| 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 | 42.7 | Very low | 51.5 | Low | 239 Ų | 239 | 119.4 Ų | 119.4 | 100% | 1.177 | 70% | 0.696 | S | S | * | * | 0 | 46 | 0 | -150.3 | 174.9 | -165.8 | 0 | 0 | 111.6 | |||||
| 2 | F | 51 | Low | 51.5 | Low | 185 Ų | 185 | 116.6 Ų | 116.6 | 81% | 0.811 | 69% | 0.688 | S | S | * | * | trans | -135.6 | -9.2 | -179.3 | -113.3 | -87.6 | 0 | 0 | 0 | 112.8 | ||||
| 3 | T | 51.5 | Low | 51 | Low | 106 Ų | 106 | 112.9 Ų | 112.9 | 65% | 0.65 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -77.1 | -28.7 | -173.7 | 46.3 | 0 | 0 | 0 | 0 | 113 | ||
| 4 | N | 53.5 | Low | 51 | Low | 132 Ų | 132 | 113.1 Ų | 113.1 | 71% | 0.706 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -77.1 | -28.7 | -172.6 | -61.7 | 1 | 0 | 0 | 0 | 112.3 | A8 | N4-A8 PolarHBondContact O-N 3.44Å |
| 5 | T | 53.8 | Low | 50.9 | Low | 110 Ų | 110 | 116.7 Ų | 116.7 | 68% | 0.675 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -74.2 | -32.2 | -179.9 | -29.7 | 0 | 0 | 0 | 0 | 112.2 | G9 | T5-G9 PolarHBondContact O-N 2.84Å |
| 6 | L | 54.6 | Low | 51.1 | Low | 127 Ų | 127 | 119.1 Ų | 119.1 | 67% | 0.665 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -71.2 | -39.4 | 177.4 | -164.5 | 75.3 | 0 | 0 | 0 | 111.6 | G9 L10 | L6-G9 PolarHBondContact O-N 3.34Å; L6-L10 PolarHBondContact O-N 3.1Å |
| 7 | A | 49.3 | Very low | 50.9 | Low | 63 Ų | 63 | 125.9 Ų | 125.9 | 52% | 0.521 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -65.9 | -37.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S11 | A7-S11 WeakPolarHBondContact O-CB 3.3Å; A7-S11 PolarHBondContact O-N 3.04Å; A7-S11 VanDerWaalsContact O-N 3.14Å |
| 8 | A | 53 | Low | 51.3 | Low | 63 Ų | 63 | 126.6 Ų | 126.6 | 52% | 0.521 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -67.7 | -36 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | N4 S11 S12 | N4-A8 PolarHBondContact O-N 3.44Å; A8-S11 PolarHBondContact O-N 2.77Å; A8-S12 PolarHBondContact O-N 3.02Å |
| 9 | G | 55.5 | Low | 51.6 | Low | 49 Ų | 49 | 126.3 Ų | 126.3 | 51% | 0.505 | 71% | 0.709 | S | S | . | * | H | α-helix | trans | -68.2 | -34.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | T5 L6 | T5-G9 PolarHBondContact O-N 2.84Å; L6-G9 PolarHBondContact O-N 3.34Å |
| 10 | L | 52.6 | Low | 51.9 | Low | 140 Ų | 140 | 124.2 Ų | 124.2 | 73% | 0.733 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -81.1 | -21.2 | 175.6 | -68.5 | 171.1 | 0 | 0 | 0 | 113.1 | L6 | L6-L10 PolarHBondContact O-N 3.1Å |
| 11 | S | 49.1 | Very low | 51.9 | Low | 99 Ų | 99 | 121.6 Ų | 121.6 | 69% | 0.692 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -84.7 | -13.7 | 176.3 | -172 | 0 | 0 | 0 | 0 | 113.2 | A7 A8 G13 | A7-S11 WeakPolarHBondContact O-CB 3.3Å; A7-S11 PolarHBondContact O-N 3.04Å; A7-S11 VanDerWaalsContact O-N 3.14Å; A8-S11 PolarHBondContact O-N 2.77Å; S11-G13 PolarHBondContact O-N 3.46Å |
| 12 | S | 51.7 | Low | 52.5 | Low | 86 Ų | 86 | 113.6 Ų | 113.6 | 60% | 0.601 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -80.5 | 84 | 176.9 | 174.7 | 0 | 0 | 0 | 0 | 110.7 | A8 I14 | A8-S12 PolarHBondContact O-N 3.02Å; S12-I14 PolarHBondContact O-N 2.72Å |
| 13 | G | 44.9 | Very low | 52.5 | Low | 69 Ų | 69 | 111.3 Ų | 111.3 | 71% | 0.711 | 65% | 0.653 | S | S | * | * | trans | 48.4 | 64.2 | 137.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | S11 | S11-G13 PolarHBondContact O-N 3.46Š| ||
| 14 | I | 51.5 | Low | 52.4 | Low | 116 Ų | 116 | 111 Ų | 111 | 60% | 0.595 | 65% | 0.651 | S | S | * | * | trans | -107.1 | 87.6 | 160.7 | 3.9 | -178.3 | 0 | 0 | 0 | 109.4 | S12 F16 | S12-I14 PolarHBondContact O-N 2.72Å; I14-F16 HydrophobicContact CB-CD2 3.81Å; I14-F16 HydrophobicContact CB-CE2 4.3Å; I14-F16 HydrophobicContact CG2-CD2 3.07Å; I14-F16 HydrophobicContact CG2-CE2 3.11Å; I14-F16 HydrophobicContact CG2-CG 4.14Å; I14-F16 HydrophobicContact CG2-CZ 4.19Å; I14-F16 PolarHBondContact O-N 2.9Å | ||
| 15 | D | 49.7 | Very low | 52.2 | Low | 167 Ų | 167 | 108.4 Ų | 108.4 | 89% | 0.893 | 64% | 0.64 | S | S | * | * | trans | -61.6 | 31.9 | 162.2 | -89.1 | -38.9 | 0 | 0 | 0 | 112.4 | R17 | D15-R17 PolarHBondContact O-N 2.84Å; D15-R17 VanDerWaalsContact O-N 3.15Å | ||
| 16 | F | 52.8 | Low | 52.1 | Low | 155 Ų | 155 | 108.4 Ų | 108.4 | 68% | 0.68 | 63% | 0.634 | S | S | * | * | trans | -75.4 | 111.8 | 168.1 | -70.2 | -53.3 | 0 | 0 | 0 | 107.3 | I14 I18 | I14-F16 HydrophobicContact CB-CD2 3.81Å; I14-F16 HydrophobicContact CB-CE2 4.3Å; I14-F16 HydrophobicContact CG2-CD2 3.07Å; I14-F16 HydrophobicContact CG2-CE2 3.11Å; I14-F16 HydrophobicContact CG2-CG 4.14Å; I14-F16 HydrophobicContact CG2-CZ 4.19Å; I14-F16 PolarHBondContact O-N 2.9Å; F16-I18 HydrophobicContact CB-CG1 4.31Å; F16-I18 WeakPolarHBondContact O-CG1 3.25Å; F16-I18 PolarHBondContact O-N 3.28Å | ||
| 17 | R | 48.8 | Very low | 52.1 | Low | 235 Ų | 235 | 107.7 Ų | 107.7 | 89% | 0.887 | 63% | 0.627 | S | S | * | * | trans | -57.1 | 79.3 | 161.5 | -158.3 | 179.8 | -167.3 | -124.9 | 4.1 | 107.7 | D15 V19 | D15-R17 PolarHBondContact O-N 2.84Å; D15-R17 VanDerWaalsContact O-N 3.15Å; R17-V19 VanDerWaalsContact C-N 3.29Å; R17-V19 PolarHBondContact O-N 3Å | ||
| 18 | I | 57.8 | Low | 52.6 | Low | 138 Ų | 138 | 109.3 Ų | 109.3 | 71% | 0.708 | 63% | 0.63 | S | S | * | * | trans | -68 | 96.1 | 175.3 | -66 | 168.1 | 0 | 0 | 0 | 105.1 | F16 A20 | F16-I18 HydrophobicContact CB-CG1 4.31Å; F16-I18 WeakPolarHBondContact O-CG1 3.25Å; F16-I18 PolarHBondContact O-N 3.28Å; I18-A20 PolarHBondContact O-N 2.78Å; I18-A20 VanDerWaalsContact O-N 3.09Å | ||
| 19 | V | 57.2 | Low | 52.7 | Low | 121 Ų | 121 | 111.3 Ų | 111.3 | 73% | 0.733 | 63% | 0.632 | S | S | * | * | trans | -54.9 | 115.1 | 159.7 | 176.9 | 0 | 0 | 0 | 0 | 105 | R17 P21 | R17-V19 VanDerWaalsContact C-N 3.29Å; R17-V19 PolarHBondContact O-N 3Å; V19-P21 WeakPolarHBondContact O-CD 3.49Å | ||
| 20 | A | 56.4 | Low | 52.8 | Low | 84 Ų | 84 | 111.3 Ų | 111.3 | 69% | 0.694 | 62% | 0.62 | S | S | * | * | trans | -52.2 | 112.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | I18 S22 | I18-A20 PolarHBondContact O-N 2.78Å; I18-A20 VanDerWaalsContact O-N 3.09Å; A20-S22 PolarHBondContact O-N 3.41Å; A20-S22 VanDerWaalsContact O-N 3.15Å | ||
| 21 | P | 52.1 | Low | 53 | Low | 70 Ų | 70 | 109.3 Ų | 109.3 | 46% | 0.455 | 61% | 0.61 | S | S | . | * | trans | -62.2 | 124.6 | 172.5 | -11 | 24.6 | 0 | 0 | 0 | 105.8 | V19 F23 M26 | V19-P21 WeakPolarHBondContact O-CD 3.49Å; P21-F23 PolarHBondContact O-N 3.17Å; P21-M26 HydrophobicContact CG-CE 4.49Å | ||
| 22 | S | 55.1 | Low | 53.4 | Low | 71 Ų | 71 | 106.6 Ų | 106.6 | 50% | 0.497 | 59% | 0.594 | S | S | . | * | trans | -51.9 | 138.6 | 171.7 | 68.1 | 0 | 0 | 0 | 0 | 108.4 | A20 V24 T25 | A20-S22 PolarHBondContact O-N 3.41Å; A20-S22 VanDerWaalsContact O-N 3.15Å; S22-V24 PolarHBondContact O-N 3.25Å; S22-T25 PolarHBondContact N-OG1 2.81Å; S22-T25 PolarHBondContact O-N 2.88Å; S22-T25 PolarHBondContact O-OG1 3.1Å; S22-T25 PolarHBondContact OG-OG1 3.19Å | ||
| 23 | F | 51.5 | Low | 53.7 | Low | 136 Ų | 136 | 106.7 Ų | 106.7 | 60% | 0.596 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -52.8 | -24.7 | -177.5 | -173.8 | -111.3 | 0 | 0 | 0 | 113 | P21 M26 Q27 | P21-F23 PolarHBondContact O-N 3.17Å; F23-M26 PolarHBondContact O-N 3.34Å; F23-Q27 PolarHBondContact O-N 3.41Å |
| 24 | V | 48.9 | Very low | 54.2 | Low | 101 Ų | 101 | 105.9 Ų | 105.9 | 61% | 0.612 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61.3 | -44.7 | 173.8 | -179.5 | 0 | 0 | 0 | 0 | 112.2 | S22 M26 Q27 V28 | S22-V24 PolarHBondContact O-N 3.25Å; V24-M26 VanDerWaalsContact C-N 3.29Å; V24-M26 PolarHBondContact O-N 2.9Å; V24-Q27 PolarHBondContact O-N 3.09Å; V24-V28 WeakPolarHBondContact O-CG2 3.29Å; V24-V28 PolarHBondContact O-N 2.88Å |
| 25 | T | 50.6 | Low | 54.4 | Low | 76 Ų | 76 | 104.5 Ų | 104.5 | 47% | 0.466 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -65.7 | -29.8 | -178.6 | 19.2 | 0 | 0 | 0 | 0 | 113.4 | S22 L29 | S22-T25 PolarHBondContact N-OG1 2.81Å; S22-T25 PolarHBondContact O-N 2.88Å; S22-T25 PolarHBondContact O-OG1 3.1Å; S22-T25 PolarHBondContact OG-OG1 3.19Å; T25-L29 PolarHBondContact O-N 3.28Å; T25-L29 VanDerWaalsContact O-N 3.17Å |
| 26 | M | 51.5 | Low | 54.7 | Low | 110 Ų | 110 | 102.7 Ų | 102.7 | 54% | 0.542 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -74.6 | -36.1 | 178.4 | -67.8 | -61 | -134 | 0 | 0 | 112.5 | P21 F23 V24 L29 L30 | P21-M26 HydrophobicContact CG-CE 4.49Å; F23-M26 PolarHBondContact O-N 3.34Å; V24-M26 VanDerWaalsContact C-N 3.29Å; V24-M26 PolarHBondContact O-N 2.9Å; M26-L29 PolarHBondContact O-N 3.46Å; M26-L30 WeakPolarHBondContact O-CB 3.2Å; M26-L30 PolarHBondContact O-N 3.42Å |
| 27 | Q | 54.3 | Low | 54.7 | Low | 112 Ų | 112 | 101.6 Ų | 101.6 | 52% | 0.523 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -66.8 | -42.7 | 176.4 | -71.5 | -176.8 | 32.8 | 0 | 0 | 111.4 | F23 V24 L29 L30 D31 | F23-Q27 PolarHBondContact O-N 3.41Å; V24-Q27 PolarHBondContact O-N 3.09Å; Q27-L29 VanDerWaalsContact C-N 3.33Å; Q27-L29 PolarHBondContact O-N 3.47Å; Q27-L30 PolarHBondContact O-N 2.88Å; Q27-D31 VanDerWaalsContact O-CB 3.29Å; Q27-D31 WeakPolarHBondContact O-CB 3.35Å; Q27-D31 PolarHBondContact O-N 3.2Å |
| 28 | V | 59.2 | Low | 54.5 | Low | 98 Ų | 98 | 95 Ų | 95 | 59% | 0.594 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.1 | -39.6 | 177.7 | 177.4 | 0 | 0 | 0 | 0 | 111.1 | V24 A32 | V24-V28 WeakPolarHBondContact O-CG2 3.29Å; V24-V28 PolarHBondContact O-N 2.88Å; V28-A32 WeakPolarHBondContact O-CB 3.13Å; V28-A32 PolarHBondContact O-N 3.48Å |
| 29 | L | 56.4 | Low | 54.6 | Low | 104 Ų | 104 | 95 Ų | 95 | 55% | 0.545 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67 | -39.9 | 176.7 | -173.7 | 65.8 | 0 | 0 | 0 | 111.9 | T25 M26 Q27 L33 | T25-L29 PolarHBondContact O-N 3.28Å; T25-L29 VanDerWaalsContact O-N 3.17Å; M26-L29 PolarHBondContact O-N 3.46Å; Q27-L29 VanDerWaalsContact C-N 3.33Å; Q27-L29 PolarHBondContact O-N 3.47Å; L29-L33 HydrophobicContact CD1-CD1 4.1Å; L29-L33 HydrophobicContact CG-CD1 4.32Å; L29-L33 WeakPolarHBondContact O-CB 3.25Å; L29-L33 PolarHBondContact O-N 3.29Å |
| 30 | L | 56.7 | Low | 54.6 | Low | 50 Ų | 50 | 94.4 Ų | 94.4 | 26% | 0.262 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -71 | -39.9 | -179.5 | -162.8 | 69 | 0 | 0 | 0 | 111.9 | M26 Q27 L33 C34 I80 L81 | M26-L30 WeakPolarHBondContact O-CB 3.2Å; M26-L30 PolarHBondContact O-N 3.42Å; Q27-L30 PolarHBondContact O-N 2.88Å; L30-L33 PolarHBondContact O-N 2.84Å; L30-C34 WeakPolarHBondContact O-CB 3.35Å; L30-C34 PolarHBondContact O-N 3.21Å; L30-C34 PolarHBondContact O-SG 3.43Å; L30-I80 HydrophobicContact CD1-CG2 4.18Å; L30-L81 HydrophobicContact CD2-CD2 3.79Å |
| 31 | D | 56.9 | Low | 54.4 | Low | 98 Ų | 98 | 100.6 Ų | 100.6 | 52% | 0.524 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -69.8 | -39.2 | 175.9 | -162.8 | 43.1 | 0 | 0 | 0 | 111.1 | Q27 C34 N35 | Q27-D31 VanDerWaalsContact O-CB 3.29Å; Q27-D31 WeakPolarHBondContact O-CB 3.35Å; Q27-D31 PolarHBondContact O-N 3.2Å; D31-C34 PolarHBondContact O-N 2.86Å; D31-N35 WeakPolarHBondContact O-CB 3.39Å; D31-N35 VanDerWaalsContact O-CG 3.26Å; D31-N35 PolarHBondContact O-N 3Å; D31-N35 PolarHBondContact O-ND2 2.91Å; D31-N35 PolarHBondContact OD1-ND2 2.81Å; D31-N35 PolarHBondContact OD2-ND2 3.36Å |
| 32 | A | 57.9 | Low | 54.7 | Low | 42 Ų | 42 | 99.9 Ų | 99.9 | 35% | 0.347 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.1 | -37.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | V28 N36 | V28-A32 WeakPolarHBondContact O-CB 3.13Å; V28-A32 PolarHBondContact O-N 3.48Å; A32-N36 VanDerWaalsContact O-CB 3.25Å; A32-N36 WeakPolarHBondContact O-CB 3.4Å; A32-N36 VanDerWaalsContact O-CG 3.31Å; A32-N36 PolarHBondContact O-N 3.3Å |
| 33 | L | 56.5 | Low | 54.6 | Low | 88 Ų | 88 | 102.1 Ų | 102.1 | 46% | 0.461 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.5 | -39 | 176.3 | -118.6 | 82.1 | 0 | 0 | 0 | 112 | L29 L30 | L29-L33 HydrophobicContact CD1-CD1 4.1Å; L29-L33 HydrophobicContact CG-CD1 4.32Å; L29-L33 WeakPolarHBondContact O-CB 3.25Å; L29-L33 PolarHBondContact O-N 3.29Å; L30-L33 PolarHBondContact O-N 2.84Å |
| 34 | C | 56 | Low | 54.6 | Low | 52 Ų | 52 | 103.3 Ų | 103.3 | 35% | 0.351 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -79.2 | -37.3 | -179 | -75.5 | 0 | 0 | 0 | 0 | 112.7 | L30 D31 | L30-C34 WeakPolarHBondContact O-CB 3.35Å; L30-C34 PolarHBondContact O-N 3.21Å; L30-C34 PolarHBondContact O-SG 3.43Å; D31-C34 PolarHBondContact O-N 2.86Å |
| 35 | N | 56.7 | Low | 54.6 | Low | 87 Ų | 87 | 103.5 Ų | 103.5 | 47% | 0.465 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -81 | -25 | -177.3 | -68.8 | -29 | 0 | 0 | 0 | 113.7 | D31 L37 S38 | D31-N35 WeakPolarHBondContact O-CB 3.39Å; D31-N35 VanDerWaalsContact O-CG 3.26Å; D31-N35 PolarHBondContact O-N 3Å; D31-N35 PolarHBondContact O-ND2 2.91Å; D31-N35 PolarHBondContact OD1-ND2 2.81Å; D31-N35 PolarHBondContact OD2-ND2 3.36Å; N35-L37 PolarHBondContact O-N 3.15Å; N35-L37 VanDerWaalsContact O-N 3.1Å; N35-S38 PolarHBondContact O-N 2.91Å; N35-S38 PolarHBondContact O-OG 2.65Å |
| 36 | N | 55.9 | Low | 54.6 | Low | 129 Ų | 129 | 106.6 Ų | 106.6 | 69% | 0.69 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.1 | -0.5 | 176.4 | -84.2 | 4.6 | 0 | 0 | 0 | 114.7 | A32 S38 | A32-N36 VanDerWaalsContact O-CB 3.25Å; A32-N36 WeakPolarHBondContact O-CB 3.4Å; A32-N36 VanDerWaalsContact O-CG 3.31Å; A32-N36 PolarHBondContact O-N 3.3Å; N36-S38 PolarHBondContact O-N 3.15Å |
| 37 | L | 51.4 | Low | 54.3 | Low | 132 Ų | 132 | 111 Ų | 111 | 69% | 0.691 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | 0.1 | 171.5 | -71.3 | 168.9 | 0 | 0 | 0 | 113.5 | N35 I39 | N35-L37 PolarHBondContact O-N 3.15Å; N35-L37 VanDerWaalsContact O-N 3.1Å; L37-I39 PolarHBondContact O-N 3.43Å; L37-I39 VanDerWaalsContact O-N 3.17Å |
| 38 | S | 45.8 | Very low | 53.9 | Low | 97 Ų | 97 | 111 Ų | 111 | 68% | 0.678 | 62% | 0.624 | S | S | * | * | trans | -85.7 | 58.4 | 167.4 | 56.5 | 0 | 0 | 0 | 0 | 111.2 | N35 N36 P40 | N35-S38 PolarHBondContact O-N 2.91Å; N35-S38 PolarHBondContact O-OG 2.65Å; N36-S38 PolarHBondContact O-N 3.15Å; S38-P40 VanDerWaalsContact O-CD 3.25Å; S38-P40 WeakPolarHBondContact O-CD 3.47Å | ||
| 39 | I | 59.1 | Low | 53.4 | Low | 136 Ų | 136 | 115.8 Ų | 115.8 | 70% | 0.697 | 64% | 0.636 | S | S | * | * | trans | -65.2 | 116 | 165.4 | -61.6 | 167.8 | 0 | 0 | 0 | 105.8 | L37 F41 | L37-I39 PolarHBondContact O-N 3.43Å; L37-I39 VanDerWaalsContact O-N 3.17Å; I39-F41 PolarHBondContact O-N 3.33Å | ||
| 40 | P | 56.9 | Low | 53.2 | Low | 109 Ų | 109 | 115.4 Ų | 115.4 | 71% | 0.708 | 64% | 0.643 | S | S | * | * | trans | -60.2 | 128 | 174.8 | 25.9 | -31.7 | 0 | 0 | 0 | 106.8 | S38 G42 | S38-P40 VanDerWaalsContact O-CD 3.25Å; S38-P40 WeakPolarHBondContact O-CD 3.47Å; P40-G42 PolarHBondContact O-N 3.48Å | ||
| 41 | F | 54 | Low | 52.8 | Low | 214 Ų | 214 | 119.2 Ų | 119.2 | 94% | 0.939 | 67% | 0.671 | S | S | * | * | trans | -42 | 108.7 | 169.2 | -83.9 | -92.7 | 0 | 0 | 0 | 108.2 | I39 | I39-F41 PolarHBondContact O-N 3.33Š| ||
| 42 | G | 56.9 | Low | 52.7 | Low | 56 Ų | 56 | 120.1 Ų | 120.1 | 58% | 0.577 | 68% | 0.68 | S | S | * | * | trans | -57.4 | 153.9 | -177 | 0 | 0 | 0 | 0 | 0 | 110.4 | P40 N44 | P40-G42 PolarHBondContact O-N 3.48Å; G42-N44 PolarHBondContact O-N 3.17Å | ||
| 43 | P | 53.4 | Low | 52.6 | Low | 117 Ų | 117 | 123 Ų | 123 | 76% | 0.76 | 70% | 0.703 | S | S | * | * | trans | -53.5 | 133.4 | -177 | 22.6 | -32.4 | 0 | 0 | 0 | 109.8 | V45 | P43-V45 VanDerWaalsContact C-N 3.3Å; P43-V45 VanDerWaalsContact O-CG2 3.3Å; P43-V45 WeakPolarHBondContact O-CG2 3.16Å; P43-V45 PolarHBondContact O-N 3.48Å | ||
| 44 | N | 51.2 | Low | 52.7 | Low | 162 Ų | 162 | 126.4 Ų | 126.4 | 87% | 0.866 | 72% | 0.719 | S | S | * | * | trans | -61.7 | 88.5 | -179.8 | -160.2 | -3.4 | 0 | 0 | 0 | 108.9 | G42 L46 | G42-N44 PolarHBondContact O-N 3.17Å; N44-L46 PolarHBondContact O-N 3.46Å | ||
| 45 | V | 49.4 | Very low | 52.8 | Low | 104 Ų | 104 | 127.7 Ų | 127.7 | 63% | 0.63 | 73% | 0.733 | S | S | * | * | trans | -74.7 | 100.5 | -179.5 | -170.3 | 0 | 0 | 0 | 0 | 107.6 | P43 F47 | P43-V45 VanDerWaalsContact C-N 3.3Å; P43-V45 VanDerWaalsContact O-CG2 3.3Å; P43-V45 WeakPolarHBondContact O-CG2 3.16Å; P43-V45 PolarHBondContact O-N 3.48Å; V45-F47 PolarHBondContact O-N 3.01Å | ||
| 46 | L | 50.1 | Low | 52.8 | Low | 141 Ų | 141 | 127.6 Ų | 127.6 | 74% | 0.738 | 74% | 0.738 | S | S | * | * | trans | -53.5 | 105.1 | 163.5 | -105.2 | 148.3 | 0 | 0 | 0 | 108.5 | N44 T48 | N44-L46 PolarHBondContact O-N 3.46Å; L46-T48 PolarHBondContact O-N 2.89Å | ||
| 47 | F | 46.2 | Very low | 52.8 | Low | 204 Ų | 204 | 126.3 Ų | 126.3 | 90% | 0.895 | 73% | 0.734 | S | S | * | * | trans | -62.4 | 82.5 | 172 | -73.8 | -83.7 | 0 | 0 | 0 | 110.1 | V45 | V45-F47 PolarHBondContact O-N 3.01Š| ||
| 48 | T | 44.9 | Very low | 53.2 | Low | 111 Ų | 111 | 126.3 Ų | 126.3 | 68% | 0.681 | 74% | 0.735 | S | S | * | * | trans | -138.5 | 132.6 | 167.6 | 52.5 | 0 | 0 | 0 | 0 | 108.9 | L46 | L46-T48 PolarHBondContact O-N 2.89Š| ||
| 49 | K | 50.3 | Low | 53.7 | Low | 198 Ų | 198 | 125.3 Ų | 125.3 | 86% | 0.861 | 73% | 0.733 | S | S | * | * | S | Bend | trans | 83.2 | 90.6 | 176.4 | -80.3 | 176.1 | 171 | 169.9 | 0 | 118.5 | ||
| 50 | S | 51.4 | Low | 53.5 | Low | 97 Ų | 97 | 123.5 Ų | 123.5 | 68% | 0.678 | 72% | 0.724 | S | S | * | * | 73.2 | 131 | 127.6 | 55.5 | 0 | 0 | 0 | 0 | 120 | T52 | S50-T52 PolarHBondContact O-N 3.44Å; S50-T52 VanDerWaalsContact O-N 3.1Å | |||
| 51 | P | 49 | Very low | 53.3 | Low | 130 Ų | 130 | 125.4 Ų | 125.4 | 84% | 0.844 | 72% | 0.722 | S | S | * | * | trans | -81.1 | 93.7 | -177.7 | 34.1 | -31.8 | 0 | 0 | 0 | 110.1 | A53 | P51-A53 PolarHBondContact O-N 3.15Š| ||
| 52 | T | 54.3 | Low | 53.3 | Low | 117 Ų | 117 | 126.6 Ų | 126.6 | 72% | 0.718 | 72% | 0.72 | S | S | * | * | trans | -84 | 96.7 | 155.2 | -56.3 | 0 | 0 | 0 | 0 | 106.1 | S50 M54 | S50-T52 PolarHBondContact O-N 3.44Å; S50-T52 VanDerWaalsContact O-N 3.1Å; T52-M54 VanDerWaalsContact C-N 3.28Å; T52-M54 PolarHBondContact O-N 2.89Å | ||
| 53 | A | 55 | Low | 53.2 | Low | 101 Ų | 101 | 127.8 Ų | 127.8 | 84% | 0.835 | 72% | 0.724 | S | S | * | * | trans | -63.5 | 91.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | P51 A55 | P51-A53 PolarHBondContact O-N 3.15Å; A53-A55 PolarHBondContact O-N 3.09Å | ||
| 54 | M | 58.2 | Low | 52.8 | Low | 160 Ų | 160 | 131 Ų | 131 | 79% | 0.788 | 73% | 0.727 | S | S | * | * | trans | -75 | 117.6 | 170.3 | -148.3 | 166.9 | -63.7 | 0 | 0 | 106.9 | T52 | T52-M54 VanDerWaalsContact C-N 3.28Å; T52-M54 PolarHBondContact O-N 2.89Å | ||
| 55 | A | 59.7 | Low | 52.5 | Low | 80 Ų | 80 | 127 Ų | 127 | 66% | 0.661 | 71% | 0.711 | S | S | * | * | trans | -58.6 | 134.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | A53 T57 | A53-A55 PolarHBondContact O-N 3.09Å; A55-T57 PolarHBondContact O-N 2.7Å | ||
| 56 | P | 56.8 | Low | 52.6 | Low | 85 Ų | 85 | 126.4 Ų | 126.4 | 55% | 0.552 | 72% | 0.717 | S | S | * | * | trans | -65.2 | 104.3 | -176.3 | 24.9 | -32 | 0 | 0 | 0 | 109.1 | ||||
| 57 | T | 55.6 | Low | 52.6 | Low | 102 Ų | 102 | 126.3 Ų | 126.3 | 63% | 0.626 | 72% | 0.717 | S | S | * | * | trans | -62.2 | 140.3 | 171.1 | -22.7 | 0 | 0 | 0 | 0 | 107.4 | A55 A59 D60 | A55-T57 PolarHBondContact O-N 2.7Å; T57-A59 PolarHBondContact O-N 3.11Å; T57-D60 PolarHBondContact O-N 3.47Å | ||
| 58 | N | 58.3 | Low | 52.7 | Low | 132 Ų | 132 | 121.5 Ų | 121.5 | 71% | 0.706 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.4 | -7.5 | -173.3 | -68.3 | -47.8 | 0 | 0 | 0 | 115.5 | ||
| 59 | A | 57.9 | Low | 52.8 | Low | 76 Ų | 76 | 121 Ų | 121 | 63% | 0.628 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | -36.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | T57 K61 | T57-A59 PolarHBondContact O-N 3.11Å; A59-K61 PolarHBondContact O-N 2.83Å |
| 60 | D | 54.7 | Low | 52.8 | Low | 97 Ų | 97 | 115.3 Ų | 115.3 | 52% | 0.519 | 69% | 0.691 | S | S | . | * | G | 310 helix | trans | -78.5 | -21.6 | -174 | -62 | -32.4 | 0 | 0 | 0 | 113 | T57 R62 | T57-D60 PolarHBondContact O-N 3.47Å; D60-R62 VanDerWaalsContact C-N 3.27Å; D60-R62 PolarHBondContact O-N 3.21Å |
| 61 | K | 52.7 | Low | 52.9 | Low | 150 Ų | 150 | 116.8 Ų | 116.8 | 65% | 0.652 | 70% | 0.696 | S | S | * | * | G | 310 helix | trans | -76.2 | -13.5 | 178.9 | -70.1 | -175.3 | 179.6 | 174.2 | 0 | 113.5 | A59 | A59-K61 PolarHBondContact O-N 2.83Š|
| 62 | R | 54.2 | Low | 53 | Low | 238 Ų | 238 | 117.7 Ų | 117.7 | 90% | 0.898 | 68% | 0.683 | S | S | * | * | G | 310 helix | trans | -90.1 | -10.2 | -178.3 | -140.9 | 178.7 | -175 | -155.6 | 1 | 113.6 | D60 | D60-R62 VanDerWaalsContact C-N 3.27Å; D60-R62 PolarHBondContact O-N 3.21Å |
| 63 | A | 53.6 | Low | 53.3 | Low | 81 Ų | 81 | 114.3 Ų | 114.3 | 67% | 0.669 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -96.3 | -13.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | S65 | A63-S65 VanDerWaalsContact C-N 3.35Å; A63-S65 PolarHBondContact O-N 3.5Å; A63-S65 VanDerWaalsContact O-N 3.09Å |
| 64 | F | 44.9 | Very low | 53.5 | Low | 186 Ų | 186 | 114.2 Ų | 114.2 | 82% | 0.816 | 66% | 0.655 | S | S | * | * | trans | -87.6 | 74.8 | 176.9 | -76.5 | -84.8 | 0 | 0 | 0 | 110.9 | A66 | F64-A66 PolarHBondContact O-N 3.36Š| ||
| 65 | S | 45 | Very low | 54.1 | Low | 77 Ų | 77 | 112.1 Ų | 112.1 | 54% | 0.538 | 65% | 0.647 | S | S | . | * | trans | -74.8 | 115.7 | 161.1 | -161.7 | 0 | 0 | 0 | 0 | 107.5 | A63 L67 S68 | A63-S65 VanDerWaalsContact C-N 3.35Å; A63-S65 PolarHBondContact O-N 3.5Å; A63-S65 VanDerWaalsContact O-N 3.09Å; S65-L67 PolarHBondContact O-N 2.99Å; S65-S68 WeakPolarHBondContact O-CB 3.29Å; S65-S68 PolarHBondContact O-N 2.88Å | ||
| 66 | A | 51.5 | Low | 54.7 | Low | 92 Ų | 92 | 110.9 Ų | 110.9 | 76% | 0.76 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.1 | 4.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | F64 | F64-A66 PolarHBondContact O-N 3.36Š|
| 67 | L | 51 | Low | 55.3 | Low | 138 Ų | 138 | 108.3 Ų | 108.3 | 72% | 0.723 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | -8.2 | 171.2 | -68.9 | 163.9 | 0 | 0 | 0 | 113 | S65 S69 | S65-L67 PolarHBondContact O-N 2.99Å; L67-S69 VanDerWaalsContact C-N 3.34Å |
| 68 | S | 47.6 | Very low | 56.1 | Low | 104 Ų | 104 | 106.7 Ų | 106.7 | 73% | 0.727 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.4 | -9.2 | -179.7 | -171.8 | 0 | 0 | 0 | 0 | 114.3 | S65 | S65-S68 WeakPolarHBondContact O-CB 3.29Å; S65-S68 PolarHBondContact O-N 2.88Å |
| 69 | S | 46.9 | Very low | 57 | Low | 100 Ų | 100 | 105.8 Ų | 105.8 | 70% | 0.699 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | 5.2 | -179.2 | 60.7 | 0 | 0 | 0 | 0 | 114.2 | L67 T71 | L67-S69 VanDerWaalsContact C-N 3.34Å; S69-T71 PolarHBondContact O-N 3.23Å; S69-T71 VanDerWaalsContact O-N 3.11Å |
| 70 | V | 51.1 | Low | 58.1 | Low | 78 Ų | 78 | 105.1 Ų | 105.1 | 47% | 0.473 | 58% | 0.582 | S | S | . | * | trans | -77.3 | 97.1 | 163.2 | -178.2 | 0 | 0 | 0 | 0 | 105.4 | W72 | V70-W72 VanDerWaalsContact C-N 3.33Å; V70-W72 PolarHBondContact O-N 3.38Å; V70-W72 PolarHBondContact O-NE1 2.79Å | ||
| 71 | T | 52.2 | Low | 59.3 | Low | 129 Ų | 129 | 104.7 Ų | 104.7 | 79% | 0.791 | 58% | 0.579 | S | S | * | * | trans | -58.8 | 104.3 | 164.8 | 47.3 | 0 | 0 | 0 | 0 | 106.4 | S69 S73 | S69-T71 PolarHBondContact O-N 3.23Å; S69-T71 VanDerWaalsContact O-N 3.11Å; T71-S73 VanDerWaalsContact C-N 3.28Å; T71-S73 PolarHBondContact O-N 3.4Å | ||
| 72 | W | 52.7 | Low | 60.6 | Low | 149 Ų | 149 | 102.5 Ų | 102.5 | 56% | 0.564 | 58% | 0.575 | S | S | * | * | trans | -66.2 | 97.6 | 176.4 | -67.6 | 73.7 | 0 | 0 | 0 | 106.1 | V70 I76 | V70-W72 VanDerWaalsContact C-N 3.33Å; V70-W72 PolarHBondContact O-N 3.38Å; V70-W72 PolarHBondContact O-NE1 2.79Å; W72-I76 HydrophobicContact CE3-CB 4.35Å; W72-I76 HydrophobicContact CE3-CD1 4.17Å; W72-I76 HydrophobicContact CE3-CG2 3.61Å; W72-I76 HydrophobicContact CZ3-CG2 3.89Å | ||
| 73 | S | 59.4 | Low | 62.1 | Low | 45 Ų | 45 | 96.3 Ų | 96.3 | 32% | 0.315 | 56% | 0.559 | S | S | . | * | trans | -54.2 | 141.6 | 177.7 | 178.7 | 0 | 0 | 0 | 0 | 107.9 | T71 N75 I76 | T71-S73 VanDerWaalsContact C-N 3.28Å; T71-S73 PolarHBondContact O-N 3.4Å; S73-N75 PolarHBondContact O-N 3.45Å; S73-N75 PolarHBondContact OG-N 3.46Å; S73-I76 WeakPolarHBondContact O-CB 3.31Å; S73-I76 PolarHBondContact O-N 2.96Å | ||
| 74 | P | 60.2 | Low | 63.7 | Low | 100 Ų | 100 | 97 Ų | 97 | 65% | 0.649 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -52.5 | -20.8 | 173 | 20.9 | -33.2 | 0 | 0 | 0 | 112.7 | I76 C77 T78 | P74-I76 VanDerWaalsContact C-N 3.29Å; P74-I76 PolarHBondContact O-N 3.37Å; P74-C77 PolarHBondContact O-N 3.32Å; P74-T78 PolarHBondContact O-N 3.42Å; P74-T78 PolarHBondContact O-OG1 2.9Å |
| 75 | N | 71 | Confident | 65.6 | Low | 115 Ų | 115 | 91.2 Ų | 91.2 | 62% | 0.615 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.3 | -26.8 | 171.6 | -67.4 | -23.2 | 0 | 0 | 0 | 114.4 | S73 T78 L79 | S73-N75 PolarHBondContact O-N 3.45Å; S73-N75 PolarHBondContact OG-N 3.46Å; N75-T78 WeakPolarHBondContact CA-OG1 3.49Å; N75-T78 PolarHBondContact O-OG1 2.84Å; N75-L79 WeakPolarHBondContact O-CB 3.5Å; N75-L79 PolarHBondContact O-N 2.88Å |
| 76 | I | 71 | Confident | 67.6 | Low | 55 Ų | 55 | 93.9 Ų | 93.9 | 28% | 0.282 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -75.7 | -41 | 177.6 | -63.6 | 168.6 | 0 | 0 | 0 | 110 | W72 S73 P74 T78 L79 I80 | W72-I76 HydrophobicContact CE3-CB 4.35Å; W72-I76 HydrophobicContact CE3-CD1 4.17Å; W72-I76 HydrophobicContact CE3-CG2 3.61Å; W72-I76 HydrophobicContact CZ3-CG2 3.89Å; S73-I76 WeakPolarHBondContact O-CB 3.31Å; S73-I76 PolarHBondContact O-N 2.96Å; P74-I76 VanDerWaalsContact C-N 3.29Å; P74-I76 PolarHBondContact O-N 3.37Å; I76-T78 VanDerWaalsContact C-N 3.34Å; I76-T78 PolarHBondContact O-N 2.93Å; I76-L79 PolarHBondContact O-N 3.37Å; I76-I80 HydrophobicContact CG2-CD1 3.84Å; I76-I80 HydrophobicContact CG2-CG1 4.35Å; I76-I80 VanDerWaalsContact O-CG1 3.29Å; I76-I80 WeakPolarHBondContact O-CG1 3.31Å; I76-I80 PolarHBondContact O-N 3.04Å |
| 77 | C | 69.2 | Low | 69.4 | Low | 30 Ų | 30 | 93.4 Ų | 93.4 | 20% | 0.203 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -60.9 | -44.4 | 174.8 | -65.1 | 0 | 0 | 0 | 0 | 111.1 | P74 L79 I80 L81 | P74-C77 PolarHBondContact O-N 3.32Å; C77-L79 VanDerWaalsContact C-N 3.35Å; C77-L79 PolarHBondContact O-N 2.93Å; C77-I80 PolarHBondContact O-N 3.48Å; C77-L81 WeakPolarHBondContact O-CB 3.36Å; C77-L81 VanDerWaalsContact O-CG 3.31Å; C77-L81 WeakPolarHBondContact O-CG 3.36Å; C77-L81 PolarHBondContact O-N 2.91Å |
| 78 | T | 74.1 | Confident | 71.2 | Confident | 69 Ų | 69 | 95.9 Ų | 95.9 | 42% | 0.423 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.3 | -38.1 | 175.5 | 56.4 | 0 | 0 | 0 | 0 | 112.1 | P74 N75 I76 L81 N82 | P74-T78 PolarHBondContact O-N 3.42Å; P74-T78 PolarHBondContact O-OG1 2.9Å; N75-T78 WeakPolarHBondContact CA-OG1 3.49Å; N75-T78 PolarHBondContact O-OG1 2.84Å; I76-T78 VanDerWaalsContact C-N 3.34Å; I76-T78 PolarHBondContact O-N 2.93Å; T78-L81 PolarHBondContact O-N 3.48Å; T78-N82 VanDerWaalsContact O-CB 3.29Å; T78-N82 WeakPolarHBondContact O-CB 3.45Å; T78-N82 PolarHBondContact O-N 2.88Å; T78-N82 PolarHBondContact O-ND2 3.3Å |
| 79 | L | 76 | Confident | 73.1 | Confident | 113 Ų | 113 | 96.6 Ų | 96.6 | 59% | 0.592 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.1 | -43 | 175.1 | -175.4 | 131.7 | 0 | 0 | 0 | 112.2 | N75 I76 C77 N82 L83 | N75-L79 WeakPolarHBondContact O-CB 3.5Å; N75-L79 PolarHBondContact O-N 2.88Å; I76-L79 PolarHBondContact O-N 3.37Å; C77-L79 VanDerWaalsContact C-N 3.35Å; C77-L79 PolarHBondContact O-N 2.93Å; L79-N82 PolarHBondContact O-N 3.47Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 PolarHBondContact O-N 3.2Å |
| 80 | I | 80.7 | Confident | 75.1 | Confident | 62 Ų | 62 | 95.2 Ų | 95.2 | 32% | 0.318 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.2 | -45.3 | 176.7 | -67.9 | 166 | 0 | 0 | 0 | 110.6 | L30 I76 C77 N82 L83 L84 | L30-I80 HydrophobicContact CD1-CG2 4.18Å; I76-I80 HydrophobicContact CG2-CD1 3.84Å; I76-I80 HydrophobicContact CG2-CG1 4.35Å; I76-I80 VanDerWaalsContact O-CG1 3.29Å; I76-I80 WeakPolarHBondContact O-CG1 3.31Å; I76-I80 PolarHBondContact O-N 3.04Å; C77-I80 PolarHBondContact O-N 3.48Å; I80-N82 VanDerWaalsContact C-N 3.35Å; I80-N82 PolarHBondContact O-N 3.42Å; I80-L83 PolarHBondContact O-N 2.93Å; I80-L84 WeakPolarHBondContact O-CB 3.29Å; I80-L84 PolarHBondContact O-N 2.92Å |
| 81 | L | 80.4 | Confident | 76.8 | Confident | 87 Ų | 87 | 96.4 Ų | 96.4 | 46% | 0.455 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 177.2 | -72.2 | 170.8 | 0 | 0 | 0 | 112.1 | L30 C77 T78 L84 S85 | L30-L81 HydrophobicContact CD2-CD2 3.79Å; C77-L81 WeakPolarHBondContact O-CB 3.36Å; C77-L81 VanDerWaalsContact O-CG 3.31Å; C77-L81 WeakPolarHBondContact O-CG 3.36Å; C77-L81 PolarHBondContact O-N 2.91Å; T78-L81 PolarHBondContact O-N 3.48Å; L81-L84 PolarHBondContact O-N 3.48Å; L81-S85 WeakPolarHBondContact O-CB 3.22Å; L81-S85 PolarHBondContact O-N 3.44Å; L81-S85 PolarHBondContact O-OG 3.41Å |
| 82 | N | 80.8 | Confident | 78.5 | Confident | 105 Ų | 105 | 94.7 Ų | 94.7 | 56% | 0.561 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -66.8 | -38.4 | 176.2 | -76.1 | -26.7 | 0 | 0 | 0 | 112.3 | T78 L79 I80 S85 F86 | T78-N82 VanDerWaalsContact O-CB 3.29Å; T78-N82 WeakPolarHBondContact O-CB 3.45Å; T78-N82 PolarHBondContact O-N 2.88Å; T78-N82 PolarHBondContact O-ND2 3.3Å; L79-N82 PolarHBondContact O-N 3.47Å; I80-N82 VanDerWaalsContact C-N 3.35Å; I80-N82 PolarHBondContact O-N 3.42Å; N82-S85 PolarHBondContact O-N 3.42Å; N82-S85 PolarHBondContact O-OG 3Å; N82-F86 VanDerWaalsContact O-CB 3.28Å; N82-F86 WeakPolarHBondContact O-CB 3.33Å; N82-F86 PolarHBondContact O-N 3.29Å |
| 83 | L | 85.2 | Confident | 80.1 | Confident | 108 Ų | 108 | 90.4 Ų | 90.4 | 57% | 0.565 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.9 | -43.2 | 176 | -172 | 68.3 | 0 | 0 | 0 | 110.8 | L79 I80 F86 V87 | L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 PolarHBondContact O-N 3.2Å; I80-L83 PolarHBondContact O-N 2.93Å; L83-F86 PolarHBondContact O-N 3.27Å; L83-V87 VanDerWaalsContact O-CG2 3.31Å; L83-V87 WeakPolarHBondContact O-CG2 3.42Å; L83-V87 PolarHBondContact O-N 3.07Å |
| 84 | L | 87 | Confident | 81.3 | Confident | 94 Ų | 94 | 95.8 Ų | 95.8 | 49% | 0.492 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.2 | -41.6 | 177.3 | -175 | 63.2 | 0 | 0 | 0 | 111.7 | I80 L81 R88 | I80-L84 WeakPolarHBondContact O-CB 3.29Å; I80-L84 PolarHBondContact O-N 2.92Å; L81-L84 PolarHBondContact O-N 3.48Å; L84-R88 WeakPolarHBondContact O-CB 3.36Å; L84-R88 PolarHBondContact O-N 2.88Å |
| 85 | S | 85.6 | Confident | 82.4 | Confident | 65 Ų | 65 | 94.5 Ų | 94.5 | 46% | 0.455 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.3 | -40.4 | 176.6 | 74.9 | 0 | 0 | 0 | 0 | 111.8 | L81 N82 R88 L89 | L81-S85 WeakPolarHBondContact O-CB 3.22Å; L81-S85 PolarHBondContact O-N 3.44Å; L81-S85 PolarHBondContact O-OG 3.41Å; N82-S85 PolarHBondContact O-N 3.42Å; N82-S85 PolarHBondContact O-OG 3Å; S85-R88 PolarHBondContact O-N 3.47Å; S85-L89 WeakPolarHBondContact O-CB 3.33Å; S85-L89 PolarHBondContact O-N 2.93Å |
| 86 | F | 85.4 | Confident | 82.8 | Confident | 134 Ų | 134 | 94.9 Ų | 94.9 | 59% | 0.588 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.3 | -51.6 | 175.7 | -176.9 | -96.7 | 0 | 0 | 0 | 111.5 | N82 L83 R88 L89 T90 | N82-F86 VanDerWaalsContact O-CB 3.28Å; N82-F86 WeakPolarHBondContact O-CB 3.33Å; N82-F86 PolarHBondContact O-N 3.29Å; L83-F86 PolarHBondContact O-N 3.27Å; F86-R88 VanDerWaalsContact C-N 3.28Å; F86-R88 PolarHBondContact O-N 3.31Å; F86-L89 PolarHBondContact O-N 2.99Å; F86-L89 VanDerWaalsContact O-N 3.14Å; F86-T90 PolarHBondContact O-N 3.36Å; F86-T90 PolarHBondContact O-OG1 2.94Å |
| 87 | V | 89.9 | Confident | 83.2 | Confident | 81 Ų | 81 | 95.4 Ų | 95.4 | 49% | 0.491 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58 | -42 | 177.8 | 171.4 | 0 | 0 | 0 | 0 | 111.2 | L83 T90 L91 | L83-V87 VanDerWaalsContact O-CG2 3.31Å; L83-V87 WeakPolarHBondContact O-CG2 3.42Å; L83-V87 PolarHBondContact O-N 3.07Å; V87-T90 PolarHBondContact O-N 3.39Å; V87-L91 WeakPolarHBondContact O-CB 3.28Å; V87-L91 PolarHBondContact O-N 2.89Å |
| 88 | R | 88.4 | Confident | 83.5 | Confident | 191 Ų | 191 | 96.8 Ų | 96.8 | 72% | 0.721 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.8 | -42.7 | 177.4 | -172.4 | 178.2 | -179.5 | -176.7 | -0.2 | 112.2 | L84 S85 F86 L91 L92 | L84-R88 WeakPolarHBondContact O-CB 3.36Å; L84-R88 PolarHBondContact O-N 2.88Å; S85-R88 PolarHBondContact O-N 3.47Å; F86-R88 VanDerWaalsContact C-N 3.28Å; F86-R88 PolarHBondContact O-N 3.31Å; R88-L91 PolarHBondContact O-N 3.14Å; R88-L92 WeakPolarHBondContact O-CB 3.45Å; R88-L92 PolarHBondContact O-N 2.93Å |
| 89 | L | 87.8 | Confident | 83 | Confident | 118 Ų | 118 | 98.7 Ų | 98.7 | 62% | 0.618 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66 | -43.7 | 177.9 | -170.6 | 72.1 | 0 | 0 | 0 | 111.1 | S85 F86 L92 A93 | S85-L89 WeakPolarHBondContact O-CB 3.33Å; S85-L89 PolarHBondContact O-N 2.93Å; F86-L89 PolarHBondContact O-N 2.99Å; F86-L89 VanDerWaalsContact O-N 3.14Å; L89-L92 PolarHBondContact O-N 2.94Å; L89-A93 WeakPolarHBondContact O-CB 3.01Å; L89-A93 PolarHBondContact O-N 3.14Å |
| 90 | T | 88.6 | Confident | 82.2 | Confident | 71 Ų | 71 | 99.3 Ų | 99.3 | 44% | 0.436 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 176.3 | -53.8 | 0 | 0 | 0 | 0 | 111.4 | F86 V87 A93 Y94 | F86-T90 PolarHBondContact O-N 3.36Å; F86-T90 PolarHBondContact O-OG1 2.94Å; V87-T90 PolarHBondContact O-N 3.39Å; T90-A93 PolarHBondContact O-N 3.37Å; T90-Y94 WeakPolarHBondContact O-CB 3.28Å; T90-Y94 PolarHBondContact O-N 3.3Å |
| 91 | L | 88.2 | Confident | 81.1 | Confident | 103 Ų | 103 | 100 Ų | 100 | 54% | 0.539 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 176.2 | -177.1 | 66.5 | 0 | 0 | 0 | 111.6 | V87 R88 Y94 L95 | V87-L91 WeakPolarHBondContact O-CB 3.28Å; V87-L91 PolarHBondContact O-N 2.89Å; R88-L91 PolarHBondContact O-N 3.14Å; L91-Y94 PolarHBondContact O-N 3.01Å; L91-L95 HydrophobicContact CG-CD1 4.31Å; L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 3.28Å |
| 92 | L | 86.6 | Confident | 79.9 | Confident | 94 Ų | 94 | 100.4 Ų | 100.4 | 49% | 0.492 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.8 | -44.4 | 177.3 | -170.3 | 70.8 | 0 | 0 | 0 | 111.3 | R88 L89 Y94 L95 M96 | R88-L92 WeakPolarHBondContact O-CB 3.45Å; R88-L92 PolarHBondContact O-N 2.93Å; L89-L92 PolarHBondContact O-N 2.94Å; L92-Y94 VanDerWaalsContact C-N 3.34Å; L92-Y94 PolarHBondContact O-N 3.21Å; L92-L95 PolarHBondContact O-N 2.68Å; L92-M96 HydrophobicContact CD1-CE 4.49Å; L92-M96 VanDerWaalsContact O-CG 3.28Å; L92-M96 WeakPolarHBondContact O-CG 3.37Å; L92-M96 PolarHBondContact O-N 2.92Å |
| 93 | A | 86.2 | Confident | 78.6 | Confident | 59 Ų | 59 | 103 Ų | 103 | 49% | 0.488 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.7 | -41.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L89 T90 M96 A97 | L89-A93 WeakPolarHBondContact O-CB 3.01Å; L89-A93 PolarHBondContact O-N 3.14Å; T90-A93 PolarHBondContact O-N 3.37Å; A93-M96 PolarHBondContact O-N 3.37Å; A93-A97 VanDerWaalsContact O-CB 3.3Å; A93-A97 WeakPolarHBondContact O-CB 3.48Å; A93-A97 PolarHBondContact O-N 2.69Å |
| 94 | Y | 84.5 | Confident | 77.1 | Confident | 157 Ų | 157 | 106 Ų | 106 | 62% | 0.616 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.7 | -43.9 | 175.4 | -178.6 | -95.6 | 0 | 0 | 0 | 111.9 | T90 L91 L92 A97 T98 | T90-Y94 WeakPolarHBondContact O-CB 3.28Å; T90-Y94 PolarHBondContact O-N 3.3Å; L91-Y94 PolarHBondContact O-N 3.01Å; L92-Y94 VanDerWaalsContact C-N 3.34Å; L92-Y94 PolarHBondContact O-N 3.21Å; Y94-A97 PolarHBondContact O-N 3.18Å; Y94-T98 WeakPolarHBondContact O-CB 3.44Å; Y94-T98 PolarHBondContact O-N 3.18Å; Y94-T98 PolarHBondContact O-OG1 3.49Å |
| 95 | L | 83.1 | Confident | 75.4 | Confident | 73 Ų | 73 | 105.8 Ų | 105.8 | 38% | 0.382 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62 | -48.5 | 176.2 | -71.7 | 168.6 | 0 | 0 | 0 | 110.9 | L91 L92 A97 T98 F99 | L91-L95 HydrophobicContact CG-CD1 4.31Å; L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 3.28Å; L92-L95 PolarHBondContact O-N 2.68Å; L95-A97 VanDerWaalsContact C-N 3.33Å; L95-A97 PolarHBondContact O-N 3.21Å; L95-T98 PolarHBondContact O-N 3.15Å; L95-T98 VanDerWaalsContact O-N 3.09Å; L95-F99 HydrophobicContact CB-CD2 4.36Å; L95-F99 HydrophobicContact CB-CE2 4.25Å; L95-F99 HydrophobicContact CD2-CE2 4.01Å; L95-F99 WeakPolarHBondContact O-CD2 3.35Å; L95-F99 PolarHBondContact O-N 2.9Å |
| 96 | M | 80.6 | Confident | 73.9 | Confident | 124 Ų | 124 | 106.5 Ų | 106.5 | 61% | 0.611 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -58.9 | -44 | 177.1 | -66.7 | -59.5 | -165.3 | 0 | 0 | 112 | L92 A93 T98 F99 H100 | L92-M96 HydrophobicContact CD1-CE 4.49Å; L92-M96 VanDerWaalsContact O-CG 3.28Å; L92-M96 WeakPolarHBondContact O-CG 3.37Å; L92-M96 PolarHBondContact O-N 2.92Å; A93-M96 PolarHBondContact O-N 3.37Å; M96-T98 VanDerWaalsContact C-N 3.27Å; M96-T98 PolarHBondContact O-N 3.09Å; M96-F99 PolarHBondContact O-N 3.37Å; M96-H100 VanDerWaalsContact O-CB 3.28Å; M96-H100 WeakPolarHBondContact O-CB 3.46Å; M96-H100 PolarHBondContact O-N 2.94Å |
| 97 | A | 78.5 | Confident | 72.5 | Confident | 65 Ų | 65 | 103.9 Ų | 103.9 | 54% | 0.537 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.8 | -28.8 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | A93 Y94 L95 P101 | A93-A97 VanDerWaalsContact O-CB 3.3Å; A93-A97 WeakPolarHBondContact O-CB 3.48Å; A93-A97 PolarHBondContact O-N 2.69Å; Y94-A97 PolarHBondContact O-N 3.18Å; L95-A97 VanDerWaalsContact C-N 3.33Å; L95-A97 PolarHBondContact O-N 3.21Å; A97-P101 WeakPolarHBondContact O-CD 3.28Å |
| 98 | T | 75.2 | Confident | 70.7 | Confident | 59 Ų | 59 | 107.3 Ų | 107.3 | 36% | 0.362 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -78.7 | -37.1 | 177.1 | -50.9 | 0 | 0 | 0 | 0 | 111.6 | Y94 L95 M96 P101 | Y94-T98 WeakPolarHBondContact O-CB 3.44Å; Y94-T98 PolarHBondContact O-N 3.18Å; Y94-T98 PolarHBondContact O-OG1 3.49Å; L95-T98 PolarHBondContact O-N 3.15Å; L95-T98 VanDerWaalsContact O-N 3.09Å; M96-T98 VanDerWaalsContact C-N 3.27Å; M96-T98 PolarHBondContact O-N 3.09Å; T98-P101 WeakPolarHBondContact O-CD 3.42Å |
| 99 | F | 64.5 | Low | 69 | Low | 109 Ų | 109 | 103.9 Ų | 103.9 | 48% | 0.478 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -81.7 | -28.2 | 178.9 | -69.5 | -66.9 | 0 | 0 | 0 | 113.6 | L95 M96 L102 F103 | L95-F99 HydrophobicContact CB-CD2 4.36Å; L95-F99 HydrophobicContact CB-CE2 4.25Å; L95-F99 HydrophobicContact CD2-CE2 4.01Å; L95-F99 WeakPolarHBondContact O-CD2 3.35Å; L95-F99 PolarHBondContact O-N 2.9Å; M96-F99 PolarHBondContact O-N 3.37Å; F99-L102 HydrophobicContact CD1-CD1 4.15Å; F99-L102 WeakPolarHBondContact O-CB 3.3Å; F99-L102 PolarHBondContact O-N 3.38Å; F99-L102 VanDerWaalsContact O-N 3.09Å; F99-F103 PolarHBondContact O-N 2.89Å |
| 100 | H | 59.3 | Low | 67 | Low | 126 Ų | 126 | 110.4 Ų | 110.4 | 58% | 0.583 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -58.8 | -42.7 | 179.9 | -162.9 | -98.3 | 0 | 0 | 0 | 114.6 | M96 L102 Y104 | M96-H100 VanDerWaalsContact O-CB 3.28Å; M96-H100 WeakPolarHBondContact O-CB 3.46Å; M96-H100 PolarHBondContact O-N 2.94Å; H100-L102 VanDerWaalsContact C-N 3.32Å; H100-L102 PolarHBondContact O-N 3.09Å; H100-Y104 AromaticContact CE1-CE2 3.95Å |
| 101 | P | 57.7 | Low | 66 | Low | 77 Ų | 77 | 112.4 Ų | 112.4 | 50% | 0.5 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -73.2 | -21.6 | 174 | 28 | -33.9 | 0 | 0 | 0 | 113.3 | A97 T98 Y104 C105 | A97-P101 WeakPolarHBondContact O-CD 3.28Å; T98-P101 WeakPolarHBondContact O-CD 3.42Å; P101-Y104 PolarHBondContact O-N 2.88Å; P101-C105 PolarHBondContact O-N 3.38Å |
| 102 | L | 54.4 | Low | 64.8 | Low | 96 Ų | 96 | 112.9 Ų | 112.9 | 50% | 0.503 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -72.5 | -31.1 | 176.5 | -68.9 | 172 | 0 | 0 | 0 | 112.2 | F99 H100 S106 | F99-L102 HydrophobicContact CD1-CD1 4.15Å; F99-L102 WeakPolarHBondContact O-CB 3.3Å; F99-L102 PolarHBondContact O-N 3.38Å; F99-L102 VanDerWaalsContact O-N 3.09Å; H100-L102 VanDerWaalsContact C-N 3.32Å; H100-L102 PolarHBondContact O-N 3.09Å; L102-S106 WeakPolarHBondContact O-CB 2.92Å; L102-S106 PolarHBondContact O-N 3.39Å; L102-S106 VanDerWaalsContact O-N 3.15Å; L102-S106 PolarHBondContact O-OG 3.2Å |
| 103 | F | 53.8 | Low | 63.6 | Low | 158 Ų | 158 | 113.9 Ų | 113.9 | 69% | 0.693 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.6 | -34.6 | 173.4 | -89.4 | -85.7 | 0 | 0 | 0 | 113 | F99 A107 | F99-F103 PolarHBondContact O-N 2.89Å; F103-A107 PolarHBondContact O-N 3.46Å |
| 104 | Y | 54.4 | Low | 62.3 | Low | 171 Ų | 171 | 117.2 Ų | 117.2 | 67% | 0.671 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -72.8 | -29.9 | 175.7 | -92.1 | -86.4 | 0 | 0 | 0 | 113.3 | H100 P101 | H100-Y104 AromaticContact CE1-CE2 3.95Å; P101-Y104 PolarHBondContact O-N 2.88Å |
| 105 | C | 51.1 | Low | 60.9 | Low | 91 Ų | 91 | 114.7 Ų | 114.7 | 62% | 0.615 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -79.6 | -28.6 | 177.6 | -144.6 | 0 | 0 | 0 | 0 | 112.5 | P101 | P101-C105 PolarHBondContact O-N 3.38Å |
| 106 | S | 54.7 | Low | 59.4 | Low | 80 Ų | 80 | 117.5 Ų | 117.5 | 56% | 0.559 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -78.9 | -21.3 | 178.9 | -49.7 | 0 | 0 | 0 | 0 | 113.8 | L102 | L102-S106 WeakPolarHBondContact O-CB 2.92Å; L102-S106 PolarHBondContact O-N 3.39Å; L102-S106 VanDerWaalsContact O-N 3.15Å; L102-S106 PolarHBondContact O-OG 3.2Å |
| 107 | A | 54.3 | Low | 57.9 | Low | 78 Ų | 78 | 117 Ų | 117 | 65% | 0.645 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.9 | -0.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | F103 | F103-A107 PolarHBondContact O-N 3.46Š|
| 108 | L | 52.6 | Low | 56.3 | Low | 153 Ų | 153 | 121 Ų | 121 | 80% | 0.801 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | 7.1 | -179.6 | -131.8 | 138.9 | 0 | 0 | 0 | 112.7 | ||
| 109 | V | 52.6 | Low | 54.7 | Low | 120 Ų | 120 | 126.2 Ų | 126.2 | 73% | 0.727 | 66% | 0.658 | S | S | * | * | trans | -116 | 8.9 | -178 | -176.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 110 | F | 47.2 | Very low | 53.8 | Low | 255 Ų | 255 | 127.7 Ų | 127.7 | 100% | 1.118 | 67% | 0.674 | S | S | * | * | trans | -125.5 | 0 | 167.4 | -82 | -82.8 | 0 | 0 | 0 | 109.8 |
Retrieved 110 of 110 residues in 58.7 ms
(Link to these results)