| 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 | 61.8 | Low | 77.8 | Confident | 181 Ų | 181 | 115.1 Ų | 115.1 | 89% | 0.892 | 60% | 0.603 | S | S | * | * | 0 | -52.5 | 0 | -70.2 | -95.4 | 87.3 | 0 | 0 | 111.9 | L3 I4 I5 | M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.44Å; M1-I4 HydrophobicContact CE-CD1 4.16Å; M1-I4 PolarHBondContact O-N 3.15Å; M1-I4 VanDerWaalsContact O-N 3.15Å; M1-I5 PolarHBondContact O-N 3.25Å | |||
| 2 | L | 73.5 | Confident | 77.8 | Confident | 131 Ų | 131 | 109.9 Ų | 109.9 | 69% | 0.686 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -53.3 | -42 | -179.6 | -112.2 | 113.2 | 0 | 0 | 0 | 115 | I4 I5 H6 | L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 3.13Å; L2-I5 PolarHBondContact O-N 3.46Å; L2-H6 PolarHBondContact O-CD2 3.47Å; L2-H6 PolarHBondContact O-N 3.36Å; L2-H6 VanDerWaalsContact O-N 3.13Å |
| 3 | L | 75.9 | Confident | 77.8 | Confident | 143 Ų | 143 | 107.8 Ų | 107.8 | 75% | 0.749 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.4 | -36.2 | -179.9 | -109.6 | 155.9 | 0 | 0 | 0 | 113.4 | M1 H6 C7 | M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.44Å; L3-H6 PolarHBondContact O-N 3.12Å; L3-C7 PolarHBondContact O-N 3.49Å; L3-C7 VanDerWaalsContact O-N 3.12Å |
| 4 | I | 78.5 | Confident | 77.7 | Confident | 107 Ų | 107 | 108.4 Ų | 108.4 | 55% | 0.549 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -70.5 | -41.2 | -179.4 | -59.4 | 173.1 | 0 | 0 | 0 | 109.7 | M1 L2 H6 C7 V8 | M1-I4 HydrophobicContact CE-CD1 4.16Å; M1-I4 PolarHBondContact O-N 3.15Å; M1-I4 VanDerWaalsContact O-N 3.15Å; L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 3.13Å; I4-H6 VanDerWaalsContact C-N 3.34Å; I4-H6 PolarHBondContact O-N 3.39Å; I4-C7 PolarHBondContact O-N 3Å; I4-V8 WeakPolarHBondContact O-CG2 3.47Å; I4-V8 PolarHBondContact O-N 3.3Å |
| 5 | I | 80.5 | Confident | 77.2 | Confident | 108 Ų | 108 | 110.4 Ų | 110.4 | 55% | 0.554 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.7 | -44.8 | 177.9 | -60.4 | 170.6 | 0 | 0 | 0 | 110 | M1 L2 C7 V8 M9 | M1-I5 PolarHBondContact O-N 3.25Å; L2-I5 PolarHBondContact O-N 3.46Å; I5-C7 PolarHBondContact O-N 3.29Å; I5-V8 PolarHBondContact O-N 3.27Å; I5-M9 HydrophobicContact CG2-CG 4.43Å; I5-M9 VanDerWaalsContact O-CG 3.26Å; I5-M9 WeakPolarHBondContact O-CG 3.45Å; I5-M9 PolarHBondContact O-N 3.03Å |
| 6 | H | 79.5 | Confident | 76.7 | Confident | 114 Ų | 114 | 110.7 Ų | 110.7 | 53% | 0.528 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -61.1 | -42.7 | 176.3 | -85.2 | -72 | 0 | 0 | 0 | 113 | L2 L3 I4 V8 M9 L10 | L2-H6 PolarHBondContact O-CD2 3.47Å; L2-H6 PolarHBondContact O-N 3.36Å; L2-H6 VanDerWaalsContact O-N 3.13Å; L3-H6 PolarHBondContact O-N 3.12Å; I4-H6 VanDerWaalsContact C-N 3.34Å; I4-H6 PolarHBondContact O-N 3.39Å; H6-V8 PolarHBondContact O-N 3.5Å; H6-M9 PolarHBondContact O-N 2.99Å; H6-L10 WeakPolarHBondContact O-CG 3.42Å; H6-L10 PolarHBondContact O-N 3.35Å |
| 7 | C | 79.4 | Confident | 76.3 | Confident | 70 Ų | 70 | 111.8 Ų | 111.8 | 47% | 0.473 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -61.5 | -43.7 | 175.8 | -85.4 | 0 | 0 | 0 | 0 | 112.5 | L3 I4 I5 M9 L10 L11 | L3-C7 PolarHBondContact O-N 3.49Å; L3-C7 VanDerWaalsContact O-N 3.12Å; I4-C7 PolarHBondContact O-N 3Å; I5-C7 PolarHBondContact O-N 3.29Å; C7-M9 PolarHBondContact O-N 3.5Å; C7-L10 PolarHBondContact O-N 2.75Å; C7-L11 WeakPolarHBondContact O-CB 3.26Å; C7-L11 WeakPolarHBondContact O-CD1 3.47Å; C7-L11 WeakPolarHBondContact O-CG 3.37Å; C7-L11 PolarHBondContact O-N 3.36Å |
| 8 | V | 84.5 | Confident | 76 | Confident | 91 Ų | 91 | 109.8 Ų | 109.8 | 55% | 0.552 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -64 | -42.4 | 179.1 | 175 | 0 | 0 | 0 | 0 | 111 | I4 I5 H6 L10 L11 S12 | I4-V8 WeakPolarHBondContact O-CG2 3.47Å; I4-V8 PolarHBondContact O-N 3.3Å; I5-V8 PolarHBondContact O-N 3.27Å; H6-V8 PolarHBondContact O-N 3.5Å; V8-L10 PolarHBondContact O-N 3.4Å; V8-L11 PolarHBondContact O-N 3.36Å; V8-S12 PolarHBondContact O-N 3.49Å; V8-S12 PolarHBondContact O-OG 3.39Å |
| 9 | M | 80.5 | Confident | 75.3 | Confident | 110 Ų | 110 | 109.7 Ų | 109.7 | 54% | 0.542 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -60.7 | -46.1 | 176.1 | -69.1 | -66 | -66.1 | 0 | 0 | 111.6 | I5 H6 C7 L11 S12 L13 | I5-M9 HydrophobicContact CG2-CG 4.43Å; I5-M9 VanDerWaalsContact O-CG 3.26Å; I5-M9 WeakPolarHBondContact O-CG 3.45Å; I5-M9 PolarHBondContact O-N 3.03Å; H6-M9 PolarHBondContact O-N 2.99Å; C7-M9 PolarHBondContact O-N 3.5Å; M9-L11 PolarHBondContact O-N 3.02Å; M9-S12 PolarHBondContact O-N 3.4Å; M9-S12 PolarHBondContact O-OG 3.5Å; M9-L13 WeakPolarHBondContact O-CG 3.48Å; M9-L13 PolarHBondContact O-N 2.96Å |
| 10 | L | 81.4 | Confident | 74.7 | Confident | 104 Ų | 104 | 108.3 Ų | 108.3 | 55% | 0.545 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.3 | -41 | 178.2 | -71.1 | 170.8 | 0 | 0 | 0 | 112.4 | H6 C7 V8 L13 I14 | H6-L10 WeakPolarHBondContact O-CG 3.42Å; H6-L10 PolarHBondContact O-N 3.35Å; C7-L10 PolarHBondContact O-N 2.75Å; V8-L10 PolarHBondContact O-N 3.4Å; L10-L13 PolarHBondContact O-N 3.27Å; L10-I14 VanDerWaalsContact O-CG1 3.31Å; L10-I14 WeakPolarHBondContact O-CG1 3.31Å; L10-I14 PolarHBondContact O-N 2.93Å |
| 11 | L | 80.8 | Confident | 73.8 | Confident | 107 Ų | 107 | 111.8 Ų | 111.8 | 56% | 0.56 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -61.8 | -43 | 175.5 | -81.7 | 156.1 | 0 | 0 | 0 | 112 | C7 V8 M9 I14 Q15 | C7-L11 WeakPolarHBondContact O-CB 3.26Å; C7-L11 WeakPolarHBondContact O-CD1 3.47Å; C7-L11 WeakPolarHBondContact O-CG 3.37Å; C7-L11 PolarHBondContact O-N 3.36Å; V8-L11 PolarHBondContact O-N 3.36Å; M9-L11 PolarHBondContact O-N 3.02Å; L11-I14 PolarHBondContact O-N 3.01Å; L11-Q15 WeakPolarHBondContact O-CG 3.35Å; L11-Q15 PolarHBondContact O-N 2.95Å; L11-Q15 VanDerWaalsContact O-N 3.1Å |
| 12 | S | 78 | Confident | 73.5 | Confident | 53 Ų | 53 | 108.2 Ų | 108.2 | 37% | 0.371 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.1 | -36.5 | 176.9 | 65.3 | 0 | 0 | 0 | 0 | 112.9 | V8 M9 Q15 L16 | V8-S12 PolarHBondContact O-N 3.49Å; V8-S12 PolarHBondContact O-OG 3.39Å; M9-S12 PolarHBondContact O-N 3.4Å; M9-S12 PolarHBondContact O-OG 3.5Å; S12-Q15 PolarHBondContact O-N 3.33Å; S12-L16 WeakPolarHBondContact O-CB 3.4Å; S12-L16 PolarHBondContact O-N 3.1Å |
| 13 | L | 77.3 | Confident | 72.5 | Confident | 83 Ų | 83 | 111.6 Ų | 111.6 | 44% | 0.435 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66 | -41.5 | 175.8 | -76.6 | 166.6 | 0 | 0 | 0 | 111.7 | M9 L10 Q15 L16 H17 | M9-L13 WeakPolarHBondContact O-CG 3.48Å; M9-L13 PolarHBondContact O-N 2.96Å; L10-L13 PolarHBondContact O-N 3.27Å; L13-Q15 VanDerWaalsContact C-N 3.34Å; L13-Q15 PolarHBondContact O-N 3.26Å; L13-L16 PolarHBondContact O-N 3.32Å; L13-H17 PolarHBondContact O-CD2 3.04Å; L13-H17 VanDerWaalsContact O-CD2 3.26Å; L13-H17 PolarHBondContact O-N 3.49Å |
| 14 | I | 77 | Confident | 71.3 | Confident | 115 Ų | 115 | 115 Ų | 115 | 59% | 0.59 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.6 | -42 | 176.8 | -66.4 | 164.1 | 0 | 0 | 0 | 110.6 | L10 L11 L16 H17 A18 | L10-I14 VanDerWaalsContact O-CG1 3.31Å; L10-I14 WeakPolarHBondContact O-CG1 3.31Å; L10-I14 PolarHBondContact O-N 2.93Å; L11-I14 PolarHBondContact O-N 3.01Å; I14-L16 VanDerWaalsContact C-N 3.35Å; I14-H17 PolarHBondContact O-N 3.19Å; I14-A18 VanDerWaalsContact O-CB 3.28Å; I14-A18 WeakPolarHBondContact O-CB 3.49Å; I14-A18 PolarHBondContact O-N 3.45Å |
| 15 | Q | 69.9 | Low | 70.2 | Confident | 139 Ų | 139 | 113 Ų | 113 | 65% | 0.65 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.7 | -40.3 | 175.5 | -73 | 179.3 | -13 | 0 | 0 | 112.2 | L11 S12 L13 A18 L19 | L11-Q15 WeakPolarHBondContact O-CG 3.35Å; L11-Q15 PolarHBondContact O-N 2.95Å; L11-Q15 VanDerWaalsContact O-N 3.1Å; S12-Q15 PolarHBondContact O-N 3.33Å; L13-Q15 VanDerWaalsContact C-N 3.34Å; L13-Q15 PolarHBondContact O-N 3.26Å; Q15-A18 PolarHBondContact O-N 3.23Å; Q15-L19 PolarHBondContact O-N 3.28Å |
| 16 | L | 69.7 | Low | 68.9 | Low | 115 Ų | 115 | 114.6 Ų | 114.6 | 60% | 0.602 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -66.2 | -38.1 | 177.7 | -168.2 | 73.1 | 0 | 0 | 0 | 112 | S12 L13 I14 L19 | S12-L16 WeakPolarHBondContact O-CB 3.4Å; S12-L16 PolarHBondContact O-N 3.1Å; L13-L16 PolarHBondContact O-N 3.32Å; I14-L16 VanDerWaalsContact C-N 3.35Å; L16-L19 HydrophobicContact CD1-CD1 4Å; L16-L19 WeakPolarHBondContact O-CB 3.28Å; L16-L19 PolarHBondContact O-N 2.92Å |
| 17 | H | 69.4 | Low | 67.9 | Low | 129 Ų | 129 | 112.7 Ų | 112.7 | 60% | 0.597 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -73.9 | -25.5 | 174.6 | -86.5 | -101.6 | 0 | 0 | 0 | 113.5 | L13 I14 L19 | L13-H17 PolarHBondContact O-CD2 3.04Å; L13-H17 VanDerWaalsContact O-CD2 3.26Å; L13-H17 PolarHBondContact O-N 3.49Å; I14-H17 PolarHBondContact O-N 3.19Å; H17-L19 VanDerWaalsContact C-N 3.29Å |
| 18 | A | 69.9 | Low | 66.8 | Low | 77 Ų | 77 | 114.6 Ų | 114.6 | 64% | 0.636 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -80.4 | -9.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113 | I14 Q15 | I14-A18 VanDerWaalsContact O-CB 3.28Å; I14-A18 WeakPolarHBondContact O-CB 3.49Å; I14-A18 PolarHBondContact O-N 3.45Å; Q15-A18 PolarHBondContact O-N 3.23Å |
| 19 | L | 63.8 | Low | 65.5 | Low | 107 Ų | 107 | 114.7 Ų | 114.7 | 56% | 0.56 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -65.3 | 125.8 | 169.5 | -71.5 | 167 | 0 | 0 | 0 | 108.2 | Q15 L16 H17 Y21 | Q15-L19 PolarHBondContact O-N 3.28Å; L16-L19 HydrophobicContact CD1-CD1 4Å; L16-L19 WeakPolarHBondContact O-CB 3.28Å; L16-L19 PolarHBondContact O-N 2.92Å; H17-L19 VanDerWaalsContact C-N 3.29Å; L19-Y21 PolarHBondContact O-N 3.38Å |
| 20 | P | 62 | Low | 64.4 | Low | 81 Ų | 81 | 116.9 Ų | 116.9 | 53% | 0.526 | 59% | 0.593 | S | S | . | * | trans | -59.3 | 127.7 | 178 | 24.7 | -32.3 | 0 | 0 | 0 | 108.6 | D22 Y23 | P20-D22 HydrophobicContact CB-CB 4.23Å; P20-D22 PolarHBondContact O-N 3.1Å; P20-Y23 PolarHBondContact O-N 3.02Å | ||
| 21 | Y | 57.5 | Low | 63.4 | Low | 183 Ų | 183 | 116.1 Ų | 116.1 | 72% | 0.718 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -55.3 | -12.7 | 171.3 | -77.9 | -89.2 | 0 | 0 | 0 | 112.4 | L19 Y23 Y24 | L19-Y21 PolarHBondContact O-N 3.38Å; Y21-Y23 PolarHBondContact O-N 2.76Å; Y21-Y23 VanDerWaalsContact O-N 3.07Å; Y21-Y24 PolarHBondContact O-N 2.98Å |
| 22 | D | 55.6 | Low | 62.3 | Low | 105 Ų | 105 | 114.6 Ų | 114.6 | 56% | 0.561 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -61.2 | -8.2 | 174 | -68.1 | -39.5 | 0 | 0 | 0 | 114.7 | P20 Y24 S25 | P20-D22 HydrophobicContact CB-CB 4.23Å; P20-D22 PolarHBondContact O-N 3.1Å; D22-Y24 PolarHBondContact O-N 2.95Å; D22-S25 PolarHBondContact O-N 3.45Å; D22-S25 PolarHBondContact O-OG 3.44Å |
| 23 | Y | 51.1 | Low | 61.3 | Low | 203 Ų | 203 | 120 Ų | 120 | 80% | 0.796 | 60% | 0.596 | S | S | * | * | G | 310 helix | trans | -66.1 | -19.8 | 172.2 | -140.8 | -91.7 | 0 | 0 | 0 | 113.2 | P20 Y21 | P20-Y23 PolarHBondContact O-N 3.02Å; Y21-Y23 PolarHBondContact O-N 2.76Å; Y21-Y23 VanDerWaalsContact O-N 3.07Å |
| 24 | Y | 50.6 | Low | 60.4 | Low | 214 Ų | 214 | 125.4 Ų | 125.4 | 84% | 0.839 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -95.6 | -9.3 | 177.9 | -68.9 | -80.7 | 0 | 0 | 0 | 114.3 | Y21 D22 H26 | Y21-Y24 PolarHBondContact O-N 2.98Å; D22-Y24 PolarHBondContact O-N 2.95Å; Y24-H26 VanDerWaalsContact C-N 3.35Å |
| 25 | S | 55.4 | Low | 59.5 | Low | 65 Ų | 65 | 127.5 Ų | 127.5 | 46% | 0.455 | 61% | 0.612 | S | S | . | * | S | Bend | trans | -89.7 | -3.6 | 178.1 | 60.3 | 0 | 0 | 0 | 0 | 112.8 | D22 P27 | D22-S25 PolarHBondContact O-N 3.45Å; D22-S25 PolarHBondContact O-OG 3.44Å; S25-P27 WeakPolarHBondContact O-CD 3.48Å |
| 26 | H | 54 | Low | 58.9 | Low | 142 Ų | 142 | 124.2 Ų | 124.2 | 66% | 0.657 | 60% | 0.599 | S | S | * | * | S | Bend | trans | -112.8 | 97.5 | 179 | -67.8 | -4.3 | 0 | 0 | 0 | 109.5 | Y24 D28 | Y24-H26 VanDerWaalsContact C-N 3.35Å; H26-D28 PolarHBondContact O-N 3.3Å |
| 27 | P | 58 | Low | 58.2 | Low | 74 Ų | 74 | 123.2 Ų | 123.2 | 48% | 0.481 | 59% | 0.591 | S | S | . | * | trans | -57.1 | 133.3 | 169.9 | 14.7 | -18 | 0 | 0 | 0 | 108.4 | S25 I32 | S25-P27 WeakPolarHBondContact O-CD 3.48Å; P27-I32 HydrophobicContact CB-CD1 4.27Å; P27-I32 HydrophobicContact CB-CG1 3.79Å; P27-I32 HydrophobicContact CG-CD1 3.8Å; P27-I32 HydrophobicContact CG-CG1 3.66Å; P27-I32 WeakPolarHBondContact O-CD1 3.46Å | ||
| 28 | D | 57.1 | Low | 57.5 | Low | 110 Ų | 110 | 126.8 Ų | 126.8 | 59% | 0.588 | 60% | 0.6 | S | S | * | * | trans | -43.1 | 135.8 | 176.6 | -99 | -40.2 | 0 | 0 | 0 | 110.1 | H26 F30 V31 I32 | H26-D28 PolarHBondContact O-N 3.3Å; D28-F30 PolarHBondContact O-N 2.91Å; D28-V31 HydrophobicContact CB-CB 4.33Å; D28-V31 HydrophobicContact CB-CG2 3.88Å; D28-V31 WeakPolarHBondContact O-CA 3.42Å; D28-V31 WeakPolarHBondContact O-CB 3.4Å; D28-V31 PolarHBondContact O-N 3.2Å; D28-I32 PolarHBondContact O-N 3.25Å | ||
| 29 | P | 57.4 | Low | 56.7 | Low | 92 Ų | 92 | 126.1 Ų | 126.1 | 60% | 0.597 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -56.8 | -25.5 | -179.3 | 19.9 | -30.5 | 0 | 0 | 0 | 112.1 | R33 | P29-R33 WeakPolarHBondContact O-CB 3.17Å; P29-R33 PolarHBondContact O-N 3.43Å |
| 30 | F | 57.6 | Low | 56 | Low | 157 Ų | 157 | 127.7 Ų | 127.7 | 69% | 0.689 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.5 | -37.5 | 171.2 | -69.6 | -78.2 | 0 | 0 | 0 | 113.7 | D28 R34 | D28-F30 PolarHBondContact O-N 2.91Å; F30-R34 WeakPolarHBondContact O-CB 3.49Å; F30-R34 WeakPolarHBondContact O-CG 3.34Å; F30-R34 PolarHBondContact O-N 2.99Å; F30-R34 VanDerWaalsContact O-N 3.1Å |
| 31 | V | 59.6 | Low | 55.5 | Low | 87 Ų | 87 | 130.8 Ų | 130.8 | 53% | 0.527 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -72.8 | -43.1 | 177.3 | 179.3 | 0 | 0 | 0 | 0 | 110.1 | D28 R34 Y35 | D28-V31 HydrophobicContact CB-CB 4.33Å; D28-V31 HydrophobicContact CB-CG2 3.88Å; D28-V31 WeakPolarHBondContact O-CA 3.42Å; D28-V31 WeakPolarHBondContact O-CB 3.4Å; D28-V31 PolarHBondContact O-N 3.2Å; V31-R34 PolarHBondContact O-N 3.32Å; V31-Y35 WeakPolarHBondContact O-CB 3.38Å; V31-Y35 PolarHBondContact O-N 2.94Å |
| 32 | I | 58.4 | Low | 55.4 | Low | 75 Ų | 75 | 127 Ų | 127 | 39% | 0.385 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -61.1 | -47.6 | 175.2 | -59.1 | 176.1 | 0 | 0 | 0 | 110.5 | P27 D28 R34 Y35 N36 | P27-I32 HydrophobicContact CB-CD1 4.27Å; P27-I32 HydrophobicContact CB-CG1 3.79Å; P27-I32 HydrophobicContact CG-CD1 3.8Å; P27-I32 HydrophobicContact CG-CG1 3.66Å; P27-I32 WeakPolarHBondContact O-CD1 3.46Å; D28-I32 PolarHBondContact O-N 3.25Å; I32-R34 PolarHBondContact O-N 3.22Å; I32-Y35 PolarHBondContact O-N 3.22Å; I32-N36 WeakPolarHBondContact O-CB 3.21Å; I32-N36 PolarHBondContact O-N 3.45Å |
| 33 | R | 57 | Low | 55.2 | Low | 166 Ų | 166 | 127.1 Ų | 127.1 | 63% | 0.626 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -61 | -44.5 | -179.8 | -174.3 | 175.4 | 176.4 | 171.4 | 6.3 | 112 | P29 N36 E37 | P29-R33 WeakPolarHBondContact O-CB 3.17Å; P29-R33 PolarHBondContact O-N 3.43Å; R33-N36 PolarHBondContact O-N 3.23Å; R33-E37 IonicContact NE-OE1 3.22Å; R33-E37 PolarHBondContact NE-OE1 3.45Å; R33-E37 WeakPolarHBondContact O-CB 3.35Å; R33-E37 WeakPolarHBondContact O-CG 3.36Å; R33-E37 PolarHBondContact O-N 2.98Å |
| 34 | R | 57.9 | Low | 54.6 | Low | 198 Ų | 198 | 121.2 Ų | 121.2 | 75% | 0.747 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -69.5 | -31.1 | 176.4 | -76.3 | -161.2 | 179.6 | -170.8 | 3.2 | 113.4 | F30 V31 I32 R38 | F30-R34 WeakPolarHBondContact O-CB 3.49Å; F30-R34 WeakPolarHBondContact O-CG 3.34Å; F30-R34 PolarHBondContact O-N 2.99Å; F30-R34 VanDerWaalsContact O-N 3.1Å; V31-R34 PolarHBondContact O-N 3.32Å; I32-R34 PolarHBondContact O-N 3.22Å; R34-R38 WeakPolarHBondContact O-CB 3.35Å; R34-R38 PolarHBondContact O-N 3.07Å |
| 35 | Y | 58.5 | Low | 54.2 | Low | 159 Ų | 159 | 115.5 Ų | 115.5 | 62% | 0.624 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -68 | -45.9 | 175 | -166.6 | -96.4 | 0 | 0 | 0 | 110.5 | V31 I32 R38 T39 | V31-Y35 WeakPolarHBondContact O-CB 3.38Å; V31-Y35 PolarHBondContact O-N 2.94Å; I32-Y35 PolarHBondContact O-N 3.22Å; Y35-R38 PolarHBondContact O-N 3.47Å; Y35-T39 HydrophobicContact CD1-CG2 4.47Å; Y35-T39 HydrophobicContact CE1-CG2 4.05Å; Y35-T39 PolarHBondContact O-N 3.36Å; Y35-T39 PolarHBondContact O-OG1 3.37Å |
| 36 | N | 55.6 | Low | 53.8 | Low | 69 Ų | 69 | 118.7 Ų | 118.7 | 37% | 0.369 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -68.9 | -39 | -179.8 | -78.9 | -6.9 | 0 | 0 | 0 | 113.9 | I32 R33 R38 T39 Q40 | I32-N36 WeakPolarHBondContact O-CB 3.21Å; I32-N36 PolarHBondContact O-N 3.45Å; R33-N36 PolarHBondContact O-N 3.23Å; N36-R38 PolarHBondContact O-N 3.28Å; N36-T39 WeakPolarHBondContact CA-OG1 3.5Å; N36-T39 PolarHBondContact O-N 2.92Å; N36-T39 PolarHBondContact O-OG1 2.9Å; N36-Q40 WeakPolarHBondContact O-CB 3.37Å; N36-Q40 WeakPolarHBondContact O-CG 3.48Å; N36-Q40 PolarHBondContact O-N 3.33Å |
| 37 | E | 56.3 | Low | 53.5 | Low | 94 Ų | 94 | 118.8 Ų | 118.8 | 44% | 0.439 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -61.4 | -28.4 | 173 | -76.2 | 172.5 | -172.9 | 0 | 0 | 111.8 | R33 N41 | R33-E37 IonicContact NE-OE1 3.22Å; R33-E37 PolarHBondContact NE-OE1 3.45Å; R33-E37 WeakPolarHBondContact O-CB 3.35Å; R33-E37 WeakPolarHBondContact O-CG 3.36Å; R33-E37 PolarHBondContact O-N 2.98Å; E37-N41 PolarHBondContact O-ND2 3.25Å |
| 38 | R | 53.6 | Low | 52.9 | Low | 204 Ų | 204 | 123.1 Ų | 123.1 | 77% | 0.77 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -85.5 | -32.8 | 179.3 | -145.8 | -179.4 | -142 | -159.7 | 4.4 | 113 | R34 Y35 N36 C42 | R34-R38 WeakPolarHBondContact O-CB 3.35Å; R34-R38 PolarHBondContact O-N 3.07Å; Y35-R38 PolarHBondContact O-N 3.47Å; N36-R38 PolarHBondContact O-N 3.28Å; R38-C42 PolarHBondContact O-SG 3.35Å; R38-C42 VanDerWaalsContact O-SG 3.36Å |
| 39 | T | 52.9 | Low | 52.7 | Low | 64 Ų | 64 | 123.9 Ų | 123.9 | 39% | 0.393 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -80.3 | -34.9 | 176.5 | 33.2 | 0 | 0 | 0 | 0 | 113 | Y35 N36 N41 C42 | Y35-T39 HydrophobicContact CD1-CG2 4.47Å; Y35-T39 HydrophobicContact CE1-CG2 4.05Å; Y35-T39 PolarHBondContact O-N 3.36Å; Y35-T39 PolarHBondContact O-OG1 3.37Å; N36-T39 WeakPolarHBondContact CA-OG1 3.5Å; N36-T39 PolarHBondContact O-N 2.92Å; N36-T39 PolarHBondContact O-OG1 2.9Å; T39-N41 VanDerWaalsContact C-N 3.27Å; T39-N41 PolarHBondContact O-N 3Å; T39-C42 PolarHBondContact O-N 3.19Å |
| 40 | Q | 49.5 | Very low | 52.5 | Low | 140 Ų | 140 | 125.6 Ų | 125.6 | 65% | 0.654 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -64.4 | -30.2 | 176.8 | -76.8 | -179.8 | -17.9 | 0 | 0 | 112.9 | N36 C42 | N36-Q40 WeakPolarHBondContact O-CB 3.37Å; N36-Q40 WeakPolarHBondContact O-CG 3.48Å; N36-Q40 PolarHBondContact O-N 3.33Å; Q40-C42 VanDerWaalsContact C-N 3.35Å; Q40-C42 PolarHBondContact O-N 2.92Å |
| 41 | N | 52.7 | Low | 52.4 | Low | 146 Ų | 146 | 126.8 Ų | 126.8 | 78% | 0.781 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -8.6 | 179.2 | -76.1 | -11.6 | 0 | 0 | 0 | 114.8 | E37 T39 | E37-N41 PolarHBondContact O-ND2 3.25Å; T39-N41 VanDerWaalsContact C-N 3.27Å; T39-N41 PolarHBondContact O-N 3Å |
| 42 | C | 55.4 | Low | 52 | Low | 103 Ų | 103 | 131.4 Ų | 131.4 | 70% | 0.696 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.5 | -16.7 | -175.7 | -68.8 | 0 | 0 | 0 | 0 | 114.1 | R38 T39 Q40 | R38-C42 PolarHBondContact O-SG 3.35Å; R38-C42 VanDerWaalsContact O-SG 3.36Å; T39-C42 PolarHBondContact O-N 3.19Å; Q40-C42 VanDerWaalsContact C-N 3.35Å; Q40-C42 PolarHBondContact O-N 2.92Å |
| 43 | C | 50.3 | Low | 51.8 | Low | 107 Ų | 107 | 133.4 Ų | 133.4 | 72% | 0.723 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -144.1 | 80.3 | -175.5 | -63.4 | 0 | 0 | 0 | 0 | 109.4 | S45 | C43-S45 PolarHBondContact O-N 3.03Š|
| 44 | G | 38.3 | Very low | 51.6 | Low | 80 Ų | 80 | 133.5 Ų | 133.5 | 83% | 0.825 | 69% | 0.687 | S | S | * | * | trans | -60.9 | 117.4 | 171 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 45 | S | 42.5 | Very low | 51.1 | Low | 94 Ų | 94 | 132.3 Ų | 132.3 | 66% | 0.657 | 69% | 0.69 | S | S | * | * | trans | -172.9 | 113 | 150.7 | -150.6 | 0 | 0 | 0 | 0 | 106.8 | C43 | C43-S45 PolarHBondContact O-N 3.03Š| ||
| 46 | D | 47.2 | Very low | 50.5 | Low | 131 Ų | 131 | 135.3 Ų | 135.3 | 70% | 0.701 | 70% | 0.702 | S | S | * | * | trans | 41.2 | 94.4 | 136.9 | -42.3 | -47.6 | 0 | 0 | 0 | 115.7 | ||||
| 47 | N | 47.6 | Very low | 50 | Low | 145 Ų | 145 | 137.4 Ų | 137.4 | 78% | 0.775 | 71% | 0.712 | S | S | * | * | 175 | 115.3 | 127.1 | -81 | -36.4 | 0 | 0 | 0 | 109.3 | D49 | N47-D49 PolarHBondContact O-N 2.82Š| |||
| 48 | D | 46.1 | Very low | 49.4 | Very low | 165 Ų | 165 | 137.1 Ų | 137.1 | 88% | 0.882 | 72% | 0.717 | S | S | * | * | trans | -68.3 | 55.1 | 173.9 | -68.8 | -51.5 | 0 | 0 | 0 | 112.5 | I50 | D48-I50 PolarHBondContact O-N 3.03Š| ||
| 49 | D | 51.5 | Low | 48.9 | Very low | 126 Ų | 126 | 135.2 Ų | 135.2 | 67% | 0.674 | 72% | 0.722 | S | S | * | * | trans | -93 | 86.7 | 167.7 | -74.2 | -28.1 | 0 | 0 | 0 | 108.2 | N47 F51 | N47-D49 PolarHBondContact O-N 2.82Å; D49-F51 VanDerWaalsContact C-N 3.3Å; D49-F51 WeakPolarHBondContact O-CD2 3.29Å; D49-F51 PolarHBondContact O-N 3.19Å | ||
| 50 | I | 53.4 | Low | 48.5 | Very low | 127 Ų | 127 | 136.5 Ų | 136.5 | 65% | 0.651 | 73% | 0.733 | S | S | * | * | trans | -55.6 | 96.9 | 164.7 | -62.9 | 169.8 | 0 | 0 | 0 | 106.7 | D48 Y52 | D48-I50 PolarHBondContact O-N 3.03Å; I50-Y52 HydrophobicContact CB-CE2 4.33Å; I50-Y52 HydrophobicContact CG2-CD2 4.23Å; I50-Y52 HydrophobicContact CG2-CE2 3.91Å; I50-Y52 VanDerWaalsContact O-CD2 3.29Å; I50-Y52 WeakPolarHBondContact O-CD2 3.36Å; I50-Y52 PolarHBondContact O-N 2.86Å | ||
| 51 | F | 55.6 | Low | 48.2 | Very low | 183 Ų | 183 | 137.6 Ų | 137.6 | 80% | 0.803 | 74% | 0.736 | S | S | * | * | trans | -63.5 | 98.2 | 170 | -86.8 | -91.7 | 0 | 0 | 0 | 108.2 | D49 | D49-F51 VanDerWaalsContact C-N 3.3Å; D49-F51 WeakPolarHBondContact O-CD2 3.29Å; D49-F51 PolarHBondContact O-N 3.19Å | ||
| 52 | Y | 51.2 | Low | 47.7 | Very low | 184 Ų | 184 | 142.3 Ų | 142.3 | 72% | 0.722 | 74% | 0.743 | S | S | * | * | trans | -64 | 127.1 | 162.2 | -71.9 | -91.2 | 0 | 0 | 0 | 107 | I50 E54 | I50-Y52 HydrophobicContact CB-CE2 4.33Å; I50-Y52 HydrophobicContact CG2-CD2 4.23Å; I50-Y52 HydrophobicContact CG2-CE2 3.91Å; I50-Y52 VanDerWaalsContact O-CD2 3.29Å; I50-Y52 WeakPolarHBondContact O-CD2 3.36Å; I50-Y52 PolarHBondContact O-N 2.86Å; Y52-E54 PolarHBondContact O-N 2.91Å | ||
| 53 | P | 54.7 | Low | 47.1 | Very low | 117 Ų | 117 | 144.8 Ų | 144.8 | 76% | 0.76 | 75% | 0.748 | S | S | * | * | trans | -56.8 | 119.3 | 172.4 | 23.9 | -30.6 | 0 | 0 | 0 | 106.7 | E55 | P53-E55 PolarHBondContact O-N 3.33Š| ||
| 54 | E | 53.7 | Low | 46.9 | Very low | 168 Ų | 168 | 144.2 Ų | 144.2 | 79% | 0.785 | 74% | 0.738 | S | S | * | * | trans | -48.7 | 105.7 | -178.2 | -74.8 | -176.7 | 155 | 0 | 0 | 108.7 | Y52 Y56 | Y52-E54 PolarHBondContact O-N 2.91Å; E54-Y56 PolarHBondContact O-N 2.75Å | ||
| 55 | E | 46.4 | Very low | 47.3 | Very low | 173 Ų | 173 | 145.5 Ų | 145.5 | 81% | 0.808 | 73% | 0.732 | S | S | * | * | trans | -54.6 | 112.6 | 165.7 | -76.2 | -176.8 | 152.3 | 0 | 0 | 106.2 | P53 I57 | P53-E55 PolarHBondContact O-N 3.33Å; E55-I57 VanDerWaalsContact C-N 3.32Å; E55-I57 WeakPolarHBondContact O-CG1 3.42Å; E55-I57 PolarHBondContact O-N 2.77Å | ||
| 56 | Y | 45.1 | Very low | 47.7 | Very low | 221 Ų | 221 | 151.4 Ų | 151.4 | 87% | 0.867 | 74% | 0.74 | S | S | * | * | trans | -2.7 | 82.6 | 162.2 | -62.1 | -89.5 | 0 | 0 | 0 | 112.8 | E54 T58 | E54-Y56 PolarHBondContact O-N 2.75Å; Y56-T58 PolarHBondContact O-N 3.36Å | ||
| 57 | I | 46.7 | Very low | 47.9 | Very low | 114 Ų | 114 | 152.5 Ų | 152.5 | 59% | 0.585 | 74% | 0.744 | S | S | * | * | trans | -75.1 | 77.9 | 172.5 | -55.4 | 178.4 | 0 | 0 | 0 | 104.5 | E55 D59 | E55-I57 VanDerWaalsContact C-N 3.32Å; E55-I57 WeakPolarHBondContact O-CG1 3.42Å; E55-I57 PolarHBondContact O-N 2.77Å; I57-D59 PolarHBondContact O-N 2.86Å | ||
| 58 | T | 42.7 | Very low | 47.6 | Very low | 88 Ų | 88 | 148.9 Ų | 148.9 | 54% | 0.54 | 74% | 0.741 | S | S | . | * | trans | -53.5 | 128.4 | 158.3 | 51.1 | 0 | 0 | 0 | 0 | 106.2 | Y56 S60 K61 | Y56-T58 PolarHBondContact O-N 3.36Å; T58-S60 PolarHBondContact O-N 2.65Å; T58-K61 PolarHBondContact O-N 3.3Å | ||
| 59 | D | 43.8 | Very low | 47.8 | Very low | 163 Ų | 163 | 149.2 Ų | 149.2 | 87% | 0.872 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.9 | 8.8 | -171.5 | -75.3 | -54.9 | 0 | 0 | 0 | 117.6 | I57 | I57-D59 PolarHBondContact O-N 2.86Š|
| 60 | S | 44.4 | Very low | 47.5 | Very low | 91 Ų | 91 | 152.6 Ų | 152.6 | 64% | 0.636 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | -6.7 | -178.9 | 63.2 | 0 | 0 | 0 | 0 | 115.2 | T58 | T58-S60 PolarHBondContact O-N 2.65Š|
| 61 | K | 42.9 | Very low | 47.3 | Very low | 163 Ų | 163 | 158.3 Ų | 158.3 | 71% | 0.709 | 76% | 0.759 | S | S | * | * | trans | -109.2 | 35.3 | -178.9 | -69.4 | -170.7 | -177.4 | 177.1 | 0 | 114.9 | T58 L63 | T58-K61 PolarHBondContact O-N 3.3Å; K61-L63 PolarHBondContact O-N 2.83Å | ||
| 62 | R | 42.4 | Very low | 46.9 | Very low | 245 Ų | 245 | 157.9 Ų | 157.9 | 93% | 0.925 | 76% | 0.757 | S | S | * | * | trans | -65.7 | 20.7 | 166.8 | -121.9 | -180 | -174.3 | 144.3 | 2.1 | 114.4 | ||||
| 63 | L | 43.4 | Very low | 46.6 | Very low | 155 Ų | 155 | 158.7 Ų | 158.7 | 81% | 0.812 | 76% | 0.764 | S | S | * | * | trans | -102.8 | 69.1 | 175.5 | -86.3 | 148.9 | 0 | 0 | 0 | 108.1 | K61 P65 | K61-L63 PolarHBondContact O-N 2.83Å; L63-P65 WeakPolarHBondContact O-CD 3.38Å | ||
| 64 | D | 45.3 | Very low | 46 | Very low | 95 Ų | 95 | 157.8 Ų | 157.8 | 51% | 0.508 | 75% | 0.752 | S | S | . | * | trans | -90.2 | 107.5 | 162.9 | -146.7 | -15.6 | 0 | 0 | 0 | 107.2 | R66 I67 | D64-R66 PolarHBondContact O-N 3.27Å; D64-I67 HydrophobicContact CB-CD1 4.27Å; D64-I67 PolarHBondContact O-N 3.07Å | ||
| 65 | P | 47.1 | Very low | 45.7 | Very low | 107 Ų | 107 | 153 Ų | 153 | 70% | 0.695 | 75% | 0.747 | S | S | * | * | G | 310 helix | trans | -67 | -10.1 | -175.6 | -15.7 | 30.3 | 0 | 0 | 0 | 112.8 | L63 I67 G68 | L63-P65 WeakPolarHBondContact O-CD 3.38Å; P65-I67 PolarHBondContact O-N 3.28Å; P65-G68 PolarHBondContact O-N 3.27Å |
| 66 | R | 50.4 | Low | 45.8 | Very low | 219 Ų | 219 | 151.6 Ų | 151.6 | 83% | 0.826 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -73.3 | -7.8 | 178 | -58.8 | -173.3 | -155.6 | -159.9 | 5.2 | 113.6 | D64 | D64-R66 PolarHBondContact O-N 3.27Š|
| 67 | I | 50.7 | Low | 45.6 | Very low | 153 Ų | 153 | 141.9 Ų | 141.9 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -89.9 | -2.8 | 176 | -63.6 | 171.7 | 0 | 0 | 0 | 111.9 | D64 P65 | D64-I67 HydrophobicContact CB-CD1 4.27Å; D64-I67 PolarHBondContact O-N 3.07Å; P65-I67 PolarHBondContact O-N 3.28Å |
| 68 | G | 43 | Very low | 45.5 | Very low | 70 Ų | 70 | 145.3 Ų | 145.3 | 72% | 0.722 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -106.8 | -6.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | P65 | P65-G68 PolarHBondContact O-N 3.27Š|
| 69 | E | 49.1 | Very low | 45.8 | Very low | 171 Ų | 171 | 148.1 Ų | 148.1 | 80% | 0.799 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -101.2 | 115.7 | -171.5 | -138.4 | 171.9 | -176.3 | 0 | 0 | 112.5 | R71 | E69-R71 PolarHBondContact O-N 3.27Š|
| 70 | K | 45.8 | Very low | 45.8 | Very low | 198 Ų | 198 | 150.2 Ų | 150.2 | 86% | 0.861 | 74% | 0.735 | S | S | * | * | trans | -34.1 | 102.2 | -177.9 | -66 | 168.9 | 179.6 | 172.2 | 0 | 113.3 | K72 | K70-K72 PolarHBondContact O-N 2.88Š| ||
| 71 | R | 50 | Low | 45.5 | Very low | 246 Ų | 246 | 153.3 Ų | 153.3 | 93% | 0.928 | 78% | 0.782 | S | S | * | * | trans | -63.6 | 88 | 155.4 | -73.6 | -170.9 | 174.3 | -168.8 | -1.9 | 108.2 | E69 K73 | E69-R71 PolarHBondContact O-N 3.27Å; R71-K73 PolarHBondContact O-N 2.78Å; R71-K73 VanDerWaalsContact O-N 3.1Å | ||
| 72 | K | 46.8 | Very low | 45.7 | Very low | 175 Ų | 175 | 152.9 Ų | 152.9 | 76% | 0.761 | 79% | 0.785 | S | S | * | * | trans | -62.3 | 110.7 | 166.2 | -147.9 | 176.6 | -172.7 | -176.6 | 0 | 105.2 | K70 I74 Y79 | K70-K72 PolarHBondContact O-N 2.88Å; K72-I74 PolarHBondContact O-N 3.02Å; K72-Y79 PolarHBondContact O-OH 3.23Å | ||
| 73 | K | 43.5 | Very low | 45.8 | Very low | 200 Ų | 200 | 148 Ų | 148 | 87% | 0.87 | 78% | 0.778 | S | S | * | * | trans | -61.6 | 119.6 | 175.5 | -83.3 | -176.5 | 175 | -178.4 | 0 | 108.6 | R71 | R71-K73 PolarHBondContact O-N 2.78Å; R71-K73 VanDerWaalsContact O-N 3.1Å | ||
| 74 | I | 42.7 | Very low | 46 | Very low | 99 Ų | 99 | 147.6 Ų | 147.6 | 51% | 0.508 | 78% | 0.776 | S | S | . | * | trans | -125.8 | 86.4 | 147 | -56.8 | 170.3 | 0 | 0 | 0 | 105.9 | K72 G77 Y79 | K72-I74 PolarHBondContact O-N 3.02Å; I74-G77 PolarHBondContact O-N 2.9Å; I74-Y79 HydrophobicContact CB-CE2 4.01Å; I74-Y79 VanDerWaalsContact CB-OH 3.27Å; I74-Y79 WeakPolarHBondContact CB-OH 3.05Å; I74-Y79 HydrophobicContact CD1-CE1 4.49Å; I74-Y79 VanDerWaalsContact CD1-OH 3.23Å; I74-Y79 WeakPolarHBondContact CD1-OH 3.38Å; I74-Y79 WeakPolarHBondContact CG1-OH 3.27Å; I74-Y79 PolarHBondContact N-OH 3.1Å | ||
| 75 | G | 47.7 | Very low | 46 | Very low | 66 Ų | 66 | 150.7 Ų | 150.7 | 68% | 0.68 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | 153 | 157.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 76 | P | 47.8 | Very low | 45.9 | Very low | 145 Ų | 145 | 153.4 Ų | 153.4 | 94% | 0.942 | 80% | 0.798 | S | S | * | * | T | Hydrogen-bonded Turn | cis | -85.6 | 58.9 | -40.2 | 35.2 | -22.5 | 0 | 0 | 0 | 107.4 | ||
| 77 | G | 40.9 | Very low | 45.6 | Very low | 17 Ų | 17 | 149.1 Ų | 149.1 | 18% | 0.175 | 80% | 0.796 | C | S | . | * | trans | -116 | 112 | -167.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | I74 Y79 | I74-G77 PolarHBondContact O-N 2.9Å; G77-Y79 WeakPolarHBondContact O-CE2 3.23Å | ||
| 78 | F | 45 | Very low | 45.3 | Very low | 186 Ų | 186 | 148.8 Ų | 148.8 | 82% | 0.816 | 80% | 0.797 | S | S | * | * | trans | 33 | 113.9 | 145.4 | -65.2 | -88.3 | 0 | 0 | 0 | 118.2 | ||||
| 79 | Y | 48.4 | Very low | 45.4 | Very low | 147 Ų | 147 | 154.8 Ų | 154.8 | 58% | 0.576 | 80% | 0.802 | S | S | * | * | trans | -136.4 | 111.4 | 150.9 | -65.3 | -82.7 | 0 | 0 | 0 | 108.9 | K72 I74 G77 | K72-Y79 PolarHBondContact O-OH 3.23Å; I74-Y79 HydrophobicContact CB-CE2 4.01Å; I74-Y79 VanDerWaalsContact CB-OH 3.27Å; I74-Y79 WeakPolarHBondContact CB-OH 3.05Å; I74-Y79 HydrophobicContact CD1-CE1 4.49Å; I74-Y79 VanDerWaalsContact CD1-OH 3.23Å; I74-Y79 WeakPolarHBondContact CD1-OH 3.38Å; I74-Y79 WeakPolarHBondContact CG1-OH 3.27Å; I74-Y79 PolarHBondContact N-OH 3.1Å; G77-Y79 WeakPolarHBondContact O-CE2 3.23Å | ||
| 80 | F | 44.7 | Very low | 45.1 | Very low | 207 Ų | 207 | 153.5 Ų | 153.5 | 91% | 0.908 | 80% | 0.803 | S | S | * | * | trans | -116.5 | 127.1 | 160.4 | -84.1 | -86.2 | 0 | 0 | 0 | 106.1 | ||||
| 81 | G | 38.5 | Very low | 45.1 | Very low | 156 Ų | 156 | 149.5 Ų | 149.5 | 100% | 1.608 | 80% | 0.797 | S | S | * | * | trans | 143.4 | 0 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112 |
Retrieved 81 of 81 residues in 36.7 ms
(Link to these results)