 | 70% | 0.695 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -70.6 | -19.9 | 172.2 | -165.8 | 26.4 | 0 | 0 | 0 | 113.4 | D44 D45 E49 D50 | D44-N47 PolarHBondContact O-N 3.03Å; D45-N47 PolarHBondContact O-N 3.38Å; N47-E49 VanDerWaalsContact C-N 3.26Å; N47-E49 PolarHBondContact O-N 3.24Å; N47-D50 PolarHBondContact O-N 3.47Å |
| 48 | V | 56.3 | Low | 64 | Low | 93 Ų | 93 | 119.2 Ų | 119.2 | 56% | 0.564 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -75.4 | -18.5 | 177.1 | -171.6 | 0 | 0 | 0 | 0 | 111.6 | D45 D46 D50 | D45-V48 PolarHBondContact O-N 3.44Å; D45-V48 WeakPolarHBondContact OD1-CG2 2.95Å; D46-V48 VanDerWaalsContact C-N 3.28Å; D46-V48 PolarHBondContact O-N 3.42Å; V48-D50 VanDerWaalsContact C-N 3.27Å; V48-D50 PolarHBondContact O-N 2.85Å |
| 49 | E | 56.2 | Low | 64.3 | Low | 135 Ų | 135 | 122.2 Ų | 122.2 | 63% | 0.631 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -73.5 | -17.5 | 175.6 | -146.3 | -176.3 | 110.1 | 0 | 0 | 113 | D46 N47 S53 | D46-E49 PolarHBondContact O-N 3.46Å; N47-E49 VanDerWaalsContact C-N 3.26Å; N47-E49 PolarHBondContact O-N 3.24Å; E49-S53 WeakPolarHBondContact O-CB 3.33Å; E49-S53 PolarHBondContact O-N 3.41Å; E49-S53 PolarHBondContact O-OG 3.33Å |
| 50 | D | 62.7 | Low | 64.6 | Low | 86 Ų | 86 | 114 Ų | 114 | 46% | 0.46 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -75.5 | -36.2 | 180 | -157.6 | 53.8 | 0 | 0 | 0 | 112.2 | N47 V48 S53 N54 | N47-D50 PolarHBondContact O-N 3.47Å; V48-D50 VanDerWaalsContact C-N 3.27Å; V48-D50 PolarHBondContact O-N 2.85Å; D50-S53 PolarHBondContact O-N 3.25Å; D50-N54 VanDerWaalsContact O-CB 3.23Å; D50-N54 WeakPolarHBondContact O-CB 3.28Å; D50-N54 PolarHBondContact O-N 2.85Å; D50-N54 PolarHBondContact O-ND2 3.48Å; D50-N54 PolarHBondContact OD2-ND2 3Å |
| 51 | D | 69.7 | Low | 65 | Low | 103 Ų | 103 | 112.6 Ų | 112.6 | 55% | 0.551 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -69.7 | -36.7 | -179.3 | -162.5 | 41.1 | 0 | 0 | 0 | 112.2 | N54 Q55 | D51-N54 PolarHBondContact O-N 3.32Å; D51-Q55 VanDerWaalsContact O-CG 3.28Å; D51-Q55 WeakPolarHBondContact O-CG 3.44Å; D51-Q55 PolarHBondContact O-N 3.47Å; D51-Q55 PolarHBondContact OD2-NE2 2.93Å |
| 52 | F | 66.3 | Low | 65 | Low | 143 Ų | 143 | 112.3 Ų | 112.3 | 63% | 0.627 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.9 | -40 | 173.9 | -148.8 | -93.2 | 0 | 0 | 0 | 111.5 | Q55 L56 | F52-Q55 PolarHBondContact O-N 3.17Å; F52-L56 HydrophobicContact CD1-CD1 4.13Å; F52-L56 HydrophobicContact CE1-CD1 4.34Å; F52-L56 WeakPolarHBondContact O-CG 3.23Å; F52-L56 PolarHBondContact O-N 2.79Å; F52-L56 VanDerWaalsContact O-N 3.17Å |
| 53 | S | 73.8 | Confident | 65.1 | Low | 48 Ų | 48 | 111.1 Ų | 111.1 | 34% | 0.336 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.8 | -39.2 | 175.8 | -65.7 | 0 | 0 | 0 | 0 | 112.4 | E49 D50 L56 R57 | E49-S53 WeakPolarHBondContact O-CB 3.33Å; E49-S53 PolarHBondContact O-N 3.41Å; E49-S53 PolarHBondContact O-OG 3.33Å; D50-S53 PolarHBondContact O-N 3.25Å; S53-L56 PolarHBondContact O-N 2.94Å; S53-R57 WeakPolarHBondContact O-CG 3.35Å; S53-R57 PolarHBondContact O-N 3.31Å |
| 54 | N | 72.9 | Confident | 64.8 | Low | 68 Ų | 68 | 108 Ų | 108 | 36% | 0.364 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.3 | -42.3 | 176.1 | -74 | -37 | 0 | 0 | 0 | 111.3 | D50 D51 L56 R57 D58 | D50-N54 VanDerWaalsContact O-CB 3.23Å; D50-N54 WeakPolarHBondContact O-CB 3.28Å; D50-N54 PolarHBondContact O-N 2.85Å; D50-N54 PolarHBondContact O-ND2 3.48Å; D50-N54 PolarHBondContact OD2-ND2 3Å; D51-N54 PolarHBondContact O-N 3.32Å; N54-L56 PolarHBondContact O-N 3.43Å; N54-R57 PolarHBondContact O-N 3.06Å; N54-D58 WeakPolarHBondContact O-CB 3.28Å; N54-D58 PolarHBondContact O-N 3.01Å |
| 55 | Q | 76 | Confident | 64.7 | Low | 109 Ų | 109 | 106.4 Ų | 106.4 | 51% | 0.509 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -61.3 | -42 | 174.8 | -74 | 175.2 | 35.8 | 0 | 0 | 112.8 | D51 F52 D58 M59 | D51-Q55 VanDerWaalsContact O-CG 3.28Å; D51-Q55 WeakPolarHBondContact O-CG 3.44Å; D51-Q55 PolarHBondContact O-N 3.47Å; D51-Q55 PolarHBondContact OD2-NE2 2.93Å; F52-Q55 PolarHBondContact O-N 3.17Å; Q55-D58 PolarHBondContact O-N 3.47Å; Q55-M59 VanDerWaalsContact O-CB 3.28Å; Q55-M59 WeakPolarHBondContact O-CB 3.46Å; Q55-M59 PolarHBondContact O-N 3.25Å |
| 56 | L | 71.9 | Confident | 64.3 | Low | 112 Ų | 112 | 111.3 Ų | 111.3 | 59% | 0.586 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.4 | -38.9 | 176.9 | -73.2 | 171.8 | 0 | 0 | 0 | 112.5 | F52 S53 N54 G60 | F52-L56 HydrophobicContact CD1-CD1 4.13Å; F52-L56 HydrophobicContact CE1-CD1 4.34Å; F52-L56 WeakPolarHBondContact O-CG 3.23Å; F52-L56 PolarHBondContact O-N 2.79Å; F52-L56 VanDerWaalsContact O-N 3.17Å; S53-L56 PolarHBondContact O-N 2.94Å; N54-L56 PolarHBondContact O-N 3.43Å; L56-G60 PolarHBondContact O-N 2.92Å |
| 57 | R | 74.8 | Confident | 64.7 | Low | 180 Ų | 180 | 111.3 Ų | 111.3 | 68% | 0.679 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -64.8 | -43.8 | 174.7 | -77.9 | 176.7 | 136.3 | -177 | -1.6 | 111.9 | S53 N54 G60 N61 | S53-R57 WeakPolarHBondContact O-CG 3.35Å; S53-R57 PolarHBondContact O-N 3.31Å; N54-R57 PolarHBondContact O-N 3.06Å; R57-G60 PolarHBondContact O-N 3.42Å; R57-N61 PolarHBondContact O-N 3.4Å; R57-N61 PolarHBondContact O-OD1 3.34Å |
| 58 | D | 72.7 | Confident | 65.1 | Low | 110 Ų | 110 | 110.3 Ų | 110.3 | 59% | 0.588 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -67.8 | -42.1 | 180 | -146.7 | 40.9 | 0 | 0 | 0 | 111.1 | N54 Q55 G60 N61 V62 | N54-D58 WeakPolarHBondContact O-CB 3.28Å; N54-D58 PolarHBondContact O-N 3.01Å; Q55-D58 PolarHBondContact O-N 3.47Å; D58-G60 VanDerWaalsContact C-N 3.32Å; D58-G60 PolarHBondContact O-N 3.47Å; D58-N61 PolarHBondContact O-N 3.08Å; D58-V62 VanDerWaalsContact O-CG2 3.3Å; D58-V62 WeakPolarHBondContact O-CG2 3.41Å; D58-V62 PolarHBondContact O-N 3.02Å; D58-V62 VanDerWaalsContact O-N 3.08Å |
| 59 | M | 64.6 | Low | 65.6 | Low | 139 Ų | 139 | 111.2 Ų | 111.2 | 69% | 0.685 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -60.2 | -38.6 | 173.5 | -168.2 | 93.9 | 109.6 | 0 | 0 | 112.7 | Q55 S63 | Q55-M59 VanDerWaalsContact O-CB 3.28Å; Q55-M59 WeakPolarHBondContact O-CB 3.46Å; Q55-M59 PolarHBondContact O-N 3.25Å; M59-S63 PolarHBondContact O-N 3.37Å; M59-S63 PolarHBondContact O-OG 3.35Å |
| 60 | G | 68.3 | Low | 66.1 | Low | 30 Ų | 30 | 109.8 Ų | 109.8 | 31% | 0.309 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -66.8 | -40.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L56 R57 D58 S63 I64 | L56-G60 PolarHBondContact O-N 2.92Å; R57-G60 PolarHBondContact O-N 3.42Å; D58-G60 VanDerWaalsContact C-N 3.32Å; D58-G60 PolarHBondContact O-N 3.47Å; G60-S63 PolarHBondContact O-N 3.07Å; G60-I64 WeakPolarHBondContact O-CD1 3.39Å; G60-I64 WeakPolarHBondContact O-CG1 3.3Å; G60-I64 PolarHBondContact O-N 3.45Å |
| 61 | N | 63.8 | Low | 66.3 | Low | 103 Ų | 103 | 111.3 Ų | 111.3 | 55% | 0.551 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -70.3 | -34.9 | 179.6 | -67.8 | -10.2 | 0 | 0 | 0 | 112.6 | R57 D58 S63 S65 | R57-N61 PolarHBondContact O-N 3.4Å; R57-N61 PolarHBondContact O-OD1 3.34Å; D58-N61 PolarHBondContact O-N 3.08Å; N61-S63 VanDerWaalsContact C-N 3.34Å; N61-S65 PolarHBondContact O-OG 3.33Å |
| 62 | V | 60.9 | Low | 66.1 | Low | 104 Ų | 104 | 111.9 Ų | 111.9 | 63% | 0.63 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -66.3 | -35.6 | 175.7 | 173.5 | 0 | 0 | 0 | 0 | 111.6 | D58 | D58-V62 VanDerWaalsContact O-CG2 3.3Å; D58-V62 WeakPolarHBondContact O-CG2 3.41Å; D58-V62 PolarHBondContact O-N 3.02Å; D58-V62 VanDerWaalsContact O-N 3.08Å |
| 63 | S | 59.1 | Low | 66.1 | Low | 89 Ų | 89 | 109.6 Ų | 109.6 | 62% | 0.622 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -77 | -20 | -177.7 | -58.3 | 0 | 0 | 0 | 0 | 114.3 | M59 G60 N61 | M59-S63 PolarHBondContact O-N 3.37Å; M59-S63 PolarHBondContact O-OG 3.35Å; G60-S63 PolarHBondContact O-N 3.07Å; N61-S63 VanDerWaalsContact C-N 3.34Å |
| 64 | I | 60.6 | Low | 65.5 | Low | 140 Ų | 140 | 114.4 Ų | 114.4 | 72% | 0.718 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -89.6 | -14.4 | -179.8 | -66.3 | 163 | 0 | 0 | 0 | 111.9 | G60 V66 | G60-I64 WeakPolarHBondContact O-CD1 3.39Å; G60-I64 WeakPolarHBondContact O-CG1 3.3Å; G60-I64 PolarHBondContact O-N 3.45Å; I64-V66 VanDerWaalsContact C-N 3.3Å; I64-V66 PolarHBondContact O-N 3.31Å |
| 65 | S | 56.8 | Low | 64.9 | Low | 109 Ų | 109 | 118.3 Ų | 118.3 | 76% | 0.762 | 65% | 0.651 | S | S | * | * | trans | -87.3 | 23.4 | -178.7 | -63.2 | 0 | 0 | 0 | 0 | 114.9 | N61 | N61-S65 PolarHBondContact O-OG 3.33Š| ||
| 66 | V | 49.1 | Very low | 63.9 | Low | 194 Ų | 194 | 119.1 Ų | 119.1 | 100% | 1.176 | 66% | 0.664 | S | S | * | * | trans | -110.5 | 0 | 175.6 | 86.5 | 0 | 0 | 0 | 0 | 112.8 | I64 | I64-V66 VanDerWaalsContact C-N 3.3Å; I64-V66 PolarHBondContact O-N 3.31Å |
Retrieved 66 of 66 residues in 80.8 ms
(Link to these results)