| 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 | 59.5 | Low | 62.9 | Low | 249 Ų | 249 | 143.4 Ų | 143.4 | 100% | 1.227 | 84% | 0.84 | S | S | * | * | 0 | 97.3 | 0 | -69.6 | -179.7 | 177.8 | 0 | 0 | 106.8 | |||||
| 2 | E | 54 | Low | 63.3 | Low | 203 Ų | 203 | 144.3 Ų | 144.3 | 95% | 0.949 | 84% | 0.836 | S | S | * | * | trans | -78.2 | 132.4 | -175.4 | -69.9 | -150 | 106 | 0 | 0 | 111.4 | ||||
| 3 | R | 63.9 | Low | 63.4 | Low | 254 Ų | 254 | 143.9 Ų | 143.9 | 96% | 0.958 | 83% | 0.829 | S | S | * | * | trans | -109.9 | 101.4 | 171.6 | -137.9 | 176.9 | -157.7 | -141.2 | 3.9 | 106.4 | ||||
| 4 | G | 69.7 | Low | 63.5 | Low | 60 Ų | 60 | 145.2 Ų | 145.2 | 62% | 0.619 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 159.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 5 | P | 66.4 | Low | 63 | Low | 139 Ų | 139 | 142.1 Ų | 142.1 | 90% | 0.903 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 134.3 | -172.5 | -7.7 | 25.1 | 0 | 0 | 0 | 111.6 | ||
| 6 | T | 65.6 | Low | 62.7 | Low | 136 Ų | 136 | 142.5 Ų | 142.5 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 131.5 | -177.9 | 45.5 | 0 | 0 | 0 | 0 | 113 | G8 | T6-G8 PolarHBondContact O-N 2.84Š|
| 7 | T | 63.1 | Low | 62.5 | Low | 139 Ų | 139 | 145.6 Ų | 145.6 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -7 | 110.5 | 159.9 | -44.7 | 0 | 0 | 0 | 0 | 115.3 | S9 | T7-S9 PolarHBondContact O-N 2.93Š| ||
| 8 | G | 59.2 | Low | 62.1 | Low | 72 Ų | 72 | 146 Ų | 146 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | trans | -57.9 | 117.1 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | T6 C10 | T6-G8 PolarHBondContact O-N 2.84Å; G8-C10 PolarHBondContact O-N 3.15Å; G8-C10 VanDerWaalsContact O-N 3.15Å | ||
| 9 | S | 64.5 | Low | 62 | Low | 109 Ų | 109 | 146 Ų | 146 | 76% | 0.762 | 80% | 0.802 | S | S | * | * | trans | -67.8 | 104.9 | 169.3 | -175.3 | 0 | 0 | 0 | 0 | 108.5 | T7 T11 | T7-S9 PolarHBondContact O-N 2.93Å; S9-T11 PolarHBondContact O-N 3.16Å; S9-T11 VanDerWaalsContact O-N 3.16Å | ||
| 10 | C | 63.8 | Low | 62.1 | Low | 112 Ų | 112 | 150.2 Ų | 150.2 | 76% | 0.757 | 81% | 0.805 | S | S | * | * | trans | -76.6 | 99.4 | 174.4 | -163.5 | 0 | 0 | 0 | 0 | 108.3 | G8 I12 | G8-C10 PolarHBondContact O-N 3.15Å; G8-C10 VanDerWaalsContact O-N 3.15Å; C10-I12 PolarHBondContact O-N 3.42Å | ||
| 11 | T | 62 | Low | 62.3 | Low | 104 Ų | 104 | 149.6 Ų | 149.6 | 64% | 0.638 | 80% | 0.796 | S | S | * | * | trans | -71.7 | 96.4 | 170.4 | 40.8 | 0 | 0 | 0 | 0 | 108.7 | S9 N13 | S9-T11 PolarHBondContact O-N 3.16Å; S9-T11 VanDerWaalsContact O-N 3.16Å; T11-N13 VanDerWaalsContact C-N 3.3Å; T11-N13 PolarHBondContact O-N 3.2Å | ||
| 12 | I | 67.8 | Low | 63.2 | Low | 155 Ų | 155 | 141.2 Ų | 141.2 | 80% | 0.795 | 76% | 0.756 | S | S | * | * | trans | -70.3 | 94.2 | 169.7 | -57.2 | 174.9 | 0 | 0 | 0 | 106.5 | C10 H14 | C10-I12 PolarHBondContact O-N 3.42Å; I12-H14 PolarHBondContact O-N 2.77Å | ||
| 13 | N | 64.6 | Low | 64.8 | Low | 139 Ų | 139 | 135.5 Ų | 135.5 | 74% | 0.743 | 74% | 0.736 | S | S | * | * | trans | -59 | 105.6 | 169.5 | -68.5 | -46.6 | 0 | 0 | 0 | 107.7 | T11 S15 | T11-N13 VanDerWaalsContact C-N 3.3Å; T11-N13 PolarHBondContact O-N 3.2Å; N13-S15 PolarHBondContact O-N 3.32Å | ||
| 14 | H | 64.8 | Low | 65.9 | Low | 162 Ų | 162 | 127.5 Ų | 127.5 | 75% | 0.75 | 72% | 0.716 | S | S | * | * | trans | -67.3 | 81.8 | 167.8 | -176.3 | 68 | 0 | 0 | 0 | 107.3 | I12 Q16 | I12-H14 PolarHBondContact O-N 2.77Å; H14-Q16 VanDerWaalsContact C-N 3.29Å; H14-Q16 PolarHBondContact O-N 2.94Å | ||
| 15 | S | 56.4 | Low | 66.8 | Low | 99 Ų | 99 | 129.1 Ų | 129.1 | 69% | 0.692 | 71% | 0.709 | S | S | * | * | trans | -62.5 | 100.4 | 167.2 | 61.4 | 0 | 0 | 0 | 0 | 106.5 | N13 K17 | N13-S15 PolarHBondContact O-N 3.32Å; S15-K17 PolarHBondContact O-N 3.4Å | ||
| 16 | Q | 58.4 | Low | 67.9 | Low | 148 Ų | 148 | 126.8 Ų | 126.8 | 69% | 0.692 | 69% | 0.686 | S | S | * | * | trans | -67 | 75.2 | 163.4 | -140.5 | -149.7 | 81.4 | 0 | 0 | 105.3 | H14 E18 | H14-Q16 VanDerWaalsContact C-N 3.29Å; H14-Q16 PolarHBondContact O-N 2.94Å; Q16-E18 PolarHBondContact O-N 3.39Å | ||
| 17 | K | 57.9 | Low | 69.1 | Low | 195 Ų | 195 | 129 Ų | 129 | 85% | 0.848 | 68% | 0.679 | S | S | * | * | trans | -65.6 | 98.1 | 167.7 | -149.4 | -179.3 | -170.2 | -175.7 | 0 | 102.9 | S15 L19 | S15-K17 PolarHBondContact O-N 3.4Å; K17-L19 PolarHBondContact O-N 3.15Å; K17-L19 VanDerWaalsContact O-N 3.17Å | ||
| 18 | E | 56.3 | Low | 70.6 | Confident | 153 Ų | 153 | 127.3 Ų | 127.3 | 72% | 0.715 | 66% | 0.664 | S | S | * | * | trans | -6.7 | 109.2 | 171.5 | -90.5 | -74.3 | 131.8 | 0 | 0 | 110.4 | Q16 R20 | Q16-E18 PolarHBondContact O-N 3.39Å; E18-R20 PolarHBondContact O-N 2.94Å | ||
| 19 | L | 60.6 | Low | 72.3 | Confident | 146 Ų | 146 | 128 Ų | 128 | 76% | 0.764 | 65% | 0.65 | S | S | * | * | trans | -66.1 | 65.1 | 177.6 | -165.9 | 119.9 | 0 | 0 | 0 | 108.2 | K17 K21 | K17-L19 PolarHBondContact O-N 3.15Å; K17-L19 VanDerWaalsContact O-N 3.17Å; L19-K21 VanDerWaalsContact C-N 3.26Å; L19-K21 HydrophobicContact CD2-CG 4.35Å; L19-K21 PolarHBondContact O-N 3Å | ||
| 20 | R | 62.9 | Low | 73.8 | Confident | 229 Ų | 229 | 129.3 Ų | 129.3 | 86% | 0.864 | 64% | 0.644 | S | S | * | * | trans | -57.6 | 103.6 | 162.1 | -95 | -168.9 | 175.5 | -165.7 | -0.4 | 103.4 | E18 D22 | E18-R20 PolarHBondContact O-N 2.94Å; R20-D22 VanDerWaalsContact C-N 3.31Å; R20-D22 PolarHBondContact O-N 2.86Å | ||
| 21 | K | 67.4 | Low | 75.3 | Confident | 139 Ų | 139 | 127.5 Ų | 127.5 | 60% | 0.604 | 63% | 0.633 | S | S | * | * | trans | -53.5 | 105.2 | 176.3 | -55.6 | -178.1 | -172.9 | 175.6 | 0 | 105.4 | L19 P23 E26 | L19-K21 VanDerWaalsContact C-N 3.26Å; L19-K21 HydrophobicContact CD2-CG 4.35Å; L19-K21 PolarHBondContact O-N 3Å; K21-P23 WeakPolarHBondContact O-CD 3.49Å; K21-P23 VanDerWaalsContact O-N 3.12Å; K21-E26 HydrophobicContact CB-CG 3.85Å; K21-E26 VanDerWaalsContact CB-OE1 3.22Å; K21-E26 WeakPolarHBondContact CB-OE1 3.44Å; K21-E26 WeakPolarHBondContact CD-OE1 3.46Å | ||
| 22 | D | 78.6 | Confident | 76.9 | Confident | 72 Ų | 72 | 126.8 Ų | 126.8 | 39% | 0.385 | 63% | 0.628 | S | S | . | * | trans | -60 | 121.1 | -179.5 | -179.2 | -35.2 | 0 | 0 | 0 | 105.4 | R20 V24 I25 E26 | R20-D22 VanDerWaalsContact C-N 3.31Å; R20-D22 PolarHBondContact O-N 2.86Å; D22-V24 PolarHBondContact O-N 2.81Å; D22-V24 WeakPolarHBondContact OD1-CA 3.2Å; D22-V24 WeakPolarHBondContact OD1-CB 3.25Å; D22-V24 WeakPolarHBondContact OD1-CG2 3.27Å; D22-V24 PolarHBondContact OD1-N 3.04Å; D22-I25 HydrophobicContact CB-CB 4.04Å; D22-I25 HydrophobicContact CB-CD1 3.68Å; D22-I25 HydrophobicContact CB-CG1 3.72Å; D22-I25 WeakPolarHBondContact O-CA 3.26Å; D22-I25 WeakPolarHBondContact O-CB 3.41Å; D22-I25 PolarHBondContact O-N 2.86Å; D22-E26 PolarHBondContact O-N 3.17Å | ||
| 23 | P | 86.8 | Confident | 78.3 | Confident | 83 Ų | 83 | 126.4 Ų | 126.4 | 54% | 0.539 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -58.1 | -24.8 | -175.9 | 24.2 | -34.8 | 0 | 0 | 0 | 111.8 | K21 R27 | K21-P23 WeakPolarHBondContact O-CD 3.49Å; K21-P23 VanDerWaalsContact O-N 3.12Å; P23-R27 WeakPolarHBondContact O-CB 2.86Å; P23-R27 VanDerWaalsContact O-CG 3.25Å; P23-R27 WeakPolarHBondContact O-CG 3.22Å; P23-R27 PolarHBondContact O-N 2.77Å; P23-R27 VanDerWaalsContact O-N 3.15Å |
| 24 | V | 86.8 | Confident | 79.7 | Confident | 87 Ų | 87 | 123.4 Ų | 123.4 | 53% | 0.527 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -70.7 | -43.6 | 173.5 | -175.2 | 0 | 0 | 0 | 0 | 110.6 | D22 R27 L28 | D22-V24 PolarHBondContact O-N 2.81Å; D22-V24 WeakPolarHBondContact OD1-CA 3.2Å; D22-V24 WeakPolarHBondContact OD1-CB 3.25Å; D22-V24 WeakPolarHBondContact OD1-CG2 3.27Å; D22-V24 PolarHBondContact OD1-N 3.04Å; V24-R27 PolarHBondContact O-N 2.88Å; V24-L28 HydrophobicContact CG1-CD1 4.09Å; V24-L28 HydrophobicContact CG1-CG 4.49Å; V24-L28 WeakPolarHBondContact O-CB 3.44Å; V24-L28 VanDerWaalsContact O-CG 3.26Å; V24-L28 WeakPolarHBondContact O-CG 3.44Å; V24-L28 PolarHBondContact O-N 2.78Å |
| 25 | I | 88.5 | Confident | 81.3 | Confident | 93 Ų | 93 | 121.1 Ų | 121.1 | 48% | 0.477 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.9 | -42.5 | 177.7 | -63.1 | 177.2 | 0 | 0 | 0 | 110.4 | D22 L28 I29 | D22-I25 HydrophobicContact CB-CB 4.04Å; D22-I25 HydrophobicContact CB-CD1 3.68Å; D22-I25 HydrophobicContact CB-CG1 3.72Å; D22-I25 WeakPolarHBondContact O-CA 3.26Å; D22-I25 WeakPolarHBondContact O-CB 3.41Å; D22-I25 PolarHBondContact O-N 2.86Å; I25-L28 PolarHBondContact O-N 2.93Å; I25-I29 HydrophobicContact CG2-CD1 3.8Å; I25-I29 HydrophobicContact CG2-CG1 4.39Å; I25-I29 VanDerWaalsContact O-CG1 3.27Å; I25-I29 WeakPolarHBondContact O-CG1 3.44Å; I25-I29 PolarHBondContact O-N 2.64Å |
| 26 | E | 90.2 | Very high | 83.1 | Confident | 90 Ų | 90 | 120.3 Ų | 120.3 | 42% | 0.421 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -61.7 | -46.6 | 176.8 | -68.9 | -166.5 | 143.7 | 0 | 0 | 112.2 | K21 D22 L28 I29 E30 | K21-E26 HydrophobicContact CB-CG 3.85Å; K21-E26 VanDerWaalsContact CB-OE1 3.22Å; K21-E26 WeakPolarHBondContact CB-OE1 3.44Å; K21-E26 WeakPolarHBondContact CD-OE1 3.46Å; D22-E26 PolarHBondContact O-N 3.17Å; E26-L28 VanDerWaalsContact C-N 3.3Å; E26-L28 PolarHBondContact O-N 3.07Å; E26-I29 PolarHBondContact O-N 2.85Å; E26-E30 WeakPolarHBondContact O-CB 3.5Å; E26-E30 PolarHBondContact O-N 3.3Å |
| 27 | R | 91.2 | Very high | 84.8 | Confident | 182 Ų | 182 | 119.1 Ų | 119.1 | 69% | 0.687 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -61.3 | -38.6 | 176.8 | -76.6 | 177.7 | 178.9 | -141.9 | 0.7 | 112.5 | P23 V24 E30 S31 | P23-R27 WeakPolarHBondContact O-CB 2.86Å; P23-R27 VanDerWaalsContact O-CG 3.25Å; P23-R27 WeakPolarHBondContact O-CG 3.22Å; P23-R27 PolarHBondContact O-N 2.77Å; P23-R27 VanDerWaalsContact O-N 3.15Å; V24-R27 PolarHBondContact O-N 2.88Å; R27-E30 PolarHBondContact O-N 2.93Å; R27-S31 WeakPolarHBondContact O-CB 3.33Å; R27-S31 PolarHBondContact O-N 2.92Å; R27-S31 PolarHBondContact O-OG 3.23Å |
| 28 | L | 94.8 | Very high | 86.5 | Confident | 104 Ų | 104 | 112.4 Ų | 112.4 | 55% | 0.545 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66 | -44.5 | 176.1 | -74.8 | 171 | 0 | 0 | 0 | 111.2 | V24 I25 E26 E30 S31 V32 | V24-L28 HydrophobicContact CG1-CD1 4.09Å; V24-L28 HydrophobicContact CG1-CG 4.49Å; V24-L28 WeakPolarHBondContact O-CB 3.44Å; V24-L28 VanDerWaalsContact O-CG 3.26Å; V24-L28 WeakPolarHBondContact O-CG 3.44Å; V24-L28 PolarHBondContact O-N 2.78Å; I25-L28 PolarHBondContact O-N 2.93Å; E26-L28 VanDerWaalsContact C-N 3.3Å; E26-L28 PolarHBondContact O-N 3.07Å; L28-E30 VanDerWaalsContact C-N 3.32Å; L28-E30 PolarHBondContact O-N 2.91Å; L28-S31 PolarHBondContact O-N 3.45Å; L28-V32 WeakPolarHBondContact O-CG2 3.33Å; L28-V32 PolarHBondContact O-N 2.94Å |
| 29 | I | 94.1 | Very high | 88.2 | Confident | 86 Ų | 86 | 107.7 Ų | 107.7 | 44% | 0.441 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.7 | -43.7 | 176.3 | -69.4 | 167.2 | 0 | 0 | 0 | 110.6 | I25 E26 V32 K33 | I25-I29 HydrophobicContact CG2-CD1 3.8Å; I25-I29 HydrophobicContact CG2-CG1 4.39Å; I25-I29 VanDerWaalsContact O-CG1 3.27Å; I25-I29 WeakPolarHBondContact O-CG1 3.44Å; I25-I29 PolarHBondContact O-N 2.64Å; E26-I29 PolarHBondContact O-N 2.85Å; I29-V32 PolarHBondContact O-N 3.46Å; I29-K33 HydrophobicContact CG2-CD 4.21Å; I29-K33 WeakPolarHBondContact O-CB 3.35Å; I29-K33 WeakPolarHBondContact O-CG 3.37Å; I29-K33 PolarHBondContact O-N 2.94Å |
| 30 | E | 94.8 | Very high | 89.6 | Confident | 137 Ų | 137 | 104.2 Ų | 104.2 | 64% | 0.64 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.3 | -44 | 177.2 | -171.7 | 175.1 | -163.1 | 0 | 0 | 111.9 | E26 R27 L28 V32 K33 S34 | E26-E30 WeakPolarHBondContact O-CB 3.5Å; E26-E30 PolarHBondContact O-N 3.3Å; R27-E30 PolarHBondContact O-N 2.93Å; L28-E30 VanDerWaalsContact C-N 3.32Å; L28-E30 PolarHBondContact O-N 2.91Å; E30-V32 PolarHBondContact O-N 3.26Å; E30-K33 PolarHBondContact O-N 3.46Å; E30-S34 WeakPolarHBondContact O-CB 3.49Å; E30-S34 PolarHBondContact O-N 3.48Å |
| 31 | S | 95.4 | Very high | 90.7 | Very high | 75 Ų | 75 | 101.6 Ų | 101.6 | 52% | 0.524 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.6 | -43.3 | 177.1 | -59.2 | 0 | 0 | 0 | 0 | 112 | R27 L28 S34 L35 | R27-S31 WeakPolarHBondContact O-CB 3.33Å; R27-S31 PolarHBondContact O-N 2.92Å; R27-S31 PolarHBondContact O-OG 3.23Å; L28-S31 PolarHBondContact O-N 3.45Å; S31-S34 PolarHBondContact O-N 2.99Å; S31-L35 WeakPolarHBondContact O-CB 3.49Å; S31-L35 PolarHBondContact O-N 3.45Å |
| 32 | V | 96.4 | Very high | 91.6 | Very high | 89 Ų | 89 | 101.3 Ų | 101.3 | 54% | 0.539 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.3 | -38.9 | 177.2 | 171.3 | 0 | 0 | 0 | 0 | 111.3 | L28 I29 E30 L35 T36 | L28-V32 WeakPolarHBondContact O-CG2 3.33Å; L28-V32 PolarHBondContact O-N 2.94Å; I29-V32 PolarHBondContact O-N 3.46Å; E30-V32 PolarHBondContact O-N 3.26Å; V32-L35 PolarHBondContact O-N 3.45Å; V32-T36 WeakPolarHBondContact O-CB 3.5Å; V32-T36 PolarHBondContact O-N 2.99Å; V32-T36 PolarHBondContact O-OG1 3.25Å |
| 33 | K | 97 | Very high | 91.9 | Very high | 147 Ų | 147 | 104.1 Ų | 104.1 | 64% | 0.639 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.4 | -48.4 | 175.2 | -77.2 | 177 | 179 | -179.6 | 0 | 111.6 | I29 E30 L35 T36 E37 | I29-K33 HydrophobicContact CG2-CD 4.21Å; I29-K33 WeakPolarHBondContact O-CB 3.35Å; I29-K33 WeakPolarHBondContact O-CG 3.37Å; I29-K33 PolarHBondContact O-N 2.94Å; E30-K33 PolarHBondContact O-N 3.46Å; K33-L35 VanDerWaalsContact C-N 3.33Å; K33-L35 PolarHBondContact O-N 3.38Å; K33-T36 PolarHBondContact O-N 2.98Å; K33-E37 PolarHBondContact O-N 3.29Å |
| 34 | S | 95.1 | Very high | 91.4 | Very high | 76 Ų | 76 | 104.2 Ų | 104.2 | 53% | 0.531 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.3 | -42.9 | 177.5 | -176.7 | 0 | 0 | 0 | 0 | 111.8 | E30 S31 E37 A38 | E30-S34 WeakPolarHBondContact O-CB 3.49Å; E30-S34 PolarHBondContact O-N 3.48Å; S31-S34 PolarHBondContact O-N 2.99Å; S34-E37 PolarHBondContact O-N 3.49Å; S34-A38 WeakPolarHBondContact O-CB 3.33Å; S34-A38 PolarHBondContact O-N 3.29Å |
| 35 | L | 96.9 | Very high | 90.4 | Very high | 114 Ų | 114 | 102.6 Ų | 102.6 | 60% | 0.597 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.9 | -44 | 176.3 | -179.6 | 61.4 | 0 | 0 | 0 | 111.9 | S31 V32 K33 E37 A38 V39 | S31-L35 WeakPolarHBondContact O-CB 3.49Å; S31-L35 PolarHBondContact O-N 3.45Å; V32-L35 PolarHBondContact O-N 3.45Å; K33-L35 VanDerWaalsContact C-N 3.33Å; K33-L35 PolarHBondContact O-N 3.38Å; L35-E37 VanDerWaalsContact C-N 3.34Å; L35-E37 PolarHBondContact O-N 3.4Å; L35-A38 PolarHBondContact O-N 2.97Å; L35-V39 HydrophobicContact CD1-CG2 4.46Å; L35-V39 WeakPolarHBondContact O-CG2 3.34Å; L35-V39 PolarHBondContact O-N 3.47Å |
| 36 | T | 95.9 | Very high | 89 | Confident | 81 Ų | 81 | 105.8 Ų | 105.8 | 50% | 0.497 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.8 | -43.9 | 178.8 | -56.8 | 0 | 0 | 0 | 0 | 110.9 | V32 K33 V39 T40 | V32-T36 WeakPolarHBondContact O-CB 3.5Å; V32-T36 PolarHBondContact O-N 2.99Å; V32-T36 PolarHBondContact O-OG1 3.25Å; K33-T36 PolarHBondContact O-N 2.98Å; T36-V39 PolarHBondContact O-N 2.94Å; T36-T40 PolarHBondContact O-N 3.46Å; T36-T40 PolarHBondContact O-OG1 3.22Å; T36-T40 VanDerWaalsContact O-OG1 3.07Å |
| 37 | E | 94.2 | Very high | 87.6 | Confident | 124 Ų | 124 | 112 Ų | 112 | 58% | 0.579 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61.8 | -44.7 | 176.1 | -171.6 | -177.5 | 169.9 | 0 | 0 | 111.9 | K33 S34 L35 V39 T40 R41 | K33-E37 PolarHBondContact O-N 3.29Å; S34-E37 PolarHBondContact O-N 3.49Å; L35-E37 VanDerWaalsContact C-N 3.34Å; L35-E37 PolarHBondContact O-N 3.4Å; E37-V39 VanDerWaalsContact C-N 3.31Å; E37-V39 PolarHBondContact O-N 2.75Å; E37-T40 PolarHBondContact O-N 3.36Å; E37-R41 WeakPolarHBondContact O-CG 3.48Å; E37-R41 PolarHBondContact O-N 2.96Å |
| 38 | A | 92.7 | Very high | 86.1 | Confident | 54 Ų | 54 | 109.3 Ų | 109.3 | 45% | 0.446 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -59.5 | -42.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | S34 L35 R41 M42 | S34-A38 WeakPolarHBondContact O-CB 3.33Å; S34-A38 PolarHBondContact O-N 3.29Å; L35-A38 PolarHBondContact O-N 2.97Å; A38-R41 PolarHBondContact O-N 3.19Å; A38-M42 WeakPolarHBondContact O-CB 3.39Å; A38-M42 PolarHBondContact O-N 2.9Å |
| 39 | V | 92.2 | Very high | 84 | Confident | 53 Ų | 53 | 115.2 Ų | 115.2 | 32% | 0.321 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.7 | -44.2 | 176.2 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | L35 T36 E37 R41 M42 Q43 | L35-V39 HydrophobicContact CD1-CG2 4.46Å; L35-V39 WeakPolarHBondContact O-CG2 3.34Å; L35-V39 PolarHBondContact O-N 3.47Å; T36-V39 PolarHBondContact O-N 2.94Å; E37-V39 VanDerWaalsContact C-N 3.31Å; E37-V39 PolarHBondContact O-N 2.75Å; V39-R41 PolarHBondContact O-N 2.84Å; V39-M42 PolarHBondContact O-N 2.77Å; V39-Q43 WeakPolarHBondContact O-CG 3.41Å; V39-Q43 PolarHBondContact O-N 3.23Å |
| 40 | T | 90.4 | Very high | 82.3 | Confident | 74 Ų | 74 | 115.7 Ų | 115.7 | 45% | 0.454 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -62 | -42.1 | 176.5 | -57.4 | 0 | 0 | 0 | 0 | 111.9 | T36 E37 M42 Q43 T44 | T36-T40 PolarHBondContact O-N 3.46Å; T36-T40 PolarHBondContact O-OG1 3.22Å; T36-T40 VanDerWaalsContact O-OG1 3.07Å; E37-T40 PolarHBondContact O-N 3.36Å; T40-M42 VanDerWaalsContact C-N 3.33Å; T40-M42 PolarHBondContact O-N 3Å; T40-Q43 PolarHBondContact O-N 2.94Å; T40-T44 WeakPolarHBondContact O-CG2 3.44Å; T40-T44 PolarHBondContact O-N 2.96Å; T40-T44 PolarHBondContact O-OG1 3.48Å |
| 41 | R | 86.4 | Confident | 80.4 | Confident | 173 Ų | 173 | 120.4 Ų | 120.4 | 65% | 0.653 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -63.3 | -38.6 | 174.9 | -69.5 | -178.6 | 82.4 | -98.9 | 0.4 | 112.1 | E37 A38 V39 T44 G45 | E37-R41 WeakPolarHBondContact O-CG 3.48Å; E37-R41 PolarHBondContact O-N 2.96Å; A38-R41 PolarHBondContact O-N 3.19Å; V39-R41 PolarHBondContact O-N 2.84Å; R41-T44 WeakPolarHBondContact CA-OG1 3.49Å; R41-T44 PolarHBondContact O-OG1 3.47Å; R41-G45 WeakPolarHBondContact O-CA 3.41Å; R41-G45 PolarHBondContact O-N 3.41Å |
| 42 | M | 85.6 | Confident | 78.8 | Confident | 134 Ų | 134 | 121.7 Ų | 121.7 | 66% | 0.66 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -66 | -42.7 | 176.4 | -173.4 | 173.3 | 63.4 | 0 | 0 | 111.9 | A38 V39 T40 H46 | A38-M42 WeakPolarHBondContact O-CB 3.39Å; A38-M42 PolarHBondContact O-N 2.9Å; V39-M42 PolarHBondContact O-N 2.77Å; T40-M42 VanDerWaalsContact C-N 3.33Å; T40-M42 PolarHBondContact O-N 3Å; M42-H46 PolarHBondContact O-N 3.07Å |
| 43 | Q | 84.1 | Confident | 77.1 | Confident | 131 Ų | 131 | 123 Ų | 123 | 61% | 0.612 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -66.9 | -38.3 | 178.3 | -71.6 | -179.4 | 6.8 | 0 | 0 | 112.6 | V39 T40 | V39-Q43 WeakPolarHBondContact O-CG 3.41Å; V39-Q43 PolarHBondContact O-N 3.23Å; T40-Q43 PolarHBondContact O-N 2.94Å |
| 44 | T | 76 | Confident | 75.6 | Confident | 84 Ų | 84 | 123.4 Ų | 123.4 | 52% | 0.515 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -78.6 | -34.8 | 178.6 | 48.6 | 0 | 0 | 0 | 0 | 112.6 | T40 R41 H46 R47 | T40-T44 WeakPolarHBondContact O-CG2 3.44Å; T40-T44 PolarHBondContact O-N 2.96Å; T40-T44 PolarHBondContact O-OG1 3.48Å; R41-T44 WeakPolarHBondContact CA-OG1 3.49Å; R41-T44 PolarHBondContact O-OG1 3.47Å; T44-H46 PolarHBondContact O-N 3.27Å; T44-R47 PolarHBondContact O-N 3.28Å |
| 45 | G | 65.7 | Low | 74.1 | Confident | 53 Ų | 53 | 130 Ų | 130 | 55% | 0.546 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -65.3 | -23.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | R41 R47 | R41-G45 WeakPolarHBondContact O-CA 3.41Å; R41-G45 PolarHBondContact O-N 3.41Å; G45-R47 VanDerWaalsContact C-N 3.34Å |
| 46 | H | 60.7 | Low | 72.6 | Confident | 160 Ų | 160 | 130 Ų | 130 | 74% | 0.741 | 65% | 0.652 | S | S | * | * | G | 310 helix | trans | -82 | -10.1 | 180 | -148 | -64.1 | 0 | 0 | 0 | 113.9 | M42 T44 | M42-H46 PolarHBondContact O-N 3.07Å; T44-H46 PolarHBondContact O-N 3.27Å |
| 47 | R | 60.7 | Low | 71 | Confident | 220 Ų | 220 | 136.1 Ų | 136.1 | 83% | 0.83 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -85.5 | -12.2 | -179.8 | -72.3 | -171 | 169.3 | 168.8 | -1.2 | 114.2 | T44 G45 | T44-R47 PolarHBondContact O-N 3.28Å; G45-R47 VanDerWaalsContact C-N 3.34Å |
| 48 | N | 58.1 | Low | 69.4 | Low | 127 Ų | 127 | 135.4 Ų | 135.4 | 68% | 0.679 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -127.4 | 46 | -179 | -62.3 | -41.1 | 0 | 0 | 0 | 111.6 | S50 | N48-S50 PolarHBondContact O-N 2.87Å; N48-S50 PolarHBondContact O-OG 3.41Å |
| 49 | R | 51.8 | Low | 67.7 | Low | 228 Ų | 228 | 142.3 Ų | 142.3 | 86% | 0.86 | 70% | 0.695 | S | S | * | * | trans | -67.9 | 80.1 | 152.5 | -167 | 175.2 | -164.5 | 168.6 | 4.8 | 105.7 | R51 | R49-R51 VanDerWaalsContact C-N 3.26Å; R49-R51 PolarHBondContact O-N 2.73Å | ||
| 50 | S | 58.8 | Low | 66.1 | Low | 96 Ų | 96 | 142.7 Ų | 142.7 | 67% | 0.671 | 70% | 0.7 | S | S | * | * | trans | -46.4 | 99.4 | 171.8 | -57.7 | 0 | 0 | 0 | 0 | 105.2 | N48 S52 | N48-S50 PolarHBondContact O-N 2.87Å; N48-S50 PolarHBondContact O-OG 3.41Å; S50-S52 VanDerWaalsContact C-N 3.27Å; S50-S52 PolarHBondContact O-N 2.74Å | ||
| 51 | R | 53.9 | Low | 64.4 | Low | 236 Ų | 236 | 145.5 Ų | 145.5 | 89% | 0.891 | 71% | 0.708 | S | S | * | * | trans | -46.6 | 113.3 | 152.4 | -91.1 | 177.9 | 170.3 | 148.7 | -2 | 101.9 | R49 | R49-R51 VanDerWaalsContact C-N 3.26Å; R49-R51 PolarHBondContact O-N 2.73Å | ||
| 52 | S | 62.3 | Low | 62.9 | Low | 102 Ų | 102 | 143.3 Ų | 143.3 | 71% | 0.713 | 71% | 0.707 | S | S | * | * | trans | -37 | 121.6 | 167.8 | -96.3 | 0 | 0 | 0 | 0 | 104.7 | S50 Q54 | S50-S52 VanDerWaalsContact C-N 3.27Å; S50-S52 PolarHBondContact O-N 2.74Å; S52-Q54 WeakPolarHBondContact O-CA 3.49Å; S52-Q54 PolarHBondContact O-N 2.7Å | ||
| 53 | P | 61 | Low | 61.3 | Low | 117 Ų | 117 | 143 Ų | 143 | 76% | 0.76 | 70% | 0.702 | S | S | * | * | trans | -51.3 | 106.2 | 177.4 | -20.8 | 29.4 | 0 | 0 | 0 | 103.3 | R55 | P53-R55 WeakPolarHBondContact O-CA 3.42Å; P53-R55 PolarHBondContact O-N 2.64Å | ||
| 54 | Q | 65 | Low | 59.9 | Low | 154 Ų | 154 | 144.2 Ų | 144.2 | 72% | 0.72 | 71% | 0.707 | S | S | * | * | trans | -66.2 | 104.4 | -171.6 | -167.1 | 173 | 4.8 | 0 | 0 | 100.8 | S52 | S52-Q54 WeakPolarHBondContact O-CA 3.49Å; S52-Q54 PolarHBondContact O-N 2.7Å | ||
| 55 | R | 64 | Low | 58.8 | Low | 216 Ų | 216 | 147.4 Ų | 147.4 | 82% | 0.815 | 72% | 0.717 | S | S | * | * | trans | -37.7 | 121.6 | -164.9 | -169.6 | -176.5 | -165.2 | 175.8 | 4.6 | 105.9 | P53 R57 | P53-R55 WeakPolarHBondContact O-CA 3.42Å; P53-R55 PolarHBondContact O-N 2.64Å; R55-R57 VanDerWaalsContact C-N 3.33Å; R55-R57 PolarHBondContact O-N 2.72Å | ||
| 56 | P | 64.4 | Low | 58 | Low | 112 Ų | 112 | 151.4 Ų | 151.4 | 73% | 0.727 | 72% | 0.719 | S | S | * | * | trans | -51.1 | 111.3 | -175.7 | 18.6 | -28.9 | 0 | 0 | 0 | 104.7 | S58 | P56-S58 PolarHBondContact O-N 2.8Š| ||
| 57 | R | 62.9 | Low | 57.8 | Low | 211 Ų | 211 | 146 Ų | 146 | 80% | 0.796 | 71% | 0.706 | S | S | * | * | trans | -57.4 | 116.1 | -174.7 | -85.3 | -172.1 | 169.7 | 107.4 | -4.8 | 103.4 | R55 K59 | R55-R57 VanDerWaalsContact C-N 3.33Å; R55-R57 PolarHBondContact O-N 2.72Å; R57-K59 PolarHBondContact O-N 2.89Å | ||
| 58 | S | 59.9 | Low | 57.8 | Low | 109 Ų | 109 | 144 Ų | 144 | 76% | 0.762 | 70% | 0.699 | S | S | * | * | trans | -47.7 | 115.7 | 171.9 | -52.7 | 0 | 0 | 0 | 0 | 104.9 | P56 S60 | P56-S58 PolarHBondContact O-N 2.8Å; S58-S60 VanDerWaalsContact C-N 3.3Å; S58-S60 PolarHBondContact O-N 2.86Å | ||
| 59 | K | 57.5 | Low | 58 | Low | 198 Ų | 198 | 143.1 Ų | 143.1 | 86% | 0.861 | 69% | 0.689 | S | S | * | * | trans | -54 | 108.5 | 170.2 | -83.5 | -179.6 | 176.9 | 175.3 | 0 | 103.6 | R57 Q61 | R57-K59 PolarHBondContact O-N 2.89Å; K59-Q61 PolarHBondContact O-N 3.33Å | ||
| 60 | S | 57.8 | Low | 59 | Low | 62 Ų | 62 | 132.9 Ų | 132.9 | 43% | 0.434 | 65% | 0.652 | S | S | . | * | trans | -55.6 | 108.8 | -177.6 | 52 | 0 | 0 | 0 | 0 | 106.7 | S58 M62 F63 | S58-S60 VanDerWaalsContact C-N 3.3Å; S58-S60 PolarHBondContact O-N 2.86Å; S60-M62 PolarHBondContact O-N 3.37Å; S60-F63 PolarHBondContact O-N 3.44Å; S60-F63 VanDerWaalsContact O-N 3.11Å; S60-F63 WeakPolarHBondContact OG-CD2 3.37Å | ||
| 61 | Q | 56.6 | Low | 59.7 | Low | 132 Ų | 132 | 134.2 Ų | 134.2 | 62% | 0.617 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | -8.2 | 174.2 | -83.6 | 179.7 | -30.7 | 0 | 0 | 111.8 | K59 F63 Q64 Q65 | K59-Q61 PolarHBondContact O-N 3.33Å; Q61-F63 PolarHBondContact O-N 3.15Å; Q61-Q64 WeakPolarHBondContact O-CA 3.35Å; Q61-Q64 WeakPolarHBondContact O-CB 3.48Å; Q61-Q64 PolarHBondContact O-N 3.08Å; Q61-Q65 PolarHBondContact O-N 3.4Å |
| 62 | M | 53.9 | Low | 60.5 | Low | 128 Ų | 128 | 127 Ų | 127 | 63% | 0.631 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -50.2 | -36.3 | 166.8 | -165 | 173.8 | -174 | 0 | 0 | 113.3 | S60 Q64 F66 | S60-M62 PolarHBondContact O-N 3.37Å; M62-Q64 VanDerWaalsContact C-N 3.29Å; M62-Q64 PolarHBondContact O-N 2.92Å; M62-F66 HydrophobicContact CG-CD2 4.13Å; M62-F66 HydrophobicContact CG-CE2 4.47Å; M62-F66 PolarHBondContact O-N 3.11Å |
| 63 | F | 52.5 | Low | 61.1 | Low | 126 Ų | 126 | 123 Ų | 123 | 55% | 0.553 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -76.7 | -13.6 | 175.9 | -72.5 | -71.7 | 0 | 0 | 0 | 114.1 | S60 Q61 | S60-F63 PolarHBondContact O-N 3.44Å; S60-F63 VanDerWaalsContact O-N 3.11Å; S60-F63 WeakPolarHBondContact OG-CD2 3.37Å; Q61-F63 PolarHBondContact O-N 3.15Å |
| 64 | Q | 53.5 | Low | 61.7 | Low | 157 Ų | 157 | 127.3 Ų | 127.3 | 73% | 0.734 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -94.1 | -26.3 | 175.5 | -75.6 | 179.2 | -15.3 | 0 | 0 | 112.2 | Q61 M62 | Q61-Q64 WeakPolarHBondContact O-CA 3.35Å; Q61-Q64 WeakPolarHBondContact O-CB 3.48Å; Q61-Q64 PolarHBondContact O-N 3.08Å; M62-Q64 VanDerWaalsContact C-N 3.29Å; M62-Q64 PolarHBondContact O-N 2.92Å |
| 65 | Q | 53 | Low | 62.4 | Low | 152 Ų | 152 | 125.6 Ų | 125.6 | 71% | 0.71 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -86.9 | -31.8 | -179.9 | -71.1 | -177.4 | -31.3 | 0 | 0 | 113.5 | Q61 | Q61-Q65 PolarHBondContact O-N 3.4Å |
| 66 | F | 49.6 | Very low | 62.9 | Low | 137 Ų | 137 | 119.8 Ų | 119.8 | 60% | 0.601 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -105 | 94 | 173.3 | -64.1 | -81.6 | 0 | 0 | 0 | 108.6 | M62 R68 | M62-F66 HydrophobicContact CG-CD2 4.13Å; M62-F66 HydrophobicContact CG-CE2 4.47Å; M62-F66 PolarHBondContact O-N 3.11Å; F66-R68 PolarHBondContact O-N 2.82Å |
| 67 | G | 55.9 | Low | 63.2 | Low | 45 Ų | 45 | 118.1 Ų | 118.1 | 46% | 0.464 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -41.8 | 124.1 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | F69 | G67-F69 VanDerWaalsContact C-N 3.27Å; G67-F69 WeakPolarHBondContact O-CD2 3.46Å; G67-F69 WeakPolarHBondContact O-CE2 3.43Å; G67-F69 PolarHBondContact O-N 2.9Å |
| 68 | R | 61.9 | Low | 63.5 | Low | 180 Ų | 180 | 112.9 Ų | 112.9 | 68% | 0.679 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.3 | 23.6 | 153.3 | -59.4 | -175.1 | 173.3 | -125.5 | 2.8 | 118.4 | F66 C70 F87 | F66-R68 PolarHBondContact O-N 2.82Å; R68-C70 PolarHBondContact O-N 3.42Å; R68-F87 HydrophobicContact CB-CD1 4.28Å; R68-F87 WeakPolarHBondContact O-CD1 3.34Å |
| 69 | F | 62.3 | Low | 64 | Low | 107 Ų | 107 | 113.8 Ų | 113.8 | 47% | 0.469 | 53% | 0.531 | S | S | . | . | trans | -86.8 | 112.6 | 173.8 | -61.6 | -68.6 | 0 | 0 | 0 | 110.9 | G67 | G67-F69 VanDerWaalsContact C-N 3.27Å; G67-F69 WeakPolarHBondContact O-CD2 3.46Å; G67-F69 WeakPolarHBondContact O-CE2 3.43Å; G67-F69 PolarHBondContact O-N 2.9Å | ||
| 70 | C | 71.2 | Confident | 64.4 | Low | 13 Ų | 13 | 105 Ų | 105 | 9% | 0.088 | 50% | 0.495 | C | S | . | . | trans | -60.9 | 137.1 | 171.8 | -176.6 | 0 | 0 | 0 | 0 | 109.9 | R68 Y72 H73 W74 F87 | R68-C70 PolarHBondContact O-N 3.42Å; C70-Y72 PolarHBondContact O-N 3.27Å; C70-Y72 VanDerWaalsContact O-N 3.08Å; C70-H73 HydrophobicContact CB-CB 4.24Å; C70-H73 WeakPolarHBondContact O-CA 3.08Å; C70-H73 WeakPolarHBondContact O-CB 3.21Å; C70-H73 PolarHBondContact O-N 3.31Å; C70-W74 PolarHBondContact O-N 2.84Å; C70-W74 VanDerWaalsContact O-N 3.1Å; C70-F87 HydrophobicContact CB-CB 3.62Å; C70-F87 HydrophobicContact CB-CD2 4.14Å; C70-F87 HydrophobicContact CB-CG 3.86Å | ||
| 71 | W | 73.3 | Confident | 64.8 | Low | 125 Ų | 125 | 108.5 Ų | 108.5 | 47% | 0.473 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -51.6 | -35.2 | 175 | 179.6 | 86.3 | 0 | 0 | 0 | 112.6 | W74 K75 F76 | W71-W74 PolarHBondContact O-N 3.33Å; W71-K75 HydrophobicContact CH2-CD 3.58Å; W71-K75 HydrophobicContact CZ2-CD 3.88Å; W71-K75 HydrophobicContact CZ3-CD 4.14Å; W71-K75 PolarHBondContact O-N 3.11Å; W71-K75 VanDerWaalsContact O-N 3.15Å; W71-F76 HydrophobicContact CZ3-CE2 4.48Å |
| 72 | Y | 72.3 | Confident | 65.4 | Low | 85 Ų | 85 | 109.3 Ų | 109.3 | 33% | 0.333 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68.6 | -34.5 | 176.6 | -69.7 | -86.4 | 0 | 0 | 0 | 113 | C70 K75 F76 S80 K82 | C70-Y72 PolarHBondContact O-N 3.27Å; C70-Y72 VanDerWaalsContact O-N 3.08Å; Y72-K75 PolarHBondContact O-N 3.1Å; Y72-F76 HydrophobicContact CD1-CD2 4.04Å; Y72-F76 AromaticContact CD1-CE2 3.91Å; Y72-F76 HydrophobicContact CD1-CE2 3.91Å; Y72-F76 HydrophobicContact CE1-CE2 4.5Å; Y72-F76 WeakPolarHBondContact O-CB 3.39Å; Y72-F76 WeakPolarHBondContact O-CD2 3.5Å; Y72-F76 PolarHBondContact O-N 2.87Å; Y72-S80 WeakPolarHBondContact CB-OG 2.96Å; Y72-K82 HydrophobicContact CD1-CB 3.96Å; Y72-K82 HydrophobicContact CE1-CB 3.8Å; Y72-K82 HydrophobicContact CE1-CD 4.06Å; Y72-K82 HydrophobicContact CG-CB 4.42Å |
| 73 | H | 74.2 | Confident | 66.1 | Low | 17 Ų | 17 | 104.7 Ų | 104.7 | 8% | 0.079 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -70.5 | -34.4 | 174.3 | -74.6 | 142.9 | 0 | 0 | 0 | 112 | C70 K75 D77 C83 W89 | C70-H73 HydrophobicContact CB-CB 4.24Å; C70-H73 WeakPolarHBondContact O-CA 3.08Å; C70-H73 WeakPolarHBondContact O-CB 3.21Å; C70-H73 PolarHBondContact O-N 3.31Å; H73-K75 VanDerWaalsContact C-N 3.28Å; H73-K75 PolarHBondContact O-N 2.96Å; H73-D77 WeakPolarHBondContact O-CA 3.2Å; H73-D77 PolarHBondContact O-N 3.44Å; H73-C83 PolarHBondContact CE1-SG 2.9Å; H73-W89 HydrophobicContact CB-CE3 3.59Å; H73-W89 HydrophobicContact CB-CZ3 3.65Å; H73-W89 AromaticContact CD2-CE3 3.8Å; H73-W89 PolarHBondContact CE1-N 2.93Å; H73-W89 VanDerWaalsContact CE1-N 3.32Å; H73-W89 AromaticContact CG-CE3 3.61Å |
| 74 | W | 73 | Confident | 66.7 | Low | 207 Ų | 207 | 109 Ų | 109 | 78% | 0.784 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.9 | -35.8 | 172.4 | 177.4 | 71.3 | 0 | 0 | 0 | 112.3 | C70 W71 | C70-W74 PolarHBondContact O-N 2.84Å; C70-W74 VanDerWaalsContact O-N 3.1Å; W71-W74 PolarHBondContact O-N 3.33Å |
| 75 | K | 79.6 | Confident | 67 | Low | 119 Ų | 119 | 109.2 Ų | 109.2 | 52% | 0.517 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -87.6 | -39 | -176 | -174.3 | 168.5 | -178 | 175.3 | 0 | 114.4 | W71 Y72 H73 | W71-K75 HydrophobicContact CH2-CD 3.58Å; W71-K75 HydrophobicContact CZ2-CD 3.88Å; W71-K75 HydrophobicContact CZ3-CD 4.14Å; W71-K75 PolarHBondContact O-N 3.11Å; W71-K75 VanDerWaalsContact O-N 3.15Å; Y72-K75 PolarHBondContact O-N 3.1Å; H73-K75 VanDerWaalsContact C-N 3.28Å; H73-K75 PolarHBondContact O-N 2.96Å |
| 76 | F | 75.2 | Confident | 67.5 | Low | 93 Ų | 93 | 105.8 Ų | 105.8 | 41% | 0.408 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -119.9 | -0.2 | -169.8 | -57 | -73.6 | 0 | 0 | 0 | 113.1 | W71 Y72 V78 N79 | W71-F76 HydrophobicContact CZ3-CE2 4.48Å; Y72-F76 HydrophobicContact CD1-CD2 4.04Å; Y72-F76 AromaticContact CD1-CE2 3.91Å; Y72-F76 HydrophobicContact CD1-CE2 3.91Å; Y72-F76 HydrophobicContact CE1-CE2 4.5Å; Y72-F76 WeakPolarHBondContact O-CB 3.39Å; Y72-F76 WeakPolarHBondContact O-CD2 3.5Å; Y72-F76 PolarHBondContact O-N 2.87Å; F76-V78 PolarHBondContact O-N 3.4Å; F76-N79 HydrophobicContact CB-CB 4.5Å; F76-N79 WeakPolarHBondContact O-CA 3.46Å; F76-N79 WeakPolarHBondContact O-CB 3.47Å; F76-N79 PolarHBondContact O-N 3.35Å |
| 77 | D | 71.6 | Confident | 67.9 | Low | 77 Ų | 77 | 103 Ų | 103 | 41% | 0.412 | 49% | 0.487 | S | S | . | . | G | 310 helix | trans | 50.6 | -134.5 | -178.7 | -164.4 | -10.2 | 0 | 0 | 0 | 110.4 | H73 N79 S80 W89 | H73-D77 WeakPolarHBondContact O-CA 3.2Å; H73-D77 PolarHBondContact O-N 3.44Å; D77-N79 PolarHBondContact O-N 3.12Å; D77-N79 VanDerWaalsContact O-N 3.11Å; D77-S80 WeakPolarHBondContact O-CB 3.17Å; D77-S80 PolarHBondContact O-N 3.2Å; D77-W89 VanDerWaalsContact OD1-CE2 3.26Å; D77-W89 WeakPolarHBondContact OD1-CH2 2.8Å; D77-W89 WeakPolarHBondContact OD1-CZ2 3.21Å |
| 78 | V | 69.5 | Low | 68.1 | Low | 102 Ų | 102 | 104.2 Ų | 104.2 | 62% | 0.618 | 49% | 0.492 | S | S | * | . | G | 310 helix | trans | -57.5 | -18.2 | 175.3 | -63.8 | 0 | 0 | 0 | 0 | 114.9 | F76 S80 | F76-V78 PolarHBondContact O-N 3.4Å; V78-S80 VanDerWaalsContact C-N 3.28Å; V78-S80 PolarHBondContact O-N 3.32Å |
| 79 | N | 69.2 | Low | 68 | Low | 128 Ų | 128 | 99.6 Ų | 99.6 | 68% | 0.684 | 48% | 0.475 | S | S | * | . | G | 310 helix | trans | -85.8 | 6.1 | 179.2 | -67.6 | -22.9 | 0 | 0 | 0 | 113.6 | F76 D77 T81 | F76-N79 HydrophobicContact CB-CB 4.5Å; F76-N79 WeakPolarHBondContact O-CA 3.46Å; F76-N79 WeakPolarHBondContact O-CB 3.47Å; F76-N79 PolarHBondContact O-N 3.35Å; D77-N79 PolarHBondContact O-N 3.12Å; D77-N79 VanDerWaalsContact O-N 3.11Å; N79-T81 PolarHBondContact O-N 3.04Å |
| 80 | S | 66.6 | Low | 68 | Low | 14 Ų | 14 | 98.2 Ų | 98.2 | 10% | 0.098 | 48% | 0.477 | C | S | . | . | trans | -72.7 | 79.9 | 179.6 | 168.4 | 0 | 0 | 0 | 0 | 113 | Y72 D77 V78 K82 | Y72-S80 WeakPolarHBondContact CB-OG 2.96Å; D77-S80 WeakPolarHBondContact O-CB 3.17Å; D77-S80 PolarHBondContact O-N 3.2Å; V78-S80 VanDerWaalsContact C-N 3.28Å; V78-S80 PolarHBondContact O-N 3.32Å; S80-K82 PolarHBondContact O-N 2.89Å | ||
| 81 | T | 66.7 | Low | 67.6 | Low | 135 Ų | 135 | 107 Ų | 107 | 83% | 0.828 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.4 | -15.8 | 175 | 57.2 | 0 | 0 | 0 | 0 | 114.2 | N79 | N79-T81 PolarHBondContact O-N 3.04Š|
| 82 | K | 69 | Low | 66.9 | Low | 148 Ų | 148 | 109.3 Ų | 109.3 | 64% | 0.643 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.9 | 6.1 | -177.7 | -65.1 | -175.2 | 179.4 | 179.3 | 0 | 113.9 | Y72 S80 R84 | Y72-K82 HydrophobicContact CD1-CB 3.96Å; Y72-K82 HydrophobicContact CE1-CB 3.8Å; Y72-K82 HydrophobicContact CE1-CD 4.06Å; Y72-K82 HydrophobicContact CG-CB 4.42Å; S80-K82 PolarHBondContact O-N 2.89Å; K82-R84 PolarHBondContact O-N 3.22Å |
| 83 | C | 68.5 | Low | 65.7 | Low | 31 Ų | 31 | 110.9 Ų | 110.9 | 21% | 0.209 | 54% | 0.544 | C | S | . | . | trans | -68.1 | 122.9 | 176.4 | -167.4 | 0 | 0 | 0 | 0 | 110.2 | H73 F87 | H73-C83 PolarHBondContact CE1-SG 2.9Å; C83-F87 PolarHBondContact SG-O 3.28Å | ||
| 84 | R | 64.1 | Low | 64.8 | Low | 217 Ų | 217 | 116 Ų | 116 | 82% | 0.819 | 58% | 0.578 | S | S | * | * | trans | -106 | 143.1 | 171.2 | -63.5 | -170.5 | -172 | -154 | 2.6 | 109.3 | K82 | K82-R84 PolarHBondContact O-N 3.22Š| ||
| 85 | Q | 60.5 | Low | 63.9 | Low | 162 Ų | 162 | 114.1 Ų | 114.1 | 76% | 0.757 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -46.1 | 144.7 | 176.2 | -70.6 | -73.1 | -31.5 | 0 | 0 | 111.5 | ||
| 86 | P | 62.7 | Low | 62.4 | Low | 79 Ų | 79 | 116.3 Ų | 116.3 | 51% | 0.513 | 59% | 0.593 | S | S | . | * | T | Hydrogen-bonded Turn | cis | -96.3 | 13.8 | 18.4 | 38 | -36.6 | 0 | 0 | 0 | 114.8 | ||
| 87 | F | 59.3 | Low | 61 | Low | 80 Ų | 80 | 124.1 Ų | 124.1 | 35% | 0.351 | 63% | 0.634 | S | S | . | * | trans | -86.9 | 122.1 | -178.4 | -54.7 | -71.6 | 0 | 0 | 0 | 110.8 | R68 C70 C83 | R68-F87 HydrophobicContact CB-CD1 4.28Å; R68-F87 WeakPolarHBondContact O-CD1 3.34Å; C70-F87 HydrophobicContact CB-CB 3.62Å; C70-F87 HydrophobicContact CB-CD2 4.14Å; C70-F87 HydrophobicContact CB-CG 3.86Å; C83-F87 PolarHBondContact SG-O 3.28Å | ||
| 88 | A | 59.5 | Low | 60.5 | Low | 69 Ų | 69 | 126.5 Ų | 126.5 | 57% | 0.57 | 65% | 0.645 | S | S | * | * | trans | -125.8 | 137.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 89 | W | 59.7 | Low | 60 | Low | 83 Ų | 83 | 127.8 Ų | 127.8 | 31% | 0.314 | 65% | 0.647 | S | S | . | * | trans | -61.7 | 134.1 | 169.1 | -166 | -111.1 | 0 | 0 | 0 | 108.1 | H73 D77 K91 | H73-W89 HydrophobicContact CB-CE3 3.59Å; H73-W89 HydrophobicContact CB-CZ3 3.65Å; H73-W89 AromaticContact CD2-CE3 3.8Å; H73-W89 PolarHBondContact CE1-N 2.93Å; H73-W89 VanDerWaalsContact CE1-N 3.32Å; H73-W89 AromaticContact CG-CE3 3.61Å; D77-W89 VanDerWaalsContact OD1-CE2 3.26Å; D77-W89 WeakPolarHBondContact OD1-CH2 2.8Å; D77-W89 WeakPolarHBondContact OD1-CZ2 3.21Å; W89-K91 PolarHBondContact O-N 2.9Å | ||
| 90 | P | 62.6 | Low | 59.5 | Low | 78 Ų | 78 | 127.8 Ų | 127.8 | 51% | 0.506 | 64% | 0.644 | S | S | . | * | trans | -60.4 | 107.9 | 169.5 | 23.9 | -29 | 0 | 0 | 0 | 107 | Q92 | P90-Q92 PolarHBondContact O-N 2.88Š| ||
| 91 | K | 61.5 | Low | 59.1 | Low | 197 Ų | 197 | 134.5 Ų | 134.5 | 86% | 0.857 | 68% | 0.677 | S | S | * | * | trans | -54.5 | 111.4 | 168.9 | -77.1 | -177.6 | 177.5 | -177.6 | 0 | 105.6 | W89 N93 | W89-K91 PolarHBondContact O-N 2.9Å; K91-N93 PolarHBondContact O-N 2.92Å | ||
| 92 | Q | 58.9 | Low | 58.6 | Low | 175 Ų | 175 | 134.4 Ų | 134.4 | 82% | 0.818 | 67% | 0.667 | S | S | * | * | trans | -57.9 | 108.6 | 171 | -69.1 | -164.3 | -1.5 | 0 | 0 | 106.4 | P90 | P90-Q92 PolarHBondContact O-N 2.88Š| ||
| 93 | N | 47.7 | Very low | 58 | Low | 118 Ų | 118 | 133.5 Ų | 133.5 | 63% | 0.631 | 67% | 0.669 | S | S | * | * | trans | -76.4 | 122.3 | 170.8 | -152 | -28.3 | 0 | 0 | 0 | 104.5 | K91 K95 | K91-N93 PolarHBondContact O-N 2.92Å; N93-K95 PolarHBondContact O-N 2.74Å | ||
| 94 | P | 56.4 | Low | 57.2 | Low | 124 Ų | 124 | 140.9 Ų | 140.9 | 81% | 0.805 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | 34.3 | -175.6 | 29.7 | -36.1 | 0 | 0 | 0 | 113.3 | ||
| 95 | K | 53.7 | Low | 56.7 | Low | 168 Ų | 168 | 135 Ų | 135 | 73% | 0.73 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | 1.9 | -173 | -79.1 | -172.8 | 174.9 | -177.4 | 0 | 115.5 | N93 | N93-K95 PolarHBondContact O-N 2.74Š|
| 96 | N | 47.9 | Very low | 56.3 | Low | 165 Ų | 165 | 132.8 Ų | 132.8 | 88% | 0.882 | 69% | 0.687 | S | S | * | * | trans | -131.3 | 53 | 178 | -64.7 | -6.2 | 0 | 0 | 0 | 111.9 | ||||
| 97 | M | 46.4 | Very low | 55.8 | Low | 257 Ų | 257 | 137.6 Ų | 137.6 | 100% | 1.266 | 70% | 0.703 | S | S | * | * | trans | -111.6 | 0 | 155.5 | -119.9 | 177 | 122.1 | 0 | 0 | 107.2 |
Retrieved 97 of 97 residues in 40.8 ms
(Link to these results)