| 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 | 44.5 | Very low | 44.4 | Very low | 234 Ų | 234 | 160.9 Ų | 160.9 | 100% | 1.153 | 81% | 0.805 | S | S | * | * | 0 | 121.8 | 0 | -94.9 | 172.6 | 154.7 | 0 | 0 | 108.4 | |||||
| 2 | L | 40.8 | Very low | 44.2 | Very low | 145 Ų | 145 | 164.9 Ų | 164.9 | 76% | 0.759 | 81% | 0.814 | S | S | * | * | trans | 45.3 | 116.3 | 154.5 | -71.1 | 94.4 | 0 | 0 | 0 | 121.1 | ||||
| 3 | H | 45.6 | Very low | 43.6 | Very low | 174 Ų | 174 | 158 Ų | 158 | 81% | 0.806 | 81% | 0.811 | S | S | * | * | 30.5 | 154.8 | 112.1 | -63.6 | -85.8 | 0 | 0 | 0 | 118.8 | |||||
| 4 | P | 44.7 | Very low | 43.8 | Very low | 103 Ų | 103 | 155 Ų | 155 | 67% | 0.669 | 81% | 0.811 | S | S | * | * | cis | -141.6 | 164 | 21.4 | 29 | -4.9 | 0 | 0 | 0 | 116.5 | M6 | P4-M6 PolarHBondContact O-N 3.01Å; P4-M6 VanDerWaalsContact O-N 3.16Å | ||
| 5 | L | 40.5 | Very low | 44.1 | Very low | 154 Ų | 154 | 151.3 Ų | 151.3 | 81% | 0.806 | 81% | 0.812 | S | S | * | * | trans | -48.8 | 111.4 | 152.1 | -69.2 | 158.5 | 0 | 0 | 0 | 110.1 | L7 | L5-L7 HydrophobicContact CB-CD1 4.46Š| ||
| 6 | M | 47.9 | Very low | 44.1 | Very low | 167 Ų | 167 | 152.2 Ų | 152.2 | 82% | 0.823 | 82% | 0.816 | S | S | * | * | trans | -101.4 | 91.9 | 153.8 | -80.7 | -155.8 | 176.6 | 0 | 0 | 108.1 | P4 R8 | P4-M6 PolarHBondContact O-N 3.01Å; P4-M6 VanDerWaalsContact O-N 3.16Å; M6-R8 VanDerWaalsContact C-N 3.35Å; M6-R8 PolarHBondContact O-N 3.02Å | ||
| 7 | L | 44.2 | Very low | 44.2 | Very low | 159 Ų | 159 | 150.8 Ų | 150.8 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | -56.5 | 103.5 | 149.7 | -85.7 | 89 | 0 | 0 | 0 | 107.5 | L5 | L5-L7 HydrophobicContact CB-CD1 4.46Š| ||
| 8 | R | 37.7 | Very low | 43.9 | Very low | 215 Ų | 215 | 146.4 Ų | 146.4 | 81% | 0.811 | 81% | 0.812 | S | S | * | * | trans | -163.8 | 101.9 | 160.8 | -163.4 | 169.7 | 167.6 | -154.7 | -4.5 | 110.2 | M6 | M6-R8 VanDerWaalsContact C-N 3.35Å; M6-R8 PolarHBondContact O-N 3.02Å | ||
| 9 | S | 47.5 | Very low | 44.6 | Very low | 101 Ų | 101 | 147.1 Ų | 147.1 | 71% | 0.706 | 81% | 0.812 | S | S | * | * | -156.9 | 139 | 123.9 | -99.6 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 10 | P | 48.5 | Very low | 44.9 | Very low | 95 Ų | 95 | 151.8 Ų | 151.8 | 62% | 0.617 | 82% | 0.817 | S | S | * | * | trans | -89.9 | 133.1 | -178.8 | 36 | -28.3 | 0 | 0 | 0 | 109.6 | ||||
| 11 | Y | 46.6 | Very low | 45.5 | Very low | 223 Ų | 223 | 151.2 Ų | 151.2 | 88% | 0.875 | 81% | 0.814 | S | S | * | * | trans | -125.3 | 60.4 | 155.8 | -73.3 | -78.8 | 0 | 0 | 0 | 108.4 | ||||
| 12 | F | 41.9 | Very low | 46.2 | Very low | 209 Ų | 209 | 149.3 Ų | 149.3 | 92% | 0.917 | 80% | 0.803 | S | S | * | * | trans | -83.7 | 119.1 | 151.8 | -95.9 | -86.9 | 0 | 0 | 0 | 107.4 | ||||
| 13 | G | 37.1 | Very low | 47.4 | Very low | 75 Ų | 75 | 149.4 Ų | 149.4 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | trans | 96.5 | 81.4 | 149.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 14 | S | 45.4 | Very low | 48.5 | Very low | 116 Ų | 116 | 147.7 Ų | 147.7 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -139.3 | 67.8 | 137.5 | 61 | 0 | 0 | 0 | 0 | 108.6 | L16 | S14-L16 PolarHBondContact O-N 3.48Š| ||
| 15 | A | 48.2 | Very low | 49.7 | Very low | 100 Ų | 100 | 149.3 Ų | 149.3 | 83% | 0.826 | 80% | 0.799 | S | S | * | * | trans | -70 | 113.1 | 164.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 16 | L | 44.4 | Very low | 51.3 | Low | 165 Ų | 165 | 146.9 Ų | 146.9 | 86% | 0.864 | 79% | 0.79 | S | S | * | * | trans | -61.8 | 134 | 176.7 | -73.4 | 161.4 | 0 | 0 | 0 | 109.7 | S14 | S14-L16 PolarHBondContact O-N 3.48Š| ||
| 17 | P | 45.4 | Very low | 52.4 | Low | 128 Ų | 128 | 147.6 Ų | 147.6 | 83% | 0.831 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -78.6 | 125.3 | -179.8 | 30.5 | -30.7 | 0 | 0 | 0 | 110.1 | ||
| 18 | G | 39.8 | Very low | 53.7 | Low | 72 Ų | 72 | 147.5 Ų | 147.5 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | trans | 113.7 | 55.5 | 152.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 19 | I | 56.4 | Low | 55.3 | Low | 159 Ų | 159 | 145.7 Ų | 145.7 | 82% | 0.815 | 79% | 0.792 | S | S | * | * | trans | -128.4 | 116.2 | 144.5 | -46.6 | 176.4 | 0 | 0 | 0 | 104.8 | D21 | I19-D21 PolarHBondContact O-N 3.24Š| ||
| 20 | R | 50.8 | Low | 56.1 | Low | 241 Ų | 241 | 146.6 Ų | 146.6 | 91% | 0.909 | 80% | 0.795 | S | S | * | * | trans | -72.4 | 112.7 | -177.1 | -66.4 | 164.4 | 79.4 | 168.4 | 2.3 | 106.4 | E22 | R20-E22 PolarHBondContact O-N 3.18Å; R20-E22 VanDerWaalsContact O-N 3.09Å | ||
| 21 | D | 57.9 | Low | 57.2 | Low | 141 Ų | 141 | 149.5 Ų | 149.5 | 75% | 0.754 | 81% | 0.805 | S | S | * | * | trans | -64.3 | 102.5 | 169.4 | -73 | -41.4 | 0 | 0 | 0 | 108 | I19 E23 | I19-D21 PolarHBondContact O-N 3.24Å; D21-E23 PolarHBondContact O-N 3.08Å | ||
| 22 | E | 59.6 | Low | 58.1 | Low | 194 Ų | 194 | 143 Ų | 143 | 91% | 0.907 | 79% | 0.793 | S | S | * | * | trans | -86.3 | 78.2 | 159.3 | -159.4 | 150.8 | 146.8 | 0 | 0 | 105.9 | R20 D24 | R20-E22 PolarHBondContact O-N 3.18Å; R20-E22 VanDerWaalsContact O-N 3.09Å; E22-D24 PolarHBondContact O-N 2.82Å; E22-D24 VanDerWaalsContact O-N 3.12Å | ||
| 23 | E | 65.1 | Low | 58.9 | Low | 146 Ų | 146 | 139 Ų | 139 | 68% | 0.682 | 79% | 0.788 | S | S | * | * | trans | -64.4 | 103.4 | 171 | 41.5 | -176 | 113.7 | 0 | 0 | 108.4 | D21 N25 | D21-E23 PolarHBondContact O-N 3.08Å; E23-N25 PolarHBondContact O-N 2.83Å; E23-N25 PolarHBondContact O-ND2 2.93Å | ||
| 24 | D | 70 | Confident | 60.5 | Low | 139 Ų | 139 | 141.5 Ų | 141.5 | 74% | 0.743 | 79% | 0.788 | S | S | * | * | trans | -59.6 | 102.3 | 173.6 | -167.6 | 23.7 | 0 | 0 | 0 | 108.5 | E22 V26 | E22-D24 PolarHBondContact O-N 2.82Å; E22-D24 VanDerWaalsContact O-N 3.12Å; D24-V26 PolarHBondContact O-N 3.2Å | ||
| 25 | N | 69.8 | Low | 61.6 | Low | 137 Ų | 137 | 147.1 Ų | 147.1 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | trans | -71.3 | 78.7 | 176.7 | -86.9 | -82.9 | 0 | 0 | 0 | 109.1 | E23 E27 | E23-N25 PolarHBondContact O-N 2.83Å; E23-N25 PolarHBondContact O-ND2 2.93Å; N25-E27 PolarHBondContact O-N 3.49Å; N25-E27 VanDerWaalsContact O-N 3.16Å | ||
| 26 | V | 73.1 | Confident | 62.6 | Low | 102 Ų | 102 | 151.1 Ų | 151.1 | 62% | 0.618 | 79% | 0.793 | S | S | * | * | trans | -73.2 | 100.5 | 163.5 | -74.6 | 0 | 0 | 0 | 0 | 108.3 | D24 L28 | D24-V26 PolarHBondContact O-N 3.2Å; V26-L28 PolarHBondContact O-N 3.4Å | ||
| 27 | E | 71.9 | Confident | 63.9 | Low | 183 Ų | 183 | 147.3 Ų | 147.3 | 86% | 0.855 | 79% | 0.786 | S | S | * | * | trans | -60.6 | 99.3 | 166.6 | -78.7 | -173 | 163.2 | 0 | 0 | 108.5 | N25 Q29 | N25-E27 PolarHBondContact O-N 3.49Å; N25-E27 VanDerWaalsContact O-N 3.16Å; E27-Q29 VanDerWaalsContact C-N 3.3Å; E27-Q29 PolarHBondContact O-N 3.08Å | ||
| 28 | L | 71.5 | Confident | 65.2 | Low | 157 Ų | 157 | 150.5 Ų | 150.5 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | trans | -68.5 | 91.9 | 168.4 | -64.9 | 177.3 | 0 | 0 | 0 | 107.5 | V26 P30 | V26-L28 PolarHBondContact O-N 3.4Å; L28-P30 WeakPolarHBondContact O-CD 3.2Å | ||
| 29 | Q | 71.5 | Confident | 66.8 | Low | 177 Ų | 177 | 153 Ų | 153 | 83% | 0.827 | 79% | 0.791 | S | S | * | * | trans | -59.4 | 125.2 | 165.9 | -94.5 | -166.8 | -45.6 | 0 | 0 | 108 | E27 D31 | E27-Q29 VanDerWaalsContact C-N 3.3Å; E27-Q29 PolarHBondContact O-N 3.08Å; Q29-D31 PolarHBondContact O-N 2.77Å | ||
| 30 | P | 64.2 | Low | 67.8 | Low | 119 Ų | 119 | 154.5 Ų | 154.5 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | -64.5 | 120.7 | 178 | 25.8 | -32 | 0 | 0 | 0 | 108.2 | L28 S32 | L28-P30 WeakPolarHBondContact O-CD 3.2Å; P30-S32 PolarHBondContact O-N 2.85Å | ||
| 31 | D | 70.7 | Confident | 69.1 | Low | 156 Ų | 156 | 146.3 Ų | 146.3 | 83% | 0.834 | 79% | 0.785 | S | S | * | * | trans | -72 | 76.5 | -178.3 | -165 | 12.3 | 0 | 0 | 0 | 110 | Q29 | Q29-D31 PolarHBondContact O-N 2.77Š| ||
| 32 | S | 65.9 | Low | 70.1 | Confident | 88 Ų | 88 | 144 Ų | 144 | 62% | 0.615 | 78% | 0.775 | S | S | * | * | S | Bend | trans | 58.2 | 150.3 | 176.6 | 68.3 | 0 | 0 | 0 | 0 | 116.1 | P30 T34 | P30-S32 PolarHBondContact O-N 2.85Å; S32-T34 PolarHBondContact O-N 2.8Å; S32-T34 VanDerWaalsContact O-N 3.08Å |
| 33 | P | 59 | Low | 71 | Confident | 124 Ų | 124 | 139 Ų | 139 | 81% | 0.805 | 76% | 0.755 | S | S | * | * | trans | -66.6 | 118.5 | -175.6 | 25.8 | -32.1 | 0 | 0 | 0 | 109.6 | R35 | P33-R35 PolarHBondContact O-N 2.83Š| ||
| 34 | T | 69.2 | Low | 71.4 | Confident | 128 Ų | 128 | 139.1 Ų | 139.1 | 79% | 0.785 | 75% | 0.753 | S | S | * | * | trans | -41.5 | 112 | 162.4 | -54 | 0 | 0 | 0 | 0 | 107.7 | S32 E36 | S32-T34 PolarHBondContact O-N 2.8Å; S32-T34 VanDerWaalsContact O-N 3.08Å; T34-E36 PolarHBondContact O-N 2.96Å | ||
| 35 | R | 69.7 | Low | 71.8 | Confident | 234 Ų | 234 | 140.7 Ų | 140.7 | 88% | 0.883 | 76% | 0.756 | S | S | * | * | trans | -55 | 117.2 | 173.5 | -112.7 | -177.1 | 168.6 | 128 | -3.6 | 106.7 | P33 A37 | P33-R35 PolarHBondContact O-N 2.83Å; R35-A37 PolarHBondContact O-N 3.34Å | ||
| 36 | E | 69.7 | Low | 72 | Confident | 183 Ų | 183 | 140.4 Ų | 140.4 | 86% | 0.855 | 76% | 0.755 | S | S | * | * | trans | -51.8 | 107.5 | 167.3 | -59.9 | -87.1 | 141.1 | 0 | 0 | 106.3 | T34 E38 | T34-E36 PolarHBondContact O-N 2.96Å; E36-E38 PolarHBondContact O-N 3.06Å; E36-E38 VanDerWaalsContact O-N 3.07Å | ||
| 37 | A | 71.2 | Confident | 72.2 | Confident | 86 Ų | 86 | 141.7 Ų | 141.7 | 71% | 0.711 | 75% | 0.752 | S | S | * | * | trans | -67.7 | 109.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 106.1 | R35 T39 | R35-A37 PolarHBondContact O-N 3.34Å; A37-T39 VanDerWaalsContact C-N 3.34Å; A37-T39 PolarHBondContact O-N 3.09Å | ||
| 38 | E | 71.7 | Confident | 72.4 | Confident | 195 Ų | 195 | 138.9 Ų | 138.9 | 91% | 0.911 | 75% | 0.748 | S | S | * | * | trans | -59.3 | 99.2 | 170 | -69.6 | 177.7 | 160.5 | 0 | 0 | 107.5 | E36 E40 | E36-E38 PolarHBondContact O-N 3.06Å; E36-E38 VanDerWaalsContact O-N 3.07Å; E38-E40 PolarHBondContact O-N 3.33Å | ||
| 39 | T | 73.1 | Confident | 72.5 | Confident | 125 Ų | 125 | 135.4 Ų | 135.4 | 77% | 0.767 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 119.6 | 172.5 | 54.5 | 0 | 0 | 0 | 0 | 107.6 | A37 G41 | A37-T39 VanDerWaalsContact C-N 3.34Å; A37-T39 PolarHBondContact O-N 3.09Å; T39-G41 PolarHBondContact O-N 2.81Å; T39-G41 VanDerWaalsContact O-N 3.12Å |
| 40 | E | 77.4 | Confident | 72.4 | Confident | 189 Ų | 189 | 134.9 Ų | 134.9 | 88% | 0.883 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 119.2 | 165.3 | -172.7 | 170.6 | -169.4 | 0 | 0 | 107.9 | E38 V42 | E38-E40 PolarHBondContact O-N 3.33Å; E40-V42 PolarHBondContact O-N 3.16Å |
| 41 | G | 78.1 | Confident | 72.6 | Confident | 69 Ų | 69 | 137.2 Ų | 137.2 | 71% | 0.711 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 126.2 | -169.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | T39 D43 | T39-G41 PolarHBondContact O-N 2.81Å; T39-G41 VanDerWaalsContact O-N 3.12Å; G41-D43 PolarHBondContact O-N 2.77Å |
| 42 | V | 78.8 | Confident | 72.6 | Confident | 93 Ų | 93 | 136.9 Ų | 136.9 | 56% | 0.564 | 74% | 0.741 | S | S | * | * | trans | -70.8 | 115.9 | 171.5 | -179.7 | 0 | 0 | 0 | 0 | 107.5 | E40 F44 F47 | E40-V42 PolarHBondContact O-N 3.16Å; V42-F44 HydrophobicContact CB-CE2 4.41Å; V42-F44 HydrophobicContact CB-CZ 4.46Å; V42-F44 WeakPolarHBondContact O-CD2 3.42Å; V42-F44 WeakPolarHBondContact O-CE2 3.3Å; V42-F44 PolarHBondContact O-N 3.15Å; V42-F47 HydrophobicContact CG1-CE2 3.82Å; V42-F47 HydrophobicContact CG1-CZ 3.81Å | ||
| 43 | D | 78.5 | Confident | 72.9 | Confident | 89 Ų | 89 | 140.8 Ų | 140.8 | 48% | 0.476 | 75% | 0.75 | S | S | . | * | trans | -67.5 | 112.6 | 171 | 172.5 | 8.7 | 0 | 0 | 0 | 109 | G41 E45 | G41-D43 PolarHBondContact O-N 2.77Å; D43-E45 WeakPolarHBondContact OD1-CA 3.42Å; D43-E45 VanDerWaalsContact OD1-CB 3.27Å; D43-E45 WeakPolarHBondContact OD1-CB 3.29Å; D43-E45 PolarHBondContact OD1-N 3.08Å | ||
| 44 | F | 74.9 | Confident | 73.3 | Confident | 148 Ų | 148 | 139.7 Ų | 139.7 | 65% | 0.649 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -83.9 | -12.3 | 180 | -68.6 | -88.1 | 0 | 0 | 0 | 113.6 | V42 N46 F47 | V42-F44 HydrophobicContact CB-CE2 4.41Å; V42-F44 HydrophobicContact CB-CZ 4.46Å; V42-F44 WeakPolarHBondContact O-CD2 3.42Å; V42-F44 WeakPolarHBondContact O-CE2 3.3Å; V42-F44 PolarHBondContact O-N 3.15Å; F44-N46 PolarHBondContact O-N 2.9Å; F44-F47 VanDerWaalsContact CA-CD2 3.42Å; F44-F47 HydrophobicContact CB-CD2 3.91Å; F44-F47 HydrophobicContact CB-CE2 4.13Å; F44-F47 AromaticContact CD1-CD2 3.54Å; F44-F47 HydrophobicContact CD1-CD2 3.54Å; F44-F47 AromaticContact CD1-CE2 3.22Å; F44-F47 HydrophobicContact CD1-CE2 3.22Å; F44-F47 HydrophobicContact CD1-CZ 4.27Å; F44-F47 HydrophobicContact CE1-CD2 4.46Å; F44-F47 AromaticContact CE1-CE2 3.79Å; F44-F47 HydrophobicContact CE1-CE2 3.79Å; F44-F47 HydrophobicContact CE1-CZ 4.47Å; F44-F47 HydrophobicContact CG-CD2 4.08Å; F44-F47 AromaticContact CG-CE2 3.86Å; F44-F47 HydrophobicContact CG-CE2 3.86Å; F44-F47 WeakPolarHBondContact O-CD2 3.4Å; F44-F47 PolarHBondContact O-N 2.74Å |
| 45 | E | 78 | Confident | 73.3 | Confident | 172 Ų | 172 | 137.4 Ų | 137.4 | 80% | 0.804 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -21.1 | 179.6 | -60.9 | 98 | -128.7 | 0 | 0 | 112.2 | D43 | D43-E45 WeakPolarHBondContact OD1-CA 3.42Å; D43-E45 VanDerWaalsContact OD1-CB 3.27Å; D43-E45 WeakPolarHBondContact OD1-CB 3.29Å; D43-E45 PolarHBondContact OD1-N 3.08Å |
| 46 | N | 74 | Confident | 73.3 | Confident | 131 Ų | 131 | 131.7 Ų | 131.7 | 70% | 0.701 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | -3.6 | 175 | -167.8 | 45.6 | 0 | 0 | 0 | 113.9 | F44 V48 | F44-N46 PolarHBondContact O-N 2.9Å; N46-V48 PolarHBondContact O-N 3.21Å |
| 47 | F | 76.2 | Confident | 73 | Confident | 129 Ų | 129 | 128.3 Ų | 128.3 | 57% | 0.566 | 72% | 0.723 | S | S | * | * | trans | -71.4 | 98.6 | 169.1 | -67.3 | -76.5 | 0 | 0 | 0 | 108.4 | V42 F44 A49 | V42-F47 HydrophobicContact CG1-CE2 3.82Å; V42-F47 HydrophobicContact CG1-CZ 3.81Å; F44-F47 VanDerWaalsContact CA-CD2 3.42Å; F44-F47 HydrophobicContact CB-CD2 3.91Å; F44-F47 HydrophobicContact CB-CE2 4.13Å; F44-F47 AromaticContact CD1-CD2 3.54Å; F44-F47 HydrophobicContact CD1-CD2 3.54Å; F44-F47 AromaticContact CD1-CE2 3.22Å; F44-F47 HydrophobicContact CD1-CE2 3.22Å; F44-F47 HydrophobicContact CD1-CZ 4.27Å; F44-F47 HydrophobicContact CE1-CD2 4.46Å; F44-F47 AromaticContact CE1-CE2 3.79Å; F44-F47 HydrophobicContact CE1-CE2 3.79Å; F44-F47 HydrophobicContact CE1-CZ 4.47Å; F44-F47 HydrophobicContact CG-CD2 4.08Å; F44-F47 AromaticContact CG-CE2 3.86Å; F44-F47 HydrophobicContact CG-CE2 3.86Å; F44-F47 WeakPolarHBondContact O-CD2 3.4Å; F44-F47 PolarHBondContact O-N 2.74Å; F47-A49 PolarHBondContact O-N 3.39Å; F47-A49 VanDerWaalsContact O-N 3.13Å | ||
| 48 | V | 76.7 | Confident | 73.1 | Confident | 125 Ų | 125 | 129.6 Ų | 129.6 | 76% | 0.758 | 72% | 0.722 | S | S | * | * | trans | -54.7 | 120.5 | 156 | 179.2 | 0 | 0 | 0 | 0 | 105.3 | N46 I50 | N46-V48 PolarHBondContact O-N 3.21Å; V48-I50 PolarHBondContact O-N 3.23Å | ||
| 49 | A | 73 | Confident | 73.4 | Confident | 84 Ų | 84 | 127.8 Ų | 127.8 | 69% | 0.694 | 71% | 0.713 | S | S | * | * | trans | -51.9 | 107 | 172.4 | 0 | 0 | 0 | 0 | 0 | 106.7 | F47 E51 | F47-A49 PolarHBondContact O-N 3.39Å; F47-A49 VanDerWaalsContact O-N 3.13Å; A49-E51 VanDerWaalsContact C-N 3.29Å; A49-E51 PolarHBondContact O-N 3.37Å | ||
| 50 | I | 70.2 | Confident | 73.7 | Confident | 165 Ų | 165 | 125.3 Ų | 125.3 | 85% | 0.846 | 70% | 0.7 | S | S | * | * | trans | -61.3 | 109.5 | 163.7 | -56.2 | -174.6 | 0 | 0 | 0 | 101.6 | V48 D52 | V48-I50 PolarHBondContact O-N 3.23Å; I50-D52 PolarHBondContact O-N 3.45Å | ||
| 51 | E | 69.7 | Low | 74.1 | Confident | 169 Ų | 169 | 120.2 Ų | 120.2 | 79% | 0.79 | 68% | 0.678 | S | S | * | * | trans | -46.3 | 132.5 | 171.1 | -78 | -178.6 | 163 | 0 | 0 | 105.8 | A49 E53 | A49-E51 VanDerWaalsContact C-N 3.29Å; A49-E51 PolarHBondContact O-N 3.37Å; E51-E53 PolarHBondContact O-N 2.99Å | ||
| 52 | D | 70.6 | Confident | 74.5 | Confident | 148 Ų | 148 | 120.4 Ų | 120.4 | 79% | 0.791 | 67% | 0.667 | S | S | * | * | trans | -63.7 | 72.4 | 167.4 | -173.8 | 42.8 | 0 | 0 | 0 | 105.6 | I50 V54 | I50-D52 PolarHBondContact O-N 3.45Å; D52-V54 PolarHBondContact O-N 2.96Å | ||
| 53 | E | 71.1 | Confident | 75.1 | Confident | 171 Ų | 171 | 122.9 Ų | 122.9 | 80% | 0.799 | 67% | 0.672 | S | S | * | * | trans | -59.9 | 95.2 | 163.4 | -177.1 | 177.3 | 178.9 | 0 | 0 | 101.1 | E51 A55 | E51-E53 PolarHBondContact O-N 2.99Å; E53-A55 PolarHBondContact O-N 3.5Å | ||
| 54 | V | 68.3 | Low | 75.6 | Confident | 101 Ų | 101 | 120.9 Ų | 120.9 | 61% | 0.612 | 67% | 0.668 | S | S | * | * | trans | -55.8 | 90.1 | 170.5 | 177.9 | 0 | 0 | 0 | 0 | 102.8 | D52 T56 | D52-V54 PolarHBondContact O-N 2.96Å; V54-T56 PolarHBondContact O-N 3.22Å | ||
| 55 | A | 68.2 | Low | 76.3 | Confident | 80 Ų | 80 | 117.9 Ų | 117.9 | 66% | 0.661 | 66% | 0.659 | S | S | * | * | trans | -54.3 | 106.3 | 166.9 | 0 | 0 | 0 | 0 | 0 | 100.9 | E53 S57 | E53-A55 PolarHBondContact O-N 3.5Å; A55-S57 PolarHBondContact O-N 3.27Å | ||
| 56 | T | 69.2 | Low | 76.8 | Confident | 113 Ų | 113 | 116.3 Ų | 116.3 | 69% | 0.693 | 65% | 0.649 | S | S | * | * | trans | -61.1 | 98.7 | 177.4 | 51.5 | 0 | 0 | 0 | 0 | 102.2 | V54 T58 | V54-T56 PolarHBondContact O-N 3.22Å; T56-T58 PolarHBondContact O-N 2.93Å | ||
| 57 | S | 64.1 | Low | 77.6 | Confident | 113 Ų | 113 | 115.2 Ų | 115.2 | 79% | 0.79 | 64% | 0.64 | S | S | * | * | trans | -72.4 | 69 | 174.5 | -168.2 | 0 | 0 | 0 | 0 | 103.9 | A55 E59 | A55-S57 PolarHBondContact O-N 3.27Å; S57-E59 PolarHBondContact O-N 3.49Å | ||
| 58 | T | 73.4 | Confident | 78.2 | Confident | 113 Ų | 113 | 113.2 Ų | 113.2 | 69% | 0.693 | 64% | 0.638 | S | S | * | * | trans | -69.4 | 86.5 | 157.5 | -54.7 | 0 | 0 | 0 | 0 | 101.7 | T56 P60 | T56-T58 PolarHBondContact O-N 2.93Å; T58-P60 VanDerWaalsContact O-CD 3.3Å; T58-P60 WeakPolarHBondContact O-CD 3.38Å | ||
| 59 | E | 78.6 | Confident | 78.9 | Confident | 156 Ų | 156 | 112.2 Ų | 112.2 | 73% | 0.729 | 63% | 0.628 | S | S | * | * | trans | -49 | 115 | 166.4 | -174 | 175.9 | 176.2 | 0 | 0 | 105.2 | S57 D61 | S57-E59 PolarHBondContact O-N 3.49Å; E59-D61 PolarHBondContact O-N 3.39Å | ||
| 60 | P | 79.2 | Confident | 79.6 | Confident | 74 Ų | 74 | 110.5 Ų | 110.5 | 48% | 0.481 | 61% | 0.607 | S | S | . | * | trans | -60.1 | 132.9 | -175.9 | 23.6 | -32.9 | 0 | 0 | 0 | 107.9 | T58 P62 L65 | T58-P60 VanDerWaalsContact O-CD 3.3Å; T58-P60 WeakPolarHBondContact O-CD 3.38Å; P60-P62 VanDerWaalsContact O-CD 3.23Å; P60-P62 WeakPolarHBondContact O-CD 3.39Å; P60-L65 HydrophobicContact CB-CD1 3.98Å; P60-L65 HydrophobicContact CB-CD2 4.3Å; P60-L65 HydrophobicContact CB-CG 4.14Å; P60-L65 HydrophobicContact CG-CD1 3.83Å | ||
| 61 | D | 86 | Confident | 80.5 | Confident | 81 Ų | 81 | 106 Ų | 106 | 43% | 0.433 | 59% | 0.594 | S | S | . | * | trans | -52.6 | 117.8 | 176.4 | 167.5 | 26 | 0 | 0 | 0 | 109 | E59 Q63 A64 L65 | E59-D61 PolarHBondContact O-N 3.39Å; D61-Q63 PolarHBondContact O-N 3.36Å; D61-Q63 VanDerWaalsContact O-N 3.15Å; D61-Q63 WeakPolarHBondContact OD1-CB 3.26Å; D61-Q63 PolarHBondContact OD1-N 3.43Å; D61-A64 HydrophobicContact CB-CB 4Å; D61-A64 PolarHBondContact O-N 3.43Å; D61-A64 VanDerWaalsContact O-N 3.12Å; D61-A64 PolarHBondContact OD2-N 2.9Å; D61-A64 VanDerWaalsContact OD2-N 3.15Å; D61-L65 PolarHBondContact O-N 3.24Å; D61-L65 VanDerWaalsContact O-N 3.11Å | ||
| 62 | P | 85.9 | Confident | 81.4 | Confident | 73 Ų | 73 | 106 Ų | 106 | 47% | 0.474 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -54.6 | -35.3 | 179.5 | -26.7 | 34.9 | 0 | 0 | 0 | 112.1 | P60 L65 F66 | P60-P62 VanDerWaalsContact O-CD 3.23Å; P60-P62 WeakPolarHBondContact O-CD 3.39Å; P62-L65 WeakPolarHBondContact O-CB 3.38Å; P62-L65 PolarHBondContact O-N 2.99Å; P62-F66 WeakPolarHBondContact O-CD2 3.44Å; P62-F66 PolarHBondContact O-N 3.42Å |
| 63 | Q | 90.9 | Very high | 82.3 | Confident | 145 Ų | 145 | 102 Ų | 102 | 68% | 0.678 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67 | -44.2 | 179.8 | -64.7 | 176.4 | -46.3 | 0 | 0 | 111.6 | D61 L65 F66 Q67 | D61-Q63 PolarHBondContact O-N 3.36Å; D61-Q63 VanDerWaalsContact O-N 3.15Å; D61-Q63 WeakPolarHBondContact OD1-CB 3.26Å; D61-Q63 PolarHBondContact OD1-N 3.43Å; Q63-L65 VanDerWaalsContact C-N 3.29Å; Q63-L65 PolarHBondContact O-N 3.44Å; Q63-F66 PolarHBondContact O-N 2.98Å; Q63-Q67 WeakPolarHBondContact O-CG 3.35Å; Q63-Q67 PolarHBondContact O-N 2.98Å |
| 64 | A | 89 | Confident | 82.8 | Confident | 48 Ų | 48 | 96.9 Ų | 96.9 | 40% | 0.397 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -59.4 | -38.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | D61 Q67 T68 | D61-A64 HydrophobicContact CB-CB 4Å; D61-A64 PolarHBondContact O-N 3.43Å; D61-A64 VanDerWaalsContact O-N 3.12Å; D61-A64 PolarHBondContact OD2-N 2.9Å; D61-A64 VanDerWaalsContact OD2-N 3.15Å; A64-Q67 PolarHBondContact O-N 3.21Å; A64-T68 WeakPolarHBondContact O-CB 3.43Å; A64-T68 PolarHBondContact O-N 3.4Å; A64-T68 PolarHBondContact O-OG1 2.81Å |
| 65 | L | 90 | Very high | 83.2 | Confident | 84 Ų | 84 | 97.7 Ų | 97.7 | 44% | 0.44 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.3 | -45.4 | 174.3 | -69.9 | 176.3 | 0 | 0 | 0 | 111.7 | P60 D61 P62 Q63 Q67 T68 I69 | P60-L65 HydrophobicContact CB-CD1 3.98Å; P60-L65 HydrophobicContact CB-CD2 4.3Å; P60-L65 HydrophobicContact CB-CG 4.14Å; P60-L65 HydrophobicContact CG-CD1 3.83Å; D61-L65 PolarHBondContact O-N 3.24Å; D61-L65 VanDerWaalsContact O-N 3.11Å; P62-L65 WeakPolarHBondContact O-CB 3.38Å; P62-L65 PolarHBondContact O-N 2.99Å; Q63-L65 VanDerWaalsContact C-N 3.29Å; Q63-L65 PolarHBondContact O-N 3.44Å; L65-Q67 PolarHBondContact O-N 2.68Å; L65-T68 WeakPolarHBondContact O-CB 3.46Å; L65-T68 PolarHBondContact O-N 3.08Å; L65-I69 WeakPolarHBondContact O-CG1 3.48Å; L65-I69 PolarHBondContact O-N 3.47Å |
| 66 | F | 88.3 | Confident | 83.1 | Confident | 140 Ų | 140 | 98.1 Ų | 98.1 | 61% | 0.614 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -58.6 | -45.9 | 176.3 | -82.7 | -69.8 | 0 | 0 | 0 | 112.2 | P62 Q63 T68 I69 L70 | P62-F66 WeakPolarHBondContact O-CD2 3.44Å; P62-F66 PolarHBondContact O-N 3.42Å; Q63-F66 PolarHBondContact O-N 2.98Å; F66-T68 VanDerWaalsContact C-N 3.3Å; F66-T68 PolarHBondContact O-N 2.87Å; F66-I69 PolarHBondContact O-N 3.3Å; F66-L70 WeakPolarHBondContact O-CB 3.07Å; F66-L70 VanDerWaalsContact O-CG 3.26Å; F66-L70 WeakPolarHBondContact O-CG 3.5Å; F66-L70 PolarHBondContact O-N 2.89Å |
| 67 | Q | 90.1 | Very high | 82.9 | Confident | 107 Ų | 107 | 96.4 Ų | 96.4 | 50% | 0.5 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64.2 | -36.9 | 178.2 | -64.9 | -60.3 | -16.9 | 0 | 0 | 112.2 | Q63 A64 L65 L70 A71 | Q63-Q67 WeakPolarHBondContact O-CG 3.35Å; Q63-Q67 PolarHBondContact O-N 2.98Å; A64-Q67 PolarHBondContact O-N 3.21Å; L65-Q67 PolarHBondContact O-N 2.68Å; Q67-L70 PolarHBondContact O-N 3.39Å; Q67-A71 VanDerWaalsContact O-CB 3.32Å; Q67-A71 WeakPolarHBondContact O-CB 3.48Å; Q67-A71 PolarHBondContact O-N 2.88Å |
| 68 | T | 89.9 | Confident | 82.7 | Confident | 87 Ų | 87 | 98.1 Ų | 98.1 | 53% | 0.534 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.3 | -47.6 | 176.4 | -57.6 | 0 | 0 | 0 | 0 | 111.1 | A64 L65 F66 L70 A71 E72 | A64-T68 WeakPolarHBondContact O-CB 3.43Å; A64-T68 PolarHBondContact O-N 3.4Å; A64-T68 PolarHBondContact O-OG1 2.81Å; L65-T68 WeakPolarHBondContact O-CB 3.46Å; L65-T68 PolarHBondContact O-N 3.08Å; F66-T68 VanDerWaalsContact C-N 3.3Å; F66-T68 PolarHBondContact O-N 2.87Å; T68-L70 VanDerWaalsContact C-N 3.33Å; T68-L70 PolarHBondContact O-N 3.11Å; T68-A71 PolarHBondContact O-N 2.89Å; T68-E72 WeakPolarHBondContact O-CB 3.32Å; T68-E72 PolarHBondContact O-N 3.44Å |
| 69 | I | 90.3 | Very high | 81.9 | Confident | 105 Ų | 105 | 98.8 Ų | 98.8 | 54% | 0.538 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -61.9 | -42.6 | 178.2 | -66.6 | 164.6 | 0 | 0 | 0 | 110.7 | L65 F66 E72 A73 | L65-I69 WeakPolarHBondContact O-CG1 3.48Å; L65-I69 PolarHBondContact O-N 3.47Å; F66-I69 PolarHBondContact O-N 3.3Å; I69-E72 PolarHBondContact O-N 2.91Å; I69-A73 VanDerWaalsContact O-CB 3.29Å; I69-A73 WeakPolarHBondContact O-CB 3.45Å; I69-A73 PolarHBondContact O-N 2.98Å |
| 70 | L | 89.4 | Confident | 80.5 | Confident | 48 Ų | 48 | 96 Ų | 96 | 25% | 0.251 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.5 | -45.1 | 177.6 | -72.3 | 171.9 | 0 | 0 | 0 | 111.4 | F66 Q67 T68 A73 G74 M75 V77 | F66-L70 WeakPolarHBondContact O-CB 3.07Å; F66-L70 VanDerWaalsContact O-CG 3.26Å; F66-L70 WeakPolarHBondContact O-CG 3.5Å; F66-L70 PolarHBondContact O-N 2.89Å; Q67-L70 PolarHBondContact O-N 3.39Å; T68-L70 VanDerWaalsContact C-N 3.33Å; T68-L70 PolarHBondContact O-N 3.11Å; L70-A73 PolarHBondContact O-N 2.81Å; L70-G74 PolarHBondContact O-N 3.02Å; L70-M75 CarbonylContact C-O 3.33Å; L70-M75 HydrophobicContact CB-CB 4.43Å; L70-M75 WeakPolarHBondContact CB-O 3.49Å; L70-M75 HydrophobicContact CD2-CB 4.05Å; L70-M75 HydrophobicContact CD2-CE 4.36Å; L70-M75 HydrophobicContact CD2-SD 4.15Å; L70-M75 CarbonylContact O-C 3.24Å; L70-M75 VanDerWaalsContact O-C 3.24Å; L70-M75 VanDerWaalsContact O-CA 3.3Å; L70-M75 WeakPolarHBondContact O-CA 3.23Å; L70-M75 WeakPolarHBondContact O-CB 3.3Å; L70-M75 PolarHBondContact O-N 3.02Å; L70-M75 VanDerWaalsContact O-O 3.1Å; L70-V77 HydrophobicContact CD1-CG2 3.79Å |
| 71 | A | 88.9 | Confident | 79.2 | Confident | 69 Ų | 69 | 98.3 Ų | 98.3 | 57% | 0.57 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -62.6 | -43 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q67 T68 G74 | Q67-A71 VanDerWaalsContact O-CB 3.32Å; Q67-A71 WeakPolarHBondContact O-CB 3.48Å; Q67-A71 PolarHBondContact O-N 2.88Å; T68-A71 PolarHBondContact O-N 2.89Å; A71-G74 PolarHBondContact O-N 3.44Å; A71-G74 VanDerWaalsContact O-N 3.09Å |
| 72 | E | 87.5 | Confident | 77.6 | Confident | 169 Ų | 169 | 99 Ų | 99 | 79% | 0.79 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -63.5 | -40.7 | 175.8 | -174.9 | -179.5 | 171.2 | 0 | 0 | 111.9 | T68 I69 G74 | T68-E72 WeakPolarHBondContact O-CB 3.32Å; T68-E72 PolarHBondContact O-N 3.44Å; I69-E72 PolarHBondContact O-N 2.91Å; E72-G74 PolarHBondContact O-N 3.45Å |
| 73 | A | 89 | Confident | 75.6 | Confident | 65 Ų | 65 | 99.2 Ų | 99.2 | 54% | 0.537 | 61% | 0.607 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.2 | -1.3 | 175 | 0 | 0 | 0 | 0 | 0 | 113.4 | I69 L70 M75 | I69-A73 VanDerWaalsContact O-CB 3.29Å; I69-A73 WeakPolarHBondContact O-CB 3.45Å; I69-A73 PolarHBondContact O-N 2.98Å; L70-A73 PolarHBondContact O-N 2.81Å; A73-M75 HydrophobicContact CB-CG 4.03Å; A73-M75 HydrophobicContact CB-SD 4.26Å; A73-M75 PolarHBondContact O-N 3.34Å |
| 74 | G | 82.6 | Confident | 73.7 | Confident | 63 Ų | 63 | 100 Ų | 100 | 65% | 0.649 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69 | 9.9 | -172.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L70 A71 E72 S76 | L70-G74 PolarHBondContact O-N 3.02Å; A71-G74 PolarHBondContact O-N 3.44Å; A71-G74 VanDerWaalsContact O-N 3.09Å; E72-G74 PolarHBondContact O-N 3.45Å; G74-S76 PolarHBondContact O-N 3.21Å |
| 75 | M | 77.4 | Confident | 72 | Confident | 119 Ų | 119 | 105.4 Ų | 105.4 | 59% | 0.586 | 63% | 0.632 | S | S | * | * | trans | -87.1 | 68.1 | 172.1 | -58.1 | 179.4 | 72.2 | 0 | 0 | 107.4 | L70 A73 V77 | L70-M75 CarbonylContact C-O 3.33Å; L70-M75 HydrophobicContact CB-CB 4.43Å; L70-M75 WeakPolarHBondContact CB-O 3.49Å; L70-M75 HydrophobicContact CD2-CB 4.05Å; L70-M75 HydrophobicContact CD2-CE 4.36Å; L70-M75 HydrophobicContact CD2-SD 4.15Å; L70-M75 CarbonylContact O-C 3.24Å; L70-M75 VanDerWaalsContact O-C 3.24Å; L70-M75 VanDerWaalsContact O-CA 3.3Å; L70-M75 WeakPolarHBondContact O-CA 3.23Å; L70-M75 WeakPolarHBondContact O-CB 3.3Å; L70-M75 PolarHBondContact O-N 3.02Å; L70-M75 VanDerWaalsContact O-O 3.1Å; A73-M75 HydrophobicContact CB-CG 4.03Å; A73-M75 HydrophobicContact CB-SD 4.26Å; A73-M75 PolarHBondContact O-N 3.34Å; M75-V77 PolarHBondContact O-N 3.41Å | ||
| 76 | S | 64.6 | Low | 70.3 | Confident | 88 Ų | 88 | 105.5 Ų | 105.5 | 62% | 0.615 | 65% | 0.646 | S | S | * | * | trans | -58.3 | 113.5 | 165.1 | 49.2 | 0 | 0 | 0 | 0 | 107.1 | G74 E78 | G74-S76 PolarHBondContact O-N 3.21Å; S76-E78 PolarHBondContact O-N 3.32Å | ||
| 77 | V | 65.3 | Low | 68.6 | Low | 77 Ų | 77 | 106.5 Ų | 106.5 | 47% | 0.467 | 65% | 0.652 | S | S | . | * | trans | -62.6 | 95.2 | 162.3 | 171.2 | 0 | 0 | 0 | 0 | 104.4 | L70 M75 T79 | L70-V77 HydrophobicContact CD1-CG2 3.79Å; M75-V77 PolarHBondContact O-N 3.41Å; V77-T79 HydrophobicContact CG1-CG2 4.42Å; V77-T79 PolarHBondContact O-N 3.15Å | ||
| 78 | E | 60.2 | Low | 66.6 | Low | 150 Ų | 150 | 109.3 Ų | 109.3 | 70% | 0.701 | 67% | 0.665 | S | S | * | * | trans | -58.4 | 102 | 161.6 | -60.8 | -165.6 | 141.9 | 0 | 0 | 104.5 | S76 S80 | S76-E78 PolarHBondContact O-N 3.32Å; E78-S80 PolarHBondContact O-N 3.12Å | ||
| 79 | T | 55.8 | Low | 64.8 | Low | 126 Ų | 126 | 114.6 Ų | 114.6 | 77% | 0.773 | 68% | 0.684 | S | S | * | * | trans | -68.5 | 55.8 | 163.4 | 14.6 | 0 | 0 | 0 | 0 | 108.1 | V77 C81 | V77-T79 HydrophobicContact CG1-CG2 4.42Å; V77-T79 PolarHBondContact O-N 3.15Å; T79-C81 PolarHBondContact O-N 2.77Å; T79-C81 VanDerWaalsContact O-N 3.08Å | ||
| 80 | S | 49.9 | Very low | 62.9 | Low | 98 Ų | 98 | 113.2 Ų | 113.2 | 69% | 0.685 | 68% | 0.684 | S | S | * | * | trans | -80.9 | 55.2 | 161.6 | 55.8 | 0 | 0 | 0 | 0 | 108.6 | E78 | E78-S80 PolarHBondContact O-N 3.12Š| ||
| 81 | C | 52.8 | Low | 61.5 | Low | 122 Ų | 122 | 119.2 Ų | 119.2 | 82% | 0.824 | 72% | 0.716 | S | S | * | * | trans | -134.6 | 40.3 | 163.1 | -147.8 | 0 | 0 | 0 | 0 | 108.8 | T79 G83 | T79-C81 PolarHBondContact O-N 2.77Å; T79-C81 VanDerWaalsContact O-N 3.08Å; C81-G83 PolarHBondContact O-N 2.96Å | ||
| 82 | A | 52.2 | Low | 59.8 | Low | 96 Ų | 96 | 121 Ų | 121 | 79% | 0.793 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -71.6 | 112.7 | 153.5 | 0 | 0 | 0 | 0 | 0 | 105.9 | D84 | A82-D84 PolarHBondContact O-N 3.15Š|
| 83 | G | 44.1 | Very low | 58.4 | Low | 77 Ų | 77 | 121.8 Ų | 121.8 | 79% | 0.794 | 72% | 0.72 | S | S | * | * | trans | -52.7 | 132.8 | -167.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | C81 | C81-G83 PolarHBondContact O-N 2.96Š| ||
| 84 | D | 51.1 | Low | 56.4 | Low | 161 Ų | 161 | 122.5 Ų | 122.5 | 86% | 0.861 | 72% | 0.718 | S | S | * | * | trans | -93.1 | 122.6 | 148.3 | -162.2 | 17.9 | 0 | 0 | 0 | 107.7 | A82 A86 | A82-D84 PolarHBondContact O-N 3.15Å; D84-A86 PolarHBondContact O-N 3.11Å | ||
| 85 | Q | 51.8 | Low | 55.1 | Low | 162 Ų | 162 | 127.7 Ų | 127.7 | 76% | 0.757 | 73% | 0.725 | S | S | * | * | trans | -69.7 | 91.3 | -174.5 | -175.6 | 128.1 | -74.3 | 0 | 0 | 109 | ||||
| 86 | A | 56.2 | Low | 53.9 | Low | 87 Ų | 87 | 129 Ų | 129 | 72% | 0.719 | 73% | 0.731 | S | S | * | * | trans | -98.2 | 99.6 | 163.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | D84 E88 | D84-A86 PolarHBondContact O-N 3.11Å; A86-E88 PolarHBondContact O-N 3.27Å | ||
| 87 | E | 52.5 | Low | 53.9 | Low | 160 Ų | 160 | 129.3 Ų | 129.3 | 75% | 0.748 | 73% | 0.729 | S | S | * | * | trans | -43.9 | 99.9 | 172.4 | -55.7 | -83.9 | 145.2 | 0 | 0 | 111.4 | ||||
| 88 | E | 47.5 | Very low | 53.5 | Low | 167 Ų | 167 | 132.5 Ų | 132.5 | 78% | 0.78 | 74% | 0.739 | S | S | * | * | trans | -102.3 | 89.7 | 165.3 | -83.1 | -106.6 | 156.4 | 0 | 0 | 108.1 | A86 S90 | A86-E88 PolarHBondContact O-N 3.27Å; E88-S90 PolarHBondContact O-N 3.31Å | ||
| 89 | E | 51.9 | Low | 53.9 | Low | 198 Ų | 198 | 134 Ų | 134 | 93% | 0.925 | 74% | 0.743 | S | S | * | * | trans | -62.3 | 84.5 | 149.6 | -72.2 | -176.5 | 163.6 | 0 | 0 | 107.5 | ||||
| 90 | S | 50.8 | Low | 54.5 | Low | 76 Ų | 76 | 132.4 Ų | 132.4 | 53% | 0.531 | 73% | 0.729 | S | S | . | * | trans | -127.4 | 85 | 168.1 | -167.8 | 0 | 0 | 0 | 0 | 108.9 | E88 N92 | E88-S90 PolarHBondContact O-N 3.31Å; S90-N92 PolarHBondContact O-N 3.09Å | ||
| 91 | D | 58.9 | Low | 55.8 | Low | 174 Ų | 174 | 135 Ų | 135 | 93% | 0.93 | 73% | 0.729 | S | S | * | * | trans | -62.6 | 43.3 | 162 | -113.5 | -9.5 | 0 | 0 | 0 | 111.2 | E93 | D91-E93 PolarHBondContact O-N 3.24Å; D91-E93 VanDerWaalsContact O-N 3.08Å | ||
| 92 | N | 54 | Low | 56.8 | Low | 106 Ų | 106 | 137.7 Ų | 137.7 | 57% | 0.567 | 73% | 0.729 | S | S | * | * | trans | -90.4 | 67.3 | 175 | -162 | 54.3 | 0 | 0 | 0 | 110.3 | S90 T94 | S90-N92 PolarHBondContact O-N 3.09Å; N92-T94 PolarHBondContact ND2-OG1 2.9Å; N92-T94 PolarHBondContact O-N 3.12Å; N92-T94 WeakPolarHBondContact OD1-CG2 3.42Å | ||
| 93 | E | 57.4 | Low | 58 | Low | 186 Ų | 186 | 138.9 Ų | 138.9 | 87% | 0.869 | 72% | 0.718 | S | S | * | * | trans | -48.2 | 75.3 | 141.5 | -176.1 | -167.3 | 109.1 | 0 | 0 | 109.6 | D91 | D91-E93 PolarHBondContact O-N 3.24Å; D91-E93 VanDerWaalsContact O-N 3.08Å | ||
| 94 | T | 48.5 | Very low | 59.8 | Low | 80 Ų | 80 | 138.5 Ų | 138.5 | 49% | 0.491 | 70% | 0.698 | S | S | . | * | trans | -130.9 | 85.3 | 157.8 | 65.7 | 0 | 0 | 0 | 0 | 108.9 | N92 M96 | N92-T94 PolarHBondContact ND2-OG1 2.9Å; N92-T94 PolarHBondContact O-N 3.12Å; N92-T94 WeakPolarHBondContact OD1-CG2 3.42Å; T94-M96 PolarHBondContact O-N 3.28Å | ||
| 95 | E | 53.6 | Low | 61.4 | Low | 171 Ų | 171 | 133.7 Ų | 133.7 | 80% | 0.799 | 67% | 0.674 | S | S | * | * | trans | -35.1 | 77.2 | 141.7 | -171.4 | -175.2 | -179 | 0 | 0 | 111.2 | V97 | E95-V97 HydrophobicContact CG-CB 4.1Å; E95-V97 HydrophobicContact CG-CG2 3.78Å; E95-V97 PolarHBondContact O-N 3.05Å; E95-V97 VanDerWaalsContact O-N 3.16Å | ||
| 96 | M | 52.3 | Low | 62.8 | Low | 146 Ų | 146 | 127.8 Ų | 127.8 | 72% | 0.719 | 66% | 0.657 | S | S | * | * | trans | -85.1 | 50.9 | 159.7 | -69.5 | -122.5 | -66.3 | 0 | 0 | 108.5 | T94 Q98 | T94-M96 PolarHBondContact O-N 3.28Å; M96-Q98 PolarHBondContact O-N 3.4Å | ||
| 97 | V | 65.7 | Low | 64.2 | Low | 96 Ų | 96 | 129.5 Ų | 129.5 | 58% | 0.582 | 65% | 0.645 | S | S | * | * | trans | -72.9 | 81.5 | 158.9 | -176.8 | 0 | 0 | 0 | 0 | 105.3 | E95 K99 | E95-V97 HydrophobicContact CG-CB 4.1Å; E95-V97 HydrophobicContact CG-CG2 3.78Å; E95-V97 PolarHBondContact O-N 3.05Å; E95-V97 VanDerWaalsContact O-N 3.16Å; V97-K99 HydrophobicContact CG1-CG 3.99Å; V97-K99 PolarHBondContact O-N 3.16Å | ||
| 98 | Q | 57.4 | Low | 65.8 | Low | 143 Ų | 143 | 126.6 Ų | 126.6 | 67% | 0.668 | 63% | 0.632 | S | S | * | * | trans | -63.8 | 93.7 | 161.5 | -70 | -171.5 | 3.8 | 0 | 0 | 106.1 | M96 L100 | M96-Q98 PolarHBondContact O-N 3.4Å; Q98-L100 PolarHBondContact O-N 2.99Å | ||
| 99 | K | 68.5 | Low | 67.6 | Low | 182 Ų | 182 | 124 Ų | 124 | 79% | 0.791 | 62% | 0.623 | S | S | * | * | trans | -63.8 | 82.6 | 164.2 | -74.2 | -159.3 | 178.3 | -171.9 | 0 | 107.4 | V97 K101 | V97-K99 HydrophobicContact CG1-CG 3.99Å; V97-K99 PolarHBondContact O-N 3.16Å; K99-K101 PolarHBondContact O-N 2.84Å; K99-K101 VanDerWaalsContact O-N 3.11Å | ||
| 100 | L | 68.5 | Low | 69.2 | Low | 92 Ų | 92 | 117.5 Ų | 117.5 | 48% | 0.482 | 60% | 0.603 | S | S | . | * | trans | -58.7 | 115.1 | 158.8 | -64.7 | 176.4 | 0 | 0 | 0 | 105.5 | Q98 V105 | Q98-L100 PolarHBondContact O-N 2.99Å; L100-V105 HydrophobicContact CB-CG2 3.93Å; L100-V105 HydrophobicContact CD1-CG2 4.32Å | ||
| 101 | K | 76.6 | Confident | 70.6 | Confident | 154 Ų | 154 | 121.2 Ų | 121.2 | 67% | 0.67 | 61% | 0.612 | S | S | * | * | trans | -62.1 | 142.7 | 169.1 | -69.9 | -177.1 | 178.6 | 175.8 | 0 | 106.8 | K99 E103 D104 V105 | K99-K101 PolarHBondContact O-N 2.84Å; K99-K101 VanDerWaalsContact O-N 3.11Å; K101-E103 PolarHBondContact O-N 2.64Å; K101-D104 PolarHBondContact O-N 2.91Å; K101-V105 PolarHBondContact O-N 2.68Å | ||
| 102 | E | 73.1 | Confident | 71.6 | Confident | 177 Ų | 177 | 120 Ų | 120 | 83% | 0.827 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -48.9 | -32.6 | 178.5 | -171.4 | 176.9 | 178.9 | 0 | 0 | 112.5 | D104 V105 G106 | E102-D104 PolarHBondContact O-N 2.75Å; E102-V105 PolarHBondContact O-N 2.61Å; E102-G106 PolarHBondContact O-N 2.78Å |
| 103 | E | 78.6 | Confident | 72.3 | Confident | 121 Ų | 121 | 119.8 Ų | 119.8 | 57% | 0.565 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -60.8 | -37.6 | 174.1 | -160.6 | -169.8 | 178.1 | 0 | 0 | 113.8 | K101 G106 R107 | K101-E103 PolarHBondContact O-N 2.64Å; E103-G106 PolarHBondContact O-N 3.16Å; E103-R107 VanDerWaalsContact CD-CZ 3.44Å; E103-R107 WeakPolarHBondContact O-CG 3.41Å; E103-R107 PolarHBondContact O-N 2.9Å; E103-R107 IonicContact OE1-CZ 3.08Å; E103-R107 IonicContact OE1-NH1 2.68Å; E103-R107 PolarHBondContact OE1-NH1 3.08Å; E103-R107 IonicContact OE1-NH2 2.89Å; E103-R107 PolarHBondContact OE1-NH2 3.17Å; E103-R107 IonicContact OE2-CZ 3.39Å; E103-R107 IonicContact OE2-NH1 3.83Å; E103-R107 IonicContact OE2-NH2 3.84Å; E103-R107 PolarHBondContact OE2-NH2 2.96Å; E103-R107 VanDerWaalsContact OE2-NH2 3.08Å |
| 104 | D | 80.9 | Confident | 72.4 | Confident | 70 Ų | 70 | 124.7 Ų | 124.7 | 37% | 0.374 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -75.1 | -35.4 | 177.6 | -78.5 | -13.1 | 0 | 0 | 0 | 111.9 | K101 E102 G106 R107 M108 | K101-D104 PolarHBondContact O-N 2.91Å; E102-D104 PolarHBondContact O-N 2.75Å; D104-G106 VanDerWaalsContact C-N 3.33Å; D104-R107 PolarHBondContact O-N 2.75Å; D104-R107 IonicContact OD1-CZ 3.4Å; D104-R107 IonicContact OD1-NE 3.15Å; D104-R107 PolarHBondContact OD1-NE 2.62Å; D104-R107 VanDerWaalsContact OD1-NE 3.15Å; D104-R107 IonicContact OD1-NH2 3.46Å; D104-R107 PolarHBondContact OD1-NH2 3.01Å; D104-M108 WeakPolarHBondContact O-CB 3.27Å; D104-M108 PolarHBondContact O-N 2.94Å |
| 105 | V | 84.1 | Confident | 73.6 | Confident | 60 Ų | 60 | 126.9 Ų | 126.9 | 36% | 0.364 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -63.6 | -43.3 | 170.9 | -177.6 | 0 | 0 | 0 | 0 | 109.9 | L100 K101 E102 R107 M108 L109 | L100-V105 HydrophobicContact CB-CG2 3.93Å; L100-V105 HydrophobicContact CD1-CG2 4.32Å; K101-V105 PolarHBondContact O-N 2.68Å; E102-V105 PolarHBondContact O-N 2.61Å; V105-R107 PolarHBondContact O-N 3.19Å; V105-M108 PolarHBondContact O-N 2.93Å; V105-L109 HydrophobicContact CG1-CD1 4.21Å; V105-L109 WeakPolarHBondContact O-CG 3.19Å; V105-L109 PolarHBondContact O-N 3.07Å |
| 106 | G | 81.5 | Confident | 74.7 | Confident | 38 Ų | 38 | 124.6 Ų | 124.6 | 39% | 0.392 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -61.1 | -42.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113 | E102 E103 D104 L109 A110 | E102-G106 PolarHBondContact O-N 2.78Å; E103-G106 PolarHBondContact O-N 3.16Å; D104-G106 VanDerWaalsContact C-N 3.33Å; G106-L109 PolarHBondContact O-N 3.38Å; G106-A110 WeakPolarHBondContact O-CB 3.49Å; G106-A110 PolarHBondContact O-N 2.87Å |
| 107 | R | 86.1 | Confident | 75.9 | Confident | 122 Ų | 122 | 123.4 Ų | 123.4 | 46% | 0.46 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -63.4 | -41.5 | 174.2 | -79.6 | -170.5 | -90.6 | -99.2 | -0.8 | 112.5 | E103 D104 V105 A110 Q111 | E103-R107 VanDerWaalsContact CD-CZ 3.44Å; E103-R107 WeakPolarHBondContact O-CG 3.41Å; E103-R107 PolarHBondContact O-N 2.9Å; E103-R107 IonicContact OE1-CZ 3.08Å; E103-R107 IonicContact OE1-NH1 2.68Å; E103-R107 PolarHBondContact OE1-NH1 3.08Å; E103-R107 IonicContact OE1-NH2 2.89Å; E103-R107 PolarHBondContact OE1-NH2 3.17Å; E103-R107 IonicContact OE2-CZ 3.39Å; E103-R107 IonicContact OE2-NH1 3.83Å; E103-R107 IonicContact OE2-NH2 3.84Å; E103-R107 PolarHBondContact OE2-NH2 2.96Å; E103-R107 VanDerWaalsContact OE2-NH2 3.08Å; D104-R107 PolarHBondContact O-N 2.75Å; D104-R107 IonicContact OD1-CZ 3.4Å; D104-R107 IonicContact OD1-NE 3.15Å; D104-R107 PolarHBondContact OD1-NE 2.62Å; D104-R107 VanDerWaalsContact OD1-NE 3.15Å; D104-R107 IonicContact OD1-NH2 3.46Å; D104-R107 PolarHBondContact OD1-NH2 3.01Å; V105-R107 PolarHBondContact O-N 3.19Å; R107-A110 PolarHBondContact O-N 3.13Å; R107-Q111 PolarHBondContact O-N 3.28Å; R107-Q111 VanDerWaalsContact O-N 3.08Å |
| 108 | M | 86.6 | Confident | 76.5 | Confident | 99 Ų | 99 | 125 Ų | 125 | 49% | 0.488 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64 | -45.5 | 178.3 | -167.6 | -174.1 | -46.5 | 0 | 0 | 111.3 | D104 V105 A110 Q111 M112 | D104-M108 WeakPolarHBondContact O-CB 3.27Å; D104-M108 PolarHBondContact O-N 2.94Å; V105-M108 PolarHBondContact O-N 2.93Å; M108-A110 VanDerWaalsContact C-N 3.34Å; M108-A110 PolarHBondContact O-N 3.12Å; M108-Q111 PolarHBondContact O-N 3.26Å; M108-M112 PolarHBondContact O-N 2.81Å |
| 109 | L | 84 | Confident | 77.7 | Confident | 112 Ų | 112 | 123.9 Ų | 123.9 | 59% | 0.586 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -61.8 | -40.6 | 175.3 | -72.3 | 171.9 | 0 | 0 | 0 | 112.2 | V105 G106 Q111 M112 S113 | V105-L109 HydrophobicContact CG1-CD1 4.21Å; V105-L109 WeakPolarHBondContact O-CG 3.19Å; V105-L109 PolarHBondContact O-N 3.07Å; G106-L109 PolarHBondContact O-N 3.38Å; L109-Q111 VanDerWaalsContact C-N 3.28Å; L109-Q111 PolarHBondContact O-N 3.22Å; L109-M112 PolarHBondContact O-N 3.36Å; L109-S113 PolarHBondContact O-N 2.94Å |
| 110 | A | 85.8 | Confident | 78.3 | Confident | 62 Ų | 62 | 120 Ų | 120 | 51% | 0.512 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.6 | -25.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | G106 R107 M108 S113 | G106-A110 WeakPolarHBondContact O-CB 3.49Å; G106-A110 PolarHBondContact O-N 2.87Å; R107-A110 PolarHBondContact O-N 3.13Å; M108-A110 VanDerWaalsContact C-N 3.34Å; M108-A110 PolarHBondContact O-N 3.12Å; A110-S113 PolarHBondContact O-OG 3.26Å |
| 111 | Q | 81.1 | Confident | 79 | Confident | 154 Ų | 154 | 122 Ų | 122 | 72% | 0.72 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -76.8 | -31.4 | 172.3 | -75.7 | -172.7 | -14.8 | 0 | 0 | 112.6 | R107 M108 L109 | R107-Q111 PolarHBondContact O-N 3.28Å; R107-Q111 VanDerWaalsContact O-N 3.08Å; M108-Q111 PolarHBondContact O-N 3.26Å; L109-Q111 VanDerWaalsContact C-N 3.28Å; L109-Q111 PolarHBondContact O-N 3.22Å |
| 112 | M | 79.4 | Confident | 79.2 | Confident | 150 Ų | 150 | 119.5 Ų | 119.5 | 74% | 0.739 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -76.7 | -20.4 | 178.8 | -67.6 | -175.5 | 71.1 | 0 | 0 | 113.7 | M108 L109 R114 | M108-M112 PolarHBondContact O-N 2.81Å; L109-M112 PolarHBondContact O-N 3.36Å; M112-R114 VanDerWaalsContact C-N 3.26Å; M112-R114 PolarHBondContact O-N 2.81Å |
| 113 | S | 69.1 | Low | 79.7 | Confident | 101 Ų | 101 | 114.8 Ų | 114.8 | 71% | 0.706 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | 9.1 | 176.5 | 62.8 | 0 | 0 | 0 | 0 | 114 | L109 A110 | L109-S113 PolarHBondContact O-N 2.94Å; A110-S113 PolarHBondContact O-OG 3.26Å |
| 114 | R | 59.7 | Low | 79.8 | Confident | 288 Ų | 288 | 114.2 Ų | 114.2 | 100% | 1.087 | 58% | 0.584 | S | S | * | * | trans | -95 | 0 | 175.3 | -134.3 | -171 | -152.4 | -153.9 | 6.1 | 111.5 | M112 | M112-R114 VanDerWaalsContact C-N 3.26Å; M112-R114 PolarHBondContact O-N 2.81Å |
Retrieved 114 of 114 residues in 37.8 ms
(Link to these results)